A0A3Q0KR73_SCHMA Loading...

Nuclear pore complex protein Nup85

Functions as a component of the nuclear pore complex (NPC).

AlphaFold DB , UniProt , Accession A0A3Q0KR73, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 792 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	32.8	Very low	53.1	Low	230 Å²	230	107.1 Å²	107.1	100%	1.133	66%	0.658	S	S	*	*				0	99.6	0	-77.5	-166.3	-174.7	0	0	107.3
2	E	35.4	Very low	54.5	Low	182 Å²	182	103.8 Å²	103.8	85%	0.85	64%	0.639	S	S	*	*			trans	-114	66.2	173.3	-70.9	-177.6	165.7	0	0	108.3
3	S	41.7	Very low	56.1	Low	100 Å²	100	101.9 Å²	101.9	70%	0.699	62%	0.622	S	S	*	*			trans	-80.9	125.3	161.1	46.6	0	0	0	0	107.1	L5	S3-L5 PolarHBondContact O-N 3.27Å
4	P	53.1	Low	57.5	Low	111 Å²	111	99.2 Å²	99.2	72%	0.721	60%	0.602	S	S	*	*			trans	-56.7	131.4	177.7	22.5	-31.7	0	0	0	109.5	V6	P4-V6 PolarHBondContact O-N 3.01Å
5	L	54.5	Low	59	Low	121 Å²	121	100.5 Å²	100.5	63%	0.634	60%	0.599	S	S	*	*			trans	-71.4	101.3	177.5	-158	111.9	0	0	0	108.3	S3 V7 V45	S3-L5 PolarHBondContact O-N 3.27Å; L5-V7 HydrophobicContact CD2-CG2 4Å; L5-V7 PolarHBondContact O-N 3.45Å; L5-V45 HydrophobicContact CD2-CG2 4.08Å
6	V	60.4	Low	60.3	Low	130 Å²	130	98.6 Å²	98.6	79%	0.788	59%	0.588	S	S	*	*			trans	-87.1	104.5	-179	-176.8	0	0	0	0	109.3	P4 G8	P4-V6 PolarHBondContact O-N 3.01Å; V6-G8 PolarHBondContact O-N 3.06Å
7	V	60.2	Low	61	Low	35 Å²	35	100.9 Å²	100.9	21%	0.212	58%	0.584	C	S	.	*			trans	-83.6	108.3	173.1	-177.4	0	0	0	0	108.9	L5 V9 I25 I42 E43	L5-V7 HydrophobicContact CD2-CG2 4Å; L5-V7 PolarHBondContact O-N 3.45Å; V7-V9 HydrophobicContact CG1-CB 4.33Å; V7-V9 HydrophobicContact CG1-CG2 3.85Å; V7-V9 PolarHBondContact O-N 3.22Å; V7-I25 HydrophobicContact CG2-CD1 4.38Å; V7-I42 HydrophobicContact CG1-CG2 3.84Å; V7-E43 HydrophobicContact CG2-CG 4.34Å
8	G	58.2	Low	61.2	Low	76 Å²	76	99.9 Å²	99.9	78%	0.784	58%	0.575	S	S	*	*			trans	-75.1	53.9	-176.2	0	0	0	0	0	114.9	V6	V6-G8 PolarHBondContact O-N 3.06Å
9	V	61.7	Low	61.2	Low	45 Å²	45	96.6 Å²	96.6	27%	0.273	56%	0.559	S	S	.	*			trans	-121.7	126	-177.8	-177.5	0	0	0	0	111.6	V7 I42	V7-V9 HydrophobicContact CG1-CB 4.33Å; V7-V9 HydrophobicContact CG1-CG2 3.85Å; V7-V9 PolarHBondContact O-N 3.22Å; V9-I42 HydrophobicContact CG1-CD1 4.38Å; V9-I42 HydrophobicContact CG2-CG2 3.93Å
10	P	58.6	Low	60.9	Low	101 Å²	101	96.8 Å²	96.8	66%	0.656	55%	0.554	S	S	*	*			trans	-78.6	126	175.8	29	-31.5	0	0	0	111.8	R27	P10-R27 PolarHBondContact O-NE 2.68Å; P10-R27 PolarHBondContact O-NH2 3.32Å
11	G	67.4	Low	60.9	Low	47 Å²	47	93.6 Å²	93.6	49%	0.485	54%	0.535	S	S	.	.	S	Bend	trans	127.8	170.6	173.7	0	0	0	0	0	113.5	L13	G11-L13 PolarHBondContact O-N 3.03Å
12	P	69.6	Low	62.4	Low	67 Å²	67	84.7 Å²	84.7	44%	0.435	49%	0.491	S	S	.	.			trans	-65.4	127.9	177.8	21.6	-26.4	0	0	0	111	K28	P12-K28 HydrophobicContact CB-CB 4.14Å; P12-K28 HydrophobicContact CB-CD 4.2Å; P12-K28 HydrophobicContact CG-CB 4.07Å; P12-K28 HydrophobicContact CG-CD 4.35Å; P12-K28 WeakPolarHBondContact O-CB 3.41Å; P12-K28 PolarHBondContact O-N 3.38Å
13	L	75.3	Confident	64.4	Low	80 Å²	80	77.7 Å²	77.7	42%	0.419	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	147.8	172.9	-62	173.7	0	0	0	109.7	G11 I25 F26 I42	G11-L13 PolarHBondContact O-N 3.03Å; L13-I25 HydrophobicContact CB-CG2 4.3Å; L13-I25 HydrophobicContact CD1-CG2 4.18Å; L13-I25 HydrophobicContact CD2-CG2 4.1Å; L13-I25 HydrophobicContact CG-CG2 4.43Å; L13-F26 CarbonylContact C-O 3.59Å; L13-F26 WeakPolarHBondContact CA-O 3.46Å; L13-I42 HydrophobicContact CD2-CD1 3.44Å; L13-I42 VanDerWaalsContact CD2-CD1 3.44Å
14	N	76.2	Confident	66.1	Low	64 Å²	64	73 Å²	73	34%	0.342	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	154.4	165.9	-156.2	10.7	0	0	0	108.3	F26	N14-F26 HydrophobicContact CB-CB 4.47Å; N14-F26 PolarHBondContact N-O 2.7Å; N14-F26 PolarHBondContact O-N 2.96Å
15	H	79.6	Confident	67.4	Low	119 Å²	119	68.8 Å²	68.8	55%	0.551	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	142.7	176.3	63.3	-87.2	0	0	0	110	L23 G24	H15-L23 HydrophobicContact CB-CD1 4.02Å; H15-L23 HydrophobicContact CB-CG 4.36Å; H15-G24 CarbonylContact C-O 3.59Å; H15-G24 VanDerWaalsContact CA-O 3.28Å; H15-G24 WeakPolarHBondContact CA-O 3.1Å
16	V	80.3	Confident	68.5	Low	70 Å²	70	64.1 Å²	64.1	42%	0.424	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132.9	174.9	176.4	0	0	0	0	107.8	L18 G24 F26	V16-L18 PolarHBondContact O-N 2.66Å; V16-L18 VanDerWaalsContact O-N 3.13Å; V16-G24 PolarHBondContact N-O 3.07Å; V16-G24 PolarHBondContact O-N 3.46Å; V16-F26 HydrophobicContact CB-CE2 3.99Å; V16-F26 HydrophobicContact CG2-CD2 4.49Å; V16-F26 HydrophobicContact CG2-CE2 4.36Å
17	W	71.5	Confident	69	Low	137 Å²	137	64.1 Å²	64.1	52%	0.519	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	110.6	168	-72.8	103.5	0	0	0	108.8	S19 E20 E22 L23	W17-S19 VanDerWaalsContact C-N 3.35Å; W17-S19 VanDerWaalsContact CE3-O 3.29Å; W17-E20 VanDerWaalsContact CZ3-O 3.23Å; W17-E20 WeakPolarHBondContact CZ3-O 3.04Å; W17-E22 CarbonylContact C-O 3.57Å; W17-E22 WeakPolarHBondContact CA-O 3.5Å; W17-L23 HydrophobicContact CD2-CD1 3.9Å; W17-L23 HydrophobicContact CE3-CB 4.25Å; W17-L23 HydrophobicContact CE3-CD1 4.26Å; W17-L23 HydrophobicContact CG-CD1 4.21Å; W17-L23 HydrophobicContact CZ2-CD1 4.41Å; W17-L23 HydrophobicContact CZ3-CB 4.23Å
18	L	64.4	Low	69.3	Low	83 Å²	83	68 Å²	68	44%	0.435	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-33.5	174.2	-62.8	174.2	0	0	0	110.3	V16 E22 F26 L41	V16-L18 PolarHBondContact O-N 2.66Å; V16-L18 VanDerWaalsContact O-N 3.13Å; L18-E22 HydrophobicContact CB-CB 4.02Å; L18-E22 PolarHBondContact N-O 3.3Å; L18-F26 HydrophobicContact CD2-CE2 4.5Å; L18-F26 HydrophobicContact CD2-CZ 4.11Å; L18-L41 HydrophobicContact CD1-CD1 4.37Å
19	S	61.3	Low	69.4	Low	37 Å²	37	68.7 Å²	68.7	26%	0.259	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	173.5	168.1	79.4	0	0	0	0	109	W17 N21 E22	W17-S19 VanDerWaalsContact C-N 3.35Å; W17-S19 VanDerWaalsContact CE3-O 3.29Å; S19-N21 PolarHBondContact O-N 3.19Å; S19-E22 PolarHBondContact N-O 2.77Å; S19-E22 PolarHBondContact O-N 3.36Å; S19-E22 VanDerWaalsContact O-O 3.11Å; S19-E22 WeakPolarHBondContact OG-CB 3.49Å; S19-E22 VanDerWaalsContact OG-CG 3.32Å; S19-E22 WeakPolarHBondContact OG-CG 3.09Å; S19-E22 PolarHBondContact OG-N 3.25Å
20	E	55.9	Low	69.2	Low	100 Å²	100	70.9 Å²	70.9	47%	0.467	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-28.4	180	-72.2	172.7	-172.1	0	0	114	W17 R494	W17-E20 VanDerWaalsContact CZ3-O 3.23Å; W17-E20 WeakPolarHBondContact CZ3-O 3.04Å; E20-R494 VanDerWaalsContact CB-NH2 3.35Å; E20-R494 VanDerWaalsContact N-NH2 3.15Å; E20-R494 IonicContact OE1-CZ 2.79Å; E20-R494 IonicContact OE1-NH1 3.61Å; E20-R494 PolarHBondContact OE1-NH1 2.9Å; E20-R494 IonicContact OE2-CZ 3.6Å; E20-R494 IonicContact OE2-NH1 2.76Å; E20-R494 PolarHBondContact OE2-NH1 2.8Å; E20-R494 IonicContact OE2-NH2 3.38Å
21	N	60.1	Low	69	Low	30 Å²	30	71 Å²	71	16%	0.16	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	11	-178.8	-69.3	9.8	0	0	0	112.4	S19 K46 W47 S466	S19-N21 PolarHBondContact O-N 3.19Å; N21-K46 CarbonylContact O-C 3.59Å; N21-K46 WeakPolarHBondContact O-CA 3.49Å; N21-W47 HydrophobicContact CB-CB 4.33Å; N21-W47 PolarHBondContact O-N 2.84Å; N21-S466 WeakPolarHBondContact ND2-CB 3.35Å; N21-S466 PolarHBondContact ND2-OG 3.3Å; N21-S466 VanDerWaalsContact ND2-OG 3.16Å
22	E	65.1	Low	68.4	Low	43 Å²	43	73.3 Å²	73.3	20%	0.201	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	119	-179.3	-63.6	-166	-163.7	0	0	111	W17 L18 S19 N44 K46	W17-E22 CarbonylContact C-O 3.57Å; W17-E22 WeakPolarHBondContact CA-O 3.5Å; L18-E22 HydrophobicContact CB-CB 4.02Å; L18-E22 PolarHBondContact N-O 3.3Å; S19-E22 PolarHBondContact N-O 2.77Å; S19-E22 PolarHBondContact O-N 3.36Å; S19-E22 VanDerWaalsContact O-O 3.11Å; S19-E22 WeakPolarHBondContact OG-CB 3.49Å; S19-E22 VanDerWaalsContact OG-CG 3.32Å; S19-E22 WeakPolarHBondContact OG-CG 3.09Å; S19-E22 PolarHBondContact OG-N 3.25Å; E22-N44 PolarHBondContact OE2-ND2 3.05Å; E22-K46 HydrophobicContact CG-CB 4.38Å; E22-K46 HydrophobicContact CG-CD 3.74Å; E22-K46 HydrophobicContact CG-CG 3.76Å; E22-K46 WeakPolarHBondContact OE1-CD 3.37Å; E22-K46 WeakPolarHBondContact OE1-CE 3.44Å; E22-K46 IonicContact OE1-NZ 3.63Å; E22-K46 PolarHBondContact OE1-NZ 3.37Å; E22-K46 IonicContact OE2-NZ 3.65Å
23	L	76.7	Confident	67.2	Low	36 Å²	36	76.2 Å²	76.2	19%	0.188	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.2	177.2	-172.7	71.3	0	0	0	109.3	H15 W17 V45	H15-L23 HydrophobicContact CB-CD1 4.02Å; H15-L23 HydrophobicContact CB-CG 4.36Å; W17-L23 HydrophobicContact CD2-CD1 3.9Å; W17-L23 HydrophobicContact CE3-CB 4.25Å; W17-L23 HydrophobicContact CE3-CD1 4.26Å; W17-L23 HydrophobicContact CG-CD1 4.21Å; W17-L23 HydrophobicContact CZ2-CD1 4.41Å; W17-L23 HydrophobicContact CZ3-CB 4.23Å; L23-V45 HydrophobicContact CB-CB 4.36Å; L23-V45 PolarHBondContact N-O 2.89Å; L23-V45 PolarHBondContact O-N 3.11Å
24	G	78.4	Confident	65.5	Low	0 Å²	0	81.5 Å²	81.5	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.9	171.4	0	0	0	0	0	110.4	H15 V16 F26	H15-G24 CarbonylContact C-O 3.59Å; H15-G24 VanDerWaalsContact CA-O 3.28Å; H15-G24 WeakPolarHBondContact CA-O 3.1Å; V16-G24 PolarHBondContact N-O 3.07Å; V16-G24 PolarHBondContact O-N 3.46Å; G24-F26 WeakPolarHBondContact O-CD2 3.5Å; G24-F26 WeakPolarHBondContact O-CE2 3.37Å
25	I	80	Confident	63.9	Low	23 Å²	23	83.6 Å²	83.6	12%	0.118	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.6	175.3	-57.2	174.2	0	0	0	108.3	V7 L13 I42 E43 V45	V7-I25 HydrophobicContact CG2-CD1 4.38Å; L13-I25 HydrophobicContact CB-CG2 4.3Å; L13-I25 HydrophobicContact CD1-CG2 4.18Å; L13-I25 HydrophobicContact CD2-CG2 4.1Å; L13-I25 HydrophobicContact CG-CG2 4.43Å; I25-I42 WeakPolarHBondContact O-CB 3.49Å; I25-I42 PolarHBondContact O-N 3.08Å; I25-E43 HydrophobicContact CB-CB 4.4Å; I25-E43 HydrophobicContact CD1-CB 4.39Å; I25-E43 PolarHBondContact N-O 3.45Å; I25-E43 PolarHBondContact O-N 3.34Å; I25-V45 HydrophobicContact CD1-CG2 3.96Å
26	F	78.2	Confident	62.1	Low	24 Å²	24	83.7 Å²	83.7	11%	0.105	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	151.9	-174.9	-60.1	-90	0	0	0	111.1	L13 N14 V16 L18 G24 E39 L41	L13-F26 CarbonylContact C-O 3.59Å; L13-F26 WeakPolarHBondContact CA-O 3.46Å; N14-F26 HydrophobicContact CB-CB 4.47Å; N14-F26 PolarHBondContact N-O 2.7Å; N14-F26 PolarHBondContact O-N 2.96Å; V16-F26 HydrophobicContact CB-CE2 3.99Å; V16-F26 HydrophobicContact CG2-CD2 4.49Å; V16-F26 HydrophobicContact CG2-CE2 4.36Å; L18-F26 HydrophobicContact CD2-CE2 4.5Å; L18-F26 HydrophobicContact CD2-CZ 4.11Å; G24-F26 WeakPolarHBondContact O-CD2 3.5Å; G24-F26 WeakPolarHBondContact O-CE2 3.37Å; F26-E39 HydrophobicContact CD1-CB 3.96Å; F26-L41 HydrophobicContact CD1-CB 4.2Å; F26-L41 HydrophobicContact CD1-CD1 4.23Å; F26-L41 HydrophobicContact CE1-CB 3.79Å; F26-L41 HydrophobicContact CE1-CD1 3.66Å; F26-L41 HydrophobicContact CE1-CG 4.34Å; F26-L41 HydrophobicContact CE2-CD1 4.06Å; F26-L41 HydrophobicContact CZ-CD1 3.58Å
27	R	71.2	Confident	60.1	Low	129 Å²	129	89.9 Å²	89.9	49%	0.487	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.7	171.6	-156.5	173.5	-176.5	176.2	-0.3	109.6	P10 P29 I42	P10-R27 PolarHBondContact O-NE 2.68Å; P10-R27 PolarHBondContact O-NH2 3.32Å; R27-P29 WeakPolarHBondContact O-CD 3.4Å; R27-I42 HydrophobicContact CB-CD1 3.82Å; R27-I42 HydrophobicContact CB-CG1 4.33Å; R27-I42 HydrophobicContact CG-CD1 4.45Å
28	K	66.6	Low	58.8	Low	117 Å²	117	89.5 Å²	89.5	51%	0.509	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-72.2	122.7	172.6	-168.9	173.9	-173.7	170.7	0	108.8	P12 T30	P12-K28 HydrophobicContact CB-CB 4.14Å; P12-K28 HydrophobicContact CB-CD 4.2Å; P12-K28 HydrophobicContact CG-CB 4.07Å; P12-K28 HydrophobicContact CG-CD 4.35Å; P12-K28 WeakPolarHBondContact O-CB 3.41Å; P12-K28 PolarHBondContact O-N 3.38Å; K28-T30 PolarHBondContact O-N 3.02Å
29	P	59.3	Low	58.3	Low	91 Å²	91	91 Å²	91	59%	0.591	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-66.1	123.9	179.2	23.3	-29.8	0	0	0	109.9	R27	R27-P29 WeakPolarHBondContact O-CD 3.4Å
30	T	56.7	Low	58.3	Low	91 Å²	91	95.2 Å²	95.2	56%	0.558	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-70.7	138.3	168.5	48.7	0	0	0	0	108.7	K28 S32 N33	K28-T30 PolarHBondContact O-N 3.02Å; T30-S32 PolarHBondContact O-N 2.8Å; T30-N33 PolarHBondContact O-N 3.25Å
31	A	55.9	Low	58.7	Low	103 Å²	103	94.3 Å²	94.3	85%	0.851	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	3.6	-166.7	0	0	0	0	0	117.4
32	S	53.8	Low	59.2	Low	95 Å²	95	95.1 Å²	95.1	66%	0.664	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-13	-178.8	63.4	0	0	0	0	115.5	T30	T30-S32 PolarHBondContact O-N 2.8Å
33	N	44.1	Very low	59.2	Low	128 Å²	128	97.5 Å²	97.5	68%	0.684	52%	0.521	S	S	*	.			trans	-119.9	84.6	-179.7	-77.6	-4	0	0	0	111.8	T30 S35	T30-N33 PolarHBondContact O-N 3.25Å; N33-S35 VanDerWaalsContact C-N 3.34Å; N33-S35 PolarHBondContact O-N 3.06Å
34	K	41.5	Very low	58.8	Low	192 Å²	192	98.5 Å²	98.5	84%	0.835	53%	0.526	S	S	*	.			trans	-82.6	10.1	-179.4	-87.3	-173.5	176.6	-178.8	0	115.5
35	S	41.1	Very low	58.3	Low	107 Å²	107	100.6 Å²	100.6	75%	0.748	54%	0.539	S	S	*	.	S	Bend	trans	-120	14.4	-167.8	55.1	0	0	0	0	117.1	N33	N33-S35 VanDerWaalsContact C-N 3.34Å; N33-S35 PolarHBondContact O-N 3.06Å
36	T	41.9	Very low	57.4	Low	121 Å²	121	104.4 Å²	104.4	74%	0.742	55%	0.554	S	S	*	*			trans	-153.7	91.3	165.4	-11.8	0	0	0	0	110.3	N38	T36-N38 PolarHBondContact O-N 3.4Å
37	F	38.2	Very low	56.5	Low	200 Å²	200	111.8 Å²	111.8	88%	0.877	58%	0.582	S	S	*	*			trans	-69.6	81.1	168.2	-86	-91	0	0	0	109.2
38	N	45.6	Very low	55.5	Low	130 Å²	130	107.4 Å²	107.4	70%	0.695	58%	0.577	S	S	*	*			trans	-131.3	105.8	153.5	-87.8	-17.4	0	0	0	105.3	T36 I40	T36-N38 PolarHBondContact O-N 3.4Å; N38-I40 VanDerWaalsContact C-N 3.31Å; N38-I40 PolarHBondContact O-N 3.36Å
39	E	53.2	Low	54.6	Low	113 Å²	113	103.2 Å²	103.2	53%	0.528	56%	0.561	S	S	.	*			trans	-61.5	100	164.6	-71.9	-176.4	151.4	0	0	106.8	F26 L41	F26-E39 HydrophobicContact CD1-CB 3.96Å; E39-L41 PolarHBondContact O-N 3.31Å; E39-L41 VanDerWaalsContact O-N 3.16Å
40	I	61.7	Low	54.4	Low	127 Å²	127	101.9 Å²	101.9	65%	0.651	55%	0.554	S	S	*	*			trans	-70.6	112.7	179.5	-58.7	171.7	0	0	0	106.6	N38 I42	N38-I40 VanDerWaalsContact C-N 3.31Å; N38-I40 PolarHBondContact O-N 3.36Å; I40-I42 PolarHBondContact O-N 3.15Å
41	L	63.8	Low	54.5	Low	80 Å²	80	99.4 Å²	99.4	42%	0.419	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	117.9	168.8	-179.8	70.3	0	0	0	108	L18 F26 E39	L18-L41 HydrophobicContact CD1-CD1 4.37Å; F26-L41 HydrophobicContact CD1-CB 4.2Å; F26-L41 HydrophobicContact CD1-CD1 4.23Å; F26-L41 HydrophobicContact CE1-CB 3.79Å; F26-L41 HydrophobicContact CE1-CD1 3.66Å; F26-L41 HydrophobicContact CE1-CG 4.34Å; F26-L41 HydrophobicContact CE2-CD1 4.06Å; F26-L41 HydrophobicContact CZ-CD1 3.58Å; E39-L41 PolarHBondContact O-N 3.31Å; E39-L41 VanDerWaalsContact O-N 3.16Å
42	I	70	Confident	54.9	Low	48 Å²	48	95 Å²	95	25%	0.246	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-52.7	-179.9	-58	168	0	0	0	109.2	V7 V9 L13 I25 R27 I40	V7-I42 HydrophobicContact CG1-CG2 3.84Å; V9-I42 HydrophobicContact CG1-CD1 4.38Å; V9-I42 HydrophobicContact CG2-CG2 3.93Å; L13-I42 HydrophobicContact CD2-CD1 3.44Å; L13-I42 VanDerWaalsContact CD2-CD1 3.44Å; I25-I42 WeakPolarHBondContact O-CB 3.49Å; I25-I42 PolarHBondContact O-N 3.08Å; R27-I42 HydrophobicContact CB-CD1 3.82Å; R27-I42 HydrophobicContact CB-CG1 4.33Å; R27-I42 HydrophobicContact CG-CD1 4.45Å; I40-I42 PolarHBondContact O-N 3.15Å
43	E	65.8	Low	55.6	Low	93 Å²	93	95.4 Å²	95.4	44%	0.435	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	145.3	-173.6	-84.1	-66.5	170.6	0	0	109.8	V7 I25	V7-E43 HydrophobicContact CG2-CG 4.34Å; I25-E43 HydrophobicContact CB-CB 4.4Å; I25-E43 HydrophobicContact CD1-CB 4.39Å; I25-E43 PolarHBondContact N-O 3.45Å; I25-E43 PolarHBondContact O-N 3.34Å
44	N	69.1	Low	57.3	Low	57 Å²	57	90.2 Å²	90.2	31%	0.305	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	112.8	171.6	-175.8	1.7	0	0	0	108.9	E22	E22-N44 PolarHBondContact OE2-ND2 3.05Å
45	V	65.9	Low	59.5	Low	43 Å²	43	87.8 Å²	87.8	26%	0.261	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	114	179.7	-177.8	0	0	0	0	108.9	L5 L23 I25	L5-V45 HydrophobicContact CD2-CG2 4.08Å; L23-V45 HydrophobicContact CB-CB 4.36Å; L23-V45 PolarHBondContact N-O 2.89Å; L23-V45 PolarHBondContact O-N 3.11Å; I25-V45 HydrophobicContact CD1-CG2 3.96Å
46	K	62.6	Low	61.9	Low	104 Å²	104	83.5 Å²	83.5	45%	0.452	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.2	175.8	-53	-153.4	-175.4	-167.5	0	112	N21 E22 T49	N21-K46 CarbonylContact O-C 3.59Å; N21-K46 WeakPolarHBondContact O-CA 3.49Å; E22-K46 HydrophobicContact CG-CB 4.38Å; E22-K46 HydrophobicContact CG-CD 3.74Å; E22-K46 HydrophobicContact CG-CG 3.76Å; E22-K46 WeakPolarHBondContact OE1-CD 3.37Å; E22-K46 WeakPolarHBondContact OE1-CE 3.44Å; E22-K46 IonicContact OE1-NZ 3.63Å; E22-K46 PolarHBondContact OE1-NZ 3.37Å; E22-K46 IonicContact OE2-NZ 3.65Å; K46-T49 HydrophobicContact CB-CG2 4.06Å; K46-T49 VanDerWaalsContact CB-OG1 3.24Å; K46-T49 WeakPolarHBondContact CB-OG1 3.43Å; K46-T49 HydrophobicContact CD-CG2 3.99Å
47	W	58.1	Low	64.2	Low	178 Å²	178	78 Å²	78	67%	0.674	39%	0.391	S	S	*	.	S	Bend	trans	-77.2	134.1	169.7	-101.5	79.5	0	0	0	111.2	N21 T49	N21-W47 HydrophobicContact CB-CB 4.33Å; N21-W47 PolarHBondContact O-N 2.84Å; W47-T49 PolarHBondContact O-N 3.04Å
48	G	50.6	Low	66.7	Low	37 Å²	37	71.5 Å²	71.5	38%	0.381	36%	0.362	S	S	.	.	S	Bend	trans	69.2	-14.2	166.5	0	0	0	0	0	118.1	S50 I51	G48-S50 VanDerWaalsContact C-N 3.26Å; G48-S50 PolarHBondContact O-N 2.82Å; G48-S50 VanDerWaalsContact O-N 3.16Å; G48-I51 PolarHBondContact O-N 3.33Å
49	T	48.9	Very low	68.9	Low	29 Å²	29	70.5 Å²	70.5	18%	0.178	35%	0.349	C	S	.	.	H	α-helix	trans	-64.1	-20.7	-173.9	50.3	0	0	0	0	115.1	K46 W47 I51 N53	K46-T49 HydrophobicContact CB-CG2 4.06Å; K46-T49 VanDerWaalsContact CB-OG1 3.24Å; K46-T49 WeakPolarHBondContact CB-OG1 3.43Å; K46-T49 HydrophobicContact CD-CG2 3.99Å; W47-T49 PolarHBondContact O-N 3.04Å; T49-I51 PolarHBondContact O-N 3.43Å; T49-N53 PolarHBondContact O-ND2 3.37Å
50	S	54.7	Low	70.9	Confident	63 Å²	63	65.4 Å²	65.4	44%	0.441	33%	0.325	S	S	.	.	H	α-helix	trans	-70.9	-31.1	-179.9	61.3	0	0	0	0	113.4	G48	G48-S50 VanDerWaalsContact C-N 3.26Å; G48-S50 PolarHBondContact O-N 2.82Å; G48-S50 VanDerWaalsContact O-N 3.16Å
51	I	59.2	Low	72.5	Confident	39 Å²	39	59.3 Å²	59.3	20%	0.2	29%	0.294	C	S	.	.	H	α-helix	trans	-68.2	-44.4	-171.2	-60.9	175.5	0	0	0	110.6	G48 T49 M57 Q119	G48-I51 PolarHBondContact O-N 3.33Å; T49-I51 PolarHBondContact O-N 3.43Å; I51-M57 HydrophobicContact CG2-CE 3.77Å; I51-M57 HydrophobicContact CG2-CG 4.07Å; I51-M57 VanDerWaalsContact O-CB 3.28Å; I51-M57 WeakPolarHBondContact O-CB 3.38Å; I51-M57 WeakPolarHBondContact O-CG 3.33Å; I51-Q119 PolarHBondContact O-NE2 2.95Å
52	Y	64.4	Low	73.9	Confident	11 Å²	11	61.3 Å²	61.3	4%	0.043	30%	0.299	C	S	.	.	H	α-helix	trans	-89.4	-9.1	-174.3	-62.1	-59.6	0	0	0	113.8	D54 M57 K58 V61 Y460 S463 L464 E467 L470	Y52-D54 PolarHBondContact O-N 3.02Å; Y52-M57 HydrophobicContact CD1-CB 4.26Å; Y52-K58 WeakPolarHBondContact O-CE 3.35Å; Y52-K58 WeakPolarHBondContact O-CG 3.09Å; Y52-V61 HydrophobicContact CD1-CG2 3.9Å; Y52-V61 HydrophobicContact CE1-CG2 3.62Å; Y52-Y460 WeakPolarHBondContact OH-CE2 3.21Å; Y52-S463 PolarHBondContact OH-OG 3.15Å; Y52-L464 HydrophobicContact CD1-CD2 4.33Å; Y52-L464 HydrophobicContact CE1-CD2 3.87Å; Y52-L464 HydrophobicContact CE2-CD2 4.19Å; Y52-E467 WeakPolarHBondContact CB-OE1 3.45Å; Y52-L470 HydrophobicContact CD1-CD1 3.94Å; Y52-L470 HydrophobicContact CG-CD1 3.81Å
53	N	66.8	Low	75.1	Confident	103 Å²	103	61.3 Å²	61.3	55%	0.551	30%	0.303	S	S	*	.	H	α-helix	trans	-62.4	-26.3	174.5	-82.5	-30.3	0	0	0	112.6	T49 E467	T49-N53 PolarHBondContact O-ND2 3.37Å; N53-E467 PolarHBondContact N-OE1 3.17Å; N53-E467 VanDerWaalsContact N-OE1 3.1Å; N53-E467 PolarHBondContact OD1-OE1 2.79Å
54	D	80.1	Confident	76.6	Confident	19 Å²	19	56.9 Å²	56.9	10%	0.102	28%	0.282	C	S	.	.	S	Bend	trans	-82.1	135.8	179.7	-77.4	-46.2	0	0	0	113.2	Y52 F56 M57 K58 H115 Q119	Y52-D54 PolarHBondContact O-N 3.02Å; D54-F56 PolarHBondContact O-N 3.38Å; D54-F56 VanDerWaalsContact O-N 3.14Å; D54-M57 PolarHBondContact O-N 2.74Å; D54-M57 VanDerWaalsContact O-N 3.12Å; D54-K58 PolarHBondContact O-N 2.87Å; D54-H115 IonicContact OD2-CD2 2.7Å; D54-H115 PolarHBondContact OD2-CD2 2.73Å; D54-H115 IonicContact OD2-NE2 3.43Å; D54-H115 PolarHBondContact OD2-NE2 3.37Å; D54-Q119 PolarHBondContact OD2-OE1 3.43Å
55	E	87.9	Confident	77.9	Confident	141 Å²	141	56.1 Å²	56.1	66%	0.659	28%	0.276	S	S	*	.	H	α-helix	trans	-59.5	-27.8	-178.4	-67.2	-176.2	161.7	0	0	113.4	R59	E55-R59 WeakPolarHBondContact O-CG 3.36Å; E55-R59 PolarHBondContact O-N 3.27Å; E55-R59 VanDerWaalsContact O-N 3.1Å; E55-R59 PolarHBondContact O-NE 3.14Å
56	F	91.4	Very high	79.4	Confident	17 Å²	17	59.4 Å²	59.4	8%	0.075	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-46.6	176.5	-57.3	-77.3	0	0	0	111.4	D54 R59 L60 E97 I98 F101 L116	D54-F56 PolarHBondContact O-N 3.38Å; D54-F56 VanDerWaalsContact O-N 3.14Å; F56-R59 PolarHBondContact O-N 3.14Å; F56-L60 PolarHBondContact O-N 3.15Å; F56-E97 HydrophobicContact CD1-CB 3.97Å; F56-E97 HydrophobicContact CE1-CB 4.05Å; F56-I98 HydrophobicContact CB-CD1 4.02Å; F56-I98 HydrophobicContact CB-CG1 3.78Å; F56-I98 HydrophobicContact CD1-CG1 3.8Å; F56-I98 HydrophobicContact CD2-CG1 3.96Å; F56-I98 HydrophobicContact CE1-CG1 4.42Å; F56-I98 HydrophobicContact CG-CD1 4.34Å; F56-I98 HydrophobicContact CG-CG1 3.57Å; F56-F101 HydrophobicContact CE1-CB 4.29Å; F56-F101 HydrophobicContact CE2-CD1 4.41Å; F56-F101 HydrophobicContact CE2-CG 4.44Å; F56-F101 HydrophobicContact CZ-CB 3.77Å; F56-F101 HydrophobicContact CZ-CD1 4.15Å; F56-F101 HydrophobicContact CZ-CD2 4.14Å; F56-F101 AromaticContact CZ-CG 3.75Å; F56-F101 HydrophobicContact CZ-CG 3.75Å; F56-L116 HydrophobicContact CD2-CD2 3.94Å; F56-L116 HydrophobicContact CE2-CD1 4.45Å; F56-L116 HydrophobicContact CE2-CD2 4.06Å
57	M	90	Very high	81	Confident	6 Å²	6	55 Å²	55	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-69.8	-36.9	178.8	-68.8	-55.5	-68.6	0	0	111.9	I51 Y52 D54 R59 L60 V61 Q119 I123	I51-M57 HydrophobicContact CG2-CE 3.77Å; I51-M57 HydrophobicContact CG2-CG 4.07Å; I51-M57 VanDerWaalsContact O-CB 3.28Å; I51-M57 WeakPolarHBondContact O-CB 3.38Å; I51-M57 WeakPolarHBondContact O-CG 3.33Å; Y52-M57 HydrophobicContact CD1-CB 4.26Å; D54-M57 PolarHBondContact O-N 2.74Å; D54-M57 VanDerWaalsContact O-N 3.12Å; M57-R59 VanDerWaalsContact C-N 3.25Å; M57-R59 PolarHBondContact O-N 3.46Å; M57-L60 HydrophobicContact CE-CD2 3.86Å; M57-L60 PolarHBondContact O-N 3.13Å; M57-L60 HydrophobicContact SD-CD2 4.05Å; M57-V61 WeakPolarHBondContact O-CB 3.44Å; M57-V61 VanDerWaalsContact O-CG2 3.26Å; M57-V61 WeakPolarHBondContact O-CG2 3.4Å; M57-V61 PolarHBondContact O-N 3.19Å; M57-Q119 HydrophobicContact CG-CG 4.46Å; M57-Q119 HydrophobicContact SD-CG 4.29Å; M57-I123 HydrophobicContact SD-CD1 3.72Å; M57-I123 HydrophobicContact SD-CG1 4.27Å
58	K	90.2	Very high	82.8	Confident	64 Å²	64	46.6 Å²	46.6	28%	0.278	24%	0.239	S	C	.	.	H	α-helix	trans	-60.2	-38.8	174.2	-61.8	-169.6	-175.8	-169.6	0	111.7	Y52 D54 K62 E467 S469 L470	Y52-K58 WeakPolarHBondContact O-CE 3.35Å; Y52-K58 WeakPolarHBondContact O-CG 3.09Å; D54-K58 PolarHBondContact O-N 2.87Å; K58-K62 WeakPolarHBondContact O-CB 2.96Å; K58-K62 PolarHBondContact O-N 2.92Å; K58-E467 IonicContact NZ-OE2 3.33Å; K58-S469 PolarHBondContact NZ-OG 2.87Å; K58-L470 HydrophobicContact CB-CD2 4.39Å; K58-L470 HydrophobicContact CG-CD2 4.2Å
59	R	92.8	Very high	84.8	Confident	109 Å²	109	45.7 Å²	45.7	41%	0.411	23%	0.227	S	C	.	.	H	α-helix	trans	-69.8	-39.9	175.4	-72.4	-174.1	-68.5	136	6.4	112.2	E55 F56 M57 K62 S63 E97	E55-R59 WeakPolarHBondContact O-CG 3.36Å; E55-R59 PolarHBondContact O-N 3.27Å; E55-R59 VanDerWaalsContact O-N 3.1Å; E55-R59 PolarHBondContact O-NE 3.14Å; F56-R59 PolarHBondContact O-N 3.14Å; M57-R59 VanDerWaalsContact C-N 3.25Å; M57-R59 PolarHBondContact O-N 3.46Å; R59-K62 PolarHBondContact O-N 2.86Å; R59-S63 WeakPolarHBondContact O-CB 3.37Å; R59-S63 PolarHBondContact O-N 3.34Å; R59-E97 IonicContact CZ-OE1 2.79Å; R59-E97 IonicContact CZ-OE2 2.75Å; R59-E97 IonicContact NH1-OE1 3.17Å; R59-E97 PolarHBondContact NH1-OE1 3.46Å; R59-E97 IonicContact NH1-OE2 3.63Å; R59-E97 PolarHBondContact NH1-OE2 3.08Å; R59-E97 IonicContact NH2-OE1 3.82Å; R59-E97 IonicContact NH2-OE2 2.76Å; R59-E97 PolarHBondContact NH2-OE2 2.82Å
60	L	94.9	Very high	87	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-58.7	-49.5	171.8	177.6	61.6	0	0	0	111.4	F56 M57 K62 S63 S64 A90 L91 C94 W393	F56-L60 PolarHBondContact O-N 3.15Å; M57-L60 HydrophobicContact CE-CD2 3.86Å; M57-L60 PolarHBondContact O-N 3.13Å; M57-L60 HydrophobicContact SD-CD2 4.05Å; L60-K62 VanDerWaalsContact C-N 3.31Å; L60-K62 PolarHBondContact O-N 2.98Å; L60-S63 PolarHBondContact O-N 3.27Å; L60-S64 WeakPolarHBondContact O-CB 3.31Å; L60-S64 PolarHBondContact O-N 2.96Å; L60-S64 PolarHBondContact O-OG 3.39Å; L60-S64 VanDerWaalsContact O-OG 3.09Å; L60-A90 HydrophobicContact CD1-CB 3.97Å; L60-L91 HydrophobicContact CD1-CD2 4.28Å; L60-L91 HydrophobicContact CD2-CD2 4.16Å; L60-C94 HydrophobicContact CB-CB 4.2Å; L60-C94 HydrophobicContact CD1-CB 4.22Å; L60-C94 HydrophobicContact CD2-CB 4.44Å; L60-W393 HydrophobicContact CD1-CZ2 4.22Å
61	V	94.5	Very high	88.8	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.2	-43.3	178.4	170.1	0	0	0	0	111.3	Y52 M57 S64 F65 L464 L470 I473	Y52-V61 HydrophobicContact CD1-CG2 3.9Å; Y52-V61 HydrophobicContact CE1-CG2 3.62Å; M57-V61 WeakPolarHBondContact O-CB 3.44Å; M57-V61 VanDerWaalsContact O-CG2 3.26Å; M57-V61 WeakPolarHBondContact O-CG2 3.4Å; M57-V61 PolarHBondContact O-N 3.19Å; V61-S64 WeakPolarHBondContact CA-OG 3.28Å; V61-S64 PolarHBondContact O-OG 2.87Å; V61-F65 WeakPolarHBondContact O-CB 3.39Å; V61-F65 PolarHBondContact O-N 3.21Å; V61-L464 HydrophobicContact CG1-CD1 4.17Å; V61-L464 HydrophobicContact CG1-CD2 3.79Å; V61-L464 HydrophobicContact CG2-CD2 3.94Å; V61-L470 HydrophobicContact CG1-CD2 4.31Å; V61-I473 HydrophobicContact CG1-CD1 4.02Å; V61-I473 HydrophobicContact CG1-CG2 3.95Å
62	K	94.5	Very high	90.3	Very high	122 Å²	122	43.8 Å²	43.8	53%	0.53	22%	0.216	S	C	.	.	H	α-helix	trans	-63.6	-48.7	176.9	-173.7	-178.9	175.7	-172.9	0	111.6	K58 R59 L60 S64 F65 E66 I473	K58-K62 WeakPolarHBondContact O-CB 2.96Å; K58-K62 PolarHBondContact O-N 2.92Å; R59-K62 PolarHBondContact O-N 2.86Å; L60-K62 VanDerWaalsContact C-N 3.31Å; L60-K62 PolarHBondContact O-N 2.98Å; K62-S64 VanDerWaalsContact C-N 3.35Å; K62-S64 PolarHBondContact O-N 3.02Å; K62-F65 PolarHBondContact O-N 2.97Å; K62-E66 WeakPolarHBondContact CE-OE1 3.33Å; K62-E66 WeakPolarHBondContact O-CG 3.45Å; K62-E66 PolarHBondContact O-N 3.18Å; K62-E66 VanDerWaalsContact O-N 3.09Å; K62-I473 HydrophobicContact CB-CD1 4.34Å
63	S	95.7	Very high	91.4	Very high	47 Å²	47	51.3 Å²	51.3	33%	0.329	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-42.6	178.7	-171.4	0	0	0	0	111.5	R59 L60 F65 E66 V67	R59-S63 WeakPolarHBondContact O-CB 3.37Å; R59-S63 PolarHBondContact O-N 3.34Å; L60-S63 PolarHBondContact O-N 3.27Å; S63-F65 VanDerWaalsContact C-N 3.33Å; S63-F65 PolarHBondContact O-N 2.96Å; S63-E66 PolarHBondContact O-N 3.05Å; S63-V67 WeakPolarHBondContact O-CG2 3.43Å; S63-V67 PolarHBondContact O-N 2.95Å
64	S	96.4	Very high	92.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.6	-34.4	178.4	60.9	0	0	0	0	112.2	L60 V61 K62 V67 F68 W393	L60-S64 WeakPolarHBondContact O-CB 3.31Å; L60-S64 PolarHBondContact O-N 2.96Å; L60-S64 PolarHBondContact O-OG 3.39Å; L60-S64 VanDerWaalsContact O-OG 3.09Å; V61-S64 WeakPolarHBondContact CA-OG 3.28Å; V61-S64 PolarHBondContact O-OG 2.87Å; K62-S64 VanDerWaalsContact C-N 3.35Å; K62-S64 PolarHBondContact O-N 3.02Å; S64-V67 PolarHBondContact O-N 3.04Å; S64-F68 WeakPolarHBondContact O-CB 3.31Å; S64-F68 PolarHBondContact O-N 2.94Å; S64-W393 PolarHBondContact OG-NE1 3.45Å
65	F	96.8	Very high	92.1	Very high	41 Å²	41	52.3 Å²	52.3	18%	0.18	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-36	175.2	177	-109.5	0	0	0	112.7	V61 K62 S63 F68 S69 I473 G476 Y477	V61-F65 WeakPolarHBondContact O-CB 3.39Å; V61-F65 PolarHBondContact O-N 3.21Å; K62-F65 PolarHBondContact O-N 2.97Å; S63-F65 VanDerWaalsContact C-N 3.33Å; S63-F65 PolarHBondContact O-N 2.96Å; F65-F68 HydrophobicContact CD2-CD1 4.41Å; F65-F68 HydrophobicContact CE2-CD1 4.45Å; F65-F68 PolarHBondContact O-N 3.37Å; F65-S69 WeakPolarHBondContact CE1-OG 3.43Å; F65-S69 WeakPolarHBondContact CE2-OG 3.27Å; F65-S69 WeakPolarHBondContact CZ-OG 3.49Å; F65-S69 VanDerWaalsContact O-CB 3.3Å; F65-S69 WeakPolarHBondContact O-CB 3.47Å; F65-S69 PolarHBondContact O-N 3.38Å; F65-S69 PolarHBondContact O-OG 3.38Å; F65-I473 HydrophobicContact CB-CG2 3.74Å; F65-I473 HydrophobicContact CD1-CG2 4.26Å; F65-I473 HydrophobicContact CD2-CG2 4Å; F65-I473 HydrophobicContact CG-CG2 3.72Å; F65-G476 VanDerWaalsContact CE2-C 3.46Å; F65-Y477 WeakPolarHBondContact CA-OH 3.27Å; F65-Y477 HydrophobicContact CB-CE2 4.01Å; F65-Y477 HydrophobicContact CD2-CD1 4.17Å; F65-Y477 AromaticContact CD2-CD2 3.73Å; F65-Y477 HydrophobicContact CD2-CD2 3.73Å; F65-Y477 HydrophobicContact CD2-CE1 4.01Å; F65-Y477 AromaticContact CD2-CE2 3.5Å; F65-Y477 HydrophobicContact CD2-CE2 3.5Å; F65-Y477 VanDerWaalsContact CD2-CE2 3.5Å; F65-Y477 HydrophobicContact CD2-CG 4.05Å; F65-Y477 AromaticContact CD2-CZ 3.64Å; F65-Y477 HydrophobicContact CE2-CD2 4.22Å; F65-Y477 HydrophobicContact CE2-CE2 4.41Å; F65-Y477 HydrophobicContact CE2-CG 4.26Å; F65-Y477 HydrophobicContact CG-CE2 4.14Å; F65-Y477 PolarHBondContact N-OH 3.22Å
66	E	96.1	Very high	91.5	Very high	112 Å²	112	49.6 Å²	49.6	52%	0.523	26%	0.258	S	S	.	.	H	α-helix	trans	-63.1	-44.9	174.6	-71.7	173.2	-169.4	0	0	110.8	K62 S63 S69 A70	K62-E66 WeakPolarHBondContact CE-OE1 3.33Å; K62-E66 WeakPolarHBondContact O-CG 3.45Å; K62-E66 PolarHBondContact O-N 3.18Å; K62-E66 VanDerWaalsContact O-N 3.09Å; S63-E66 PolarHBondContact O-N 3.05Å; E66-S69 PolarHBondContact O-N 2.86Å; E66-A70 WeakPolarHBondContact O-CB 3.46Å; E66-A70 PolarHBondContact O-N 3.25Å
67	V	96.2	Very high	90.3	Very high	12 Å²	12	55.3 Å²	55.3	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-44.8	174.6	-178.3	0	0	0	0	111	S63 S64 S69 A70 L71 H83 Q86 Y87	S63-V67 WeakPolarHBondContact O-CG2 3.43Å; S63-V67 PolarHBondContact O-N 2.95Å; S64-V67 PolarHBondContact O-N 3.04Å; V67-S69 PolarHBondContact O-N 3.09Å; V67-A70 PolarHBondContact O-N 3.11Å; V67-L71 WeakPolarHBondContact O-CB 3.47Å; V67-L71 PolarHBondContact O-N 2.96Å; V67-H83 HydrophobicContact CG1-CB 4.15Å; V67-Q86 HydrophobicContact CG1-CB 4.01Å; V67-Q86 HydrophobicContact CG2-CB 3.73Å; V67-Y87 HydrophobicContact CB-CD1 4.24Å; V67-Y87 HydrophobicContact CB-CE1 3.87Å; V67-Y87 HydrophobicContact CB-CE2 4.34Å; V67-Y87 HydrophobicContact CG1-CD1 4.11Å; V67-Y87 HydrophobicContact CG1-CD2 3.71Å; V67-Y87 HydrophobicContact CG1-CE1 3.87Å; V67-Y87 HydrophobicContact CG1-CE2 3.46Å; V67-Y87 VanDerWaalsContact CG1-CE2 3.46Å; V67-Y87 HydrophobicContact CG1-CG 4.03Å
68	F	96.2	Very high	89.3	Confident	1 Å²	1	61.6 Å²	61.6	0%	0.004	32%	0.318	C	S	.	.	H	α-helix	trans	-57.9	-50.7	176.1	176.9	-90.4	0	0	0	111.5	S64 F65 A70 L71 Q72 Y87 N400 L457 Y477 H480	S64-F68 WeakPolarHBondContact O-CB 3.31Å; S64-F68 PolarHBondContact O-N 2.94Å; F65-F68 HydrophobicContact CD2-CD1 4.41Å; F65-F68 HydrophobicContact CE2-CD1 4.45Å; F65-F68 PolarHBondContact O-N 3.37Å; F68-A70 VanDerWaalsContact C-N 3.28Å; F68-A70 PolarHBondContact O-N 3.07Å; F68-L71 WeakPolarHBondContact O-CB 3.44Å; F68-L71 PolarHBondContact O-N 3.38Å; F68-L71 VanDerWaalsContact O-N 3.13Å; F68-Q72 HydrophobicContact CD1-CG 4.03Å; F68-Q72 HydrophobicContact CE1-CG 3.64Å; F68-Q72 HydrophobicContact CE2-CG 4.44Å; F68-Q72 HydrophobicContact CZ-CG 3.87Å; F68-Q72 WeakPolarHBondContact O-CG 3.3Å; F68-Q72 PolarHBondContact O-N 3.42Å; F68-Y87 WeakPolarHBondContact CA-OH 3.31Å; F68-Y87 WeakPolarHBondContact CB-OH 3.41Å; F68-Y87 PolarHBondContact N-OH 3.36Å; F68-N400 HydrophobicContact CE2-CB 4.35Å; F68-L457 HydrophobicContact CE2-CD1 4Å; F68-L457 HydrophobicContact CE2-CD2 4.05Å; F68-L457 HydrophobicContact CZ-CD1 4.3Å; F68-L457 HydrophobicContact CZ-CD2 3.76Å; F68-Y477 HydrophobicContact CB-CE1 3.78Å; F68-Y477 AromaticContact CD1-CD1 3.51Å; F68-Y477 HydrophobicContact CD1-CD1 3.51Å; F68-Y477 AromaticContact CD1-CE1 3.57Å; F68-Y477 HydrophobicContact CD1-CE1 3.57Å; F68-Y477 AromaticContact CD2-CD1 3.98Å; F68-Y477 HydrophobicContact CD2-CD1 3.98Å; F68-Y477 AromaticContact CD2-CE1 3.64Å; F68-Y477 HydrophobicContact CD2-CE1 3.64Å; F68-Y477 AromaticContact CE1-CD1 3.48Å; F68-Y477 HydrophobicContact CE1-CD1 3.48Å; F68-Y477 VanDerWaalsContact CE1-CD1 3.48Å; F68-Y477 HydrophobicContact CE1-CE1 4.01Å; F68-Y477 HydrophobicContact CE1-CG 4.43Å; F68-Y477 AromaticContact CE2-CD1 3.92Å; F68-Y477 HydrophobicContact CE2-CD1 3.92Å; F68-Y477 HydrophobicContact CE2-CE1 4.05Å; F68-Y477 AromaticContact CG-CD1 3.77Å; F68-Y477 HydrophobicContact CG-CD1 3.77Å; F68-Y477 AromaticContact CG-CE1 3.38Å; F68-Y477 HydrophobicContact CG-CE1 3.38Å; F68-Y477 AromaticContact CZ-CD1 3.68Å; F68-Y477 HydrophobicContact CZ-CD1 3.68Å; F68-Y477 HydrophobicContact CZ-CE1 4.23Å; F68-H480 HydrophobicContact CE1-CB 4.13Å; F68-H480 AromaticContact CE1-CD2 3.71Å; F68-H480 HydrophobicContact CZ-CB 4.29Å
69	S	94	Very high	88.9	Confident	19 Å²	19	60 Å²	60	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-35.6	-178.8	-62.5	0	0	0	0	112.4	F65 E66 V67 K73	F65-S69 WeakPolarHBondContact CE1-OG 3.43Å; F65-S69 WeakPolarHBondContact CE2-OG 3.27Å; F65-S69 WeakPolarHBondContact CZ-OG 3.49Å; F65-S69 VanDerWaalsContact O-CB 3.3Å; F65-S69 WeakPolarHBondContact O-CB 3.47Å; F65-S69 PolarHBondContact O-N 3.38Å; F65-S69 PolarHBondContact O-OG 3.38Å; E66-S69 PolarHBondContact O-N 2.86Å; V67-S69 PolarHBondContact O-N 3.09Å; S69-K73 WeakPolarHBondContact O-CG 3.24Å
70	A	93.5	Very high	88.6	Confident	44 Å²	44	55.3 Å²	55.3	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-67.6	-44.8	173.6	0	0	0	0	0	111.3	E66 V67 F68 Q72 K73 C74	E66-A70 WeakPolarHBondContact O-CB 3.46Å; E66-A70 PolarHBondContact O-N 3.25Å; V67-A70 PolarHBondContact O-N 3.11Å; F68-A70 VanDerWaalsContact C-N 3.28Å; F68-A70 PolarHBondContact O-N 3.07Å; A70-Q72 PolarHBondContact O-N 3.32Å; A70-K73 PolarHBondContact O-N 3.5Å; A70-K73 VanDerWaalsContact O-N 3.12Å; A70-C74 PolarHBondContact O-N 3.27Å
71	L	93.3	Very high	88.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-43.1	178.7	178.4	63.6	0	0	0	111.9	V67 F68 K73 C74 F80 H83 N400 L401 H404	V67-L71 WeakPolarHBondContact O-CB 3.47Å; V67-L71 PolarHBondContact O-N 2.96Å; F68-L71 WeakPolarHBondContact O-CB 3.44Å; F68-L71 PolarHBondContact O-N 3.38Å; F68-L71 VanDerWaalsContact O-N 3.13Å; L71-K73 PolarHBondContact O-N 3.42Å; L71-K73 VanDerWaalsContact O-N 3.12Å; L71-C74 VanDerWaalsContact O-CB 3.29Å; L71-C74 WeakPolarHBondContact O-CB 3.5Å; L71-C74 PolarHBondContact O-N 3.06Å; L71-F80 HydrophobicContact CD1-CD1 3.47Å; L71-F80 VanDerWaalsContact CD1-CD1 3.47Å; L71-F80 HydrophobicContact CD1-CE1 3.78Å; L71-H83 HydrophobicContact CD1-CB 4.24Å; L71-N400 WeakPolarHBondContact CD2-ND2 3.25Å; L71-L401 HydrophobicContact CD1-CD1 4.03Å; L71-L401 HydrophobicContact CD2-CB 4.26Å; L71-L401 HydrophobicContact CD2-CD1 3.84Å; L71-H404 HydrophobicContact CD1-CB 4.42Å
72	Q	91	Very high	88.2	Confident	47 Å²	47	61.2 Å²	61.2	22%	0.22	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.7	179.1	-61.9	-51.1	-27.5	0	0	113.9	F68 A70 N400 H404 H480	F68-Q72 HydrophobicContact CD1-CG 4.03Å; F68-Q72 HydrophobicContact CE1-CG 3.64Å; F68-Q72 HydrophobicContact CE2-CG 4.44Å; F68-Q72 HydrophobicContact CZ-CG 3.87Å; F68-Q72 WeakPolarHBondContact O-CG 3.3Å; F68-Q72 PolarHBondContact O-N 3.42Å; A70-Q72 PolarHBondContact O-N 3.32Å; Q72-N400 VanDerWaalsContact NE2-CG 3.34Å; Q72-N400 PolarHBondContact NE2-ND2 3.4Å; Q72-N400 PolarHBondContact NE2-OD1 3.11Å; Q72-H404 PolarHBondContact OE1-CE1 2.65Å; Q72-H404 PolarHBondContact OE1-NE2 3.39Å; Q72-H480 HydrophobicContact CG-CB 4.24Å
73	K	88.2	Confident	88.2	Confident	168 Å²	168	56.2 Å²	56.2	73%	0.73	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-5.5	178.6	-63.5	172.4	-173.8	174.1	0	112.4	S69 A70 L71	S69-K73 WeakPolarHBondContact O-CG 3.24Å; A70-K73 PolarHBondContact O-N 3.5Å; A70-K73 VanDerWaalsContact O-N 3.12Å; L71-K73 PolarHBondContact O-N 3.42Å; L71-K73 VanDerWaalsContact O-N 3.12Å
74	C	84.8	Confident	88.2	Confident	30 Å²	30	54 Å²	54	20%	0.203	29%	0.294	C	S	.	.			trans	-86.9	131.7	-172.8	-165.8	0	0	0	0	111	A70 L71 S79 F80	A70-C74 PolarHBondContact O-N 3.27Å; L71-C74 VanDerWaalsContact O-CB 3.29Å; L71-C74 WeakPolarHBondContact O-CB 3.5Å; L71-C74 PolarHBondContact O-N 3.06Å; C74-S79 PolarHBondContact SG-OG 3.38Å; C74-F80 HydrophobicContact CB-CE1 4.28Å
75	S	75	Confident	88.1	Confident	114 Å²	114	57.6 Å²	57.6	80%	0.797	31%	0.313	S	S	*	.			trans	-108.9	-9.1	175.9	56.6	0	0	0	0	113.9
76	V	75.6	Confident	88	Confident	83 Å²	83	59.5 Å²	59.5	50%	0.503	32%	0.322	S	S	.	.			trans	-100.1	124.8	-171.5	-178.2	0	0	0	0	110.2	N78 S79	V76-N78 PolarHBondContact O-N 3.29Å; V76-S79 WeakPolarHBondContact CB-OG 3.38Å; V76-S79 PolarHBondContact O-N 2.99Å; V76-S79 PolarHBondContact O-OG 2.88Å
77	Q	67.8	Low	88.1	Confident	137 Å²	137	54.1 Å²	54.1	64%	0.64	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-41	-176.1	-83.6	175.3	-22.8	0	0	113.9	S79 F80	Q77-S79 PolarHBondContact O-N 3.46Å; Q77-S79 VanDerWaalsContact O-N 3.14Å; Q77-F80 HydrophobicContact CB-CD2 4.28Å; Q77-F80 HydrophobicContact CB-CE2 4.21Å; Q77-F80 HydrophobicContact CG-CD2 4.22Å; Q77-F80 HydrophobicContact CG-CE2 3.77Å; Q77-F80 WeakPolarHBondContact O-CB 3.46Å; Q77-F80 VanDerWaalsContact O-CD2 3.26Å; Q77-F80 WeakPolarHBondContact O-CD2 3.47Å; Q77-F80 WeakPolarHBondContact O-CG 3.49Å; Q77-F80 PolarHBondContact O-N 3.15Å
78	N	67.2	Low	88	Confident	138 Å²	138	55.6 Å²	55.6	74%	0.738	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.2	-177.7	-72.4	-1.7	0	0	0	113.4	V76 F80	V76-N78 PolarHBondContact O-N 3.29Å; N78-F80 VanDerWaalsContact C-N 3.29Å; N78-F80 PolarHBondContact O-N 3.31Å
79	S	81.5	Confident	88	Confident	30 Å²	30	57.9 Å²	57.9	21%	0.21	32%	0.32	C	S	.	.	H	α-helix	trans	-74.8	-14.6	175.1	22	0	0	0	0	113.6	C74 V76 Q77 I81 T82 H83	C74-S79 PolarHBondContact SG-OG 3.38Å; V76-S79 WeakPolarHBondContact CB-OG 3.38Å; V76-S79 PolarHBondContact O-N 2.99Å; V76-S79 PolarHBondContact O-OG 2.88Å; Q77-S79 PolarHBondContact O-N 3.46Å; Q77-S79 VanDerWaalsContact O-N 3.14Å; S79-I81 VanDerWaalsContact C-N 3.34Å; S79-I81 PolarHBondContact O-N 3.48Å; S79-T82 WeakPolarHBondContact O-CA 3.34Å; S79-T82 VanDerWaalsContact O-CB 3.25Å; S79-T82 WeakPolarHBondContact O-CB 3.29Å; S79-T82 PolarHBondContact O-N 2.95Å; S79-H83 PolarHBondContact O-N 2.91Å; S79-H83 VanDerWaalsContact O-N 3.11Å; S79-H83 PolarHBondContact O-ND1 3.28Å
80	F	87.4	Confident	88.2	Confident	11 Å²	11	57.3 Å²	57.3	5%	0.048	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-36.5	-178.1	-60.7	-36.5	0	0	0	112.8	L71 C74 Q77 N78 T82 H83 S84 L401 H404 I405	L71-F80 HydrophobicContact CD1-CD1 3.47Å; L71-F80 VanDerWaalsContact CD1-CD1 3.47Å; L71-F80 HydrophobicContact CD1-CE1 3.78Å; C74-F80 HydrophobicContact CB-CE1 4.28Å; Q77-F80 HydrophobicContact CB-CD2 4.28Å; Q77-F80 HydrophobicContact CB-CE2 4.21Å; Q77-F80 HydrophobicContact CG-CD2 4.22Å; Q77-F80 HydrophobicContact CG-CE2 3.77Å; Q77-F80 WeakPolarHBondContact O-CB 3.46Å; Q77-F80 VanDerWaalsContact O-CD2 3.26Å; Q77-F80 WeakPolarHBondContact O-CD2 3.47Å; Q77-F80 WeakPolarHBondContact O-CG 3.49Å; Q77-F80 PolarHBondContact O-N 3.15Å; N78-F80 VanDerWaalsContact C-N 3.29Å; N78-F80 PolarHBondContact O-N 3.31Å; F80-T82 PolarHBondContact O-N 3.38Å; F80-H83 PolarHBondContact O-N 3.03Å; F80-H83 VanDerWaalsContact O-N 3.14Å; F80-S84 PolarHBondContact O-N 3.11Å; F80-L401 HydrophobicContact CB-CD1 4.25Å; F80-H404 HydrophobicContact CD1-CB 4.43Å; F80-H404 HydrophobicContact CE1-CB 4.02Å; F80-H404 HydrophobicContact CE2-CB 4.36Å; F80-H404 WeakPolarHBondContact CE2-O 3.46Å; F80-H404 HydrophobicContact CZ-CB 3.98Å; F80-I405 HydrophobicContact CB-CD1 4.15Å; F80-I405 HydrophobicContact CB-CG1 3.6Å; F80-I405 HydrophobicContact CD2-CB 4.34Å; F80-I405 HydrophobicContact CD2-CG1 3.68Å; F80-I405 HydrophobicContact CG-CG1 3.89Å
81	I	88.8	Confident	88.3	Confident	60 Å²	60	55.2 Å²	55.2	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-40.1	171.8	-62.4	170.5	0	0	0	110.1	S79 H83 S84 I85 I138	S79-I81 VanDerWaalsContact C-N 3.34Å; S79-I81 PolarHBondContact O-N 3.48Å; I81-H83 VanDerWaalsContact C-N 3.32Å; I81-H83 PolarHBondContact O-N 3.35Å; I81-S84 WeakPolarHBondContact O-CB 3.5Å; I81-S84 PolarHBondContact O-N 2.92Å; I81-I85 HydrophobicContact CG2-CD1 3.96Å; I81-I85 HydrophobicContact CG2-CG1 4.47Å; I81-I85 WeakPolarHBondContact O-CG1 3.25Å; I81-I85 PolarHBondContact O-N 3.15Å; I81-I138 HydrophobicContact CG1-CG2 4.08Å
82	T	92.4	Very high	88.4	Confident	70 Å²	70	56.7 Å²	56.7	43%	0.429	31%	0.312	S	S	.	.	H	α-helix	trans	-61.2	-40.5	176.7	-50.9	0	0	0	0	111.7	S79 F80 I85 Q86	S79-T82 WeakPolarHBondContact O-CA 3.34Å; S79-T82 VanDerWaalsContact O-CB 3.25Å; S79-T82 WeakPolarHBondContact O-CB 3.29Å; S79-T82 PolarHBondContact O-N 2.95Å; F80-T82 PolarHBondContact O-N 3.38Å; T82-I85 PolarHBondContact O-N 3.49Å; T82-Q86 VanDerWaalsContact O-CG 3.29Å; T82-Q86 WeakPolarHBondContact O-CG 3.28Å; T82-Q86 PolarHBondContact O-N 3.49Å
83	H	94.2	Very high	88.6	Confident	16 Å²	16	58.3 Å²	58.3	7%	0.074	33%	0.325	C	S	.	.	H	α-helix	trans	-68.4	-36.7	176.2	-65.1	85.7	0	0	0	111.9	V67 L71 S79 F80 I81 Q86 Y87 L401	V67-H83 HydrophobicContact CG1-CB 4.15Å; L71-H83 HydrophobicContact CD1-CB 4.24Å; S79-H83 PolarHBondContact O-N 2.91Å; S79-H83 VanDerWaalsContact O-N 3.11Å; S79-H83 PolarHBondContact O-ND1 3.28Å; F80-H83 PolarHBondContact O-N 3.03Å; F80-H83 VanDerWaalsContact O-N 3.14Å; I81-H83 VanDerWaalsContact C-N 3.32Å; I81-H83 PolarHBondContact O-N 3.35Å; H83-Q86 WeakPolarHBondContact O-CB 3.32Å; H83-Q86 PolarHBondContact O-N 3.16Å; H83-Y87 WeakPolarHBondContact O-CD2 3.43Å; H83-Y87 PolarHBondContact O-N 3.48Å; H83-L401 HydrophobicContact CB-CD1 4.44Å
84	S	94.9	Very high	89	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-47.7	172.5	-164.3	0	0	0	0	111.8	F80 I81 Q86 Y87 R88 W130 E134	F80-S84 PolarHBondContact O-N 3.11Å; I81-S84 WeakPolarHBondContact O-CB 3.5Å; I81-S84 PolarHBondContact O-N 2.92Å; S84-Q86 VanDerWaalsContact C-N 3.26Å; S84-Q86 PolarHBondContact O-N 3.25Å; S84-Y87 PolarHBondContact O-N 3.05Å; S84-R88 PolarHBondContact O-N 3.44Å; S84-W130 PolarHBondContact O-NE1 3.07Å; S84-W130 PolarHBondContact OG-NE1 3.14Å; S84-E134 VanDerWaalsContact C-OE2 3.29Å; S84-E134 WeakPolarHBondContact CB-OE2 3.14Å; S84-E134 VanDerWaalsContact OG-CD 3.31Å; S84-E134 WeakPolarHBondContact OG-CG 3.35Å; S84-E134 PolarHBondContact OG-OE2 2.93Å
85	I	94.4	Very high	89.5	Confident	77 Å²	77	49.4 Å²	49.4	40%	0.395	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-38.4	176.6	-66.1	166.3	0	0	0	110.6	I81 T82 R88 A89 E134	I81-I85 HydrophobicContact CG2-CD1 3.96Å; I81-I85 HydrophobicContact CG2-CG1 4.47Å; I81-I85 WeakPolarHBondContact O-CG1 3.25Å; I81-I85 PolarHBondContact O-N 3.15Å; T82-I85 PolarHBondContact O-N 3.49Å; I85-R88 PolarHBondContact O-N 2.97Å; I85-A89 WeakPolarHBondContact O-CB 3.29Å; I85-A89 PolarHBondContact O-N 3.1Å; I85-E134 PolarHBondContact N-OE2 3.02Å
86	Q	96.6	Very high	90.4	Very high	80 Å²	80	48.8 Å²	48.8	37%	0.374	27%	0.272	S	S	.	.	H	α-helix	trans	-66.4	-41.4	176.6	-72.2	170.8	-2.1	0	0	112.8	V67 T82 H83 S84 R88 A89 A90	V67-Q86 HydrophobicContact CG1-CB 4.01Å; V67-Q86 HydrophobicContact CG2-CB 3.73Å; T82-Q86 VanDerWaalsContact O-CG 3.29Å; T82-Q86 WeakPolarHBondContact O-CG 3.28Å; T82-Q86 PolarHBondContact O-N 3.49Å; H83-Q86 WeakPolarHBondContact O-CB 3.32Å; H83-Q86 PolarHBondContact O-N 3.16Å; S84-Q86 VanDerWaalsContact C-N 3.26Å; S84-Q86 PolarHBondContact O-N 3.25Å; Q86-R88 VanDerWaalsContact C-N 3.34Å; Q86-A89 PolarHBondContact O-N 3.04Å; Q86-A90 PolarHBondContact O-N 3.33Å
87	Y	97.2	Very high	91.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-44.4	173.3	-78.1	-64.2	0	0	0	111.6	V67 F68 H83 S84 A89 A90 L91 W130 W393 H397	V67-Y87 HydrophobicContact CB-CD1 4.24Å; V67-Y87 HydrophobicContact CB-CE1 3.87Å; V67-Y87 HydrophobicContact CB-CE2 4.34Å; V67-Y87 HydrophobicContact CG1-CD1 4.11Å; V67-Y87 HydrophobicContact CG1-CD2 3.71Å; V67-Y87 HydrophobicContact CG1-CE1 3.87Å; V67-Y87 HydrophobicContact CG1-CE2 3.46Å; V67-Y87 VanDerWaalsContact CG1-CE2 3.46Å; V67-Y87 HydrophobicContact CG1-CG 4.03Å; F68-Y87 WeakPolarHBondContact CA-OH 3.31Å; F68-Y87 WeakPolarHBondContact CB-OH 3.41Å; F68-Y87 PolarHBondContact N-OH 3.36Å; H83-Y87 WeakPolarHBondContact O-CD2 3.43Å; H83-Y87 PolarHBondContact O-N 3.48Å; S84-Y87 PolarHBondContact O-N 3.05Å; Y87-A89 PolarHBondContact O-N 3.47Å; Y87-A90 WeakPolarHBondContact O-CB 3.4Å; Y87-A90 PolarHBondContact O-N 3.35Å; Y87-L91 PolarHBondContact O-N 2.87Å; Y87-L91 VanDerWaalsContact O-N 3.1Å; Y87-W130 VanDerWaalsContact CB-CZ2 3.5Å; Y87-W130 HydrophobicContact CD1-CH2 4.48Å; Y87-W130 AromaticContact CD2-CH2 3.98Å; Y87-W130 HydrophobicContact CD2-CH2 3.98Å; Y87-W130 AromaticContact CD2-CZ2 3.58Å; Y87-W130 HydrophobicContact CD2-CZ2 3.58Å; Y87-W130 HydrophobicContact CE2-CZ2 4.46Å; Y87-W130 AromaticContact CG-CH2 3.93Å; Y87-W130 HydrophobicContact CG-CH2 3.93Å; Y87-W130 AromaticContact CG-CZ2 3.69Å; Y87-W130 HydrophobicContact CG-CZ2 3.69Å; Y87-W393 HydrophobicContact CD1-CZ2 4.32Å; Y87-H397 HydrophobicContact CD1-CB 4.43Å; Y87-H397 HydrophobicContact CE1-CB 4Å; Y87-H397 AromaticContact CE1-CD2 3.4Å; Y87-H397 WeakPolarHBondContact CE1-CD2 3.32Å; Y87-H397 AromaticContact CE1-CG 3.84Å; Y87-H397 AromaticContact CZ-CD2 3.72Å; Y87-H397 PolarHBondContact OH-CD2 2.96Å
88	R	95.1	Very high	92.5	Very high	43 Å²	43	41.1 Å²	41.1	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-43.6	175.3	178	163.2	56.3	123.8	-13.5	112.1	S84 I85 Q86 A90 L91 A92 E127 H131 E134	S84-R88 PolarHBondContact O-N 3.44Å; I85-R88 PolarHBondContact O-N 2.97Å; Q86-R88 VanDerWaalsContact C-N 3.34Å; R88-A90 VanDerWaalsContact C-N 3.31Å; R88-A90 PolarHBondContact O-N 3.31Å; R88-L91 WeakPolarHBondContact O-CB 3.5Å; R88-L91 PolarHBondContact O-N 3.07Å; R88-A92 PolarHBondContact O-N 3.14Å; R88-E127 HydrophobicContact CG-CG 4.11Å; R88-H131 VanDerWaalsContact CD-CB 3.41Å; R88-H131 VanDerWaalsContact CD-CG 3.41Å; R88-H131 PolarHBondContact NH1-CD2 3.5Å; R88-H131 PolarHBondContact NH1-CE1 3.32Å; R88-H131 PolarHBondContact NH1-ND1 3.46Å; R88-H131 PolarHBondContact NH1-NE2 3.15Å; R88-E134 IonicContact CZ-OE1 2.93Å; R88-E134 IonicContact NE-OE1 3.49Å; R88-E134 IonicContact NE-OE2 3.44Å; R88-E134 IonicContact NH2-OE1 3.98Å; R88-E134 PolarHBondContact NH2-OE1 3.21Å
89	A	96.2	Very high	93.7	Very high	48 Å²	48	37.2 Å²	37.2	40%	0.397	21%	0.207	S	C	.	.	H	α-helix	trans	-61.7	-39.1	175.2	0	0	0	0	0	112	I85 Q86 Y87 L91 A92 V93	I85-A89 WeakPolarHBondContact O-CB 3.29Å; I85-A89 PolarHBondContact O-N 3.1Å; Q86-A89 PolarHBondContact O-N 3.04Å; Y87-A89 PolarHBondContact O-N 3.47Å; A89-L91 VanDerWaalsContact C-N 3.35Å; A89-L91 PolarHBondContact O-N 3.31Å; A89-A92 PolarHBondContact O-N 3.19Å; A89-V93 WeakPolarHBondContact O-CB 3.49Å; A89-V93 VanDerWaalsContact O-CG2 3.26Å; A89-V93 WeakPolarHBondContact O-CG2 3.4Å; A89-V93 PolarHBondContact O-N 3.31Å
90	A	96.9	Very high	94.3	Very high	8 Å²	8	38.9 Å²	38.9	7%	0.066	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-40.9	176.1	0	0	0	0	0	112.1	L60 Q86 Y87 R88 C94	L60-A90 HydrophobicContact CD1-CB 3.97Å; Q86-A90 PolarHBondContact O-N 3.33Å; Y87-A90 WeakPolarHBondContact O-CB 3.4Å; Y87-A90 PolarHBondContact O-N 3.35Å; R88-A90 VanDerWaalsContact C-N 3.31Å; R88-A90 PolarHBondContact O-N 3.31Å; A90-C94 WeakPolarHBondContact O-CB 3.48Å; A90-C94 PolarHBondContact O-N 3.12Å
91	L	96	Very high	94.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-48.4	173.5	-70.8	168.6	0	0	0	111.8	L60 Y87 R88 A89 V93 C94 S95 I123 L126 E127 W130 W393	L60-L91 HydrophobicContact CD1-CD2 4.28Å; L60-L91 HydrophobicContact CD2-CD2 4.16Å; Y87-L91 PolarHBondContact O-N 2.87Å; Y87-L91 VanDerWaalsContact O-N 3.1Å; R88-L91 WeakPolarHBondContact O-CB 3.5Å; R88-L91 PolarHBondContact O-N 3.07Å; A89-L91 VanDerWaalsContact C-N 3.35Å; A89-L91 PolarHBondContact O-N 3.31Å; L91-V93 PolarHBondContact O-N 3.19Å; L91-C94 PolarHBondContact O-N 3.18Å; L91-S95 PolarHBondContact O-N 3.47Å; L91-S95 PolarHBondContact O-OG 3.03Å; L91-I123 HydrophobicContact CB-CG2 4.27Å; L91-I123 HydrophobicContact CD2-CG2 3.89Å; L91-I123 WeakPolarHBondContact O-CG2 3.5Å; L91-L126 HydrophobicContact CD1-CB 4.41Å; L91-L126 HydrophobicContact CD2-CB 4.31Å; L91-E127 HydrophobicContact CB-CB 3.96Å; L91-E127 HydrophobicContact CB-CG 4.15Å; L91-E127 HydrophobicContact CD1-CB 4.28Å; L91-W130 HydrophobicContact CD1-CB 4.24Å; L91-W393 HydrophobicContact CD1-CH2 3.66Å; L91-W393 HydrophobicContact CD1-CZ3 3.77Å; L91-W393 HydrophobicContact CD2-CE3 4.3Å; L91-W393 HydrophobicContact CD2-CH2 3.55Å; L91-W393 HydrophobicContact CD2-CZ2 4.21Å; L91-W393 HydrophobicContact CD2-CZ3 3.6Å; L91-W393 HydrophobicContact CG-CH2 3.56Å; L91-W393 HydrophobicContact CG-CZ2 4.37Å; L91-W393 HydrophobicContact CG-CZ3 3.96Å
92	A	95.1	Very high	94.7	Very high	31 Å²	31	40.5 Å²	40.5	26%	0.256	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-41.8	-179.8	0	0	0	0	0	112.6	R88 A89 S95 N96 E127	R88-A92 PolarHBondContact O-N 3.14Å; A89-A92 PolarHBondContact O-N 3.19Å; A92-S95 PolarHBondContact O-OG 3.04Å; A92-S95 VanDerWaalsContact O-OG 3.05Å; A92-N96 WeakPolarHBondContact O-CB 3.49Å; A92-N96 PolarHBondContact O-N 2.99Å; A92-E127 WeakPolarHBondContact CA-OE2 3.49Å; A92-E127 WeakPolarHBondContact CB-OE1 3.48Å
93	V	96.3	Very high	94.6	Very high	81 Å²	81	45.6 Å²	45.6	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-63	-46	175.1	169.8	0	0	0	0	110.1	A89 L91 N96 E97	A89-V93 WeakPolarHBondContact O-CB 3.49Å; A89-V93 VanDerWaalsContact O-CG2 3.26Å; A89-V93 WeakPolarHBondContact O-CG2 3.4Å; A89-V93 PolarHBondContact O-N 3.31Å; L91-V93 PolarHBondContact O-N 3.19Å; V93-N96 PolarHBondContact O-N 3.45Å; V93-E97 HydrophobicContact CG1-CG 4.35Å; V93-E97 WeakPolarHBondContact O-CB 3.45Å; V93-E97 VanDerWaalsContact O-CG 3.23Å; V93-E97 WeakPolarHBondContact O-CG 3.48Å; V93-E97 PolarHBondContact O-N 3.17Å
94	C	95.7	Very high	94.4	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.02	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-47.4	-178.9	-169.7	0	0	0	0	112.2	L60 A90 L91 E97 I98 I123	L60-C94 HydrophobicContact CB-CB 4.2Å; L60-C94 HydrophobicContact CD1-CB 4.22Å; L60-C94 HydrophobicContact CD2-CB 4.44Å; A90-C94 WeakPolarHBondContact O-CB 3.48Å; A90-C94 PolarHBondContact O-N 3.12Å; L91-C94 PolarHBondContact O-N 3.18Å; C94-E97 PolarHBondContact O-N 3.26Å; C94-I98 WeakPolarHBondContact O-CG1 3.17Å; C94-I98 PolarHBondContact O-N 2.69Å; C94-I98 VanDerWaalsContact O-N 3.14Å; C94-I123 HydrophobicContact CB-CG2 4.31Å
95	S	94.6	Very high	93.8	Very high	8 Å²	8	52.7 Å²	52.7	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-45.4	178.1	63.7	0	0	0	0	111.4	L91 A92 E97 I98 F99	L91-S95 PolarHBondContact O-N 3.47Å; L91-S95 PolarHBondContact O-OG 3.03Å; A92-S95 PolarHBondContact O-OG 3.04Å; A92-S95 VanDerWaalsContact O-OG 3.05Å; S95-E97 PolarHBondContact O-N 3.44Å; S95-I98 PolarHBondContact O-N 3.4Å; S95-F99 WeakPolarHBondContact O-CD2 3.24Å; S95-F99 PolarHBondContact O-N 3.01Å
96	N	94	Very high	92.4	Very high	100 Å²	100	55.5 Å²	55.5	54%	0.535	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-39.1	-179.9	-173.8	44.6	0	0	0	112.6	A92 V93 F99 T100	A92-N96 WeakPolarHBondContact O-CB 3.49Å; A92-N96 PolarHBondContact O-N 2.99Å; V93-N96 PolarHBondContact O-N 3.45Å; N96-F99 PolarHBondContact O-N 2.72Å; N96-T100 VanDerWaalsContact O-CB 3.23Å; N96-T100 WeakPolarHBondContact O-CB 3.42Å; N96-T100 PolarHBondContact O-N 3.33Å; N96-T100 PolarHBondContact O-OG1 3.31Å
97	E	94.7	Very high	91	Very high	59 Å²	59	55.6 Å²	55.6	28%	0.276	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-42	175	-75.8	-180	161.5	0	0	112.3	F56 R59 V93 C94 S95 T100 F101	F56-E97 HydrophobicContact CD1-CB 3.97Å; F56-E97 HydrophobicContact CE1-CB 4.05Å; R59-E97 IonicContact CZ-OE1 2.79Å; R59-E97 IonicContact CZ-OE2 2.75Å; R59-E97 IonicContact NH1-OE1 3.17Å; R59-E97 PolarHBondContact NH1-OE1 3.46Å; R59-E97 IonicContact NH1-OE2 3.63Å; R59-E97 PolarHBondContact NH1-OE2 3.08Å; R59-E97 IonicContact NH2-OE1 3.82Å; R59-E97 IonicContact NH2-OE2 2.76Å; R59-E97 PolarHBondContact NH2-OE2 2.82Å; V93-E97 HydrophobicContact CG1-CG 4.35Å; V93-E97 WeakPolarHBondContact O-CB 3.45Å; V93-E97 VanDerWaalsContact O-CG 3.23Å; V93-E97 WeakPolarHBondContact O-CG 3.48Å; V93-E97 PolarHBondContact O-N 3.17Å; C94-E97 PolarHBondContact O-N 3.26Å; S95-E97 PolarHBondContact O-N 3.44Å; E97-T100 PolarHBondContact O-N 3.45Å; E97-F101 VanDerWaalsContact O-CB 3.28Å; E97-F101 WeakPolarHBondContact O-CB 3.42Å; E97-F101 PolarHBondContact O-N 3.48Å
98	I	93.9	Very high	89.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-50.3	175.9	-70	166.9	0	0	0	110.1	F56 C94 S95 T100 F101 L102 L116 Q119 I123	F56-I98 HydrophobicContact CB-CD1 4.02Å; F56-I98 HydrophobicContact CB-CG1 3.78Å; F56-I98 HydrophobicContact CD1-CG1 3.8Å; F56-I98 HydrophobicContact CD2-CG1 3.96Å; F56-I98 HydrophobicContact CE1-CG1 4.42Å; F56-I98 HydrophobicContact CG-CD1 4.34Å; F56-I98 HydrophobicContact CG-CG1 3.57Å; C94-I98 WeakPolarHBondContact O-CG1 3.17Å; C94-I98 PolarHBondContact O-N 2.69Å; C94-I98 VanDerWaalsContact O-N 3.14Å; S95-I98 PolarHBondContact O-N 3.4Å; I98-T100 PolarHBondContact O-N 3.15Å; I98-F101 WeakPolarHBondContact O-CB 3.42Å; I98-F101 PolarHBondContact O-N 3.08Å; I98-L102 HydrophobicContact CG2-CD1 4.02Å; I98-L102 WeakPolarHBondContact O-CG 3.48Å; I98-L102 PolarHBondContact O-N 3.35Å; I98-L116 HydrophobicContact CG2-CB 4.22Å; I98-L116 VanDerWaalsContact CG2-O 3.28Å; I98-L116 WeakPolarHBondContact CG2-O 3.33Å; I98-Q119 HydrophobicContact CD1-CG 4.42Å; I98-I123 HydrophobicContact CD1-CD1 3.4Å; I98-I123 VanDerWaalsContact CD1-CD1 3.4Å
99	F	93	Very high	88.7	Confident	57 Å²	57	61.3 Å²	61.3	25%	0.25	36%	0.36	C	S	.	.	H	α-helix	trans	-67.3	-36.5	-179.1	-65.5	-53.3	0	0	0	112.8	S95 N96 L102 K103 L117	S95-F99 WeakPolarHBondContact O-CD2 3.24Å; S95-F99 PolarHBondContact O-N 3.01Å; N96-F99 PolarHBondContact O-N 2.72Å; F99-L102 HydrophobicContact CD1-CD1 4.32Å; F99-L102 PolarHBondContact O-N 2.94Å; F99-K103 WeakPolarHBondContact O-CB 3.25Å; F99-K103 PolarHBondContact O-N 3.38Å; F99-L117 HydrophobicContact CD1-CD1 4.47Å; F99-L117 HydrophobicContact CE1-CD1 4.06Å
100	T	93.6	Very high	88.1	Confident	65 Å²	65	67 Å²	67	40%	0.399	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-44.5	174	-60.4	0	0	0	0	110.7	N96 E97 I98 L102 K103 L104	N96-T100 VanDerWaalsContact O-CB 3.23Å; N96-T100 WeakPolarHBondContact O-CB 3.42Å; N96-T100 PolarHBondContact O-N 3.33Å; N96-T100 PolarHBondContact O-OG1 3.31Å; E97-T100 PolarHBondContact O-N 3.45Å; I98-T100 PolarHBondContact O-N 3.15Å; T100-L102 PolarHBondContact O-N 3.02Å; T100-K103 PolarHBondContact O-N 3.31Å; T100-L104 HydrophobicContact CG2-CD1 3.96Å; T100-L104 WeakPolarHBondContact O-CG 3.44Å; T100-L104 PolarHBondContact O-N 3.14Å; T100-L104 VanDerWaalsContact O-N 3.09Å
101	F	92.5	Very high	87.5	Confident	68 Å²	68	70 Å²	70	30%	0.298	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-45.5	175.7	177.3	-95.2	0	0	0	111.7	F56 E97 I98 K103 L104 S105 L116	F56-F101 HydrophobicContact CE1-CB 4.29Å; F56-F101 HydrophobicContact CE2-CD1 4.41Å; F56-F101 HydrophobicContact CE2-CG 4.44Å; F56-F101 HydrophobicContact CZ-CB 3.77Å; F56-F101 HydrophobicContact CZ-CD1 4.15Å; F56-F101 HydrophobicContact CZ-CD2 4.14Å; F56-F101 AromaticContact CZ-CG 3.75Å; F56-F101 HydrophobicContact CZ-CG 3.75Å; E97-F101 VanDerWaalsContact O-CB 3.28Å; E97-F101 WeakPolarHBondContact O-CB 3.42Å; E97-F101 PolarHBondContact O-N 3.48Å; I98-F101 WeakPolarHBondContact O-CB 3.42Å; I98-F101 PolarHBondContact O-N 3.08Å; F101-K103 VanDerWaalsContact C-N 3.34Å; F101-K103 PolarHBondContact O-N 2.94Å; F101-L104 PolarHBondContact O-N 3.25Å; F101-S105 WeakPolarHBondContact CZ-OG 3.24Å; F101-S105 WeakPolarHBondContact O-CB 3.44Å; F101-S105 PolarHBondContact O-N 3.27Å; F101-S105 PolarHBondContact O-OG 3.43Å; F101-L116 HydrophobicContact CD1-CD1 3.85Å; F101-L116 HydrophobicContact CE1-CD1 3.72Å
102	L	92	Very high	87	Confident	36 Å²	36	75.7 Å²	75.7	19%	0.188	42%	0.424	C	S	.	.	H	α-helix	trans	-61.1	-40.8	177.2	-73.8	170.6	0	0	0	112.3	I98 F99 T100 L104 S105 A113 L116 L117	I98-L102 HydrophobicContact CG2-CD1 4.02Å; I98-L102 WeakPolarHBondContact O-CG 3.48Å; I98-L102 PolarHBondContact O-N 3.35Å; F99-L102 HydrophobicContact CD1-CD1 4.32Å; F99-L102 PolarHBondContact O-N 2.94Å; T100-L102 PolarHBondContact O-N 3.02Å; L102-L104 PolarHBondContact O-N 3.47Å; L102-S105 PolarHBondContact O-N 3.35Å; L102-A113 HydrophobicContact CD2-CB 4Å; L102-L116 HydrophobicContact CD1-CB 4.33Å; L102-L116 HydrophobicContact CD2-CB 4.03Å; L102-L116 HydrophobicContact CD2-CD1 4.45Å; L102-L116 HydrophobicContact CG-CB 4.38Å; L102-L117 HydrophobicContact CD1-CB 4.06Å; L102-L117 HydrophobicContact CD1-CD1 4.11Å
103	K	90	Very high	86.6	Confident	177 Å²	177	75.5 Å²	75.5	77%	0.77	42%	0.422	S	S	*	.	H	α-helix	trans	-65.9	-36.4	178.4	-170.8	175.5	-178.2	177	0	112.8	F99 T100 F101	F99-K103 WeakPolarHBondContact O-CB 3.25Å; F99-K103 PolarHBondContact O-N 3.38Å; T100-K103 PolarHBondContact O-N 3.31Å; F101-K103 VanDerWaalsContact C-N 3.34Å; F101-K103 PolarHBondContact O-N 2.94Å
104	L	89.2	Confident	86.2	Confident	134 Å²	134	74.2 Å²	74.2	70%	0.702	42%	0.42	S	S	*	.	H	α-helix	trans	-82.4	-23.6	179.9	-66.1	172.2	0	0	0	113	T100 F101 L102 T106	T100-L104 HydrophobicContact CG2-CD1 3.96Å; T100-L104 WeakPolarHBondContact O-CG 3.44Å; T100-L104 PolarHBondContact O-N 3.14Å; T100-L104 VanDerWaalsContact O-N 3.09Å; F101-L104 PolarHBondContact O-N 3.25Å; L102-L104 PolarHBondContact O-N 3.47Å; L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 3Å; L104-T106 VanDerWaalsContact O-N 3.12Å
105	S	82.6	Confident	85.8	Confident	32 Å²	32	77.2 Å²	77.2	22%	0.224	43%	0.434	C	S	.	.			trans	-89.3	55.9	-174.3	-58.6	0	0	0	0	112.6	F101 L102 G107 S108	F101-S105 WeakPolarHBondContact CZ-OG 3.24Å; F101-S105 WeakPolarHBondContact O-CB 3.44Å; F101-S105 PolarHBondContact O-N 3.27Å; F101-S105 PolarHBondContact O-OG 3.43Å; L102-S105 PolarHBondContact O-N 3.35Å; S105-G107 VanDerWaalsContact C-N 3.32Å; S105-G107 PolarHBondContact O-N 3.01Å; S105-S108 PolarHBondContact O-N 3.35Å
106	T	66	Low	85.5	Confident	136 Å²	136	76.9 Å²	76.9	83%	0.834	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	84.3	175	55.4	0	0	0	0	110.2	L104	L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 3Å; L104-T106 VanDerWaalsContact O-N 3.12Å
107	G	66.1	Low	85.4	Confident	82 Å²	82	76.1 Å²	76.1	85%	0.845	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	142.6	2.5	179.9	0	0	0	0	0	115.8	S105	S105-G107 VanDerWaalsContact C-N 3.32Å; S105-G107 PolarHBondContact O-N 3.01Å
108	S	64.9	Low	85.1	Confident	47 Å²	47	76.1 Å²	76.1	33%	0.329	44%	0.437	S	S	.	.	S	Bend	trans	-72.5	162.3	177.8	78.1	0	0	0	0	113.1	S105 E110	S105-S108 PolarHBondContact O-N 3.35Å; S108-E110 PolarHBondContact O-N 3.34Å; S108-E110 VanDerWaalsContact O-N 3.14Å
109	N	80.4	Confident	84.9	Confident	115 Å²	115	76.7 Å²	76.7	62%	0.615	44%	0.44	S	S	*	.			trans	-49.9	116.8	173.2	-177.7	-8.3	0	0	0	110.9	A111 R112 A113	N109-A111 PolarHBondContact O-N 3Å; N109-A111 PolarHBondContact OD1-N 3.5Å; N109-R112 HydrophobicContact CB-CB 4.23Å; N109-R112 WeakPolarHBondContact O-CA 3.29Å; N109-R112 WeakPolarHBondContact O-CB 3.42Å; N109-R112 PolarHBondContact O-N 3.42Å; N109-A113 PolarHBondContact O-N 3.3Å
110	E	83.5	Confident	84.9	Confident	169 Å²	169	74 Å²	74	79%	0.79	43%	0.428	S	S	*	.	H	α-helix	trans	-54.9	-37.7	-174.9	-169.3	175	-171.1	0	0	112.4	S108 R112 A113 A114	S108-E110 PolarHBondContact O-N 3.34Å; S108-E110 VanDerWaalsContact O-N 3.14Å; E110-R112 VanDerWaalsContact C-N 3.35Å; E110-R112 PolarHBondContact O-N 3.34Å; E110-A113 PolarHBondContact O-N 2.97Å; E110-A114 WeakPolarHBondContact O-CB 3.47Å; E110-A114 PolarHBondContact O-N 3.19Å
111	A	84.2	Confident	84.8	Confident	70 Å²	70	74.4 Å²	74.4	58%	0.579	43%	0.428	S	S	*	.	H	α-helix	trans	-64.1	-38.8	176.6	0	0	0	0	0	112.5	N109 H115	N109-A111 PolarHBondContact O-N 3Å; N109-A111 PolarHBondContact OD1-N 3.5Å; A111-H115 PolarHBondContact O-N 3.01Å
112	R	84.3	Confident	84.7	Confident	119 Å²	119	72.9 Å²	72.9	45%	0.449	42%	0.423	S	S	.	.	H	α-helix	trans	-70.2	-42.1	176.4	-174.4	178.5	-176	-175.2	0.3	110.8	N109 E110 A114 H115 L116	N109-R112 HydrophobicContact CB-CB 4.23Å; N109-R112 WeakPolarHBondContact O-CA 3.29Å; N109-R112 WeakPolarHBondContact O-CB 3.42Å; N109-R112 PolarHBondContact O-N 3.42Å; E110-R112 VanDerWaalsContact C-N 3.35Å; E110-R112 PolarHBondContact O-N 3.34Å; R112-A114 VanDerWaalsContact C-N 3.33Å; R112-A114 PolarHBondContact O-N 3.02Å; R112-H115 PolarHBondContact O-N 3.33Å; R112-L116 HydrophobicContact CG-CD1 4.12Å; R112-L116 HydrophobicContact CG-CG 4.42Å; R112-L116 WeakPolarHBondContact O-CB 3.47Å; R112-L116 WeakPolarHBondContact O-CG 3.39Å; R112-L116 PolarHBondContact O-N 3.03Å
113	A	87	Confident	84.8	Confident	27 Å²	27	71.3 Å²	71.3	22%	0.223	41%	0.414	C	S	.	.	H	α-helix	trans	-60.7	-43.7	176.7	0	0	0	0	0	111.3	L102 N109 E110 L116 L117	L102-A113 HydrophobicContact CD2-CB 4Å; N109-A113 PolarHBondContact O-N 3.3Å; E110-A113 PolarHBondContact O-N 2.97Å; A113-L116 PolarHBondContact O-N 3.5Å; A113-L117 VanDerWaalsContact O-CB 3.31Å; A113-L117 WeakPolarHBondContact O-CB 3.2Å; A113-L117 PolarHBondContact O-N 2.87Å
114	A	87.7	Confident	85	Confident	54 Å²	54	65.8 Å²	65.8	45%	0.446	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-40.6	175.6	0	0	0	0	0	112.5	E110 R112 L117 A118	E110-A114 WeakPolarHBondContact O-CB 3.47Å; E110-A114 PolarHBondContact O-N 3.19Å; R112-A114 VanDerWaalsContact C-N 3.33Å; R112-A114 PolarHBondContact O-N 3.02Å; A114-L117 PolarHBondContact O-N 3.31Å; A114-A118 PolarHBondContact O-N 3.49Å
115	H	86.9	Confident	85.2	Confident	66 Å²	66	60.9 Å²	60.9	31%	0.306	37%	0.367	S	S	.	.	H	α-helix	trans	-62.1	-50.8	175.3	-177.9	63.7	0	0	0	112	D54 A111 R112 L117 A118 Q119	D54-H115 IonicContact OD2-CD2 2.7Å; D54-H115 PolarHBondContact OD2-CD2 2.73Å; D54-H115 IonicContact OD2-NE2 3.43Å; D54-H115 PolarHBondContact OD2-NE2 3.37Å; A111-H115 PolarHBondContact O-N 3.01Å; R112-H115 PolarHBondContact O-N 3.33Å; H115-L117 VanDerWaalsContact C-N 3.3Å; H115-L117 PolarHBondContact O-N 2.91Å; H115-A118 PolarHBondContact O-N 3.05Å; H115-Q119 WeakPolarHBondContact O-CB 3.35Å; H115-Q119 PolarHBondContact O-N 2.89Å
116	L	89.2	Confident	85.8	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-62.2	-38.2	178.5	-73.4	175.4	0	0	0	111.6	F56 I98 F101 L102 R112 A113 Q119 G120	F56-L116 HydrophobicContact CD2-CD2 3.94Å; F56-L116 HydrophobicContact CE2-CD1 4.45Å; F56-L116 HydrophobicContact CE2-CD2 4.06Å; I98-L116 HydrophobicContact CG2-CB 4.22Å; I98-L116 VanDerWaalsContact CG2-O 3.28Å; I98-L116 WeakPolarHBondContact CG2-O 3.33Å; F101-L116 HydrophobicContact CD1-CD1 3.85Å; F101-L116 HydrophobicContact CE1-CD1 3.72Å; L102-L116 HydrophobicContact CD1-CB 4.33Å; L102-L116 HydrophobicContact CD2-CB 4.03Å; L102-L116 HydrophobicContact CD2-CD1 4.45Å; L102-L116 HydrophobicContact CG-CB 4.38Å; R112-L116 HydrophobicContact CG-CD1 4.12Å; R112-L116 HydrophobicContact CG-CG 4.42Å; R112-L116 WeakPolarHBondContact O-CB 3.47Å; R112-L116 WeakPolarHBondContact O-CG 3.39Å; R112-L116 PolarHBondContact O-N 3.03Å; A113-L116 PolarHBondContact O-N 3.5Å; L116-Q119 PolarHBondContact O-N 3.13Å; L116-G120 PolarHBondContact O-N 3.2Å
117	L	91.5	Very high	87.2	Confident	84 Å²	84	54.1 Å²	54.1	44%	0.44	32%	0.323	S	S	.	.	H	α-helix	trans	-62.3	-45.9	175.5	-176.1	69.2	0	0	0	111.3	F99 L102 A113 A114 H115 Q119 G120 N121	F99-L117 HydrophobicContact CD1-CD1 4.47Å; F99-L117 HydrophobicContact CE1-CD1 4.06Å; L102-L117 HydrophobicContact CD1-CB 4.06Å; L102-L117 HydrophobicContact CD1-CD1 4.11Å; A113-L117 VanDerWaalsContact O-CB 3.31Å; A113-L117 WeakPolarHBondContact O-CB 3.2Å; A113-L117 PolarHBondContact O-N 2.87Å; A114-L117 PolarHBondContact O-N 3.31Å; H115-L117 VanDerWaalsContact C-N 3.3Å; H115-L117 PolarHBondContact O-N 2.91Å; L117-Q119 VanDerWaalsContact C-N 3.31Å; L117-Q119 PolarHBondContact O-N 3.2Å; L117-G120 PolarHBondContact O-N 3.19Å; L117-N121 WeakPolarHBondContact O-CB 3.25Å; L117-N121 PolarHBondContact O-N 2.97Å; L117-N121 PolarHBondContact O-ND2 3.26Å
118	A	89.4	Confident	88.6	Confident	60 Å²	60	50.8 Å²	50.8	50%	0.496	29%	0.285	S	S	.	.	H	α-helix	trans	-62.3	-39.4	176.4	0	0	0	0	0	111.9	A114 H115 L122	A114-A118 PolarHBondContact O-N 3.49Å; H115-A118 PolarHBondContact O-N 3.05Å; A118-L122 PolarHBondContact O-N 3.28Å
119	Q	89	Confident	90.1	Very high	12 Å²	12	48.5 Å²	48.5	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-67.9	-44.1	177.1	-171.6	175.5	49.5	0	0	112.3	I51 D54 M57 I98 H115 L116 L117 N121 L122 I123	I51-Q119 PolarHBondContact O-NE2 2.95Å; D54-Q119 PolarHBondContact OD2-OE1 3.43Å; M57-Q119 HydrophobicContact CG-CG 4.46Å; M57-Q119 HydrophobicContact SD-CG 4.29Å; I98-Q119 HydrophobicContact CD1-CG 4.42Å; H115-Q119 WeakPolarHBondContact O-CB 3.35Å; H115-Q119 PolarHBondContact O-N 2.89Å; L116-Q119 PolarHBondContact O-N 3.13Å; L117-Q119 VanDerWaalsContact C-N 3.31Å; L117-Q119 PolarHBondContact O-N 3.2Å; Q119-N121 VanDerWaalsContact C-N 3.34Å; Q119-N121 PolarHBondContact O-N 3.05Å; Q119-L122 WeakPolarHBondContact O-CB 3.43Å; Q119-L122 PolarHBondContact O-N 3.43Å; Q119-I123 HydrophobicContact CG-CD1 4.07Å; Q119-I123 WeakPolarHBondContact O-CD1 3.37Å; Q119-I123 WeakPolarHBondContact O-CG1 3.34Å; Q119-I123 PolarHBondContact O-N 3.07Å
120	G	92.4	Very high	90.9	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59	-44.5	174.8	0	0	0	0	0	112	L116 L117 L122 I123 Q124	L116-G120 PolarHBondContact O-N 3.2Å; L117-G120 PolarHBondContact O-N 3.19Å; G120-L122 VanDerWaalsContact C-N 3.35Å; G120-L122 PolarHBondContact O-N 2.79Å; G120-I123 PolarHBondContact O-N 3.34Å; G120-Q124 WeakPolarHBondContact O-CB 3.06Å; G120-Q124 PolarHBondContact O-N 3.34Å
121	N	91.7	Very high	91.5	Very high	74 Å²	74	35.5 Å²	35.5	40%	0.396	21%	0.205	S	C	.	.	H	α-helix	trans	-63.8	-37.8	175.8	-69	-17.4	0	0	0	112.7	L117 Q119 T125	L117-N121 WeakPolarHBondContact O-CB 3.25Å; L117-N121 PolarHBondContact O-N 2.97Å; L117-N121 PolarHBondContact O-ND2 3.26Å; Q119-N121 VanDerWaalsContact C-N 3.34Å; Q119-N121 PolarHBondContact O-N 3.05Å; N121-T125 PolarHBondContact O-N 3.37Å; N121-T125 PolarHBondContact O-OG1 3.04Å
122	L	91.3	Very high	92.1	Very high	35 Å²	35	32.2 Å²	32.2	18%	0.183	18%	0.178	C	C	.	.	H	α-helix	trans	-63.2	-48.8	174.2	177	62.7	0	0	0	110.7	A118 Q119 G120 Q124 T125 L126 F362	A118-L122 PolarHBondContact O-N 3.28Å; Q119-L122 WeakPolarHBondContact O-CB 3.43Å; Q119-L122 PolarHBondContact O-N 3.43Å; G120-L122 VanDerWaalsContact C-N 3.35Å; G120-L122 PolarHBondContact O-N 2.79Å; L122-Q124 VanDerWaalsContact C-N 3.33Å; L122-Q124 PolarHBondContact O-N 2.98Å; L122-T125 WeakPolarHBondContact O-CB 3.12Å; L122-T125 PolarHBondContact O-N 3.48Å; L122-T125 VanDerWaalsContact O-N 3.13Å; L122-L126 HydrophobicContact CG-CD1 4.41Å; L122-L126 WeakPolarHBondContact O-CG 3.39Å; L122-L126 PolarHBondContact O-N 2.91Å; L122-F362 HydrophobicContact CD1-CE1 4.31Å; L122-F362 HydrophobicContact CD1-CE2 3.7Å; L122-F362 HydrophobicContact CD1-CZ 3.44Å; L122-F362 VanDerWaalsContact CD1-CZ 3.44Å
123	I	93.5	Very high	92.7	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.015	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-42.4	180	-65.7	157.6	0	0	0	110.9	M57 L91 C94 I98 Q119 G120 T125 L126 E127	M57-I123 HydrophobicContact SD-CD1 3.72Å; M57-I123 HydrophobicContact SD-CG1 4.27Å; L91-I123 HydrophobicContact CB-CG2 4.27Å; L91-I123 HydrophobicContact CD2-CG2 3.89Å; L91-I123 WeakPolarHBondContact O-CG2 3.5Å; C94-I123 HydrophobicContact CB-CG2 4.31Å; I98-I123 HydrophobicContact CD1-CD1 3.4Å; I98-I123 VanDerWaalsContact CD1-CD1 3.4Å; Q119-I123 HydrophobicContact CG-CD1 4.07Å; Q119-I123 WeakPolarHBondContact O-CD1 3.37Å; Q119-I123 WeakPolarHBondContact O-CG1 3.34Å; Q119-I123 PolarHBondContact O-N 3.07Å; G120-I123 PolarHBondContact O-N 3.34Å; I123-T125 VanDerWaalsContact C-N 3.3Å; I123-T125 PolarHBondContact O-N 3.35Å; I123-L126 WeakPolarHBondContact O-CB 3.4Å; I123-L126 PolarHBondContact O-N 2.94Å; I123-L126 VanDerWaalsContact O-N 3.15Å; I123-E127 PolarHBondContact O-N 2.6Å
124	Q	93.4	Very high	93	Very high	61 Å²	61	25.3 Å²	25.3	29%	0.285	15%	0.146	S	C	.	.	H	α-helix	trans	-63	-37.8	176.1	-168.4	177.7	14	0	0	111.9	G120 L122 E127 L128	G120-Q124 WeakPolarHBondContact O-CB 3.06Å; G120-Q124 PolarHBondContact O-N 3.34Å; L122-Q124 VanDerWaalsContact C-N 3.33Å; L122-Q124 PolarHBondContact O-N 2.98Å; Q124-E127 PolarHBondContact O-N 3.43Å; Q124-L128 WeakPolarHBondContact O-CB 3.49Å; Q124-L128 PolarHBondContact O-N 3.16Å
125	T	93.7	Very high	93.3	Very high	32 Å²	32	23 Å²	23	20%	0.196	13%	0.126	C	C	.	.	H	α-helix	trans	-63.6	-41.8	172.4	-57.1	0	0	0	0	111.8	N121 L122 I123 E127 L128 L129 F362 V366	N121-T125 PolarHBondContact O-N 3.37Å; N121-T125 PolarHBondContact O-OG1 3.04Å; L122-T125 WeakPolarHBondContact O-CB 3.12Å; L122-T125 PolarHBondContact O-N 3.48Å; L122-T125 VanDerWaalsContact O-N 3.13Å; I123-T125 VanDerWaalsContact C-N 3.3Å; I123-T125 PolarHBondContact O-N 3.35Å; T125-E127 VanDerWaalsContact C-N 3.34Å; T125-L128 WeakPolarHBondContact O-CB 3.31Å; T125-L128 PolarHBondContact O-N 3.49Å; T125-L129 HydrophobicContact CG2-CD1 4.12Å; T125-L129 WeakPolarHBondContact O-CG 3.45Å; T125-L129 PolarHBondContact O-N 3.14Å; T125-F362 HydrophobicContact CG2-CE1 3.87Å; T125-F362 HydrophobicContact CG2-CZ 3.8Å; T125-V366 HydrophobicContact CG2-CG1 4.15Å; T125-V366 HydrophobicContact CG2-CG2 3.53Å
126	L	95	Very high	93.7	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-64.6	-39.3	176.1	-63.7	175.2	0	0	0	111.6	L91 L122 I123 L129 W130 L389 N391 F394	L91-L126 HydrophobicContact CD1-CB 4.41Å; L91-L126 HydrophobicContact CD2-CB 4.31Å; L122-L126 HydrophobicContact CG-CD1 4.41Å; L122-L126 WeakPolarHBondContact O-CG 3.39Å; L122-L126 PolarHBondContact O-N 2.91Å; I123-L126 WeakPolarHBondContact O-CB 3.4Å; I123-L126 PolarHBondContact O-N 2.94Å; I123-L126 VanDerWaalsContact O-N 3.15Å; L126-L129 PolarHBondContact O-N 3.14Å; L126-W130 VanDerWaalsContact O-CB 3.25Å; L126-W130 WeakPolarHBondContact O-CB 3.46Å; L126-W130 PolarHBondContact O-N 2.76Å; L126-L389 HydrophobicContact CD2-CD1 4.05Å; L126-L389 HydrophobicContact CD2-CD2 4.12Å; L126-N391 VanDerWaalsContact CD1-ND2 3.25Å; L126-N391 WeakPolarHBondContact CD1-ND2 3.16Å; L126-F394 HydrophobicContact CB-CD2 4.1Å; L126-F394 HydrophobicContact CD2-CB 4.06Å; L126-F394 HydrophobicContact CD2-CD2 3.78Å; L126-F394 HydrophobicContact CD2-CG 4.09Å; L126-F394 HydrophobicContact CG-CD2 4.45Å; L126-F394 WeakPolarHBondContact O-CE2 3.32Å
127	E	95.7	Very high	93.8	Very high	22 Å²	22	20.9 Å²	20.9	10%	0.103	12%	0.116	C	C	.	.	H	α-helix	trans	-61.5	-44.3	174.4	-169.8	-166.6	156.3	0	0	111.6	R88 L91 A92 I123 Q124 T125 W130 H131	R88-E127 HydrophobicContact CG-CG 4.11Å; L91-E127 HydrophobicContact CB-CB 3.96Å; L91-E127 HydrophobicContact CB-CG 4.15Å; L91-E127 HydrophobicContact CD1-CB 4.28Å; A92-E127 WeakPolarHBondContact CA-OE2 3.49Å; A92-E127 WeakPolarHBondContact CB-OE1 3.48Å; I123-E127 PolarHBondContact O-N 2.6Å; Q124-E127 PolarHBondContact O-N 3.43Å; T125-E127 VanDerWaalsContact C-N 3.34Å; E127-W130 PolarHBondContact O-N 3.15Å; E127-H131 VanDerWaalsContact O-CB 3.31Å; E127-H131 WeakPolarHBondContact O-CB 3.33Å; E127-H131 PolarHBondContact O-N 3.42Å
128	L	95.8	Very high	93.7	Very high	11 Å²	11	17.2 Å²	17.2	6%	0.058	10%	0.097	C	C	.	.	H	α-helix	trans	-58.8	-50.2	177.3	-179.9	150.6	0	0	0	111.4	Q124 T125 L132 W153 Q157 F321 F322 I370	Q124-L128 WeakPolarHBondContact O-CB 3.49Å; Q124-L128 PolarHBondContact O-N 3.16Å; T125-L128 WeakPolarHBondContact O-CB 3.31Å; T125-L128 PolarHBondContact O-N 3.49Å; L128-L132 PolarHBondContact O-N 3.35Å; L128-W153 HydrophobicContact CD1-CZ2 4.36Å; L128-W153 HydrophobicContact CD2-CH2 4.45Å; L128-W153 HydrophobicContact CD2-CZ2 3.77Å; L128-W153 HydrophobicContact CG-CZ2 3.7Å; L128-W153 PolarHBondContact O-NE1 3.4Å; L128-Q157 HydrophobicContact CD1-CB 4.42Å; L128-Q157 HydrophobicContact CD1-CG 4.49Å; L128-Q157 HydrophobicContact CG-CG 4.31Å; L128-F321 HydrophobicContact CD1-CE2 3.89Å; L128-F321 HydrophobicContact CD1-CZ 4.09Å; L128-F321 HydrophobicContact CD2-CE2 4.43Å; L128-F321 HydrophobicContact CD2-CZ 4.49Å; L128-F322 HydrophobicContact CD1-CE1 4.45Å; L128-F322 HydrophobicContact CD1-CZ 3.86Å; L128-I370 HydrophobicContact CD2-CD1 3.85Å
129	L	96.3	Very high	93.6	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.1	-44.3	178.1	-71.3	170.9	0	0	0	111.7	T125 L126 L132 A133 V366 L369 I370 I373 L389 F394	T125-L129 HydrophobicContact CG2-CD1 4.12Å; T125-L129 WeakPolarHBondContact O-CG 3.45Å; T125-L129 PolarHBondContact O-N 3.14Å; L126-L129 PolarHBondContact O-N 3.14Å; L129-L132 PolarHBondContact O-N 3.11Å; L129-A133 VanDerWaalsContact O-CB 3.23Å; L129-A133 WeakPolarHBondContact O-CB 3.45Å; L129-A133 PolarHBondContact O-N 2.6Å; L129-V366 HydrophobicContact CD2-CG1 4.4Å; L129-L369 HydrophobicContact CD1-CD1 3.79Å; L129-L369 HydrophobicContact CD2-CB 3.85Å; L129-L369 HydrophobicContact CD2-CD1 4.49Å; L129-I370 HydrophobicContact CD2-CD1 4.34Å; L129-I370 HydrophobicContact CD2-CG1 3.65Å; L129-I373 HydrophobicContact CD2-CD1 4.32Å; L129-L389 HydrophobicContact CD1-CD2 4.49Å; L129-F394 HydrophobicContact CB-CE2 4.06Å; L129-F394 HydrophobicContact CB-CZ 4.03Å
130	W	97	Very high	92.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-48	178.9	-168.6	-70.7	0	0	0	110.9	S84 Y87 L91 L126 E127 L132 A133 E134 W393 F394 H397 F398 L401	S84-W130 PolarHBondContact O-NE1 3.07Å; S84-W130 PolarHBondContact OG-NE1 3.14Å; Y87-W130 VanDerWaalsContact CB-CZ2 3.5Å; Y87-W130 HydrophobicContact CD1-CH2 4.48Å; Y87-W130 AromaticContact CD2-CH2 3.98Å; Y87-W130 HydrophobicContact CD2-CH2 3.98Å; Y87-W130 AromaticContact CD2-CZ2 3.58Å; Y87-W130 HydrophobicContact CD2-CZ2 3.58Å; Y87-W130 HydrophobicContact CE2-CZ2 4.46Å; Y87-W130 AromaticContact CG-CH2 3.93Å; Y87-W130 HydrophobicContact CG-CH2 3.93Å; Y87-W130 AromaticContact CG-CZ2 3.69Å; Y87-W130 HydrophobicContact CG-CZ2 3.69Å; L91-W130 HydrophobicContact CD1-CB 4.24Å; L126-W130 VanDerWaalsContact O-CB 3.25Å; L126-W130 WeakPolarHBondContact O-CB 3.46Å; L126-W130 PolarHBondContact O-N 2.76Å; E127-W130 PolarHBondContact O-N 3.15Å; W130-L132 VanDerWaalsContact C-N 3.34Å; W130-L132 PolarHBondContact O-N 2.8Å; W130-A133 PolarHBondContact O-N 3.07Å; W130-E134 VanDerWaalsContact O-CB 3.25Å; W130-E134 WeakPolarHBondContact O-CB 3.22Å; W130-E134 PolarHBondContact O-N 3.49Å; W130-W393 HydrophobicContact CE3-CH2 4.35Å; W130-W393 HydrophobicContact CE3-CZ3 4.11Å; W130-W393 HydrophobicContact CZ3-CH2 4.22Å; W130-W393 HydrophobicContact CZ3-CZ3 4.08Å; W130-F394 HydrophobicContact CB-CE2 3.89Å; W130-F394 HydrophobicContact CD2-CE2 4.45Å; W130-F394 AromaticContact CE3-CD2 3.86Å; W130-F394 HydrophobicContact CE3-CD2 3.86Å; W130-F394 AromaticContact CE3-CE2 3.74Å; W130-F394 HydrophobicContact CE3-CE2 3.74Å; W130-F394 HydrophobicContact CE3-CZ 4.34Å; W130-F394 HydrophobicContact CZ3-CD2 4.48Å; W130-H397 HydrophobicContact CH2-CB 3.7Å; W130-H397 HydrophobicContact CZ3-CB 4.02Å; W130-F398 AromaticContact CD2-CD2 3.88Å; W130-F398 HydrophobicContact CD2-CD2 3.88Å; W130-F398 HydrophobicContact CD2-CE2 4.44Å; W130-F398 AromaticContact CE2-CD2 3.85Å; W130-F398 HydrophobicContact CE3-CB 4.37Å; W130-F398 AromaticContact CE3-CD2 3.9Å; W130-F398 HydrophobicContact CE3-CD2 3.9Å; W130-F398 HydrophobicContact CH2-CB 3.93Å; W130-F398 AromaticContact CH2-CD2 3.94Å; W130-F398 HydrophobicContact CH2-CD2 3.94Å; W130-F398 HydrophobicContact CH2-CG 4.45Å; W130-F398 AromaticContact CZ2-CD2 3.89Å; W130-F398 HydrophobicContact CZ2-CD2 3.89Å; W130-F398 HydrophobicContact CZ3-CB 3.75Å; W130-F398 AromaticContact CZ3-CD2 3.94Å; W130-F398 HydrophobicContact CZ3-CD2 3.94Å; W130-F398 HydrophobicContact CZ3-CG 4.37Å; W130-L401 HydrophobicContact CZ2-CD2 4.05Å
131	H	96.2	Very high	92.1	Very high	11 Å²	11	23 Å²	23	5%	0.051	12%	0.124	C	C	.	.	H	α-helix	trans	-63.9	-41.1	-179	-167.6	-172.9	0	0	0	111.2	R88 E127 E134 L135 W153 Q157	R88-H131 VanDerWaalsContact CD-CB 3.41Å; R88-H131 VanDerWaalsContact CD-CG 3.41Å; R88-H131 PolarHBondContact NH1-CD2 3.5Å; R88-H131 PolarHBondContact NH1-CE1 3.32Å; R88-H131 PolarHBondContact NH1-ND1 3.46Å; R88-H131 PolarHBondContact NH1-NE2 3.15Å; E127-H131 VanDerWaalsContact O-CB 3.31Å; E127-H131 WeakPolarHBondContact O-CB 3.33Å; E127-H131 PolarHBondContact O-N 3.42Å; H131-E134 PolarHBondContact O-N 3.26Å; H131-L135 WeakPolarHBondContact O-CG 3.46Å; H131-L135 PolarHBondContact O-N 3.36Å; H131-L135 VanDerWaalsContact O-N 3.08Å; H131-W153 AromaticContact CD2-CD1 3.87Å; H131-W153 AromaticContact CE1-CD1 3.7Å; H131-W153 AromaticContact CG-CD1 3.37Å; H131-W153 AromaticContact ND1-CD1 3.31Å; H131-W153 VanDerWaalsContact ND1-CD1 3.31Å; H131-Q157 PolarHBondContact ND1-NE2 3.41Å; H131-Q157 VanDerWaalsContact ND1-NE2 3.13Å
132	L	97	Very high	91.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.7	-45.5	177.6	-173.5	61.8	0	0	0	111.4	L128 L129 W130 E134 L135 I136 L150 W153 I370 I373 F374	L128-L132 PolarHBondContact O-N 3.35Å; L129-L132 PolarHBondContact O-N 3.11Å; W130-L132 VanDerWaalsContact C-N 3.34Å; W130-L132 PolarHBondContact O-N 2.8Å; L132-E134 VanDerWaalsContact C-N 3.31Å; L132-E134 PolarHBondContact O-N 2.91Å; L132-L135 PolarHBondContact O-N 3.3Å; L132-I136 PolarHBondContact O-N 2.83Å; L132-I136 VanDerWaalsContact O-N 3.11Å; L132-L150 HydrophobicContact CD1-CD2 3.75Å; L132-W153 HydrophobicContact CB-CZ2 3.91Å; L132-W153 HydrophobicContact CD1-CD2 4.27Å; L132-W153 HydrophobicContact CD1-CE3 4.47Å; L132-W153 HydrophobicContact CD1-CH2 4.38Å; L132-W153 HydrophobicContact CD1-CZ2 4.19Å; L132-W153 HydrophobicContact CD2-CH2 4.22Å; L132-W153 HydrophobicContact CD2-CZ2 4.07Å; L132-W153 HydrophobicContact CG-CZ2 4.27Å; L132-I370 HydrophobicContact CD2-CB 4.47Å; L132-I370 HydrophobicContact CD2-CG1 4.26Å; L132-I370 HydrophobicContact CD2-CG2 3.92Å; L132-I373 HydrophobicContact CB-CD1 4.38Å; L132-I373 HydrophobicContact CD2-CB 4.35Å; L132-I373 HydrophobicContact CD2-CD1 4.13Å; L132-I373 HydrophobicContact CD2-CG2 4.16Å; L132-I373 HydrophobicContact CG-CD1 4.33Å; L132-I373 HydrophobicContact CG-CG2 3.81Å; L132-F374 HydrophobicContact CD1-CE1 3.82Å; L132-F374 HydrophobicContact CD1-CZ 3.97Å; L132-F374 HydrophobicContact CD2-CE1 4.29Å; L132-F374 HydrophobicContact CD2-CE2 4.16Å; L132-F374 HydrophobicContact CD2-CZ 3.92Å
133	A	96	Very high	90.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-35	177.7	0	0	0	0	0	112	L129 W130 I136 F137 I373 F381 F398	L129-A133 VanDerWaalsContact O-CB 3.23Å; L129-A133 WeakPolarHBondContact O-CB 3.45Å; L129-A133 PolarHBondContact O-N 2.6Å; W130-A133 PolarHBondContact O-N 3.07Å; A133-I136 PolarHBondContact O-N 3.31Å; A133-F137 HydrophobicContact CB-CD2 3.94Å; A133-F137 HydrophobicContact CB-CE2 4.27Å; A133-F137 WeakPolarHBondContact O-CB 3.43Å; A133-F137 PolarHBondContact O-N 3.41Å; A133-I373 HydrophobicContact CB-CD1 4.01Å; A133-I373 HydrophobicContact CB-CG1 4.31Å; A133-F381 HydrophobicContact CB-CE1 4.41Å; A133-F381 HydrophobicContact CB-CE2 4.39Å; A133-F381 HydrophobicContact CB-CZ 3.89Å; A133-F398 HydrophobicContact CB-CE1 4.2Å; A133-F398 HydrophobicContact CB-CE2 3.79Å; A133-F398 HydrophobicContact CB-CZ 3.43Å; A133-F398 VanDerWaalsContact CB-CZ 3.43Å
134	E	94.7	Very high	89.1	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	14%	0.138	C	C	.	.	I	π-helix	trans	-59.7	-47.9	171.2	175.4	-176	115.3	0	0	111	S84 I85 R88 W130 H131 L132 I136 I138 Q139	S84-E134 VanDerWaalsContact C-OE2 3.29Å; S84-E134 WeakPolarHBondContact CB-OE2 3.14Å; S84-E134 VanDerWaalsContact OG-CD 3.31Å; S84-E134 WeakPolarHBondContact OG-CG 3.35Å; S84-E134 PolarHBondContact OG-OE2 2.93Å; I85-E134 PolarHBondContact N-OE2 3.02Å; R88-E134 IonicContact CZ-OE1 2.93Å; R88-E134 IonicContact NE-OE1 3.49Å; R88-E134 IonicContact NE-OE2 3.44Å; R88-E134 IonicContact NH2-OE1 3.98Å; R88-E134 PolarHBondContact NH2-OE1 3.21Å; W130-E134 VanDerWaalsContact O-CB 3.25Å; W130-E134 WeakPolarHBondContact O-CB 3.22Å; W130-E134 PolarHBondContact O-N 3.49Å; H131-E134 PolarHBondContact O-N 3.26Å; L132-E134 VanDerWaalsContact C-N 3.31Å; L132-E134 PolarHBondContact O-N 2.91Å; E134-I136 VanDerWaalsContact C-N 3.33Å; E134-I136 PolarHBondContact O-N 3Å; E134-I138 CarbonylContact O-C 3.54Å; E134-I138 WeakPolarHBondContact O-CA 3.2Å; E134-I138 WeakPolarHBondContact O-CB 3.34Å; E134-I138 PolarHBondContact O-N 3.13Å; E134-I138 VanDerWaalsContact O-N 3.11Å; E134-Q139 PolarHBondContact O-N 2.91Å
135	L	93.6	Very high	88.7	Confident	6 Å²	6	22 Å²	22	3%	0.031	13%	0.127	C	C	.	.	I	π-helix	trans	-63.2	-37.3	-179.5	-73.4	-177.7	0	0	0	113.3	H131 L132 Q139 N149 L150 W153	H131-L135 WeakPolarHBondContact O-CG 3.46Å; H131-L135 PolarHBondContact O-N 3.36Å; H131-L135 VanDerWaalsContact O-N 3.08Å; L132-L135 PolarHBondContact O-N 3.3Å; L135-Q139 VanDerWaalsContact CD2-OE1 3.25Å; L135-N149 HydrophobicContact CD2-CB 4.27Å; L135-L150 HydrophobicContact CD1-CD2 4.42Å; L135-W153 HydrophobicContact CD1-CB 3.55Å; L135-W153 HydrophobicContact CD1-CG 4.15Å
136	I	94.2	Very high	88.5	Confident	6 Å²	6	20.6 Å²	20.6	3%	0.031	12%	0.118	C	C	.	.	I	π-helix	trans	-90.9	-46.1	-174.6	-59.2	-54.9	0	0	0	112.7	L132 A133 E134 L146 L150 L340 I373 V376	L132-I136 PolarHBondContact O-N 2.83Å; L132-I136 VanDerWaalsContact O-N 3.11Å; A133-I136 PolarHBondContact O-N 3.31Å; E134-I136 VanDerWaalsContact C-N 3.33Å; E134-I136 PolarHBondContact O-N 3Å; I136-L146 HydrophobicContact CD1-CD1 3.85Å; I136-L150 HydrophobicContact CD1-CD2 4.27Å; I136-L340 HydrophobicContact CD1-CD2 3.66Å; I136-I373 HydrophobicContact CB-CG2 3.8Å; I136-I373 HydrophobicContact CG1-CG2 3.68Å; I136-I373 HydrophobicContact CG2-CG2 4.26Å; I136-I373 WeakPolarHBondContact CG2-O 3.48Å; I136-V376 HydrophobicContact CG2-CG1 4.18Å; I136-V376 HydrophobicContact CG2-CG2 4.12Å
137	F	92	Very high	88.3	Confident	17 Å²	17	20.4 Å²	20.4	8%	0.075	12%	0.117	C	C	.	.	I	π-helix	trans	-91.7	-29.5	-173.5	-59.5	-46.5	0	0	0	113.6	A133 I373 V376 L378 F381 F398 L402 Y406	A133-F137 HydrophobicContact CB-CD2 3.94Å; A133-F137 HydrophobicContact CB-CE2 4.27Å; A133-F137 WeakPolarHBondContact O-CB 3.43Å; A133-F137 PolarHBondContact O-N 3.41Å; F137-I373 HydrophobicContact CE2-CB 4.46Å; F137-I373 HydrophobicContact CE2-CG1 3.93Å; F137-I373 HydrophobicContact CE2-CG2 4.37Å; F137-I373 HydrophobicContact CZ-CB 4.44Å; F137-I373 HydrophobicContact CZ-CG1 4.3Å; F137-I373 HydrophobicContact CZ-CG2 4.46Å; F137-V376 HydrophobicContact CD1-CG1 4.46Å; F137-V376 HydrophobicContact CE1-CG1 4.27Å; F137-L378 HydrophobicContact CD1-CB 4.47Å; F137-L378 HydrophobicContact CD2-CD1 4.03Å; F137-L378 HydrophobicContact CE1-CB 4.11Å; F137-L378 HydrophobicContact CE2-CD1 4.06Å; F137-L378 HydrophobicContact CG-CD1 4.26Å; F137-L378 HydrophobicContact CZ-CB 4.33Å; F137-L378 HydrophobicContact CZ-CD1 4.32Å; F137-F381 HydrophobicContact CD2-CD1 4.46Å; F137-F381 HydrophobicContact CE2-CB 4.18Å; F137-F381 AromaticContact CE2-CD1 3.75Å; F137-F381 HydrophobicContact CE2-CD1 3.75Å; F137-F381 HydrophobicContact CE2-CD2 4.43Å; F137-F381 HydrophobicContact CE2-CE1 4.19Å; F137-F381 AromaticContact CE2-CG 3.86Å; F137-F381 HydrophobicContact CE2-CG 3.86Å; F137-F381 HydrophobicContact CZ-CB 4.22Å; F137-F381 HydrophobicContact CZ-CG 4.38Å; F137-F398 HydrophobicContact CD2-CE1 4.21Å; F137-F398 HydrophobicContact CD2-CZ 4.22Å; F137-L402 HydrophobicContact CB-CD2 4.41Å; F137-Y406 VanDerWaalsContact O-CE2 3.29Å; F137-Y406 WeakPolarHBondContact O-CE2 3.4Å; F137-Y406 PolarHBondContact O-OH 2.75Å
138	I	90.1	Very high	88	Confident	7 Å²	7	22 Å²	22	4%	0.036	12%	0.124	C	C	.	.	I	π-helix	trans	-106	-45	-170.5	-61.7	176.7	0	0	0	111.4	I81 E134 V140 F398 L401 L402 I405	I81-I138 HydrophobicContact CG1-CG2 4.08Å; E134-I138 CarbonylContact O-C 3.54Å; E134-I138 WeakPolarHBondContact O-CA 3.2Å; E134-I138 WeakPolarHBondContact O-CB 3.34Å; E134-I138 PolarHBondContact O-N 3.13Å; E134-I138 VanDerWaalsContact O-N 3.11Å; I138-V140 PolarHBondContact O-N 3.49Å; I138-F398 HydrophobicContact CD1-CE2 3.97Å; I138-F398 HydrophobicContact CD1-CZ 4.07Å; I138-L401 HydrophobicContact CD1-CD2 3.72Å; I138-L401 HydrophobicContact CD1-CG 4.24Å; I138-L402 HydrophobicContact CG1-CD2 4.09Å; I138-I405 HydrophobicContact CB-CD1 4.25Å; I138-I405 HydrophobicContact CD1-CD1 3.95Å; I138-I405 HydrophobicContact CG1-CD1 3.81Å; I138-I405 HydrophobicContact CG2-CD1 3.63Å
139	Q	86.4	Confident	87.8	Confident	58 Å²	58	22.6 Å²	22.6	27%	0.271	13%	0.127	S	C	.	.			trans	-87	114.9	-174.5	-171	171	-6.7	0	0	111.5	E134 L135 S141	E134-Q139 PolarHBondContact O-N 2.91Å; L135-Q139 VanDerWaalsContact CD2-OE1 3.25Å; Q139-S141 PolarHBondContact O-N 3.36Å; Q139-S141 VanDerWaalsContact O-N 3.08Å
140	V	74	Confident	87.7	Confident	120 Å²	120	22.6 Å²	22.6	73%	0.727	13%	0.127	S	C	*	.			trans	-75.5	100	170.2	-175.3	0	0	0	0	108.6	I138	I138-V140 PolarHBondContact O-N 3.49Å
141	S	76.7	Confident	87.5	Confident	16 Å²	16	22.7 Å²	22.7	11%	0.112	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-81.3	130.5	174	-65.4	0	0	0	0	109.8	Q139 N149	Q139-S141 PolarHBondContact O-N 3.36Å; Q139-S141 VanDerWaalsContact O-N 3.08Å; S141-N149 PolarHBondContact OG-ND2 2.74Å
142	P	73.5	Confident	87.3	Confident	54 Å²	54	24.5 Å²	24.5	35%	0.351	14%	0.142	S	C	.	.	P	Polyproline II helix	trans	-61.9	156.1	169.8	-13.4	25.5	0	0	0	110.5	G144 Y145 W251	P142-G144 PolarHBondContact O-N 3.39Å; P142-Y145 HydrophobicContact CB-CD2 3.7Å; P142-Y145 HydrophobicContact CB-CE2 3.93Å; P142-Y145 HydrophobicContact CG-CD2 3.85Å; P142-Y145 HydrophobicContact CG-CE2 4.01Å; P142-Y145 PolarHBondContact O-N 2.96Å; P142-Y145 VanDerWaalsContact O-N 3.15Å; P142-W251 HydrophobicContact CB-CD2 4.37Å
143	P	67.9	Low	87.2	Confident	84 Å²	84	24.5 Å²	24.5	55%	0.545	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	133.9	179.5	-26.2	34.5	0	0	0	112.2	Y145 W251	P143-Y145 VanDerWaalsContact C-N 3.35Å; P143-W251 WeakPolarHBondContact O-CZ3 3.48Å
144	G	72.7	Confident	87.2	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.01	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-5.4	-179.7	0	0	0	0	0	116.4	P142	P142-G144 PolarHBondContact O-N 3.39Å
145	Y	83.8	Confident	87.2	Confident	11 Å²	11	26.6 Å²	26.6	4%	0.043	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-21	172	-72.4	-84.4	0	0	0	114.3	P142 P143 A147 F148 N149 A242 S243 H244 A245 W251	P142-Y145 HydrophobicContact CB-CD2 3.7Å; P142-Y145 HydrophobicContact CB-CE2 3.93Å; P142-Y145 HydrophobicContact CG-CD2 3.85Å; P142-Y145 HydrophobicContact CG-CE2 4.01Å; P142-Y145 PolarHBondContact O-N 2.96Å; P142-Y145 VanDerWaalsContact O-N 3.15Å; P143-Y145 VanDerWaalsContact C-N 3.35Å; Y145-A147 PolarHBondContact O-N 3.21Å; Y145-F148 PolarHBondContact O-N 3.3Å; Y145-F148 VanDerWaalsContact O-N 3.09Å; Y145-N149 WeakPolarHBondContact O-CB 3.3Å; Y145-N149 VanDerWaalsContact O-CG 3.31Å; Y145-N149 PolarHBondContact O-N 3.17Å; Y145-A242 HydrophobicContact CE1-CB 4.42Å; Y145-S243 PolarHBondContact OH-O 3.23Å; Y145-H244 AromaticContact CE1-ND1 3.83Å; Y145-H244 WeakPolarHBondContact OH-CA 3.42Å; Y145-A245 PolarHBondContact OH-N 3.49Å; Y145-W251 AromaticContact CD2-CH2 3.98Å; Y145-W251 HydrophobicContact CD2-CH2 3.98Å; Y145-W251 HydrophobicContact CD2-CZ2 4.21Å; Y145-W251 HydrophobicContact CD2-CZ3 4.18Å; Y145-W251 HydrophobicContact CE1-CH2 4.32Å; Y145-W251 HydrophobicContact CE2-CD2 4.19Å; Y145-W251 AromaticContact CE2-CE2 3.51Å; Y145-W251 HydrophobicContact CE2-CE3 4.21Å; Y145-W251 AromaticContact CE2-CH2 3.01Å; Y145-W251 HydrophobicContact CE2-CH2 3.01Å; Y145-W251 AromaticContact CE2-CZ2 3.02Å; Y145-W251 HydrophobicContact CE2-CZ2 3.02Å; Y145-W251 AromaticContact CE2-CZ3 3.61Å; Y145-W251 HydrophobicContact CE2-CZ3 3.61Å; Y145-W251 AromaticContact CZ-CH2 3.2Å; Y145-W251 AromaticContact CZ-CZ2 3.3Å; Y145-W251 WeakPolarHBondContact OH-CH2 3.4Å; Y145-W251 WeakPolarHBondContact OH-CZ2 3.4Å
146	L	89.7	Confident	87.1	Confident	3 Å²	3	29 Å²	29	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-48.9	-173.5	178.9	59	0	0	0	111.3	I136 F148 N149 L150 V335 I337 L340	I136-L146 HydrophobicContact CD1-CD1 3.85Å; L146-F148 VanDerWaalsContact C-N 3.31Å; L146-F148 PolarHBondContact O-N 3.26Å; L146-N149 PolarHBondContact O-N 3Å; L146-L150 HydrophobicContact CD1-CD1 4.25Å; L146-L150 HydrophobicContact CD1-CG 4.2Å; L146-L150 HydrophobicContact CG-CD1 4.13Å; L146-L150 WeakPolarHBondContact O-CB 3.2Å; L146-L150 VanDerWaalsContact O-CG 3.3Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.07Å; L146-V335 HydrophobicContact CB-CG1 4.2Å; L146-V335 HydrophobicContact CD2-CG1 4.31Å; L146-V335 HydrophobicContact CG-CG1 4.3Å; L146-I337 HydrophobicContact CD2-CG1 3.97Å; L146-L340 HydrophobicContact CD2-CD2 4.39Å
147	A	90.3	Very high	87	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-54.9	-45.5	174.7	0	0	0	0	0	112.5	Y145 L150 C151 F329 V335	Y145-A147 PolarHBondContact O-N 3.21Å; A147-L150 PolarHBondContact O-N 3.42Å; A147-C151 PolarHBondContact O-N 2.88Å; A147-F329 HydrophobicContact CB-CD2 4.15Å; A147-V335 HydrophobicContact CB-CG1 3.83Å
148	F	89.5	Confident	86.9	Confident	57 Å²	57	28.5 Å²	28.5	25%	0.25	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-43.6	178.2	-177.8	-94.8	0	0	0	112.3	Y145 L146 L150 C151 S152 F329	Y145-F148 PolarHBondContact O-N 3.3Å; Y145-F148 VanDerWaalsContact O-N 3.09Å; L146-F148 VanDerWaalsContact C-N 3.31Å; L146-F148 PolarHBondContact O-N 3.26Å; F148-L150 VanDerWaalsContact C-N 3.3Å; F148-L150 PolarHBondContact O-N 3.46Å; F148-C151 PolarHBondContact O-N 2.81Å; F148-S152 WeakPolarHBondContact O-CB 3.18Å; F148-S152 PolarHBondContact O-N 3.39Å; F148-F329 HydrophobicContact CB-CE2 4.48Å; F148-F329 HydrophobicContact CD2-CE2 4.29Å
149	N	91.5	Very high	86.9	Confident	22 Å²	22	30.8 Å²	30.8	12%	0.118	17%	0.174	C	C	.	.	H	α-helix	trans	-63.1	-38	177.8	-71.3	-17.4	0	0	0	111.2	L135 S141 Y145 L146 S152 W153	L135-N149 HydrophobicContact CD2-CB 4.27Å; S141-N149 PolarHBondContact OG-ND2 2.74Å; Y145-N149 WeakPolarHBondContact O-CB 3.3Å; Y145-N149 VanDerWaalsContact O-CG 3.31Å; Y145-N149 PolarHBondContact O-N 3.17Å; L146-N149 PolarHBondContact O-N 3Å; N149-S152 WeakPolarHBondContact O-CB 3.46Å; N149-S152 PolarHBondContact O-N 2.88Å; N149-W153 PolarHBondContact O-N 2.65Å
150	L	94.6	Very high	87	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-45.7	173.8	-70.7	173.2	0	0	0	111.8	L132 L135 I136 L146 A147 F148 S152 W153 F154 V325 L340 F374	L132-L150 HydrophobicContact CD1-CD2 3.75Å; L135-L150 HydrophobicContact CD1-CD2 4.42Å; I136-L150 HydrophobicContact CD1-CD2 4.27Å; L146-L150 HydrophobicContact CD1-CD1 4.25Å; L146-L150 HydrophobicContact CD1-CG 4.2Å; L146-L150 HydrophobicContact CG-CD1 4.13Å; L146-L150 WeakPolarHBondContact O-CB 3.2Å; L146-L150 VanDerWaalsContact O-CG 3.3Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.07Å; A147-L150 PolarHBondContact O-N 3.42Å; F148-L150 VanDerWaalsContact C-N 3.3Å; F148-L150 PolarHBondContact O-N 3.46Å; L150-S152 VanDerWaalsContact C-N 3.29Å; L150-S152 PolarHBondContact O-N 2.97Å; L150-W153 WeakPolarHBondContact O-CA 3.4Å; L150-W153 VanDerWaalsContact O-CB 3.3Å; L150-W153 WeakPolarHBondContact O-CB 3.39Å; L150-W153 PolarHBondContact O-N 3.42Å; L150-W153 VanDerWaalsContact O-N 3.09Å; L150-F154 PolarHBondContact O-N 3Å; L150-V325 HydrophobicContact CB-CB 4.39Å; L150-V325 HydrophobicContact CB-CG1 3.67Å; L150-V325 HydrophobicContact CB-CG2 3.97Å; L150-V325 HydrophobicContact CD2-CG2 4.35Å; L150-V325 WeakPolarHBondContact O-CG1 3.45Å; L150-L340 HydrophobicContact CD1-CD1 4.27Å; L150-F374 HydrophobicContact CD2-CE1 4.07Å
151	C	93.1	Very high	87.9	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-37.1	173.4	-83.5	0	0	0	0	112.2	A147 F148 W153 F154 Y155 A209 F329	A147-C151 PolarHBondContact O-N 2.88Å; F148-C151 PolarHBondContact O-N 2.81Å; C151-W153 VanDerWaalsContact C-N 3.31Å; C151-W153 PolarHBondContact O-N 2.9Å; C151-F154 PolarHBondContact O-N 3.04Å; C151-Y155 PolarHBondContact O-N 3.4Å; C151-A209 HydrophobicContact CB-CB 3.96Å; C151-F329 HydrophobicContact CB-CD2 4.11Å; C151-F329 WeakPolarHBondContact SG-CB 3.39Å; C151-F329 VanDerWaalsContact SG-CD2 3.53Å; C151-F329 WeakPolarHBondContact SG-CG 3.45Å
152	S	92	Very high	88.7	Confident	48 Å²	48	26.1 Å²	26.1	34%	0.336	14%	0.143	S	C	.	.	H	α-helix	trans	-63.6	-37.3	172.2	-174.6	0	0	0	0	111.6	F148 N149 L150 Y155 V156	F148-S152 WeakPolarHBondContact O-CB 3.18Å; F148-S152 PolarHBondContact O-N 3.39Å; N149-S152 WeakPolarHBondContact O-CB 3.46Å; N149-S152 PolarHBondContact O-N 2.88Å; L150-S152 VanDerWaalsContact C-N 3.29Å; L150-S152 PolarHBondContact O-N 2.97Å; S152-Y155 PolarHBondContact O-N 3.18Å; S152-V156 VanDerWaalsContact O-CG2 3.3Å; S152-V156 WeakPolarHBondContact O-CG2 3.35Å; S152-V156 PolarHBondContact O-N 3.13Å
153	W	95.2	Very high	89.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-46.1	171.2	165.3	96	0	0	0	111.8	L128 H131 L132 L135 N149 L150 C151 Y155 V156 Q157 F321 F322 V325	L128-W153 HydrophobicContact CD1-CZ2 4.36Å; L128-W153 HydrophobicContact CD2-CH2 4.45Å; L128-W153 HydrophobicContact CD2-CZ2 3.77Å; L128-W153 HydrophobicContact CG-CZ2 3.7Å; L128-W153 PolarHBondContact O-NE1 3.4Å; H131-W153 AromaticContact CD2-CD1 3.87Å; H131-W153 AromaticContact CE1-CD1 3.7Å; H131-W153 AromaticContact CG-CD1 3.37Å; H131-W153 AromaticContact ND1-CD1 3.31Å; H131-W153 VanDerWaalsContact ND1-CD1 3.31Å; L132-W153 HydrophobicContact CB-CZ2 3.91Å; L132-W153 HydrophobicContact CD1-CD2 4.27Å; L132-W153 HydrophobicContact CD1-CE3 4.47Å; L132-W153 HydrophobicContact CD1-CH2 4.38Å; L132-W153 HydrophobicContact CD1-CZ2 4.19Å; L132-W153 HydrophobicContact CD2-CH2 4.22Å; L132-W153 HydrophobicContact CD2-CZ2 4.07Å; L132-W153 HydrophobicContact CG-CZ2 4.27Å; L135-W153 HydrophobicContact CD1-CB 3.55Å; L135-W153 HydrophobicContact CD1-CG 4.15Å; N149-W153 PolarHBondContact O-N 2.65Å; L150-W153 WeakPolarHBondContact O-CA 3.4Å; L150-W153 VanDerWaalsContact O-CB 3.3Å; L150-W153 WeakPolarHBondContact O-CB 3.39Å; L150-W153 PolarHBondContact O-N 3.42Å; L150-W153 VanDerWaalsContact O-N 3.09Å; C151-W153 VanDerWaalsContact C-N 3.31Å; C151-W153 PolarHBondContact O-N 2.9Å; W153-Y155 VanDerWaalsContact C-N 3.33Å; W153-Y155 PolarHBondContact O-N 3.43Å; W153-V156 PolarHBondContact O-N 2.79Å; W153-Q157 HydrophobicContact CD2-CG 4.23Å; W153-Q157 HydrophobicContact CG-CG 4.26Å; W153-Q157 HydrophobicContact CZ2-CG 4.46Å; W153-Q157 VanDerWaalsContact O-CG 3.31Å; W153-Q157 WeakPolarHBondContact O-CG 3.49Å; W153-Q157 PolarHBondContact O-N 3.42Å; W153-F321 AromaticContact CH2-CD2 3.51Å; W153-F321 HydrophobicContact CH2-CD2 3.51Å; W153-F321 HydrophobicContact CH2-CE2 4.05Å; W153-F321 HydrophobicContact CH2-CG 4.36Å; W153-F321 HydrophobicContact CZ3-CD2 4.13Å; W153-F322 HydrophobicContact CE3-CD1 4.11Å; W153-F322 HydrophobicContact CE3-CE1 4.03Å; W153-F322 AromaticContact CH2-CD1 3.89Å; W153-F322 HydrophobicContact CH2-CD1 3.89Å; W153-F322 AromaticContact CH2-CE1 3.65Å; W153-F322 HydrophobicContact CH2-CE1 3.65Å; W153-F322 HydrophobicContact CZ2-CE1 4.17Å; W153-F322 AromaticContact CZ3-CD1 3.47Å; W153-F322 HydrophobicContact CZ3-CD1 3.47Å; W153-F322 VanDerWaalsContact CZ3-CD1 3.47Å; W153-F322 AromaticContact CZ3-CE1 3.56Å; W153-F322 HydrophobicContact CZ3-CE1 3.56Å; W153-V325 HydrophobicContact CE3-CG2 4.12Å; W153-V325 HydrophobicContact CZ3-CG2 3.88Å
154	F	95.3	Very high	90.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.5	-47.9	175.5	177.7	-163.1	0	0	0	110.8	L150 C151 V156 Q157 S158 L207 Q208 T314 F322 V325	L150-F154 PolarHBondContact O-N 3Å; C151-F154 PolarHBondContact O-N 3.04Å; F154-V156 PolarHBondContact O-N 3.35Å; F154-Q157 PolarHBondContact O-N 3.4Å; F154-S158 WeakPolarHBondContact O-CB 3.25Å; F154-S158 PolarHBondContact O-N 2.94Å; F154-L207 HydrophobicContact CE1-CB 4.07Å; F154-Q208 HydrophobicContact CD1-CG 3.67Å; F154-Q208 HydrophobicContact CD2-CG 4.25Å; F154-Q208 HydrophobicContact CE1-CG 3.66Å; F154-Q208 HydrophobicContact CE2-CG 4.22Å; F154-Q208 HydrophobicContact CG-CG 3.97Å; F154-Q208 HydrophobicContact CZ-CG 3.92Å; F154-T314 HydrophobicContact CE1-CG2 4.33Å; F154-T314 HydrophobicContact CZ-CG2 4.03Å; F154-F322 HydrophobicContact CB-CD1 3.86Å; F154-F322 HydrophobicContact CB-CE1 4.34Å; F154-F322 HydrophobicContact CD1-CB 4.07Å; F154-F322 HydrophobicContact CD1-CD1 4.49Å; F154-F322 HydrophobicContact CD2-CB 3.69Å; F154-F322 AromaticContact CD2-CD1 3.16Å; F154-F322 HydrophobicContact CD2-CD1 3.16Å; F154-F322 AromaticContact CD2-CD2 3.94Å; F154-F322 HydrophobicContact CD2-CD2 3.94Å; F154-F322 AromaticContact CD2-CE1 3.63Å; F154-F322 HydrophobicContact CD2-CE1 3.63Å; F154-F322 HydrophobicContact CD2-CE2 4.3Å; F154-F322 AromaticContact CD2-CG 3.34Å; F154-F322 HydrophobicContact CD2-CG 3.34Å; F154-F322 HydrophobicContact CD2-CZ 4.16Å; F154-F322 HydrophobicContact CE1-CB 3.96Å; F154-F322 HydrophobicContact CE2-CB 3.6Å; F154-F322 AromaticContact CE2-CD1 3.84Å; F154-F322 HydrophobicContact CE2-CD1 3.84Å; F154-F322 AromaticContact CE2-CD2 3.76Å; F154-F322 HydrophobicContact CE2-CD2 3.76Å; F154-F322 HydrophobicContact CE2-CE1 4.4Å; F154-F322 HydrophobicContact CE2-CE2 4.31Å; F154-F322 AromaticContact CE2-CG 3.48Å; F154-F322 HydrophobicContact CE2-CG 3.48Å; F154-F322 VanDerWaalsContact CE2-CG 3.48Å; F154-F322 HydrophobicContact CG-CB 3.97Å; F154-F322 AromaticContact CG-CD1 3.59Å; F154-F322 HydrophobicContact CG-CD1 3.59Å; F154-F322 HydrophobicContact CG-CE1 4.28Å; F154-F322 AromaticContact CG-CG 3.96Å; F154-F322 HydrophobicContact CG-CG 3.96Å; F154-F322 HydrophobicContact CZ-CB 3.75Å; F154-F322 HydrophobicContact CZ-CG 4.16Å; F154-V325 HydrophobicContact CB-CG1 4.33Å
155	Y	94	Very high	91.9	Very high	46 Å²	46	24.6 Å²	24.6	18%	0.18	13%	0.131	C	C	.	.	H	α-helix	trans	-53.8	-52.4	174.2	172.5	-100.6	0	0	0	111.6	C151 S152 W153 Q157 S158 Q159 A162 R210	C151-Y155 PolarHBondContact O-N 3.4Å; S152-Y155 PolarHBondContact O-N 3.18Å; W153-Y155 VanDerWaalsContact C-N 3.33Å; W153-Y155 PolarHBondContact O-N 3.43Å; Y155-Q157 PolarHBondContact O-N 3.27Å; Y155-S158 CarbonylContact O-C 3.58Å; Y155-S158 VanDerWaalsContact O-C 3.27Å; Y155-S158 PolarHBondContact O-N 2.98Å; Y155-Q159 PolarHBondContact O-NE2 3.39Å; Y155-Q159 PolarHBondContact OH-OE1 3.09Å; Y155-A162 HydrophobicContact CE2-CB 3.8Å; Y155-R210 HydrophobicContact CD2-CG 4.02Å; Y155-R210 HydrophobicContact CE2-CG 4.42Å
156	V	92.3	Very high	92.3	Very high	56 Å²	56	30.5 Å²	30.5	34%	0.339	15%	0.153	S	C	.	.	H	α-helix	trans	-60	-42.5	-178.9	171.2	0	0	0	0	112	S152 W153 F154 S158	S152-V156 VanDerWaalsContact O-CG2 3.3Å; S152-V156 WeakPolarHBondContact O-CG2 3.35Å; S152-V156 PolarHBondContact O-N 3.13Å; W153-V156 PolarHBondContact O-N 2.79Å; F154-V156 PolarHBondContact O-N 3.35Å; V156-S158 VanDerWaalsContact C-N 3.32Å; V156-S158 PolarHBondContact O-N 2.89Å
157	Q	92.8	Very high	92.4	Very high	8 Å²	8	36.8 Å²	36.8	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-78.3	-14.8	-178.2	-61.3	-56.5	-21.5	0	0	114.1	L128 H131 W153 F154 Y155 R315 F322	L128-Q157 HydrophobicContact CD1-CB 4.42Å; L128-Q157 HydrophobicContact CD1-CG 4.49Å; L128-Q157 HydrophobicContact CG-CG 4.31Å; H131-Q157 PolarHBondContact ND1-NE2 3.41Å; H131-Q157 VanDerWaalsContact ND1-NE2 3.13Å; W153-Q157 HydrophobicContact CD2-CG 4.23Å; W153-Q157 HydrophobicContact CG-CG 4.26Å; W153-Q157 HydrophobicContact CZ2-CG 4.46Å; W153-Q157 VanDerWaalsContact O-CG 3.31Å; W153-Q157 WeakPolarHBondContact O-CG 3.49Å; W153-Q157 PolarHBondContact O-N 3.42Å; F154-Q157 PolarHBondContact O-N 3.4Å; Y155-Q157 PolarHBondContact O-N 3.27Å; Q157-R315 PolarHBondContact O-NH2 3.41Å; Q157-F322 HydrophobicContact CB-CE1 3.89Å; Q157-F322 HydrophobicContact CB-CZ 3.73Å
158	S	90.2	Very high	92.4	Very high	5 Å²	5	37.1 Å²	37.1	4%	0.035	18%	0.184	C	C	.	.			trans	-137.4	76	-177.4	-166.7	0	0	0	0	111.3	F154 Y155 V156 E160 Q208	F154-S158 WeakPolarHBondContact O-CB 3.25Å; F154-S158 PolarHBondContact O-N 2.94Å; Y155-S158 CarbonylContact O-C 3.58Å; Y155-S158 VanDerWaalsContact O-C 3.27Å; Y155-S158 PolarHBondContact O-N 2.98Å; V156-S158 VanDerWaalsContact C-N 3.32Å; V156-S158 PolarHBondContact O-N 2.89Å; S158-E160 WeakPolarHBondContact CA-OE2 3.27Å; S158-E160 VanDerWaalsContact CB-OE2 3.3Å; S158-E160 WeakPolarHBondContact CB-OE2 3.47Å; S158-E160 PolarHBondContact O-N 3.01Å; S158-E160 PolarHBondContact OG-OE2 3.15Å; S158-Q208 PolarHBondContact O-NE2 3.08Å
159	Q	89.6	Confident	92.4	Very high	55 Å²	55	37.3 Å²	37.3	26%	0.257	19%	0.187	S	C	.	.			trans	-77.9	-0.3	178.6	-69.5	-67.5	-48.9	0	0	113.8	Y155 A161 A162 N163	Y155-Q159 PolarHBondContact O-NE2 3.39Å; Y155-Q159 PolarHBondContact OH-OE1 3.09Å; Q159-A161 PolarHBondContact O-N 2.93Å; Q159-A162 PolarHBondContact O-N 3.31Å; Q159-N163 WeakPolarHBondContact O-CB 3.34Å; Q159-N163 VanDerWaalsContact O-CG 3.22Å; Q159-N163 PolarHBondContact O-N 2.98Å; Q159-N163 PolarHBondContact O-ND2 3.11Å; Q159-N163 VanDerWaalsContact O-ND2 3.16Å
160	E	89.3	Confident	92.3	Very high	89 Å²	89	40.3 Å²	40.3	42%	0.416	20%	0.203	S	C	.	.	H	α-helix	trans	-58.3	-46.8	-175.7	-61	86.2	168.7	0	0	111.7	S158 A162 N163 C164 R315	S158-E160 WeakPolarHBondContact CA-OE2 3.27Å; S158-E160 VanDerWaalsContact CB-OE2 3.3Å; S158-E160 WeakPolarHBondContact CB-OE2 3.47Å; S158-E160 PolarHBondContact O-N 3.01Å; S158-E160 PolarHBondContact OG-OE2 3.15Å; E160-A162 PolarHBondContact O-N 2.97Å; E160-N163 PolarHBondContact O-N 2.94Å; E160-C164 WeakPolarHBondContact O-CB 3.29Å; E160-C164 PolarHBondContact O-N 3.28Å; E160-C164 PolarHBondContact O-SG 3.42Å; E160-C164 VanDerWaalsContact O-SG 3.33Å; E160-R315 IonicContact OE1-CZ 3.34Å; E160-R315 IonicContact OE1-NE 3.06Å; E160-R315 IonicContact OE1-NH2 3.47Å; E160-R315 PolarHBondContact OE1-NH2 3.36Å; E160-R315 IonicContact OE2-NH2 2.72Å
161	A	92.4	Very high	91.9	Very high	5 Å²	5	42.2 Å²	42.2	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-43.4	179.1	0	0	0	0	0	112.4	Q159 N163 C164 A165 T201 S204 L205	Q159-A161 PolarHBondContact O-N 2.93Å; A161-N163 PolarHBondContact O-N 3.23Å; A161-C164 PolarHBondContact O-N 3.32Å; A161-A165 VanDerWaalsContact O-CB 3.23Å; A161-A165 WeakPolarHBondContact O-CB 3.44Å; A161-A165 PolarHBondContact O-N 3.4Å; A161-T201 VanDerWaalsContact O-CG2 3.31Å; A161-T201 WeakPolarHBondContact O-CG2 3.37Å; A161-S204 WeakPolarHBondContact CB-OG 3.09Å; A161-L205 HydrophobicContact CB-CD2 4.25Å; A161-L205 HydrophobicContact CB-CG 4.31Å
162	A	93.5	Very high	91.4	Very high	2 Å²	2	42.3 Å²	42.3	2%	0.017	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-36.3	177.9	0	0	0	0	0	112.4	Y155 Q159 E160 R166	Y155-A162 HydrophobicContact CE2-CB 3.8Å; Q159-A162 PolarHBondContact O-N 3.31Å; E160-A162 PolarHBondContact O-N 2.97Å; A162-R166 PolarHBondContact O-N 3.18Å; A162-R166 VanDerWaalsContact O-N 3.13Å; A162-R166 PolarHBondContact O-NE 3.38Å
163	N	93.1	Very high	91	Very high	63 Å²	63	42.7 Å²	42.7	34%	0.337	22%	0.22	S	C	.	.	H	α-helix	trans	-65.1	-51.3	173.3	-71.2	-33.3	0	0	0	110.8	Q159 E160 A161 A165 R166 E167	Q159-N163 WeakPolarHBondContact O-CB 3.34Å; Q159-N163 VanDerWaalsContact O-CG 3.22Å; Q159-N163 PolarHBondContact O-N 2.98Å; Q159-N163 PolarHBondContact O-ND2 3.11Å; Q159-N163 VanDerWaalsContact O-ND2 3.16Å; E160-N163 PolarHBondContact O-N 2.94Å; A161-N163 PolarHBondContact O-N 3.23Å; N163-A165 VanDerWaalsContact C-N 3.31Å; N163-A165 PolarHBondContact O-N 3.23Å; N163-R166 PolarHBondContact O-N 3.35Å; N163-R166 PolarHBondContact OD1-NH2 3.09Å; N163-E167 WeakPolarHBondContact O-CG 3.45Å; N163-E167 PolarHBondContact O-N 3.3Å
164	C	93.6	Very high	90.1	Very high	40 Å²	40	51 Å²	51	27%	0.27	25%	0.252	S	S	.	.	H	α-helix	trans	-58.8	-42.3	177.2	-71.5	0	0	0	0	111.8	E160 A161 R166 E167 I168 T201	E160-C164 WeakPolarHBondContact O-CB 3.29Å; E160-C164 PolarHBondContact O-N 3.28Å; E160-C164 PolarHBondContact O-SG 3.42Å; E160-C164 VanDerWaalsContact O-SG 3.33Å; A161-C164 PolarHBondContact O-N 3.32Å; C164-R166 VanDerWaalsContact C-N 3.35Å; C164-R166 PolarHBondContact O-N 3.34Å; C164-E167 PolarHBondContact O-N 2.9Å; C164-I168 WeakPolarHBondContact O-CB 3.23Å; C164-I168 VanDerWaalsContact O-CG1 3.26Å; C164-I168 WeakPolarHBondContact O-CG1 3.46Å; C164-I168 PolarHBondContact O-N 2.79Å; C164-T201 HydrophobicContact CB-CG2 4.14Å; C164-T201 WeakPolarHBondContact CB-OG1 3.45Å
165	A	94	Very high	88.9	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-45.5	176.8	0	0	0	0	0	111.9	A161 N163 I168 L169 T201 L205 L217	A161-A165 VanDerWaalsContact O-CB 3.23Å; A161-A165 WeakPolarHBondContact O-CB 3.44Å; A161-A165 PolarHBondContact O-N 3.4Å; N163-A165 VanDerWaalsContact C-N 3.31Å; N163-A165 PolarHBondContact O-N 3.23Å; A165-I168 PolarHBondContact O-N 3.3Å; A165-L169 WeakPolarHBondContact O-CB 3.45Å; A165-L169 VanDerWaalsContact O-CG 3.31Å; A165-L169 WeakPolarHBondContact O-CG 3.48Å; A165-L169 PolarHBondContact O-N 3.31Å; A165-T201 HydrophobicContact CB-CG2 3.86Å; A165-L205 HydrophobicContact CB-CD1 4.02Å; A165-L217 HydrophobicContact CB-CD1 3.79Å; A165-L217 HydrophobicContact CB-CD2 4.37Å; A165-L217 HydrophobicContact CB-CG 4.37Å
166	R	93.2	Very high	87.5	Confident	134 Å²	134	59.2 Å²	59.2	51%	0.506	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-43.7	175.7	-80.2	-174.2	-79.1	124.2	-9.2	112.2	A162 N163 C164 I168 L169 D170	A162-R166 PolarHBondContact O-N 3.18Å; A162-R166 VanDerWaalsContact O-N 3.13Å; A162-R166 PolarHBondContact O-NE 3.38Å; N163-R166 PolarHBondContact O-N 3.35Å; N163-R166 PolarHBondContact OD1-NH2 3.09Å; C164-R166 VanDerWaalsContact C-N 3.35Å; C164-R166 PolarHBondContact O-N 3.34Å; R166-I168 VanDerWaalsContact C-N 3.33Å; R166-I168 PolarHBondContact O-N 2.93Å; R166-L169 PolarHBondContact O-N 3.4Å; R166-D170 VanDerWaalsContact O-CB 3.31Å; R166-D170 WeakPolarHBondContact O-CB 3.4Å; R166-D170 PolarHBondContact O-N 2.84Å
167	E	91.4	Very high	85.9	Confident	135 Å²	135	61.3 Å²	61.3	63%	0.631	31%	0.308	S	S	*	.	H	α-helix	trans	-62.1	-40.4	177.4	-71.2	179	-178.5	0	0	112.2	N163 C164 S171	N163-E167 WeakPolarHBondContact O-CG 3.45Å; N163-E167 PolarHBondContact O-N 3.3Å; C164-E167 PolarHBondContact O-N 2.9Å; E167-S171 WeakPolarHBondContact O-CB 3.3Å; E167-S171 PolarHBondContact O-N 2.9Å; E167-S171 PolarHBondContact O-OG 2.67Å
168	I	90.8	Very high	84.1	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.036	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-46.2	175.4	-68.5	167.2	0	0	0	110.7	C164 A165 R166 S171 A172 W192 L217 L220	C164-I168 WeakPolarHBondContact O-CB 3.23Å; C164-I168 VanDerWaalsContact O-CG1 3.26Å; C164-I168 WeakPolarHBondContact O-CG1 3.46Å; C164-I168 PolarHBondContact O-N 2.79Å; A165-I168 PolarHBondContact O-N 3.3Å; R166-I168 VanDerWaalsContact C-N 3.33Å; R166-I168 PolarHBondContact O-N 2.93Å; I168-S171 WeakPolarHBondContact CA-OG 3.46Å; I168-S171 PolarHBondContact O-N 3.41Å; I168-S171 PolarHBondContact O-OG 3.42Å; I168-A172 WeakPolarHBondContact O-CB 3.46Å; I168-A172 PolarHBondContact O-N 2.9Å; I168-W192 HydrophobicContact CG2-CE3 3.88Å; I168-W192 HydrophobicContact CG2-CZ3 4.13Å; I168-L217 HydrophobicContact CB-CD2 4.27Å; I168-L217 HydrophobicContact CG2-CD2 3.98Å; I168-L220 HydrophobicContact CG2-CD1 3.72Å
169	L	89.4	Confident	81.8	Confident	62 Å²	62	72 Å²	72	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-66.8	-40.6	179	-71.9	165.9	0	0	0	112.4	A165 R166 A172 S173 L217 L220	A165-L169 WeakPolarHBondContact O-CB 3.45Å; A165-L169 VanDerWaalsContact O-CG 3.31Å; A165-L169 WeakPolarHBondContact O-CG 3.48Å; A165-L169 PolarHBondContact O-N 3.31Å; R166-L169 PolarHBondContact O-N 3.4Å; L169-A172 PolarHBondContact O-N 3.27Å; L169-S173 WeakPolarHBondContact O-CB 3.3Å; L169-S173 PolarHBondContact O-N 3.2Å; L169-S173 PolarHBondContact O-OG 3.44Å; L169-L217 HydrophobicContact CD1-CD2 4.21Å; L169-L217 HydrophobicContact CD2-CD2 4.13Å; L169-L217 HydrophobicContact CG-CD2 3.8Å; L169-L220 HydrophobicContact CD2-CD1 4.06Å
170	D	88.3	Confident	79.9	Confident	84 Å²	84	72.4 Å²	72.4	45%	0.449	37%	0.37	S	S	.	.	H	α-helix	trans	-65.7	-41.6	177.3	-83	-2.9	0	0	0	111.4	R166 S173 R174	R166-D170 VanDerWaalsContact O-CB 3.31Å; R166-D170 WeakPolarHBondContact O-CB 3.4Å; R166-D170 PolarHBondContact O-N 2.84Å; D170-S173 PolarHBondContact O-N 3.3Å; D170-S173 PolarHBondContact O-OG 3.31Å; D170-R174 WeakPolarHBondContact O-CG 3.22Å; D170-R174 PolarHBondContact O-N 3.01Å; D170-R174 VanDerWaalsContact O-N 3.08Å
171	S	86.2	Confident	77.8	Confident	42 Å²	42	75.1 Å²	75.1	29%	0.294	39%	0.387	S	S	.	.	H	α-helix	trans	-66	-42.5	175.5	52.1	0	0	0	0	111.6	E167 I168 S173 R174 E175 W192	E167-S171 WeakPolarHBondContact O-CB 3.3Å; E167-S171 PolarHBondContact O-N 2.9Å; E167-S171 PolarHBondContact O-OG 2.67Å; I168-S171 WeakPolarHBondContact CA-OG 3.46Å; I168-S171 PolarHBondContact O-N 3.41Å; I168-S171 PolarHBondContact O-OG 3.42Å; S171-S173 PolarHBondContact O-N 3.34Å; S171-R174 PolarHBondContact O-N 3.21Å; S171-E175 WeakPolarHBondContact O-CG 3.43Å; S171-E175 PolarHBondContact O-N 3.34Å; S171-E175 VanDerWaalsContact O-N 3.12Å; S171-W192 VanDerWaalsContact OG-CH2 3.29Å; S171-W192 WeakPolarHBondContact OG-CH2 3.44Å; S171-W192 WeakPolarHBondContact OG-CZ3 3.29Å
172	A	83.6	Confident	75.8	Confident	4 Å²	4	81.9 Å²	81.9	3%	0.033	42%	0.422	C	S	.	.	H	α-helix	trans	-61.2	-40.1	174.6	0	0	0	0	0	112.9	I168 L169 E175 Q176 W192 L220	I168-A172 WeakPolarHBondContact O-CB 3.46Å; I168-A172 PolarHBondContact O-N 2.9Å; L169-A172 PolarHBondContact O-N 3.27Å; A172-E175 PolarHBondContact O-N 2.8Å; A172-Q176 WeakPolarHBondContact O-CG 3.34Å; A172-Q176 PolarHBondContact O-N 3.04Å; A172-W192 HydrophobicContact CB-CH2 4.17Å; A172-W192 HydrophobicContact CB-CZ2 3.65Å; A172-L220 HydrophobicContact CB-CD1 3.99Å; A172-L220 HydrophobicContact CB-CD2 3.81Å
173	S	82.2	Confident	73.5	Confident	55 Å²	55	89.1 Å²	89.1	39%	0.385	46%	0.455	S	S	.	.	H	α-helix	trans	-69.9	-36.9	178.8	68.6	0	0	0	0	112.9	L169 D170 S171 Q176 S177	L169-S173 WeakPolarHBondContact O-CB 3.3Å; L169-S173 PolarHBondContact O-N 3.2Å; L169-S173 PolarHBondContact O-OG 3.44Å; D170-S173 PolarHBondContact O-N 3.3Å; D170-S173 PolarHBondContact O-OG 3.31Å; S171-S173 PolarHBondContact O-N 3.34Å; S173-Q176 PolarHBondContact O-N 3Å; S173-S177 PolarHBondContact O-N 3.3Å; S173-S177 VanDerWaalsContact O-N 3.13Å; S173-S177 PolarHBondContact O-OG 2.85Å
174	R	77.7	Confident	71.2	Confident	176 Å²	176	90.2 Å²	90.2	66%	0.664	46%	0.461	S	S	*	.	H	α-helix	trans	-64.8	-39	174.4	-71.7	178.2	-159.3	-171.6	7.7	112.2	D170 S171 Q176 S177 G178	D170-R174 WeakPolarHBondContact O-CG 3.22Å; D170-R174 PolarHBondContact O-N 3.01Å; D170-R174 VanDerWaalsContact O-N 3.08Å; S171-R174 PolarHBondContact O-N 3.21Å; R174-Q176 VanDerWaalsContact C-N 3.28Å; R174-Q176 PolarHBondContact O-N 3.03Å; R174-S177 WeakPolarHBondContact CA-OG 3.35Å; R174-S177 PolarHBondContact O-N 3.47Å; R174-S177 PolarHBondContact O-OG 3.1Å; R174-G178 PolarHBondContact O-N 3.33Å
175	E	68.3	Low	69.1	Low	64 Å²	64	94.2 Å²	94.2	30%	0.299	47%	0.473	S	S	.	.	H	α-helix	trans	-65.4	-32.2	176.2	-72.7	179.5	-175.3	0	0	112.3	S171 A172 I180 K190 W192	S171-E175 WeakPolarHBondContact O-CG 3.43Å; S171-E175 PolarHBondContact O-N 3.34Å; S171-E175 VanDerWaalsContact O-N 3.12Å; A172-E175 PolarHBondContact O-N 2.8Å; E175-I180 HydrophobicContact CB-CD1 4.18Å; E175-I180 HydrophobicContact CG-CD1 4.16Å; E175-K190 IonicContact OE1-NZ 3.35Å; E175-W192 WeakPolarHBondContact OE2-CZ2 3.38Å
176	Q	65.7	Low	66.6	Low	154 Å²	154	101.2 Å²	101.2	72%	0.72	51%	0.509	S	S	*	.	H	α-helix	trans	-75.4	-30	175.7	-69.9	176.6	15.5	0	0	113.4	A172 S173 R174	A172-Q176 WeakPolarHBondContact O-CG 3.34Å; A172-Q176 PolarHBondContact O-N 3.04Å; S173-Q176 PolarHBondContact O-N 3Å; R174-Q176 VanDerWaalsContact C-N 3.28Å; R174-Q176 PolarHBondContact O-N 3.03Å
177	S	59.4	Low	64.2	Low	99 Å²	99	100.7 Å²	100.7	69%	0.692	52%	0.517	S	S	*	.	H	α-helix	trans	-97.9	-20.2	-174.4	47.4	0	0	0	0	114.5	S173 R174	S173-S177 PolarHBondContact O-N 3.3Å; S173-S177 VanDerWaalsContact O-N 3.13Å; S173-S177 PolarHBondContact O-OG 2.85Å; R174-S177 WeakPolarHBondContact CA-OG 3.35Å; R174-S177 PolarHBondContact O-N 3.47Å; R174-S177 PolarHBondContact O-OG 3.1Å
178	G	53.6	Low	61.9	Low	35 Å²	35	99.1 Å²	99.1	36%	0.361	51%	0.513	S	S	.	.	S	Bend	trans	-84.7	139.1	176.9	0	0	0	0	0	113.6	R174 I180	R174-G178 PolarHBondContact O-N 3.33Å; G178-I180 PolarHBondContact O-N 3.45Å
179	H	43.6	Very low	60.1	Low	202 Å²	202	106 Å²	106	94%	0.935	55%	0.548	S	S	*	.			trans	-60.6	65.6	163.8	-90.5	-92.2	0	0	0	111.5	L181	H179-L181 PolarHBondContact O-N 2.88Å; H179-L181 VanDerWaalsContact O-N 3.16Å
180	I	49.5	Very low	58.6	Low	64 Å²	64	108.6 Å²	108.6	33%	0.328	56%	0.557	S	S	.	*			trans	-65.8	114.9	161.8	-65.1	173	0	0	0	105.3	E175 G178 L182 D184	E175-I180 HydrophobicContact CB-CD1 4.18Å; E175-I180 HydrophobicContact CG-CD1 4.16Å; G178-I180 PolarHBondContact O-N 3.45Å; I180-L182 PolarHBondContact O-N 3.01Å; I180-D184 HydrophobicContact CG2-CB 3.36Å
181	L	45.2	Very low	57.8	Low	146 Å²	146	106 Å²	106	76%	0.764	55%	0.546	S	S	*	.			trans	-43.1	133.7	175.5	-71.4	165.6	0	0	0	108.6	H179 H183 D184	H179-L181 PolarHBondContact O-N 2.88Å; H179-L181 VanDerWaalsContact O-N 3.16Å; L181-H183 PolarHBondContact O-N 2.89Å; L181-D184 PolarHBondContact O-N 3.25Å
182	L	50	Low	57.5	Low	148 Å²	148	105.1 Å²	105.1	78%	0.775	54%	0.536	S	S	*	.	H	α-helix	trans	-46.5	-21.2	-177.8	-81	160.1	0	0	0	114.2	I180	I180-L182 PolarHBondContact O-N 3.01Å
183	H	44.5	Very low	57.3	Low	153 Å²	153	105.6 Å²	105.6	71%	0.708	54%	0.538	S	S	*	.	H	α-helix	trans	-73.9	-25.2	178.5	-139.8	-63.3	0	0	0	115	L181	L181-H183 PolarHBondContact O-N 2.89Å
184	D	45.9	Very low	57.2	Low	87 Å²	87	108.2 Å²	108.2	47%	0.465	55%	0.551	S	S	.	*	H	α-helix	trans	-87.8	-28.1	176.4	-121.5	-18.3	0	0	0	112.1	I180 L181 L186 N187 N188	I180-D184 HydrophobicContact CG2-CB 3.36Å; L181-D184 PolarHBondContact O-N 3.25Å; D184-L186 PolarHBondContact O-N 2.65Å; D184-N187 PolarHBondContact O-N 3.39Å; D184-N188 WeakPolarHBondContact O-CB 3.22Å; D184-N188 PolarHBondContact O-N 2.67Å; D184-N188 PolarHBondContact OD1-ND2 3.36Å
185	K	47.7	Very low	57.6	Low	123 Å²	123	102.2 Å²	102.2	54%	0.535	53%	0.532	S	S	.	.	H	α-helix	trans	-63.6	-25.9	174.8	-88.1	-175.1	174.8	179.3	0	113.7
186	L	42.4	Very low	58.6	Low	151 Å²	151	107.1 Å²	107.1	79%	0.791	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-23.9	-178.4	-122.8	111.4	0	0	0	113.4	D184	D184-L186 PolarHBondContact O-N 2.65Å
187	N	42.7	Very low	59.8	Low	124 Å²	124	103 Å²	103	66%	0.663	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-16.6	-176.7	-74.6	-14.1	0	0	0	113.8	D184	D184-N187 PolarHBondContact O-N 3.39Å
188	N	43.1	Very low	61.5	Low	102 Å²	102	98.3 Å²	98.3	55%	0.545	50%	0.503	S	S	.	.			trans	-124.7	64.9	177.7	-74	-44.7	0	0	0	110.5	D184 K190	D184-N188 WeakPolarHBondContact O-CB 3.22Å; D184-N188 PolarHBondContact O-N 2.67Å; D184-N188 PolarHBondContact OD1-ND2 3.36Å; N188-K190 PolarHBondContact O-N 3.08Å
189	L	52.5	Low	63.4	Low	150 Å²	150	97 Å²	97	79%	0.785	49%	0.487	S	S	*	.			trans	-69.1	79.4	152	-157.9	83.5	0	0	0	105.4	S191	L189-S191 VanDerWaalsContact C-N 3.29Å; L189-S191 PolarHBondContact O-N 3.15Å
190	K	58.7	Low	65.9	Low	117 Å²	117	89.1 Å²	89.1	51%	0.509	45%	0.454	S	S	.	.			trans	-62.3	98.4	-175.7	-163	179.4	-177.5	-173.7	0	106.7	E175 N188 W192	E175-K190 IonicContact OE1-NZ 3.35Å; N188-K190 PolarHBondContact O-N 3.08Å; K190-W192 PolarHBondContact O-N 3.18Å
191	S	71.4	Confident	68.2	Low	30 Å²	30	86.4 Å²	86.4	21%	0.21	44%	0.44	C	S	.	.			trans	-64.7	99.1	177.5	159.1	0	0	0	0	106.3	L189 E193 T194	L189-S191 VanDerWaalsContact C-N 3.29Å; L189-S191 PolarHBondContact O-N 3.15Å; S191-E193 WeakPolarHBondContact CB-OE1 3.47Å; S191-E193 PolarHBondContact O-N 2.95Å; S191-E193 VanDerWaalsContact O-N 3.16Å; S191-E193 WeakPolarHBondContact OG-CG 3.16Å; S191-E193 PolarHBondContact OG-OE1 3.14Å; S191-E193 PolarHBondContact OG-OE2 3.15Å; S191-T194 WeakPolarHBondContact O-CB 3.32Å; S191-T194 PolarHBondContact O-N 2.91Å; S191-T194 PolarHBondContact O-OG1 2.99Å; S191-T194 WeakPolarHBondContact OG-CG2 3.38Å
192	W	80.6	Confident	70.6	Confident	23 Å²	23	79.4 Å²	79.4	9%	0.087	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-58.6	-28.7	-176.5	-70.8	96.4	0	0	0	111.4	I168 S171 A172 E175 K190 T194 N195 F198 L220	I168-W192 HydrophobicContact CG2-CE3 3.88Å; I168-W192 HydrophobicContact CG2-CZ3 4.13Å; S171-W192 VanDerWaalsContact OG-CH2 3.29Å; S171-W192 WeakPolarHBondContact OG-CH2 3.44Å; S171-W192 WeakPolarHBondContact OG-CZ3 3.29Å; A172-W192 HydrophobicContact CB-CH2 4.17Å; A172-W192 HydrophobicContact CB-CZ2 3.65Å; E175-W192 WeakPolarHBondContact OE2-CZ2 3.38Å; K190-W192 PolarHBondContact O-N 3.18Å; W192-T194 PolarHBondContact O-N 3.42Å; W192-N195 WeakPolarHBondContact O-CB 3.37Å; W192-N195 PolarHBondContact O-N 3.09Å; W192-F198 HydrophobicContact CB-CD2 4.17Å; W192-F198 HydrophobicContact CB-CE2 4.29Å; W192-F198 WeakPolarHBondContact O-CB 3.39Å; W192-F198 WeakPolarHBondContact O-CG 3.44Å; W192-L220 HydrophobicContact CB-CB 4.25Å; W192-L220 HydrophobicContact CG-CB 4.07Å
193	E	78.2	Confident	72.9	Confident	15 Å²	15	72.4 Å²	72.4	7%	0.07	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-63.2	-21.5	173.9	65	-84.9	-173	0	0	114.2	S191 N195 F198 H221 S222	S191-E193 WeakPolarHBondContact CB-OE1 3.47Å; S191-E193 PolarHBondContact O-N 2.95Å; S191-E193 VanDerWaalsContact O-N 3.16Å; S191-E193 WeakPolarHBondContact OG-CG 3.16Å; S191-E193 PolarHBondContact OG-OE1 3.14Å; S191-E193 PolarHBondContact OG-OE2 3.15Å; E193-N195 VanDerWaalsContact C-N 3.33Å; E193-F198 HydrophobicContact CB-CD1 4.32Å; E193-F198 HydrophobicContact CB-CE1 4.38Å; E193-H221 IonicContact OE2-CG 3.76Å; E193-S222 WeakPolarHBondContact OE1-CB 3.45Å; E193-S222 PolarHBondContact OE1-OG 2.99Å; E193-S222 PolarHBondContact OE2-N 3.47Å; E193-S222 VanDerWaalsContact OE2-N 3.12Å
194	T	81	Confident	75.4	Confident	109 Å²	109	65.5 Å²	65.5	67%	0.669	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-81.3	-10.7	171.9	63.4	0	0	0	0	113.5	S191 W192 K196	S191-T194 WeakPolarHBondContact O-CB 3.32Å; S191-T194 PolarHBondContact O-N 2.91Å; S191-T194 PolarHBondContact O-OG1 2.99Å; S191-T194 WeakPolarHBondContact OG-CG2 3.38Å; W192-T194 PolarHBondContact O-N 3.42Å; T194-K196 PolarHBondContact O-N 3.3Å
195	N	85.5	Confident	77.8	Confident	50 Å²	50	61.3 Å²	61.3	27%	0.267	31%	0.314	S	S	.	.	S	Bend	trans	-68.3	123.9	172.4	-175	-6.9	0	0	0	109.1	W192 E193 D197 F198	W192-N195 WeakPolarHBondContact O-CB 3.37Å; W192-N195 PolarHBondContact O-N 3.09Å; E193-N195 VanDerWaalsContact C-N 3.33Å; N195-D197 PolarHBondContact O-N 2.85Å; N195-D197 PolarHBondContact OD1-N 3.42Å; N195-D197 VanDerWaalsContact OD1-N 3.17Å; N195-F198 HydrophobicContact CB-CB 4.21Å; N195-F198 WeakPolarHBondContact O-CB 3.36Å; N195-F198 PolarHBondContact O-N 3.21Å
196	K	89.8	Confident	80.2	Confident	167 Å²	167	55.5 Å²	55.5	73%	0.726	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-29.1	178.3	63.8	173.6	-169.8	172	0	113.8	T194 P200	T194-K196 PolarHBondContact O-N 3.3Å; K196-P200 VanDerWaalsContact O-CD 3.31Å; K196-P200 WeakPolarHBondContact O-CD 3.47Å; K196-P200 VanDerWaalsContact O-CG 3.29Å; K196-P200 WeakPolarHBondContact O-CG 3.15Å
197	D	91.1	Very high	82.7	Confident	69 Å²	69	48.3 Å²	48.3	37%	0.369	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-12.6	-175.8	-57.7	-43.3	0	0	0	112.5	N195 T201	N195-D197 PolarHBondContact O-N 2.85Å; N195-D197 PolarHBondContact OD1-N 3.42Å; N195-D197 VanDerWaalsContact OD1-N 3.17Å; D197-T201 WeakPolarHBondContact O-CB 3.38Å; D197-T201 PolarHBondContact O-N 2.93Å; D197-T201 PolarHBondContact O-OG1 3.18Å
198	F	93.7	Very high	85.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-63.2	-172.6	178.4	-96.3	0	0	0	112.8	W192 E193 N195 T201 V202 L217 L218 L220 H221	W192-F198 HydrophobicContact CB-CD2 4.17Å; W192-F198 HydrophobicContact CB-CE2 4.29Å; W192-F198 WeakPolarHBondContact O-CB 3.39Å; W192-F198 WeakPolarHBondContact O-CG 3.44Å; E193-F198 HydrophobicContact CB-CD1 4.32Å; E193-F198 HydrophobicContact CB-CE1 4.38Å; N195-F198 HydrophobicContact CB-CB 4.21Å; N195-F198 WeakPolarHBondContact O-CB 3.36Å; N195-F198 PolarHBondContact O-N 3.21Å; F198-T201 WeakPolarHBondContact O-CB 3.47Å; F198-T201 PolarHBondContact O-N 2.94Å; F198-V202 HydrophobicContact CE1-CG2 4.29Å; F198-V202 HydrophobicContact CZ-CG2 4.3Å; F198-V202 WeakPolarHBondContact O-CG2 3.49Å; F198-V202 PolarHBondContact O-N 2.85Å; F198-L217 HydrophobicContact CE2-CB 4.38Å; F198-L218 HydrophobicContact CE1-CD2 4.5Å; F198-L218 HydrophobicContact CZ-CD2 4.45Å; F198-L220 HydrophobicContact CE2-CB 4.46Å; F198-H221 HydrophobicContact CZ-CB 4.47Å
199	W	95	Very high	87.6	Confident	6 Å²	6	38.2 Å²	38.2	2%	0.023	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-42	-178.6	-78	117.7	0	0	0	113.4	T201 V202 L203 L218 H221 L229 S287 Y290 I291 I294	W199-T201 VanDerWaalsContact C-N 3.28Å; W199-T201 PolarHBondContact O-N 3.36Å; W199-V202 HydrophobicContact CE3-CB 4.39Å; W199-V202 HydrophobicContact CE3-CG1 4.47Å; W199-V202 HydrophobicContact CZ3-CG1 4.43Å; W199-V202 PolarHBondContact O-N 3.45Å; W199-L203 WeakPolarHBondContact O-CB 3.02Å; W199-L203 PolarHBondContact O-N 3.26Å; W199-L218 HydrophobicContact CH2-CD2 3.76Å; W199-L218 HydrophobicContact CZ3-CD2 3.7Å; W199-H221 AromaticContact CZ2-CD2 3.66Å; W199-H221 AromaticContact CZ2-NE2 3.89Å; W199-L229 HydrophobicContact CH2-CD2 4.41Å; W199-S287 WeakPolarHBondContact CZ2-OG 3.03Å; W199-S287 PolarHBondContact NE1-OG 2.89Å; W199-S287 VanDerWaalsContact NE1-OG 3.08Å; W199-Y290 HydrophobicContact CB-CD1 3.81Å; W199-Y290 HydrophobicContact CB-CD2 3.5Å; W199-Y290 HydrophobicContact CB-CE1 3.82Å; W199-Y290 HydrophobicContact CB-CE2 3.52Å; W199-Y290 HydrophobicContact CB-CG 3.66Å; W199-Y290 AromaticContact CD1-CD2 3.86Å; W199-Y290 AromaticContact CD2-CD2 3.98Å; W199-Y290 HydrophobicContact CD2-CD2 3.98Å; W199-Y290 AromaticContact CD2-CG 3.87Å; W199-Y290 HydrophobicContact CD2-CG 3.87Å; W199-Y290 VanDerWaalsContact CE3-CB 3.47Å; W199-Y290 AromaticContact CE3-CG 3.98Å; W199-Y290 HydrophobicContact CE3-CG 3.98Å; W199-Y290 HydrophobicContact CG-CD1 4.38Å; W199-Y290 AromaticContact CG-CD2 3.5Å; W199-Y290 HydrophobicContact CG-CD2 3.5Å; W199-Y290 VanDerWaalsContact CG-CD2 3.5Å; W199-Y290 AromaticContact CG-CE2 3.94Å; W199-Y290 HydrophobicContact CG-CE2 3.94Å; W199-Y290 AromaticContact CG-CG 3.75Å; W199-Y290 HydrophobicContact CG-CG 3.75Å; W199-I291 HydrophobicContact CH2-CD1 3.86Å; W199-I291 HydrophobicContact CH2-CG1 3.53Å; W199-I291 HydrophobicContact CZ2-CD1 4.43Å; W199-I291 HydrophobicContact CZ2-CG1 4.39Å; W199-I291 HydrophobicContact CZ3-CG1 4.01Å; W199-I294 HydrophobicContact CE3-CD1 4.42Å; W199-I294 HydrophobicContact CZ3-CD1 4.16Å
200	P	95.9	Very high	89.6	Confident	37 Å²	37	35 Å²	35	24%	0.24	18%	0.176	C	C	.	.	H	α-helix	trans	-55.5	-40.5	170.4	-30.6	39.3	0	0	0	113.4	K196 L203 S204 V313	K196-P200 VanDerWaalsContact O-CD 3.31Å; K196-P200 WeakPolarHBondContact O-CD 3.47Å; K196-P200 VanDerWaalsContact O-CG 3.29Å; K196-P200 WeakPolarHBondContact O-CG 3.15Å; P200-L203 PolarHBondContact O-N 3.46Å; P200-S204 VanDerWaalsContact O-CB 3.3Å; P200-S204 WeakPolarHBondContact O-CB 3.38Å; P200-S204 PolarHBondContact O-N 3.4Å; P200-V313 HydrophobicContact CB-CG1 3.8Å
201	T	96.7	Very high	91.3	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.043	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-46.7	176.7	-61.2	0	0	0	0	111.4	A161 C164 A165 D197 F198 W199 L203 S204 L205 L217	A161-T201 VanDerWaalsContact O-CG2 3.31Å; A161-T201 WeakPolarHBondContact O-CG2 3.37Å; C164-T201 HydrophobicContact CB-CG2 4.14Å; C164-T201 WeakPolarHBondContact CB-OG1 3.45Å; A165-T201 HydrophobicContact CB-CG2 3.86Å; D197-T201 WeakPolarHBondContact O-CB 3.38Å; D197-T201 PolarHBondContact O-N 2.93Å; D197-T201 PolarHBondContact O-OG1 3.18Å; F198-T201 WeakPolarHBondContact O-CB 3.47Å; F198-T201 PolarHBondContact O-N 2.94Å; W199-T201 VanDerWaalsContact C-N 3.28Å; W199-T201 PolarHBondContact O-N 3.36Å; T201-L203 VanDerWaalsContact C-N 3.34Å; T201-L203 PolarHBondContact O-N 3.4Å; T201-S204 PolarHBondContact O-N 3.48Å; T201-L205 HydrophobicContact CG2-CD1 4.18Å; T201-L205 HydrophobicContact CG2-CG 4.5Å; T201-L205 WeakPolarHBondContact O-CG 3.39Å; T201-L205 PolarHBondContact O-N 3.44Å; T201-L217 HydrophobicContact CG2-CD1 3.75Å
202	V	96.8	Very high	92.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.1	-46.6	176.8	175	0	0	0	0	110.7	F198 W199 L205 V206 A214 L217 L218 I294	F198-V202 HydrophobicContact CE1-CG2 4.29Å; F198-V202 HydrophobicContact CZ-CG2 4.3Å; F198-V202 WeakPolarHBondContact O-CG2 3.49Å; F198-V202 PolarHBondContact O-N 2.85Å; W199-V202 HydrophobicContact CE3-CB 4.39Å; W199-V202 HydrophobicContact CE3-CG1 4.47Å; W199-V202 HydrophobicContact CZ3-CG1 4.43Å; W199-V202 PolarHBondContact O-N 3.45Å; V202-L205 PolarHBondContact O-N 3.47Å; V202-V206 WeakPolarHBondContact O-CG2 3.46Å; V202-V206 PolarHBondContact O-N 3.32Å; V202-A214 HydrophobicContact CG1-CB 4.21Å; V202-L217 HydrophobicContact CG2-CB 4.01Å; V202-L217 HydrophobicContact CG2-CD1 4.11Å; V202-L218 HydrophobicContact CG1-CD1 4.48Å; V202-L218 HydrophobicContact CG1-CD2 4.09Å; V202-L218 HydrophobicContact CG1-CG 4.22Å; V202-L218 HydrophobicContact CG2-CD2 4.31Å; V202-I294 HydrophobicContact CG1-CD1 3.79Å
203	L	97.5	Very high	92.9	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.1	-46.4	178.8	-179.8	61.5	0	0	0	111.5	W199 P200 T201 L205 V206 L207 Y290 L293 I294 I297 R309 I310 V313	W199-L203 WeakPolarHBondContact O-CB 3.02Å; W199-L203 PolarHBondContact O-N 3.26Å; P200-L203 PolarHBondContact O-N 3.46Å; T201-L203 VanDerWaalsContact C-N 3.34Å; T201-L203 PolarHBondContact O-N 3.4Å; L203-L205 PolarHBondContact O-N 3.44Å; L203-V206 PolarHBondContact O-N 3.32Å; L203-L207 HydrophobicContact CD1-CG 4.49Å; L203-L207 HydrophobicContact CG-CD1 4.25Å; L203-L207 WeakPolarHBondContact O-CG 3.27Å; L203-L207 PolarHBondContact O-N 3.07Å; L203-Y290 HydrophobicContact CD2-CE1 4.28Å; L203-L293 HydrophobicContact CD1-CD2 4.35Å; L203-L293 HydrophobicContact CD2-CD2 4.02Å; L203-I294 HydrophobicContact CD1-CG1 4.04Å; L203-I297 HydrophobicContact CD1-CD1 3.58Å; L203-R309 HydrophobicContact CD2-CB 4.13Å; L203-I310 HydrophobicContact CD2-CG1 4.46Å; L203-V313 HydrophobicContact CD2-CG1 4.22Å; L203-V313 HydrophobicContact CD2-CG2 3.95Å; L203-V313 HydrophobicContact CG-CG2 4.06Å
204	S	96.8	Very high	93.7	Very high	8 Å²	8	35.2 Å²	35.2	6%	0.056	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-42.1	178.9	-167.5	0	0	0	0	112	A161 P200 T201 V206 L207 Q208	A161-S204 WeakPolarHBondContact CB-OG 3.09Å; P200-S204 VanDerWaalsContact O-CB 3.3Å; P200-S204 WeakPolarHBondContact O-CB 3.38Å; P200-S204 PolarHBondContact O-N 3.4Å; T201-S204 PolarHBondContact O-N 3.48Å; S204-V206 VanDerWaalsContact C-N 3.34Å; S204-V206 PolarHBondContact O-N 3.17Å; S204-L207 PolarHBondContact O-N 3.21Å; S204-Q208 VanDerWaalsContact O-CG 3.3Å; S204-Q208 WeakPolarHBondContact O-CG 3.2Å; S204-Q208 PolarHBondContact O-N 3.18Å
205	L	96.9	Very high	94.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-39.6	174.6	-72	172.2	0	0	0	112.5	A161 A165 T201 V202 L203 Q208 A209 R210 E213 A214 L217	A161-L205 HydrophobicContact CB-CD2 4.25Å; A161-L205 HydrophobicContact CB-CG 4.31Å; A165-L205 HydrophobicContact CB-CD1 4.02Å; T201-L205 HydrophobicContact CG2-CD1 4.18Å; T201-L205 HydrophobicContact CG2-CG 4.5Å; T201-L205 WeakPolarHBondContact O-CG 3.39Å; T201-L205 PolarHBondContact O-N 3.44Å; V202-L205 PolarHBondContact O-N 3.47Å; L203-L205 PolarHBondContact O-N 3.44Å; L205-Q208 CarbonylContact O-C 3.4Å; L205-Q208 PolarHBondContact O-N 2.7Å; L205-A209 PolarHBondContact O-N 3.08Å; L205-R210 HydrophobicContact CB-CB 4.33Å; L205-R210 HydrophobicContact CD2-CB 4.1Å; L205-R210 WeakPolarHBondContact O-CA 3.44Å; L205-R210 WeakPolarHBondContact O-CB 3.43Å; L205-R210 PolarHBondContact O-N 3.3Å; L205-E213 HydrophobicContact CD1-CB 4.06Å; L205-E213 HydrophobicContact CD2-CB 4.35Å; L205-A214 HydrophobicContact CB-CB 4.05Å; L205-L217 HydrophobicContact CD1-CD1 3.6Å
206	V	97.2	Very high	94.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.6	-46	174.4	171.9	0	0	0	0	110.5	V202 L203 S204 Q208 A209 A214 L236 I294 I297 L298 Y330	V202-V206 WeakPolarHBondContact O-CG2 3.46Å; V202-V206 PolarHBondContact O-N 3.32Å; L203-V206 PolarHBondContact O-N 3.32Å; S204-V206 VanDerWaalsContact C-N 3.34Å; S204-V206 PolarHBondContact O-N 3.17Å; V206-Q208 PolarHBondContact O-N 3.13Å; V206-A209 WeakPolarHBondContact O-CA 3.41Å; V206-A209 PolarHBondContact O-N 3.14Å; V206-A214 HydrophobicContact CG2-CB 3.8Å; V206-L236 HydrophobicContact CG2-CD2 3.88Å; V206-I294 HydrophobicContact CG1-CG2 4.3Å; V206-I294 HydrophobicContact CG2-CG2 4.1Å; V206-I297 HydrophobicContact CG1-CG2 4.45Å; V206-L298 HydrophobicContact CG1-CD2 3.96Å; V206-Y330 HydrophobicContact CG1-CE2 4.49Å; V206-Y330 WeakPolarHBondContact CG1-OH 3.37Å; V206-Y330 PolarHBondContact O-OH 3.18Å
207	L	96.5	Very high	94.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.3	-32.1	177.8	-67.3	173.4	0	0	0	112.4	F154 L203 S204 A209 I297 W305 I310 V313 T314 S326	F154-L207 HydrophobicContact CE1-CB 4.07Å; L203-L207 HydrophobicContact CD1-CG 4.49Å; L203-L207 HydrophobicContact CG-CD1 4.25Å; L203-L207 WeakPolarHBondContact O-CG 3.27Å; L203-L207 PolarHBondContact O-N 3.07Å; S204-L207 PolarHBondContact O-N 3.21Å; L207-A209 PolarHBondContact O-N 3.47Å; L207-I297 HydrophobicContact CD2-CD1 4Å; L207-I297 HydrophobicContact CD2-CG2 4.37Å; L207-W305 HydrophobicContact CD2-CH2 3.87Å; L207-W305 HydrophobicContact CD2-CZ3 3.76Å; L207-I310 HydrophobicContact CD1-CG2 4.02Å; L207-I310 HydrophobicContact CD2-CG2 4.44Å; L207-V313 HydrophobicContact CD1-CG2 3.5Å; L207-V313 VanDerWaalsContact CD1-CG2 3.5Å; L207-T314 HydrophobicContact CD1-CG2 3.81Å; L207-S326 PolarHBondContact O-OG 3.34Å; L207-S326 VanDerWaalsContact O-OG 3.07Å
208	Q	95	Very high	95	Very high	3 Å²	3	19.2 Å²	19.2	1%	0.014	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	8.3	173.3	-65.9	175.9	3.4	0	0	114	F154 S158 S204 L205 V206 R210	F154-Q208 HydrophobicContact CD1-CG 3.67Å; F154-Q208 HydrophobicContact CD2-CG 4.25Å; F154-Q208 HydrophobicContact CE1-CG 3.66Å; F154-Q208 HydrophobicContact CE2-CG 4.22Å; F154-Q208 HydrophobicContact CG-CG 3.97Å; F154-Q208 HydrophobicContact CZ-CG 3.92Å; S158-Q208 PolarHBondContact O-NE2 3.08Å; S204-Q208 VanDerWaalsContact O-CG 3.3Å; S204-Q208 WeakPolarHBondContact O-CG 3.2Å; S204-Q208 PolarHBondContact O-N 3.18Å; L205-Q208 CarbonylContact O-C 3.4Å; L205-Q208 PolarHBondContact O-N 2.7Å; V206-Q208 PolarHBondContact O-N 3.13Å; Q208-R210 HydrophobicContact CB-CG 4.11Å; Q208-R210 PolarHBondContact O-N 2.96Å
209	A	93.6	Very high	94.9	Very high	11 Å²	11	22.4 Å²	22.4	9%	0.091	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	22.8	-175.3	0	0	0	0	0	115.1	C151 L205 V206 L207 C211 F329	C151-A209 HydrophobicContact CB-CB 3.96Å; L205-A209 PolarHBondContact O-N 3.08Å; V206-A209 WeakPolarHBondContact O-CA 3.41Å; V206-A209 PolarHBondContact O-N 3.14Å; L207-A209 PolarHBondContact O-N 3.47Å; A209-C211 VanDerWaalsContact C-N 3.27Å; A209-C211 PolarHBondContact O-N 2.87Å; A209-F329 HydrophobicContact CB-CD1 4.1Å; A209-F329 HydrophobicContact CB-CD2 4.25Å; A209-F329 HydrophobicContact CB-CE1 3.56Å; A209-F329 HydrophobicContact CB-CE2 3.74Å; A209-F329 HydrophobicContact CB-CG 4.43Å; A209-F329 HydrophobicContact CB-CZ 3.38Å
210	R	93.9	Very high	94.6	Very high	84 Å²	84	23.6 Å²	23.6	32%	0.317	13%	0.126	S	C	.	.			trans	-92.7	50.4	177.4	-53.7	-64.4	-81.5	-147.8	-10.2	111.2	Y155 L205 Q208 Q212 E213 A214	Y155-R210 HydrophobicContact CD2-CG 4.02Å; Y155-R210 HydrophobicContact CE2-CG 4.42Å; L205-R210 HydrophobicContact CB-CB 4.33Å; L205-R210 HydrophobicContact CD2-CB 4.1Å; L205-R210 WeakPolarHBondContact O-CA 3.44Å; L205-R210 WeakPolarHBondContact O-CB 3.43Å; L205-R210 PolarHBondContact O-N 3.3Å; Q208-R210 HydrophobicContact CB-CG 4.11Å; Q208-R210 PolarHBondContact O-N 2.96Å; R210-Q212 PolarHBondContact O-N 3.35Å; R210-Q212 VanDerWaalsContact O-N 3.13Å; R210-E213 HydrophobicContact CB-CB 4.3Å; R210-E213 HydrophobicContact CB-CG 4.48Å; R210-E213 IonicContact CZ-OE1 3.97Å; R210-E213 IonicContact NE-OE1 2.92Å; R210-E213 PolarHBondContact NE-OE1 3.02Å; R210-E213 IonicContact NH2-OE1 2.93Å; R210-E213 PolarHBondContact NH2-OE1 2.86Å; R210-E213 PolarHBondContact O-N 3.28Å; R210-A214 PolarHBondContact O-N 3.39Å; R210-A214 VanDerWaalsContact O-N 3.07Å
211	C	93.4	Very high	94.3	Very high	4 Å²	4	22 Å²	22	3%	0.027	12%	0.115	C	C	.	.	H	α-helix	trans	-57.7	-32	-173.1	-66.9	0	0	0	0	113.5	A209 A214 A215 L236 M239	A209-C211 VanDerWaalsContact C-N 3.27Å; A209-C211 PolarHBondContact O-N 2.87Å; C211-A214 PolarHBondContact O-N 3.14Å; C211-A215 VanDerWaalsContact O-CB 3.29Å; C211-A215 WeakPolarHBondContact O-CB 3.48Å; C211-A215 PolarHBondContact O-N 3.42Å; C211-L236 HydrophobicContact CB-CB 4.06Å; C211-L236 HydrophobicContact CB-CD2 3.84Å; C211-L236 VanDerWaalsContact CB-O 3.3Å; C211-L236 WeakPolarHBondContact CB-O 2.77Å; C211-M239 HydrophobicContact CB-CE 4.28Å; C211-M239 HydrophobicContact CB-SD 4.28Å; C211-M239 PolarHBondContact SG-SD 3.12Å
212	Q	92.8	Very high	93.8	Very high	129 Å²	129	24.4 Å²	24.4	60%	0.603	13%	0.132	S	C	*	.	H	α-helix	trans	-69.6	-39	177.3	-167.9	66.5	-5.9	0	0	113	R210 A215 S216	R210-Q212 PolarHBondContact O-N 3.35Å; R210-Q212 VanDerWaalsContact O-N 3.13Å; Q212-A215 PolarHBondContact O-N 3.08Å; Q212-S216 PolarHBondContact O-N 3.33Å
213	E	93.4	Very high	93.3	Very high	56 Å²	56	27.7 Å²	27.7	26%	0.262	15%	0.15	S	C	.	.	H	α-helix	trans	-68.1	-43.2	175.4	-66.2	179.4	-138.2	0	0	110.2	L205 R210 A215 S216 L217	L205-E213 HydrophobicContact CD1-CB 4.06Å; L205-E213 HydrophobicContact CD2-CB 4.35Å; R210-E213 HydrophobicContact CB-CB 4.3Å; R210-E213 HydrophobicContact CB-CG 4.48Å; R210-E213 IonicContact CZ-OE1 3.97Å; R210-E213 IonicContact NE-OE1 2.92Å; R210-E213 PolarHBondContact NE-OE1 3.02Å; R210-E213 IonicContact NH2-OE1 2.93Å; R210-E213 PolarHBondContact NH2-OE1 2.86Å; R210-E213 PolarHBondContact O-N 3.28Å; E213-A215 VanDerWaalsContact C-N 3.34Å; E213-A215 PolarHBondContact O-N 3.26Å; E213-S216 WeakPolarHBondContact O-CB 3.33Å; E213-S216 PolarHBondContact O-N 3.21Å; E213-S216 VanDerWaalsContact O-N 3.11Å; E213-S216 PolarHBondContact O-OG 3.25Å; E213-L217 PolarHBondContact O-N 2.79Å; E213-L217 VanDerWaalsContact O-N 3.11Å
214	A	95.9	Very high	92.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.6	-45.8	172.9	0	0	0	0	0	111.8	V202 L205 V206 R210 C211 S216 L217 L218 L236	V202-A214 HydrophobicContact CG1-CB 4.21Å; L205-A214 HydrophobicContact CB-CB 4.05Å; V206-A214 HydrophobicContact CG2-CB 3.8Å; R210-A214 PolarHBondContact O-N 3.39Å; R210-A214 VanDerWaalsContact O-N 3.07Å; C211-A214 PolarHBondContact O-N 3.14Å; A214-S216 PolarHBondContact O-N 3.13Å; A214-L217 PolarHBondContact O-N 3.27Å; A214-L218 WeakPolarHBondContact O-CG 3.38Å; A214-L218 PolarHBondContact O-N 3.19Å; A214-L218 VanDerWaalsContact O-N 3.12Å; A214-L236 HydrophobicContact CB-CD1 4.32Å
215	A	94.9	Very high	92.3	Very high	8 Å²	8	33.6 Å²	33.6	7%	0.066	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-29.2	177.5	0	0	0	0	0	113.2	C211 Q212 E213 R233 L236	C211-A215 VanDerWaalsContact O-CB 3.29Å; C211-A215 WeakPolarHBondContact O-CB 3.48Å; C211-A215 PolarHBondContact O-N 3.42Å; Q212-A215 PolarHBondContact O-N 3.08Å; E213-A215 VanDerWaalsContact C-N 3.34Å; E213-A215 PolarHBondContact O-N 3.26Å; A215-R233 HydrophobicContact CB-CG 4.46Å; A215-R233 PolarHBondContact O-NE 2.69Å; A215-L236 HydrophobicContact CB-CB 4.05Å; A215-L236 HydrophobicContact CB-CD1 4.24Å
216	S	92.8	Very high	91.8	Very high	51 Å²	51	34.9 Å²	34.9	36%	0.357	20%	0.196	S	C	.	.	H	α-helix	trans	-72.5	-41.1	175.7	78.6	0	0	0	0	112.3	Q212 E213 A214 L218 V219	Q212-S216 PolarHBondContact O-N 3.33Å; E213-S216 WeakPolarHBondContact O-CB 3.33Å; E213-S216 PolarHBondContact O-N 3.21Å; E213-S216 VanDerWaalsContact O-N 3.11Å; E213-S216 PolarHBondContact O-OG 3.25Å; A214-S216 PolarHBondContact O-N 3.13Å; S216-L218 VanDerWaalsContact C-N 3.34Å; S216-L218 PolarHBondContact O-N 3.23Å; S216-V219 VanDerWaalsContact O-CB 3.31Å; S216-V219 WeakPolarHBondContact O-CB 3.41Å; S216-V219 WeakPolarHBondContact O-CG2 3.18Å; S216-V219 PolarHBondContact O-N 3.23Å
217	L	92.9	Very high	91.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-39.1	174.7	-76.1	176.3	0	0	0	112	A165 I168 L169 F198 T201 V202 L205 E213 A214 V219 L220	A165-L217 HydrophobicContact CB-CD1 3.79Å; A165-L217 HydrophobicContact CB-CD2 4.37Å; A165-L217 HydrophobicContact CB-CG 4.37Å; I168-L217 HydrophobicContact CB-CD2 4.27Å; I168-L217 HydrophobicContact CG2-CD2 3.98Å; L169-L217 HydrophobicContact CD1-CD2 4.21Å; L169-L217 HydrophobicContact CD2-CD2 4.13Å; L169-L217 HydrophobicContact CG-CD2 3.8Å; F198-L217 HydrophobicContact CE2-CB 4.38Å; T201-L217 HydrophobicContact CG2-CD1 3.75Å; V202-L217 HydrophobicContact CG2-CB 4.01Å; V202-L217 HydrophobicContact CG2-CD1 4.11Å; L205-L217 HydrophobicContact CD1-CD1 3.6Å; E213-L217 PolarHBondContact O-N 2.79Å; E213-L217 VanDerWaalsContact O-N 3.11Å; A214-L217 PolarHBondContact O-N 3.27Å; L217-V219 PolarHBondContact O-N 2.8Å; L217-L220 HydrophobicContact CD2-CD1 4.41Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.45Å
218	L	92.8	Very high	91.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-62	-14.3	178.6	-70.6	175.2	0	0	0	113.8	F198 W199 V202 A214 S216 L220 H221 S224 L229 L232 R233 L236	F198-L218 HydrophobicContact CE1-CD2 4.5Å; F198-L218 HydrophobicContact CZ-CD2 4.45Å; W199-L218 HydrophobicContact CH2-CD2 3.76Å; W199-L218 HydrophobicContact CZ3-CD2 3.7Å; V202-L218 HydrophobicContact CG1-CD1 4.48Å; V202-L218 HydrophobicContact CG1-CD2 4.09Å; V202-L218 HydrophobicContact CG1-CG 4.22Å; V202-L218 HydrophobicContact CG2-CD2 4.31Å; A214-L218 WeakPolarHBondContact O-CG 3.38Å; A214-L218 PolarHBondContact O-N 3.19Å; A214-L218 VanDerWaalsContact O-N 3.12Å; S216-L218 VanDerWaalsContact C-N 3.34Å; S216-L218 PolarHBondContact O-N 3.23Å; L218-L220 VanDerWaalsContact C-N 3.26Å; L218-L220 PolarHBondContact O-N 2.89Å; L218-H221 WeakPolarHBondContact O-CB 3.43Å; L218-H221 PolarHBondContact O-N 2.89Å; L218-S224 WeakPolarHBondContact O-CB 3.49Å; L218-L229 HydrophobicContact CD2-CD2 3.89Å; L218-L232 HydrophobicContact CD1-CD2 3.65Å; L218-L232 HydrophobicContact CD1-CG 3.99Å; L218-R233 HydrophobicContact CB-CG 3.77Å; L218-R233 HydrophobicContact CD1-CG 3.99Å; L218-L236 HydrophobicContact CD1-CD1 3.73Å
219	V	91.5	Very high	90.9	Very high	66 Å²	66	43.3 Å²	43.3	40%	0.4	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-66.2	-31	172.1	-178.3	0	0	0	0	111.7	S216 L217 H221 S224 R233	S216-V219 VanDerWaalsContact O-CB 3.31Å; S216-V219 WeakPolarHBondContact O-CB 3.41Å; S216-V219 WeakPolarHBondContact O-CG2 3.18Å; S216-V219 PolarHBondContact O-N 3.23Å; L217-V219 PolarHBondContact O-N 2.8Å; V219-H221 VanDerWaalsContact C-N 3.26Å; V219-H221 PolarHBondContact O-N 3.34Å; V219-S224 WeakPolarHBondContact O-CB 3.37Å; V219-S224 PolarHBondContact O-OG 3.2Å; V219-R233 VanDerWaalsContact CG2-CZ 3.46Å
220	L	89.5	Confident	90.9	Very high	32 Å²	32	48.8 Å²	48.8	17%	0.168	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-74.1	-17.6	-177.5	-59	179.8	0	0	0	113.2	I168 L169 A172 W192 F198 L217 L218	I168-L220 HydrophobicContact CG2-CD1 3.72Å; L169-L220 HydrophobicContact CD2-CD1 4.06Å; A172-L220 HydrophobicContact CB-CD1 3.99Å; A172-L220 HydrophobicContact CB-CD2 3.81Å; W192-L220 HydrophobicContact CB-CB 4.25Å; W192-L220 HydrophobicContact CG-CB 4.07Å; F198-L220 HydrophobicContact CE2-CB 4.46Å; L217-L220 HydrophobicContact CD2-CD1 4.41Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.45Å; L218-L220 VanDerWaalsContact C-N 3.26Å; L218-L220 PolarHBondContact O-N 2.89Å
221	H	89.5	Confident	90.9	Very high	2 Å²	2	45 Å²	45	1%	0.009	23%	0.233	C	C	.	.	S	Bend	trans	-60.3	137.6	177.8	-170.3	-64	0	0	0	110.5	E193 F198 W199 L218 V219 N223 S224 L229 S287	E193-H221 IonicContact OE2-CG 3.76Å; F198-H221 HydrophobicContact CZ-CB 4.47Å; W199-H221 AromaticContact CZ2-CD2 3.66Å; W199-H221 AromaticContact CZ2-NE2 3.89Å; L218-H221 WeakPolarHBondContact O-CB 3.43Å; L218-H221 PolarHBondContact O-N 2.89Å; V219-H221 VanDerWaalsContact C-N 3.26Å; V219-H221 PolarHBondContact O-N 3.34Å; H221-N223 VanDerWaalsContact C-N 3.27Å; H221-N223 PolarHBondContact ND1-N 2.83Å; H221-N223 VanDerWaalsContact ND1-N 3.12Å; H221-N223 PolarHBondContact O-N 3.19Å; H221-N223 VanDerWaalsContact O-N 3.17Å; H221-S224 WeakPolarHBondContact O-CB 3.23Å; H221-S224 PolarHBondContact O-N 3.39Å; H221-S224 PolarHBondContact O-OG 3.07Å; H221-L229 HydrophobicContact CB-CD1 4.02Å; H221-L229 WeakPolarHBondContact ND1-CD1 3.24Å; H221-S287 PolarHBondContact NE2-OG 3.24Å
222	S	86.5	Confident	91	Very high	58 Å²	58	44.9 Å²	44.9	41%	0.406	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-44.9	-177.6	59.9	0	0	0	0	113.6	E193	E193-S222 WeakPolarHBondContact OE1-CB 3.45Å; E193-S222 PolarHBondContact OE1-OG 2.99Å; E193-S222 PolarHBondContact OE2-N 3.47Å; E193-S222 VanDerWaalsContact OE2-N 3.12Å
223	N	85.8	Confident	91.1	Very high	69 Å²	69	42 Å²	42	37%	0.369	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	34.3	173.9	-82	-12	0	0	0	115.6	H221 N225 G226 L229 G282	H221-N223 VanDerWaalsContact C-N 3.27Å; H221-N223 PolarHBondContact ND1-N 2.83Å; H221-N223 VanDerWaalsContact ND1-N 3.12Å; H221-N223 PolarHBondContact O-N 3.19Å; H221-N223 VanDerWaalsContact O-N 3.17Å; N223-N225 PolarHBondContact O-N 3.33Å; N223-G226 WeakPolarHBondContact O-CA 3.23Å; N223-G226 PolarHBondContact O-N 3.39Å; N223-L229 WeakPolarHBondContact O-CD1 3.47Å; N223-G282 WeakPolarHBondContact CB-O 3.48Å; N223-G282 VanDerWaalsContact CG-O 3.3Å; N223-G282 VanDerWaalsContact ND2-CA 3.28Å; N223-G282 WeakPolarHBondContact ND2-CA 3.34Å; N223-G282 PolarHBondContact ND2-O 3.44Å
224	S	86	Confident	91.2	Very high	15 Å²	15	44.6 Å²	44.6	11%	0.105	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.4	176.3	62.4	0	0	0	0	114.6	L218 V219 H221	L218-S224 WeakPolarHBondContact O-CB 3.49Å; V219-S224 WeakPolarHBondContact O-CB 3.37Å; V219-S224 PolarHBondContact O-OG 3.2Å; H221-S224 WeakPolarHBondContact O-CB 3.23Å; H221-S224 PolarHBondContact O-N 3.39Å; H221-S224 PolarHBondContact O-OG 3.07Å
225	N	86.7	Confident	91.2	Very high	117 Å²	117	44.7 Å²	44.7	63%	0.626	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.4	173.9	-75.4	-47.3	0	0	0	114.6	N223 R230	N223-N225 PolarHBondContact O-N 3.33Å; N225-R230 VanDerWaalsContact O-CZ 3.32Å; N225-R230 PolarHBondContact O-NH1 3.09Å; N225-R230 PolarHBondContact O-NH2 3.41Å; N225-R230 PolarHBondContact OD1-NH2 3.15Å
226	G	87.2	Confident	91.3	Very high	28 Å²	28	44.4 Å²	44.4	29%	0.289	23%	0.226	S	C	.	.	S	Bend	trans	-64.4	151.2	173.9	0	0	0	0	0	111.6	N223 G228 L229 R230	N223-G226 WeakPolarHBondContact O-CA 3.23Å; N223-G226 PolarHBondContact O-N 3.39Å; G226-G228 PolarHBondContact O-N 3.35Å; G226-L229 PolarHBondContact O-N 2.89Å; G226-R230 WeakPolarHBondContact O-CB 3.28Å; G226-R230 PolarHBondContact O-N 3.3Å
227	R	89.7	Confident	91.3	Very high	177 Å²	177	44.8 Å²	44.8	67%	0.668	23%	0.231	S	C	*	.	H	α-helix	trans	-56	-49.1	-176	-177	-179.9	171.8	-163.9	-4.7	112.3	R230 S231 E277	R227-R230 PolarHBondContact O-N 3.13Å; R227-S231 WeakPolarHBondContact O-CB 3.39Å; R227-S231 PolarHBondContact O-N 2.91Å; R227-E277 HydrophobicContact CG-CG 4.43Å; R227-E277 IonicContact CZ-OE1 3.98Å; R227-E277 VanDerWaalsContact CZ-OE1 3.24Å; R227-E277 IonicContact NE-OE1 2.96Å; R227-E277 PolarHBondContact NE-OE1 3.15Å; R227-E277 IonicContact NH2-OE1 2.76Å; R227-E277 PolarHBondContact NH2-OE1 3.5Å
228	G	90	Very high	91.3	Very high	3 Å²	3	47.7 Å²	47.7	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-46.4	-178.2	0	0	0	0	0	113.4	G226 S231 L232 F278	G226-G228 PolarHBondContact O-N 3.35Å; G228-S231 WeakPolarHBondContact O-CB 3.29Å; G228-S231 PolarHBondContact O-N 2.96Å; G228-L232 PolarHBondContact O-N 3.5Å; G228-F278 WeakPolarHBondContact O-CE1 3.38Å
229	L	91.4	Very high	91.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-37.8	177.9	-86.3	165.1	0	0	0	112.9	W199 L218 H221 N223 G226 S231 L232 R233 V281 I291	W199-L229 HydrophobicContact CH2-CD2 4.41Å; L218-L229 HydrophobicContact CD2-CD2 3.89Å; H221-L229 HydrophobicContact CB-CD1 4.02Å; H221-L229 WeakPolarHBondContact ND1-CD1 3.24Å; N223-L229 WeakPolarHBondContact O-CD1 3.47Å; G226-L229 PolarHBondContact O-N 2.89Å; L229-S231 VanDerWaalsContact C-N 3.33Å; L229-L232 PolarHBondContact O-N 3.08Å; L229-R233 WeakPolarHBondContact O-CB 3.35Å; L229-R233 VanDerWaalsContact O-CG 3.26Å; L229-R233 WeakPolarHBondContact O-CG 3.19Å; L229-R233 PolarHBondContact O-N 2.82Å; L229-V281 HydrophobicContact CD1-CG1 3.66Å; L229-V281 HydrophobicContact CG-CG1 3.75Å; L229-I291 HydrophobicContact CD2-CD1 3.74Å; L229-I291 HydrophobicContact CD2-CG1 4.43Å; L229-I291 HydrophobicContact CG-CD1 3.95Å
230	R	92.8	Very high	91.1	Very high	126 Å²	126	46.6 Å²	46.6	48%	0.475	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-41.8	172.8	-171.9	-179.6	-67.6	124.8	3.8	110.9	N225 G226 R227 R233 Q234	N225-R230 VanDerWaalsContact O-CZ 3.32Å; N225-R230 PolarHBondContact O-NH1 3.09Å; N225-R230 PolarHBondContact O-NH2 3.41Å; N225-R230 PolarHBondContact OD1-NH2 3.15Å; G226-R230 WeakPolarHBondContact O-CB 3.28Å; G226-R230 PolarHBondContact O-N 3.3Å; R227-R230 PolarHBondContact O-N 3.13Å; R230-R233 PolarHBondContact O-N 2.94Å; R230-Q234 WeakPolarHBondContact O-CB 3.41Å; R230-Q234 PolarHBondContact O-N 3.34Å
231	S	93.6	Very high	90.7	Very high	5 Å²	5	49 Å²	49	4%	0.035	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-46.6	176.4	-168.8	0	0	0	0	111.3	R227 G228 L229 R233 Q234 L235 R272 E277	R227-S231 WeakPolarHBondContact O-CB 3.39Å; R227-S231 PolarHBondContact O-N 2.91Å; G228-S231 WeakPolarHBondContact O-CB 3.29Å; G228-S231 PolarHBondContact O-N 2.96Å; L229-S231 VanDerWaalsContact C-N 3.33Å; S231-R233 PolarHBondContact O-N 3.24Å; S231-Q234 WeakPolarHBondContact O-CB 3.28Å; S231-Q234 PolarHBondContact O-N 3.49Å; S231-L235 WeakPolarHBondContact O-CG 3.5Å; S231-L235 PolarHBondContact O-N 3.25Å; S231-R272 WeakPolarHBondContact OG-CD 3.32Å; S231-R272 PolarHBondContact OG-NH1 3.15Å; S231-E277 WeakPolarHBondContact CB-OE2 3.47Å; S231-E277 PolarHBondContact OG-OE2 3.1Å
232	L	95.4	Very high	89.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-48	175.6	173.6	60.1	0	0	0	111.8	L218 G228 L229 Q234 L235 L236 F278 I291 I294 V295 L298	L218-L232 HydrophobicContact CD1-CD2 3.65Å; L218-L232 HydrophobicContact CD1-CG 3.99Å; G228-L232 PolarHBondContact O-N 3.5Å; L229-L232 PolarHBondContact O-N 3.08Å; L232-Q234 PolarHBondContact O-N 3.02Å; L232-L235 PolarHBondContact O-N 3.49Å; L232-L235 VanDerWaalsContact O-N 3.15Å; L232-L236 HydrophobicContact CD1-CD1 4.09Å; L232-L236 HydrophobicContact CD1-CG 4.06Å; L232-L236 HydrophobicContact CG-CD1 4.03Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.4Å; L232-F278 HydrophobicContact CB-CE1 4.14Å; L232-I291 HydrophobicContact CD2-CB 4.39Å; L232-I291 HydrophobicContact CD2-CG1 3.92Å; L232-I291 HydrophobicContact CD2-CG2 4.11Å; L232-I294 HydrophobicContact CD1-CG2 3.79Å; L232-V295 HydrophobicContact CD1-CG2 3.85Å; L232-L298 HydrophobicContact CD1-CD1 4.13Å
233	R	95.5	Very high	88.2	Confident	70 Å²	70	49.3 Å²	49.3	26%	0.264	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-36.3	177.8	-73.4	172.8	61.2	-139.2	-10.7	112	A215 L218 V219 L229 R230 S231 A237	A215-R233 HydrophobicContact CB-CG 4.46Å; A215-R233 PolarHBondContact O-NE 2.69Å; L218-R233 HydrophobicContact CB-CG 3.77Å; L218-R233 HydrophobicContact CD1-CG 3.99Å; V219-R233 VanDerWaalsContact CG2-CZ 3.46Å; L229-R233 WeakPolarHBondContact O-CB 3.35Å; L229-R233 VanDerWaalsContact O-CG 3.26Å; L229-R233 WeakPolarHBondContact O-CG 3.19Å; L229-R233 PolarHBondContact O-N 2.82Å; R230-R233 PolarHBondContact O-N 2.94Å; S231-R233 PolarHBondContact O-N 3.24Å; R233-A237 VanDerWaalsContact O-CB 3.3Å; R233-A237 WeakPolarHBondContact O-CB 3.32Å; R233-A237 PolarHBondContact O-N 3.18Å
234	Q	95.3	Very high	86.5	Confident	109 Å²	109	52.2 Å²	52.2	51%	0.509	27%	0.274	S	S	.	.	H	α-helix	trans	-64.9	-47.5	174.1	-175.7	-174.9	1.4	0	0	111.3	R230 S231 L232 L236 A237 S238	R230-Q234 WeakPolarHBondContact O-CB 3.41Å; R230-Q234 PolarHBondContact O-N 3.34Å; S231-Q234 WeakPolarHBondContact O-CB 3.28Å; S231-Q234 PolarHBondContact O-N 3.49Å; L232-Q234 PolarHBondContact O-N 3.02Å; Q234-L236 VanDerWaalsContact C-N 3.32Å; Q234-L236 PolarHBondContact O-N 3.44Å; Q234-A237 PolarHBondContact O-N 3.3Å; Q234-S238 VanDerWaalsContact O-CB 3.32Å; Q234-S238 WeakPolarHBondContact O-CB 3.24Å; Q234-S238 PolarHBondContact O-N 3.48Å; Q234-S238 PolarHBondContact O-OG 3.26Å; Q234-S238 VanDerWaalsContact O-OG 3.06Å
235	L	96.6	Very high	84.7	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-44.3	177.7	-70.3	176.8	0	0	0	111.8	S231 L232 S238 M239 W265 E268 C269 F278 L298	S231-L235 WeakPolarHBondContact O-CG 3.5Å; S231-L235 PolarHBondContact O-N 3.25Å; L232-L235 PolarHBondContact O-N 3.49Å; L232-L235 VanDerWaalsContact O-N 3.15Å; L235-S238 PolarHBondContact O-N 2.88Å; L235-S238 PolarHBondContact O-OG 2.74Å; L235-M239 PolarHBondContact O-N 2.98Å; L235-W265 PolarHBondContact O-NE1 3.22Å; L235-E268 HydrophobicContact CD2-CG 4.11Å; L235-C269 HydrophobicContact CD1-CB 4.5Å; L235-F278 HydrophobicContact CD1-CZ 3.97Å; L235-L298 HydrophobicContact CB-CD1 4.39Å
236	L	96.4	Very high	82.8	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-43.9	177.4	-71.2	172.7	0	0	0	112.1	V206 C211 A214 A215 L218 L232 Q234 S238 L298	V206-L236 HydrophobicContact CG2-CD2 3.88Å; C211-L236 HydrophobicContact CB-CB 4.06Å; C211-L236 HydrophobicContact CB-CD2 3.84Å; C211-L236 VanDerWaalsContact CB-O 3.3Å; C211-L236 WeakPolarHBondContact CB-O 2.77Å; A214-L236 HydrophobicContact CB-CD1 4.32Å; A215-L236 HydrophobicContact CB-CB 4.05Å; A215-L236 HydrophobicContact CB-CD1 4.24Å; L218-L236 HydrophobicContact CD1-CD1 3.73Å; L232-L236 HydrophobicContact CD1-CD1 4.09Å; L232-L236 HydrophobicContact CD1-CG 4.06Å; L232-L236 HydrophobicContact CG-CD1 4.03Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.4Å; Q234-L236 VanDerWaalsContact C-N 3.32Å; Q234-L236 PolarHBondContact O-N 3.44Å; L236-S238 VanDerWaalsContact C-N 3.33Å; L236-L298 HydrophobicContact CD2-CD1 3.79Å; L236-L298 HydrophobicContact CD2-CD2 3.95Å; L236-L298 HydrophobicContact CD2-CG 4.45Å; L236-L298 HydrophobicContact CG-CD1 4.33Å
237	A	93.1	Very high	80.9	Confident	58 Å²	58	63.5 Å²	63.5	48%	0.479	32%	0.318	S	S	.	.	H	α-helix	trans	-72.7	-25.3	179.6	0	0	0	0	0	113.1	R233 Q234	R233-A237 VanDerWaalsContact O-CB 3.3Å; R233-A237 WeakPolarHBondContact O-CB 3.32Å; R233-A237 PolarHBondContact O-N 3.18Å; Q234-A237 PolarHBondContact O-N 3.3Å
238	S	92.8	Very high	78.7	Confident	61 Å²	61	64.5 Å²	64.5	43%	0.427	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	3.3	179.2	70.1	0	0	0	0	113.9	Q234 L235 L236 P240 W265	Q234-S238 VanDerWaalsContact O-CB 3.32Å; Q234-S238 WeakPolarHBondContact O-CB 3.24Å; Q234-S238 PolarHBondContact O-N 3.48Å; Q234-S238 PolarHBondContact O-OG 3.26Å; Q234-S238 VanDerWaalsContact O-OG 3.06Å; L235-S238 PolarHBondContact O-N 2.88Å; L235-S238 PolarHBondContact O-OG 2.74Å; L236-S238 VanDerWaalsContact C-N 3.33Å; S238-P240 WeakPolarHBondContact O-CD 3.42Å; S238-W265 PolarHBondContact OG-NE1 3.38Å
239	M	91.8	Very high	76.7	Confident	20 Å²	20	67.6 Å²	67.6	10%	0.099	36%	0.363	C	S	.	.			trans	-56.9	123.4	178.7	-175.3	-176.5	76.8	0	0	109.6	C211 L235 V241 W262 W265 F329	C211-M239 HydrophobicContact CB-CE 4.28Å; C211-M239 HydrophobicContact CB-SD 4.28Å; C211-M239 PolarHBondContact SG-SD 3.12Å; L235-M239 PolarHBondContact O-N 2.98Å; M239-V241 PolarHBondContact O-N 2.97Å; M239-W262 HydrophobicContact CG-CH2 4.45Å; M239-W262 HydrophobicContact CG-CZ3 4.04Å; M239-W265 HydrophobicContact CB-CH2 4.4Å; M239-W265 HydrophobicContact CB-CZ2 3.86Å; M239-W265 HydrophobicContact CG-CH2 3.87Å; M239-W265 HydrophobicContact CG-CZ2 3.84Å; M239-W265 HydrophobicContact CG-CZ3 4.27Å; M239-W265 HydrophobicContact SD-CH2 4.34Å; M239-F329 HydrophobicContact CE-CE1 4.43Å; M239-F329 HydrophobicContact CE-CZ 4.15Å; M239-F329 HydrophobicContact SD-CE1 4.01Å; M239-F329 HydrophobicContact SD-CZ 4.27Å
240	P	88.4	Confident	74.7	Confident	24 Å²	24	72 Å²	72	16%	0.156	38%	0.384	C	S	.	.			trans	-61.7	130.2	176.7	-22.7	34.2	0	0	0	110.4	S238 F258 A261 W262 W265	S238-P240 WeakPolarHBondContact O-CD 3.42Å; P240-F258 HydrophobicContact CB-CD2 4.35Å; P240-F258 HydrophobicContact CB-CE2 3.83Å; P240-A261 HydrophobicContact CB-CB 4.47Å; P240-A261 HydrophobicContact CG-CB 4.26Å; P240-W262 HydrophobicContact CB-CE3 4.19Å; P240-W262 HydrophobicContact CG-CE3 4.33Å; P240-W262 WeakPolarHBondContact O-CZ3 3.41Å; P240-W265 HydrophobicContact CG-CB 4.01Å; P240-W265 HydrophobicContact CG-CG 4.32Å
241	V	79.3	Confident	73	Confident	83 Å²	83	68.1 Å²	68.1	50%	0.503	37%	0.37	S	S	.	.			trans	-108.6	127.7	176.5	-176.1	0	0	0	0	108.1	M239 S243	M239-V241 PolarHBondContact O-N 2.97Å; V241-S243 PolarHBondContact O-N 2.89Å
242	A	67.8	Low	71.3	Confident	5 Å²	5	73.5 Å²	73.5	4%	0.041	40%	0.403	C	S	.	.			trans	-66.9	88.1	168.4	0	0	0	0	0	107.8	Y145 F258	Y145-A242 HydrophobicContact CE1-CB 4.42Å; A242-F258 HydrophobicContact CB-CE2 4.09Å; A242-F258 HydrophobicContact CB-CZ 4.17Å
243	S	56.5	Low	69.7	Low	60 Å²	60	79.4 Å²	79.4	42%	0.42	43%	0.431	S	S	.	.			trans	-69.7	143.2	-179.7	85.9	0	0	0	0	109.2	Y145 V241 A245 Y254	Y145-S243 PolarHBondContact OH-O 3.23Å; V241-S243 PolarHBondContact O-N 2.89Å; S243-A245 PolarHBondContact O-N 3.4Å; S243-Y254 PolarHBondContact OG-OH 3.47Å
244	H	51.2	Low	68.4	Low	130 Å²	130	79.3 Å²	79.3	60%	0.602	43%	0.431	S	S	*	.			trans	-59.3	74.7	170.3	-64.3	-70.9	0	0	0	111.3	Y145 E246	Y145-H244 AromaticContact CE1-ND1 3.83Å; Y145-H244 WeakPolarHBondContact OH-CA 3.42Å; H244-E246 VanDerWaalsContact C-N 3.31Å; H244-E246 PolarHBondContact O-N 3.35Å; H244-E246 VanDerWaalsContact O-N 3.08Å
245	A	46.9	Very low	67.4	Low	42 Å²	42	74.9 Å²	74.9	35%	0.347	41%	0.414	S	S	.	.			trans	-77.6	91.5	165.1	0	0	0	0	0	106.6	Y145 S243 K247	Y145-A245 PolarHBondContact OH-N 3.49Å; S243-A245 PolarHBondContact O-N 3.4Å; A245-K247 PolarHBondContact O-N 3.29Å
246	E	46.9	Very low	66.6	Low	185 Å²	185	77.7 Å²	77.7	86%	0.864	44%	0.438	S	S	*	.			trans	-56.6	3.1	-178.3	-66.7	178.1	154.4	0	0	115.4	H244 E248	H244-E246 VanDerWaalsContact C-N 3.31Å; H244-E246 PolarHBondContact O-N 3.35Å; H244-E246 VanDerWaalsContact O-N 3.08Å; E246-E248 PolarHBondContact O-N 2.92Å; E246-E248 VanDerWaalsContact O-N 3.09Å
247	K	47.6	Very low	65.9	Low	170 Å²	170	83.4 Å²	83.4	74%	0.739	46%	0.464	S	S	*	.			trans	-85.6	89.5	178.2	-72.8	-173	177.2	179.9	0	110.2	A245 G249 M250	A245-K247 PolarHBondContact O-N 3.29Å; K247-G249 PolarHBondContact O-N 2.94Å; K247-M250 PolarHBondContact O-N 3.44Å
248	E	43.3	Very low	65.5	Low	198 Å²	198	81.4 Å²	81.4	93%	0.925	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.2	122.1	160.1	-96.1	179.5	152.5	0	0	110.4	E246	E246-E248 PolarHBondContact O-N 2.92Å; E246-E248 VanDerWaalsContact O-N 3.09Å
249	G	48.8	Very low	65.2	Low	69 Å²	69	80 Å²	80	71%	0.711	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	108	-10.5	173.2	0	0	0	0	0	117.1	K247	K247-G249 PolarHBondContact O-N 2.94Å
250	M	48.8	Very low	65.1	Low	91 Å²	91	86 Å²	86	45%	0.448	46%	0.463	S	S	.	.			trans	-103.1	9	-178	-73.4	-98.3	50.6	0	0	115.3	K247 T252 E253 Y254	K247-M250 PolarHBondContact O-N 3.44Å; M250-T252 VanDerWaalsContact C-N 3.26Å; M250-T252 PolarHBondContact O-N 2.96Å; M250-E253 HydrophobicContact CE-CB 4.01Å; M250-E253 HydrophobicContact CE-CG 3.95Å; M250-E253 WeakPolarHBondContact CE-OE2 3.24Å; M250-E253 PolarHBondContact O-N 3.19Å; M250-Y254 WeakPolarHBondContact O-CB 2.98Å; M250-Y254 PolarHBondContact O-N 3.27Å; M250-Y254 VanDerWaalsContact O-N 3.12Å
251	W	56.2	Low	65.2	Low	45 Å²	45	86.9 Å²	86.9	17%	0.17	47%	0.473	C	S	.	.	H	α-helix	trans	-61.3	-27.9	-178.1	-82	91	0	0	0	114.5	P142 P143 Y145 Y254 G255	P142-W251 HydrophobicContact CB-CD2 4.37Å; P143-W251 WeakPolarHBondContact O-CZ3 3.48Å; Y145-W251 AromaticContact CD2-CH2 3.98Å; Y145-W251 HydrophobicContact CD2-CH2 3.98Å; Y145-W251 HydrophobicContact CD2-CZ2 4.21Å; Y145-W251 HydrophobicContact CD2-CZ3 4.18Å; Y145-W251 HydrophobicContact CE1-CH2 4.32Å; Y145-W251 HydrophobicContact CE2-CD2 4.19Å; Y145-W251 AromaticContact CE2-CE2 3.51Å; Y145-W251 HydrophobicContact CE2-CE3 4.21Å; Y145-W251 AromaticContact CE2-CH2 3.01Å; Y145-W251 HydrophobicContact CE2-CH2 3.01Å; Y145-W251 AromaticContact CE2-CZ2 3.02Å; Y145-W251 HydrophobicContact CE2-CZ2 3.02Å; Y145-W251 AromaticContact CE2-CZ3 3.61Å; Y145-W251 HydrophobicContact CE2-CZ3 3.61Å; Y145-W251 AromaticContact CZ-CH2 3.2Å; Y145-W251 AromaticContact CZ-CZ2 3.3Å; Y145-W251 WeakPolarHBondContact OH-CH2 3.4Å; Y145-W251 WeakPolarHBondContact OH-CZ2 3.4Å; W251-Y254 HydrophobicContact CE3-CD1 4.44Å; W251-Y254 AromaticContact CH2-CD1 3.67Å; W251-Y254 HydrophobicContact CH2-CD1 3.67Å; W251-Y254 AromaticContact CH2-CE1 3.85Å; W251-Y254 HydrophobicContact CH2-CE1 3.85Å; W251-Y254 HydrophobicContact CZ2-CD1 4.29Å; W251-Y254 AromaticContact CZ3-CD1 3.82Å; W251-Y254 HydrophobicContact CZ3-CD1 3.82Å; W251-Y254 HydrophobicContact CZ3-CE1 4.25Å; W251-G255 VanDerWaalsContact O-CA 3.28Å; W251-G255 WeakPolarHBondContact O-CA 3.34Å; W251-G255 PolarHBondContact O-N 2.93Å
252	T	58.8	Low	65.8	Low	119 Å²	119	83.4 Å²	83.4	73%	0.73	45%	0.45	S	S	*	.	H	α-helix	trans	-67.1	-43.6	-178.5	47.6	0	0	0	0	112.3	M250	M250-T252 VanDerWaalsContact C-N 3.26Å; M250-T252 PolarHBondContact O-N 2.96Å
253	E	60.7	Low	67	Low	124 Å²	124	87 Å²	87	58%	0.579	47%	0.469	S	S	*	.	H	α-helix	trans	-78.4	-41.6	176.7	-67.6	-174.3	174.3	0	0	111.8	M250 Q257	M250-E253 HydrophobicContact CE-CB 4.01Å; M250-E253 HydrophobicContact CE-CG 3.95Å; M250-E253 WeakPolarHBondContact CE-OE2 3.24Å; M250-E253 PolarHBondContact O-N 3.19Å; E253-Q257 WeakPolarHBondContact O-CG 3.4Å; E253-Q257 PolarHBondContact O-N 2.89Å
254	Y	68.6	Low	68.8	Low	68 Å²	68	92 Å²	92	27%	0.267	48%	0.479	S	S	.	.	H	α-helix	trans	-68.6	-39	-179.8	-170.6	-99.1	0	0	0	112.2	S243 M250 W251 A256 Q257 F258	S243-Y254 PolarHBondContact OG-OH 3.47Å; M250-Y254 WeakPolarHBondContact O-CB 2.98Å; M250-Y254 PolarHBondContact O-N 3.27Å; M250-Y254 VanDerWaalsContact O-N 3.12Å; W251-Y254 HydrophobicContact CE3-CD1 4.44Å; W251-Y254 AromaticContact CH2-CD1 3.67Å; W251-Y254 HydrophobicContact CH2-CD1 3.67Å; W251-Y254 AromaticContact CH2-CE1 3.85Å; W251-Y254 HydrophobicContact CH2-CE1 3.85Å; W251-Y254 HydrophobicContact CZ2-CD1 4.29Å; W251-Y254 AromaticContact CZ3-CD1 3.82Å; W251-Y254 HydrophobicContact CZ3-CD1 3.82Å; W251-Y254 HydrophobicContact CZ3-CE1 4.25Å; Y254-A256 PolarHBondContact O-N 3.3Å; Y254-Q257 PolarHBondContact O-N 2.94Å; Y254-F258 VanDerWaalsContact O-CB 3.29Å; Y254-F258 WeakPolarHBondContact O-CB 3.42Å; Y254-F258 PolarHBondContact O-N 3.07Å
255	G	74.5	Confident	70.9	Confident	15 Å²	15	86.1 Å²	86.1	16%	0.155	45%	0.452	C	S	.	.	H	α-helix	trans	-63.7	-38.7	178.6	0	0	0	0	0	112.5	W251 S259	W251-G255 VanDerWaalsContact O-CA 3.28Å; W251-G255 WeakPolarHBondContact O-CA 3.34Å; W251-G255 PolarHBondContact O-N 2.93Å; G255-S259 VanDerWaalsContact O-CB 3.26Å; G255-S259 WeakPolarHBondContact O-CB 3.32Å; G255-S259 PolarHBondContact O-N 3.43Å
256	A	79.2	Confident	73.3	Confident	62 Å²	62	85.5 Å²	85.5	51%	0.512	44%	0.442	S	S	.	.	H	α-helix	trans	-66.7	-44.2	175.3	0	0	0	0	0	112.1	Y254 S259 Q260	Y254-A256 PolarHBondContact O-N 3.3Å; A256-S259 PolarHBondContact O-N 2.8Å; A256-Q260 WeakPolarHBondContact O-CB 3.41Å; A256-Q260 PolarHBondContact O-N 3.12Å
257	Q	82	Confident	75.6	Confident	123 Å²	123	80.3 Å²	80.3	58%	0.575	43%	0.426	S	S	*	.	H	α-helix	trans	-63.6	-43	176.2	-68.7	174.9	13.8	0	0	111.6	E253 Y254 Q260 A261	E253-Q257 WeakPolarHBondContact O-CG 3.4Å; E253-Q257 PolarHBondContact O-N 2.89Å; Y254-Q257 PolarHBondContact O-N 2.94Å; Q257-Q260 PolarHBondContact O-N 3.49Å; Q257-A261 WeakPolarHBondContact O-CB 3.43Å; Q257-A261 PolarHBondContact O-N 3.07Å
258	F	85	Confident	77.9	Confident	15 Å²	15	74.4 Å²	74.4	7%	0.066	40%	0.401	C	S	.	.	H	α-helix	trans	-63	-46.9	175.7	177.4	-93.7	0	0	0	111.3	P240 A242 Y254 Q260 A261 W262 Q333 L334	P240-F258 HydrophobicContact CB-CD2 4.35Å; P240-F258 HydrophobicContact CB-CE2 3.83Å; A242-F258 HydrophobicContact CB-CE2 4.09Å; A242-F258 HydrophobicContact CB-CZ 4.17Å; Y254-F258 VanDerWaalsContact O-CB 3.29Å; Y254-F258 WeakPolarHBondContact O-CB 3.42Å; Y254-F258 PolarHBondContact O-N 3.07Å; F258-Q260 VanDerWaalsContact C-N 3.29Å; F258-Q260 PolarHBondContact O-N 3.2Å; F258-A261 PolarHBondContact O-N 3.46Å; F258-A261 VanDerWaalsContact O-N 3.16Å; F258-W262 HydrophobicContact CE1-CB 4.45Å; F258-W262 HydrophobicContact CE1-CE3 4.4Å; F258-W262 AromaticContact CZ-CE3 3.82Å; F258-W262 HydrophobicContact CZ-CE3 3.82Å; F258-W262 HydrophobicContact CZ-CZ3 4.4Å; F258-W262 WeakPolarHBondContact O-CB 3.4Å; F258-W262 PolarHBondContact O-N 3.46Å; F258-Q333 HydrophobicContact CE1-CG 3.73Å; F258-Q333 HydrophobicContact CZ-CG 3.91Å; F258-L334 HydrophobicContact CD1-CD2 3.95Å; F258-L334 HydrophobicContact CE1-CD2 4.21Å
259	S	87.2	Confident	80.5	Confident	33 Å²	33	65 Å²	65	23%	0.231	36%	0.357	C	S	.	.	H	α-helix	trans	-55.3	-45.3	175.6	-170.5	0	0	0	0	111.5	G255 A256 W262 N263	G255-S259 VanDerWaalsContact O-CB 3.26Å; G255-S259 WeakPolarHBondContact O-CB 3.32Å; G255-S259 PolarHBondContact O-N 3.43Å; A256-S259 PolarHBondContact O-N 2.8Å; S259-W262 PolarHBondContact O-N 3.44Å; S259-N263 WeakPolarHBondContact O-CB 3.48Å; S259-N263 PolarHBondContact O-N 2.9Å; S259-N263 PolarHBondContact O-ND2 3.14Å; S259-N263 VanDerWaalsContact O-ND2 3.17Å
260	Q	89	Confident	82.7	Confident	144 Å²	144	66 Å²	66	67%	0.673	34%	0.343	S	S	*	.	H	α-helix	trans	-63.6	-44.6	178.1	-172.2	178.5	14.6	0	0	111.9	A256 Q257 F258 W262 Y264	A256-Q260 WeakPolarHBondContact O-CB 3.41Å; A256-Q260 PolarHBondContact O-N 3.12Å; Q257-Q260 PolarHBondContact O-N 3.49Å; F258-Q260 VanDerWaalsContact C-N 3.29Å; F258-Q260 PolarHBondContact O-N 3.2Å; Q260-W262 VanDerWaalsContact C-N 3.34Å; Q260-Y264 VanDerWaalsContact O-CB 3.29Å; Q260-Y264 WeakPolarHBondContact O-CB 3.43Å; Q260-Y264 PolarHBondContact O-N 3.25Å
261	A	90.9	Very high	85	Confident	44 Å²	44	67 Å²	67	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-40.9	176.8	0	0	0	0	0	111.9	P240 Q257 F258 W265	P240-A261 HydrophobicContact CB-CB 4.47Å; P240-A261 HydrophobicContact CG-CB 4.26Å; Q257-A261 WeakPolarHBondContact O-CB 3.43Å; Q257-A261 PolarHBondContact O-N 3.07Å; F258-A261 PolarHBondContact O-N 3.46Å; F258-A261 VanDerWaalsContact O-N 3.16Å; A261-W265 VanDerWaalsContact O-CB 3.31Å; A261-W265 WeakPolarHBondContact O-CB 3.21Å; A261-W265 PolarHBondContact O-N 3.43Å
262	W	91.6	Very high	86.8	Confident	10 Å²	10	66.6 Å²	66.6	4%	0.038	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-52.5	176.6	-172.4	-92	0	0	0	111.7	M239 P240 F258 S259 Q260 Y264 W265 Q266 F329 Q333	M239-W262 HydrophobicContact CG-CH2 4.45Å; M239-W262 HydrophobicContact CG-CZ3 4.04Å; P240-W262 HydrophobicContact CB-CE3 4.19Å; P240-W262 HydrophobicContact CG-CE3 4.33Å; P240-W262 WeakPolarHBondContact O-CZ3 3.41Å; F258-W262 HydrophobicContact CE1-CB 4.45Å; F258-W262 HydrophobicContact CE1-CE3 4.4Å; F258-W262 AromaticContact CZ-CE3 3.82Å; F258-W262 HydrophobicContact CZ-CE3 3.82Å; F258-W262 HydrophobicContact CZ-CZ3 4.4Å; F258-W262 WeakPolarHBondContact O-CB 3.4Å; F258-W262 PolarHBondContact O-N 3.46Å; S259-W262 PolarHBondContact O-N 3.44Å; Q260-W262 VanDerWaalsContact C-N 3.34Å; W262-Y264 VanDerWaalsContact C-N 3.3Å; W262-Y264 PolarHBondContact O-N 3.16Å; W262-W265 HydrophobicContact CH2-CZ3 4.13Å; W262-W265 HydrophobicContact CZ2-CZ3 4.13Å; W262-W265 HydrophobicContact CZ3-CZ3 4.42Å; W262-W265 PolarHBondContact O-N 3.23Å; W262-W265 VanDerWaalsContact O-N 3.12Å; W262-Q266 PolarHBondContact O-N 3.5Å; W262-F329 HydrophobicContact CH2-CD1 4.3Å; W262-F329 AromaticContact CH2-CE1 3.71Å; W262-F329 HydrophobicContact CH2-CE1 3.71Å; W262-F329 HydrophobicContact CH2-CZ 4.02Å; W262-F329 WeakPolarHBondContact CZ2-O 3.45Å; W262-Q333 HydrophobicContact CD2-CB 4.06Å; W262-Q333 HydrophobicContact CD2-CG 4.06Å; W262-Q333 HydrophobicContact CE3-CG 4.07Å; W262-Q333 HydrophobicContact CH2-CB 4.35Å; W262-Q333 HydrophobicContact CH2-CG 4.06Å; W262-Q333 HydrophobicContact CZ2-CB 3.83Å; W262-Q333 HydrophobicContact CZ2-CG 4.05Å; W262-Q333 HydrophobicContact CZ3-CG 4.08Å
263	N	92.8	Very high	88.4	Confident	81 Å²	81	62 Å²	62	43%	0.433	32%	0.316	S	S	.	.	H	α-helix	trans	-61.7	-39.5	179.7	-67.5	-23.4	0	0	0	111.8	S259 S267	S259-N263 WeakPolarHBondContact O-CB 3.48Å; S259-N263 PolarHBondContact O-N 2.9Å; S259-N263 PolarHBondContact O-ND2 3.14Å; S259-N263 VanDerWaalsContact O-ND2 3.17Å; N263-S267 WeakPolarHBondContact O-CB 3.3Å; N263-S267 PolarHBondContact O-N 2.76Å; N263-S267 PolarHBondContact O-OG 3.09Å
264	Y	95.1	Very high	90	Very high	163 Å²	163	60.3 Å²	60.3	64%	0.639	32%	0.318	S	S	*	.	H	α-helix	trans	-62.2	-47.7	173.7	175.2	-100.5	0	0	0	111.4	Q260 W262 S267 E268	Q260-Y264 VanDerWaalsContact O-CB 3.29Å; Q260-Y264 WeakPolarHBondContact O-CB 3.43Å; Q260-Y264 PolarHBondContact O-N 3.25Å; W262-Y264 VanDerWaalsContact C-N 3.3Å; W262-Y264 PolarHBondContact O-N 3.16Å; Y264-S267 PolarHBondContact O-N 2.92Å; Y264-E268 PolarHBondContact O-N 2.92Å
265	W	95.7	Very high	91.2	Very high	8 Å²	8	60.3 Å²	60.3	3%	0.03	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-43	178.9	172.5	81	0	0	0	112.4	L235 S238 M239 P240 A261 W262 E268 C269 L298 Y330	L235-W265 PolarHBondContact O-NE1 3.22Å; S238-W265 PolarHBondContact OG-NE1 3.38Å; M239-W265 HydrophobicContact CB-CH2 4.4Å; M239-W265 HydrophobicContact CB-CZ2 3.86Å; M239-W265 HydrophobicContact CG-CH2 3.87Å; M239-W265 HydrophobicContact CG-CZ2 3.84Å; M239-W265 HydrophobicContact CG-CZ3 4.27Å; M239-W265 HydrophobicContact SD-CH2 4.34Å; P240-W265 HydrophobicContact CG-CB 4.01Å; P240-W265 HydrophobicContact CG-CG 4.32Å; A261-W265 VanDerWaalsContact O-CB 3.31Å; A261-W265 WeakPolarHBondContact O-CB 3.21Å; A261-W265 PolarHBondContact O-N 3.43Å; W262-W265 HydrophobicContact CH2-CZ3 4.13Å; W262-W265 HydrophobicContact CZ2-CZ3 4.13Å; W262-W265 HydrophobicContact CZ3-CZ3 4.42Å; W262-W265 PolarHBondContact O-N 3.23Å; W262-W265 VanDerWaalsContact O-N 3.12Å; W265-E268 WeakPolarHBondContact O-CB 3.43Å; W265-E268 PolarHBondContact O-N 3.46Å; W265-C269 PolarHBondContact O-N 3.33Å; W265-C269 PolarHBondContact O-SG 2.76Å; W265-C269 VanDerWaalsContact O-SG 3.36Å; W265-L298 HydrophobicContact CH2-CB 3.81Å; W265-L298 HydrophobicContact CH2-CD2 3.8Å; W265-L298 HydrophobicContact CH2-CG 4.29Å; W265-L298 HydrophobicContact CZ2-CB 4.09Å; W265-L298 HydrophobicContact CZ2-CD1 4.37Å; W265-L298 HydrophobicContact CZ2-CD2 4.03Å; W265-L298 HydrophobicContact CZ2-CG 4.36Å; W265-L298 WeakPolarHBondContact CZ3-O 3.49Å; W265-Y330 HydrophobicContact CH2-CE1 4.36Å
266	Q	95.7	Very high	91.9	Very high	29 Å²	29	60.6 Å²	60.6	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-64.3	-40.8	175.1	-69.7	-164.6	-54.9	0	0	112.3	W262 E268 C269 E270 Y330	W262-Q266 PolarHBondContact O-N 3.5Å; Q266-E268 VanDerWaalsContact C-N 3.25Å; Q266-E268 PolarHBondContact O-N 3.14Å; Q266-C269 WeakPolarHBondContact O-CB 3.38Å; Q266-C269 PolarHBondContact O-N 3.05Å; Q266-E270 PolarHBondContact O-N 3.16Å; Q266-Y330 PolarHBondContact NE2-O 3.14Å
267	S	95.8	Very high	92.4	Very high	75 Å²	75	59.2 Å²	59.2	52%	0.524	31%	0.313	S	S	.	.	H	α-helix	trans	-61.3	-37.2	175.1	-59.2	0	0	0	0	111.5	N263 Y264 E270 H271	N263-S267 WeakPolarHBondContact O-CB 3.3Å; N263-S267 PolarHBondContact O-N 2.76Å; N263-S267 PolarHBondContact O-OG 3.09Å; Y264-S267 PolarHBondContact O-N 2.92Å; S267-E270 PolarHBondContact O-N 2.99Å; S267-H271 VanDerWaalsContact O-CB 3.29Å; S267-H271 WeakPolarHBondContact O-CB 3.32Å; S267-H271 PolarHBondContact O-N 3.39Å
268	E	96.5	Very high	92.8	Very high	46 Å²	46	53.4 Å²	53.4	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-67.6	-41.2	175.3	-176.1	66	-170.6	0	0	111.7	L235 Y264 W265 Q266 E270 H271 R272	L235-E268 HydrophobicContact CD2-CG 4.11Å; Y264-E268 PolarHBondContact O-N 2.92Å; W265-E268 WeakPolarHBondContact O-CB 3.43Å; W265-E268 PolarHBondContact O-N 3.46Å; Q266-E268 VanDerWaalsContact C-N 3.25Å; Q266-E268 PolarHBondContact O-N 3.14Å; E268-E270 VanDerWaalsContact C-N 3.34Å; E268-E270 PolarHBondContact O-N 3.44Å; E268-H271 PolarHBondContact O-N 2.87Å; E268-R272 WeakPolarHBondContact O-CG 3.26Å; E268-R272 PolarHBondContact O-N 3.48Å; E268-R272 IonicContact OE1-CZ 2.71Å; E268-R272 VanDerWaalsContact OE1-CZ 3.24Å; E268-R272 IonicContact OE1-NE 2.76Å; E268-R272 PolarHBondContact OE1-NE 3.23Å; E268-R272 IonicContact OE1-NH2 3.75Å; E268-R272 PolarHBondContact OE1-NH2 3.18Å
269	C	96.6	Very high	92.9	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57	-47.5	172.2	-68.4	0	0	0	0	111.3	L235 W265 Q266 R272 L273 V295 L298 S299	L235-C269 HydrophobicContact CD1-CB 4.5Å; W265-C269 PolarHBondContact O-N 3.33Å; W265-C269 PolarHBondContact O-SG 2.76Å; W265-C269 VanDerWaalsContact O-SG 3.36Å; Q266-C269 WeakPolarHBondContact O-CB 3.38Å; Q266-C269 PolarHBondContact O-N 3.05Å; C269-R272 PolarHBondContact O-N 2.71Å; C269-L273 WeakPolarHBondContact O-CB 3.26Å; C269-L273 PolarHBondContact O-N 3.49Å; C269-V295 HydrophobicContact CB-CG1 4.5Å; C269-L298 HydrophobicContact CB-CB 4.34Å; C269-S299 WeakPolarHBondContact CB-OG 3.28Å
270	E	95.9	Very high	92.4	Very high	90 Å²	90	62.6 Å²	62.6	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-67.7	-39.9	179	178.9	158.5	-131.9	0	0	112.5	Q266 S267 E268 L273 S274 S299 R301	Q266-E270 PolarHBondContact O-N 3.16Å; S267-E270 PolarHBondContact O-N 2.99Å; E268-E270 VanDerWaalsContact C-N 3.34Å; E268-E270 PolarHBondContact O-N 3.44Å; E270-L273 PolarHBondContact O-N 2.96Å; E270-S274 WeakPolarHBondContact O-CB 3.41Å; E270-S274 PolarHBondContact O-N 3.47Å; E270-S274 PolarHBondContact O-OG 2.97Å; E270-S299 PolarHBondContact N-OG 3.38Å; E270-R301 IonicContact OE1-CZ 3.34Å; E270-R301 IonicContact OE1-NE 3.62Å; E270-R301 IonicContact OE1-NH2 3.77Å; E270-R301 PolarHBondContact OE1-NH2 3.22Å
271	H	96.4	Very high	91.6	Very high	113 Å²	113	56.2 Å²	56.2	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-47.8	176.6	179	60.1	0	0	0	111.3	S267 E268 L273 S274 S275	S267-H271 VanDerWaalsContact O-CB 3.29Å; S267-H271 WeakPolarHBondContact O-CB 3.32Å; S267-H271 PolarHBondContact O-N 3.39Å; E268-H271 PolarHBondContact O-N 2.87Å; H271-L273 VanDerWaalsContact C-N 3.32Å; H271-L273 PolarHBondContact O-N 3.18Å; H271-S274 WeakPolarHBondContact CA-OG 3.45Å; H271-S274 PolarHBondContact O-N 3.1Å; H271-S274 PolarHBondContact O-OG 3.43Å; H271-S275 WeakPolarHBondContact O-CB 3.47Å; H271-S275 PolarHBondContact O-N 2.89Å
272	R	94.9	Very high	90.1	Very high	36 Å²	36	55.9 Å²	55.9	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-38	178.6	-68.3	-175.5	-169.5	-160.6	5.9	111.9	S231 E268 C269 S275 E277 F278	S231-R272 WeakPolarHBondContact OG-CD 3.32Å; S231-R272 PolarHBondContact OG-NH1 3.15Å; E268-R272 WeakPolarHBondContact O-CG 3.26Å; E268-R272 PolarHBondContact O-N 3.48Å; E268-R272 IonicContact OE1-CZ 2.71Å; E268-R272 VanDerWaalsContact OE1-CZ 3.24Å; E268-R272 IonicContact OE1-NE 2.76Å; E268-R272 PolarHBondContact OE1-NE 3.23Å; E268-R272 IonicContact OE1-NH2 3.75Å; E268-R272 PolarHBondContact OE1-NH2 3.18Å; C269-R272 PolarHBondContact O-N 2.71Å; R272-S275 PolarHBondContact O-N 3.35Å; R272-S275 PolarHBondContact O-OG 3.28Å; R272-E277 WeakPolarHBondContact CD-OE2 3.45Å; R272-E277 PolarHBondContact O-N 3.04Å; R272-F278 HydrophobicContact CB-CE2 3.75Å; R272-F278 HydrophobicContact CB-CZ 4.03Å
273	L	93.4	Very high	88.8	Confident	24 Å²	24	56.8 Å²	56.8	13%	0.126	31%	0.312	C	S	.	.	H	α-helix	trans	-62.8	-47.6	175.1	-173.7	62.3	0	0	0	112.2	C269 E270 H271 S275 G276 F278 K292 V295 N296	C269-L273 WeakPolarHBondContact O-CB 3.26Å; C269-L273 PolarHBondContact O-N 3.49Å; E270-L273 PolarHBondContact O-N 2.96Å; H271-L273 VanDerWaalsContact C-N 3.32Å; H271-L273 PolarHBondContact O-N 3.18Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 3.3Å; L273-G276 PolarHBondContact O-N 3.46Å; L273-F278 HydrophobicContact CD1-CD2 4.14Å; L273-K292 HydrophobicContact CD1-CG 4.29Å; L273-V295 HydrophobicContact CB-CG1 3.83Å; L273-V295 HydrophobicContact CD1-CB 4.34Å; L273-V295 HydrophobicContact CD1-CG1 4.18Å; L273-V295 HydrophobicContact CD2-CG1 4.35Å; L273-V295 HydrophobicContact CG-CG1 4.34Å; L273-N296 WeakPolarHBondContact CD2-OD1 3.02Å
274	S	93.8	Very high	88.2	Confident	87 Å²	87	55.7 Å²	55.7	61%	0.608	31%	0.306	S	S	*	.	H	α-helix	trans	-69.8	-26.1	179.8	56	0	0	0	0	113.3	E270 H271 G276	E270-S274 WeakPolarHBondContact O-CB 3.41Å; E270-S274 PolarHBondContact O-N 3.47Å; E270-S274 PolarHBondContact O-OG 2.97Å; H271-S274 WeakPolarHBondContact CA-OG 3.45Å; H271-S274 PolarHBondContact O-N 3.1Å; H271-S274 PolarHBondContact O-OG 3.43Å; S274-G276 PolarHBondContact O-N 2.95Å
275	S	92.8	Very high	87.7	Confident	69 Å²	69	52.8 Å²	52.8	48%	0.483	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.3	175.1	77.7	0	0	0	0	114.6	H271 R272 L273 E277	H271-S275 WeakPolarHBondContact O-CB 3.47Å; H271-S275 PolarHBondContact O-N 2.89Å; R272-S275 PolarHBondContact O-N 3.35Å; R272-S275 PolarHBondContact O-OG 3.28Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 3.3Å; S275-E277 VanDerWaalsContact C-N 3.32Å; S275-E277 PolarHBondContact OG-N 3.49Å
276	G	89.7	Confident	87.3	Confident	20 Å²	20	55.9 Å²	55.9	21%	0.206	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	15.6	-176.7	0	0	0	0	0	114.2	L273 S274 F278 D279	L273-G276 PolarHBondContact O-N 3.46Å; S274-G276 PolarHBondContact O-N 2.95Å; G276-F278 PolarHBondContact O-N 3.42Å; G276-F278 VanDerWaalsContact O-N 3.11Å; G276-D279 WeakPolarHBondContact CA-OD2 3.28Å; G276-D279 WeakPolarHBondContact O-CB 3.35Å; G276-D279 PolarHBondContact O-N 2.76Å; G276-D279 VanDerWaalsContact O-N 3.11Å
277	E	90.1	Very high	87.1	Confident	33 Å²	33	54.5 Å²	54.5	15%	0.154	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.5	-177.9	-174.7	165.8	-133.2	0	0	113.1	R227 S231 R272 S275	R227-E277 HydrophobicContact CG-CG 4.43Å; R227-E277 IonicContact CZ-OE1 3.98Å; R227-E277 VanDerWaalsContact CZ-OE1 3.24Å; R227-E277 IonicContact NE-OE1 2.96Å; R227-E277 PolarHBondContact NE-OE1 3.15Å; R227-E277 IonicContact NH2-OE1 2.76Å; R227-E277 PolarHBondContact NH2-OE1 3.5Å; S231-E277 WeakPolarHBondContact CB-OE2 3.47Å; S231-E277 PolarHBondContact OG-OE2 3.1Å; R272-E277 WeakPolarHBondContact CD-OE2 3.45Å; R272-E277 PolarHBondContact O-N 3.04Å; S275-E277 VanDerWaalsContact C-N 3.32Å; S275-E277 PolarHBondContact OG-N 3.49Å
278	F	90.9	Very high	86.9	Confident	1 Å²	1	52 Å²	52	0%	0.004	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.2	-179.2	-52	-69.8	0	0	0	114.3	G228 L232 L235 R272 L273 G276 H280 I291 K292 V295	G228-F278 WeakPolarHBondContact O-CE1 3.38Å; L232-F278 HydrophobicContact CB-CE1 4.14Å; L235-F278 HydrophobicContact CD1-CZ 3.97Å; R272-F278 HydrophobicContact CB-CE2 3.75Å; R272-F278 HydrophobicContact CB-CZ 4.03Å; L273-F278 HydrophobicContact CD1-CD2 4.14Å; G276-F278 PolarHBondContact O-N 3.42Å; G276-F278 VanDerWaalsContact O-N 3.11Å; F278-H280 VanDerWaalsContact C-N 3.27Å; F278-H280 PolarHBondContact O-N 3.31Å; F278-I291 HydrophobicContact CB-CG2 3.91Å; F278-I291 HydrophobicContact CD1-CG2 3.61Å; F278-I291 HydrophobicContact CE1-CG2 4.44Å; F278-I291 HydrophobicContact CG-CG2 3.93Å; F278-K292 HydrophobicContact CB-CG 4.49Å; F278-V295 HydrophobicContact CD1-CG2 4.44Å; F278-V295 HydrophobicContact CD2-CG1 4.36Å; F278-V295 HydrophobicContact CD2-CG2 4.1Å; F278-V295 HydrophobicContact CE1-CG2 4.13Å; F278-V295 HydrophobicContact CE2-CB 4.3Å; F278-V295 HydrophobicContact CE2-CG1 3.8Å; F278-V295 HydrophobicContact CE2-CG2 3.77Å; F278-V295 HydrophobicContact CG-CG2 4.43Å; F278-V295 HydrophobicContact CZ-CG1 4.38Å; F278-V295 HydrophobicContact CZ-CG2 3.78Å
279	D	85.4	Confident	86.7	Confident	70 Å²	70	54.8 Å²	54.8	37%	0.374	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-23.6	-176.5	-71.2	-26.7	0	0	0	113.5	G276 K292	G276-D279 WeakPolarHBondContact CA-OD2 3.28Å; G276-D279 WeakPolarHBondContact O-CB 3.35Å; G276-D279 PolarHBondContact O-N 2.76Å; G276-D279 VanDerWaalsContact O-N 3.11Å; D279-K292 WeakPolarHBondContact OD1-CE 3.35Å; D279-K292 IonicContact OD1-NZ 3.49Å; D279-K292 PolarHBondContact OD1-NZ 3.29Å
280	H	77.7	Confident	86.6	Confident	171 Å²	171	56.3 Å²	56.3	79%	0.792	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	54.5	-171.3	-58.5	79.2	0	0	0	111.5	F278 G282	F278-H280 VanDerWaalsContact C-N 3.27Å; F278-H280 PolarHBondContact O-N 3.31Å; H280-G282 PolarHBondContact O-N 3.49Å
281	V	71.8	Confident	86.5	Confident	11 Å²	11	52 Å²	52	7%	0.067	30%	0.301	C	S	.	.			trans	-78	102.4	167.9	-176.2	0	0	0	0	106.4	L229 G283 V288 I291	L229-V281 HydrophobicContact CD1-CG1 3.66Å; L229-V281 HydrophobicContact CG-CG1 3.75Å; V281-G283 PolarHBondContact O-N 3.09Å; V281-V288 HydrophobicContact CB-CG2 4.15Å; V281-I291 HydrophobicContact CB-CD1 3.97Å; V281-I291 HydrophobicContact CG1-CD1 3.67Å; V281-I291 HydrophobicContact CG2-CD1 3.67Å
282	G	60.2	Low	86.4	Confident	37 Å²	37	50 Å²	50	38%	0.381	29%	0.291	S	S	.	.	S	Bend	trans	-57.1	137.5	179.7	0	0	0	0	0	109.5	N223 H280	N223-G282 WeakPolarHBondContact CB-O 3.48Å; N223-G282 VanDerWaalsContact CG-O 3.3Å; N223-G282 VanDerWaalsContact ND2-CA 3.28Å; N223-G282 WeakPolarHBondContact ND2-CA 3.34Å; N223-G282 PolarHBondContact ND2-O 3.44Å; H280-G282 PolarHBondContact O-N 3.49Å
283	G	64.4	Low	86.5	Confident	29 Å²	29	48.5 Å²	48.5	30%	0.299	29%	0.285	S	S	.	.	S	Bend	trans	100.6	91.9	-171.9	0	0	0	0	0	109.3	V281 S287	V281-G283 PolarHBondContact O-N 3.09Å; G283-S287 WeakPolarHBondContact O-CB 3.2Å
284	D	78.5	Confident	86.7	Confident	58 Å²	58	47.3 Å²	47.3	31%	0.31	28%	0.279	S	S	.	.			trans	55.1	143.8	166.8	81.3	-91.1	0	0	0	120.5	T286 S287	D284-T286 VanDerWaalsContact C-N 3.28Å; D284-T286 PolarHBondContact O-N 3.3Å; D284-T286 WeakPolarHBondContact OD2-CA 3.24Å; D284-T286 WeakPolarHBondContact OD2-CB 3.47Å; D284-T286 PolarHBondContact OD2-N 2.96Å; D284-T286 VanDerWaalsContact OD2-N 3.07Å; D284-S287 VanDerWaalsContact CG-OG 3.26Å; D284-S287 PolarHBondContact O-N 2.93Å; D284-S287 PolarHBondContact OD1-OG 3.48Å; D284-S287 PolarHBondContact OD2-N 2.95Å; D284-S287 PolarHBondContact OD2-OG 3.14Å; D284-S287 VanDerWaalsContact OD2-OG 3.13Å
285	P	85.5	Confident	86.8	Confident	101 Å²	101	43.2 Å²	43.2	66%	0.656	25%	0.25	S	S	*	.	H	α-helix	trans	-61.3	-32.4	177.5	-22.3	32.9	0	0	0	114	S287 V288 E289	P285-S287 PolarHBondContact O-N 2.71Å; P285-V288 PolarHBondContact O-N 3.12Å; P285-E289 WeakPolarHBondContact O-CG 3.42Å; P285-E289 PolarHBondContact O-N 3.49Å; P285-E289 VanDerWaalsContact O-N 3.13Å
286	T	88.3	Confident	87	Confident	73 Å²	73	41 Å²	41	45%	0.448	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-42.8	-176.2	-56.5	0	0	0	0	110.7	D284 V288 E289 Y290	D284-T286 VanDerWaalsContact C-N 3.28Å; D284-T286 PolarHBondContact O-N 3.3Å; D284-T286 WeakPolarHBondContact OD2-CA 3.24Å; D284-T286 WeakPolarHBondContact OD2-CB 3.47Å; D284-T286 PolarHBondContact OD2-N 2.96Å; D284-T286 VanDerWaalsContact OD2-N 3.07Å; T286-V288 VanDerWaalsContact C-N 3.33Å; T286-V288 PolarHBondContact O-N 3.23Å; T286-E289 PolarHBondContact O-N 3.38Å; T286-Y290 HydrophobicContact CG2-CD2 3.77Å; T286-Y290 HydrophobicContact CG2-CE2 3.63Å; T286-Y290 WeakPolarHBondContact O-CD2 3.49Å; T286-Y290 PolarHBondContact O-N 3.05Å
287	S	89.8	Confident	87.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-42.6	174.1	-67.3	0	0	0	0	112.3	W199 H221 G283 D284 P285 E289 Y290 I291	W199-S287 WeakPolarHBondContact CZ2-OG 3.03Å; W199-S287 PolarHBondContact NE1-OG 2.89Å; W199-S287 VanDerWaalsContact NE1-OG 3.08Å; H221-S287 PolarHBondContact NE2-OG 3.24Å; G283-S287 WeakPolarHBondContact O-CB 3.2Å; D284-S287 VanDerWaalsContact CG-OG 3.26Å; D284-S287 PolarHBondContact O-N 2.93Å; D284-S287 PolarHBondContact OD1-OG 3.48Å; D284-S287 PolarHBondContact OD2-N 2.95Å; D284-S287 PolarHBondContact OD2-OG 3.14Å; D284-S287 VanDerWaalsContact OD2-OG 3.13Å; P285-S287 PolarHBondContact O-N 2.71Å; S287-E289 VanDerWaalsContact C-N 3.35Å; S287-E289 PolarHBondContact O-N 3.29Å; S287-Y290 PolarHBondContact O-N 2.93Å; S287-I291 WeakPolarHBondContact O-CB 3.39Å; S287-I291 WeakPolarHBondContact O-CD1 3.28Å; S287-I291 WeakPolarHBondContact O-CG1 3.49Å; S287-I291 PolarHBondContact O-N 2.97Å
288	V	91.5	Very high	87.7	Confident	24 Å²	24	38.6 Å²	38.6	15%	0.145	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-43.1	175.9	175.3	0	0	0	0	111.3	V281 P285 T286 I291 K292	V281-V288 HydrophobicContact CB-CG2 4.15Å; P285-V288 PolarHBondContact O-N 3.12Å; T286-V288 VanDerWaalsContact C-N 3.33Å; T286-V288 PolarHBondContact O-N 3.23Å; V288-I291 PolarHBondContact O-N 3.24Å; V288-K292 HydrophobicContact CG1-CD 4.16Å; V288-K292 WeakPolarHBondContact O-CB 3.35Å; V288-K292 WeakPolarHBondContact O-CG 3.33Å; V288-K292 PolarHBondContact O-N 3.45Å
289	E	92.8	Very high	87.9	Confident	103 Å²	103	39.2 Å²	39.2	48%	0.481	22%	0.221	S	C	.	.	H	α-helix	trans	-66.4	-44	179.9	-63.1	-177.4	-179.6	0	0	112.7	P285 T286 S287 K292 L293 R309	P285-E289 WeakPolarHBondContact O-CG 3.42Å; P285-E289 PolarHBondContact O-N 3.49Å; P285-E289 VanDerWaalsContact O-N 3.13Å; T286-E289 PolarHBondContact O-N 3.38Å; S287-E289 VanDerWaalsContact C-N 3.35Å; S287-E289 PolarHBondContact O-N 3.29Å; E289-K292 PolarHBondContact O-N 3.49Å; E289-L293 WeakPolarHBondContact O-CB 3.26Å; E289-L293 PolarHBondContact O-N 3.05Å; E289-R309 IonicContact OE2-CZ 3.79Å; E289-R309 IonicContact OE2-NH1 2.99Å; E289-R309 PolarHBondContact OE2-NH1 3.49Å
290	Y	94.6	Very high	88.3	Confident	33 Å²	33	36.8 Å²	36.8	13%	0.129	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-41.8	176.1	-85.6	-75.7	0	0	0	111.9	W199 L203 T286 S287 L293 I294 R309	W199-Y290 HydrophobicContact CB-CD1 3.81Å; W199-Y290 HydrophobicContact CB-CD2 3.5Å; W199-Y290 HydrophobicContact CB-CE1 3.82Å; W199-Y290 HydrophobicContact CB-CE2 3.52Å; W199-Y290 HydrophobicContact CB-CG 3.66Å; W199-Y290 AromaticContact CD1-CD2 3.86Å; W199-Y290 AromaticContact CD2-CD2 3.98Å; W199-Y290 HydrophobicContact CD2-CD2 3.98Å; W199-Y290 AromaticContact CD2-CG 3.87Å; W199-Y290 HydrophobicContact CD2-CG 3.87Å; W199-Y290 VanDerWaalsContact CE3-CB 3.47Å; W199-Y290 AromaticContact CE3-CG 3.98Å; W199-Y290 HydrophobicContact CE3-CG 3.98Å; W199-Y290 HydrophobicContact CG-CD1 4.38Å; W199-Y290 AromaticContact CG-CD2 3.5Å; W199-Y290 HydrophobicContact CG-CD2 3.5Å; W199-Y290 VanDerWaalsContact CG-CD2 3.5Å; W199-Y290 AromaticContact CG-CE2 3.94Å; W199-Y290 HydrophobicContact CG-CE2 3.94Å; W199-Y290 AromaticContact CG-CG 3.75Å; W199-Y290 HydrophobicContact CG-CG 3.75Å; L203-Y290 HydrophobicContact CD2-CE1 4.28Å; T286-Y290 HydrophobicContact CG2-CD2 3.77Å; T286-Y290 HydrophobicContact CG2-CE2 3.63Å; T286-Y290 WeakPolarHBondContact O-CD2 3.49Å; T286-Y290 PolarHBondContact O-N 3.05Å; S287-Y290 PolarHBondContact O-N 2.93Å; Y290-L293 PolarHBondContact O-N 2.92Å; Y290-I294 WeakPolarHBondContact O-CB 3.15Å; Y290-I294 VanDerWaalsContact O-CG1 3.26Å; Y290-I294 WeakPolarHBondContact O-CG1 3.31Å; Y290-I294 PolarHBondContact O-N 3.2Å; Y290-R309 HydrophobicContact CE1-CB 4.32Å; Y290-R309 HydrophobicContact CE1-CG 4.34Å
291	I	94.5	Very high	89	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-47.3	177.2	-71.2	168.6	0	0	0	110.3	W199 L229 L232 F278 V281 S287 V288 L293 I294 V295	W199-I291 HydrophobicContact CH2-CD1 3.86Å; W199-I291 HydrophobicContact CH2-CG1 3.53Å; W199-I291 HydrophobicContact CZ2-CD1 4.43Å; W199-I291 HydrophobicContact CZ2-CG1 4.39Å; W199-I291 HydrophobicContact CZ3-CG1 4.01Å; L229-I291 HydrophobicContact CD2-CD1 3.74Å; L229-I291 HydrophobicContact CD2-CG1 4.43Å; L229-I291 HydrophobicContact CG-CD1 3.95Å; L232-I291 HydrophobicContact CD2-CB 4.39Å; L232-I291 HydrophobicContact CD2-CG1 3.92Å; L232-I291 HydrophobicContact CD2-CG2 4.11Å; F278-I291 HydrophobicContact CB-CG2 3.91Å; F278-I291 HydrophobicContact CD1-CG2 3.61Å; F278-I291 HydrophobicContact CE1-CG2 4.44Å; F278-I291 HydrophobicContact CG-CG2 3.93Å; V281-I291 HydrophobicContact CB-CD1 3.97Å; V281-I291 HydrophobicContact CG1-CD1 3.67Å; V281-I291 HydrophobicContact CG2-CD1 3.67Å; S287-I291 WeakPolarHBondContact O-CB 3.39Å; S287-I291 WeakPolarHBondContact O-CD1 3.28Å; S287-I291 WeakPolarHBondContact O-CG1 3.49Å; S287-I291 PolarHBondContact O-N 2.97Å; V288-I291 PolarHBondContact O-N 3.24Å; I291-L293 VanDerWaalsContact C-N 3.32Å; I291-L293 PolarHBondContact O-N 3.46Å; I291-I294 PolarHBondContact O-N 2.94Å; I291-V295 HydrophobicContact CG2-CG2 4.48Å; I291-V295 VanDerWaalsContact O-CG2 3.3Å; I291-V295 WeakPolarHBondContact O-CG2 3.48Å; I291-V295 PolarHBondContact O-N 3.47Å
292	K	94.5	Very high	89.9	Confident	70 Å²	70	35.1 Å²	35.1	30%	0.304	21%	0.205	S	C	.	.	H	α-helix	trans	-60.8	-42.5	176	-75.5	-178.7	176.4	-174	0	111.5	L273 F278 D279 V288 E289 V295 N296	L273-K292 HydrophobicContact CD1-CG 4.29Å; F278-K292 HydrophobicContact CB-CG 4.49Å; D279-K292 WeakPolarHBondContact OD1-CE 3.35Å; D279-K292 IonicContact OD1-NZ 3.49Å; D279-K292 PolarHBondContact OD1-NZ 3.29Å; V288-K292 HydrophobicContact CG1-CD 4.16Å; V288-K292 WeakPolarHBondContact O-CB 3.35Å; V288-K292 WeakPolarHBondContact O-CG 3.33Å; V288-K292 PolarHBondContact O-N 3.45Å; E289-K292 PolarHBondContact O-N 3.49Å; K292-V295 PolarHBondContact O-N 3.01Å; K292-N296 WeakPolarHBondContact O-CB 3.06Å; K292-N296 PolarHBondContact O-N 3.5Å; K292-N296 PolarHBondContact O-ND2 3.34Å
293	L	96.2	Very high	91.3	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-48.5	176.9	-178	61.7	0	0	0	111.3	L203 E289 Y290 I291 V295 N296 I297 I304 D307 R309 I310	L203-L293 HydrophobicContact CD1-CD2 4.35Å; L203-L293 HydrophobicContact CD2-CD2 4.02Å; E289-L293 WeakPolarHBondContact O-CB 3.26Å; E289-L293 PolarHBondContact O-N 3.05Å; Y290-L293 PolarHBondContact O-N 2.92Å; I291-L293 VanDerWaalsContact C-N 3.32Å; I291-L293 PolarHBondContact O-N 3.46Å; L293-V295 PolarHBondContact O-N 3.48Å; L293-N296 WeakPolarHBondContact O-CB 3.13Å; L293-N296 PolarHBondContact O-N 3.1Å; L293-I297 HydrophobicContact CG-CD1 4.29Å; L293-I297 WeakPolarHBondContact O-CG1 3.28Å; L293-I297 PolarHBondContact O-N 2.86Å; L293-I304 HydrophobicContact CD1-CB 4.28Å; L293-D307 HydrophobicContact CD1-CB 4.16Å; L293-R309 HydrophobicContact CD2-CB 4.04Å; L293-I310 HydrophobicContact CD1-CD1 4.04Å; L293-I310 HydrophobicContact CD1-CG1 4.37Å; L293-I310 HydrophobicContact CD2-CG1 4.12Å
294	I	97.3	Very high	92.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.1	-49.8	177.1	-70.6	164.4	0	0	0	110.2	W199 V202 L203 V206 L232 Y290 I291 N296 I297 L298	W199-I294 HydrophobicContact CE3-CD1 4.42Å; W199-I294 HydrophobicContact CZ3-CD1 4.16Å; V202-I294 HydrophobicContact CG1-CD1 3.79Å; L203-I294 HydrophobicContact CD1-CG1 4.04Å; V206-I294 HydrophobicContact CG1-CG2 4.3Å; V206-I294 HydrophobicContact CG2-CG2 4.1Å; L232-I294 HydrophobicContact CD1-CG2 3.79Å; Y290-I294 WeakPolarHBondContact O-CB 3.15Å; Y290-I294 VanDerWaalsContact O-CG1 3.26Å; Y290-I294 WeakPolarHBondContact O-CG1 3.31Å; Y290-I294 PolarHBondContact O-N 3.2Å; I291-I294 PolarHBondContact O-N 2.94Å; I294-N296 VanDerWaalsContact C-N 3.31Å; I294-N296 PolarHBondContact O-N 3.48Å; I294-I297 WeakPolarHBondContact O-CB 3.3Å; I294-I297 PolarHBondContact O-N 3.32Å; I294-I297 VanDerWaalsContact O-N 3.08Å; I294-L298 HydrophobicContact CG2-CD1 4.16Å; I294-L298 HydrophobicContact CG2-CG 4.29Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 3.04Å
295	V	96.5	Very high	93.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-35.4	-179.4	-179.8	0	0	0	0	111.7	L232 C269 L273 F278 I291 K292 L293 I297 L298 S299	L232-V295 HydrophobicContact CD1-CG2 3.85Å; C269-V295 HydrophobicContact CB-CG1 4.5Å; L273-V295 HydrophobicContact CB-CG1 3.83Å; L273-V295 HydrophobicContact CD1-CB 4.34Å; L273-V295 HydrophobicContact CD1-CG1 4.18Å; L273-V295 HydrophobicContact CD2-CG1 4.35Å; L273-V295 HydrophobicContact CG-CG1 4.34Å; F278-V295 HydrophobicContact CD1-CG2 4.44Å; F278-V295 HydrophobicContact CD2-CG1 4.36Å; F278-V295 HydrophobicContact CD2-CG2 4.1Å; F278-V295 HydrophobicContact CE1-CG2 4.13Å; F278-V295 HydrophobicContact CE2-CB 4.3Å; F278-V295 HydrophobicContact CE2-CG1 3.8Å; F278-V295 HydrophobicContact CE2-CG2 3.77Å; F278-V295 HydrophobicContact CG-CG2 4.43Å; F278-V295 HydrophobicContact CZ-CG1 4.38Å; F278-V295 HydrophobicContact CZ-CG2 3.78Å; I291-V295 HydrophobicContact CG2-CG2 4.48Å; I291-V295 VanDerWaalsContact O-CG2 3.3Å; I291-V295 WeakPolarHBondContact O-CG2 3.48Å; I291-V295 PolarHBondContact O-N 3.47Å; K292-V295 PolarHBondContact O-N 3.01Å; L293-V295 PolarHBondContact O-N 3.48Å; V295-I297 VanDerWaalsContact C-N 3.32Å; V295-I297 PolarHBondContact O-N 3.27Å; V295-L298 PolarHBondContact O-N 2.62Å; V295-S299 WeakPolarHBondContact O-CB 3.48Å; V295-S299 PolarHBondContact O-N 3.44Å; V295-S299 PolarHBondContact O-OG 3.3Å
296	N	96.5	Very high	93.3	Very high	24 Å²	24	36 Å²	36	13%	0.128	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-40.8	172.2	-79	-65.1	0	0	0	111.7	L273 K292 L293 I294 S299 R301 I304	L273-N296 WeakPolarHBondContact CD2-OD1 3.02Å; K292-N296 WeakPolarHBondContact O-CB 3.06Å; K292-N296 PolarHBondContact O-N 3.5Å; K292-N296 PolarHBondContact O-ND2 3.34Å; L293-N296 WeakPolarHBondContact O-CB 3.13Å; L293-N296 PolarHBondContact O-N 3.1Å; I294-N296 VanDerWaalsContact C-N 3.31Å; I294-N296 PolarHBondContact O-N 3.48Å; N296-S299 PolarHBondContact O-N 2.93Å; N296-R301 PolarHBondContact O-N 3.44Å; N296-R301 WeakPolarHBondContact OD1-CD 3.18Å; N296-R301 PolarHBondContact OD1-NH1 2.93Å; N296-I304 HydrophobicContact CB-CG1 4.24Å; N296-I304 HydrophobicContact CB-CG2 3.89Å
297	I	97.2	Very high	93.4	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-51.2	174.1	-66.5	160.8	0	0	0	110.1	L203 V206 L207 L293 I294 V295 S299 G300 I304 W305 I310 Y330	L203-I297 HydrophobicContact CD1-CD1 3.58Å; V206-I297 HydrophobicContact CG1-CG2 4.45Å; L207-I297 HydrophobicContact CD2-CD1 4Å; L207-I297 HydrophobicContact CD2-CG2 4.37Å; L293-I297 HydrophobicContact CG-CD1 4.29Å; L293-I297 WeakPolarHBondContact O-CG1 3.28Å; L293-I297 PolarHBondContact O-N 2.86Å; I294-I297 WeakPolarHBondContact O-CB 3.3Å; I294-I297 PolarHBondContact O-N 3.32Å; I294-I297 VanDerWaalsContact O-N 3.08Å; V295-I297 VanDerWaalsContact C-N 3.32Å; V295-I297 PolarHBondContact O-N 3.27Å; I297-S299 PolarHBondContact O-N 2.91Å; I297-S299 VanDerWaalsContact O-N 3.15Å; I297-G300 PolarHBondContact O-N 3.18Å; I297-I304 HydrophobicContact CG1-CD1 3.58Å; I297-I304 HydrophobicContact CG1-CG1 4.46Å; I297-W305 HydrophobicContact CG2-CH2 4.31Å; I297-W305 HydrophobicContact CG2-CZ2 4.4Å; I297-I310 HydrophobicContact CD1-CD1 3.94Å; I297-I310 HydrophobicContact CD1-CG1 4.41Å; I297-I310 HydrophobicContact CG1-CD1 4.24Å; I297-Y330 HydrophobicContact CG2-CD1 4.29Å; I297-Y330 HydrophobicContact CG2-CD2 3.37Å; I297-Y330 HydrophobicContact CG2-CE1 4.44Å; I297-Y330 HydrophobicContact CG2-CE2 3.57Å; I297-Y330 HydrophobicContact CG2-CG 3.78Å
298	L	96.8	Very high	93.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-30.4	179.9	-60.1	179.5	0	0	0	112.5	V206 L232 L235 L236 W265 C269 I294 V295 G300 Y330	V206-L298 HydrophobicContact CG1-CD2 3.96Å; L232-L298 HydrophobicContact CD1-CD1 4.13Å; L235-L298 HydrophobicContact CB-CD1 4.39Å; L236-L298 HydrophobicContact CD2-CD1 3.79Å; L236-L298 HydrophobicContact CD2-CD2 3.95Å; L236-L298 HydrophobicContact CD2-CG 4.45Å; L236-L298 HydrophobicContact CG-CD1 4.33Å; W265-L298 HydrophobicContact CH2-CB 3.81Å; W265-L298 HydrophobicContact CH2-CD2 3.8Å; W265-L298 HydrophobicContact CH2-CG 4.29Å; W265-L298 HydrophobicContact CZ2-CB 4.09Å; W265-L298 HydrophobicContact CZ2-CD1 4.37Å; W265-L298 HydrophobicContact CZ2-CD2 4.03Å; W265-L298 HydrophobicContact CZ2-CG 4.36Å; W265-L298 WeakPolarHBondContact CZ3-O 3.49Å; C269-L298 HydrophobicContact CB-CB 4.34Å; I294-L298 HydrophobicContact CG2-CD1 4.16Å; I294-L298 HydrophobicContact CG2-CG 4.29Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 3.04Å; V295-L298 PolarHBondContact O-N 2.62Å; L298-G300 PolarHBondContact O-N 2.86Å; L298-Y330 HydrophobicContact CD2-CE1 3.76Å
299	S	95.6	Very high	93.7	Very high	14 Å²	14	41.7 Å²	41.7	10%	0.098	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-3.1	177.7	-50.5	0	0	0	0	113.7	C269 E270 V295 N296 I297	C269-S299 WeakPolarHBondContact CB-OG 3.28Å; E270-S299 PolarHBondContact N-OG 3.38Å; V295-S299 WeakPolarHBondContact O-CB 3.48Å; V295-S299 PolarHBondContact O-N 3.44Å; V295-S299 PolarHBondContact O-OG 3.3Å; N296-S299 PolarHBondContact O-N 2.93Å; I297-S299 PolarHBondContact O-N 2.91Å; I297-S299 VanDerWaalsContact O-N 3.15Å
300	G	94.2	Very high	93.7	Very high	19 Å²	19	36.8 Å²	36.8	20%	0.196	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	24.3	-179.6	0	0	0	0	0	114.7	I297 L298 Y330	I297-G300 PolarHBondContact O-N 3.18Å; L298-G300 PolarHBondContact O-N 2.86Å; G300-Y330 VanDerWaalsContact CA-O 3.23Å; G300-Y330 WeakPolarHBondContact CA-O 3.32Å
301	R	92.6	Very high	93.6	Very high	84 Å²	84	36.6 Å²	36.6	32%	0.317	20%	0.199	S	C	.	.			trans	-71.3	133.9	179.5	-77.7	178.2	175	-175.1	-2	111.8	E270 N296 I304 W305	E270-R301 IonicContact OE1-CZ 3.34Å; E270-R301 IonicContact OE1-NE 3.62Å; E270-R301 IonicContact OE1-NH2 3.77Å; E270-R301 PolarHBondContact OE1-NH2 3.22Å; N296-R301 PolarHBondContact O-N 3.44Å; N296-R301 WeakPolarHBondContact OD1-CD 3.18Å; N296-R301 PolarHBondContact OD1-NH1 2.93Å; R301-I304 HydrophobicContact CB-CG1 4.4Å; R301-I304 WeakPolarHBondContact O-CG1 3.47Å; R301-W305 PolarHBondContact O-NE1 3.46Å; R301-W305 VanDerWaalsContact O-NE1 3.08Å
302	T	91	Very high	93.4	Very high	64 Å²	64	41.6 Å²	41.6	39%	0.393	23%	0.225	S	C	.	.	S	Bend	trans	-87.1	-17.7	-178.3	56	0	0	0	0	113.9	I304 F327 T331	T302-I304 VanDerWaalsContact C-N 3.35Å; T302-I304 PolarHBondContact O-N 2.81Å; T302-F327 HydrophobicContact CG2-CE2 4.06Å; T302-T331 HydrophobicContact CG2-CG2 4.16Å
303	S	89	Confident	93.4	Very high	101 Å²	101	39.4 Å²	39.4	71%	0.706	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.8	-174.5	56.1	0	0	0	0	115.2
304	I	92.1	Very high	93.2	Very high	21 Å²	21	39.2 Å²	39.2	11%	0.108	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-7.3	-172.3	56.3	73.2	0	0	0	114.1	L293 N296 I297 R301 T302 D306 D307 I310	L293-I304 HydrophobicContact CD1-CB 4.28Å; N296-I304 HydrophobicContact CB-CG1 4.24Å; N296-I304 HydrophobicContact CB-CG2 3.89Å; I297-I304 HydrophobicContact CG1-CD1 3.58Å; I297-I304 HydrophobicContact CG1-CG1 4.46Å; R301-I304 HydrophobicContact CB-CG1 4.4Å; R301-I304 WeakPolarHBondContact O-CG1 3.47Å; T302-I304 VanDerWaalsContact C-N 3.35Å; T302-I304 PolarHBondContact O-N 2.81Å; I304-D306 VanDerWaalsContact C-N 3.25Å; I304-D306 PolarHBondContact O-N 2.77Å; I304-D307 WeakPolarHBondContact O-CB 3.15Å; I304-D307 PolarHBondContact O-N 3.48Å; I304-I310 HydrophobicContact CD1-CD1 3.68Å; I304-I310 WeakPolarHBondContact O-CD1 3.47Å
305	W	91.4	Very high	92.6	Very high	10 Å²	10	43.7 Å²	43.7	4%	0.038	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-12.5	-169	-68.3	96.4	0	0	0	114.6	L207 I297 R301 D307 I310 S326 F327 Y330	L207-W305 HydrophobicContact CD2-CH2 3.87Å; L207-W305 HydrophobicContact CD2-CZ3 3.76Å; I297-W305 HydrophobicContact CG2-CH2 4.31Å; I297-W305 HydrophobicContact CG2-CZ2 4.4Å; R301-W305 PolarHBondContact O-NE1 3.46Å; R301-W305 VanDerWaalsContact O-NE1 3.08Å; W305-D307 VanDerWaalsContact C-N 3.33Å; W305-I310 HydrophobicContact CE3-CD1 4.37Å; W305-I310 HydrophobicContact CE3-CG2 4.07Å; W305-I310 HydrophobicContact CZ3-CG2 4.21Å; W305-S326 VanDerWaalsContact CH2-C 3.44Å; W305-F327 AromaticContact CD1-CD2 3.62Å; W305-F327 HydrophobicContact CD2-CB 4.11Å; W305-F327 HydrophobicContact CD2-CD2 4.16Å; W305-F327 AromaticContact CE2-CD2 3.85Å; W305-F327 HydrophobicContact CE3-CB 4.3Å; W305-F327 HydrophobicContact CG-CD2 4.05Å; W305-F327 HydrophobicContact CH2-CB 4.27Å; W305-F327 VanDerWaalsContact CZ2-CA 3.46Å; W305-F327 HydrophobicContact CZ2-CB 4.08Å; W305-F327 HydrophobicContact CZ3-CB 4.37Å; W305-F327 AromaticContact NE1-CD2 3.51Å; W305-Y330 HydrophobicContact CH2-CD2 4.41Å
306	D	86.9	Confident	92.1	Very high	111 Å²	111	44.5 Å²	44.5	59%	0.594	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	0.1	171.1	-67.3	-26.7	0	0	0	112.9	I304 L308	I304-D306 VanDerWaalsContact C-N 3.25Å; I304-D306 PolarHBondContact O-N 2.77Å; D306-L308 PolarHBondContact O-N 2.73Å
307	D	91.6	Very high	91.3	Very high	42 Å²	42	46 Å²	46	23%	0.225	25%	0.254	C	S	.	.			trans	-62	127.5	177.5	-169.5	-59.7	0	0	0	110.7	L293 I304 W305 R309 I310 S311	L293-D307 HydrophobicContact CD1-CB 4.16Å; I304-D307 WeakPolarHBondContact O-CB 3.15Å; I304-D307 PolarHBondContact O-N 3.48Å; W305-D307 VanDerWaalsContact C-N 3.33Å; D307-R309 PolarHBondContact O-N 3.41Å; D307-R309 VanDerWaalsContact O-N 3.13Å; D307-R309 VanDerWaalsContact OD1-CB 3.27Å; D307-R309 WeakPolarHBondContact OD1-CB 3.44Å; D307-R309 WeakPolarHBondContact OD1-CG 3.5Å; D307-R309 IonicContact OD1-CZ 3.97Å; D307-R309 PolarHBondContact OD1-N 3.33Å; D307-R309 IonicContact OD1-NE 3.15Å; D307-R309 PolarHBondContact OD1-NE 3.09Å; D307-R309 IonicContact OD1-NH2 3.61Å; D307-R309 IonicContact OD2-CZ 3.39Å; D307-R309 IonicContact OD2-NE 3.76Å; D307-R309 PolarHBondContact OD2-NE 3.21Å; D307-R309 IonicContact OD2-NH2 2.8Å; D307-R309 PolarHBondContact OD2-NH2 2.84Å; D307-I310 HydrophobicContact CB-CD1 4.32Å; D307-I310 HydrophobicContact CB-CG1 4.25Å; D307-I310 WeakPolarHBondContact O-CB 3.42Å; D307-I310 PolarHBondContact O-N 2.83Å; D307-S311 PolarHBondContact O-N 2.7Å
308	L	91.5	Very high	90.5	Very high	120 Å²	120	53 Å²	53	63%	0.628	28%	0.28	S	S	*	.	H	α-helix	trans	-55.7	-34.9	-176.6	-172.6	67.3	0	0	0	112.1	D306 I310 S311 D312	D306-L308 PolarHBondContact O-N 2.73Å; L308-I310 VanDerWaalsContact C-N 3.31Å; L308-I310 PolarHBondContact O-N 3.39Å; L308-S311 WeakPolarHBondContact O-CB 3.29Å; L308-S311 PolarHBondContact O-N 3.39Å; L308-D312 VanDerWaalsContact O-CG 3.23Å; L308-D312 PolarHBondContact O-N 3.11Å
309	R	94.2	Very high	90.1	Very high	55 Å²	55	53 Å²	53	21%	0.208	28%	0.28	C	S	.	.	H	α-helix	trans	-66.2	-34.4	-180	-62.8	169.1	-73.1	-157.5	-1.3	112.1	L203 E289 Y290 L293 D307 V313	L203-R309 HydrophobicContact CD2-CB 4.13Å; E289-R309 IonicContact OE2-CZ 3.79Å; E289-R309 IonicContact OE2-NH1 2.99Å; E289-R309 PolarHBondContact OE2-NH1 3.49Å; Y290-R309 HydrophobicContact CE1-CB 4.32Å; Y290-R309 HydrophobicContact CE1-CG 4.34Å; L293-R309 HydrophobicContact CD2-CB 4.04Å; D307-R309 PolarHBondContact O-N 3.41Å; D307-R309 VanDerWaalsContact O-N 3.13Å; D307-R309 VanDerWaalsContact OD1-CB 3.27Å; D307-R309 WeakPolarHBondContact OD1-CB 3.44Å; D307-R309 WeakPolarHBondContact OD1-CG 3.5Å; D307-R309 IonicContact OD1-CZ 3.97Å; D307-R309 PolarHBondContact OD1-N 3.33Å; D307-R309 IonicContact OD1-NE 3.15Å; D307-R309 PolarHBondContact OD1-NE 3.09Å; D307-R309 IonicContact OD1-NH2 3.61Å; D307-R309 IonicContact OD2-CZ 3.39Å; D307-R309 IonicContact OD2-NE 3.76Å; D307-R309 PolarHBondContact OD2-NE 3.21Å; D307-R309 IonicContact OD2-NH2 2.8Å; D307-R309 PolarHBondContact OD2-NH2 2.84Å; R309-V313 WeakPolarHBondContact O-CG1 3.36Å; R309-V313 WeakPolarHBondContact O-CG2 3.47Å; R309-V313 PolarHBondContact O-N 2.69Å
310	I	94.6	Very high	89.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69.7	-43.6	174.2	-60.3	-177.8	0	0	0	109.4	L203 L207 L293 I297 I304 W305 D307 L308 D312 V313 T314 R323	L203-I310 HydrophobicContact CD2-CG1 4.46Å; L207-I310 HydrophobicContact CD1-CG2 4.02Å; L207-I310 HydrophobicContact CD2-CG2 4.44Å; L293-I310 HydrophobicContact CD1-CD1 4.04Å; L293-I310 HydrophobicContact CD1-CG1 4.37Å; L293-I310 HydrophobicContact CD2-CG1 4.12Å; I297-I310 HydrophobicContact CD1-CD1 3.94Å; I297-I310 HydrophobicContact CD1-CG1 4.41Å; I297-I310 HydrophobicContact CG1-CD1 4.24Å; I304-I310 HydrophobicContact CD1-CD1 3.68Å; I304-I310 WeakPolarHBondContact O-CD1 3.47Å; W305-I310 HydrophobicContact CE3-CD1 4.37Å; W305-I310 HydrophobicContact CE3-CG2 4.07Å; W305-I310 HydrophobicContact CZ3-CG2 4.21Å; D307-I310 HydrophobicContact CB-CD1 4.32Å; D307-I310 HydrophobicContact CB-CG1 4.25Å; D307-I310 WeakPolarHBondContact O-CB 3.42Å; D307-I310 PolarHBondContact O-N 2.83Å; L308-I310 VanDerWaalsContact C-N 3.31Å; L308-I310 PolarHBondContact O-N 3.39Å; I310-D312 PolarHBondContact O-N 2.94Å; I310-V313 WeakPolarHBondContact O-CG2 3.36Å; I310-T314 WeakPolarHBondContact O-CB 3.42Å; I310-T314 WeakPolarHBondContact O-CG2 3.37Å; I310-T314 PolarHBondContact O-N 3.34Å; I310-T314 PolarHBondContact O-OG1 3.23Å; I310-R323 HydrophobicContact CG2-CG 4.07Å
311	S	90.9	Very high	89.9	Confident	29 Å²	29	52.5 Å²	52.5	20%	0.203	27%	0.271	C	S	.	.	H	α-helix	trans	-57	-48.1	176	-167	0	0	0	0	111.5	D307 L308 V313 T314 G316	D307-S311 PolarHBondContact O-N 2.7Å; L308-S311 WeakPolarHBondContact O-CB 3.29Å; L308-S311 PolarHBondContact O-N 3.39Å; S311-V313 PolarHBondContact O-N 2.84Å; S311-T314 CarbonylContact O-C 3.46Å; S311-T314 PolarHBondContact O-N 2.72Å; S311-T314 PolarHBondContact O-OG1 2.92Å; S311-T314 VanDerWaalsContact O-OG1 3.05Å; S311-G316 WeakPolarHBondContact O-CA 3.36Å; S311-G316 PolarHBondContact O-N 3.38Å
312	D	91.2	Very high	90	Very high	104 Å²	104	48.5 Å²	48.5	56%	0.556	26%	0.256	S	S	*	.	H	α-helix	trans	-62.7	-45.5	-176.2	-69	-18.6	0	0	0	112.6	L308 I310 T314 R315	L308-D312 VanDerWaalsContact O-CG 3.23Å; L308-D312 PolarHBondContact O-N 3.11Å; I310-D312 PolarHBondContact O-N 2.94Å; D312-T314 PolarHBondContact O-N 2.91Å; D312-R315 PolarHBondContact O-N 2.82Å
313	V	93.8	Very high	90.2	Very high	25 Å²	25	46.6 Å²	46.6	15%	0.152	24%	0.241	C	C	.	.	H	α-helix	trans	-73.7	-9.8	-179.8	-58.7	0	0	0	0	113.9	P200 L203 L207 R309 I310 S311	P200-V313 HydrophobicContact CB-CG1 3.8Å; L203-V313 HydrophobicContact CD2-CG1 4.22Å; L203-V313 HydrophobicContact CD2-CG2 3.95Å; L203-V313 HydrophobicContact CG-CG2 4.06Å; L207-V313 HydrophobicContact CD1-CG2 3.5Å; L207-V313 VanDerWaalsContact CD1-CG2 3.5Å; R309-V313 WeakPolarHBondContact O-CG1 3.36Å; R309-V313 WeakPolarHBondContact O-CG2 3.47Å; R309-V313 PolarHBondContact O-N 2.69Å; I310-V313 WeakPolarHBondContact O-CG2 3.36Å; S311-V313 PolarHBondContact O-N 2.84Å
314	T	91.8	Very high	90.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	32.1	178.4	55.2	0	0	0	0	112.1	F154 L207 I310 S311 D312 G316 G319 F322 R323	F154-T314 HydrophobicContact CE1-CG2 4.33Å; F154-T314 HydrophobicContact CZ-CG2 4.03Å; L207-T314 HydrophobicContact CD1-CG2 3.81Å; I310-T314 WeakPolarHBondContact O-CB 3.42Å; I310-T314 WeakPolarHBondContact O-CG2 3.37Å; I310-T314 PolarHBondContact O-N 3.34Å; I310-T314 PolarHBondContact O-OG1 3.23Å; S311-T314 CarbonylContact O-C 3.46Å; S311-T314 PolarHBondContact O-N 2.72Å; S311-T314 PolarHBondContact O-OG1 2.92Å; S311-T314 VanDerWaalsContact O-OG1 3.05Å; D312-T314 PolarHBondContact O-N 2.91Å; T314-G316 VanDerWaalsContact C-N 3.31Å; T314-G316 PolarHBondContact O-N 3.44Å; T314-G319 CarbonylContact O-C 3.58Å; T314-G319 WeakPolarHBondContact O-CA 3.15Å; T314-F322 HydrophobicContact CG2-CB 4.49Å; T314-R323 HydrophobicContact CG2-CG 3.6Å; T314-R323 VanDerWaalsContact OG1-CD 3.23Å; T314-R323 WeakPolarHBondContact OG1-CD 3.41Å; T314-R323 WeakPolarHBondContact OG1-CG 3.4Å; T314-R323 PolarHBondContact OG1-NH1 3.09Å
315	R	86.1	Confident	90.6	Very high	93 Å²	93	40.8 Å²	40.8	35%	0.351	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	27.4	178.5	-51.9	-173.1	174.3	167.7	-1.5	114.6	Q157 E160 D312	Q157-R315 PolarHBondContact O-NH2 3.41Å; E160-R315 IonicContact OE1-CZ 3.34Å; E160-R315 IonicContact OE1-NE 3.06Å; E160-R315 IonicContact OE1-NH2 3.47Å; E160-R315 PolarHBondContact OE1-NH2 3.36Å; E160-R315 IonicContact OE2-NH2 2.72Å; D312-R315 PolarHBondContact O-N 2.82Å
316	G	85.3	Confident	90.8	Very high	17 Å²	17	40.3 Å²	40.3	18%	0.175	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	62.4	-143.9	175.8	0	0	0	0	0	112.5	S311 T314 R318 G319 R323	S311-G316 WeakPolarHBondContact O-CA 3.36Å; S311-G316 PolarHBondContact O-N 3.38Å; T314-G316 VanDerWaalsContact C-N 3.31Å; T314-G316 PolarHBondContact O-N 3.44Å; G316-R318 PolarHBondContact O-N 2.95Å; G316-G319 PolarHBondContact O-N 3.4Å; G316-R323 PolarHBondContact O-NH1 3.35Å; G316-R323 PolarHBondContact O-NH2 3.27Å
317	S	80.9	Confident	91.2	Very high	55 Å²	55	35 Å²	35	39%	0.385	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-55	-39.4	-179.9	56.5	0	0	0	0	112.6	G319 M356	S317-G319 VanDerWaalsContact C-N 3.31Å; S317-G319 PolarHBondContact O-N 3.47Å; S317-M356 WeakPolarHBondContact O-CE 3.36Å
318	R	80.3	Confident	91.3	Very high	148 Å²	148	33 Å²	33	56%	0.558	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-72	-12.1	-175.4	-75.8	179	153.4	170.1	-5.9	116.1	G316 F321 D363	G316-R318 PolarHBondContact O-N 2.95Å; R318-F321 WeakPolarHBondContact O-CE1 3.44Å; R318-F321 WeakPolarHBondContact O-CZ 3.31Å; R318-D363 IonicContact CZ-OD1 2.94Å; R318-D363 IonicContact CZ-OD2 3.73Å; R318-D363 IonicContact NE-OD1 3.24Å; R318-D363 PolarHBondContact NE-OD1 3.38Å; R318-D363 IonicContact NE-OD2 3.24Å; R318-D363 PolarHBondContact NE-OD2 2.94Å; R318-D363 IonicContact NH2-OD1 2.79Å; R318-D363 PolarHBondContact NH2-OD1 3.26Å; R318-D363 IonicContact NH2-OD2 2.84Å; R318-D363 PolarHBondContact NH2-OD2 3.12Å
319	G	87.7	Confident	91.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-117.2	30.8	179.3	0	0	0	0	0	113.3	T314 G316 S317 F321 F322 R323	T314-G319 CarbonylContact O-C 3.58Å; T314-G319 WeakPolarHBondContact O-CA 3.15Å; G316-G319 PolarHBondContact O-N 3.4Å; S317-G319 VanDerWaalsContact C-N 3.31Å; S317-G319 PolarHBondContact O-N 3.47Å; G319-F321 PolarHBondContact O-N 3.02Å; G319-F321 VanDerWaalsContact O-N 3.14Å; G319-F322 WeakPolarHBondContact O-CB 3.5Å; G319-F322 PolarHBondContact O-N 3.01Å; G319-R323 PolarHBondContact O-N 3.23Å
320	W	91.9	Very high	91.5	Very high	12 Å²	12	24.8 Å²	24.8	5%	0.045	12%	0.123	C	C	.	.	H	α-helix	trans	-53.1	-34.4	177.4	72.6	-94.5	0	0	0	112.8	F322 R323 F324 L344 W347 D367 I370 F374	W320-F322 VanDerWaalsContact C-N 3.3Å; W320-F322 PolarHBondContact O-N 2.98Å; W320-R323 CarbonylContact O-C 3.09Å; W320-R323 WeakPolarHBondContact O-CA 3.33Å; W320-R323 WeakPolarHBondContact O-CB 3.37Å; W320-R323 PolarHBondContact O-N 3.33Å; W320-R323 VanDerWaalsContact O-N 3.11Å; W320-F324 HydrophobicContact CE3-CB 4.2Å; W320-F324 HydrophobicContact CZ3-CB 4.18Å; W320-F324 HydrophobicContact CZ3-CG 4.47Å; W320-F324 PolarHBondContact O-N 2.97Å; W320-L344 HydrophobicContact CH2-CD1 3.98Å; W320-L344 HydrophobicContact CZ3-CD1 3.66Å; W320-W347 HydrophobicContact CB-CH2 3.76Å; W320-W347 HydrophobicContact CB-CZ2 4.01Å; W320-W347 AromaticContact CD2-CH2 3.9Å; W320-W347 HydrophobicContact CD2-CH2 3.9Å; W320-W347 HydrophobicContact CD2-CZ3 4.13Å; W320-W347 HydrophobicContact CE3-CE3 4.03Å; W320-W347 AromaticContact CE3-CH2 3.41Å; W320-W347 HydrophobicContact CE3-CH2 3.41Å; W320-W347 VanDerWaalsContact CE3-CH2 3.41Å; W320-W347 AromaticContact CE3-CZ2 3.98Å; W320-W347 HydrophobicContact CE3-CZ2 3.98Å; W320-W347 AromaticContact CE3-CZ3 3.4Å; W320-W347 HydrophobicContact CE3-CZ3 3.4Å; W320-W347 HydrophobicContact CG-CH2 4.07Å; W320-W347 HydrophobicContact CZ3-CE3 4.15Å; W320-W347 HydrophobicContact CZ3-CH2 4.3Å; W320-W347 AromaticContact CZ3-CZ3 3.83Å; W320-W347 HydrophobicContact CZ3-CZ3 3.83Å; W320-D367 PolarHBondContact NE1-OD1 3.37Å; W320-I370 HydrophobicContact CH2-CG2 4.11Å; W320-I370 HydrophobicContact CZ2-CB 4.44Å; W320-I370 HydrophobicContact CZ2-CG2 3.99Å; W320-F374 HydrophobicContact CH2-CD2 4.3Å
321	F	93.9	Very high	91.4	Very high	11 Å²	11	27 Å²	27	5%	0.048	14%	0.136	C	C	.	.	H	α-helix	trans	-65.5	-30.5	177.7	47.7	-101.3	0	0	0	113.1	L128 W153 R318 G319 F324 V325 I370 F374	L128-F321 HydrophobicContact CD1-CE2 3.89Å; L128-F321 HydrophobicContact CD1-CZ 4.09Å; L128-F321 HydrophobicContact CD2-CE2 4.43Å; L128-F321 HydrophobicContact CD2-CZ 4.49Å; W153-F321 AromaticContact CH2-CD2 3.51Å; W153-F321 HydrophobicContact CH2-CD2 3.51Å; W153-F321 HydrophobicContact CH2-CE2 4.05Å; W153-F321 HydrophobicContact CH2-CG 4.36Å; W153-F321 HydrophobicContact CZ3-CD2 4.13Å; R318-F321 WeakPolarHBondContact O-CE1 3.44Å; R318-F321 WeakPolarHBondContact O-CZ 3.31Å; G319-F321 PolarHBondContact O-N 3.02Å; G319-F321 VanDerWaalsContact O-N 3.14Å; F321-F324 PolarHBondContact O-N 3.19Å; F321-V325 WeakPolarHBondContact O-CG2 3.46Å; F321-V325 PolarHBondContact O-N 3.47Å; F321-I370 HydrophobicContact CB-CD1 4.4Å; F321-I370 HydrophobicContact CB-CG2 3.7Å; F321-I370 HydrophobicContact CD1-CD1 3.32Å; F321-I370 HydrophobicContact CD1-CG2 4.38Å; F321-I370 HydrophobicContact CD2-CD1 4.33Å; F321-I370 HydrophobicContact CE1-CD1 3.48Å; F321-I370 VanDerWaalsContact CE1-CD1 3.48Å; F321-I370 HydrophobicContact CE2-CD1 4.45Å; F321-I370 HydrophobicContact CG-CD1 3.77Å; F321-I370 HydrophobicContact CG-CG2 4.24Å; F321-I370 HydrophobicContact CZ-CD1 4.06Å; F321-F374 HydrophobicContact CB-CE2 3.96Å
322	F	95.2	Very high	91.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-70.3	-37	172.4	-66.8	-42.6	0	0	0	111.4	L128 W153 F154 Q157 T314 G319 W320 S326	L128-F322 HydrophobicContact CD1-CE1 4.45Å; L128-F322 HydrophobicContact CD1-CZ 3.86Å; W153-F322 HydrophobicContact CE3-CD1 4.11Å; W153-F322 HydrophobicContact CE3-CE1 4.03Å; W153-F322 AromaticContact CH2-CD1 3.89Å; W153-F322 HydrophobicContact CH2-CD1 3.89Å; W153-F322 AromaticContact CH2-CE1 3.65Å; W153-F322 HydrophobicContact CH2-CE1 3.65Å; W153-F322 HydrophobicContact CZ2-CE1 4.17Å; W153-F322 AromaticContact CZ3-CD1 3.47Å; W153-F322 HydrophobicContact CZ3-CD1 3.47Å; W153-F322 VanDerWaalsContact CZ3-CD1 3.47Å; W153-F322 AromaticContact CZ3-CE1 3.56Å; W153-F322 HydrophobicContact CZ3-CE1 3.56Å; F154-F322 HydrophobicContact CB-CD1 3.86Å; F154-F322 HydrophobicContact CB-CE1 4.34Å; F154-F322 HydrophobicContact CD1-CB 4.07Å; F154-F322 HydrophobicContact CD1-CD1 4.49Å; F154-F322 HydrophobicContact CD2-CB 3.69Å; F154-F322 AromaticContact CD2-CD1 3.16Å; F154-F322 HydrophobicContact CD2-CD1 3.16Å; F154-F322 AromaticContact CD2-CD2 3.94Å; F154-F322 HydrophobicContact CD2-CD2 3.94Å; F154-F322 AromaticContact CD2-CE1 3.63Å; F154-F322 HydrophobicContact CD2-CE1 3.63Å; F154-F322 HydrophobicContact CD2-CE2 4.3Å; F154-F322 AromaticContact CD2-CG 3.34Å; F154-F322 HydrophobicContact CD2-CG 3.34Å; F154-F322 HydrophobicContact CD2-CZ 4.16Å; F154-F322 HydrophobicContact CE1-CB 3.96Å; F154-F322 HydrophobicContact CE2-CB 3.6Å; F154-F322 AromaticContact CE2-CD1 3.84Å; F154-F322 HydrophobicContact CE2-CD1 3.84Å; F154-F322 AromaticContact CE2-CD2 3.76Å; F154-F322 HydrophobicContact CE2-CD2 3.76Å; F154-F322 HydrophobicContact CE2-CE1 4.4Å; F154-F322 HydrophobicContact CE2-CE2 4.31Å; F154-F322 AromaticContact CE2-CG 3.48Å; F154-F322 HydrophobicContact CE2-CG 3.48Å; F154-F322 VanDerWaalsContact CE2-CG 3.48Å; F154-F322 HydrophobicContact CG-CB 3.97Å; F154-F322 AromaticContact CG-CD1 3.59Å; F154-F322 HydrophobicContact CG-CD1 3.59Å; F154-F322 HydrophobicContact CG-CE1 4.28Å; F154-F322 AromaticContact CG-CG 3.96Å; F154-F322 HydrophobicContact CG-CG 3.96Å; F154-F322 HydrophobicContact CZ-CB 3.75Å; F154-F322 HydrophobicContact CZ-CG 4.16Å; Q157-F322 HydrophobicContact CB-CE1 3.89Å; Q157-F322 HydrophobicContact CB-CZ 3.73Å; T314-F322 HydrophobicContact CG2-CB 4.49Å; G319-F322 WeakPolarHBondContact O-CB 3.5Å; G319-F322 PolarHBondContact O-N 3.01Å; W320-F322 VanDerWaalsContact C-N 3.3Å; W320-F322 PolarHBondContact O-N 2.98Å; F322-S326 PolarHBondContact O-N 3.26Å; F322-S326 VanDerWaalsContact O-N 3.11Å; F322-S326 PolarHBondContact O-OG 3.34Å
323	R	94.2	Very high	91.1	Very high	24 Å²	24	23.2 Å²	23.2	9%	0.091	11%	0.114	C	C	.	.	H	α-helix	trans	-64.5	-44	170.8	-66.8	-168.4	-67.8	-75	3.7	111.5	I310 T314 G316 G319 W320 V325 S326 F327	I310-R323 HydrophobicContact CG2-CG 4.07Å; T314-R323 HydrophobicContact CG2-CG 3.6Å; T314-R323 VanDerWaalsContact OG1-CD 3.23Å; T314-R323 WeakPolarHBondContact OG1-CD 3.41Å; T314-R323 WeakPolarHBondContact OG1-CG 3.4Å; T314-R323 PolarHBondContact OG1-NH1 3.09Å; G316-R323 PolarHBondContact O-NH1 3.35Å; G316-R323 PolarHBondContact O-NH2 3.27Å; G319-R323 PolarHBondContact O-N 3.23Å; W320-R323 CarbonylContact O-C 3.09Å; W320-R323 WeakPolarHBondContact O-CA 3.33Å; W320-R323 WeakPolarHBondContact O-CB 3.37Å; W320-R323 PolarHBondContact O-N 3.33Å; W320-R323 VanDerWaalsContact O-N 3.11Å; R323-V325 PolarHBondContact O-N 3.16Å; R323-S326 WeakPolarHBondContact O-CB 3.39Å; R323-S326 PolarHBondContact O-N 2.8Å; R323-F327 WeakPolarHBondContact O-CB 3.45Å; R323-F327 PolarHBondContact O-N 3.34Å
324	F	94.8	Very high	90.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.5	-46.3	178.1	172.1	-115.2	0	0	0	111.5	W320 F321 S326 F327 V328 L340 D343 L344 W347 F374	W320-F324 HydrophobicContact CE3-CB 4.2Å; W320-F324 HydrophobicContact CZ3-CB 4.18Å; W320-F324 HydrophobicContact CZ3-CG 4.47Å; W320-F324 PolarHBondContact O-N 2.97Å; F321-F324 PolarHBondContact O-N 3.19Å; F324-S326 VanDerWaalsContact C-N 3.3Å; F324-S326 PolarHBondContact O-N 3.18Å; F324-F327 HydrophobicContact CD2-CD1 4.19Å; F324-F327 HydrophobicContact CE2-CD1 4.32Å; F324-F327 WeakPolarHBondContact O-CA 3.49Å; F324-F327 VanDerWaalsContact O-CB 3.31Å; F324-F327 WeakPolarHBondContact O-CB 3.44Å; F324-F327 PolarHBondContact O-N 2.75Å; F324-F327 VanDerWaalsContact O-N 3.12Å; F324-V328 HydrophobicContact CD2-CG2 4.01Å; F324-V328 HydrophobicContact CE1-CG2 4.08Å; F324-V328 HydrophobicContact CE2-CG2 3.43Å; F324-V328 VanDerWaalsContact CE2-CG2 3.43Å; F324-V328 HydrophobicContact CZ-CG2 3.48Å; F324-V328 VanDerWaalsContact CZ-CG2 3.48Å; F324-V328 WeakPolarHBondContact O-CG2 3.43Å; F324-V328 PolarHBondContact O-N 2.75Å; F324-L340 HydrophobicContact CE1-CD1 4.13Å; F324-L340 HydrophobicContact CZ-CD1 4.09Å; F324-D343 HydrophobicContact CE2-CB 4.25Å; F324-D343 HydrophobicContact CZ-CB 4.3Å; F324-L344 HydrophobicContact CD1-CD1 4.22Å; F324-L344 HydrophobicContact CD2-CD1 4.26Å; F324-L344 HydrophobicContact CE1-CB 4.37Å; F324-L344 HydrophobicContact CE1-CD1 4.14Å; F324-L344 HydrophobicContact CE2-CB 4.13Å; F324-L344 HydrophobicContact CE2-CD1 4.18Å; F324-L344 HydrophobicContact CG-CD1 4.27Å; F324-L344 HydrophobicContact CZ-CB 3.77Å; F324-L344 HydrophobicContact CZ-CD1 4.11Å; F324-W347 HydrophobicContact CB-CD2 4.31Å; F324-W347 HydrophobicContact CB-CG 4.39Å; F324-W347 HydrophobicContact CD2-CB 3.62Å; F324-W347 AromaticContact CD2-CD1 3.86Å; F324-W347 HydrophobicContact CD2-CD2 4.17Å; F324-W347 AromaticContact CD2-CG 3.58Å; F324-W347 HydrophobicContact CD2-CG 3.58Å; F324-W347 HydrophobicContact CE2-CB 3.92Å; F324-W347 HydrophobicContact CE2-CG 4.37Å; F324-W347 HydrophobicContact CG-CG 4.4Å; F324-F374 HydrophobicContact CD1-CD1 4.28Å; F324-F374 AromaticContact CD1-CD2 3.81Å; F324-F374 HydrophobicContact CD1-CD2 3.81Å; F324-F374 HydrophobicContact CD1-CE1 4.11Å; F324-F374 AromaticContact CD1-CE2 3.61Å; F324-F374 HydrophobicContact CD1-CE2 3.61Å; F324-F374 HydrophobicContact CD1-CG 4.15Å; F324-F374 AromaticContact CD1-CZ 3.79Å; F324-F374 HydrophobicContact CD1-CZ 3.79Å; F324-F374 HydrophobicContact CE1-CB 4.31Å; F324-F374 AromaticContact CE1-CD1 3.78Å; F324-F374 HydrophobicContact CE1-CD1 3.78Å; F324-F374 AromaticContact CE1-CD2 3.88Å; F324-F374 HydrophobicContact CE1-CD2 3.88Å; F324-F374 AromaticContact CE1-CE1 3.96Å; F324-F374 HydrophobicContact CE1-CE1 3.96Å; F324-F374 HydrophobicContact CE1-CE2 4.06Å; F324-F374 AromaticContact CE1-CG 3.75Å; F324-F374 HydrophobicContact CE1-CG 3.75Å; F324-F374 HydrophobicContact CE1-CZ 4.11Å
325	V	95.2	Very high	90.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.3	-44.2	174.6	160.8	0	0	0	0	112	L150 W153 F154 F321 R323 F327 V328 F329 F374	L150-V325 HydrophobicContact CB-CB 4.39Å; L150-V325 HydrophobicContact CB-CG1 3.67Å; L150-V325 HydrophobicContact CB-CG2 3.97Å; L150-V325 HydrophobicContact CD2-CG2 4.35Å; L150-V325 WeakPolarHBondContact O-CG1 3.45Å; W153-V325 HydrophobicContact CE3-CG2 4.12Å; W153-V325 HydrophobicContact CZ3-CG2 3.88Å; F154-V325 HydrophobicContact CB-CG1 4.33Å; F321-V325 WeakPolarHBondContact O-CG2 3.46Å; F321-V325 PolarHBondContact O-N 3.47Å; R323-V325 PolarHBondContact O-N 3.16Å; V325-F327 VanDerWaalsContact C-N 3.34Å; V325-V328 PolarHBondContact O-N 3.07Å; V325-F329 PolarHBondContact O-N 3.36Å; V325-F374 HydrophobicContact CG2-CE1 4.29Å; V325-F374 HydrophobicContact CG2-CZ 3.84Å
326	S	95.3	Very high	90.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66	-38.5	177.4	-50.7	0	0	0	0	111.6	L207 W305 F322 R323 F324 F329 Y330	L207-S326 PolarHBondContact O-OG 3.34Å; L207-S326 VanDerWaalsContact O-OG 3.07Å; W305-S326 VanDerWaalsContact CH2-C 3.44Å; F322-S326 PolarHBondContact O-N 3.26Å; F322-S326 VanDerWaalsContact O-N 3.11Å; F322-S326 PolarHBondContact O-OG 3.34Å; R323-S326 WeakPolarHBondContact O-CB 3.39Å; R323-S326 PolarHBondContact O-N 2.8Å; F324-S326 VanDerWaalsContact C-N 3.3Å; F324-S326 PolarHBondContact O-N 3.18Å; S326-F329 PolarHBondContact O-N 3.45Å; S326-Y330 VanDerWaalsContact O-CD2 3.24Å; S326-Y330 WeakPolarHBondContact O-CD2 3.45Å; S326-Y330 PolarHBondContact O-N 2.85Å; S326-Y330 VanDerWaalsContact O-N 3.16Å
327	F	95.4	Very high	90.8	Very high	1 Å²	1	25.7 Å²	25.7	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-57.7	-56.2	174.4	166.1	-93	0	0	0	110	T302 W305 R323 F324 V325 F329 Y330 T331 W347 L350	T302-F327 HydrophobicContact CG2-CE2 4.06Å; W305-F327 AromaticContact CD1-CD2 3.62Å; W305-F327 HydrophobicContact CD2-CB 4.11Å; W305-F327 HydrophobicContact CD2-CD2 4.16Å; W305-F327 AromaticContact CE2-CD2 3.85Å; W305-F327 HydrophobicContact CE3-CB 4.3Å; W305-F327 HydrophobicContact CG-CD2 4.05Å; W305-F327 HydrophobicContact CH2-CB 4.27Å; W305-F327 VanDerWaalsContact CZ2-CA 3.46Å; W305-F327 HydrophobicContact CZ2-CB 4.08Å; W305-F327 HydrophobicContact CZ3-CB 4.37Å; W305-F327 AromaticContact NE1-CD2 3.51Å; R323-F327 WeakPolarHBondContact O-CB 3.45Å; R323-F327 PolarHBondContact O-N 3.34Å; F324-F327 HydrophobicContact CD2-CD1 4.19Å; F324-F327 HydrophobicContact CE2-CD1 4.32Å; F324-F327 WeakPolarHBondContact O-CA 3.49Å; F324-F327 VanDerWaalsContact O-CB 3.31Å; F324-F327 WeakPolarHBondContact O-CB 3.44Å; F324-F327 PolarHBondContact O-N 2.75Å; F324-F327 VanDerWaalsContact O-N 3.12Å; V325-F327 VanDerWaalsContact C-N 3.34Å; F327-F329 VanDerWaalsContact C-N 3.29Å; F327-F329 PolarHBondContact O-N 3.46Å; F327-Y330 PolarHBondContact O-N 3.44Å; F327-Y330 VanDerWaalsContact O-N 3.11Å; F327-T331 HydrophobicContact CD2-CG2 3.87Å; F327-T331 HydrophobicContact CE2-CG2 3.76Å; F327-T331 HydrophobicContact CG-CG2 4.44Å; F327-T331 HydrophobicContact CZ-CG2 4.24Å; F327-T331 WeakPolarHBondContact O-CB 3.3Å; F327-T331 WeakPolarHBondContact O-CG2 3.29Å; F327-T331 PolarHBondContact O-N 3.2Å; F327-T331 PolarHBondContact O-OG1 2.89Å; F327-W347 HydrophobicContact CD1-CB 4.28Å; F327-W347 HydrophobicContact CE1-CB 4.19Å; F327-W347 AromaticContact CG-CD1 3.93Å; F327-L350 HydrophobicContact CE2-CD1 4.23Å; F327-L350 HydrophobicContact CZ-CD1 4.33Å
328	V	94.4	Very high	91.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-55	-45.4	178.9	173.8	0	0	0	0	111.1	F324 V325 Y330 T331 D332 V335 D343	F324-V328 HydrophobicContact CD2-CG2 4.01Å; F324-V328 HydrophobicContact CE1-CG2 4.08Å; F324-V328 HydrophobicContact CE2-CG2 3.43Å; F324-V328 VanDerWaalsContact CE2-CG2 3.43Å; F324-V328 HydrophobicContact CZ-CG2 3.48Å; F324-V328 VanDerWaalsContact CZ-CG2 3.48Å; F324-V328 WeakPolarHBondContact O-CG2 3.43Å; F324-V328 PolarHBondContact O-N 2.75Å; V325-V328 PolarHBondContact O-N 3.07Å; V328-Y330 VanDerWaalsContact C-N 3.35Å; V328-Y330 PolarHBondContact O-N 3.02Å; V328-T331 PolarHBondContact O-N 2.96Å; V328-D332 CarbonylContact O-C 3.51Å; V328-D332 WeakPolarHBondContact O-CA 3.37Å; V328-D332 PolarHBondContact O-N 3.42Å; V328-D332 VanDerWaalsContact O-O 3.13Å; V328-V335 HydrophobicContact CG1-CB 3.91Å; V328-V335 HydrophobicContact CG1-CG1 3.6Å; V328-V335 HydrophobicContact CG1-CG2 4.05Å; V328-D343 HydrophobicContact CG2-CB 4.21Å
329	F	93.8	Very high	91.5	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.009	13%	0.129	C	C	.	.	H	α-helix	trans	-57.7	-44	178.6	-175	-89.4	0	0	0	113.3	A147 F148 C151 A209 M239 W262 V325 S326 F327 Q333	A147-F329 HydrophobicContact CB-CD2 4.15Å; F148-F329 HydrophobicContact CB-CE2 4.48Å; F148-F329 HydrophobicContact CD2-CE2 4.29Å; C151-F329 HydrophobicContact CB-CD2 4.11Å; C151-F329 WeakPolarHBondContact SG-CB 3.39Å; C151-F329 VanDerWaalsContact SG-CD2 3.53Å; C151-F329 WeakPolarHBondContact SG-CG 3.45Å; A209-F329 HydrophobicContact CB-CD1 4.1Å; A209-F329 HydrophobicContact CB-CD2 4.25Å; A209-F329 HydrophobicContact CB-CE1 3.56Å; A209-F329 HydrophobicContact CB-CE2 3.74Å; A209-F329 HydrophobicContact CB-CG 4.43Å; A209-F329 HydrophobicContact CB-CZ 3.38Å; M239-F329 HydrophobicContact CE-CE1 4.43Å; M239-F329 HydrophobicContact CE-CZ 4.15Å; M239-F329 HydrophobicContact SD-CE1 4.01Å; M239-F329 HydrophobicContact SD-CZ 4.27Å; W262-F329 HydrophobicContact CH2-CD1 4.3Å; W262-F329 AromaticContact CH2-CE1 3.71Å; W262-F329 HydrophobicContact CH2-CE1 3.71Å; W262-F329 HydrophobicContact CH2-CZ 4.02Å; W262-F329 WeakPolarHBondContact CZ2-O 3.45Å; V325-F329 PolarHBondContact O-N 3.36Å; S326-F329 PolarHBondContact O-N 3.45Å; F327-F329 VanDerWaalsContact C-N 3.29Å; F327-F329 PolarHBondContact O-N 3.46Å; F329-Q333 PolarHBondContact O-OE1 2.84Å
330	Y	94.3	Very high	91.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-87.7	-17.1	-177.8	-71.1	-68.2	0	0	0	114.3	V206 W265 Q266 I297 L298 G300 W305 S326 F327 V328	V206-Y330 HydrophobicContact CG1-CE2 4.49Å; V206-Y330 WeakPolarHBondContact CG1-OH 3.37Å; V206-Y330 PolarHBondContact O-OH 3.18Å; W265-Y330 HydrophobicContact CH2-CE1 4.36Å; Q266-Y330 PolarHBondContact NE2-O 3.14Å; I297-Y330 HydrophobicContact CG2-CD1 4.29Å; I297-Y330 HydrophobicContact CG2-CD2 3.37Å; I297-Y330 HydrophobicContact CG2-CE1 4.44Å; I297-Y330 HydrophobicContact CG2-CE2 3.57Å; I297-Y330 HydrophobicContact CG2-CG 3.78Å; L298-Y330 HydrophobicContact CD2-CE1 3.76Å; G300-Y330 VanDerWaalsContact CA-O 3.23Å; G300-Y330 WeakPolarHBondContact CA-O 3.32Å; W305-Y330 HydrophobicContact CH2-CD2 4.41Å; S326-Y330 VanDerWaalsContact O-CD2 3.24Å; S326-Y330 WeakPolarHBondContact O-CD2 3.45Å; S326-Y330 PolarHBondContact O-N 2.85Å; S326-Y330 VanDerWaalsContact O-N 3.16Å; F327-Y330 PolarHBondContact O-N 3.44Å; F327-Y330 VanDerWaalsContact O-N 3.11Å; V328-Y330 VanDerWaalsContact C-N 3.35Å; V328-Y330 PolarHBondContact O-N 3.02Å
331	T	93.1	Very high	91.9	Very high	45 Å²	45	25.2 Å²	25.2	28%	0.276	14%	0.138	S	C	.	.	H	α-helix	trans	-107.2	-32.3	-178.5	63	0	0	0	0	114.1	T302 F327 V328	T302-T331 HydrophobicContact CG2-CG2 4.16Å; F327-T331 HydrophobicContact CD2-CG2 3.87Å; F327-T331 HydrophobicContact CE2-CG2 3.76Å; F327-T331 HydrophobicContact CG-CG2 4.44Å; F327-T331 HydrophobicContact CZ-CG2 4.24Å; F327-T331 WeakPolarHBondContact O-CB 3.3Å; F327-T331 WeakPolarHBondContact O-CG2 3.29Å; F327-T331 PolarHBondContact O-N 3.2Å; F327-T331 PolarHBondContact O-OG1 2.89Å; V328-T331 PolarHBondContact O-N 2.96Å
332	D	89.8	Confident	91.9	Very high	48 Å²	48	28.2 Å²	28.2	26%	0.257	16%	0.161	S	C	.	.			trans	-141.6	75	176.5	-173.4	15	0	0	0	111.5	V328 L334 V335	V328-D332 CarbonylContact O-C 3.51Å; V328-D332 WeakPolarHBondContact O-CA 3.37Å; V328-D332 PolarHBondContact O-N 3.42Å; V328-D332 VanDerWaalsContact O-O 3.13Å; D332-L334 PolarHBondContact O-N 3.24Å; D332-L334 VanDerWaalsContact O-N 3.14Å; D332-L334 PolarHBondContact OD1-N 3.07Å; D332-V335 HydrophobicContact CB-CB 4.47Å; D332-V335 WeakPolarHBondContact O-CB 3.46Å; D332-V335 PolarHBondContact O-N 3.46Å; D332-V335 VanDerWaalsContact O-N 3.17Å; D332-V335 PolarHBondContact OD1-N 2.96Å; D332-V335 WeakPolarHBondContact OD2-CA 3.16Å
333	Q	87	Confident	91.8	Very high	7 Å²	7	28.9 Å²	28.9	3%	0.033	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.8	-179.3	-177.1	55.3	31	0	0	113.4	F258 W262 F329	F258-Q333 HydrophobicContact CE1-CG 3.73Å; F258-Q333 HydrophobicContact CZ-CG 3.91Å; W262-Q333 HydrophobicContact CD2-CB 4.06Å; W262-Q333 HydrophobicContact CD2-CG 4.06Å; W262-Q333 HydrophobicContact CE3-CG 4.07Å; W262-Q333 HydrophobicContact CH2-CB 4.35Å; W262-Q333 HydrophobicContact CH2-CG 4.06Å; W262-Q333 HydrophobicContact CZ2-CB 3.83Å; W262-Q333 HydrophobicContact CZ2-CG 4.05Å; W262-Q333 HydrophobicContact CZ3-CG 4.08Å; F329-Q333 PolarHBondContact O-OE1 2.84Å
334	L	85.7	Confident	91.9	Very high	65 Å²	65	27.8 Å²	27.8	34%	0.34	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	12.1	-179.1	-67.2	176.4	0	0	0	113.2	F258 D332 N336	F258-L334 HydrophobicContact CD1-CD2 3.95Å; F258-L334 HydrophobicContact CE1-CD2 4.21Å; D332-L334 PolarHBondContact O-N 3.24Å; D332-L334 VanDerWaalsContact O-N 3.14Å; D332-L334 PolarHBondContact OD1-N 3.07Å; L334-N336 PolarHBondContact O-N 3.43Å
335	V	88.3	Confident	91.8	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	18%	0.182	C	C	.	.			trans	-42.8	132.9	175.5	67.8	0	0	0	0	111.6	L146 A147 V328 D332 S339 L340 D343	L146-V335 HydrophobicContact CB-CG1 4.2Å; L146-V335 HydrophobicContact CD2-CG1 4.31Å; L146-V335 HydrophobicContact CG-CG1 4.3Å; A147-V335 HydrophobicContact CB-CG1 3.83Å; V328-V335 HydrophobicContact CG1-CB 3.91Å; V328-V335 HydrophobicContact CG1-CG1 3.6Å; V328-V335 HydrophobicContact CG1-CG2 4.05Å; D332-V335 HydrophobicContact CB-CB 4.47Å; D332-V335 WeakPolarHBondContact O-CB 3.46Å; D332-V335 PolarHBondContact O-N 3.46Å; D332-V335 VanDerWaalsContact O-N 3.17Å; D332-V335 PolarHBondContact OD1-N 2.96Å; D332-V335 WeakPolarHBondContact OD2-CA 3.16Å; V335-S339 WeakPolarHBondContact CG2-OG 3.47Å; V335-L340 HydrophobicContact CG2-CB 4.35Å; V335-L340 HydrophobicContact CG2-CD1 4.17Å; V335-D343 VanDerWaalsContact CG2-OD2 3.23Å; V335-D343 WeakPolarHBondContact CG2-OD2 3.45Å
336	N	86.9	Confident	91.7	Very high	70 Å²	70	36.2 Å²	36.2	37%	0.374	20%	0.202	S	C	.	.			trans	-107	171.4	169.5	70.3	2.7	0	0	0	109.7	L334 D338 S339 L340	L334-N336 PolarHBondContact O-N 3.43Å; N336-D338 PolarHBondContact O-N 3.41Å; N336-D338 PolarHBondContact OD1-N 3.22Å; N336-S339 PolarHBondContact N-OG 3.02Å; N336-S339 PolarHBondContact O-N 2.87Å; N336-S339 PolarHBondContact O-OG 3.48Å; N336-S339 VanDerWaalsContact OD1-CB 3.3Å; N336-S339 WeakPolarHBondContact OD1-CB 3.33Å; N336-S339 PolarHBondContact OD1-N 3Å; N336-S339 PolarHBondContact OD1-OG 3.23Å; N336-S339 VanDerWaalsContact OD1-OG 3.04Å; N336-L340 PolarHBondContact O-N 3.48Å
337	I	88.5	Confident	91.5	Very high	51 Å²	51	36.9 Å²	36.9	26%	0.262	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-33.6	179.8	-66.6	173.7	0	0	0	110.8	L146 V376	L146-I337 HydrophobicContact CD2-CG1 3.97Å; I337-V376 HydrophobicContact CG2-CB 4.46Å; I337-V376 HydrophobicContact CG2-CG1 3.83Å; I337-V376 HydrophobicContact CG2-CG2 3.77Å
338	D	87	Confident	91.2	Very high	139 Å²	139	38.9 Å²	38.9	74%	0.743	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-33.1	-178	-53.5	-44.8	0	0	0	113.4	N336	N336-D338 PolarHBondContact O-N 3.41Å; N336-D338 PolarHBondContact OD1-N 3.22Å
339	S	90.1	Very high	90.9	Very high	32 Å²	32	42.1 Å²	42.1	22%	0.224	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-20.4	-178.4	66.4	0	0	0	0	113.2	V335 N336 S341 S342 D343	V335-S339 WeakPolarHBondContact CG2-OG 3.47Å; N336-S339 PolarHBondContact N-OG 3.02Å; N336-S339 PolarHBondContact O-N 2.87Å; N336-S339 PolarHBondContact O-OG 3.48Å; N336-S339 VanDerWaalsContact OD1-CB 3.3Å; N336-S339 WeakPolarHBondContact OD1-CB 3.33Å; N336-S339 PolarHBondContact OD1-N 3Å; N336-S339 PolarHBondContact OD1-OG 3.23Å; N336-S339 VanDerWaalsContact OD1-OG 3.04Å; S339-S341 PolarHBondContact O-N 3Å; S339-S341 VanDerWaalsContact O-N 3.13Å; S339-S342 WeakPolarHBondContact O-CA 3.47Å; S339-S342 WeakPolarHBondContact O-CB 3.43Å; S339-S342 PolarHBondContact O-N 3.4Å; S339-D343 PolarHBondContact O-N 3.18Å
340	L	92.8	Very high	90.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-54.8	-37.3	-175.9	-171.2	63.1	0	0	0	113.6	I136 L146 L150 F324 V335 N336 D343 L344 F374	I136-L340 HydrophobicContact CD1-CD2 3.66Å; L146-L340 HydrophobicContact CD2-CD2 4.39Å; L150-L340 HydrophobicContact CD1-CD1 4.27Å; F324-L340 HydrophobicContact CE1-CD1 4.13Å; F324-L340 HydrophobicContact CZ-CD1 4.09Å; V335-L340 HydrophobicContact CG2-CB 4.35Å; V335-L340 HydrophobicContact CG2-CD1 4.17Å; N336-L340 PolarHBondContact O-N 3.48Å; L340-D343 PolarHBondContact O-N 2.69Å; L340-L344 PolarHBondContact O-N 3.22Å; L340-F374 HydrophobicContact CD1-CD1 4.43Å; L340-F374 HydrophobicContact CD2-CD1 3.92Å; L340-F374 HydrophobicContact CG-CD1 4.29Å
341	S	94	Very high	89.8	Confident	34 Å²	34	47 Å²	47	24%	0.238	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-42.3	174.9	179.5	0	0	0	0	112	S339 D343 L344 D345 H375	S339-S341 PolarHBondContact O-N 3Å; S339-S341 VanDerWaalsContact O-N 3.13Å; S341-D343 VanDerWaalsContact C-N 3.34Å; S341-L344 PolarHBondContact O-N 2.81Å; S341-D345 PolarHBondContact O-N 3.37Å; S341-H375 PolarHBondContact OG-ND1 2.8Å
342	S	94.3	Very high	88.4	Confident	74 Å²	74	52.9 Å²	52.9	52%	0.517	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-39.4	178.8	-178.8	0	0	0	0	111	S339 L344 D345 Q346	S339-S342 WeakPolarHBondContact O-CA 3.47Å; S339-S342 WeakPolarHBondContact O-CB 3.43Å; S339-S342 PolarHBondContact O-N 3.4Å; S342-L344 VanDerWaalsContact C-N 3.31Å; S342-L344 PolarHBondContact O-N 3.3Å; S342-D345 PolarHBondContact O-N 3.44Å; S342-Q346 WeakPolarHBondContact O-CB 3.4Å; S342-Q346 PolarHBondContact O-N 3.47Å
343	D	93.7	Very high	86.5	Confident	14 Å²	14	60 Å²	60	8%	0.075	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-38.3	176.7	-62.3	-33.9	0	0	0	111.3	F324 V328 V335 S339 L340 S341 Q346 W347	F324-D343 HydrophobicContact CE2-CB 4.25Å; F324-D343 HydrophobicContact CZ-CB 4.3Å; V328-D343 HydrophobicContact CG2-CB 4.21Å; V335-D343 VanDerWaalsContact CG2-OD2 3.23Å; V335-D343 WeakPolarHBondContact CG2-OD2 3.45Å; S339-D343 PolarHBondContact O-N 3.18Å; L340-D343 PolarHBondContact O-N 2.69Å; S341-D343 VanDerWaalsContact C-N 3.34Å; D343-Q346 PolarHBondContact O-N 2.89Å; D343-W347 WeakPolarHBondContact O-CB 3.48Å; D343-W347 PolarHBondContact O-N 3.41Å
344	L	94.9	Very high	84.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-45.6	173.9	-179.3	64.8	0	0	0	111.5	W320 F324 L340 S341 S342 Q346 W347 L348 T371 F374	W320-L344 HydrophobicContact CH2-CD1 3.98Å; W320-L344 HydrophobicContact CZ3-CD1 3.66Å; F324-L344 HydrophobicContact CD1-CD1 4.22Å; F324-L344 HydrophobicContact CD2-CD1 4.26Å; F324-L344 HydrophobicContact CE1-CB 4.37Å; F324-L344 HydrophobicContact CE1-CD1 4.14Å; F324-L344 HydrophobicContact CE2-CB 4.13Å; F324-L344 HydrophobicContact CE2-CD1 4.18Å; F324-L344 HydrophobicContact CG-CD1 4.27Å; F324-L344 HydrophobicContact CZ-CB 3.77Å; F324-L344 HydrophobicContact CZ-CD1 4.11Å; L340-L344 PolarHBondContact O-N 3.22Å; S341-L344 PolarHBondContact O-N 2.81Å; S342-L344 VanDerWaalsContact C-N 3.31Å; S342-L344 PolarHBondContact O-N 3.3Å; L344-Q346 VanDerWaalsContact C-N 3.3Å; L344-Q346 PolarHBondContact O-N 2.93Å; L344-W347 HydrophobicContact CD1-CE3 4.29Å; L344-W347 PolarHBondContact O-N 3.35Å; L344-L348 HydrophobicContact CD1-CD1 4.3Å; L344-L348 HydrophobicContact CD1-CG 4.24Å; L344-L348 HydrophobicContact CD2-CD1 4.49Å; L344-L348 HydrophobicContact CG-CD1 3.95Å; L344-L348 HydrophobicContact CG-CG 4.33Å; L344-L348 WeakPolarHBondContact O-CB 3.23Å; L344-L348 WeakPolarHBondContact O-CG 3.49Å; L344-L348 PolarHBondContact O-N 2.86Å; L344-T371 HydrophobicContact CD2-CG2 4.23Å; L344-F374 HydrophobicContact CD2-CB 3.74Å
345	D	93.6	Very high	82.6	Confident	85 Å²	85	66.9 Å²	66.9	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-41.3	177.7	-75.8	-35	0	0	0	111.7	S341 S342 L348 A349 H375	S341-D345 PolarHBondContact O-N 3.37Å; S342-D345 PolarHBondContact O-N 3.44Å; D345-L348 PolarHBondContact O-N 2.73Å; D345-A349 WeakPolarHBondContact O-CB 3.25Å; D345-A349 PolarHBondContact O-N 3.46Å; D345-H375 IonicContact OD1-CE1 3.02Å; D345-H375 PolarHBondContact OD1-CE1 2.93Å
346	Q	92.2	Very high	80.9	Confident	93 Å²	93	71.8 Å²	71.8	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-62.6	-47.7	173.9	-179.1	177.7	-7.5	0	0	111.3	S342 D343 L344 L348 A349 L350	S342-Q346 WeakPolarHBondContact O-CB 3.4Å; S342-Q346 PolarHBondContact O-N 3.47Å; D343-Q346 PolarHBondContact O-N 2.89Å; L344-Q346 VanDerWaalsContact C-N 3.3Å; L344-Q346 PolarHBondContact O-N 2.93Å; Q346-L348 PolarHBondContact O-N 3Å; Q346-A349 PolarHBondContact O-N 3.21Å; Q346-L350 HydrophobicContact CG-CD1 4.22Å; Q346-L350 VanDerWaalsContact O-CG 3.32Å; Q346-L350 WeakPolarHBondContact O-CG 3.36Å; Q346-L350 PolarHBondContact O-N 3.18Å
347	W	92	Very high	79.5	Confident	14 Å²	14	76.5 Å²	76.5	5%	0.053	41%	0.414	C	S	.	.	H	α-helix	trans	-60.4	-45	177.7	176.8	93.4	0	0	0	111.7	W320 F324 F327 D343 L344 A349 L350 T351	W320-W347 HydrophobicContact CB-CH2 3.76Å; W320-W347 HydrophobicContact CB-CZ2 4.01Å; W320-W347 AromaticContact CD2-CH2 3.9Å; W320-W347 HydrophobicContact CD2-CH2 3.9Å; W320-W347 HydrophobicContact CD2-CZ3 4.13Å; W320-W347 HydrophobicContact CE3-CE3 4.03Å; W320-W347 AromaticContact CE3-CH2 3.41Å; W320-W347 HydrophobicContact CE3-CH2 3.41Å; W320-W347 VanDerWaalsContact CE3-CH2 3.41Å; W320-W347 AromaticContact CE3-CZ2 3.98Å; W320-W347 HydrophobicContact CE3-CZ2 3.98Å; W320-W347 AromaticContact CE3-CZ3 3.4Å; W320-W347 HydrophobicContact CE3-CZ3 3.4Å; W320-W347 HydrophobicContact CG-CH2 4.07Å; W320-W347 HydrophobicContact CZ3-CE3 4.15Å; W320-W347 HydrophobicContact CZ3-CH2 4.3Å; W320-W347 AromaticContact CZ3-CZ3 3.83Å; W320-W347 HydrophobicContact CZ3-CZ3 3.83Å; F324-W347 HydrophobicContact CB-CD2 4.31Å; F324-W347 HydrophobicContact CB-CG 4.39Å; F324-W347 HydrophobicContact CD2-CB 3.62Å; F324-W347 AromaticContact CD2-CD1 3.86Å; F324-W347 HydrophobicContact CD2-CD2 4.17Å; F324-W347 AromaticContact CD2-CG 3.58Å; F324-W347 HydrophobicContact CD2-CG 3.58Å; F324-W347 HydrophobicContact CE2-CB 3.92Å; F324-W347 HydrophobicContact CE2-CG 4.37Å; F324-W347 HydrophobicContact CG-CG 4.4Å; F327-W347 HydrophobicContact CD1-CB 4.28Å; F327-W347 HydrophobicContact CE1-CB 4.19Å; F327-W347 AromaticContact CG-CD1 3.93Å; D343-W347 WeakPolarHBondContact O-CB 3.48Å; D343-W347 PolarHBondContact O-N 3.41Å; L344-W347 HydrophobicContact CD1-CE3 4.29Å; L344-W347 PolarHBondContact O-N 3.35Å; W347-A349 VanDerWaalsContact C-N 3.3Å; W347-A349 PolarHBondContact O-N 3.16Å; W347-L350 PolarHBondContact O-N 3.16Å; W347-T351 HydrophobicContact CD2-CG2 4.12Å; W347-T351 HydrophobicContact CG-CG2 4.48Å; W347-T351 HydrophobicContact CH2-CG2 4.37Å; W347-T351 WeakPolarHBondContact CH2-OG1 3.31Å; W347-T351 HydrophobicContact CZ2-CG2 3.71Å; W347-T351 WeakPolarHBondContact CZ3-OG1 3.47Å; W347-T351 WeakPolarHBondContact O-CG2 3.48Å; W347-T351 PolarHBondContact O-N 2.68Å; W347-T351 PolarHBondContact O-OG1 2.97Å
348	L	89.6	Confident	78	Confident	42 Å²	42	79.8 Å²	79.8	22%	0.22	44%	0.438	C	S	.	.	H	α-helix	trans	-62.6	-38.8	177.4	-77.1	170.5	0	0	0	110.9	L344 D345 Q346 L350 K352	L344-L348 HydrophobicContact CD1-CD1 4.3Å; L344-L348 HydrophobicContact CD1-CG 4.24Å; L344-L348 HydrophobicContact CD2-CD1 4.49Å; L344-L348 HydrophobicContact CG-CD1 3.95Å; L344-L348 HydrophobicContact CG-CG 4.33Å; L344-L348 WeakPolarHBondContact O-CB 3.23Å; L344-L348 WeakPolarHBondContact O-CG 3.49Å; L344-L348 PolarHBondContact O-N 2.86Å; D345-L348 PolarHBondContact O-N 2.73Å; Q346-L348 PolarHBondContact O-N 3Å; L348-L350 VanDerWaalsContact C-N 3.33Å; L348-K352 VanDerWaalsContact O-CB 3.28Å; L348-K352 WeakPolarHBondContact O-CB 3.29Å; L348-K352 VanDerWaalsContact O-CD 3.29Å; L348-K352 WeakPolarHBondContact O-CD 3.44Å; L348-K352 WeakPolarHBondContact O-CG 3.2Å; L348-K352 PolarHBondContact O-N 2.79Å; L348-K352 VanDerWaalsContact O-N 3.17Å
349	A	88.4	Confident	77.1	Confident	69 Å²	69	74.7 Å²	74.7	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-65.2	-36.8	176.5	0	0	0	0	0	112.4	D345 Q346 W347	D345-A349 WeakPolarHBondContact O-CB 3.25Å; D345-A349 PolarHBondContact O-N 3.46Å; Q346-A349 PolarHBondContact O-N 3.21Å; W347-A349 VanDerWaalsContact C-N 3.3Å; W347-A349 PolarHBondContact O-N 3.16Å
350	L	84.6	Confident	76.7	Confident	75 Å²	75	76 Å²	76	39%	0.393	43%	0.427	S	S	.	.	H	α-helix	trans	-72.4	-42.4	178.7	-68.4	170.5	0	0	0	112.2	F327 Q346 W347 L348	F327-L350 HydrophobicContact CE2-CD1 4.23Å; F327-L350 HydrophobicContact CZ-CD1 4.33Å; Q346-L350 HydrophobicContact CG-CD1 4.22Å; Q346-L350 VanDerWaalsContact O-CG 3.32Å; Q346-L350 WeakPolarHBondContact O-CG 3.36Å; Q346-L350 PolarHBondContact O-N 3.18Å; W347-L350 PolarHBondContact O-N 3.16Å; L348-L350 VanDerWaalsContact C-N 3.33Å
351	T	80	Confident	76.3	Confident	30 Å²	30	81.5 Å²	81.5	18%	0.184	46%	0.457	C	S	.	.	H	α-helix	trans	-94.6	-3.7	-169.2	58	0	0	0	0	114.9	W347 K353	W347-T351 HydrophobicContact CD2-CG2 4.12Å; W347-T351 HydrophobicContact CG-CG2 4.48Å; W347-T351 HydrophobicContact CH2-CG2 4.37Å; W347-T351 WeakPolarHBondContact CH2-OG1 3.31Å; W347-T351 HydrophobicContact CZ2-CG2 3.71Å; W347-T351 WeakPolarHBondContact CZ3-OG1 3.47Å; W347-T351 WeakPolarHBondContact O-CG2 3.48Å; W347-T351 PolarHBondContact O-N 2.68Å; W347-T351 PolarHBondContact O-OG1 2.97Å; T351-K353 PolarHBondContact O-N 2.99Å
352	K	62.8	Low	75.9	Confident	168 Å²	168	82.6 Å²	82.6	73%	0.73	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	4.7	179.6	-100.9	166.9	-170.1	173.8	0	115.8	L348	L348-K352 VanDerWaalsContact O-CB 3.28Å; L348-K352 WeakPolarHBondContact O-CB 3.29Å; L348-K352 VanDerWaalsContact O-CD 3.29Å; L348-K352 WeakPolarHBondContact O-CD 3.44Å; L348-K352 WeakPolarHBondContact O-CG 3.2Å; L348-K352 PolarHBondContact O-N 2.79Å; L348-K352 VanDerWaalsContact O-N 3.17Å
353	K	50.9	Low	75.6	Confident	196 Å²	196	80.4 Å²	80.4	85%	0.852	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	6.7	-165.3	-120.8	179.9	-176.8	178.6	0	117.6	T351	T351-K353 PolarHBondContact O-N 2.99Å
354	G	43.8	Very low	75.3	Confident	54 Å²	54	84 Å²	84	56%	0.557	46%	0.457	S	S	*	.	S	Bend	trans	-159.9	112.8	178.7	0	0	0	0	0	116.7	M356	G354-M356 PolarHBondContact O-N 2.86Å
355	N	45.8	Very low	75.2	Confident	164 Å²	164	84.8 Å²	84.8	88%	0.877	46%	0.462	S	S	*	.			trans	41.7	66.6	145.7	-57.3	-13.7	0	0	0	117.1	E357	N355-E357 PolarHBondContact O-N 2.86Å
356	M	53.4	Low	75.1	Confident	104 Å²	104	81.3 Å²	81.3	51%	0.512	44%	0.444	S	S	.	.			trans	-78.7	106.8	151.5	-62.8	-156.6	86.9	0	0	106.9	S317 G354	S317-M356 WeakPolarHBondContact O-CE 3.36Å; G354-M356 PolarHBondContact O-N 2.86Å
357	E	57.8	Low	75.2	Confident	169 Å²	169	78.7 Å²	78.7	79%	0.79	43%	0.433	S	S	*	.			trans	-50.8	136.9	160.7	-72.9	-163.3	156.9	0	0	107.8	N355 G359	N355-E357 PolarHBondContact O-N 2.86Å; E357-G359 PolarHBondContact O-N 2.77Å
358	P	57.5	Low	75.2	Confident	120 Å²	120	79.9 Å²	79.9	78%	0.779	45%	0.445	S	S	*	.			trans	-59.6	104.7	178.1	22.9	-30	0	0	0	107.5
359	G	67.2	Low	75.6	Confident	32 Å²	32	77.9 Å²	77.9	33%	0.33	44%	0.435	S	S	.	.			trans	-57.9	171.1	174.1	0	0	0	0	0	109.9	E357 Q364	E357-G359 PolarHBondContact O-N 2.77Å; G359-Q364 PolarHBondContact O-NE2 3.41Å
360	S	82.2	Confident	75.9	Confident	58 Å²	58	74.6 Å²	74.6	41%	0.406	41%	0.407	S	S	.	.			trans	-55.9	154.8	173.9	70.7	0	0	0	0	110.5	F362 D363 Q364	S360-F362 PolarHBondContact O-N 3.13Å; S360-D363 WeakPolarHBondContact CB-OD2 3.44Å; S360-D363 PolarHBondContact N-OD2 3.12Å; S360-D363 WeakPolarHBondContact O-CB 3.41Å; S360-D363 PolarHBondContact O-N 2.79Å; S360-D363 PolarHBondContact OG-N 2.79Å; S360-D363 PolarHBondContact OG-OD2 3.13Å; S360-Q364 PolarHBondContact O-N 2.9Å; S360-Q364 VanDerWaalsContact O-N 3.08Å
361	N	83.5	Confident	76.5	Confident	116 Å²	116	72.8 Å²	72.8	62%	0.62	40%	0.4	S	S	*	.	H	α-helix	trans	-51.7	-31.2	176.1	-69.8	-11.9	0	0	0	112.3	S365	N361-S365 PolarHBondContact O-N 3.34Å; N361-S365 PolarHBondContact O-OG 3Å
362	F	85.9	Confident	77.2	Confident	57 Å²	57	72 Å²	72	25%	0.25	40%	0.395	C	S	.	.	H	α-helix	trans	-69.2	-46	174.6	-177.6	-104	0	0	0	112.2	L122 T125 S360 Q364 S365 V366 L389	L122-F362 HydrophobicContact CD1-CE1 4.31Å; L122-F362 HydrophobicContact CD1-CE2 3.7Å; L122-F362 HydrophobicContact CD1-CZ 3.44Å; L122-F362 VanDerWaalsContact CD1-CZ 3.44Å; T125-F362 HydrophobicContact CG2-CE1 3.87Å; T125-F362 HydrophobicContact CG2-CZ 3.8Å; S360-F362 PolarHBondContact O-N 3.13Å; F362-Q364 VanDerWaalsContact C-N 3.29Å; F362-Q364 PolarHBondContact O-N 2.93Å; F362-S365 WeakPolarHBondContact O-CA 3.49Å; F362-S365 WeakPolarHBondContact O-CB 3.15Å; F362-S365 PolarHBondContact O-N 3.4Å; F362-V366 HydrophobicContact CD1-CG2 4.11Å; F362-V366 HydrophobicContact CE1-CG2 3.69Å; F362-V366 HydrophobicContact CE2-CG2 4.37Å; F362-V366 HydrophobicContact CZ-CG2 3.83Å; F362-V366 WeakPolarHBondContact O-CG2 3.48Å; F362-V366 PolarHBondContact O-N 3.43Å; F362-L389 HydrophobicContact CE2-CD2 4.11Å
363	D	87	Confident	78.9	Confident	28 Å²	28	64 Å²	64	15%	0.15	36%	0.36	C	S	.	.	H	α-helix	trans	-59.3	-42.5	177.6	-56.8	-48.4	0	0	0	111.3	R318 S360 S365 V366 D367	R318-D363 IonicContact CZ-OD1 2.94Å; R318-D363 IonicContact CZ-OD2 3.73Å; R318-D363 IonicContact NE-OD1 3.24Å; R318-D363 PolarHBondContact NE-OD1 3.38Å; R318-D363 IonicContact NE-OD2 3.24Å; R318-D363 PolarHBondContact NE-OD2 2.94Å; R318-D363 IonicContact NH2-OD1 2.79Å; R318-D363 PolarHBondContact NH2-OD1 3.26Å; R318-D363 IonicContact NH2-OD2 2.84Å; R318-D363 PolarHBondContact NH2-OD2 3.12Å; S360-D363 WeakPolarHBondContact CB-OD2 3.44Å; S360-D363 PolarHBondContact N-OD2 3.12Å; S360-D363 WeakPolarHBondContact O-CB 3.41Å; S360-D363 PolarHBondContact O-N 2.79Å; S360-D363 PolarHBondContact OG-N 2.79Å; S360-D363 PolarHBondContact OG-OD2 3.13Å; D363-S365 PolarHBondContact O-N 2.88Å; D363-V366 WeakPolarHBondContact O-CB 3.26Å; D363-V366 PolarHBondContact O-N 3.31Å; D363-V366 VanDerWaalsContact O-N 3.11Å; D363-D367 PolarHBondContact O-N 2.89Å
364	Q	89.1	Confident	81	Confident	91 Å²	91	54.6 Å²	54.6	43%	0.425	32%	0.32	S	S	.	.	H	α-helix	trans	-62.1	-34.5	175.9	-63.5	174	23.8	0	0	112	G359 S360 F362 A368	G359-Q364 PolarHBondContact O-NE2 3.41Å; S360-Q364 PolarHBondContact O-N 2.9Å; S360-Q364 VanDerWaalsContact O-N 3.08Å; F362-Q364 VanDerWaalsContact C-N 3.29Å; F362-Q364 PolarHBondContact O-N 2.93Å; Q364-A368 WeakPolarHBondContact O-CB 3.49Å; Q364-A368 PolarHBondContact O-N 3.36Å
365	S	91.6	Very high	83.5	Confident	16 Å²	16	54.8 Å²	54.8	11%	0.112	31%	0.306	C	S	.	.	H	α-helix	trans	-70.6	-37.6	175.6	-56.8	0	0	0	0	111.5	N361 F362 D363 A368 L369	N361-S365 PolarHBondContact O-N 3.34Å; N361-S365 PolarHBondContact O-OG 3Å; F362-S365 WeakPolarHBondContact O-CA 3.49Å; F362-S365 WeakPolarHBondContact O-CB 3.15Å; F362-S365 PolarHBondContact O-N 3.4Å; D363-S365 PolarHBondContact O-N 2.88Å; S365-A368 PolarHBondContact O-N 3.33Å; S365-L369 VanDerWaalsContact O-CG 3.26Å; S365-L369 WeakPolarHBondContact O-CG 3.43Å; S365-L369 PolarHBondContact O-N 2.94Å
366	V	92.9	Very high	85.8	Confident	12 Å²	12	49.5 Å²	49.5	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-45	173.6	174.8	0	0	0	0	110.5	T125 L129 F362 D363 A368 L369 I370	T125-V366 HydrophobicContact CG2-CG1 4.15Å; T125-V366 HydrophobicContact CG2-CG2 3.53Å; L129-V366 HydrophobicContact CD2-CG1 4.4Å; F362-V366 HydrophobicContact CD1-CG2 4.11Å; F362-V366 HydrophobicContact CE1-CG2 3.69Å; F362-V366 HydrophobicContact CE2-CG2 4.37Å; F362-V366 HydrophobicContact CZ-CG2 3.83Å; F362-V366 WeakPolarHBondContact O-CG2 3.48Å; F362-V366 PolarHBondContact O-N 3.43Å; D363-V366 WeakPolarHBondContact O-CB 3.26Å; D363-V366 PolarHBondContact O-N 3.31Å; D363-V366 VanDerWaalsContact O-N 3.11Å; V366-A368 VanDerWaalsContact C-N 3.32Å; V366-A368 PolarHBondContact O-N 3.13Å; V366-L369 WeakPolarHBondContact O-CB 3.44Å; V366-L369 PolarHBondContact O-N 3.29Å; V366-I370 HydrophobicContact CG1-CD1 3.78Å; V366-I370 HydrophobicContact CG1-CG1 4.38Å; V366-I370 WeakPolarHBondContact O-CG1 3.1Å; V366-I370 PolarHBondContact O-N 3.33Å
367	D	92.6	Very high	87.7	Confident	38 Å²	38	47.2 Å²	47.2	20%	0.203	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-43.1	176.5	-72.7	-26.6	0	0	0	111.4	W320 D363 I370 T371	W320-D367 PolarHBondContact NE1-OD1 3.37Å; D363-D367 PolarHBondContact O-N 2.89Å; D367-I370 PolarHBondContact O-N 3.23Å; D367-T371 VanDerWaalsContact O-CB 3.25Å; D367-T371 WeakPolarHBondContact O-CB 3.36Å; D367-T371 PolarHBondContact O-N 2.86Å; D367-T371 PolarHBondContact O-OG1 3.4Å
368	A	93.6	Very high	89.3	Confident	38 Å²	38	40.2 Å²	40.2	31%	0.314	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-42.6	175.2	0	0	0	0	0	112	Q364 S365 V366 T371 S372 I384	Q364-A368 WeakPolarHBondContact O-CB 3.49Å; Q364-A368 PolarHBondContact O-N 3.36Å; S365-A368 PolarHBondContact O-N 3.33Å; V366-A368 VanDerWaalsContact C-N 3.32Å; V366-A368 PolarHBondContact O-N 3.13Å; A368-T371 PolarHBondContact O-N 3.49Å; A368-S372 PolarHBondContact O-N 3.1Å; A368-S372 PolarHBondContact O-OG 3.12Å; A368-S372 VanDerWaalsContact O-OG 3.13Å; A368-I384 HydrophobicContact CB-CD1 4.05Å; A368-I384 HydrophobicContact CB-CG2 4.32Å
369	L	96.1	Very high	90.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-47.6	176.7	-74.9	167.4	0	0	0	112.1	L129 S365 V366 T371 S372 I373 F381 I384 A385 L389	L129-L369 HydrophobicContact CD1-CD1 3.79Å; L129-L369 HydrophobicContact CD2-CB 3.85Å; L129-L369 HydrophobicContact CD2-CD1 4.49Å; S365-L369 VanDerWaalsContact O-CG 3.26Å; S365-L369 WeakPolarHBondContact O-CG 3.43Å; S365-L369 PolarHBondContact O-N 2.94Å; V366-L369 WeakPolarHBondContact O-CB 3.44Å; V366-L369 PolarHBondContact O-N 3.29Å; L369-T371 VanDerWaalsContact C-N 3.31Å; L369-T371 PolarHBondContact O-N 3.39Å; L369-S372 PolarHBondContact O-N 3.08Å; L369-I373 VanDerWaalsContact O-CG1 3.29Å; L369-I373 WeakPolarHBondContact O-CG1 3.28Å; L369-I373 PolarHBondContact O-N 3.36Å; L369-F381 HydrophobicContact CB-CD2 4.49Å; L369-F381 HydrophobicContact CD2-CD2 3.63Å; L369-F381 HydrophobicContact CD2-CE2 3.93Å; L369-F381 WeakPolarHBondContact CD2-O 3.48Å; L369-I384 HydrophobicContact CD2-CB 3.81Å; L369-I384 HydrophobicContact CD2-CG2 3.71Å; L369-I384 HydrophobicContact CG-CB 4.37Å; L369-I384 HydrophobicContact CG-CG2 3.72Å; L369-A385 HydrophobicContact CD2-CB 3.76Å; L369-L389 HydrophobicContact CD1-CD1 4.23Å; L369-L389 HydrophobicContact CD1-CD2 3.93Å; L369-L389 HydrophobicContact CD1-CG 4.13Å
370	I	96.2	Very high	92.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-41.4	179.2	-69	174	0	0	0	110.6	L128 L129 L132 W320 F321 V366 D367 I373 F374	L128-I370 HydrophobicContact CD2-CD1 3.85Å; L129-I370 HydrophobicContact CD2-CD1 4.34Å; L129-I370 HydrophobicContact CD2-CG1 3.65Å; L132-I370 HydrophobicContact CD2-CB 4.47Å; L132-I370 HydrophobicContact CD2-CG1 4.26Å; L132-I370 HydrophobicContact CD2-CG2 3.92Å; W320-I370 HydrophobicContact CH2-CG2 4.11Å; W320-I370 HydrophobicContact CZ2-CB 4.44Å; W320-I370 HydrophobicContact CZ2-CG2 3.99Å; F321-I370 HydrophobicContact CB-CD1 4.4Å; F321-I370 HydrophobicContact CB-CG2 3.7Å; F321-I370 HydrophobicContact CD1-CD1 3.32Å; F321-I370 HydrophobicContact CD1-CG2 4.38Å; F321-I370 HydrophobicContact CD2-CD1 4.33Å; F321-I370 HydrophobicContact CE1-CD1 3.48Å; F321-I370 VanDerWaalsContact CE1-CD1 3.48Å; F321-I370 HydrophobicContact CE2-CD1 4.45Å; F321-I370 HydrophobicContact CG-CD1 3.77Å; F321-I370 HydrophobicContact CG-CG2 4.24Å; F321-I370 HydrophobicContact CZ-CD1 4.06Å; V366-I370 HydrophobicContact CG1-CD1 3.78Å; V366-I370 HydrophobicContact CG1-CG1 4.38Å; V366-I370 WeakPolarHBondContact O-CG1 3.1Å; V366-I370 PolarHBondContact O-N 3.33Å; D367-I370 PolarHBondContact O-N 3.23Å; I370-I373 PolarHBondContact O-N 3.08Å; I370-F374 HydrophobicContact CG2-CD2 3.58Å; I370-F374 HydrophobicContact CG2-CE2 3.38Å; I370-F374 HydrophobicContact CG2-CZ 4.41Å; I370-F374 WeakPolarHBondContact O-CD2 3.42Å; I370-F374 PolarHBondContact O-N 3.4Å
371	T	95.7	Very high	92.8	Very high	37 Å²	37	35.9 Å²	35.9	23%	0.227	19%	0.194	C	C	.	.	H	α-helix	trans	-59.4	-46.7	174.6	-60	0	0	0	0	111	L344 D367 A368 L369 I373 F374 H375	L344-T371 HydrophobicContact CD2-CG2 4.23Å; D367-T371 VanDerWaalsContact O-CB 3.25Å; D367-T371 WeakPolarHBondContact O-CB 3.36Å; D367-T371 PolarHBondContact O-N 2.86Å; D367-T371 PolarHBondContact O-OG1 3.4Å; A368-T371 PolarHBondContact O-N 3.49Å; L369-T371 VanDerWaalsContact C-N 3.31Å; L369-T371 PolarHBondContact O-N 3.39Å; T371-I373 VanDerWaalsContact C-N 3.33Å; T371-I373 PolarHBondContact O-N 3.43Å; T371-F374 PolarHBondContact O-N 2.97Å; T371-H375 WeakPolarHBondContact O-CB 3.37Å; T371-H375 PolarHBondContact O-CD2 2.83Å; T371-H375 VanDerWaalsContact O-CD2 3.23Å; T371-H375 PolarHBondContact O-N 2.97Å
372	S	96.4	Very high	93.2	Very high	13 Å²	13	30.4 Å²	30.4	9%	0.091	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-38.5	175.2	-62.9	0	0	0	0	112.8	A368 L369 V376 D377 S380	A368-S372 PolarHBondContact O-N 3.1Å; A368-S372 PolarHBondContact O-OG 3.12Å; A368-S372 VanDerWaalsContact O-OG 3.13Å; L369-S372 PolarHBondContact O-N 3.08Å; S372-V376 PolarHBondContact O-N 3.25Å; S372-D377 PolarHBondContact O-N 3.47Å; S372-S380 WeakPolarHBondContact OG-CB 3.49Å
373	I	96.9	Very high	93.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.6	-47.7	176.2	-64	161.1	0	0	0	110.5	L129 L132 A133 I136 F137 L369 I370 T371 H375 V376 F381	L129-I373 HydrophobicContact CD2-CD1 4.32Å; L132-I373 HydrophobicContact CB-CD1 4.38Å; L132-I373 HydrophobicContact CD2-CB 4.35Å; L132-I373 HydrophobicContact CD2-CD1 4.13Å; L132-I373 HydrophobicContact CD2-CG2 4.16Å; L132-I373 HydrophobicContact CG-CD1 4.33Å; L132-I373 HydrophobicContact CG-CG2 3.81Å; A133-I373 HydrophobicContact CB-CD1 4.01Å; A133-I373 HydrophobicContact CB-CG1 4.31Å; I136-I373 HydrophobicContact CB-CG2 3.8Å; I136-I373 HydrophobicContact CG1-CG2 3.68Å; I136-I373 HydrophobicContact CG2-CG2 4.26Å; I136-I373 WeakPolarHBondContact CG2-O 3.48Å; F137-I373 HydrophobicContact CE2-CB 4.46Å; F137-I373 HydrophobicContact CE2-CG1 3.93Å; F137-I373 HydrophobicContact CE2-CG2 4.37Å; F137-I373 HydrophobicContact CZ-CB 4.44Å; F137-I373 HydrophobicContact CZ-CG1 4.3Å; F137-I373 HydrophobicContact CZ-CG2 4.46Å; L369-I373 VanDerWaalsContact O-CG1 3.29Å; L369-I373 WeakPolarHBondContact O-CG1 3.28Å; L369-I373 PolarHBondContact O-N 3.36Å; I370-I373 PolarHBondContact O-N 3.08Å; T371-I373 VanDerWaalsContact C-N 3.33Å; T371-I373 PolarHBondContact O-N 3.43Å; I373-H375 PolarHBondContact O-N 3.42Å; I373-V376 WeakPolarHBondContact O-CA 3.07Å; I373-V376 PolarHBondContact O-N 2.91Å; I373-F381 HydrophobicContact CD1-CD2 3.96Å; I373-F381 HydrophobicContact CD1-CE2 3.67Å; I373-F381 HydrophobicContact CG1-CD2 3.56Å; I373-F381 HydrophobicContact CG1-CE2 3.77Å; I373-F381 HydrophobicContact CG1-CG 4.28Å
374	F	96.1	Very high	93.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.4	-29.5	-179.9	-75.1	-47.6	0	0	0	114	L132 L150 W320 F321 F324 V325 L340 L344 I370 T371 V376	L132-F374 HydrophobicContact CD1-CE1 3.82Å; L132-F374 HydrophobicContact CD1-CZ 3.97Å; L132-F374 HydrophobicContact CD2-CE1 4.29Å; L132-F374 HydrophobicContact CD2-CE2 4.16Å; L132-F374 HydrophobicContact CD2-CZ 3.92Å; L150-F374 HydrophobicContact CD2-CE1 4.07Å; W320-F374 HydrophobicContact CH2-CD2 4.3Å; F321-F374 HydrophobicContact CB-CE2 3.96Å; F324-F374 HydrophobicContact CD1-CD1 4.28Å; F324-F374 AromaticContact CD1-CD2 3.81Å; F324-F374 HydrophobicContact CD1-CD2 3.81Å; F324-F374 HydrophobicContact CD1-CE1 4.11Å; F324-F374 AromaticContact CD1-CE2 3.61Å; F324-F374 HydrophobicContact CD1-CE2 3.61Å; F324-F374 HydrophobicContact CD1-CG 4.15Å; F324-F374 AromaticContact CD1-CZ 3.79Å; F324-F374 HydrophobicContact CD1-CZ 3.79Å; F324-F374 HydrophobicContact CE1-CB 4.31Å; F324-F374 AromaticContact CE1-CD1 3.78Å; F324-F374 HydrophobicContact CE1-CD1 3.78Å; F324-F374 AromaticContact CE1-CD2 3.88Å; F324-F374 HydrophobicContact CE1-CD2 3.88Å; F324-F374 AromaticContact CE1-CE1 3.96Å; F324-F374 HydrophobicContact CE1-CE1 3.96Å; F324-F374 HydrophobicContact CE1-CE2 4.06Å; F324-F374 AromaticContact CE1-CG 3.75Å; F324-F374 HydrophobicContact CE1-CG 3.75Å; F324-F374 HydrophobicContact CE1-CZ 4.11Å; V325-F374 HydrophobicContact CG2-CE1 4.29Å; V325-F374 HydrophobicContact CG2-CZ 3.84Å; L340-F374 HydrophobicContact CD1-CD1 4.43Å; L340-F374 HydrophobicContact CD2-CD1 3.92Å; L340-F374 HydrophobicContact CG-CD1 4.29Å; L344-F374 HydrophobicContact CD2-CB 3.74Å; I370-F374 HydrophobicContact CG2-CD2 3.58Å; I370-F374 HydrophobicContact CG2-CE2 3.38Å; I370-F374 HydrophobicContact CG2-CZ 4.41Å; I370-F374 WeakPolarHBondContact O-CD2 3.42Å; I370-F374 PolarHBondContact O-N 3.4Å; T371-F374 PolarHBondContact O-N 2.97Å; F374-V376 PolarHBondContact O-N 3.48Å
375	H	95.5	Very high	94	Very high	58 Å²	58	28 Å²	28	27%	0.269	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-3.2	167.5	-77.7	-58.3	0	0	0	113.6	S341 D345 T371 I373 D377	S341-H375 PolarHBondContact OG-ND1 2.8Å; D345-H375 IonicContact OD1-CE1 3.02Å; D345-H375 PolarHBondContact OD1-CE1 2.93Å; T371-H375 WeakPolarHBondContact O-CB 3.37Å; T371-H375 PolarHBondContact O-CD2 2.83Å; T371-H375 VanDerWaalsContact O-CD2 3.23Å; T371-H375 PolarHBondContact O-N 2.97Å; I373-H375 PolarHBondContact O-N 3.42Å; H375-D377 HydrophobicContact CB-CB 4.41Å; H375-D377 PolarHBondContact O-N 2.96Å
376	V	93.9	Very high	93.9	Very high	53 Å²	53	28.6 Å²	28.6	32%	0.321	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	28	-176.1	-157.5	0	0	0	0	111.5	I136 F137 I337 S372 I373 F374 L378	I136-V376 HydrophobicContact CG2-CG1 4.18Å; I136-V376 HydrophobicContact CG2-CG2 4.12Å; F137-V376 HydrophobicContact CD1-CG1 4.46Å; F137-V376 HydrophobicContact CE1-CG1 4.27Å; I337-V376 HydrophobicContact CG2-CB 4.46Å; I337-V376 HydrophobicContact CG2-CG1 3.83Å; I337-V376 HydrophobicContact CG2-CG2 3.77Å; S372-V376 PolarHBondContact O-N 3.25Å; I373-V376 WeakPolarHBondContact O-CA 3.07Å; I373-V376 PolarHBondContact O-N 2.91Å; F374-V376 PolarHBondContact O-N 3.48Å; V376-L378 PolarHBondContact O-N 3.26Å
377	D	93.6	Very high	93.7	Very high	55 Å²	55	33.2 Å²	33.2	29%	0.294	18%	0.175	S	C	.	.			trans	-93.2	86.3	179.2	-174.9	-6.9	0	0	0	110.2	S372 H375 F379 S380 F381	S372-D377 PolarHBondContact O-N 3.47Å; H375-D377 HydrophobicContact CB-CB 4.41Å; H375-D377 PolarHBondContact O-N 2.96Å; D377-F379 PolarHBondContact O-N 2.63Å; D377-F379 WeakPolarHBondContact OD1-CB 3.37Å; D377-F379 PolarHBondContact OD1-N 2.9Å; D377-S380 VanDerWaalsContact CG-CB 3.47Å; D377-S380 PolarHBondContact OD1-N 3.31Å; D377-S380 WeakPolarHBondContact OD2-CB 3.25Å; D377-S380 PolarHBondContact OD2-OG 3.45Å; D377-F381 WeakPolarHBondContact O-CB 3.4Å; D377-F381 PolarHBondContact O-N 3.45Å
378	L	92.1	Very high	93.4	Very high	22 Å²	22	36.7 Å²	36.7	12%	0.115	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-32.5	177.6	179.7	60.9	0	0	0	112.4	F137 V376 F381 V382 L402 V409 L410	F137-L378 HydrophobicContact CD1-CB 4.47Å; F137-L378 HydrophobicContact CD2-CD1 4.03Å; F137-L378 HydrophobicContact CE1-CB 4.11Å; F137-L378 HydrophobicContact CE2-CD1 4.06Å; F137-L378 HydrophobicContact CG-CD1 4.26Å; F137-L378 HydrophobicContact CZ-CB 4.33Å; F137-L378 HydrophobicContact CZ-CD1 4.32Å; V376-L378 PolarHBondContact O-N 3.26Å; L378-F381 HydrophobicContact CD1-CD1 4.2Å; L378-V382 HydrophobicContact CD1-CG2 4.04Å; L378-V382 HydrophobicContact CG-CG2 4.41Å; L378-V382 WeakPolarHBondContact O-CB 3.4Å; L378-V382 VanDerWaalsContact O-CG2 3.31Å; L378-V382 WeakPolarHBondContact O-CG2 3.19Å; L378-V382 PolarHBondContact O-N 3.48Å; L378-L402 HydrophobicContact CD1-CD1 3.58Å; L378-L402 HydrophobicContact CD2-CD1 4.29Å; L378-V409 HydrophobicContact CD2-CG1 4.27Å; L378-V409 HydrophobicContact CD2-CG2 4.24Å; L378-L410 HydrophobicContact CD2-CD2 4.47Å
379	F	91	Very high	93	Very high	84 Å²	84	35.3 Å²	35.3	37%	0.368	18%	0.175	S	C	.	.	H	α-helix	trans	-70.6	-51.1	-175.8	-64.6	-96.3	0	0	0	110.6	D377 F381 V382 R383 D412 L413	D377-F379 PolarHBondContact O-N 2.63Å; D377-F379 WeakPolarHBondContact OD1-CB 3.37Å; D377-F379 PolarHBondContact OD1-N 2.9Å; F379-F381 VanDerWaalsContact C-N 3.3Å; F379-F381 PolarHBondContact O-N 3.33Å; F379-V382 PolarHBondContact O-N 3.24Å; F379-R383 WeakPolarHBondContact O-CB 3.31Å; F379-R383 PolarHBondContact O-N 3.1Å; F379-D412 HydrophobicContact CE1-CB 4.46Å; F379-L413 HydrophobicContact CB-CD2 4.22Å; F379-L413 HydrophobicContact CD1-CD1 4.09Å; F379-L413 HydrophobicContact CD1-CD2 3.51Å; F379-L413 HydrophobicContact CD1-CG 3.39Å; F379-L413 HydrophobicContact CE1-CD1 4.39Å; F379-L413 HydrophobicContact CE1-CD2 4.33Å; F379-L413 HydrophobicContact CE1-CG 3.73Å; F379-L413 HydrophobicContact CG-CD2 4.32Å; F379-L413 HydrophobicContact CG-CG 4.46Å
380	S	93.5	Very high	91.7	Very high	35 Å²	35	39.7 Å²	39.7	25%	0.245	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-40.4	174.8	-69.4	0	0	0	0	111.3	S372 D377 R383 I384	S372-S380 WeakPolarHBondContact OG-CB 3.49Å; D377-S380 VanDerWaalsContact CG-CB 3.47Å; D377-S380 PolarHBondContact OD1-N 3.31Å; D377-S380 WeakPolarHBondContact OD2-CB 3.25Å; D377-S380 PolarHBondContact OD2-OG 3.45Å; S380-R383 PolarHBondContact O-N 3.07Å; S380-I384 WeakPolarHBondContact O-CB 3.38Å; S380-I384 WeakPolarHBondContact O-CD1 3.26Å; S380-I384 WeakPolarHBondContact O-CG1 3.34Å; S380-I384 PolarHBondContact O-N 3.21Å
381	F	95.1	Very high	90.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-51.7	176.1	171.4	-102.7	0	0	0	112.1	A133 F137 L369 I373 D377 L378 F379 R383 I384 A385 F394 F398	A133-F381 HydrophobicContact CB-CE1 4.41Å; A133-F381 HydrophobicContact CB-CE2 4.39Å; A133-F381 HydrophobicContact CB-CZ 3.89Å; F137-F381 HydrophobicContact CD2-CD1 4.46Å; F137-F381 HydrophobicContact CE2-CB 4.18Å; F137-F381 AromaticContact CE2-CD1 3.75Å; F137-F381 HydrophobicContact CE2-CD1 3.75Å; F137-F381 HydrophobicContact CE2-CD2 4.43Å; F137-F381 HydrophobicContact CE2-CE1 4.19Å; F137-F381 AromaticContact CE2-CG 3.86Å; F137-F381 HydrophobicContact CE2-CG 3.86Å; F137-F381 HydrophobicContact CZ-CB 4.22Å; F137-F381 HydrophobicContact CZ-CG 4.38Å; L369-F381 HydrophobicContact CB-CD2 4.49Å; L369-F381 HydrophobicContact CD2-CD2 3.63Å; L369-F381 HydrophobicContact CD2-CE2 3.93Å; L369-F381 WeakPolarHBondContact CD2-O 3.48Å; I373-F381 HydrophobicContact CD1-CD2 3.96Å; I373-F381 HydrophobicContact CD1-CE2 3.67Å; I373-F381 HydrophobicContact CG1-CD2 3.56Å; I373-F381 HydrophobicContact CG1-CE2 3.77Å; I373-F381 HydrophobicContact CG1-CG 4.28Å; D377-F381 WeakPolarHBondContact O-CB 3.4Å; D377-F381 PolarHBondContact O-N 3.45Å; L378-F381 HydrophobicContact CD1-CD1 4.2Å; F379-F381 VanDerWaalsContact C-N 3.3Å; F379-F381 PolarHBondContact O-N 3.33Å; F381-R383 PolarHBondContact O-N 2.98Å; F381-I384 PolarHBondContact O-N 3.5Å; F381-A385 WeakPolarHBondContact O-CB 3.46Å; F381-A385 PolarHBondContact O-N 2.71Å; F381-F394 HydrophobicContact CE1-CE1 4.31Å; F381-F394 HydrophobicContact CE2-CE1 4.29Å; F381-F394 HydrophobicContact CE2-CZ 4.49Å; F381-F394 AromaticContact CZ-CE1 3.57Å; F381-F394 HydrophobicContact CZ-CE1 3.57Å; F381-F394 AromaticContact CZ-CZ 3.85Å; F381-F394 HydrophobicContact CZ-CZ 3.85Å; F381-F398 HydrophobicContact CD1-CE1 4.41Å; F381-F398 AromaticContact CE1-CD1 3.69Å; F381-F398 HydrophobicContact CE1-CD1 3.69Å; F381-F398 AromaticContact CE1-CE1 3.54Å; F381-F398 HydrophobicContact CE1-CE1 3.54Å; F381-F398 HydrophobicContact CE1-CZ 4.34Å; F381-F398 HydrophobicContact CZ-CD1 4.38Å; F381-F398 HydrophobicContact CZ-CE1 4.24Å
382	V	93.2	Very high	90.2	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-45.2	179.2	164.7	0	0	0	0	111.1	L378 F379 A385 S386 I395 T399 L410 L413 L452 F456	L378-V382 HydrophobicContact CD1-CG2 4.04Å; L378-V382 HydrophobicContact CG-CG2 4.41Å; L378-V382 WeakPolarHBondContact O-CB 3.4Å; L378-V382 VanDerWaalsContact O-CG2 3.31Å; L378-V382 WeakPolarHBondContact O-CG2 3.19Å; L378-V382 PolarHBondContact O-N 3.48Å; F379-V382 PolarHBondContact O-N 3.24Å; V382-A385 PolarHBondContact O-N 3.47Å; V382-S386 WeakPolarHBondContact O-CB 3.15Å; V382-S386 PolarHBondContact O-N 3.49Å; V382-S386 PolarHBondContact O-OG 3.44Å; V382-I395 HydrophobicContact CB-CD1 4.38Å; V382-I395 HydrophobicContact CG1-CD1 4.17Å; V382-I395 HydrophobicContact CG2-CD1 4.34Å; V382-T399 HydrophobicContact CG1-CG2 4.37Å; V382-T399 HydrophobicContact CG2-CG2 4.16Å; V382-L410 HydrophobicContact CG2-CD2 4.14Å; V382-L413 HydrophobicContact CG1-CD1 4.15Å; V382-L452 HydrophobicContact CG1-CD2 4.29Å; V382-F456 HydrophobicContact CG1-CE2 3.77Å; V382-F456 HydrophobicContact CG1-CZ 3.91Å
383	R	92	Very high	90.1	Very high	107 Å²	107	42.1 Å²	42.1	40%	0.404	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-54.7	179.5	-172.5	-174.4	66.1	73.9	1.4	111.2	F379 S380 F381 A385 S386 E387	F379-R383 WeakPolarHBondContact O-CB 3.31Å; F379-R383 PolarHBondContact O-N 3.1Å; S380-R383 PolarHBondContact O-N 3.07Å; F381-R383 PolarHBondContact O-N 2.98Å; R383-A385 VanDerWaalsContact C-N 3.31Å; R383-A385 PolarHBondContact O-N 3.07Å; R383-S386 PolarHBondContact O-N 3.09Å; R383-S386 PolarHBondContact O-OG 3.39Å; R383-E387 VanDerWaalsContact CG-OE1 3.25Å; R383-E387 WeakPolarHBondContact CG-OE1 3.38Å; R383-E387 IonicContact CZ-OE1 2.65Å; R383-E387 VanDerWaalsContact NH1-CD 3.33Å; R383-E387 IonicContact NH1-OE1 3.44Å; R383-E387 PolarHBondContact NH1-OE1 2.94Å; R383-E387 IonicContact NH1-OE2 2.74Å; R383-E387 PolarHBondContact NH1-OE2 3.38Å; R383-E387 WeakPolarHBondContact O-CG 3.38Å; R383-E387 PolarHBondContact O-N 3.43Å
384	I	92.7	Very high	89.9	Confident	17 Å²	17	42.1 Å²	42.1	9%	0.087	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-42.2	-178.8	-63.2	165.4	0	0	0	110.3	A368 L369 S380 F381 S386 E387 K388	A368-I384 HydrophobicContact CB-CD1 4.05Å; A368-I384 HydrophobicContact CB-CG2 4.32Å; L369-I384 HydrophobicContact CD2-CB 3.81Å; L369-I384 HydrophobicContact CD2-CG2 3.71Å; L369-I384 HydrophobicContact CG-CB 4.37Å; L369-I384 HydrophobicContact CG-CG2 3.72Å; S380-I384 WeakPolarHBondContact O-CB 3.38Å; S380-I384 WeakPolarHBondContact O-CD1 3.26Å; S380-I384 WeakPolarHBondContact O-CG1 3.34Å; S380-I384 PolarHBondContact O-N 3.21Å; F381-I384 PolarHBondContact O-N 3.5Å; I384-S386 VanDerWaalsContact C-N 3.33Å; I384-S386 PolarHBondContact O-N 3.09Å; I384-E387 PolarHBondContact O-N 3.28Å; I384-K388 HydrophobicContact CG2-CB 4.36Å; I384-K388 HydrophobicContact CG2-CG 3.9Å; I384-K388 VanDerWaalsContact O-CB 3.26Å; I384-K388 WeakPolarHBondContact O-CB 3.38Å; I384-K388 WeakPolarHBondContact O-CG 3.42Å; I384-K388 PolarHBondContact O-N 2.78Å
385	A	93.4	Very high	89.8	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-64	-40.6	-179.9	0	0	0	0	0	111.1	L369 F381 V382 R383 L389 F394 I395	L369-A385 HydrophobicContact CD2-CB 3.76Å; F381-A385 WeakPolarHBondContact O-CB 3.46Å; F381-A385 PolarHBondContact O-N 2.71Å; V382-A385 PolarHBondContact O-N 3.47Å; R383-A385 VanDerWaalsContact C-N 3.31Å; R383-A385 PolarHBondContact O-N 3.07Å; A385-L389 HydrophobicContact CB-CD1 3.87Å; A385-L389 HydrophobicContact CB-CG 4.47Å; A385-L389 WeakPolarHBondContact O-CB 3.36Å; A385-L389 WeakPolarHBondContact O-CG 3.34Å; A385-L389 PolarHBondContact O-N 3.44Å; A385-F394 HydrophobicContact CB-CD1 4.47Å; A385-I395 HydrophobicContact CB-CD1 3.89Å
386	S	90.2	Very high	89.8	Confident	29 Å²	29	39.4 Å²	39.4	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-69.4	-31.7	177.6	72.1	0	0	0	0	114.1	V382 R383 I384	V382-S386 WeakPolarHBondContact O-CB 3.15Å; V382-S386 PolarHBondContact O-N 3.49Å; V382-S386 PolarHBondContact O-OG 3.44Å; R383-S386 PolarHBondContact O-N 3.09Å; R383-S386 PolarHBondContact O-OG 3.39Å; I384-S386 VanDerWaalsContact C-N 3.33Å; I384-S386 PolarHBondContact O-N 3.09Å
387	E	87.9	Confident	89.9	Confident	108 Å²	108	36.9 Å²	36.9	51%	0.505	18%	0.182	S	C	.	.	H	α-helix	trans	-86.2	-37.8	-178.7	-72.5	173.9	-162	0	0	113.1	R383 I384	R383-E387 VanDerWaalsContact CG-OE1 3.25Å; R383-E387 WeakPolarHBondContact CG-OE1 3.38Å; R383-E387 IonicContact CZ-OE1 2.65Å; R383-E387 VanDerWaalsContact NH1-CD 3.33Å; R383-E387 IonicContact NH1-OE1 3.44Å; R383-E387 PolarHBondContact NH1-OE1 2.94Å; R383-E387 IonicContact NH1-OE2 2.74Å; R383-E387 PolarHBondContact NH1-OE2 3.38Å; R383-E387 WeakPolarHBondContact O-CG 3.38Å; R383-E387 PolarHBondContact O-N 3.43Å; I384-E387 PolarHBondContact O-N 3.28Å
388	K	87	Confident	89.9	Confident	111 Å²	111	34.2 Å²	34.2	48%	0.483	17%	0.168	S	C	.	.	H	α-helix	trans	-106.2	-26.2	-165.6	-57.2	-60.2	-177.8	-177.4	0	114	I384 S390	I384-K388 HydrophobicContact CG2-CB 4.36Å; I384-K388 HydrophobicContact CG2-CG 3.9Å; I384-K388 VanDerWaalsContact O-CB 3.26Å; I384-K388 WeakPolarHBondContact O-CB 3.38Å; I384-K388 WeakPolarHBondContact O-CG 3.42Å; I384-K388 PolarHBondContact O-N 2.78Å; K388-S390 PolarHBondContact O-N 3.05Å
389	L	83.5	Confident	90	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.052	16%	0.163	C	C	.	.			trans	-79.2	118.6	173.3	-57.7	176.7	0	0	0	107.9	L126 L129 F362 L369 A385 N391 F394	L126-L389 HydrophobicContact CD2-CD1 4.05Å; L126-L389 HydrophobicContact CD2-CD2 4.12Å; L129-L389 HydrophobicContact CD1-CD2 4.49Å; F362-L389 HydrophobicContact CE2-CD2 4.11Å; L369-L389 HydrophobicContact CD1-CD1 4.23Å; L369-L389 HydrophobicContact CD1-CD2 3.93Å; L369-L389 HydrophobicContact CD1-CG 4.13Å; A385-L389 HydrophobicContact CB-CD1 3.87Å; A385-L389 HydrophobicContact CB-CG 4.47Å; A385-L389 WeakPolarHBondContact O-CB 3.36Å; A385-L389 WeakPolarHBondContact O-CG 3.34Å; A385-L389 PolarHBondContact O-N 3.44Å; L389-N391 PolarHBondContact O-N 3.34Å; L389-F394 HydrophobicContact CD1-CB 3.99Å; L389-F394 HydrophobicContact CD1-CD1 3.56Å; L389-F394 HydrophobicContact CD1-CE1 4.17Å; L389-F394 HydrophobicContact CD1-CG 3.79Å
390	S	69	Low	90.1	Very high	92 Å²	92	29.6 Å²	29.6	64%	0.643	15%	0.147	S	C	*	.	S	Bend	trans	-65.7	-9.4	-176.9	54.8	0	0	0	0	114	K388	K388-S390 PolarHBondContact O-N 3.05Å
391	N	74.4	Confident	90.1	Very high	12 Å²	12	28 Å²	28	6%	0.064	14%	0.136	C	C	.	.			trans	-113.2	135	174	73.3	42	0	0	0	111.4	L126 L389 W393 F394	L126-N391 VanDerWaalsContact CD1-ND2 3.25Å; L126-N391 WeakPolarHBondContact CD1-ND2 3.16Å; L389-N391 PolarHBondContact O-N 3.34Å; N391-W393 HydrophobicContact CB-CB 4.37Å; N391-W393 PolarHBondContact O-N 2.93Å; N391-F394 PolarHBondContact OD1-N 2.75Å
392	W	87.4	Confident	89.9	Confident	86 Å²	86	28 Å²	28	33%	0.326	14%	0.136	S	C	.	.	H	α-helix	trans	-71.6	-12.6	169.7	-65.8	101.2	0	0	0	112.3	F394 I395 A396 F455 F456 Y460	W392-F394 VanDerWaalsContact C-N 3.34Å; W392-F394 PolarHBondContact O-N 2.85Å; W392-I395 HydrophobicContact CE3-CG2 3.8Å; W392-I395 HydrophobicContact CZ3-CG2 4.4Å; W392-I395 PolarHBondContact O-N 3.27Å; W392-A396 WeakPolarHBondContact O-CB 3.23Å; W392-A396 PolarHBondContact O-N 2.91Å; W392-F455 HydrophobicContact CH2-CE1 4.13Å; W392-F455 HydrophobicContact CH2-CZ 4.44Å; W392-F455 HydrophobicContact CZ3-CE1 4.24Å; W392-F456 HydrophobicContact CE3-CD1 4.04Å; W392-F456 AromaticContact CZ3-CD1 3.56Å; W392-F456 HydrophobicContact CZ3-CD1 3.56Å; W392-F456 HydrophobicContact CZ3-CE1 4.01Å; W392-Y460 HydrophobicContact CB-CD2 4.25Å; W392-Y460 HydrophobicContact CB-CG 4.45Å
393	W	92.6	Very high	89.7	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-54	-50.5	-177.6	-179.8	94.1	0	0	0	111.2	L60 S64 Y87 L91 W130 N391 H397 Y460	L60-W393 HydrophobicContact CD1-CZ2 4.22Å; S64-W393 PolarHBondContact OG-NE1 3.45Å; Y87-W393 HydrophobicContact CD1-CZ2 4.32Å; L91-W393 HydrophobicContact CD1-CH2 3.66Å; L91-W393 HydrophobicContact CD1-CZ3 3.77Å; L91-W393 HydrophobicContact CD2-CE3 4.3Å; L91-W393 HydrophobicContact CD2-CH2 3.55Å; L91-W393 HydrophobicContact CD2-CZ2 4.21Å; L91-W393 HydrophobicContact CD2-CZ3 3.6Å; L91-W393 HydrophobicContact CG-CH2 3.56Å; L91-W393 HydrophobicContact CG-CZ2 4.37Å; L91-W393 HydrophobicContact CG-CZ3 3.96Å; W130-W393 HydrophobicContact CE3-CH2 4.35Å; W130-W393 HydrophobicContact CE3-CZ3 4.11Å; W130-W393 HydrophobicContact CZ3-CH2 4.22Å; W130-W393 HydrophobicContact CZ3-CZ3 4.08Å; N391-W393 HydrophobicContact CB-CB 4.37Å; N391-W393 PolarHBondContact O-N 2.93Å; W393-H397 AromaticContact CD1-CE1 3.4Å; W393-H397 AromaticContact CD1-ND1 3.63Å; W393-H397 AromaticContact CD2-ND1 3.86Å; W393-H397 AromaticContact CE2-CE1 3.97Å; W393-H397 AromaticContact CE2-ND1 3.71Å; W393-H397 AromaticContact CG-CE1 3.99Å; W393-H397 AromaticContact CG-ND1 3.79Å; W393-H397 AromaticContact NE1-CE1 3.37Å; W393-H397 PolarHBondContact NE1-CE1 3.47Å; W393-H397 AromaticContact NE1-ND1 3.58Å; W393-H397 PolarHBondContact O-N 3.37Å; W393-H397 PolarHBondContact O-ND1 3.22Å; W393-Y460 HydrophobicContact CB-CD2 4.21Å; W393-Y460 HydrophobicContact CB-CE2 3.8Å; W393-Y460 AromaticContact CD1-CE2 3.88Å; W393-Y460 AromaticContact CD1-CZ 3.71Å; W393-Y460 HydrophobicContact CG-CE2 4.26Å
394	F	94.5	Very high	89.6	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-54.7	-175.3	-176.9	-85.6	0	0	0	111	L126 L129 W130 F381 A385 L389 N391 W392 A396 F398	L126-F394 HydrophobicContact CB-CD2 4.1Å; L126-F394 HydrophobicContact CD2-CB 4.06Å; L126-F394 HydrophobicContact CD2-CD2 3.78Å; L126-F394 HydrophobicContact CD2-CG 4.09Å; L126-F394 HydrophobicContact CG-CD2 4.45Å; L126-F394 WeakPolarHBondContact O-CE2 3.32Å; L129-F394 HydrophobicContact CB-CE2 4.06Å; L129-F394 HydrophobicContact CB-CZ 4.03Å; W130-F394 HydrophobicContact CB-CE2 3.89Å; W130-F394 HydrophobicContact CD2-CE2 4.45Å; W130-F394 AromaticContact CE3-CD2 3.86Å; W130-F394 HydrophobicContact CE3-CD2 3.86Å; W130-F394 AromaticContact CE3-CE2 3.74Å; W130-F394 HydrophobicContact CE3-CE2 3.74Å; W130-F394 HydrophobicContact CE3-CZ 4.34Å; W130-F394 HydrophobicContact CZ3-CD2 4.48Å; F381-F394 HydrophobicContact CE1-CE1 4.31Å; F381-F394 HydrophobicContact CE2-CE1 4.29Å; F381-F394 HydrophobicContact CE2-CZ 4.49Å; F381-F394 AromaticContact CZ-CE1 3.57Å; F381-F394 HydrophobicContact CZ-CE1 3.57Å; F381-F394 AromaticContact CZ-CZ 3.85Å; F381-F394 HydrophobicContact CZ-CZ 3.85Å; A385-F394 HydrophobicContact CB-CD1 4.47Å; L389-F394 HydrophobicContact CD1-CB 3.99Å; L389-F394 HydrophobicContact CD1-CD1 3.56Å; L389-F394 HydrophobicContact CD1-CE1 4.17Å; L389-F394 HydrophobicContact CD1-CG 3.79Å; N391-F394 PolarHBondContact OD1-N 2.75Å; W392-F394 VanDerWaalsContact C-N 3.34Å; W392-F394 PolarHBondContact O-N 2.85Å; F394-A396 PolarHBondContact O-N 3.22Å; F394-F398 VanDerWaalsContact O-CB 3.25Å; F394-F398 WeakPolarHBondContact O-CB 3.31Å; F394-F398 PolarHBondContact O-N 2.66Å
395	I	94.1	Very high	89.3	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-69.1	-37.2	-174.1	-165.4	66.4	0	0	0	112.3	V382 A385 W392 T399 F456	V382-I395 HydrophobicContact CB-CD1 4.38Å; V382-I395 HydrophobicContact CG1-CD1 4.17Å; V382-I395 HydrophobicContact CG2-CD1 4.34Å; A385-I395 HydrophobicContact CB-CD1 3.89Å; W392-I395 HydrophobicContact CE3-CG2 3.8Å; W392-I395 HydrophobicContact CZ3-CG2 4.4Å; W392-I395 PolarHBondContact O-N 3.27Å; I395-T399 HydrophobicContact CD1-CG2 3.56Å; I395-T399 HydrophobicContact CG1-CG2 3.84Å; I395-T399 VanDerWaalsContact O-CB 3.31Å; I395-T399 WeakPolarHBondContact O-CB 3.25Å; I395-T399 VanDerWaalsContact O-CG2 3.3Å; I395-T399 WeakPolarHBondContact O-CG2 3.25Å; I395-T399 PolarHBondContact O-N 3.15Å; I395-T399 PolarHBondContact O-OG1 2.91Å; I395-F456 HydrophobicContact CG1-CD1 4.31Å; I395-F456 HydrophobicContact CG1-CD2 3.88Å; I395-F456 HydrophobicContact CG1-CE1 4.33Å; I395-F456 HydrophobicContact CG1-CE2 3.89Å; I395-F456 HydrophobicContact CG1-CG 4.08Å; I395-F456 HydrophobicContact CG1-CZ 4.11Å; I395-F456 HydrophobicContact CG2-CB 4.31Å; I395-F456 HydrophobicContact CG2-CD1 4.19Å; I395-F456 HydrophobicContact CG2-CG 4.21Å
396	A	94.1	Very high	89	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.6	-46.8	178.9	0	0	0	0	0	111.9	W392 F394 N400 F456 L457 Y460	W392-A396 WeakPolarHBondContact O-CB 3.23Å; W392-A396 PolarHBondContact O-N 2.91Å; F394-A396 PolarHBondContact O-N 3.22Å; A396-N400 WeakPolarHBondContact O-CB 3.42Å; A396-N400 PolarHBondContact O-N 2.94Å; A396-F456 HydrophobicContact CB-CB 4.44Å; A396-L457 HydrophobicContact CB-CD1 4.33Å; A396-Y460 HydrophobicContact CB-CD1 4.33Å; A396-Y460 HydrophobicContact CB-CG 4.15Å
397	H	95.7	Very high	88.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-73.4	-41.2	180	-65.8	97.3	0	0	0	112	Y87 W130 W393 N400 L401 Y460 Y477	Y87-H397 HydrophobicContact CD1-CB 4.43Å; Y87-H397 HydrophobicContact CE1-CB 4Å; Y87-H397 AromaticContact CE1-CD2 3.4Å; Y87-H397 WeakPolarHBondContact CE1-CD2 3.32Å; Y87-H397 AromaticContact CE1-CG 3.84Å; Y87-H397 AromaticContact CZ-CD2 3.72Å; Y87-H397 PolarHBondContact OH-CD2 2.96Å; W130-H397 HydrophobicContact CH2-CB 3.7Å; W130-H397 HydrophobicContact CZ3-CB 4.02Å; W393-H397 AromaticContact CD1-CE1 3.4Å; W393-H397 AromaticContact CD1-ND1 3.63Å; W393-H397 AromaticContact CD2-ND1 3.86Å; W393-H397 AromaticContact CE2-CE1 3.97Å; W393-H397 AromaticContact CE2-ND1 3.71Å; W393-H397 AromaticContact CG-CE1 3.99Å; W393-H397 AromaticContact CG-ND1 3.79Å; W393-H397 AromaticContact NE1-CE1 3.37Å; W393-H397 PolarHBondContact NE1-CE1 3.47Å; W393-H397 AromaticContact NE1-ND1 3.58Å; W393-H397 PolarHBondContact O-N 3.37Å; W393-H397 PolarHBondContact O-ND1 3.22Å; H397-N400 PolarHBondContact O-N 3.47Å; H397-L401 WeakPolarHBondContact O-CB 3.44Å; H397-L401 PolarHBondContact O-N 3.3Å; H397-Y460 AromaticContact CE1-CE1 3.45Å; H397-Y460 VanDerWaalsContact CE1-CE1 3.45Å; H397-Y460 WeakPolarHBondContact CE1-CE1 3.3Å; H397-Y460 AromaticContact CE1-CZ 3.77Å; H397-Y477 PolarHBondContact CE1-OH 2.99Å; H397-Y477 AromaticContact NE2-CE1 3.64Å; H397-Y477 AromaticContact NE2-CZ 3.5Å; H397-Y477 PolarHBondContact NE2-OH 3.46Å
398	F	95.1	Very high	88.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-67.3	-46.3	-177.4	-163.3	-97	0	0	0	111.6	W130 A133 F137 I138 F381 F394 N400 L401 L402	W130-F398 AromaticContact CD2-CD2 3.88Å; W130-F398 HydrophobicContact CD2-CD2 3.88Å; W130-F398 HydrophobicContact CD2-CE2 4.44Å; W130-F398 AromaticContact CE2-CD2 3.85Å; W130-F398 HydrophobicContact CE3-CB 4.37Å; W130-F398 AromaticContact CE3-CD2 3.9Å; W130-F398 HydrophobicContact CE3-CD2 3.9Å; W130-F398 HydrophobicContact CH2-CB 3.93Å; W130-F398 AromaticContact CH2-CD2 3.94Å; W130-F398 HydrophobicContact CH2-CD2 3.94Å; W130-F398 HydrophobicContact CH2-CG 4.45Å; W130-F398 AromaticContact CZ2-CD2 3.89Å; W130-F398 HydrophobicContact CZ2-CD2 3.89Å; W130-F398 HydrophobicContact CZ3-CB 3.75Å; W130-F398 AromaticContact CZ3-CD2 3.94Å; W130-F398 HydrophobicContact CZ3-CD2 3.94Å; W130-F398 HydrophobicContact CZ3-CG 4.37Å; A133-F398 HydrophobicContact CB-CE1 4.2Å; A133-F398 HydrophobicContact CB-CE2 3.79Å; A133-F398 HydrophobicContact CB-CZ 3.43Å; A133-F398 VanDerWaalsContact CB-CZ 3.43Å; F137-F398 HydrophobicContact CD2-CE1 4.21Å; F137-F398 HydrophobicContact CD2-CZ 4.22Å; I138-F398 HydrophobicContact CD1-CE2 3.97Å; I138-F398 HydrophobicContact CD1-CZ 4.07Å; F381-F398 HydrophobicContact CD1-CE1 4.41Å; F381-F398 AromaticContact CE1-CD1 3.69Å; F381-F398 HydrophobicContact CE1-CD1 3.69Å; F381-F398 AromaticContact CE1-CE1 3.54Å; F381-F398 HydrophobicContact CE1-CE1 3.54Å; F381-F398 HydrophobicContact CE1-CZ 4.34Å; F381-F398 HydrophobicContact CZ-CD1 4.38Å; F381-F398 HydrophobicContact CZ-CE1 4.24Å; F394-F398 VanDerWaalsContact O-CB 3.25Å; F394-F398 WeakPolarHBondContact O-CB 3.31Å; F394-F398 PolarHBondContact O-N 2.66Å; F398-N400 VanDerWaalsContact C-N 3.35Å; F398-N400 PolarHBondContact O-N 3.16Å; F398-L401 PolarHBondContact O-N 3.46Å; F398-L402 HydrophobicContact CD1-CD1 3.59Å; F398-L402 HydrophobicContact CD1-CG 4Å; F398-L402 HydrophobicContact CE1-CD1 3.5Å; F398-L402 VanDerWaalsContact CE1-CD1 3.5Å; F398-L402 HydrophobicContact CE1-CD2 4.2Å; F398-L402 HydrophobicContact CE1-CG 3.84Å; F398-L402 WeakPolarHBondContact O-CG 3.31Å; F398-L402 PolarHBondContact O-N 3.33Å
399	T	93.2	Very high	87.9	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.5	-34.1	178.2	58.1	0	0	0	0	112.5	V382 I395 L402 N403 L410 F456	V382-T399 HydrophobicContact CG1-CG2 4.37Å; V382-T399 HydrophobicContact CG2-CG2 4.16Å; I395-T399 HydrophobicContact CD1-CG2 3.56Å; I395-T399 HydrophobicContact CG1-CG2 3.84Å; I395-T399 VanDerWaalsContact O-CB 3.31Å; I395-T399 WeakPolarHBondContact O-CB 3.25Å; I395-T399 VanDerWaalsContact O-CG2 3.3Å; I395-T399 WeakPolarHBondContact O-CG2 3.25Å; I395-T399 PolarHBondContact O-N 3.15Å; I395-T399 PolarHBondContact O-OG1 2.91Å; T399-L402 PolarHBondContact O-N 3.01Å; T399-N403 WeakPolarHBondContact O-CB 3.31Å; T399-N403 PolarHBondContact O-N 3.04Å; T399-L410 HydrophobicContact CG2-CD1 4.05Å; T399-F456 HydrophobicContact CG2-CD2 3.77Å; T399-F456 HydrophobicContact CG2-CE2 3.86Å; T399-F456 WeakPolarHBondContact OG1-CD2 3.49Å
400	N	92.8	Very high	87.7	Confident	9 Å²	9	27.1 Å²	27.1	5%	0.048	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-46.1	171.4	177.2	81.4	0	0	0	111.3	F68 L71 Q72 A396 H397 F398 N403 H404 V453	F68-N400 HydrophobicContact CE2-CB 4.35Å; L71-N400 WeakPolarHBondContact CD2-ND2 3.25Å; Q72-N400 VanDerWaalsContact NE2-CG 3.34Å; Q72-N400 PolarHBondContact NE2-ND2 3.4Å; Q72-N400 PolarHBondContact NE2-OD1 3.11Å; A396-N400 WeakPolarHBondContact O-CB 3.42Å; A396-N400 PolarHBondContact O-N 2.94Å; H397-N400 PolarHBondContact O-N 3.47Å; F398-N400 VanDerWaalsContact C-N 3.35Å; F398-N400 PolarHBondContact O-N 3.16Å; N400-N403 PolarHBondContact O-N 3.41Å; N400-H404 PolarHBondContact O-CD2 3.01Å; N400-H404 PolarHBondContact O-N 3.03Å; N400-V453 HydrophobicContact CB-CG1 3.95Å
401	L	93.5	Very high	87.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61	-46.8	175.8	178	62.4	0	0	0	111.8	L71 F80 H83 W130 I138 H397 F398 N403 H404 I405	L71-L401 HydrophobicContact CD1-CD1 4.03Å; L71-L401 HydrophobicContact CD2-CB 4.26Å; L71-L401 HydrophobicContact CD2-CD1 3.84Å; F80-L401 HydrophobicContact CB-CD1 4.25Å; H83-L401 HydrophobicContact CB-CD1 4.44Å; W130-L401 HydrophobicContact CZ2-CD2 4.05Å; I138-L401 HydrophobicContact CD1-CD2 3.72Å; I138-L401 HydrophobicContact CD1-CG 4.24Å; H397-L401 WeakPolarHBondContact O-CB 3.44Å; H397-L401 PolarHBondContact O-N 3.3Å; F398-L401 PolarHBondContact O-N 3.46Å; L401-N403 VanDerWaalsContact C-N 3.3Å; L401-N403 PolarHBondContact O-N 3.45Å; L401-H404 PolarHBondContact O-N 3.3Å; L401-H404 VanDerWaalsContact O-N 3.14Å; L401-I405 HydrophobicContact CD1-CD1 4.05Å; L401-I405 HydrophobicContact CD1-CG1 4.47Å; L401-I405 HydrophobicContact CG-CD1 3.85Å; L401-I405 WeakPolarHBondContact O-CG1 3.18Å; L401-I405 PolarHBondContact O-N 2.63Å; L401-I405 VanDerWaalsContact O-N 3.12Å
402	L	91.4	Very high	87.3	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-40.6	176.5	-76.8	174.8	0	0	0	112.7	F137 I138 L378 F398 T399 H404 I405 Y406	F137-L402 HydrophobicContact CB-CD2 4.41Å; I138-L402 HydrophobicContact CG1-CD2 4.09Å; L378-L402 HydrophobicContact CD1-CD1 3.58Å; L378-L402 HydrophobicContact CD2-CD1 4.29Å; F398-L402 HydrophobicContact CD1-CD1 3.59Å; F398-L402 HydrophobicContact CD1-CG 4Å; F398-L402 HydrophobicContact CE1-CD1 3.5Å; F398-L402 VanDerWaalsContact CE1-CD1 3.5Å; F398-L402 HydrophobicContact CE1-CD2 4.2Å; F398-L402 HydrophobicContact CE1-CG 3.84Å; F398-L402 WeakPolarHBondContact O-CG 3.31Å; F398-L402 PolarHBondContact O-N 3.33Å; T399-L402 PolarHBondContact O-N 3.01Å; L402-H404 VanDerWaalsContact C-N 3.25Å; L402-H404 PolarHBondContact O-N 3.03Å; L402-I405 PolarHBondContact O-N 3.14Å; L402-I405 VanDerWaalsContact O-N 3.15Å; L402-Y406 HydrophobicContact CD2-CD2 4.3Å; L402-Y406 HydrophobicContact CD2-CE2 4.43Å; L402-Y406 PolarHBondContact O-N 3.11Å
403	N	89.8	Confident	86	Confident	40 Å²	40	26.6 Å²	26.6	21%	0.214	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-25.9	180	-176	71.7	0	0	0	113.2	T399 N400 L401 P407 V453	T399-N403 WeakPolarHBondContact O-CB 3.31Å; T399-N403 PolarHBondContact O-N 3.04Å; N400-N403 PolarHBondContact O-N 3.41Å; L401-N403 VanDerWaalsContact C-N 3.3Å; L401-N403 PolarHBondContact O-N 3.45Å; N403-P407 WeakPolarHBondContact O-CA 3.3Å; N403-V453 HydrophobicContact CB-CG2 3.59Å
404	H	88.6	Confident	84.2	Confident	45 Å²	45	29.1 Å²	29.1	21%	0.208	16%	0.159	C	C	.	.	H	α-helix	trans	-74.5	-36	170.6	-79.5	-70.9	0	0	0	112.2	L71 Q72 F80 N400 L401 L402	L71-H404 HydrophobicContact CD1-CB 4.42Å; Q72-H404 PolarHBondContact OE1-CE1 2.65Å; Q72-H404 PolarHBondContact OE1-NE2 3.39Å; F80-H404 HydrophobicContact CD1-CB 4.43Å; F80-H404 HydrophobicContact CE1-CB 4.02Å; F80-H404 HydrophobicContact CE2-CB 4.36Å; F80-H404 WeakPolarHBondContact CE2-O 3.46Å; F80-H404 HydrophobicContact CZ-CB 3.98Å; N400-H404 PolarHBondContact O-CD2 3.01Å; N400-H404 PolarHBondContact O-N 3.03Å; L401-H404 PolarHBondContact O-N 3.3Å; L401-H404 VanDerWaalsContact O-N 3.14Å; L402-H404 VanDerWaalsContact C-N 3.25Å; L402-H404 PolarHBondContact O-N 3.03Å
405	I	87.6	Confident	81.9	Confident	21 Å²	21	34.2 Å²	34.2	11%	0.108	19%	0.186	C	C	.	.	H	α-helix	trans	-75.9	-48.3	179.3	-60	160.1	0	0	0	111.1	F80 I138 L401 L402 P407	F80-I405 HydrophobicContact CB-CD1 4.15Å; F80-I405 HydrophobicContact CB-CG1 3.6Å; F80-I405 HydrophobicContact CD2-CB 4.34Å; F80-I405 HydrophobicContact CD2-CG1 3.68Å; F80-I405 HydrophobicContact CG-CG1 3.89Å; I138-I405 HydrophobicContact CB-CD1 4.25Å; I138-I405 HydrophobicContact CD1-CD1 3.95Å; I138-I405 HydrophobicContact CG1-CD1 3.81Å; I138-I405 HydrophobicContact CG2-CD1 3.63Å; L401-I405 HydrophobicContact CD1-CD1 4.05Å; L401-I405 HydrophobicContact CD1-CG1 4.47Å; L401-I405 HydrophobicContact CG-CD1 3.85Å; L401-I405 WeakPolarHBondContact O-CG1 3.18Å; L401-I405 PolarHBondContact O-N 2.63Å; L401-I405 VanDerWaalsContact O-N 3.12Å; L402-I405 PolarHBondContact O-N 3.14Å; L402-I405 VanDerWaalsContact O-N 3.15Å; I405-P407 WeakPolarHBondContact O-CD 3Å
406	Y	85.8	Confident	79.6	Confident	90 Å²	90	37.4 Å²	37.4	35%	0.353	21%	0.205	S	C	.	.	S	Bend	trans	-125.9	77.9	-177.1	-49.6	-66.1	0	0	0	110.6	F137 L402 G408 V409	F137-Y406 VanDerWaalsContact O-CE2 3.29Å; F137-Y406 WeakPolarHBondContact O-CE2 3.4Å; F137-Y406 PolarHBondContact O-OH 2.75Å; L402-Y406 HydrophobicContact CD2-CD2 4.3Å; L402-Y406 HydrophobicContact CD2-CE2 4.43Å; L402-Y406 PolarHBondContact O-N 3.11Å; Y406-G408 PolarHBondContact O-N 3Å; Y406-V409 WeakPolarHBondContact O-CG1 3.45Å; Y406-V409 PolarHBondContact O-N 3.39Å
407	P	83.7	Confident	77.3	Confident	103 Å²	103	43 Å²	43	67%	0.669	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	126.5	179	-24	33.2	0	0	0	111.5	N403 I405	N403-P407 WeakPolarHBondContact O-CA 3.3Å; I405-P407 WeakPolarHBondContact O-CD 3Å
408	G	76.8	Confident	74.7	Confident	26 Å²	26	49.4 Å²	49.4	27%	0.268	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	-14.5	176.2	0	0	0	0	0	116	Y406 L410 N411	Y406-G408 PolarHBondContact O-N 3Å; G408-L410 PolarHBondContact O-N 3.06Å; G408-L410 VanDerWaalsContact O-N 3.1Å; G408-N411 WeakPolarHBondContact O-CB 3.42Å; G408-N411 PolarHBondContact O-N 3.43Å
409	V	82.9	Confident	71.9	Confident	41 Å²	41	56.2 Å²	56.2	25%	0.248	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31	-179.2	77.6	0	0	0	0	112.7	L378 Y406	L378-V409 HydrophobicContact CD2-CG1 4.27Å; L378-V409 HydrophobicContact CD2-CG2 4.24Å; Y406-V409 WeakPolarHBondContact O-CG1 3.45Å; Y406-V409 PolarHBondContact O-N 3.39Å
410	L	79.7	Confident	69.2	Low	1 Å²	1	61.2 Å²	61.2	1%	0.005	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-6.3	179.8	-60.8	175.8	0	0	0	113.8	L378 V382 T399 G408 D412 L413 V453	L378-L410 HydrophobicContact CD2-CD2 4.47Å; V382-L410 HydrophobicContact CG2-CD2 4.14Å; T399-L410 HydrophobicContact CG2-CD1 4.05Å; G408-L410 PolarHBondContact O-N 3.06Å; G408-L410 VanDerWaalsContact O-N 3.1Å; L410-D412 VanDerWaalsContact C-N 3.34Å; L410-L413 HydrophobicContact CB-CD1 4.36Å; L410-L413 HydrophobicContact CD2-CD1 3.54Å; L410-L413 WeakPolarHBondContact O-CB 3.48Å; L410-V453 HydrophobicContact CD1-CG2 3.72Å
411	N	71.4	Confident	66.5	Low	66 Å²	66	67.8 Å²	67.8	35%	0.353	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-26.9	174.6	-69.3	-22.6	0	0	0	111	G408 L413 Q414	G408-N411 WeakPolarHBondContact O-CB 3.42Å; G408-N411 PolarHBondContact O-N 3.43Å; N411-L413 PolarHBondContact O-N 2.84Å; N411-Q414 WeakPolarHBondContact O-CB 3.43Å; N411-Q414 PolarHBondContact O-N 2.98Å
412	D	63.3	Low	63.6	Low	88 Å²	88	75 Å²	75	47%	0.471	39%	0.386	S	S	.	.	H	α-helix	trans	-64.5	-27	175	-66.2	-24.6	0	0	0	112.2	F379 L410 Q414 L415 T416	F379-D412 HydrophobicContact CE1-CB 4.46Å; L410-D412 VanDerWaalsContact C-N 3.34Å; D412-Q414 VanDerWaalsContact C-N 3.28Å; D412-Q414 PolarHBondContact O-N 3.01Å; D412-L415 PolarHBondContact O-N 2.97Å; D412-L415 VanDerWaalsContact O-N 3.16Å; D412-T416 PolarHBondContact O-N 3.47Å
413	L	59.4	Low	60.6	Low	26 Å²	26	79.1 Å²	79.1	14%	0.136	42%	0.415	C	S	.	.	H	α-helix	trans	-59.2	-34.9	170.5	-87.4	150.8	0	0	0	113.2	F379 V382 L410 N411 L415 T416 H417 L452	F379-L413 HydrophobicContact CB-CD2 4.22Å; F379-L413 HydrophobicContact CD1-CD1 4.09Å; F379-L413 HydrophobicContact CD1-CD2 3.51Å; F379-L413 HydrophobicContact CD1-CG 3.39Å; F379-L413 HydrophobicContact CE1-CD1 4.39Å; F379-L413 HydrophobicContact CE1-CD2 4.33Å; F379-L413 HydrophobicContact CE1-CG 3.73Å; F379-L413 HydrophobicContact CG-CD2 4.32Å; F379-L413 HydrophobicContact CG-CG 4.46Å; V382-L413 HydrophobicContact CG1-CD1 4.15Å; L410-L413 HydrophobicContact CB-CD1 4.36Å; L410-L413 HydrophobicContact CD2-CD1 3.54Å; L410-L413 WeakPolarHBondContact O-CB 3.48Å; N411-L413 PolarHBondContact O-N 2.84Å; L413-L415 VanDerWaalsContact C-N 3.29Å; L413-T416 PolarHBondContact O-OG1 3.41Å; L413-T416 VanDerWaalsContact O-OG1 3.1Å; L413-H417 PolarHBondContact O-N 3.18Å; L413-L452 HydrophobicContact CB-CD2 3.84Å; L413-L452 HydrophobicContact CD1-CD2 3.56Å; L413-L452 HydrophobicContact CG-CD2 4.2Å
414	Q	54.2	Low	57.7	Low	54 Å²	54	84.2 Å²	84.2	25%	0.252	44%	0.441	S	S	.	.	H	α-helix	trans	-73.4	-25.8	179.6	-69.4	-175.1	-22.3	0	0	111.7	N411 D412 S450 L452	N411-Q414 WeakPolarHBondContact O-CB 3.43Å; N411-Q414 PolarHBondContact O-N 2.98Å; D412-Q414 VanDerWaalsContact C-N 3.28Å; D412-Q414 PolarHBondContact O-N 3.01Å; Q414-S450 PolarHBondContact NE2-O 3.48Å; Q414-S450 VanDerWaalsContact NE2-O 3.15Å; Q414-L452 HydrophobicContact CG-CB 4.49Å
415	L	46.7	Very low	54.7	Low	108 Å²	108	91.5 Å²	91.5	57%	0.565	48%	0.475	S	S	*	.	H	α-helix	trans	-80	-35.6	179.7	-69.3	171.1	0	0	0	112	D412 L413	D412-L415 PolarHBondContact O-N 2.97Å; D412-L415 VanDerWaalsContact O-N 3.16Å; L413-L415 VanDerWaalsContact C-N 3.29Å
416	T	45.5	Very low	51.7	Low	67 Å²	67	95.1 Å²	95.1	41%	0.411	50%	0.502	S	S	.	.	H	α-helix	trans	-69.9	-40.8	176.9	52.4	0	0	0	0	112	D412 L413 K418 Q419 D420	D412-T416 PolarHBondContact O-N 3.47Å; L413-T416 PolarHBondContact O-OG1 3.41Å; L413-T416 VanDerWaalsContact O-OG1 3.1Å; T416-K418 PolarHBondContact O-N 3.49Å; T416-Q419 PolarHBondContact O-N 3.44Å; T416-D420 PolarHBondContact O-N 3.33Å
417	H	46.7	Very low	48.8	Very low	117 Å²	117	96.7 Å²	96.7	54%	0.542	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-29.3	177.9	-131.6	-71.3	0	0	0	113.3	L413 Q419 E421	L413-H417 PolarHBondContact O-N 3.18Å; H417-Q419 VanDerWaalsContact C-N 3.31Å; H417-Q419 PolarHBondContact O-N 3.01Å; H417-E421 PolarHBondContact O-N 3.21Å; H417-E421 VanDerWaalsContact O-N 3.13Å
418	K	40.7	Very low	46.2	Very low	136 Å²	136	97.5 Å²	97.5	59%	0.591	53%	0.531	S	S	*	.	H	α-helix	trans	-70.1	-24.6	173.1	-78.5	-176.4	178.7	179	0	113.3	T416 L422	T416-K418 PolarHBondContact O-N 3.49Å; K418-L422 WeakPolarHBondContact O-CD1 3.46Å
419	Q	36.7	Very low	43.7	Very low	142 Å²	142	105.8 Å²	105.8	66%	0.664	56%	0.559	S	S	*	*	H	α-helix	trans	-80.9	-35.3	175.3	-72.8	-176.8	-20.2	0	0	111.8	T416 H417 L422 S423	T416-Q419 PolarHBondContact O-N 3.44Å; H417-Q419 VanDerWaalsContact C-N 3.31Å; H417-Q419 PolarHBondContact O-N 3.01Å; Q419-L422 PolarHBondContact O-N 2.91Å; Q419-S423 PolarHBondContact O-OG 3.16Å
420	D	36	Very low	40.9	Very low	106 Å²	106	110.3 Å²	110.3	57%	0.567	59%	0.587	S	S	*	*	H	α-helix	trans	-73.9	-32.5	177.3	-75.9	-19.3	0	0	0	112.7	T416 L422 S423	T416-D420 PolarHBondContact O-N 3.33Å; D420-L422 VanDerWaalsContact C-N 3.26Å; D420-L422 PolarHBondContact O-N 3.06Å; D420-S423 PolarHBondContact O-N 3.35Å; D420-S423 PolarHBondContact O-OG 2.84Å; D420-S423 VanDerWaalsContact O-OG 3.08Å
421	E	36.7	Very low	38.5	Very low	147 Å²	147	116.1 Å²	116.1	69%	0.687	62%	0.622	S	S	*	*	H	α-helix	trans	-67.6	-25.1	171.8	-81.6	-171	160.2	0	0	113.3	H417 S423	H417-E421 PolarHBondContact O-N 3.21Å; H417-E421 VanDerWaalsContact O-N 3.13Å; E421-S423 PolarHBondContact O-N 2.96Å
422	L	32.6	Very low	36.2	Very low	150 Å²	150	120.3 Å²	120.3	79%	0.785	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-5.4	174.6	-81.4	165	0	0	0	113.6	K418 Q419 D420	K418-L422 WeakPolarHBondContact O-CD1 3.46Å; Q419-L422 PolarHBondContact O-N 2.91Å; D420-L422 VanDerWaalsContact C-N 3.26Å; D420-L422 PolarHBondContact O-N 3.06Å
423	S	28.2	Very low	34.7	Very low	87 Å²	87	126.9 Å²	126.9	61%	0.608	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	10	-179.3	44.8	0	0	0	0	114.6	Q419 D420 E421	Q419-S423 PolarHBondContact O-OG 3.16Å; D420-S423 PolarHBondContact O-N 3.35Å; D420-S423 PolarHBondContact O-OG 2.84Å; D420-S423 VanDerWaalsContact O-OG 3.08Å; E421-S423 PolarHBondContact O-N 2.96Å
424	L	28	Very low	33.1	Very low	147 Å²	147	132.9 Å²	132.9	77%	0.77	70%	0.695	S	S	*	*			trans	-107.3	40.6	172.8	-122.8	110	0	0	0	113.8	S426	L424-S426 VanDerWaalsContact C-N 3.33Å; L424-S426 PolarHBondContact O-N 2.92Å; L424-S426 VanDerWaalsContact O-N 3.15Å
425	E	25.6	Very low	32	Very low	198 Å²	198	135.7 Å²	135.7	93%	0.925	72%	0.721	S	S	*	*			trans	-79.8	82.2	159.3	-81.3	-165	160.3	0	0	109.9
426	S	25.5	Very low	30.9	Very low	97 Å²	97	140.4 Å²	140.4	68%	0.678	74%	0.737	S	S	*	*			trans	-144.7	112.5	157	64.9	0	0	0	0	113	L424	L424-S426 VanDerWaalsContact C-N 3.33Å; L424-S426 PolarHBondContact O-N 2.92Å; L424-S426 VanDerWaalsContact O-N 3.15Å
427	C	23.9	Very low	30	Very low	123 Å²	123	141.1 Å²	141.1	83%	0.831	75%	0.749	S	S	*	*	S	Bend	trans	91.8	142.5	159.5	-62	0	0	0	0	119.5
428	P	29.5	Very low	29	Very low	121 Å²	121	145.1 Å²	145.1	79%	0.786	77%	0.768	S	S	*	*				-133.8	162.1	-51.4	32.6	-14.9	0	0	0	113.5
429	K	25.4	Very low	28.3	Very low	199 Å²	199	144.8 Å²	144.8	87%	0.865	78%	0.777	S	S	*	*			trans	-54.5	128	174.7	-63.1	168	178.5	172.3	0	113.4
430	T	24	Very low	27.8	Very low	137 Å²	137	144.8 Å²	144.8	84%	0.84	78%	0.782	S	S	*	*			trans	158.3	133.2	143.4	29.8	0	0	0	0	107.8
431	V	28.5	Very low	27.2	Very low	122 Å²	122	149.4 Å²	149.4	74%	0.739	80%	0.8	S	S	*	*			cis	-152.7	135.9	35.6	170.8	0	0	0	0	109.1	Y433	V431-Y433 HydrophobicContact CG1-CD2 4.42Å
432	N	24	Very low	26.7	Very low	154 Å²	154	147.2 Å²	147.2	82%	0.824	80%	0.801	S	S	*	*			trans	-67	125.8	164.7	-85.5	-25.8	0	0	0	110.9
433	Y	30.2	Very low	26.4	Very low	226 Å²	226	147.4 Å²	147.4	89%	0.886	80%	0.802	S	S	*	*			trans	-138.1	120.4	146.1	-112.3	-85.6	0	0	0	110.8	V431	V431-Y433 HydrophobicContact CG1-CD2 4.42Å
434	I	27.1	Very low	26.3	Very low	152 Å²	152	154.3 Å²	154.3	78%	0.779	82%	0.816	S	S	*	*			trans	-70.9	124.6	176.8	-64.8	162.9	0	0	0	108.5
435	S	30.2	Very low	26.2	Very low	114 Å²	114	155.8 Å²	155.8	80%	0.797	82%	0.819	S	S	*	*			trans	-151.8	124.7	144	56.6	0	0	0	0	110.3	A437	S435-A437 PolarHBondContact O-N 3.44Å
436	K	23.9	Very low	26.2	Very low	207 Å²	207	151.8 Å²	151.8	90%	0.9	81%	0.81	S	S	*	*			trans	-68.1	120	177.5	-68	170	171.9	179.5	0	108.9
437	A	27.5	Very low	26.5	Very low	81 Å²	81	153 Å²	153	67%	0.669	81%	0.814	S	S	*	*			trans	-138	118.9	158.6	0	0	0	0	0	107.3	S435 V439	S435-A437 PolarHBondContact O-N 3.44Å; A437-V439 PolarHBondContact O-N 3.19Å
438	E	23.9	Very low	27	Very low	201 Å²	201	154.4 Å²	154.4	94%	0.939	81%	0.813	S	S	*	*			trans	-58.2	102.8	170.3	-69.7	167	155	0	0	108.2
439	V	27.5	Very low	27.5	Very low	129 Å²	129	152.7 Å²	152.7	78%	0.782	80%	0.804	S	S	*	*			trans	-100.2	115.9	173.7	176.2	0	0	0	0	107.5	A437 E441	A437-V439 PolarHBondContact O-N 3.19Å; V439-E441 PolarHBondContact O-N 3.13Å
440	N	24.8	Very low	28.9	Very low	142 Å²	142	144.5 Å²	144.5	76%	0.759	77%	0.772	S	S	*	*			trans	-45.7	115.9	177.7	-76.7	-35.2	0	0	0	112.7	S442	N440-S442 PolarHBondContact O-N 3.41Å
441	E	24.9	Very low	31.4	Very low	204 Å²	204	139.6 Å²	139.6	95%	0.953	74%	0.743	S	S	*	*	S	Bend	trans	-72.3	65.3	177.3	-157.4	169.6	-147.6	0	0	110.7	V439	V439-E441 PolarHBondContact O-N 3.13Å
442	S	24.9	Very low	34.1	Very low	100 Å²	100	135.2 Å²	135.2	70%	0.699	72%	0.715	S	S	*	*			trans	-150.6	17.3	179	61.8	0	0	0	0	117.5	N440	N440-S442 PolarHBondContact O-N 3.41Å
443	L	27.5	Very low	37.3	Very low	155 Å²	155	128.2 Å²	128.2	81%	0.812	68%	0.678	S	S	*	*	S	Bend	trans	-127.9	9.9	178.4	-89.6	164.8	0	0	0	116.5
444	Y	26.6	Very low	40	Very low	231 Å²	231	118.1 Å²	118.1	91%	0.906	64%	0.639	S	S	*	*			trans	-129.4	83.4	167.9	-74	-85.1	0	0	0	108.9
445	Q	25.1	Very low	43	Very low	178 Å²	178	116.1 Å²	116.1	83%	0.832	63%	0.625	S	S	*	*			trans	-62.9	132.3	155.4	-87.8	-176.7	-19.5	0	0	107.1	V447	Q445-V447 PolarHBondContact O-N 3.47Å
446	P	25.3	Very low	45.9	Very low	114 Å²	114	111 Å²	111	74%	0.74	59%	0.588	S	S	*	*			trans	-62.1	115.4	173.5	26.8	-29	0	0	0	106.3	D448	P446-D448 VanDerWaalsContact C-N 3.34Å; P446-D448 PolarHBondContact O-N 2.71Å
447	V	32	Very low	49.1	Very low	123 Å²	123	101.5 Å²	101.5	75%	0.745	55%	0.547	S	S	*	.			trans	-63.6	101.7	174.9	177	0	0	0	0	105.9	Q445 S449	Q445-V447 PolarHBondContact O-N 3.47Å; V447-S449 PolarHBondContact O-N 3.48Å
448	D	35.3	Very low	52.1	Low	152 Å²	152	98 Å²	98	81%	0.813	52%	0.517	S	S	*	.			trans	-45.6	114.2	160.1	-81.6	-32.7	0	0	0	106	P446 S450	P446-D448 VanDerWaalsContact C-N 3.34Å; P446-D448 PolarHBondContact O-N 2.71Å; D448-S450 VanDerWaalsContact C-N 3.31Å; D448-S450 PolarHBondContact O-N 2.96Å
449	S	39	Very low	55.1	Low	86 Å²	86	89 Å²	89	60%	0.601	48%	0.478	S	S	*	.			trans	-54.3	96.3	-171.3	47.8	0	0	0	0	109.4	V447 S451	V447-S449 PolarHBondContact O-N 3.48Å; S449-S451 PolarHBondContact O-N 3.19Å
450	S	54.9	Low	58.1	Low	27 Å²	27	82.9 Å²	82.9	19%	0.189	44%	0.441	C	S	.	.			trans	-53	129.5	170.1	54.3	0	0	0	0	106.4	Q414 D448 L452 E454	Q414-S450 PolarHBondContact NE2-O 3.48Å; Q414-S450 VanDerWaalsContact NE2-O 3.15Å; D448-S450 VanDerWaalsContact C-N 3.31Å; D448-S450 PolarHBondContact O-N 2.96Å; S450-L452 PolarHBondContact O-N 3.1Å; S450-E454 WeakPolarHBondContact CB-OE2 3.19Å
451	S	77.4	Confident	61.3	Low	33 Å²	33	76.2 Å²	76.2	23%	0.231	41%	0.406	C	S	.	.			trans	-46.3	145.4	178.5	55.6	0	0	0	0	109.8	S449 V453 E454 F455	S449-S451 PolarHBondContact O-N 3.19Å; S451-V453 CarbonylContact O-C 3.59Å; S451-V453 PolarHBondContact O-N 2.72Å; S451-E454 WeakPolarHBondContact O-CA 3.49Å; S451-E454 WeakPolarHBondContact O-CB 3.3Å; S451-E454 PolarHBondContact O-N 2.81Å; S451-F455 PolarHBondContact O-N 3.39Å; S451-F455 VanDerWaalsContact O-N 3.17Å
452	L	85.3	Confident	64.2	Low	30 Å²	30	69.7 Å²	69.7	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-48.8	-32.9	-177	-173.7	69.2	0	0	0	113	V382 L413 Q414 S450 F455 F456	V382-L452 HydrophobicContact CG1-CD2 4.29Å; L413-L452 HydrophobicContact CB-CD2 3.84Å; L413-L452 HydrophobicContact CD1-CD2 3.56Å; L413-L452 HydrophobicContact CG-CD2 4.2Å; Q414-L452 HydrophobicContact CG-CB 4.49Å; S450-L452 PolarHBondContact O-N 3.1Å; L452-F455 HydrophobicContact CD1-CD1 4.49Å; L452-F455 WeakPolarHBondContact O-CB 3.33Å; L452-F455 PolarHBondContact O-N 2.88Å; L452-F456 HydrophobicContact CD1-CE1 4.5Å; L452-F456 HydrophobicContact CD1-CE2 4.11Å; L452-F456 HydrophobicContact CD1-CZ 3.93Å; L452-F456 HydrophobicContact CD2-CE2 3.81Å; L452-F456 HydrophobicContact CD2-CZ 4.12Å; L452-F456 HydrophobicContact CG-CD2 4.19Å; L452-F456 HydrophobicContact CG-CE2 3.53Å; L452-F456 HydrophobicContact CG-CZ 3.87Å; L452-F456 VanDerWaalsContact O-CD2 3.3Å; L452-F456 WeakPolarHBondContact O-CD2 3.39Å; L452-F456 PolarHBondContact O-N 3.42Å; L452-F456 VanDerWaalsContact O-N 3.08Å
453	V	89.3	Confident	67.1	Low	7 Å²	7	66 Å²	66	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-58.4	-48.8	172.4	-178.9	0	0	0	0	112.7	N400 N403 L410 S451 F455 F456 L457	N400-V453 HydrophobicContact CB-CG1 3.95Å; N403-V453 HydrophobicContact CB-CG2 3.59Å; L410-V453 HydrophobicContact CD1-CG2 3.72Å; S451-V453 CarbonylContact O-C 3.59Å; S451-V453 PolarHBondContact O-N 2.72Å; V453-F455 VanDerWaalsContact C-N 3.28Å; V453-F455 PolarHBondContact O-N 2.94Å; V453-F456 PolarHBondContact O-N 2.99Å; V453-L457 WeakPolarHBondContact O-CB 3.21Å; V453-L457 PolarHBondContact O-N 2.91Å
454	E	88.7	Confident	70	Confident	14 Å²	14	58.6 Å²	58.6	7%	0.065	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-35.5	177.9	-175.1	173.7	-170	0	0	110.1	S450 S451 L457 L458 C481 K482 S483	S450-E454 WeakPolarHBondContact CB-OE2 3.19Å; S451-E454 WeakPolarHBondContact O-CA 3.49Å; S451-E454 WeakPolarHBondContact O-CB 3.3Å; S451-E454 PolarHBondContact O-N 2.81Å; E454-L457 PolarHBondContact O-N 3.47Å; E454-L458 HydrophobicContact CG-CD1 3.93Å; E454-L458 HydrophobicContact CG-CG 4.19Å; E454-L458 VanDerWaalsContact O-CB 3.28Å; E454-L458 WeakPolarHBondContact O-CB 3.3Å; E454-L458 WeakPolarHBondContact O-CD1 3.37Å; E454-L458 WeakPolarHBondContact O-CG 3.31Å; E454-L458 PolarHBondContact O-N 3.35Å; E454-C481 HydrophobicContact CG-CB 4.41Å; E454-K482 PolarHBondContact OE1-N 3.26Å; E454-K482 VanDerWaalsContact OE1-N 3.1Å; E454-S483 PolarHBondContact OE1-N 2.91Å; E454-S483 PolarHBondContact OE1-OG 2.84Å
455	F	88.7	Confident	72.8	Confident	110 Å²	110	47.6 Å²	47.6	48%	0.482	27%	0.268	S	S	.	.	H	α-helix	trans	-58.3	-50.4	172.2	170.6	-96	0	0	0	112.3	W392 S451 L452 V453 L457 L458 G459	W392-F455 HydrophobicContact CH2-CE1 4.13Å; W392-F455 HydrophobicContact CH2-CZ 4.44Å; W392-F455 HydrophobicContact CZ3-CE1 4.24Å; S451-F455 PolarHBondContact O-N 3.39Å; S451-F455 VanDerWaalsContact O-N 3.17Å; L452-F455 HydrophobicContact CD1-CD1 4.49Å; L452-F455 WeakPolarHBondContact O-CB 3.33Å; L452-F455 PolarHBondContact O-N 2.88Å; V453-F455 VanDerWaalsContact C-N 3.28Å; V453-F455 PolarHBondContact O-N 2.94Å; F455-L457 VanDerWaalsContact C-N 3.35Å; F455-L457 PolarHBondContact O-N 3.33Å; F455-L458 PolarHBondContact O-N 3.29Å; F455-G459 PolarHBondContact O-N 2.88Å
456	F	91	Very high	75.5	Confident	7 Å²	7	40.5 Å²	40.5	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-40.3	177.9	-64.4	-40.7	0	0	0	112.8	V382 W392 I395 A396 T399 L452 V453 L458 G459 Y460	V382-F456 HydrophobicContact CG1-CE2 3.77Å; V382-F456 HydrophobicContact CG1-CZ 3.91Å; W392-F456 HydrophobicContact CE3-CD1 4.04Å; W392-F456 AromaticContact CZ3-CD1 3.56Å; W392-F456 HydrophobicContact CZ3-CD1 3.56Å; W392-F456 HydrophobicContact CZ3-CE1 4.01Å; I395-F456 HydrophobicContact CG1-CD1 4.31Å; I395-F456 HydrophobicContact CG1-CD2 3.88Å; I395-F456 HydrophobicContact CG1-CE1 4.33Å; I395-F456 HydrophobicContact CG1-CE2 3.89Å; I395-F456 HydrophobicContact CG1-CG 4.08Å; I395-F456 HydrophobicContact CG1-CZ 4.11Å; I395-F456 HydrophobicContact CG2-CB 4.31Å; I395-F456 HydrophobicContact CG2-CD1 4.19Å; I395-F456 HydrophobicContact CG2-CG 4.21Å; A396-F456 HydrophobicContact CB-CB 4.44Å; T399-F456 HydrophobicContact CG2-CD2 3.77Å; T399-F456 HydrophobicContact CG2-CE2 3.86Å; T399-F456 WeakPolarHBondContact OG1-CD2 3.49Å; L452-F456 HydrophobicContact CD1-CE1 4.5Å; L452-F456 HydrophobicContact CD1-CE2 4.11Å; L452-F456 HydrophobicContact CD1-CZ 3.93Å; L452-F456 HydrophobicContact CD2-CE2 3.81Å; L452-F456 HydrophobicContact CD2-CZ 4.12Å; L452-F456 HydrophobicContact CG-CD2 4.19Å; L452-F456 HydrophobicContact CG-CE2 3.53Å; L452-F456 HydrophobicContact CG-CZ 3.87Å; L452-F456 VanDerWaalsContact O-CD2 3.3Å; L452-F456 WeakPolarHBondContact O-CD2 3.39Å; L452-F456 PolarHBondContact O-N 3.42Å; L452-F456 VanDerWaalsContact O-N 3.08Å; V453-F456 PolarHBondContact O-N 2.99Å; F456-L458 VanDerWaalsContact C-N 3.32Å; F456-L458 PolarHBondContact O-N 3.4Å; F456-G459 PolarHBondContact O-N 3.3Å; F456-Y460 PolarHBondContact O-N 3.5Å
457	L	92.3	Very high	78.1	Confident	7 Å²	7	35.8 Å²	35.8	4%	0.037	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-41.1	177.4	-167.9	62.3	0	0	0	111.1	F68 A396 V453 E454 F455 Y460 I461 Y477	F68-L457 HydrophobicContact CE2-CD1 4Å; F68-L457 HydrophobicContact CE2-CD2 4.05Å; F68-L457 HydrophobicContact CZ-CD1 4.3Å; F68-L457 HydrophobicContact CZ-CD2 3.76Å; A396-L457 HydrophobicContact CB-CD1 4.33Å; V453-L457 WeakPolarHBondContact O-CB 3.21Å; V453-L457 PolarHBondContact O-N 2.91Å; E454-L457 PolarHBondContact O-N 3.47Å; F455-L457 VanDerWaalsContact C-N 3.35Å; F455-L457 PolarHBondContact O-N 3.33Å; L457-Y460 PolarHBondContact O-N 3.16Å; L457-I461 HydrophobicContact CG-CD1 3.89Å; L457-I461 WeakPolarHBondContact O-CB 3.35Å; L457-I461 VanDerWaalsContact O-CD1 3.3Å; L457-I461 WeakPolarHBondContact O-CD1 3.22Å; L457-I461 WeakPolarHBondContact O-CG1 3.45Å; L457-I461 PolarHBondContact O-N 3.46Å; L457-Y477 HydrophobicContact CD1-CD1 3.74Å; L457-Y477 HydrophobicContact CD1-CE1 4.23Å; L457-Y477 HydrophobicContact CD1-CG 4.43Å
458	L	90.1	Very high	80.4	Confident	7 Å²	7	34 Å²	34	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-64.5	-43.2	176.8	-71.7	172.4	0	0	0	112.1	E454 F455 F456 Y460 I461 E462 L478	E454-L458 HydrophobicContact CG-CD1 3.93Å; E454-L458 HydrophobicContact CG-CG 4.19Å; E454-L458 VanDerWaalsContact O-CB 3.28Å; E454-L458 WeakPolarHBondContact O-CB 3.3Å; E454-L458 WeakPolarHBondContact O-CD1 3.37Å; E454-L458 WeakPolarHBondContact O-CG 3.31Å; E454-L458 PolarHBondContact O-N 3.35Å; F455-L458 PolarHBondContact O-N 3.29Å; F456-L458 VanDerWaalsContact C-N 3.32Å; F456-L458 PolarHBondContact O-N 3.4Å; L458-Y460 VanDerWaalsContact C-N 3.29Å; L458-Y460 PolarHBondContact O-N 3.37Å; L458-I461 HydrophobicContact CD2-CD1 4.19Å; L458-I461 PolarHBondContact O-N 3.47Å; L458-E462 WeakPolarHBondContact O-CG 3.15Å; L458-E462 PolarHBondContact O-N 3.35Å; L458-L478 HydrophobicContact CD2-CD2 3.7Å
459	G	86.8	Confident	82.8	Confident	13 Å²	13	29.9 Å²	29.9	13%	0.134	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-38.7	173.4	0	0	0	0	0	112.6	F455 F456 S463	F455-G459 PolarHBondContact O-N 2.88Å; F456-G459 PolarHBondContact O-N 3.3Å; G459-S463 PolarHBondContact O-N 3.24Å; G459-S463 VanDerWaalsContact O-N 3.15Å
460	Y	91.3	Very high	85.1	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.4	-44.8	173.4	178.9	-121.8	0	0	0	112.7	Y52 W392 W393 A396 H397 F456 L457 L458 E462 S463 L464 Y477	Y52-Y460 WeakPolarHBondContact OH-CE2 3.21Å; W392-Y460 HydrophobicContact CB-CD2 4.25Å; W392-Y460 HydrophobicContact CB-CG 4.45Å; W393-Y460 HydrophobicContact CB-CD2 4.21Å; W393-Y460 HydrophobicContact CB-CE2 3.8Å; W393-Y460 AromaticContact CD1-CE2 3.88Å; W393-Y460 AromaticContact CD1-CZ 3.71Å; W393-Y460 HydrophobicContact CG-CE2 4.26Å; A396-Y460 HydrophobicContact CB-CD1 4.33Å; A396-Y460 HydrophobicContact CB-CG 4.15Å; H397-Y460 AromaticContact CE1-CE1 3.45Å; H397-Y460 VanDerWaalsContact CE1-CE1 3.45Å; H397-Y460 WeakPolarHBondContact CE1-CE1 3.3Å; H397-Y460 AromaticContact CE1-CZ 3.77Å; F456-Y460 PolarHBondContact O-N 3.5Å; L457-Y460 PolarHBondContact O-N 3.16Å; L458-Y460 VanDerWaalsContact C-N 3.29Å; L458-Y460 PolarHBondContact O-N 3.37Å; Y460-E462 PolarHBondContact O-N 3.15Å; Y460-S463 WeakPolarHBondContact O-CB 3.37Å; Y460-S463 PolarHBondContact O-N 3.43Å; Y460-S463 VanDerWaalsContact O-N 3.16Å; Y460-S463 PolarHBondContact O-OG 3.47Å; Y460-L464 HydrophobicContact CD1-CD1 4.15Å; Y460-L464 HydrophobicContact CD2-CG 4.39Å; Y460-L464 HydrophobicContact CE1-CD1 3.52Å; Y460-L464 HydrophobicContact CE1-CG 4.16Å; Y460-L464 HydrophobicContact CE2-CD1 4.17Å; Y460-L464 HydrophobicContact CE2-CD2 3.99Å; Y460-L464 HydrophobicContact CE2-CG 3.91Å; Y460-L464 PolarHBondContact O-N 2.85Å; Y460-Y477 HydrophobicContact CD1-CE2 4.45Å; Y460-Y477 HydrophobicContact CE1-CD2 4.34Å; Y460-Y477 HydrophobicContact CE1-CE1 4.3Å; Y460-Y477 AromaticContact CE1-CE2 3.7Å; Y460-Y477 HydrophobicContact CE1-CE2 3.7Å; Y460-Y477 AromaticContact CE1-CZ 3.68Å
461	I	91.1	Very high	86.8	Confident	3 Å²	3	24.8 Å²	24.8	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-45.5	177.5	-72.4	157.9	0	0	0	111.1	L457 L458 S463 L464 A465 A474 Y477 L478 L491	L457-I461 HydrophobicContact CG-CD1 3.89Å; L457-I461 WeakPolarHBondContact O-CB 3.35Å; L457-I461 VanDerWaalsContact O-CD1 3.3Å; L457-I461 WeakPolarHBondContact O-CD1 3.22Å; L457-I461 WeakPolarHBondContact O-CG1 3.45Å; L457-I461 PolarHBondContact O-N 3.46Å; L458-I461 HydrophobicContact CD2-CD1 4.19Å; L458-I461 PolarHBondContact O-N 3.47Å; I461-S463 VanDerWaalsContact C-N 3.29Å; I461-S463 PolarHBondContact O-N 3.21Å; I461-L464 PolarHBondContact O-N 3.3Å; I461-A465 VanDerWaalsContact O-CB 3.3Å; I461-A465 WeakPolarHBondContact O-CB 3.41Å; I461-A465 PolarHBondContact O-N 3.47Å; I461-A474 HydrophobicContact CG2-CB 4.19Å; I461-Y477 HydrophobicContact CG1-CG 4.38Å; I461-L478 HydrophobicContact CD1-CD2 3.72Å; I461-L478 HydrophobicContact CD1-CG 3.86Å; I461-L478 HydrophobicContact CG2-CD1 3.83Å; I461-L478 HydrophobicContact CG2-CD2 4.11Å; I461-L478 HydrophobicContact CG2-CG 3.77Å; I461-L491 HydrophobicContact CG2-CD1 4.2Å
462	E	85.8	Confident	87.5	Confident	66 Å²	66	25.7 Å²	25.7	31%	0.308	15%	0.149	S	C	.	.	H	α-helix	trans	-60.5	-41.6	176.9	-73.6	171.5	-176.9	0	0	110.9	L458 Y460 L464 A465 S466 R487	L458-E462 WeakPolarHBondContact O-CG 3.15Å; L458-E462 PolarHBondContact O-N 3.35Å; Y460-E462 PolarHBondContact O-N 3.15Å; E462-L464 VanDerWaalsContact C-N 3.33Å; E462-L464 PolarHBondContact O-N 3.37Å; E462-A465 PolarHBondContact O-N 3.37Å; E462-S466 PolarHBondContact O-N 3.01Å; E462-R487 IonicContact OE1-CZ 3.93Å; E462-R487 IonicContact OE1-NH1 2.6Å; E462-R487 PolarHBondContact OE1-NH1 3.42Å; E462-R487 IonicContact OE1-NH2 3.69Å
463	S	85.2	Confident	87.9	Confident	22 Å²	22	25.3 Å²	25.3	15%	0.154	15%	0.146	C	C	.	.	H	α-helix	trans	-60.6	-40.9	174.9	85.2	0	0	0	0	112.5	Y52 G459 Y460 I461 S466	Y52-S463 PolarHBondContact OH-OG 3.15Å; G459-S463 PolarHBondContact O-N 3.24Å; G459-S463 VanDerWaalsContact O-N 3.15Å; Y460-S463 WeakPolarHBondContact O-CB 3.37Å; Y460-S463 PolarHBondContact O-N 3.43Å; Y460-S463 VanDerWaalsContact O-N 3.16Å; Y460-S463 PolarHBondContact O-OG 3.47Å; I461-S463 VanDerWaalsContact C-N 3.29Å; I461-S463 PolarHBondContact O-N 3.21Å; S463-S466 PolarHBondContact O-OG 2.9Å
464	L	88.5	Confident	88.1	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-71.8	-42.7	177.5	-70.3	-178.1	0	0	0	112.6	Y52 V61 Y460 I461 E462 S466 E467 L470 I473 A474 Y477	Y52-L464 HydrophobicContact CD1-CD2 4.33Å; Y52-L464 HydrophobicContact CE1-CD2 3.87Å; Y52-L464 HydrophobicContact CE2-CD2 4.19Å; V61-L464 HydrophobicContact CG1-CD1 4.17Å; V61-L464 HydrophobicContact CG1-CD2 3.79Å; V61-L464 HydrophobicContact CG2-CD2 3.94Å; Y460-L464 HydrophobicContact CD1-CD1 4.15Å; Y460-L464 HydrophobicContact CD2-CG 4.39Å; Y460-L464 HydrophobicContact CE1-CD1 3.52Å; Y460-L464 HydrophobicContact CE1-CG 4.16Å; Y460-L464 HydrophobicContact CE2-CD1 4.17Å; Y460-L464 HydrophobicContact CE2-CD2 3.99Å; Y460-L464 HydrophobicContact CE2-CG 3.91Å; Y460-L464 PolarHBondContact O-N 2.85Å; I461-L464 PolarHBondContact O-N 3.3Å; E462-L464 VanDerWaalsContact C-N 3.33Å; E462-L464 PolarHBondContact O-N 3.37Å; L464-S466 PolarHBondContact O-N 2.91Å; L464-E467 PolarHBondContact O-N 3.46Å; L464-L470 HydrophobicContact CB-CB 4.5Å; L464-L470 HydrophobicContact CD2-CD1 3.92Å; L464-I473 HydrophobicContact CD1-CG2 4.34Å; L464-A474 HydrophobicContact CB-CB 3.9Å; L464-Y477 HydrophobicContact CD1-CD2 4.07Å; L464-Y477 HydrophobicContact CD1-CE2 3.91Å
465	A	86.8	Confident	88.3	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-27.1	-176.9	0	0	0	0	0	111.5	I461 E462 E467 L471 A474 L491 H495	I461-A465 VanDerWaalsContact O-CB 3.3Å; I461-A465 WeakPolarHBondContact O-CB 3.41Å; I461-A465 PolarHBondContact O-N 3.47Å; E462-A465 PolarHBondContact O-N 3.37Å; A465-E467 PolarHBondContact O-N 2.77Å; A465-L471 HydrophobicContact CB-CD1 4.06Å; A465-A474 HydrophobicContact CB-CB 4.15Å; A465-L491 HydrophobicContact CB-CD1 3.88Å; A465-L491 HydrophobicContact CB-CD2 3.76Å; A465-L491 HydrophobicContact CB-CG 4.43Å; A465-H495 PolarHBondContact O-CE1 3.48Å; A465-H495 PolarHBondContact O-NE2 2.98Å
466	S	80	Confident	88.6	Confident	29 Å²	29	19.2 Å²	19.2	20%	0.203	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.7	173.2	77.6	0	0	0	0	113.7	N21 E462 S463 L464	N21-S466 WeakPolarHBondContact ND2-CB 3.35Å; N21-S466 PolarHBondContact ND2-OG 3.3Å; N21-S466 VanDerWaalsContact ND2-OG 3.16Å; E462-S466 PolarHBondContact O-N 3.01Å; S463-S466 PolarHBondContact O-OG 2.9Å; L464-S466 PolarHBondContact O-N 2.91Å
467	E	79.8	Confident	88.8	Confident	14 Å²	14	18.9 Å²	18.9	7%	0.065	12%	0.119	C	C	.	.	S	Bend	trans	-99.3	120.3	169.6	-70.5	-159.1	-177.7	0	0	112.5	Y52 N53 K58 L464 A465 S469 L470 L471	Y52-E467 WeakPolarHBondContact CB-OE1 3.45Å; N53-E467 PolarHBondContact N-OE1 3.17Å; N53-E467 VanDerWaalsContact N-OE1 3.1Å; N53-E467 PolarHBondContact OD1-OE1 2.79Å; K58-E467 IonicContact NZ-OE2 3.33Å; L464-E467 PolarHBondContact O-N 3.46Å; A465-E467 PolarHBondContact O-N 2.77Å; E467-S469 PolarHBondContact O-N 2.94Å; E467-S469 VanDerWaalsContact O-N 3.07Å; E467-S469 PolarHBondContact OE2-OG 3.13Å; E467-L470 HydrophobicContact CB-CB 4.4Å; E467-L470 HydrophobicContact CB-CD1 4.43Å; E467-L470 HydrophobicContact CB-CG 4.42Å; E467-L470 PolarHBondContact O-N 3.03Å; E467-L471 PolarHBondContact O-N 3.02Å
468	T	81.9	Confident	88.8	Confident	85 Å²	85	18.7 Å²	18.7	52%	0.521	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.9	178.1	-43.9	0	0	0	0	112.9	L470 L471	T468-L470 VanDerWaalsContact C-N 3.29Å; T468-L470 PolarHBondContact O-N 3.42Å; T468-L471 PolarHBondContact O-N 3.05Å
469	S	84.1	Confident	88.9	Confident	67 Å²	67	22 Å²	22	47%	0.469	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-25.2	178	74.7	0	0	0	0	113.8	K58 E467	K58-S469 PolarHBondContact NZ-OG 2.87Å; E467-S469 PolarHBondContact O-N 2.94Å; E467-S469 VanDerWaalsContact O-N 3.07Å; E467-S469 PolarHBondContact OE2-OG 3.13Å
470	L	88.9	Confident	89	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.026	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-3.5	-179.1	-62.4	177.9	0	0	0	112.8	Y52 K58 V61 L464 E467 T468 S472 I473 A474	Y52-L470 HydrophobicContact CD1-CD1 3.94Å; Y52-L470 HydrophobicContact CG-CD1 3.81Å; K58-L470 HydrophobicContact CB-CD2 4.39Å; K58-L470 HydrophobicContact CG-CD2 4.2Å; V61-L470 HydrophobicContact CG1-CD2 4.31Å; L464-L470 HydrophobicContact CB-CB 4.5Å; L464-L470 HydrophobicContact CD2-CD1 3.92Å; E467-L470 HydrophobicContact CB-CB 4.4Å; E467-L470 HydrophobicContact CB-CD1 4.43Å; E467-L470 HydrophobicContact CB-CG 4.42Å; E467-L470 PolarHBondContact O-N 3.03Å; T468-L470 VanDerWaalsContact C-N 3.29Å; T468-L470 PolarHBondContact O-N 3.42Å; L470-S472 PolarHBondContact O-N 3.35Å; L470-I473 HydrophobicContact CD2-CD1 4.13Å; L470-I473 WeakPolarHBondContact O-CB 3.45Å; L470-I473 PolarHBondContact O-N 3.04Å; L470-A474 PolarHBondContact O-N 3.04Å
471	L	89.9	Confident	88.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.2	-36.6	-179.2	-177.3	63.6	0	0	0	113.1	A465 E467 T468 I473 A474 L475 L491 H495 W506 F507	A465-L471 HydrophobicContact CB-CD1 4.06Å; E467-L471 PolarHBondContact O-N 3.02Å; T468-L471 PolarHBondContact O-N 3.05Å; L471-I473 VanDerWaalsContact C-N 3.29Å; L471-I473 PolarHBondContact O-N 3.48Å; L471-A474 PolarHBondContact O-N 3.39Å; L471-L475 HydrophobicContact CD1-CG 4.28Å; L471-L475 HydrophobicContact CG-CD1 4.17Å; L471-L475 HydrophobicContact CG-CG 4.35Å; L471-L475 WeakPolarHBondContact O-CB 3.26Å; L471-L475 VanDerWaalsContact O-CG 3.24Å; L471-L475 WeakPolarHBondContact O-CG 3.33Å; L471-L475 PolarHBondContact O-N 2.92Å; L471-L491 HydrophobicContact CD1-CB 4.39Å; L471-H495 HydrophobicContact CD2-CB 3.86Å; L471-W506 HydrophobicContact CD2-CH2 4.31Å; L471-W506 HydrophobicContact CD2-CZ3 4.08Å; L471-W506 HydrophobicContact CG-CH2 4.49Å; L471-F507 HydrophobicContact CD2-CD1 4.34Å; L471-F507 HydrophobicContact CD2-CE1 3.61Å
472	S	91.5	Very high	88.4	Confident	52 Å²	52	35.5 Å²	35.5	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-59.6	-40.3	176.3	61.7	0	0	0	0	112.7	L470 G476	L470-S472 PolarHBondContact O-N 3.35Å; S472-G476 PolarHBondContact O-N 3.2Å; S472-G476 VanDerWaalsContact O-N 3.09Å
473	I	93.6	Very high	88.1	Confident	22 Å²	22	34.3 Å²	34.3	11%	0.113	19%	0.193	C	C	.	.	H	α-helix	trans	-72.5	-43.9	177.7	-62.3	174.7	0	0	0	109.6	V61 K62 F65 L464 L470 L471 L475 G476 Y477	V61-I473 HydrophobicContact CG1-CD1 4.02Å; V61-I473 HydrophobicContact CG1-CG2 3.95Å; K62-I473 HydrophobicContact CB-CD1 4.34Å; F65-I473 HydrophobicContact CB-CG2 3.74Å; F65-I473 HydrophobicContact CD1-CG2 4.26Å; F65-I473 HydrophobicContact CD2-CG2 4Å; F65-I473 HydrophobicContact CG-CG2 3.72Å; L464-I473 HydrophobicContact CD1-CG2 4.34Å; L470-I473 HydrophobicContact CD2-CD1 4.13Å; L470-I473 WeakPolarHBondContact O-CB 3.45Å; L470-I473 PolarHBondContact O-N 3.04Å; L471-I473 VanDerWaalsContact C-N 3.29Å; L471-I473 PolarHBondContact O-N 3.48Å; I473-L475 VanDerWaalsContact C-N 3.3Å; I473-L475 PolarHBondContact O-N 3.46Å; I473-G476 CarbonylContact O-C 3.57Å; I473-G476 WeakPolarHBondContact O-CA 3.48Å; I473-G476 PolarHBondContact O-N 3.44Å; I473-Y477 HydrophobicContact CG2-CD2 3.93Å; I473-Y477 HydrophobicContact CG2-CE2 3.56Å; I473-Y477 VanDerWaalsContact O-CD2 3.28Å; I473-Y477 WeakPolarHBondContact O-CD2 3.29Å; I473-Y477 PolarHBondContact O-N 3.18Å
474	A	93.3	Very high	88	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-56.5	-44	175.8	0	0	0	0	0	112	I461 L464 A465 L470 L471 G476 Y477 L478	I461-A474 HydrophobicContact CG2-CB 4.19Å; L464-A474 HydrophobicContact CB-CB 3.9Å; A465-A474 HydrophobicContact CB-CB 4.15Å; L470-A474 PolarHBondContact O-N 3.04Å; L471-A474 PolarHBondContact O-N 3.39Å; A474-G476 VanDerWaalsContact C-N 3.31Å; A474-G476 PolarHBondContact O-N 3.37Å; A474-Y477 PolarHBondContact O-N 2.99Å; A474-L478 PolarHBondContact O-N 3.24Å
475	L	94	Very high	87.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-35.2	173.9	-67.4	170.7	0	0	0	112.2	L471 I473 L478 D479 Q488 L492 Q510	L471-L475 HydrophobicContact CD1-CG 4.28Å; L471-L475 HydrophobicContact CG-CD1 4.17Å; L471-L475 HydrophobicContact CG-CG 4.35Å; L471-L475 WeakPolarHBondContact O-CB 3.26Å; L471-L475 VanDerWaalsContact O-CG 3.24Å; L471-L475 WeakPolarHBondContact O-CG 3.33Å; L471-L475 PolarHBondContact O-N 2.92Å; I473-L475 VanDerWaalsContact C-N 3.3Å; I473-L475 PolarHBondContact O-N 3.46Å; L475-L478 HydrophobicContact CD2-CD1 4.39Å; L475-L478 WeakPolarHBondContact O-CB 3.36Å; L475-L478 PolarHBondContact O-N 3.47Å; L475-D479 VanDerWaalsContact O-CG 3.3Å; L475-D479 PolarHBondContact O-N 3.33Å; L475-D479 VanDerWaalsContact O-N 3.07Å; L475-Q488 HydrophobicContact CD2-CB 4.03Å; L475-Q488 HydrophobicContact CD2-CG 3.87Å; L475-Q488 PolarHBondContact O-NE2 3.14Å; L475-Q488 VanDerWaalsContact O-NE2 3.16Å; L475-L492 HydrophobicContact CD1-CD2 3.74Å; L475-L492 HydrophobicContact CD1-CG 4.32Å; L475-L492 HydrophobicContact CD2-CG 4.25Å; L475-Q510 HydrophobicContact CD1-CB 4.32Å
476	G	94.2	Very high	87.9	Confident	4 Å²	4	47.4 Å²	47.4	4%	0.041	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-41.5	173.7	0	0	0	0	0	113.2	F65 S472 I473 A474 D479 H480	F65-G476 VanDerWaalsContact CE2-C 3.46Å; S472-G476 PolarHBondContact O-N 3.2Å; S472-G476 VanDerWaalsContact O-N 3.09Å; I473-G476 CarbonylContact O-C 3.57Å; I473-G476 WeakPolarHBondContact O-CA 3.48Å; I473-G476 PolarHBondContact O-N 3.44Å; A474-G476 VanDerWaalsContact C-N 3.31Å; A474-G476 PolarHBondContact O-N 3.37Å; G476-D479 WeakPolarHBondContact CA-OD2 3.47Å; G476-D479 WeakPolarHBondContact O-CB 3.44Å; G476-D479 PolarHBondContact O-N 2.97Å; G476-H480 PolarHBondContact O-CD2 2.57Å
477	Y	95	Very high	88.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-40.9	172.4	-76.8	-79.4	0	0	0	111.6	F65 F68 H397 L457 Y460 I461 L464 I473 A474 D479 H480	F65-Y477 WeakPolarHBondContact CA-OH 3.27Å; F65-Y477 HydrophobicContact CB-CE2 4.01Å; F65-Y477 HydrophobicContact CD2-CD1 4.17Å; F65-Y477 AromaticContact CD2-CD2 3.73Å; F65-Y477 HydrophobicContact CD2-CD2 3.73Å; F65-Y477 HydrophobicContact CD2-CE1 4.01Å; F65-Y477 AromaticContact CD2-CE2 3.5Å; F65-Y477 HydrophobicContact CD2-CE2 3.5Å; F65-Y477 VanDerWaalsContact CD2-CE2 3.5Å; F65-Y477 HydrophobicContact CD2-CG 4.05Å; F65-Y477 AromaticContact CD2-CZ 3.64Å; F65-Y477 HydrophobicContact CE2-CD2 4.22Å; F65-Y477 HydrophobicContact CE2-CE2 4.41Å; F65-Y477 HydrophobicContact CE2-CG 4.26Å; F65-Y477 HydrophobicContact CG-CE2 4.14Å; F65-Y477 PolarHBondContact N-OH 3.22Å; F68-Y477 HydrophobicContact CB-CE1 3.78Å; F68-Y477 AromaticContact CD1-CD1 3.51Å; F68-Y477 HydrophobicContact CD1-CD1 3.51Å; F68-Y477 AromaticContact CD1-CE1 3.57Å; F68-Y477 HydrophobicContact CD1-CE1 3.57Å; F68-Y477 AromaticContact CD2-CD1 3.98Å; F68-Y477 HydrophobicContact CD2-CD1 3.98Å; F68-Y477 AromaticContact CD2-CE1 3.64Å; F68-Y477 HydrophobicContact CD2-CE1 3.64Å; F68-Y477 AromaticContact CE1-CD1 3.48Å; F68-Y477 HydrophobicContact CE1-CD1 3.48Å; F68-Y477 VanDerWaalsContact CE1-CD1 3.48Å; F68-Y477 HydrophobicContact CE1-CE1 4.01Å; F68-Y477 HydrophobicContact CE1-CG 4.43Å; F68-Y477 AromaticContact CE2-CD1 3.92Å; F68-Y477 HydrophobicContact CE2-CD1 3.92Å; F68-Y477 HydrophobicContact CE2-CE1 4.05Å; F68-Y477 AromaticContact CG-CD1 3.77Å; F68-Y477 HydrophobicContact CG-CD1 3.77Å; F68-Y477 AromaticContact CG-CE1 3.38Å; F68-Y477 HydrophobicContact CG-CE1 3.38Å; F68-Y477 AromaticContact CZ-CD1 3.68Å; F68-Y477 HydrophobicContact CZ-CD1 3.68Å; F68-Y477 HydrophobicContact CZ-CE1 4.23Å; H397-Y477 PolarHBondContact CE1-OH 2.99Å; H397-Y477 AromaticContact NE2-CE1 3.64Å; H397-Y477 AromaticContact NE2-CZ 3.5Å; H397-Y477 PolarHBondContact NE2-OH 3.46Å; L457-Y477 HydrophobicContact CD1-CD1 3.74Å; L457-Y477 HydrophobicContact CD1-CE1 4.23Å; L457-Y477 HydrophobicContact CD1-CG 4.43Å; Y460-Y477 HydrophobicContact CD1-CE2 4.45Å; Y460-Y477 HydrophobicContact CE1-CD2 4.34Å; Y460-Y477 HydrophobicContact CE1-CE1 4.3Å; Y460-Y477 AromaticContact CE1-CE2 3.7Å; Y460-Y477 HydrophobicContact CE1-CE2 3.7Å; Y460-Y477 AromaticContact CE1-CZ 3.68Å; I461-Y477 HydrophobicContact CG1-CG 4.38Å; L464-Y477 HydrophobicContact CD1-CD2 4.07Å; L464-Y477 HydrophobicContact CD1-CE2 3.91Å; I473-Y477 HydrophobicContact CG2-CD2 3.93Å; I473-Y477 HydrophobicContact CG2-CE2 3.56Å; I473-Y477 VanDerWaalsContact O-CD2 3.28Å; I473-Y477 WeakPolarHBondContact O-CD2 3.29Å; I473-Y477 PolarHBondContact O-N 3.18Å; A474-Y477 PolarHBondContact O-N 2.99Å; Y477-D479 PolarHBondContact O-N 2.63Å; Y477-H480 PolarHBondContact O-N 3.22Å; Y477-H480 VanDerWaalsContact O-N 3.08Å
478	L	93.2	Very high	88.8	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-23.1	177.5	-72.8	169	0	0	0	113.7	L458 I461 A474 L475 H480 C481 G484 R487 Q488 L491	L458-L478 HydrophobicContact CD2-CD2 3.7Å; I461-L478 HydrophobicContact CD1-CD2 3.72Å; I461-L478 HydrophobicContact CD1-CG 3.86Å; I461-L478 HydrophobicContact CG2-CD1 3.83Å; I461-L478 HydrophobicContact CG2-CD2 4.11Å; I461-L478 HydrophobicContact CG2-CG 3.77Å; A474-L478 PolarHBondContact O-N 3.24Å; L475-L478 HydrophobicContact CD2-CD1 4.39Å; L475-L478 WeakPolarHBondContact O-CB 3.36Å; L475-L478 PolarHBondContact O-N 3.47Å; L478-H480 PolarHBondContact O-N 3.16Å; L478-H480 VanDerWaalsContact O-N 3.1Å; L478-C481 HydrophobicContact CD2-CB 4.45Å; L478-C481 PolarHBondContact O-N 2.7Å; L478-C481 VanDerWaalsContact O-N 3.09Å; L478-G484 WeakPolarHBondContact O-CA 3.45Å; L478-R487 HydrophobicContact CD1-CB 4.31Å; L478-R487 HydrophobicContact CD2-CB 4.03Å; L478-Q488 HydrophobicContact CB-CG 3.49Å; L478-Q488 VanDerWaalsContact CB-CG 3.49Å; L478-Q488 HydrophobicContact CD1-CB 4.46Å; L478-Q488 HydrophobicContact CD1-CG 3.61Å; L478-Q488 HydrophobicContact CG-CG 4.16Å; L478-L491 HydrophobicContact CD1-CD1 3.62Å
479	D	91.8	Very high	89.2	Confident	78 Å²	78	47.1 Å²	47.1	42%	0.417	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.7	174.5	-66.5	-38.8	0	0	0	111.6	L475 G476 Y477 Q488 R514	L475-D479 VanDerWaalsContact O-CG 3.3Å; L475-D479 PolarHBondContact O-N 3.33Å; L475-D479 VanDerWaalsContact O-N 3.07Å; G476-D479 WeakPolarHBondContact CA-OD2 3.47Å; G476-D479 WeakPolarHBondContact O-CB 3.44Å; G476-D479 PolarHBondContact O-N 2.97Å; Y477-D479 PolarHBondContact O-N 2.63Å; D479-Q488 PolarHBondContact OD1-NE2 2.75Å; D479-R514 VanDerWaalsContact OD1-CD 3.26Å; D479-R514 WeakPolarHBondContact OD1-CD 3.42Å; D479-R514 IonicContact OD1-CZ 3.43Å; D479-R514 IonicContact OD1-NE 2.69Å; D479-R514 PolarHBondContact OD1-NE 2.76Å; D479-R514 IonicContact OD2-CZ 3.9Å; D479-R514 IonicContact OD2-NE 3.64Å; D479-R514 PolarHBondContact OD2-NE 2.9Å; D479-R514 VanDerWaalsContact OD2-NE 3.11Å; D479-R514 IonicContact OD2-NH2 3.54Å; D479-R514 PolarHBondContact OD2-NH2 2.99Å
480	H	89.4	Confident	89.4	Confident	81 Å²	81	46.7 Å²	46.7	38%	0.375	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-0	178.6	-61.9	-78.2	0	0	0	114.4	F68 Q72 G476 Y477 L478	F68-H480 HydrophobicContact CE1-CB 4.13Å; F68-H480 AromaticContact CE1-CD2 3.71Å; F68-H480 HydrophobicContact CZ-CB 4.29Å; Q72-H480 HydrophobicContact CG-CB 4.24Å; G476-H480 PolarHBondContact O-CD2 2.57Å; Y477-H480 PolarHBondContact O-N 3.22Å; Y477-H480 VanDerWaalsContact O-N 3.08Å; L478-H480 PolarHBondContact O-N 3.16Å; L478-H480 VanDerWaalsContact O-N 3.1Å
481	C	88.1	Confident	89.4	Confident	18 Å²	18	47.1 Å²	47.1	12%	0.122	24%	0.243	C	C	.	.			trans	-93.4	143.4	178.9	-65	0	0	0	0	111.9	E454 L478 S483 G484	E454-C481 HydrophobicContact CG-CB 4.41Å; L478-C481 HydrophobicContact CD2-CB 4.45Å; L478-C481 PolarHBondContact O-N 2.7Å; L478-C481 VanDerWaalsContact O-N 3.09Å; C481-S483 VanDerWaalsContact C-N 3.34Å; C481-S483 PolarHBondContact O-N 3.07Å; C481-G484 PolarHBondContact O-N 3.14Å; C481-G484 VanDerWaalsContact O-N 3.09Å
482	K	81.9	Confident	89.4	Confident	199 Å²	199	47.1 Å²	47.1	87%	0.865	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-41.6	175.5	-68.2	-179.7	-178.8	176.3	0	111.2	E454 G484	E454-K482 PolarHBondContact OE1-N 3.26Å; E454-K482 VanDerWaalsContact OE1-N 3.1Å; K482-G484 PolarHBondContact O-N 3.37Å
483	S	78.9	Confident	89.2	Confident	42 Å²	42	47.3 Å²	47.3	29%	0.294	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	9.9	174.7	63.8	0	0	0	0	113.6	E454 C481 R485	E454-S483 PolarHBondContact OE1-N 2.91Å; E454-S483 PolarHBondContact OE1-OG 2.84Å; C481-S483 VanDerWaalsContact C-N 3.34Å; C481-S483 PolarHBondContact O-N 3.07Å; S483-R485 PolarHBondContact O-N 3.43Å
484	G	83.2	Confident	88.6	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-49.4	-169.2	0	0	0	0	0	114	L478 C481 K482 T486 R487 Q488	L478-G484 WeakPolarHBondContact O-CA 3.45Å; C481-G484 PolarHBondContact O-N 3.14Å; C481-G484 VanDerWaalsContact O-N 3.09Å; K482-G484 PolarHBondContact O-N 3.37Å; G484-T486 PolarHBondContact O-N 3.36Å; G484-R487 PolarHBondContact O-N 3.34Å; G484-Q488 WeakPolarHBondContact O-CB 3.42Å; G484-Q488 VanDerWaalsContact O-CG 3.24Å; G484-Q488 WeakPolarHBondContact O-CG 3.29Å; G484-Q488 PolarHBondContact O-N 2.93Å
485	R	86.5	Confident	88	Confident	184 Å²	184	51.2 Å²	51.2	69%	0.694	25%	0.254	S	S	*	.	H	α-helix	trans	-59.2	-44.7	-172.1	-70.4	-174.2	178.7	-179.3	0.3	113.7	S483 R487 Q488 S489 L516	S483-R485 PolarHBondContact O-N 3.43Å; R485-R487 VanDerWaalsContact C-N 3.34Å; R485-R487 PolarHBondContact O-N 2.87Å; R485-Q488 PolarHBondContact O-N 3.5Å; R485-S489 PolarHBondContact O-N 3.01Å; R485-L516 HydrophobicContact CB-CD2 4.12Å; R485-L516 HydrophobicContact CG-CD2 4.41Å
486	T	86.6	Confident	87.2	Confident	113 Å²	113	51.5 Å²	51.5	69%	0.693	26%	0.256	S	S	*	.	H	α-helix	trans	-63.7	-43	-179.9	-49	0	0	0	0	110.6	G484 S489 A490	G484-T486 PolarHBondContact O-N 3.36Å; T486-S489 PolarHBondContact O-N 3.04Å; T486-A490 PolarHBondContact O-N 3.38Å; T486-A490 VanDerWaalsContact O-N 3.07Å
487	R	87.9	Confident	85.9	Confident	90 Å²	90	56 Å²	56	34%	0.34	28%	0.283	S	S	.	.	H	α-helix	trans	-70.9	-37.7	178.2	-72.1	179	170.2	-103.8	3.2	112.7	E462 L478 G484 R485 S489 A490 L491	E462-R487 IonicContact OE1-CZ 3.93Å; E462-R487 IonicContact OE1-NH1 2.6Å; E462-R487 PolarHBondContact OE1-NH1 3.42Å; E462-R487 IonicContact OE1-NH2 3.69Å; L478-R487 HydrophobicContact CD1-CB 4.31Å; L478-R487 HydrophobicContact CD2-CB 4.03Å; G484-R487 PolarHBondContact O-N 3.34Å; R485-R487 VanDerWaalsContact C-N 3.34Å; R485-R487 PolarHBondContact O-N 2.87Å; R487-S489 VanDerWaalsContact C-N 3.32Å; R487-S489 PolarHBondContact O-N 3.25Å; R487-A490 PolarHBondContact O-N 2.9Å; R487-L491 WeakPolarHBondContact O-CB 3.37Å; R487-L491 WeakPolarHBondContact O-CG 3.47Å; R487-L491 PolarHBondContact O-N 3.12Å
488	Q	91.8	Very high	84	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.019	30%	0.304	C	S	.	.	H	α-helix	trans	-58.7	-45.8	172.8	-73.1	172.8	-24.6	0	0	111	L475 L478 D479 G484 R485 A490 L491 L492 L516	L475-Q488 HydrophobicContact CD2-CB 4.03Å; L475-Q488 HydrophobicContact CD2-CG 3.87Å; L475-Q488 PolarHBondContact O-NE2 3.14Å; L475-Q488 VanDerWaalsContact O-NE2 3.16Å; L478-Q488 HydrophobicContact CB-CG 3.49Å; L478-Q488 VanDerWaalsContact CB-CG 3.49Å; L478-Q488 HydrophobicContact CD1-CB 4.46Å; L478-Q488 HydrophobicContact CD1-CG 3.61Å; L478-Q488 HydrophobicContact CG-CG 4.16Å; D479-Q488 PolarHBondContact OD1-NE2 2.75Å; G484-Q488 WeakPolarHBondContact O-CB 3.42Å; G484-Q488 VanDerWaalsContact O-CG 3.24Å; G484-Q488 WeakPolarHBondContact O-CG 3.29Å; G484-Q488 PolarHBondContact O-N 2.93Å; R485-Q488 PolarHBondContact O-N 3.5Å; Q488-A490 PolarHBondContact O-N 3.49Å; Q488-L491 PolarHBondContact O-N 2.97Å; Q488-L492 WeakPolarHBondContact O-CB 3.33Å; Q488-L492 VanDerWaalsContact O-CG 3.28Å; Q488-L492 WeakPolarHBondContact O-CG 3.48Å; Q488-L492 PolarHBondContact O-N 2.94Å; Q488-L516 HydrophobicContact CB-CD1 3.68Å
489	S	89.7	Confident	82.7	Confident	28 Å²	28	64.1 Å²	64.1	20%	0.196	33%	0.334	C	S	.	.	H	α-helix	trans	-59.1	-47.7	175.6	-178.7	0	0	0	0	111.3	R485 T486 R487 L492 L493 T519	R485-S489 PolarHBondContact O-N 3.01Å; T486-S489 PolarHBondContact O-N 3.04Å; R487-S489 VanDerWaalsContact C-N 3.32Å; R487-S489 PolarHBondContact O-N 3.25Å; S489-L492 PolarHBondContact O-N 3.41Å; S489-L493 WeakPolarHBondContact O-CB 3.4Å; S489-L493 VanDerWaalsContact O-CG 3.29Å; S489-L493 WeakPolarHBondContact O-CG 3.32Å; S489-L493 PolarHBondContact O-N 3.11Å; S489-T519 WeakPolarHBondContact CB-OG1 3.29Å; S489-T519 WeakPolarHBondContact OG-CG2 3.31Å; S489-T519 PolarHBondContact OG-OG1 2.85Å
490	A	88.7	Confident	82.2	Confident	58 Å²	58	63 Å²	63	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-45.8	179	0	0	0	0	0	112.5	T486 R487 Q488 L493 R494	T486-A490 PolarHBondContact O-N 3.38Å; T486-A490 VanDerWaalsContact O-N 3.07Å; R487-A490 PolarHBondContact O-N 2.9Å; Q488-A490 PolarHBondContact O-N 3.49Å; A490-L493 PolarHBondContact O-N 3.43Å; A490-R494 VanDerWaalsContact O-CB 3.24Å; A490-R494 WeakPolarHBondContact O-CB 3.2Å; A490-R494 PolarHBondContact O-N 3.13Å
491	L	87.9	Confident	81.7	Confident	14 Å²	14	62.5 Å²	62.5	7%	0.073	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-45.2	178.5	-72.7	178.8	0	0	0	112	I461 A465 L471 L478 R487 Q488 L493 R494 H495	I461-L491 HydrophobicContact CG2-CD1 4.2Å; A465-L491 HydrophobicContact CB-CD1 3.88Å; A465-L491 HydrophobicContact CB-CD2 3.76Å; A465-L491 HydrophobicContact CB-CG 4.43Å; L471-L491 HydrophobicContact CD1-CB 4.39Å; L478-L491 HydrophobicContact CD1-CD1 3.62Å; R487-L491 WeakPolarHBondContact O-CB 3.37Å; R487-L491 WeakPolarHBondContact O-CG 3.47Å; R487-L491 PolarHBondContact O-N 3.12Å; Q488-L491 PolarHBondContact O-N 2.97Å; L491-L493 PolarHBondContact O-N 3.29Å; L491-R494 PolarHBondContact O-N 3.18Å; L491-H495 PolarHBondContact O-CD2 3.24Å; L491-H495 PolarHBondContact O-N 3.38Å
492	L	89.7	Confident	81.5	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-45.5	178.3	-73.9	171.1	0	0	0	111.4	L475 Q488 S489 R494 H495 A496 F507 Q510 A511 L516 T519	L475-L492 HydrophobicContact CD1-CD2 3.74Å; L475-L492 HydrophobicContact CD1-CG 4.32Å; L475-L492 HydrophobicContact CD2-CG 4.25Å; Q488-L492 WeakPolarHBondContact O-CB 3.33Å; Q488-L492 VanDerWaalsContact O-CG 3.28Å; Q488-L492 WeakPolarHBondContact O-CG 3.48Å; Q488-L492 PolarHBondContact O-N 2.94Å; S489-L492 PolarHBondContact O-N 3.41Å; L492-R494 VanDerWaalsContact C-N 3.32Å; L492-R494 PolarHBondContact O-N 3.24Å; L492-H495 PolarHBondContact O-N 3.42Å; L492-A496 WeakPolarHBondContact O-CB 3.38Å; L492-A496 PolarHBondContact O-N 2.96Å; L492-A496 VanDerWaalsContact O-N 3.07Å; L492-F507 HydrophobicContact CD2-CD1 3.89Å; L492-Q510 HydrophobicContact CD2-CB 4.06Å; L492-A511 HydrophobicContact CD1-CB 3.92Å; L492-L516 HydrophobicContact CD1-CD1 4.19Å; L492-T519 HydrophobicContact CB-CG2 4.3Å
493	L	87	Confident	81.6	Confident	55 Å²	55	63.9 Å²	63.9	29%	0.288	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-39.1	176.7	-70	169.5	0	0	0	111.9	S489 A490 L491 T519 E522 L523 L526	S489-L493 WeakPolarHBondContact O-CB 3.4Å; S489-L493 VanDerWaalsContact O-CG 3.29Å; S489-L493 WeakPolarHBondContact O-CG 3.32Å; S489-L493 PolarHBondContact O-N 3.11Å; A490-L493 PolarHBondContact O-N 3.43Å; L491-L493 PolarHBondContact O-N 3.29Å; L493-T519 HydrophobicContact CD1-CG2 4.27Å; L493-T519 HydrophobicContact CD2-CG2 4.11Å; L493-T519 HydrophobicContact CG-CG2 3.83Å; L493-E522 HydrophobicContact CD2-CB 3.99Å; L493-L523 HydrophobicContact CD2-CD2 3.9Å; L493-L523 HydrophobicContact CD2-CG 4.01Å; L493-L526 HydrophobicContact CD2-CD1 4.39Å
494	R	82.2	Confident	81.9	Confident	77 Å²	77	62 Å²	62	29%	0.291	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-40.2	179.1	-179.6	176.8	168.6	-158.9	-6.6	113	E20 A490 L491 L492 V497	E20-R494 VanDerWaalsContact CB-NH2 3.35Å; E20-R494 VanDerWaalsContact N-NH2 3.15Å; E20-R494 IonicContact OE1-CZ 2.79Å; E20-R494 IonicContact OE1-NH1 3.61Å; E20-R494 PolarHBondContact OE1-NH1 2.9Å; E20-R494 IonicContact OE2-CZ 3.6Å; E20-R494 IonicContact OE2-NH1 2.76Å; E20-R494 PolarHBondContact OE2-NH1 2.8Å; E20-R494 IonicContact OE2-NH2 3.38Å; A490-R494 VanDerWaalsContact O-CB 3.24Å; A490-R494 WeakPolarHBondContact O-CB 3.2Å; A490-R494 PolarHBondContact O-N 3.13Å; L491-R494 PolarHBondContact O-N 3.18Å; L492-R494 VanDerWaalsContact C-N 3.32Å; L492-R494 PolarHBondContact O-N 3.24Å; R494-V497 WeakPolarHBondContact O-CG2 3.47Å
495	H	81	Confident	82.1	Confident	27 Å²	27	65.5 Å²	65.5	13%	0.125	34%	0.342	C	S	.	.	H	α-helix	trans	-85.1	-16.8	-178.9	-74.6	-74.6	0	0	0	114.1	A465 L471 L491 L492 V497 F507	A465-H495 PolarHBondContact O-CE1 3.48Å; A465-H495 PolarHBondContact O-NE2 2.98Å; L471-H495 HydrophobicContact CD2-CB 3.86Å; L491-H495 PolarHBondContact O-CD2 3.24Å; L491-H495 PolarHBondContact O-N 3.38Å; L492-H495 PolarHBondContact O-N 3.42Å; H495-V497 PolarHBondContact O-N 3.47Å; H495-F507 HydrophobicContact CB-CE1 3.64Å; H495-F507 HydrophobicContact CB-CZ 3.78Å; H495-F507 WeakPolarHBondContact O-CZ 3.4Å
496	A	75.7	Confident	82.3	Confident	6 Å²	6	61.1 Å²	61.1	5%	0.05	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	15.3	-178.9	0	0	0	0	0	115.3	L492 F507 L523	L492-A496 WeakPolarHBondContact O-CB 3.38Å; L492-A496 PolarHBondContact O-N 2.96Å; L492-A496 VanDerWaalsContact O-N 3.07Å; A496-F507 HydrophobicContact CB-CB 4.39Å; A496-F507 HydrophobicContact CB-CD2 3.79Å; A496-F507 HydrophobicContact CB-CE2 4.2Å; A496-F507 HydrophobicContact CB-CG 4.05Å; A496-L523 HydrophobicContact CB-CD2 3.05Å; A496-L523 HydrophobicContact CB-CG 4.48Å
497	V	67.8	Low	82.5	Confident	98 Å²	98	55.9 Å²	55.9	59%	0.594	29%	0.294	S	S	*	.	S	Bend	trans	-49.1	152.2	163.2	176.1	0	0	0	0	109.2	R494 H495 V499	R494-V497 WeakPolarHBondContact O-CG2 3.47Å; H495-V497 PolarHBondContact O-N 3.47Å; V497-V499 WeakPolarHBondContact O-CG2 3.3Å; V497-V499 PolarHBondContact O-N 3.31Å
498	P	55.5	Low	82.6	Confident	70 Å²	70	51.9 Å²	51.9	46%	0.455	28%	0.279	S	S	.	.	S	Bend	trans	-73.9	82.9	-153.6	-4	16.1	0	0	0	114.7
499	V	66.4	Low	82.5	Confident	104 Å²	104	54.4 Å²	54.4	63%	0.63	30%	0.297	S	S	*	.	S	Bend	trans	-87.8	-44.8	-178.8	-134.3	0	0	0	0	112.5	V497 A503	V497-V499 WeakPolarHBondContact O-CG2 3.3Å; V497-V499 PolarHBondContact O-N 3.31Å; V499-A503 HydrophobicContact CB-CB 4.24Å; V499-A503 HydrophobicContact CG2-CB 4.43Å
500	S	79.5	Confident	82.6	Confident	54 Å²	54	54.7 Å²	54.7	38%	0.378	30%	0.295	S	S	.	.			trans	-179.2	160.4	173.2	61.1	0	0	0	0	111.3	R502 A503 T504	S500-R502 VanDerWaalsContact C-N 3.26Å; S500-R502 PolarHBondContact O-N 2.62Å; S500-A503 PolarHBondContact O-N 3.02Å; S500-A503 WeakPolarHBondContact OG-CB 3.37Å; S500-A503 PolarHBondContact OG-N 2.99Å; S500-A503 VanDerWaalsContact OG-N 3.13Å; S500-T504 PolarHBondContact O-N 2.97Å; S500-T504 PolarHBondContact O-OG1 3.12Å; S500-T504 VanDerWaalsContact O-OG1 3.13Å
501	T	80.3	Confident	82.7	Confident	71 Å²	71	51.9 Å²	51.9	44%	0.436	27%	0.272	S	S	.	.	H	α-helix	trans	-54.2	-40.9	172.4	-51.4	0	0	0	0	112.3	T504 N505 W558	T501-T504 PolarHBondContact O-N 3.36Å; T501-N505 PolarHBondContact O-N 3.16Å; T501-W558 HydrophobicContact CG2-CH2 4.42Å; T501-W558 HydrophobicContact CG2-CZ2 3.73Å
502	R	83.7	Confident	82.8	Confident	220 Å²	220	56.2 Å²	56.2	83%	0.83	29%	0.291	S	S	*	.	H	α-helix	trans	-64.9	-43.2	178.9	-175.8	176.6	-179.9	158.3	0.6	111.8	S500 N505 W506	S500-R502 VanDerWaalsContact C-N 3.26Å; S500-R502 PolarHBondContact O-N 2.62Å; R502-N505 PolarHBondContact O-N 3.18Å; R502-W506 PolarHBondContact O-N 3.37Å; R502-W506 VanDerWaalsContact O-N 3.08Å
503	A	84	Confident	82.8	Confident	25 Å²	25	61.6 Å²	61.6	21%	0.207	32%	0.323	C	S	.	.	H	α-helix	trans	-64.6	-44.4	176	0	0	0	0	0	111.1	V499 S500 N505 W506 F507	V499-A503 HydrophobicContact CB-CB 4.24Å; V499-A503 HydrophobicContact CG2-CB 4.43Å; S500-A503 PolarHBondContact O-N 3.02Å; S500-A503 WeakPolarHBondContact OG-CB 3.37Å; S500-A503 PolarHBondContact OG-N 2.99Å; S500-A503 VanDerWaalsContact OG-N 3.13Å; A503-N505 PolarHBondContact O-N 2.95Å; A503-W506 WeakPolarHBondContact O-CA 3.23Å; A503-W506 WeakPolarHBondContact O-CB 3.15Å; A503-W506 PolarHBondContact O-N 3.39Å; A503-W506 VanDerWaalsContact O-N 3.09Å; A503-F507 HydrophobicContact CB-CE2 4.18Å; A503-F507 WeakPolarHBondContact O-CD2 3.3Å; A503-F507 PolarHBondContact O-N 2.99Å
504	T	85.4	Confident	83	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-57.1	-46.9	175.4	-55.4	0	0	0	0	112	S500 T501 W506 F507 I508 N527 W558	S500-T504 PolarHBondContact O-N 2.97Å; S500-T504 PolarHBondContact O-OG1 3.12Å; S500-T504 VanDerWaalsContact O-OG1 3.13Å; T501-T504 PolarHBondContact O-N 3.36Å; T504-W506 VanDerWaalsContact C-N 3.26Å; T504-W506 PolarHBondContact O-N 2.83Å; T504-F507 PolarHBondContact O-N 3.24Å; T504-F507 VanDerWaalsContact O-N 3.13Å; T504-I508 HydrophobicContact CG2-CD1 3.93Å; T504-I508 HydrophobicContact CG2-CG1 4.48Å; T504-I508 WeakPolarHBondContact O-CG1 3.46Å; T504-I508 PolarHBondContact O-N 2.56Å; T504-N527 HydrophobicContact CG2-CB 4.44Å; T504-N527 WeakPolarHBondContact CG2-ND2 3.32Å; T504-N527 PolarHBondContact OG1-ND2 3.5Å; T504-N527 PolarHBondContact OG1-OD1 3.24Å; T504-W558 HydrophobicContact CG2-CH2 3.33Å; T504-W558 HydrophobicContact CG2-CZ2 4.01Å; T504-W558 HydrophobicContact CG2-CZ3 3.69Å
505	N	87.6	Confident	83.3	Confident	75 Å²	75	59 Å²	59	40%	0.401	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-37	177	-77.6	-21.7	0	0	0	112.1	T501 R502 A503 I508 S509 W558	T501-N505 PolarHBondContact O-N 3.16Å; R502-N505 PolarHBondContact O-N 3.18Å; A503-N505 PolarHBondContact O-N 2.95Å; N505-I508 PolarHBondContact O-N 2.98Å; N505-S509 WeakPolarHBondContact O-CB 3.42Å; N505-S509 PolarHBondContact O-N 3.32Å; N505-W558 VanDerWaalsContact OD1-CH2 3.3Å; N505-W558 WeakPolarHBondContact OD1-CH2 2.86Å
506	W	90.7	Very high	83.8	Confident	92 Å²	92	58.4 Å²	58.4	35%	0.348	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-47	172.7	-179.7	86.6	0	0	0	111.8	L471 R502 A503 T504 I508 S509 Q510	L471-W506 HydrophobicContact CD2-CH2 4.31Å; L471-W506 HydrophobicContact CD2-CZ3 4.08Å; L471-W506 HydrophobicContact CG-CH2 4.49Å; R502-W506 PolarHBondContact O-N 3.37Å; R502-W506 VanDerWaalsContact O-N 3.08Å; A503-W506 WeakPolarHBondContact O-CA 3.23Å; A503-W506 WeakPolarHBondContact O-CB 3.15Å; A503-W506 PolarHBondContact O-N 3.39Å; A503-W506 VanDerWaalsContact O-N 3.09Å; T504-W506 VanDerWaalsContact C-N 3.26Å; T504-W506 PolarHBondContact O-N 2.83Å; W506-I508 VanDerWaalsContact C-N 3.34Å; W506-I508 PolarHBondContact O-N 3.46Å; W506-S509 WeakPolarHBondContact O-CB 3.3Å; W506-S509 PolarHBondContact O-N 2.97Å; W506-S509 VanDerWaalsContact O-N 3.15Å; W506-Q510 HydrophobicContact CD2-CG 3.94Å; W506-Q510 HydrophobicContact CE3-CG 4.14Å; W506-Q510 HydrophobicContact CH2-CG 3.8Å; W506-Q510 HydrophobicContact CZ2-CG 3.56Å; W506-Q510 HydrophobicContact CZ3-CG 4.07Å; W506-Q510 WeakPolarHBondContact O-CG 3.37Å; W506-Q510 PolarHBondContact O-N 3.17Å
507	F	90.7	Very high	84.5	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.018	35%	0.345	C	S	.	.	H	α-helix	trans	-59.3	-43.3	176.4	-68.3	-65.7	0	0	0	112.3	L471 L492 H495 A496 A503 T504 S509 Q510 A511 L523	L471-F507 HydrophobicContact CD2-CD1 4.34Å; L471-F507 HydrophobicContact CD2-CE1 3.61Å; L492-F507 HydrophobicContact CD2-CD1 3.89Å; H495-F507 HydrophobicContact CB-CE1 3.64Å; H495-F507 HydrophobicContact CB-CZ 3.78Å; H495-F507 WeakPolarHBondContact O-CZ 3.4Å; A496-F507 HydrophobicContact CB-CB 4.39Å; A496-F507 HydrophobicContact CB-CD2 3.79Å; A496-F507 HydrophobicContact CB-CE2 4.2Å; A496-F507 HydrophobicContact CB-CG 4.05Å; A503-F507 HydrophobicContact CB-CE2 4.18Å; A503-F507 WeakPolarHBondContact O-CD2 3.3Å; A503-F507 PolarHBondContact O-N 2.99Å; T504-F507 PolarHBondContact O-N 3.24Å; T504-F507 VanDerWaalsContact O-N 3.13Å; F507-S509 VanDerWaalsContact C-N 3.34Å; F507-S509 PolarHBondContact O-N 2.64Å; F507-Q510 PolarHBondContact O-N 2.75Å; F507-A511 PolarHBondContact O-N 3.49Å; F507-L523 HydrophobicContact CB-CD1 4.01Å
508	I	89.3	Confident	85.5	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-63	-42.3	175.8	-71.3	170.1	0	0	0	110.8	T504 N505 W506 Q510 A511 K512 A520 L523 A524 W558 M561	T504-I508 HydrophobicContact CG2-CD1 3.93Å; T504-I508 HydrophobicContact CG2-CG1 4.48Å; T504-I508 WeakPolarHBondContact O-CG1 3.46Å; T504-I508 PolarHBondContact O-N 2.56Å; N505-I508 PolarHBondContact O-N 2.98Å; W506-I508 VanDerWaalsContact C-N 3.34Å; W506-I508 PolarHBondContact O-N 3.46Å; I508-Q510 VanDerWaalsContact C-N 3.33Å; I508-Q510 PolarHBondContact O-N 2.93Å; I508-A511 PolarHBondContact O-N 3.15Å; I508-K512 HydrophobicContact CG2-CD 4.21Å; I508-K512 HydrophobicContact CG2-CG 4.46Å; I508-K512 WeakPolarHBondContact O-CG 3.4Å; I508-K512 PolarHBondContact O-N 2.71Å; I508-A520 HydrophobicContact CG2-CB 4.21Å; I508-L523 HydrophobicContact CD1-CB 4.44Å; I508-L523 HydrophobicContact CG1-CB 3.9Å; I508-L523 HydrophobicContact CG1-CD1 4.15Å; I508-A524 HydrophobicContact CD1-CB 4.31Å; I508-W558 HydrophobicContact CD1-CE3 4.38Å; I508-W558 HydrophobicContact CD1-CH2 4.33Å; I508-W558 HydrophobicContact CD1-CZ3 3.53Å; I508-M561 HydrophobicContact CD1-CE 3.9Å; I508-M561 HydrophobicContact CG2-CE 3.94Å
509	S	90.5	Very high	87.2	Confident	57 Å²	57	61.3 Å²	61.3	40%	0.399	32%	0.323	S	S	.	.	H	α-helix	trans	-60.8	-43	174.8	-176.1	0	0	0	0	111.4	N505 W506 F507 A511 K512 V513	N505-S509 WeakPolarHBondContact O-CB 3.42Å; N505-S509 PolarHBondContact O-N 3.32Å; W506-S509 WeakPolarHBondContact O-CB 3.3Å; W506-S509 PolarHBondContact O-N 2.97Å; W506-S509 VanDerWaalsContact O-N 3.15Å; F507-S509 VanDerWaalsContact C-N 3.34Å; F507-S509 PolarHBondContact O-N 2.64Å; S509-A511 VanDerWaalsContact C-N 3.34Å; S509-A511 PolarHBondContact O-N 3.08Å; S509-K512 PolarHBondContact O-N 3.26Å; S509-V513 VanDerWaalsContact O-CG2 3.27Å; S509-V513 WeakPolarHBondContact O-CG2 3.29Å; S509-V513 PolarHBondContact O-N 2.63Å
510	Q	90.5	Very high	88.3	Confident	34 Å²	34	56.7 Å²	56.7	16%	0.159	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-37.7	177.4	-67.7	-55.5	-53	0	0	112.3	L475 L492 W506 F507 I508 R514	L475-Q510 HydrophobicContact CD1-CB 4.32Å; L492-Q510 HydrophobicContact CD2-CB 4.06Å; W506-Q510 HydrophobicContact CD2-CG 3.94Å; W506-Q510 HydrophobicContact CE3-CG 4.14Å; W506-Q510 HydrophobicContact CH2-CG 3.8Å; W506-Q510 HydrophobicContact CZ2-CG 3.56Å; W506-Q510 HydrophobicContact CZ3-CG 4.07Å; W506-Q510 WeakPolarHBondContact O-CG 3.37Å; W506-Q510 PolarHBondContact O-N 3.17Å; F507-Q510 PolarHBondContact O-N 2.75Å; I508-Q510 VanDerWaalsContact C-N 3.33Å; I508-Q510 PolarHBondContact O-N 2.93Å; Q510-R514 PolarHBondContact O-N 2.91Å; Q510-R514 PolarHBondContact O-NH1 3.01Å
511	A	91.1	Very high	88.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-47.2	174.3	0	0	0	0	0	111.3	L492 F507 I508 S509 R514 G515 L516 A520	L492-A511 HydrophobicContact CD1-CB 3.92Å; F507-A511 PolarHBondContact O-N 3.49Å; I508-A511 PolarHBondContact O-N 3.15Å; S509-A511 VanDerWaalsContact C-N 3.34Å; S509-A511 PolarHBondContact O-N 3.08Å; A511-R514 CarbonylContact O-C 3.27Å; A511-R514 PolarHBondContact O-N 3.27Å; A511-G515 PolarHBondContact O-N 2.99Å; A511-L516 HydrophobicContact CB-CB 4.21Å; A511-L516 WeakPolarHBondContact O-CB 3.35Å; A511-L516 PolarHBondContact O-N 3.22Å; A511-A520 HydrophobicContact CB-CB 3.95Å
512	K	90	Very high	89.2	Confident	105 Å²	105	57.1 Å²	57.1	46%	0.457	29%	0.287	S	S	.	.	H	α-helix	trans	-63.1	-45.5	-179.9	-74.9	-177.5	177.1	-171.8	0	112.8	I508 S509 R514 G515 A520	I508-K512 HydrophobicContact CG2-CD 4.21Å; I508-K512 HydrophobicContact CG2-CG 4.46Å; I508-K512 WeakPolarHBondContact O-CG 3.4Å; I508-K512 PolarHBondContact O-N 2.71Å; S509-K512 PolarHBondContact O-N 3.26Å; K512-R514 PolarHBondContact O-N 2.98Å; K512-R514 VanDerWaalsContact O-N 3.12Å; K512-G515 PolarHBondContact O-N 2.89Å; K512-A520 HydrophobicContact CG-CB 4.27Å
513	V	90.9	Very high	89.5	Confident	112 Å²	112	46.7 Å²	46.7	68%	0.679	25%	0.248	S	C	*	.	H	α-helix	trans	-57.3	-28.6	178	169.2	0	0	0	0	111.8	S509	S509-V513 VanDerWaalsContact O-CG2 3.27Å; S509-V513 WeakPolarHBondContact O-CG2 3.29Å; S509-V513 PolarHBondContact O-N 2.63Å
514	R	89.9	Confident	89.7	Confident	38 Å²	38	45.5 Å²	45.5	14%	0.143	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	4.4	179.2	-66.7	177.8	170.5	81.7	5.9	114.3	D479 Q510 A511 K512 L516	D479-R514 VanDerWaalsContact OD1-CD 3.26Å; D479-R514 WeakPolarHBondContact OD1-CD 3.42Å; D479-R514 IonicContact OD1-CZ 3.43Å; D479-R514 IonicContact OD1-NE 2.69Å; D479-R514 PolarHBondContact OD1-NE 2.76Å; D479-R514 IonicContact OD2-CZ 3.9Å; D479-R514 IonicContact OD2-NE 3.64Å; D479-R514 PolarHBondContact OD2-NE 2.9Å; D479-R514 VanDerWaalsContact OD2-NE 3.11Å; D479-R514 IonicContact OD2-NH2 3.54Å; D479-R514 PolarHBondContact OD2-NH2 2.99Å; Q510-R514 PolarHBondContact O-N 2.91Å; Q510-R514 PolarHBondContact O-NH1 3.01Å; A511-R514 CarbonylContact O-C 3.27Å; A511-R514 PolarHBondContact O-N 3.27Å; K512-R514 PolarHBondContact O-N 2.98Å; K512-R514 VanDerWaalsContact O-N 3.12Å; R514-L516 VanDerWaalsContact C-N 3.31Å; R514-L516 HydrophobicContact CB-CD1 4.34Å; R514-L516 HydrophobicContact CB-CG 4.29Å; R514-L516 PolarHBondContact O-N 2.98Å
515	G	89.9	Confident	89.8	Confident	39 Å²	39	47.7 Å²	47.7	40%	0.402	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	17	-178.6	0	0	0	0	0	114.9	A511 K512 Y517	A511-G515 PolarHBondContact O-N 2.99Å; K512-G515 PolarHBondContact O-N 2.89Å; G515-Y517 VanDerWaalsContact C-N 3.3Å; G515-Y517 WeakPolarHBondContact O-CD2 3.46Å; G515-Y517 PolarHBondContact O-N 3.44Å; G515-Y517 VanDerWaalsContact O-N 3.14Å
516	L	90.4	Very high	89.7	Confident	15 Å²	15	48.4 Å²	48.4	8%	0.079	25%	0.251	C	S	.	.			trans	-87.4	63.3	178.7	-60.3	173.7	0	0	0	111	R485 Q488 L492 A511 R514 S518 T519 A520	R485-L516 HydrophobicContact CB-CD2 4.12Å; R485-L516 HydrophobicContact CG-CD2 4.41Å; Q488-L516 HydrophobicContact CB-CD1 3.68Å; L492-L516 HydrophobicContact CD1-CD1 4.19Å; A511-L516 HydrophobicContact CB-CB 4.21Å; A511-L516 WeakPolarHBondContact O-CB 3.35Å; A511-L516 PolarHBondContact O-N 3.22Å; R514-L516 VanDerWaalsContact C-N 3.31Å; R514-L516 HydrophobicContact CB-CD1 4.34Å; R514-L516 HydrophobicContact CB-CG 4.29Å; R514-L516 PolarHBondContact O-N 2.98Å; L516-S518 PolarHBondContact O-N 3.01Å; L516-T519 PolarHBondContact O-N 2.96Å; L516-A520 PolarHBondContact O-N 3.18Å
517	Y	89.6	Confident	89.4	Confident	149 Å²	149	44.3 Å²	44.3	58%	0.584	24%	0.236	S	C	*	.	H	α-helix	trans	-65	-39.2	-174.9	-62.2	-74.9	0	0	0	113.2	G515 T519 A520 E521	G515-Y517 VanDerWaalsContact C-N 3.3Å; G515-Y517 WeakPolarHBondContact O-CD2 3.46Å; G515-Y517 PolarHBondContact O-N 3.44Å; G515-Y517 VanDerWaalsContact O-N 3.14Å; Y517-T519 VanDerWaalsContact C-N 3.33Å; Y517-T519 PolarHBondContact O-N 3.32Å; Y517-A520 WeakPolarHBondContact O-CB 3.41Å; Y517-A520 PolarHBondContact O-N 2.92Å; Y517-E521 WeakPolarHBondContact O-CG 3.31Å; Y517-E521 PolarHBondContact O-N 3.36Å
518	S	90	Very high	89.1	Confident	84 Å²	84	44.1 Å²	44.1	59%	0.587	24%	0.235	S	C	*	.	H	α-helix	trans	-61.8	-41.8	176.1	54.9	0	0	0	0	111.9	L516 E521 E522	L516-S518 PolarHBondContact O-N 3.01Å; S518-E521 PolarHBondContact O-N 3.3Å; S518-E522 WeakPolarHBondContact O-CG 3.45Å; S518-E522 PolarHBondContact O-N 2.89Å
519	T	90.8	Very high	88.8	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.018	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-42.5	174.9	-44.5	0	0	0	0	111.2	S489 L492 L493 L516 Y517 E521 E522 L523	S489-T519 WeakPolarHBondContact CB-OG1 3.29Å; S489-T519 WeakPolarHBondContact OG-CG2 3.31Å; S489-T519 PolarHBondContact OG-OG1 2.85Å; L492-T519 HydrophobicContact CB-CG2 4.3Å; L493-T519 HydrophobicContact CD1-CG2 4.27Å; L493-T519 HydrophobicContact CD2-CG2 4.11Å; L493-T519 HydrophobicContact CG-CG2 3.83Å; L516-T519 PolarHBondContact O-N 2.96Å; Y517-T519 VanDerWaalsContact C-N 3.33Å; Y517-T519 PolarHBondContact O-N 3.32Å; T519-E521 VanDerWaalsContact C-N 3.3Å; T519-E521 PolarHBondContact O-N 2.69Å; T519-E522 PolarHBondContact O-N 3.34Å; T519-L523 HydrophobicContact CG2-CD1 4.42Å; T519-L523 WeakPolarHBondContact O-CB 3.49Å; T519-L523 WeakPolarHBondContact O-CG 3.45Å; T519-L523 PolarHBondContact O-N 3.47Å
520	A	89.6	Confident	88.3	Confident	7 Å²	7	54.2 Å²	54.2	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-40.8	176.1	0	0	0	0	0	112.2	I508 A511 K512 L516 Y517 A524	I508-A520 HydrophobicContact CG2-CB 4.21Å; A511-A520 HydrophobicContact CB-CB 3.95Å; K512-A520 HydrophobicContact CG-CB 4.27Å; L516-A520 PolarHBondContact O-N 3.18Å; Y517-A520 WeakPolarHBondContact O-CB 3.41Å; Y517-A520 PolarHBondContact O-N 2.92Å; A520-A524 PolarHBondContact O-N 3.23Å; A520-A524 VanDerWaalsContact O-N 3.1Å
521	E	89.4	Confident	87.8	Confident	56 Å²	56	54 Å²	54	26%	0.262	26%	0.263	S	S	.	.	H	α-helix	trans	-65.3	-46	174.4	-71.5	174.9	-170.5	0	0	111.5	Y517 S518 T519 L523 A524 K525 R563	Y517-E521 WeakPolarHBondContact O-CG 3.31Å; Y517-E521 PolarHBondContact O-N 3.36Å; S518-E521 PolarHBondContact O-N 3.3Å; T519-E521 VanDerWaalsContact C-N 3.3Å; T519-E521 PolarHBondContact O-N 2.69Å; E521-L523 VanDerWaalsContact C-N 3.32Å; E521-L523 PolarHBondContact O-N 3.35Å; E521-A524 CarbonylContact O-C 3.6Å; E521-A524 WeakPolarHBondContact O-CB 3.49Å; E521-A524 PolarHBondContact O-N 2.89Å; E521-A524 VanDerWaalsContact O-N 3.15Å; E521-K525 WeakPolarHBondContact O-CG 3.39Å; E521-K525 PolarHBondContact O-N 2.67Å; E521-R563 IonicContact OE1-NE 3.92Å
522	E	89.2	Confident	87.2	Confident	78 Å²	78	54.1 Å²	54.1	36%	0.364	26%	0.264	S	S	.	.	H	α-helix	trans	-61.9	-38.2	177.1	-72.7	-56.2	131.3	0	0	112.4	L493 S518 T519 A524 K525 L526	L493-E522 HydrophobicContact CD2-CB 3.99Å; S518-E522 WeakPolarHBondContact O-CG 3.45Å; S518-E522 PolarHBondContact O-N 2.89Å; T519-E522 PolarHBondContact O-N 3.34Å; E522-A524 VanDerWaalsContact C-N 3.35Å; E522-A524 PolarHBondContact O-N 3.01Å; E522-K525 PolarHBondContact O-N 3.08Å; E522-K525 WeakPolarHBondContact OE1-CD 3.14Å; E522-K525 IonicContact OE1-NZ 3.6Å; E522-K525 PolarHBondContact OE1-NZ 3.42Å; E522-L526 WeakPolarHBondContact O-CB 3.41Å; E522-L526 PolarHBondContact O-N 3.28Å
523	L	89.1	Confident	86.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-43	172.9	-73.9	172.8	0	0	0	112.3	L493 A496 F507 I508 T519 E521 N527	L493-L523 HydrophobicContact CD2-CD2 3.9Å; L493-L523 HydrophobicContact CD2-CG 4.01Å; A496-L523 HydrophobicContact CB-CD2 3.05Å; A496-L523 HydrophobicContact CB-CG 4.48Å; F507-L523 HydrophobicContact CB-CD1 4.01Å; I508-L523 HydrophobicContact CD1-CB 4.44Å; I508-L523 HydrophobicContact CG1-CB 3.9Å; I508-L523 HydrophobicContact CG1-CD1 4.15Å; T519-L523 HydrophobicContact CG2-CD1 4.42Å; T519-L523 WeakPolarHBondContact O-CB 3.49Å; T519-L523 WeakPolarHBondContact O-CG 3.45Å; T519-L523 PolarHBondContact O-N 3.47Å; E521-L523 VanDerWaalsContact C-N 3.32Å; E521-L523 PolarHBondContact O-N 3.35Å; L523-N527 PolarHBondContact O-N 3.11Å; L523-N527 PolarHBondContact O-ND2 3.13Å
524	A	88.8	Confident	85.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-40.9	175.1	0	0	0	0	0	111.2	I508 A520 E521 E522 L526 N527 C528 W558 M561 A562	I508-A524 HydrophobicContact CD1-CB 4.31Å; A520-A524 PolarHBondContact O-N 3.23Å; A520-A524 VanDerWaalsContact O-N 3.1Å; E521-A524 CarbonylContact O-C 3.6Å; E521-A524 WeakPolarHBondContact O-CB 3.49Å; E521-A524 PolarHBondContact O-N 2.89Å; E521-A524 VanDerWaalsContact O-N 3.15Å; E522-A524 VanDerWaalsContact C-N 3.35Å; E522-A524 PolarHBondContact O-N 3.01Å; A524-L526 PolarHBondContact O-N 3.29Å; A524-N527 PolarHBondContact O-N 3.06Å; A524-C528 WeakPolarHBondContact O-CB 3.37Å; A524-C528 PolarHBondContact O-N 3.07Å; A524-W558 HydrophobicContact CB-CE3 4.24Å; A524-M561 HydrophobicContact CB-CB 3.86Å; A524-A562 HydrophobicContact CB-CB 3.82Å
525	K	88	Confident	84.7	Confident	48 Å²	48	49.4 Å²	49.4	21%	0.209	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-42.9	175.2	-72	177.9	-165	162.7	0	112	E521 E522 N527 C528 R529 A562	E521-K525 WeakPolarHBondContact O-CG 3.39Å; E521-K525 PolarHBondContact O-N 2.67Å; E522-K525 PolarHBondContact O-N 3.08Å; E522-K525 WeakPolarHBondContact OE1-CD 3.14Å; E522-K525 IonicContact OE1-NZ 3.6Å; E522-K525 PolarHBondContact OE1-NZ 3.42Å; K525-N527 VanDerWaalsContact C-N 3.32Å; K525-N527 PolarHBondContact O-N 3.42Å; K525-C528 WeakPolarHBondContact O-CB 3.49Å; K525-C528 PolarHBondContact O-N 3.27Å; K525-R529 WeakPolarHBondContact O-CG 3.41Å; K525-R529 PolarHBondContact O-N 3.35Å; K525-A562 HydrophobicContact CB-CB 4.36Å; K525-A562 HydrophobicContact CG-CB 3.51Å
526	L	85.3	Confident	83.7	Confident	91 Å²	91	51.8 Å²	51.8	48%	0.476	25%	0.249	S	C	.	.	H	α-helix	trans	-57.3	-45.6	176.4	-106.1	158.1	0	0	0	111.6	L493 E522 A524 R530	L493-L526 HydrophobicContact CD2-CD1 4.39Å; E522-L526 WeakPolarHBondContact O-CB 3.41Å; E522-L526 PolarHBondContact O-N 3.28Å; A524-L526 PolarHBondContact O-N 3.29Å; L526-R530 PolarHBondContact O-N 2.84Å
527	N	83.9	Confident	82.4	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.027	28%	0.276	C	S	.	.	H	α-helix	trans	-71.8	-39	176.9	-79.4	-92.3	0	0	0	112	T504 L523 A524 K525 R529 R530 F531 W558	T504-N527 HydrophobicContact CG2-CB 4.44Å; T504-N527 WeakPolarHBondContact CG2-ND2 3.32Å; T504-N527 PolarHBondContact OG1-ND2 3.5Å; T504-N527 PolarHBondContact OG1-OD1 3.24Å; L523-N527 PolarHBondContact O-N 3.11Å; L523-N527 PolarHBondContact O-ND2 3.13Å; A524-N527 PolarHBondContact O-N 3.06Å; K525-N527 VanDerWaalsContact C-N 3.32Å; K525-N527 PolarHBondContact O-N 3.42Å; N527-R529 PolarHBondContact O-N 2.86Å; N527-R530 WeakPolarHBondContact O-CB 3.05Å; N527-R530 PolarHBondContact O-N 3.42Å; N527-F531 WeakPolarHBondContact O-CD2 3.45Å; N527-F531 PolarHBondContact O-N 3.03Å; N527-W558 HydrophobicContact CB-CD2 3.79Å; N527-W558 HydrophobicContact CB-CE3 4.24Å; N527-W558 HydrophobicContact CB-CG 4.01Å; N527-W558 HydrophobicContact CB-CZ2 4.35Å
528	C	85.8	Confident	80.6	Confident	1 Å²	1	54 Å²	54	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-56	-50.2	174.3	-175.9	0	0	0	0	111.1	A524 K525 R530 F531 A532 S555 W558	A524-C528 WeakPolarHBondContact O-CB 3.37Å; A524-C528 PolarHBondContact O-N 3.07Å; K525-C528 WeakPolarHBondContact O-CB 3.49Å; K525-C528 PolarHBondContact O-N 3.27Å; C528-R530 VanDerWaalsContact C-N 3.26Å; C528-R530 PolarHBondContact O-N 2.82Å; C528-F531 PolarHBondContact O-N 3.43Å; C528-A532 WeakPolarHBondContact O-CB 3.5Å; C528-A532 PolarHBondContact O-N 2.84Å; C528-S555 PolarHBondContact SG-O 3.41Å; C528-W558 HydrophobicContact CB-CB 3.76Å
529	R	83.2	Confident	78.5	Confident	162 Å²	162	57.7 Å²	57.7	61%	0.611	28%	0.281	S	S	*	.	H	α-helix	trans	-57.6	-37.8	178.1	-73.2	176	-179.2	172.5	2.6	112.8	K525 N527 C533	K525-R529 WeakPolarHBondContact O-CG 3.41Å; K525-R529 PolarHBondContact O-N 3.35Å; N527-R529 PolarHBondContact O-N 2.86Å; R529-C533 PolarHBondContact O-N 3.15Å
530	R	78.8	Confident	75.8	Confident	112 Å²	112	60.3 Å²	60.3	42%	0.423	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-52.4	177.2	-177.3	-172.4	179.1	-169.1	5.2	111.7	L526 N527 C528	L526-R530 PolarHBondContact O-N 2.84Å; N527-R530 WeakPolarHBondContact O-CB 3.05Å; N527-R530 PolarHBondContact O-N 3.42Å; C528-R530 VanDerWaalsContact C-N 3.26Å; C528-R530 PolarHBondContact O-N 2.82Å
531	F	79.6	Confident	73	Confident	29 Å²	29	64.6 Å²	64.6	13%	0.127	35%	0.353	C	S	.	.	H	α-helix	trans	-76.7	-29.4	-178	-66.8	-74.6	0	0	0	112.4	N527 C528 C533 L534 S535 I554 S555 W558	N527-F531 WeakPolarHBondContact O-CD2 3.45Å; N527-F531 PolarHBondContact O-N 3.03Å; C528-F531 PolarHBondContact O-N 3.43Å; F531-C533 VanDerWaalsContact C-N 3.3Å; F531-C533 PolarHBondContact O-N 3.11Å; F531-L534 HydrophobicContact CD1-CD1 4.24Å; F531-L534 WeakPolarHBondContact O-CB 3.26Å; F531-L534 PolarHBondContact O-N 3.41Å; F531-S535 PolarHBondContact O-N 3.26Å; F531-S535 PolarHBondContact O-OG 3.22Å; F531-I554 HydrophobicContact CB-CG2 4.43Å; F531-I554 HydrophobicContact CD1-CG2 3.94Å; F531-I554 HydrophobicContact CD2-CG2 3.78Å; F531-I554 HydrophobicContact CE1-CG2 4.08Å; F531-I554 HydrophobicContact CE2-CG2 3.95Å; F531-I554 HydrophobicContact CG-CG2 3.79Å; F531-I554 HydrophobicContact CZ-CG2 4.09Å; F531-S555 WeakPolarHBondContact CB-OG 3.37Å; F531-S555 PolarHBondContact O-OG 3.11Å; F531-W558 AromaticContact CD2-CD1 3.63Å; F531-W558 AromaticContact CD2-NE1 3.72Å; F531-W558 AromaticContact CE2-CD1 3.96Å; F531-W558 AromaticContact CE2-NE1 3.53Å
532	A	79.9	Confident	70.2	Confident	3 Å²	3	66.6 Å²	66.6	3%	0.025	37%	0.373	C	S	.	.	H	α-helix	trans	-62.9	-38	175.5	0	0	0	0	0	111.4	C528 L534 S535 L536 S555 M567	C528-A532 WeakPolarHBondContact O-CB 3.5Å; C528-A532 PolarHBondContact O-N 2.84Å; A532-L534 PolarHBondContact O-N 2.76Å; A532-S535 WeakPolarHBondContact O-CB 2.99Å; A532-S535 PolarHBondContact O-N 3.03Å; A532-L536 VanDerWaalsContact O-CG 3.3Å; A532-L536 WeakPolarHBondContact O-CG 3.21Å; A532-L536 PolarHBondContact O-N 2.89Å; A532-S555 PolarHBondContact N-OG 3.5Å; A532-M567 HydrophobicContact CB-CE 4.2Å; A532-M567 HydrophobicContact CB-SD 4.05Å
533	C	74.4	Confident	67.5	Low	63 Å²	63	69.8 Å²	69.8	43%	0.426	39%	0.392	S	S	.	.	H	α-helix	trans	-60	-44.6	174.5	-168.6	0	0	0	0	111.9	R529 F531 S535 L536 Q537	R529-C533 PolarHBondContact O-N 3.15Å; F531-C533 VanDerWaalsContact C-N 3.3Å; F531-C533 PolarHBondContact O-N 3.11Å; C533-S535 VanDerWaalsContact C-N 3.31Å; C533-S535 PolarHBondContact O-N 3.3Å; C533-L536 PolarHBondContact O-N 3.17Å; C533-Q537 WeakPolarHBondContact O-CG 3.44Å; C533-Q537 PolarHBondContact O-N 3.12Å
534	L	72	Confident	65.2	Low	91 Å²	91	77.3 Å²	77.3	48%	0.476	43%	0.43	S	S	.	.	H	α-helix	trans	-64	-37.7	175.3	-63.1	172.2	0	0	0	111.8	F531 A532 P551	F531-L534 HydrophobicContact CD1-CD1 4.24Å; F531-L534 WeakPolarHBondContact O-CB 3.26Å; F531-L534 PolarHBondContact O-N 3.41Å; A532-L534 PolarHBondContact O-N 2.76Å; L534-P551 HydrophobicContact CB-CB 4.36Å
535	S	70.6	Confident	62.5	Low	2 Å²	2	83.3 Å²	83.3	1%	0.014	46%	0.462	C	S	.	.	H	α-helix	trans	-65.7	-39.1	178.4	-58.2	0	0	0	0	112.4	F531 A532 C533 P551 I552 S555 R578	F531-S535 PolarHBondContact O-N 3.26Å; F531-S535 PolarHBondContact O-OG 3.22Å; A532-S535 WeakPolarHBondContact O-CB 2.99Å; A532-S535 PolarHBondContact O-N 3.03Å; C533-S535 VanDerWaalsContact C-N 3.31Å; C533-S535 PolarHBondContact O-N 3.3Å; S535-P551 WeakPolarHBondContact OG-CB 3.42Å; S535-P551 PolarHBondContact OG-O 3.07Å; S535-I552 PolarHBondContact OG-N 3.36Å; S535-S555 PolarHBondContact OG-OG 3.19Å; S535-S555 VanDerWaalsContact OG-OG 3.08Å; S535-R578 PolarHBondContact O-NH1 3.01Å; S535-R578 PolarHBondContact O-NH2 2.8Å
536	L	68.5	Low	59.9	Low	89 Å²	89	86.6 Å²	86.6	47%	0.466	49%	0.491	S	S	.	.	H	α-helix	trans	-75.5	-28.4	-178.2	-71.2	165.2	0	0	0	113.3	A532 C533 L574	A532-L536 VanDerWaalsContact O-CG 3.3Å; A532-L536 WeakPolarHBondContact O-CG 3.21Å; A532-L536 PolarHBondContact O-N 2.89Å; C533-L536 PolarHBondContact O-N 3.17Å; L536-L574 HydrophobicContact CD2-CD1 3.49Å; L536-L574 VanDerWaalsContact CD2-CD1 3.49Å
537	Q	62.9	Low	57.8	Low	136 Å²	136	86.7 Å²	86.7	64%	0.636	50%	0.499	S	S	*	.	H	α-helix	trans	-79.7	-13.2	-176.1	-74.8	179.2	-4.7	0	0	115.1	C533 Q539	C533-Q537 WeakPolarHBondContact O-CG 3.44Å; C533-Q537 PolarHBondContact O-N 3.12Å; Q537-Q539 PolarHBondContact O-N 2.82Å
538	S	53.8	Low	56.2	Low	75 Å²	75	92.7 Å²	92.7	52%	0.524	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	15.9	-172.1	104.4	0	0	0	0	116	R578	S538-R578 PolarHBondContact OG-NH1 3.4Å; S538-R578 PolarHBondContact OG-NH2 2.88Å
539	Q	44.9	Very low	54.9	Low	161 Å²	161	100.7 Å²	100.7	75%	0.752	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-11.3	174.7	-77.8	-166.9	-12.8	0	0	114.3	Q537	Q537-Q539 PolarHBondContact O-N 2.82Å
540	G	33.9	Very low	54.4	Low	57 Å²	57	93.9 Å²	93.9	59%	0.588	54%	0.54	S	S	*	.	S	Bend	trans	-106.5	124.1	174.9	0	0	0	0	0	111.2	S542	G540-S542 PolarHBondContact O-N 3.26Å
541	G	31.1	Very low	54.3	Low	97 Å²	97	91.1 Å²	91.1	100%	1	54%	0.536	S	S	*	.			trans	-56.6	85.6	-175.5	0	0	0	0	0	115.3
542	S	31.5	Very low	54.4	Low	99 Å²	99	89.8 Å²	89.8	69%	0.692	53%	0.531	S	S	*	.			trans	-123.8	113.3	160	-168.8	0	0	0	0	108.5	G540 I544	G540-S542 PolarHBondContact O-N 3.26Å; S542-I544 PolarHBondContact O-N 3.42Å; S542-I544 VanDerWaalsContact O-N 3.13Å
543	I	32.6	Very low	54.6	Low	145 Å²	145	90 Å²	90	74%	0.744	53%	0.532	S	S	*	.			trans	-58.9	108.5	172.4	-63.1	159.1	0	0	0	106.8
544	I	39.1	Very low	55.1	Low	157 Å²	157	89.7 Å²	89.7	81%	0.805	53%	0.525	S	S	*	.			trans	-100.2	100.2	157.8	-59	-179.3	0	0	0	105.6	S542	S542-I544 PolarHBondContact O-N 3.42Å; S542-I544 VanDerWaalsContact O-N 3.13Å
545	D	32.6	Very low	55.7	Low	127 Å²	127	85.3 Å²	85.3	68%	0.679	50%	0.502	S	S	*	.			trans	-54.3	136.8	168.7	-77.8	-41.2	0	0	0	110.8
546	S	33.4	Very low	56.6	Low	117 Å²	117	85.3 Å²	85.3	82%	0.818	50%	0.502	S	S	*	.			trans	64.5	78.5	152.8	67.8	0	0	0	0	118.9
547	S	40.4	Very low	57.5	Low	92 Å²	92	82.2 Å²	82.2	64%	0.643	49%	0.492	S	S	*	.			trans	-157.6	136.7	135.6	62.5	0	0	0	0	111.2	Y549	S547-Y549 PolarHBondContact O-N 3.19Å
548	N	51	Low	58.7	Low	131 Å²	131	76.2 Å²	76.2	70%	0.701	46%	0.463	S	S	*	.	S	Bend	trans	-67.8	20.9	-168.3	-75.3	-16.9	0	0	0	116.7
549	Y	58.6	Low	60.3	Low	170 Å²	170	72.7 Å²	72.7	67%	0.667	44%	0.438	S	S	*	.			trans	-134.6	126.4	-170.8	-55.9	-74.8	0	0	0	112.7	S547 P551	S547-Y549 PolarHBondContact O-N 3.19Å; Y549-P551 WeakPolarHBondContact O-CD 3.4Å
550	S	72.8	Confident	62.2	Low	19 Å²	19	65.3 Å²	65.3	13%	0.133	40%	0.404	C	S	.	.			trans	-68.6	125.5	174	174.4	0	0	0	0	110.6	I552 C553 I554 E599	S550-I552 PolarHBondContact O-N 3.35Å; S550-I552 PolarHBondContact OG-N 3.27Å; S550-C553 PolarHBondContact O-N 2.97Å; S550-I554 PolarHBondContact O-N 3.23Å; S550-E599 WeakPolarHBondContact OG-CG 3.16Å; S550-E599 PolarHBondContact OG-OE2 2.82Å
551	P	76.4	Confident	64.6	Low	53 Å²	53	65.7 Å²	65.7	34%	0.344	39%	0.392	S	S	.	.	H	α-helix	trans	-56.2	-30.3	174.4	-23.5	32.7	0	0	0	113	L534 S535 Y549 S555	L534-P551 HydrophobicContact CB-CB 4.36Å; S535-P551 WeakPolarHBondContact OG-CB 3.42Å; S535-P551 PolarHBondContact OG-O 3.07Å; Y549-P551 WeakPolarHBondContact O-CD 3.4Å; P551-S555 WeakPolarHBondContact O-CB 3.25Å; P551-S555 PolarHBondContact O-N 3.48Å; P551-S555 PolarHBondContact O-OG 3.08Å
552	I	83.1	Confident	67.1	Low	2 Å²	2	61.1 Å²	61.1	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-68.2	-47.5	180	-72.5	168	0	0	0	110.5	S535 S550 I554 S555 V556 L571 E599 L603	S535-I552 PolarHBondContact OG-N 3.36Å; S550-I552 PolarHBondContact O-N 3.35Å; S550-I552 PolarHBondContact OG-N 3.27Å; I552-I554 VanDerWaalsContact C-N 3.33Å; I552-I554 PolarHBondContact O-N 2.91Å; I552-S555 WeakPolarHBondContact O-CB 3.48Å; I552-S555 PolarHBondContact O-N 3.09Å; I552-S555 VanDerWaalsContact O-N 3.14Å; I552-V556 PolarHBondContact O-N 2.9Å; I552-L571 HydrophobicContact CG2-CB 4.47Å; I552-E599 WeakPolarHBondContact CD1-OE1 3.26Å; I552-L603 HydrophobicContact CG2-CD1 3.98Å
553	C	83.7	Confident	69.6	Low	8 Å²	8	62 Å²	62	5%	0.054	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-42.3	178.8	-64.3	0	0	0	0	111.8	S550 V556 G557 I606	S550-C553 PolarHBondContact O-N 2.97Å; C553-V556 PolarHBondContact O-N 2.91Å; C553-G557 PolarHBondContact O-N 2.85Å; C553-I606 HydrophobicContact CB-CD1 3.79Å
554	I	83.4	Confident	72.1	Confident	55 Å²	55	56.9 Å²	56.9	28%	0.282	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-44.1	175.1	-63	170.2	0	0	0	110.6	F531 S550 I552 V556 G557 W558	F531-I554 HydrophobicContact CB-CG2 4.43Å; F531-I554 HydrophobicContact CD1-CG2 3.94Å; F531-I554 HydrophobicContact CD2-CG2 3.78Å; F531-I554 HydrophobicContact CE1-CG2 4.08Å; F531-I554 HydrophobicContact CE2-CG2 3.95Å; F531-I554 HydrophobicContact CG-CG2 3.79Å; F531-I554 HydrophobicContact CZ-CG2 4.09Å; S550-I554 PolarHBondContact O-N 3.23Å; I552-I554 VanDerWaalsContact C-N 3.33Å; I552-I554 PolarHBondContact O-N 2.91Å; I554-V556 VanDerWaalsContact C-N 3.34Å; I554-V556 PolarHBondContact O-N 3.44Å; I554-G557 PolarHBondContact O-N 3.12Å; I554-W558 PolarHBondContact O-N 2.55Å; I554-W558 VanDerWaalsContact O-N 3.14Å
555	S	86.6	Confident	74.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-41.8	179.4	-58.6	0	0	0	0	112.1	C528 F531 A532 S535 P551 I552 W558 A559	C528-S555 PolarHBondContact SG-O 3.41Å; F531-S555 WeakPolarHBondContact CB-OG 3.37Å; F531-S555 PolarHBondContact O-OG 3.11Å; A532-S555 PolarHBondContact N-OG 3.5Å; S535-S555 PolarHBondContact OG-OG 3.19Å; S535-S555 VanDerWaalsContact OG-OG 3.08Å; P551-S555 WeakPolarHBondContact O-CB 3.25Å; P551-S555 PolarHBondContact O-N 3.48Å; P551-S555 PolarHBondContact O-OG 3.08Å; I552-S555 WeakPolarHBondContact O-CB 3.48Å; I552-S555 PolarHBondContact O-N 3.09Å; I552-S555 VanDerWaalsContact O-N 3.14Å; S555-W558 PolarHBondContact O-N 2.56Å; S555-A559 WeakPolarHBondContact O-CB 3.3Å; S555-A559 PolarHBondContact O-N 2.89Å
556	V	88	Confident	76.6	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-40.8	177.1	167.1	0	0	0	0	111.4	I552 C553 I554 W558 A559 L560 L571 L603 I607	I552-V556 PolarHBondContact O-N 2.9Å; C553-V556 PolarHBondContact O-N 2.91Å; I554-V556 VanDerWaalsContact C-N 3.34Å; I554-V556 PolarHBondContact O-N 3.44Å; V556-W558 VanDerWaalsContact C-N 3.27Å; V556-W558 PolarHBondContact O-N 3.38Å; V556-A559 PolarHBondContact O-N 3.06Å; V556-A559 VanDerWaalsContact O-N 3.1Å; V556-L560 HydrophobicContact CG1-CD1 3.77Å; V556-L560 HydrophobicContact CG1-CG 4.18Å; V556-L560 WeakPolarHBondContact O-CB 3.45Å; V556-L560 WeakPolarHBondContact O-CG 3.4Å; V556-L560 PolarHBondContact O-N 3.45Å; V556-L571 HydrophobicContact CB-CD1 4.46Å; V556-L571 HydrophobicContact CG2-CB 3.43Å; V556-L571 VanDerWaalsContact CG2-CB 3.43Å; V556-L571 HydrophobicContact CG2-CD1 3.51Å; V556-L571 HydrophobicContact CG2-CG 4.09Å; V556-L603 HydrophobicContact CB-CD1 3.68Å; V556-L603 HydrophobicContact CG1-CD1 3.96Å; V556-L603 HydrophobicContact CG2-CD1 3.49Å; V556-L603 VanDerWaalsContact CG2-CD1 3.49Å; V556-I607 HydrophobicContact CG1-CD1 4.4Å; V556-I607 HydrophobicContact CG1-CG1 4.03Å
557	G	86.9	Confident	79	Confident	24 Å²	24	48 Å²	48	25%	0.247	25%	0.252	C	S	.	.	H	α-helix	trans	-54.1	-45.7	173.1	0	0	0	0	0	112	C553 I554 M561	C553-G557 PolarHBondContact O-N 2.85Å; I554-G557 PolarHBondContact O-N 3.12Å; G557-M561 WeakPolarHBondContact O-CG 3.26Å; G557-M561 PolarHBondContact O-N 3.45Å
558	W	88.4	Confident	81.2	Confident	11 Å²	11	43.7 Å²	43.7	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-69.3	-37.2	174.9	-70	117.8	0	0	0	113.6	T501 T504 N505 I508 A524 N527 C528 F531 I554 S555 V556 L560 M561 A562	T501-W558 HydrophobicContact CG2-CH2 4.42Å; T501-W558 HydrophobicContact CG2-CZ2 3.73Å; T504-W558 HydrophobicContact CG2-CH2 3.33Å; T504-W558 HydrophobicContact CG2-CZ2 4.01Å; T504-W558 HydrophobicContact CG2-CZ3 3.69Å; N505-W558 VanDerWaalsContact OD1-CH2 3.3Å; N505-W558 WeakPolarHBondContact OD1-CH2 2.86Å; I508-W558 HydrophobicContact CD1-CE3 4.38Å; I508-W558 HydrophobicContact CD1-CH2 4.33Å; I508-W558 HydrophobicContact CD1-CZ3 3.53Å; A524-W558 HydrophobicContact CB-CE3 4.24Å; N527-W558 HydrophobicContact CB-CD2 3.79Å; N527-W558 HydrophobicContact CB-CE3 4.24Å; N527-W558 HydrophobicContact CB-CG 4.01Å; N527-W558 HydrophobicContact CB-CZ2 4.35Å; C528-W558 HydrophobicContact CB-CB 3.76Å; F531-W558 AromaticContact CD2-CD1 3.63Å; F531-W558 AromaticContact CD2-NE1 3.72Å; F531-W558 AromaticContact CE2-CD1 3.96Å; F531-W558 AromaticContact CE2-NE1 3.53Å; I554-W558 PolarHBondContact O-N 2.55Å; I554-W558 VanDerWaalsContact O-N 3.14Å; S555-W558 PolarHBondContact O-N 2.56Å; V556-W558 VanDerWaalsContact C-N 3.27Å; V556-W558 PolarHBondContact O-N 3.38Å; W558-L560 VanDerWaalsContact C-N 3.34Å; W558-M561 HydrophobicContact CE3-SD 4.03Å; W558-M561 HydrophobicContact CZ3-CE 4.46Å; W558-M561 HydrophobicContact CZ3-SD 3.88Å; W558-M561 PolarHBondContact O-N 2.96Å; W558-A562 WeakPolarHBondContact O-CB 3.03Å; W558-A562 PolarHBondContact O-N 3.26Å
559	A	87.2	Confident	82.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-39.1	178.1	0	0	0	0	0	111.9	S555 V556 A562 R563 D564 M567 I568	S555-A559 WeakPolarHBondContact O-CB 3.3Å; S555-A559 PolarHBondContact O-N 2.89Å; V556-A559 PolarHBondContact O-N 3.06Å; V556-A559 VanDerWaalsContact O-N 3.1Å; A559-A562 CarbonylContact O-C 3.59Å; A559-A562 PolarHBondContact O-N 3.48Å; A559-R563 PolarHBondContact O-N 3.34Å; A559-R563 VanDerWaalsContact O-N 3.08Å; A559-D564 PolarHBondContact O-N 3.45Å; A559-M567 HydrophobicContact CB-CB 4.34Å; A559-M567 HydrophobicContact CB-CG 4.27Å; A559-I568 HydrophobicContact CB-CD1 4.46Å; A559-I568 HydrophobicContact CB-CG1 3.57Å
560	L	86.6	Confident	83.9	Confident	6 Å²	6	37.1 Å²	37.1	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-62.5	-47.5	173	-73.2	164.2	0	0	0	111	V556 W558 A562 R563 I568 I606 I607 F610	V556-L560 HydrophobicContact CG1-CD1 3.77Å; V556-L560 HydrophobicContact CG1-CG 4.18Å; V556-L560 WeakPolarHBondContact O-CB 3.45Å; V556-L560 WeakPolarHBondContact O-CG 3.4Å; V556-L560 PolarHBondContact O-N 3.45Å; W558-L560 VanDerWaalsContact C-N 3.34Å; L560-A562 VanDerWaalsContact C-N 3.25Å; L560-A562 PolarHBondContact O-N 3.41Å; L560-R563 PolarHBondContact O-N 3.26Å; L560-R563 VanDerWaalsContact O-N 3.14Å; L560-I568 HydrophobicContact CD2-CD1 3.6Å; L560-I568 HydrophobicContact CD2-CG1 4.37Å; L560-I568 HydrophobicContact CG-CD1 4Å; L560-I568 HydrophobicContact CG-CG1 4.37Å; L560-I606 HydrophobicContact CD1-CG2 3.86Å; L560-I607 HydrophobicContact CD1-CG1 4.28Å; L560-F610 HydrophobicContact CB-CD1 4.28Å; L560-F610 HydrophobicContact CB-CD2 3.84Å; L560-F610 HydrophobicContact CB-CE1 4.35Å; L560-F610 HydrophobicContact CB-CE2 3.93Å; L560-F610 HydrophobicContact CB-CG 4.01Å; L560-F610 HydrophobicContact CB-CZ 4.18Å; L560-F610 HydrophobicContact CD1-CB 4Å; L560-F610 HydrophobicContact CD1-CG 4.22Å; L560-F610 HydrophobicContact CD2-CB 4.32Å; L560-F610 HydrophobicContact CD2-CD1 3.75Å; L560-F610 HydrophobicContact CD2-CE1 4.2Å; L560-F610 HydrophobicContact CD2-CG 4.01Å; L560-F610 HydrophobicContact CG-CD1 4.48Å; L560-F610 HydrophobicContact CG-CG 4.32Å; L560-F610 VanDerWaalsContact O-CZ 3.29Å; L560-F610 WeakPolarHBondContact O-CZ 3.35Å
561	M	83.9	Confident	84.4	Confident	66 Å²	66	36.3 Å²	36.3	33%	0.325	18%	0.183	S	C	.	.	H	α-helix	trans	-62.3	-33.1	175	-71.8	-170.8	73.1	0	0	113.2	I508 A524 G557 W558 R563	I508-M561 HydrophobicContact CD1-CE 3.9Å; I508-M561 HydrophobicContact CG2-CE 3.94Å; A524-M561 HydrophobicContact CB-CB 3.86Å; G557-M561 WeakPolarHBondContact O-CG 3.26Å; G557-M561 PolarHBondContact O-N 3.45Å; W558-M561 HydrophobicContact CE3-SD 4.03Å; W558-M561 HydrophobicContact CZ3-CE 4.46Å; W558-M561 HydrophobicContact CZ3-SD 3.88Å; W558-M561 PolarHBondContact O-N 2.96Å; M561-R563 VanDerWaalsContact C-N 3.3Å
562	A	84.1	Confident	84.8	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.008	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-9.1	177.5	0	0	0	0	0	114.5	A524 K525 W558 A559 L560 D564	A524-A562 HydrophobicContact CB-CB 3.82Å; K525-A562 HydrophobicContact CB-CB 4.36Å; K525-A562 HydrophobicContact CG-CB 3.51Å; W558-A562 WeakPolarHBondContact O-CB 3.03Å; W558-A562 PolarHBondContact O-N 3.26Å; A559-A562 CarbonylContact O-C 3.59Å; A559-A562 PolarHBondContact O-N 3.48Å; L560-A562 VanDerWaalsContact C-N 3.25Å; L560-A562 PolarHBondContact O-N 3.41Å; A562-D564 HydrophobicContact CB-CB 4.28Å; A562-D564 PolarHBondContact O-N 3.22Å
563	R	83.3	Confident	84.7	Confident	118 Å²	118	37.1 Å²	37.1	45%	0.445	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	32.9	-169	-57.8	-177	172.5	-150.2	-7.4	112.7	E521 A559 L560 M561 Y565 E627	E521-R563 IonicContact OE1-NE 3.92Å; A559-R563 PolarHBondContact O-N 3.34Å; A559-R563 VanDerWaalsContact O-N 3.08Å; L560-R563 PolarHBondContact O-N 3.26Å; L560-R563 VanDerWaalsContact O-N 3.14Å; M561-R563 VanDerWaalsContact C-N 3.3Å; R563-Y565 PolarHBondContact O-N 2.9Å; R563-E627 IonicContact CZ-OE1 2.63Å; R563-E627 IonicContact NH1-OE1 3.68Å; R563-E627 PolarHBondContact NH1-OE1 2.91Å; R563-E627 IonicContact NH2-OE1 4Å; R563-E627 PolarHBondContact NH2-OE1 3.33Å; R563-E627 VanDerWaalsContact NH2-OE1 3.15Å
564	D	84.6	Confident	84.5	Confident	37 Å²	37	37.8 Å²	37.8	20%	0.198	18%	0.184	C	C	.	.			trans	-92	81.1	178.3	-170.4	-14.9	0	0	0	111	A559 A562 S566 M567 I568	A559-D564 PolarHBondContact O-N 3.45Å; A562-D564 HydrophobicContact CB-CB 4.28Å; A562-D564 PolarHBondContact O-N 3.22Å; D564-S566 PolarHBondContact O-N 2.77Å; D564-S566 PolarHBondContact OD1-N 3.13Å; D564-S566 PolarHBondContact OD1-OG 2.94Å; D564-M567 HydrophobicContact CB-CB 4.21Å; D564-M567 PolarHBondContact O-N 2.96Å; D564-M567 PolarHBondContact OD1-N 3.37Å; D564-I568 WeakPolarHBondContact O-CG1 3.41Å; D564-I568 PolarHBondContact O-N 3.33Å; D564-I568 VanDerWaalsContact O-N 3.08Å
565	Y	82.9	Confident	84.3	Confident	85 Å²	85	35.2 Å²	35.2	33%	0.333	17%	0.172	S	C	.	.	H	α-helix	trans	-60.9	-30.6	-177.9	-54.4	-66.1	0	0	0	113.6	R563 I568 N569 L631	R563-Y565 PolarHBondContact O-N 2.9Å; Y565-I568 HydrophobicContact CD1-CD1 4.16Å; Y565-I568 PolarHBondContact O-N 3.46Å; Y565-N569 WeakPolarHBondContact O-CB 3.39Å; Y565-N569 VanDerWaalsContact O-CG 3.22Å; Y565-N569 PolarHBondContact O-N 3.18Å; Y565-N569 PolarHBondContact O-ND2 3.39Å; Y565-L631 HydrophobicContact CD1-CD2 3.6Å; Y565-L631 HydrophobicContact CD1-CG 4.45Å; Y565-L631 HydrophobicContact CE1-CD2 3.58Å; Y565-L631 HydrophobicContact CE1-CG 4.04Å
566	S	83.4	Confident	84	Confident	87 Å²	87	35.4 Å²	35.4	61%	0.608	17%	0.172	S	C	*	.	H	α-helix	trans	-65.2	-42.5	178.5	75.4	0	0	0	0	111.3	D564 R570	D564-S566 PolarHBondContact O-N 2.77Å; D564-S566 PolarHBondContact OD1-N 3.13Å; D564-S566 PolarHBondContact OD1-OG 2.94Å; S566-R570 WeakPolarHBondContact O-CB 3.3Å; S566-R570 PolarHBondContact O-N 2.96Å; S566-R570 VanDerWaalsContact O-N 3.09Å
567	M	84.5	Confident	83.3	Confident	42 Å²	42	38.6 Å²	38.6	21%	0.207	20%	0.199	C	C	.	.	H	α-helix	trans	-71.3	-38.9	177.4	-171.5	63.5	75.7	0	0	111.7	A532 A559 D564 R570 L571	A532-M567 HydrophobicContact CB-CE 4.2Å; A532-M567 HydrophobicContact CB-SD 4.05Å; A559-M567 HydrophobicContact CB-CB 4.34Å; A559-M567 HydrophobicContact CB-CG 4.27Å; D564-M567 HydrophobicContact CB-CB 4.21Å; D564-M567 PolarHBondContact O-N 2.96Å; D564-M567 PolarHBondContact OD1-N 3.37Å; M567-R570 PolarHBondContact O-N 3.08Å; M567-L571 HydrophobicContact CG-CD1 3.89Å; M567-L571 HydrophobicContact CG-CG 4.35Å; M567-L571 WeakPolarHBondContact O-CB 3.33Å; M567-L571 VanDerWaalsContact O-CG 3.29Å; M567-L571 WeakPolarHBondContact O-CG 3.42Å; M567-L571 PolarHBondContact O-N 3.14Å; M567-L571 HydrophobicContact SD-CD1 4.4Å; M567-L571 HydrophobicContact SD-CG 4.36Å
568	I	85.5	Confident	82.5	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-58.6	-50.9	175.9	-64.1	162.9	0	0	0	110.2	A559 L560 D564 Y565 R570 L571 A572 L637	A559-I568 HydrophobicContact CB-CD1 4.46Å; A559-I568 HydrophobicContact CB-CG1 3.57Å; L560-I568 HydrophobicContact CD2-CD1 3.6Å; L560-I568 HydrophobicContact CD2-CG1 4.37Å; L560-I568 HydrophobicContact CG-CD1 4Å; L560-I568 HydrophobicContact CG-CG1 4.37Å; D564-I568 WeakPolarHBondContact O-CG1 3.41Å; D564-I568 PolarHBondContact O-N 3.33Å; D564-I568 VanDerWaalsContact O-N 3.08Å; Y565-I568 HydrophobicContact CD1-CD1 4.16Å; Y565-I568 PolarHBondContact O-N 3.46Å; I568-R570 VanDerWaalsContact C-N 3.3Å; I568-R570 PolarHBondContact O-N 3.44Å; I568-L571 PolarHBondContact O-N 3.3Å; I568-A572 WeakPolarHBondContact O-CB 3.46Å; I568-A572 PolarHBondContact O-N 3.25Å; I568-L637 HydrophobicContact CG2-CD1 3.75Å
569	N	82.7	Confident	81.5	Confident	37 Å²	37	39.5 Å²	39.5	20%	0.198	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-44.3	178.9	-70	-18.4	0	0	0	111	Y565 L571 A572 E573 S634	Y565-N569 WeakPolarHBondContact O-CB 3.39Å; Y565-N569 VanDerWaalsContact O-CG 3.22Å; Y565-N569 PolarHBondContact O-N 3.18Å; Y565-N569 PolarHBondContact O-ND2 3.39Å; N569-L571 PolarHBondContact O-N 3.42Å; N569-A572 PolarHBondContact O-N 2.89Å; N569-E573 WeakPolarHBondContact O-CG 3.45Å; N569-E573 PolarHBondContact O-N 3.46Å; N569-S634 VanDerWaalsContact OD1-CB 3.27Å; N569-S634 WeakPolarHBondContact OD1-CB 3.23Å; N569-S634 PolarHBondContact OD1-OG 3.47Å
570	R	83.5	Confident	80	Confident	127 Å²	127	45 Å²	45	48%	0.479	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-40.7	179	-174.5	54.6	176.3	172.7	-0.1	113	S566 M567 I568 E573 L574	S566-R570 WeakPolarHBondContact O-CB 3.3Å; S566-R570 PolarHBondContact O-N 2.96Å; S566-R570 VanDerWaalsContact O-N 3.09Å; M567-R570 PolarHBondContact O-N 3.08Å; I568-R570 VanDerWaalsContact C-N 3.3Å; I568-R570 PolarHBondContact O-N 3.44Å; R570-E573 IonicContact NH1-OE2 3.74Å; R570-E573 PolarHBondContact NH1-OE2 3.43Å; R570-L574 HydrophobicContact CG-CD1 4.22Å; R570-L574 WeakPolarHBondContact O-CB 3.3Å; R570-L574 WeakPolarHBondContact O-CD1 3.46Å; R570-L574 VanDerWaalsContact O-CG 3.23Å; R570-L574 WeakPolarHBondContact O-CG 3.48Å; R570-L574 PolarHBondContact O-N 3.18Å; R570-L574 VanDerWaalsContact O-N 3.09Å
571	L	84.9	Confident	78.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-71	-37.3	177.9	-70.3	169.2	0	0	0	111.7	I552 V556 M567 I568 N569 L574 S575	I552-L571 HydrophobicContact CG2-CB 4.47Å; V556-L571 HydrophobicContact CB-CD1 4.46Å; V556-L571 HydrophobicContact CG2-CB 3.43Å; V556-L571 VanDerWaalsContact CG2-CB 3.43Å; V556-L571 HydrophobicContact CG2-CD1 3.51Å; V556-L571 HydrophobicContact CG2-CG 4.09Å; M567-L571 HydrophobicContact CG-CD1 3.89Å; M567-L571 HydrophobicContact CG-CG 4.35Å; M567-L571 WeakPolarHBondContact O-CB 3.33Å; M567-L571 VanDerWaalsContact O-CG 3.29Å; M567-L571 WeakPolarHBondContact O-CG 3.42Å; M567-L571 PolarHBondContact O-N 3.14Å; M567-L571 HydrophobicContact SD-CD1 4.4Å; M567-L571 HydrophobicContact SD-CG 4.36Å; I568-L571 PolarHBondContact O-N 3.3Å; N569-L571 PolarHBondContact O-N 3.42Å; L571-L574 PolarHBondContact O-N 2.96Å; L571-S575 WeakPolarHBondContact O-CB 3.49Å; L571-S575 PolarHBondContact O-N 3.38Å
572	A	83.6	Confident	76.6	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-48.6	173.3	0	0	0	0	0	111.8	I568 N569 L574 S575 L576 E636 L640	I568-A572 WeakPolarHBondContact O-CB 3.46Å; I568-A572 PolarHBondContact O-N 3.25Å; N569-A572 PolarHBondContact O-N 2.89Å; A572-L574 VanDerWaalsContact C-N 3.32Å; A572-L574 PolarHBondContact O-N 2.88Å; A572-S575 PolarHBondContact O-N 3.48Å; A572-L576 WeakPolarHBondContact O-CB 3.44Å; A572-L576 WeakPolarHBondContact O-CG 3.45Å; A572-L576 PolarHBondContact O-N 3.45Å; A572-E636 HydrophobicContact CB-CB 4.35Å; A572-L640 HydrophobicContact CB-CD1 3.59Å
573	E	80.3	Confident	74.4	Confident	72 Å²	72	54.9 Å²	54.9	34%	0.336	28%	0.275	S	S	.	.	H	α-helix	trans	-54.9	-47.2	173.4	-76.6	173.2	-169.2	0	0	111.7	N569 R570 A577 E636	N569-E573 WeakPolarHBondContact O-CG 3.45Å; N569-E573 PolarHBondContact O-N 3.46Å; R570-E573 IonicContact NH1-OE2 3.74Å; R570-E573 PolarHBondContact NH1-OE2 3.43Å; E573-A577 WeakPolarHBondContact O-CB 3.39Å; E573-A577 PolarHBondContact O-N 3.27Å; E573-E636 HydrophobicContact CG-CG 3.91Å
574	L	79.7	Confident	72.1	Confident	21 Å²	21	58.3 Å²	58.3	11%	0.11	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-41.6	-178.5	-75.9	167.4	0	0	0	112.5	L536 R570 L571 A572 R578	L536-L574 HydrophobicContact CD2-CD1 3.49Å; L536-L574 VanDerWaalsContact CD2-CD1 3.49Å; R570-L574 HydrophobicContact CG-CD1 4.22Å; R570-L574 WeakPolarHBondContact O-CB 3.3Å; R570-L574 WeakPolarHBondContact O-CD1 3.46Å; R570-L574 VanDerWaalsContact O-CG 3.23Å; R570-L574 WeakPolarHBondContact O-CG 3.48Å; R570-L574 PolarHBondContact O-N 3.18Å; R570-L574 VanDerWaalsContact O-N 3.09Å; L571-L574 PolarHBondContact O-N 2.96Å; A572-L574 VanDerWaalsContact C-N 3.32Å; A572-L574 PolarHBondContact O-N 2.88Å; L574-R578 WeakPolarHBondContact O-CB 3.49Å; L574-R578 WeakPolarHBondContact O-CG 3.15Å; L574-R578 PolarHBondContact O-N 3.04Å
575	S	80.6	Confident	69.7	Low	2 Å²	2	65.3 Å²	65.3	1%	0.014	32%	0.317	C	S	.	.	H	α-helix	trans	-67.2	-46.8	178.8	-165.5	0	0	0	0	111.1	L571 A572 A577 R578 D579 E599	L571-S575 WeakPolarHBondContact O-CB 3.49Å; L571-S575 PolarHBondContact O-N 3.38Å; A572-S575 PolarHBondContact O-N 3.48Å; S575-A577 VanDerWaalsContact C-N 3.34Å; S575-A577 PolarHBondContact O-N 3.49Å; S575-R578 PolarHBondContact O-N 2.89Å; S575-D579 PolarHBondContact O-N 3.28Å; S575-E599 WeakPolarHBondContact CB-OE1 3.46Å; S575-E599 PolarHBondContact OG-OE1 3.08Å
576	L	78.8	Confident	67	Low	3 Å²	3	67.8 Å²	67.8	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-61.7	-41.1	176	-69.8	173.9	0	0	0	111.6	A572 R578 D579 V600 E636 F639 L640 P697 L700	A572-L576 WeakPolarHBondContact O-CB 3.44Å; A572-L576 WeakPolarHBondContact O-CG 3.45Å; A572-L576 PolarHBondContact O-N 3.45Å; L576-R578 VanDerWaalsContact C-N 3.31Å; L576-R578 PolarHBondContact O-N 2.78Å; L576-D579 PolarHBondContact O-N 3.29Å; L576-V600 HydrophobicContact CD2-CG1 4.07Å; L576-E636 HydrophobicContact CD1-CB 3.89Å; L576-E636 HydrophobicContact CD1-CG 4.12Å; L576-F639 HydrophobicContact CD1-CD1 4.19Å; L576-F639 HydrophobicContact CD2-CD1 3.79Å; L576-F639 HydrophobicContact CD2-CE1 3.68Å; L576-L640 HydrophobicContact CD1-CG 4.5Å; L576-L640 HydrophobicContact CD2-CD2 4Å; L576-L640 HydrophobicContact CG-CD2 4.44Å; L576-P697 WeakPolarHBondContact O-CG 3.45Å; L576-L700 HydrophobicContact CD2-CD2 3.76Å
577	A	74.5	Confident	64.2	Low	68 Å²	68	68.7 Å²	68.7	56%	0.562	33%	0.333	S	S	*	.	H	α-helix	trans	-69.7	-25.3	177.9	0	0	0	0	0	113.8	E573 S575	E573-A577 WeakPolarHBondContact O-CB 3.39Å; E573-A577 PolarHBondContact O-N 3.27Å; S575-A577 VanDerWaalsContact C-N 3.34Å; S575-A577 PolarHBondContact O-N 3.49Å
578	R	69.7	Low	61.5	Low	50 Å²	50	74 Å²	74	19%	0.189	36%	0.362	C	S	.	.	H	α-helix	trans	-83.4	-14	178.1	-78.8	176.2	179.5	-164.8	0.4	113.6	S535 S538 L574 S575 L576 N580	S535-R578 PolarHBondContact O-NH1 3.01Å; S535-R578 PolarHBondContact O-NH2 2.8Å; S538-R578 PolarHBondContact OG-NH1 3.4Å; S538-R578 PolarHBondContact OG-NH2 2.88Å; L574-R578 WeakPolarHBondContact O-CB 3.49Å; L574-R578 WeakPolarHBondContact O-CG 3.15Å; L574-R578 PolarHBondContact O-N 3.04Å; S575-R578 PolarHBondContact O-N 2.89Å; L576-R578 VanDerWaalsContact C-N 3.31Å; L576-R578 PolarHBondContact O-N 2.78Å; R578-N580 PolarHBondContact O-N 3.22Å
579	D	68	Low	58.7	Low	5 Å²	5	80.9 Å²	80.9	3%	0.027	40%	0.398	C	S	.	.			trans	-70.1	95.4	-179.3	-166.7	5.5	0	0	0	110.9	S575 L576 V600 R703	S575-D579 PolarHBondContact O-N 3.28Å; L576-D579 PolarHBondContact O-N 3.29Å; D579-V600 HydrophobicContact CB-CG2 4.01Å; D579-R703 IonicContact OD2-CZ 3.56Å; D579-R703 IonicContact OD2-NH1 3.04Å; D579-R703 IonicContact OD2-NH2 3.63Å; D579-R703 PolarHBondContact OD2-NH2 3.32Å
580	N	55.9	Low	56.1	Low	115 Å²	115	87.5 Å²	87.5	62%	0.615	43%	0.428	S	S	*	.			trans	-85.3	-4.9	-172.8	-79.4	-31.9	0	0	0	114.9	R578 R699	R578-N580 PolarHBondContact O-N 3.22Å; N580-R699 WeakPolarHBondContact O-CD 3.28Å; N580-R699 PolarHBondContact O-NH1 3.4Å
581	G	51.3	Low	53.5	Low	19 Å²	19	88 Å²	88	20%	0.196	45%	0.446	C	S	.	.			trans	61.3	130.4	167.8	0	0	0	0	0	118.4
582	F	47.1	Very low	50.9	Low	115 Å²	115	94.3 Å²	94.3	50%	0.504	48%	0.484	S	S	.	.			trans	55.8	97.2	173.2	-82.5	-85	0	0	0	117.3	R703 A706 M749 L752	F582-R703 HydrophobicContact CE2-CB 4.12Å; F582-R703 HydrophobicContact CE2-CG 4.44Å; F582-A706 HydrophobicContact CZ-CB 4.13Å; F582-M749 HydrophobicContact CD2-CE 4.13Å; F582-M749 HydrophobicContact CD2-SD 4.14Å; F582-L752 HydrophobicContact CE1-CD2 4.46Å; F582-L752 HydrophobicContact CE2-CD2 4.19Å; F582-L752 HydrophobicContact CZ-CD2 3.94Å
583	M	37.2	Very low	48.6	Very low	147 Å²	147	101.9 Å²	101.9	72%	0.724	52%	0.523	S	S	*	.			trans	-89	125	161.3	-81.2	-68.7	-81.6	0	0	110.5	K585	M583-K585 PolarHBondContact O-N 2.72Å
584	R	36	Very low	46.7	Very low	189 Å²	189	101.2 Å²	101.2	71%	0.713	53%	0.527	S	S	*	.			trans	-49.6	99.2	170.4	-161	-173.6	-141	-169.2	3.7	110.6	E586	R584-E586 PolarHBondContact O-N 2.81Å; R584-E586 VanDerWaalsContact O-N 3.09Å
585	K	33.4	Very low	45.2	Very low	185 Å²	185	105.8 Å²	105.8	80%	0.804	55%	0.547	S	S	*	.			trans	-76.6	87.6	157.4	-100	-176	176.5	177.2	0	106.2	M583	M583-K585 PolarHBondContact O-N 2.72Å
586	E	25.8	Very low	43.6	Very low	136 Å²	136	107.8 Å²	107.8	64%	0.636	56%	0.564	S	S	*	*			trans	157.9	86.9	155.8	-89.5	169.4	-162.3	0	0	108	R584	R584-E586 PolarHBondContact O-N 2.81Å; R584-E586 VanDerWaalsContact O-N 3.09Å
587	T	26.5	Very low	42.5	Very low	107 Å²	107	110.7 Å²	110.7	66%	0.656	58%	0.584	S	S	*	*	S	Bend		169.7	115.2	123.7	33.1	0	0	0	0	109.9
588	L	26.5	Very low	42.2	Very low	154 Å²	154	110.5 Å²	110.5	81%	0.806	58%	0.576	S	S	*	*	S	Bend	trans	78.8	108	160.7	-65.5	138.3	0	0	0	119
589	N	26.6	Very low	42.5	Very low	144 Å²	144	109.2 Å²	109.2	77%	0.77	57%	0.572	S	S	*	*			trans	64.3	111	149.6	-62.6	-3	0	0	0	120.2
590	E	29.2	Very low	43.1	Very low	176 Å²	176	109 Å²	109	82%	0.822	57%	0.571	S	S	*	*	S	Bend	trans	35.6	126.9	135.4	-74.6	-178.7	168.7	0	0	120.5
591	T	28.7	Very low	44.2	Very low	139 Å²	139	104.5 Å²	104.5	85%	0.853	55%	0.55	S	S	*	*			trans	95.8	17.1	149	63.9	0	0	0	0	123.1
592	T	30.4	Very low	45.7	Very low	133 Å²	133	107.5 Å²	107.5	82%	0.816	56%	0.559	S	S	*	*			trans	-140	87.5	164.5	33.7	0	0	0	0	113.1	S594	T592-S594 PolarHBondContact O-N 3.11Å; T592-S594 VanDerWaalsContact O-N 3.13Å
593	I	35.3	Very low	47.6	Very low	159 Å²	159	102 Å²	102	82%	0.815	54%	0.535	S	S	*	.			trans	-69.9	103.8	164.5	-62	169.2	0	0	0	106.5	H595	I593-H595 PolarHBondContact O-N 2.85Å
594	S	40	Very low	49.9	Very low	59 Å²	59	95 Å²	95	41%	0.413	50%	0.5	S	S	.	.			trans	-70.1	112.2	-178.1	66	0	0	0	0	111.3	T592 A596	T592-S594 PolarHBondContact O-N 3.11Å; T592-S594 VanDerWaalsContact O-N 3.13Å; S594-A596 PolarHBondContact O-N 3.32Å
595	H	47.7	Very low	52.2	Low	117 Å²	117	88.6 Å²	88.6	54%	0.542	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-6.9	-174.5	-70	-86.1	0	0	0	117.5	I593 S597 T598 E599	I593-H595 PolarHBondContact O-N 2.85Å; H595-S597 PolarHBondContact O-N 3.44Å; H595-T598 PolarHBondContact O-OG1 2.93Å; H595-T598 VanDerWaalsContact O-OG1 3.07Å; H595-E599 PolarHBondContact O-N 3.2Å
596	A	47.6	Very low	54.7	Low	44 Å²	44	82.7 Å²	82.7	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-70.2	-30.9	-169.9	0	0	0	0	0	114.6	S594	S594-A596 PolarHBondContact O-N 3.32Å
597	S	54.9	Low	57.5	Low	63 Å²	63	76.2 Å²	76.2	44%	0.441	43%	0.434	S	S	.	.	H	α-helix	trans	-78.1	-24.3	-177	68.2	0	0	0	0	114.2	H595 R703	H595-S597 PolarHBondContact O-N 3.44Å; S597-R703 PolarHBondContact O-NH1 2.91Å
598	T	68.6	Low	60.3	Low	64 Å²	64	71.9 Å²	71.9	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-84.3	-25.1	176.4	52.7	0	0	0	0	112	H595 V600 A601 E602	H595-T598 PolarHBondContact O-OG1 2.93Å; H595-T598 VanDerWaalsContact O-OG1 3.07Å; T598-V600 PolarHBondContact O-N 2.99Å; T598-A601 WeakPolarHBondContact O-CB 3.48Å; T598-A601 PolarHBondContact O-N 3.06Å; T598-E602 WeakPolarHBondContact O-CB 3.39Å; T598-E602 WeakPolarHBondContact O-CG 3.42Å; T598-E602 PolarHBondContact O-N 2.95Å
599	E	76.4	Confident	62.9	Low	24 Å²	24	66.6 Å²	66.6	11%	0.112	39%	0.389	C	S	.	.	H	α-helix	trans	-60.3	-46.9	-178.7	-170.1	-178	113.7	0	0	112.8	S550 I552 S575 H595 A601 E602 L603	S550-E599 WeakPolarHBondContact OG-CG 3.16Å; S550-E599 PolarHBondContact OG-OE2 2.82Å; I552-E599 WeakPolarHBondContact CD1-OE1 3.26Å; S575-E599 WeakPolarHBondContact CB-OE1 3.46Å; S575-E599 PolarHBondContact OG-OE1 3.08Å; H595-E599 PolarHBondContact O-N 3.2Å; E599-A601 VanDerWaalsContact C-N 3.3Å; E599-A601 PolarHBondContact O-N 2.78Å; E599-E602 PolarHBondContact O-N 2.7Å; E599-L603 VanDerWaalsContact O-CB 3.22Å; E599-L603 WeakPolarHBondContact O-CB 3.4Å; E599-L603 PolarHBondContact O-N 3.5Å
600	V	80	Confident	65.4	Low	1 Å²	1	63.9 Å²	63.9	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-39.2	179.1	177.4	0	0	0	0	111.3	L576 D579 T598 A604 L640 Y643	L576-V600 HydrophobicContact CD2-CG1 4.07Å; D579-V600 HydrophobicContact CB-CG2 4.01Å; T598-V600 PolarHBondContact O-N 2.99Å; V600-A604 WeakPolarHBondContact O-CB 3.44Å; V600-A604 PolarHBondContact O-N 2.84Å; V600-L640 HydrophobicContact CG1-CD2 3.87Å; V600-Y643 HydrophobicContact CG1-CD1 4.19Å; V600-Y643 HydrophobicContact CG1-CE1 4.04Å
601	A	80.1	Confident	67.6	Low	20 Å²	20	56.6 Å²	56.6	17%	0.165	34%	0.339	C	S	.	.	H	α-helix	trans	-65.4	-47.7	176	0	0	0	0	0	112	T598 E599 A604 A605 Y643	T598-A601 WeakPolarHBondContact O-CB 3.48Å; T598-A601 PolarHBondContact O-N 3.06Å; E599-A601 VanDerWaalsContact C-N 3.3Å; E599-A601 PolarHBondContact O-N 2.78Å; A601-A604 PolarHBondContact O-N 3.09Å; A601-A605 WeakPolarHBondContact O-CB 3.32Å; A601-A605 PolarHBondContact O-N 3.34Å; A601-Y643 HydrophobicContact CB-CE1 4.27Å
602	E	81.9	Confident	69.7	Low	82 Å²	82	55.1 Å²	55.1	38%	0.383	32%	0.318	S	S	.	.	H	α-helix	trans	-63.2	-43.7	177.8	-73.6	173.6	-162.9	0	0	111.4	T598 E599 A605 I606	T598-E602 WeakPolarHBondContact O-CB 3.39Å; T598-E602 WeakPolarHBondContact O-CG 3.42Å; T598-E602 PolarHBondContact O-N 2.95Å; E599-E602 PolarHBondContact O-N 2.7Å; E602-A605 PolarHBondContact O-N 2.83Å; E602-I606 WeakPolarHBondContact O-CD1 3.35Å; E602-I606 WeakPolarHBondContact O-CG1 3.5Å; E602-I606 PolarHBondContact O-N 3.39Å
603	L	87	Confident	70.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.9	-48.6	176.4	-161.9	74.4	0	0	0	111.3	I552 V556 E599 A605 I606 I607 L640	I552-L603 HydrophobicContact CG2-CD1 3.98Å; V556-L603 HydrophobicContact CB-CD1 3.68Å; V556-L603 HydrophobicContact CG1-CD1 3.96Å; V556-L603 HydrophobicContact CG2-CD1 3.49Å; V556-L603 VanDerWaalsContact CG2-CD1 3.49Å; E599-L603 VanDerWaalsContact O-CB 3.22Å; E599-L603 WeakPolarHBondContact O-CB 3.4Å; E599-L603 PolarHBondContact O-N 3.5Å; L603-A605 PolarHBondContact O-N 2.91Å; L603-I606 PolarHBondContact O-N 3.34Å; L603-I607 HydrophobicContact CD2-CD1 4.49Å; L603-I607 HydrophobicContact CG-CD1 4Å; L603-I607 WeakPolarHBondContact O-CD1 3.41Å; L603-I607 VanDerWaalsContact O-CG1 3.3Å; L603-I607 WeakPolarHBondContact O-CG1 3.22Å; L603-I607 PolarHBondContact O-N 3.02Å; L603-L640 HydrophobicContact CD2-CD1 3.72Å; L603-L640 HydrophobicContact CD2-CD2 4.43Å; L603-L640 HydrophobicContact CG-CD1 4.4Å
604	A	85	Confident	71.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-45.5	178.1	0	0	0	0	0	111.2	V600 A601 I607 L608 L640 Y643 A644	V600-A604 WeakPolarHBondContact O-CB 3.44Å; V600-A604 PolarHBondContact O-N 2.84Å; A601-A604 PolarHBondContact O-N 3.09Å; A604-I607 PolarHBondContact O-N 3.08Å; A604-L608 WeakPolarHBondContact O-CB 3.41Å; A604-L608 PolarHBondContact O-N 2.92Å; A604-L640 HydrophobicContact CB-CB 4.34Å; A604-L640 HydrophobicContact CB-CD2 4.15Å; A604-L640 VanDerWaalsContact CB-O 3.32Å; A604-L640 WeakPolarHBondContact CB-O 3.5Å; A604-Y643 HydrophobicContact CB-CD1 3.79Å; A604-A644 HydrophobicContact CB-CB 3.87Å; A604-A644 WeakPolarHBondContact O-CB 3.11Å
605	A	84.8	Confident	71.7	Confident	53 Å²	53	47 Å²	47	44%	0.438	29%	0.287	S	S	.	.	H	α-helix	trans	-62.7	-42.4	176.9	0	0	0	0	0	112.6	A601 E602 L603 G609	A601-A605 WeakPolarHBondContact O-CB 3.32Å; A601-A605 PolarHBondContact O-N 3.34Å; E602-A605 PolarHBondContact O-N 2.83Å; L603-A605 PolarHBondContact O-N 2.91Å; A605-G609 PolarHBondContact O-N 2.89Å
606	I	85.5	Confident	71.2	Confident	61 Å²	61	50.8 Å²	50.8	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-61.2	-47.4	176.8	-70.2	163.2	0	0	0	110.8	C553 L560 E602 L603 G609 F610	C553-I606 HydrophobicContact CB-CD1 3.79Å; L560-I606 HydrophobicContact CD1-CG2 3.86Å; E602-I606 WeakPolarHBondContact O-CD1 3.35Å; E602-I606 WeakPolarHBondContact O-CG1 3.5Å; E602-I606 PolarHBondContact O-N 3.39Å; L603-I606 PolarHBondContact O-N 3.34Å; I606-G609 PolarHBondContact O-N 3.46Å; I606-F610 PolarHBondContact O-N 2.98Å
607	I	85.8	Confident	70.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-63.3	-48.6	-179.8	-68.9	160	0	0	0	110.5	V556 L560 L603 A604 G609 F610 C611 L637 L640 I641	V556-I607 HydrophobicContact CG1-CD1 4.4Å; V556-I607 HydrophobicContact CG1-CG1 4.03Å; L560-I607 HydrophobicContact CD1-CG1 4.28Å; L603-I607 HydrophobicContact CD2-CD1 4.49Å; L603-I607 HydrophobicContact CG-CD1 4Å; L603-I607 WeakPolarHBondContact O-CD1 3.41Å; L603-I607 VanDerWaalsContact O-CG1 3.3Å; L603-I607 WeakPolarHBondContact O-CG1 3.22Å; L603-I607 PolarHBondContact O-N 3.02Å; A604-I607 PolarHBondContact O-N 3.08Å; I607-G609 VanDerWaalsContact C-N 3.32Å; I607-G609 PolarHBondContact O-N 3.43Å; I607-F610 PolarHBondContact O-N 3.32Å; I607-C611 PolarHBondContact O-N 3.19Å; I607-C611 PolarHBondContact O-SG 3.5Å; I607-C611 VanDerWaalsContact O-SG 3.34Å; I607-L637 HydrophobicContact CD1-CD1 3.72Å; I607-L637 HydrophobicContact CG1-CD1 4.22Å; I607-L637 HydrophobicContact CG2-CD1 3.76Å; I607-L637 HydrophobicContact CG2-CG 4.23Å; I607-L640 HydrophobicContact CD1-CB 4.22Å; I607-L640 HydrophobicContact CD1-CD1 3.61Å; I607-I641 HydrophobicContact CG2-CD1 4.27Å; I607-I641 HydrophobicContact CG2-CG1 3.79Å
608	L	83.6	Confident	69.4	Low	15 Å²	15	59.5 Å²	59.5	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-61.2	-42.5	178.3	-177.6	67.5	0	0	0	111.5	A604 F610 C611 R612 I641 A644 E645	A604-L608 WeakPolarHBondContact O-CB 3.41Å; A604-L608 PolarHBondContact O-N 2.92Å; L608-F610 VanDerWaalsContact C-N 3.31Å; L608-F610 PolarHBondContact O-N 3.35Å; L608-C611 PolarHBondContact O-N 2.97Å; L608-R612 PolarHBondContact O-N 3.47Å; L608-I641 HydrophobicContact CD1-CG2 4.13Å; L608-A644 HydrophobicContact CB-CB 3.68Å; L608-A644 HydrophobicContact CD2-CB 3.54Å; L608-A644 HydrophobicContact CG-CB 4.17Å; L608-E645 HydrophobicContact CD1-CG 4.01Å; L608-E645 HydrophobicContact CD2-CG 4.15Å
609	G	81.3	Confident	67.6	Low	43 Å²	43	63.2 Å²	63.2	44%	0.443	35%	0.354	S	S	.	.	H	α-helix	trans	-58.4	-41.8	176.2	0	0	0	0	0	112.4	A605 I606 I607 R612 G613	A605-G609 PolarHBondContact O-N 2.89Å; I606-G609 PolarHBondContact O-N 3.46Å; I607-G609 VanDerWaalsContact C-N 3.32Å; I607-G609 PolarHBondContact O-N 3.43Å; G609-R612 PolarHBondContact O-N 2.92Å; G609-G613 PolarHBondContact O-N 3.35Å
610	F	79.3	Confident	65.5	Low	88 Å²	88	66 Å²	66	39%	0.386	38%	0.376	S	S	.	.	H	α-helix	trans	-66.8	-44	175.9	-169.7	-92.3	0	0	0	112.4	L560 I606 I607 L608 R612 G613 S614	L560-F610 HydrophobicContact CB-CD1 4.28Å; L560-F610 HydrophobicContact CB-CD2 3.84Å; L560-F610 HydrophobicContact CB-CE1 4.35Å; L560-F610 HydrophobicContact CB-CE2 3.93Å; L560-F610 HydrophobicContact CB-CG 4.01Å; L560-F610 HydrophobicContact CB-CZ 4.18Å; L560-F610 HydrophobicContact CD1-CB 4Å; L560-F610 HydrophobicContact CD1-CG 4.22Å; L560-F610 HydrophobicContact CD2-CB 4.32Å; L560-F610 HydrophobicContact CD2-CD1 3.75Å; L560-F610 HydrophobicContact CD2-CE1 4.2Å; L560-F610 HydrophobicContact CD2-CG 4.01Å; L560-F610 HydrophobicContact CG-CD1 4.48Å; L560-F610 HydrophobicContact CG-CG 4.32Å; L560-F610 VanDerWaalsContact O-CZ 3.29Å; L560-F610 WeakPolarHBondContact O-CZ 3.35Å; I606-F610 PolarHBondContact O-N 2.98Å; I607-F610 PolarHBondContact O-N 3.32Å; L608-F610 VanDerWaalsContact C-N 3.31Å; L608-F610 PolarHBondContact O-N 3.35Å; F610-R612 VanDerWaalsContact C-N 3.27Å; F610-R612 PolarHBondContact O-N 3.15Å; F610-G613 PolarHBondContact O-N 3.09Å; F610-S614 PolarHBondContact O-N 3.38Å
611	C	75.8	Confident	63.3	Low	23 Å²	23	71.9 Å²	71.9	16%	0.155	41%	0.407	C	S	.	.	H	α-helix	trans	-61.7	-32.8	176.9	-67.5	0	0	0	0	112.9	I607 L608 S614	I607-C611 PolarHBondContact O-N 3.19Å; I607-C611 PolarHBondContact O-SG 3.5Å; I607-C611 VanDerWaalsContact O-SG 3.34Å; L608-C611 PolarHBondContact O-N 2.97Å; C611-S614 PolarHBondContact O-OG 3.01Å
612	R	71.9	Confident	61.1	Low	107 Å²	107	78.9 Å²	78.9	40%	0.404	44%	0.442	S	S	.	.	H	α-helix	trans	-81	-36.3	175.2	-70	-176.9	178.1	176.5	4.5	112.7	L608 G609 F610 S614 S615	L608-R612 PolarHBondContact O-N 3.47Å; G609-R612 PolarHBondContact O-N 2.92Å; F610-R612 VanDerWaalsContact C-N 3.27Å; F610-R612 PolarHBondContact O-N 3.15Å; R612-S614 VanDerWaalsContact C-N 3.28Å; R612-S614 PolarHBondContact O-N 2.94Å; R612-S615 PolarHBondContact O-N 3.44Å; R612-S615 PolarHBondContact O-OG 3.2Å
613	G	55.4	Low	59	Low	41 Å²	41	81.6 Å²	81.6	42%	0.423	46%	0.459	S	S	.	.	H	α-helix	trans	-62.2	-29	-178.1	0	0	0	0	0	114.4	G609 F610 S615 Y616	G609-G613 PolarHBondContact O-N 3.35Å; F610-G613 PolarHBondContact O-N 3.09Å; G613-S615 PolarHBondContact O-N 2.99Å; G613-Y616 PolarHBondContact O-N 2.81Å
614	S	51.7	Low	56.4	Low	54 Å²	54	87 Å²	87	38%	0.378	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-8.6	177.3	67.4	0	0	0	0	114.3	F610 C611 R612	F610-S614 PolarHBondContact O-N 3.38Å; C611-S614 PolarHBondContact O-OG 3.01Å; R612-S614 VanDerWaalsContact C-N 3.28Å; R612-S614 PolarHBondContact O-N 2.94Å
615	S	40.8	Very low	54	Low	86 Å²	86	93.2 Å²	93.2	60%	0.601	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-11.3	-178.4	66.6	0	0	0	0	115.1	R612 G613	R612-S615 PolarHBondContact O-N 3.44Å; R612-S615 PolarHBondContact O-OG 3.2Å; G613-S615 PolarHBondContact O-N 2.99Å
616	Y	37.8	Very low	51.8	Low	197 Å²	197	95.3 Å²	95.3	77%	0.773	52%	0.524	S	S	*	.	S	Bend	trans	-109.7	-2	-170.1	-77	-78.4	0	0	0	116.5	G613 E618	G613-Y616 PolarHBondContact O-N 2.81Å; Y616-E618 PolarHBondContact O-N 2.89Å
617	D	32.8	Very low	49.6	Very low	133 Å²	133	95.6 Å²	95.6	71%	0.711	52%	0.524	S	S	*	.	S	Bend	trans	-91.5	101.5	173.8	-78.7	-21.4	0	0	0	111.8
618	E	32.9	Very low	47.5	Very low	156 Å²	156	99 Å²	99	73%	0.729	55%	0.545	S	S	*	.			trans	62.9	125.7	168.2	-76.3	-174.5	154	0	0	119.6	Y616 S620	Y616-E618 PolarHBondContact O-N 2.89Å; E618-S620 PolarHBondContact O-N 3.39Å
619	P	30.9	Very low	45.6	Very low	142 Å²	142	104 Å²	104	92%	0.922	57%	0.572	S	S	*	*	S	Bend	trans	-84	53.6	177.9	37.2	-35.1	0	0	0	112.5
620	S	31.9	Very low	43.8	Very low	82 Å²	82	108 Å²	108	57%	0.573	58%	0.578	S	S	*	*			trans	-144.3	64.4	177.7	64.5	0	0	0	0	113.4	E618	E618-S620 PolarHBondContact O-N 3.39Å
621	N	32.5	Very low	42.4	Very low	126 Å²	126	104.9 Å²	104.9	67%	0.674	57%	0.566	S	S	*	*			trans	-178.8	123.2	139.9	-109.9	-30.1	0	0	0	110.5	N623 K624	N621-N623 PolarHBondContact O-N 3.03Å; N621-K624 PolarHBondContact O-N 3.4Å
622	N	35	Very low	41.3	Very low	166 Å²	166	112.5 Å²	112.5	89%	0.888	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	14.4	179.5	-81	-12.6	0	0	0	115.3
623	N	37.9	Very low	40.8	Very low	140 Å²	140	111.7 Å²	111.7	75%	0.749	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	0.8	177.4	-74.5	-11.2	0	0	0	114.1	N621	N621-N623 PolarHBondContact O-N 3.03Å
624	K	32.6	Very low	41.6	Very low	113 Å²	113	110.3 Å²	110.3	49%	0.491	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-92	-6.9	-176.1	-81	-174.1	175.5	179.8	0	116.3	N621 N626 E627	N621-K624 PolarHBondContact O-N 3.4Å; K624-N626 PolarHBondContact O-N 2.81Å; K624-N626 VanDerWaalsContact O-N 3.07Å; K624-E627 PolarHBondContact O-N 3.43Å
625	V	34.3	Very low	42.6	Very low	130 Å²	130	110.5 Å²	110.5	79%	0.788	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-66.7	-9.2	175.5	-177.9	0	0	0	0	112.3
626	N	38.1	Very low	44.3	Very low	97 Å²	97	107.2 Å²	107.2	52%	0.519	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-94.9	-3.3	179	-78	-21.1	0	0	0	115.7	K624 V628 N629 H630	K624-N626 PolarHBondContact O-N 2.81Å; K624-N626 VanDerWaalsContact O-N 3.07Å; N626-V628 PolarHBondContact O-N 3.07Å; N626-N629 WeakPolarHBondContact O-CB 3.48Å; N626-N629 PolarHBondContact O-N 3.04Å; N626-H630 PolarHBondContact O-CD2 3.44Å
627	E	39.8	Very low	46.2	Very low	67 Å²	67	97.9 Å²	97.9	31%	0.313	53%	0.525	S	S	.	.	S	Bend	trans	-75.2	-24.2	-174.5	-77.4	-165.4	132.1	0	0	114.3	R563 K624 N629 H630	R563-E627 IonicContact CZ-OE1 2.63Å; R563-E627 IonicContact NH1-OE1 3.68Å; R563-E627 PolarHBondContact NH1-OE1 2.91Å; R563-E627 IonicContact NH2-OE1 4Å; R563-E627 PolarHBondContact NH2-OE1 3.33Å; R563-E627 VanDerWaalsContact NH2-OE1 3.15Å; K624-E627 PolarHBondContact O-N 3.43Å; E627-N629 VanDerWaalsContact C-N 3.26Å; E627-N629 PolarHBondContact O-N 3.45Å; E627-H630 PolarHBondContact O-N 2.6Å
628	V	40.9	Very low	48.4	Very low	74 Å²	74	93 Å²	93	45%	0.448	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-70.4	-25.2	171.2	-177.3	0	0	0	0	111.5	N626 H630	N626-V628 PolarHBondContact O-N 3.07Å; V628-H630 PolarHBondContact O-N 2.95Å
629	N	44.8	Very low	50.8	Low	119 Å²	119	85.8 Å²	85.8	64%	0.636	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-76.9	-7	179.9	-66.3	-25.6	0	0	0	113.7	N626 E627	N626-N629 WeakPolarHBondContact O-CB 3.48Å; N626-N629 PolarHBondContact O-N 3.04Å; E627-N629 VanDerWaalsContact C-N 3.26Å; E627-N629 PolarHBondContact O-N 3.45Å
630	H	42.2	Very low	53.4	Low	126 Å²	126	79 Å²	79	58%	0.583	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-93.7	-5.7	179.3	-75	-60.6	0	0	0	114.7	N626 E627 V628 Q632	N626-H630 PolarHBondContact O-CD2 3.44Å; E627-H630 PolarHBondContact O-N 2.6Å; V628-H630 PolarHBondContact O-N 2.95Å; H630-Q632 PolarHBondContact O-N 3.1Å; H630-Q632 VanDerWaalsContact O-N 3.08Å
631	L	50.4	Low	55.8	Low	24 Å²	24	76.3 Å²	76.3	13%	0.126	40%	0.404	C	S	.	.	S	Bend	trans	-72.1	100.3	158.5	-77	151	0	0	0	106.1	Y565 L633 L637	Y565-L631 HydrophobicContact CD1-CD2 3.6Å; Y565-L631 HydrophobicContact CD1-CG 4.45Å; Y565-L631 HydrophobicContact CE1-CD2 3.58Å; Y565-L631 HydrophobicContact CE1-CG 4.04Å; L631-L633 HydrophobicContact CB-CG 4.19Å; L631-L633 PolarHBondContact O-N 2.68Å; L631-L637 HydrophobicContact CD2-CD2 3.58Å; L631-L637 HydrophobicContact CG-CD2 4.49Å
632	Q	52.5	Low	58.1	Low	183 Å²	183	73.9 Å²	73.9	86%	0.855	39%	0.385	S	S	*	.			trans	-58.3	88.5	152.4	-89.3	-176.3	-24	0	0	105.3	H630 S634	H630-Q632 PolarHBondContact O-N 3.1Å; H630-Q632 VanDerWaalsContact O-N 3.08Å; Q632-S634 VanDerWaalsContact C-N 3.3Å; Q632-S634 PolarHBondContact O-N 3.2Å
633	L	61.8	Low	60.5	Low	89 Å²	89	66.9 Å²	66.9	47%	0.466	35%	0.347	S	S	.	.			trans	-60.4	99.2	-176.3	-85.8	140.2	0	0	0	106	L631 L637 A638 I641	L631-L633 HydrophobicContact CB-CG 4.19Å; L631-L633 PolarHBondContact O-N 2.68Å; L633-L637 HydrophobicContact CD2-CD2 4.2Å; L633-A638 HydrophobicContact CD2-CB 4.22Å; L633-I641 HydrophobicContact CD2-CD1 3.52Å
634	S	72	Confident	62.7	Low	12 Å²	12	60.5 Å²	60.5	8%	0.084	31%	0.313	C	S	.	.			trans	-56.3	145	166.6	59	0	0	0	0	107	N569 Q632 E636 L637 A638	N569-S634 VanDerWaalsContact OD1-CB 3.27Å; N569-S634 WeakPolarHBondContact OD1-CB 3.23Å; N569-S634 PolarHBondContact OD1-OG 3.47Å; Q632-S634 VanDerWaalsContact C-N 3.3Å; Q632-S634 PolarHBondContact O-N 3.2Å; S634-E636 PolarHBondContact O-N 3.39Å; S634-E636 VanDerWaalsContact O-N 3.11Å; S634-L637 PolarHBondContact O-N 2.98Å; S634-L637 VanDerWaalsContact OG-CB 3.25Å; S634-L637 WeakPolarHBondContact OG-CB 2.95Å; S634-L637 PolarHBondContact OG-N 2.86Å; S634-A638 PolarHBondContact O-N 2.82Å
635	P	73.1	Confident	65.1	Low	59 Å²	59	57.3 Å²	57.3	38%	0.383	30%	0.3	S	S	.	.	H	α-helix	trans	-54.7	-32.2	-179.7	17.5	-26.7	0	0	0	111.5	F639 L694	P635-F639 PolarHBondContact O-N 3.19Å; P635-F639 VanDerWaalsContact O-N 3.15Å; P635-L694 HydrophobicContact CB-CB 4.23Å; P635-L694 HydrophobicContact CB-CD1 3.23Å; P635-L694 HydrophobicContact CB-CG 3.52Å; P635-L694 HydrophobicContact CG-CG 4.42Å; P635-L694 WeakPolarHBondContact O-CD1 3.44Å
636	E	76.8	Confident	67.6	Low	17 Å²	17	51.3 Å²	51.3	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-65.5	-42.8	172.2	-64.2	70.3	-151.4	0	0	113.6	A572 E573 L576 S634 F639 L640	A572-E636 HydrophobicContact CB-CB 4.35Å; E573-E636 HydrophobicContact CG-CG 3.91Å; L576-E636 HydrophobicContact CD1-CB 3.89Å; L576-E636 HydrophobicContact CD1-CG 4.12Å; S634-E636 PolarHBondContact O-N 3.39Å; S634-E636 VanDerWaalsContact O-N 3.11Å; E636-F639 WeakPolarHBondContact O-CB 3.36Å; E636-F639 PolarHBondContact O-N 3.11Å; E636-L640 PolarHBondContact O-N 3.49Å; E636-L640 VanDerWaalsContact O-N 3.07Å
637	L	77.8	Confident	69.7	Low	1 Å²	1	49.1 Å²	49.1	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-70.4	-39	179.2	-164.6	79.3	0	0	0	111.8	I568 I607 L631 L633 S634 F639 L640 I641	I568-L637 HydrophobicContact CG2-CD1 3.75Å; I607-L637 HydrophobicContact CD1-CD1 3.72Å; I607-L637 HydrophobicContact CG1-CD1 4.22Å; I607-L637 HydrophobicContact CG2-CD1 3.76Å; I607-L637 HydrophobicContact CG2-CG 4.23Å; L631-L637 HydrophobicContact CD2-CD2 3.58Å; L631-L637 HydrophobicContact CG-CD2 4.49Å; L633-L637 HydrophobicContact CD2-CD2 4.2Å; S634-L637 PolarHBondContact O-N 2.98Å; S634-L637 VanDerWaalsContact OG-CB 3.25Å; S634-L637 WeakPolarHBondContact OG-CB 2.95Å; S634-L637 PolarHBondContact OG-N 2.86Å; L637-F639 VanDerWaalsContact C-N 3.26Å; L637-F639 PolarHBondContact O-N 3.27Å; L637-L640 PolarHBondContact O-N 2.97Å; L637-I641 HydrophobicContact CD2-CD1 4.48Å; L637-I641 HydrophobicContact CG-CD1 4.28Å; L637-I641 WeakPolarHBondContact O-CG1 3.48Å; L637-I641 PolarHBondContact O-N 2.78Å
638	A	79.2	Confident	71.7	Confident	30 Å²	30	48.8 Å²	48.8	25%	0.248	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-39.8	173.8	0	0	0	0	0	111.2	L633 S634 R642	L633-A638 HydrophobicContact CD2-CB 4.22Å; S634-A638 PolarHBondContact O-N 2.82Å; A638-R642 WeakPolarHBondContact O-CB 3.25Å; A638-R642 WeakPolarHBondContact O-CG 3.42Å; A638-R642 PolarHBondContact O-N 3.42Å; A638-R642 VanDerWaalsContact O-N 3.13Å
639	F	83	Confident	73.7	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-48.7	173.1	175.7	-90.7	0	0	0	111.8	L576 P635 E636 L637 I641 R642 Y643 L665 L694 I696 L700 L704	L576-F639 HydrophobicContact CD1-CD1 4.19Å; L576-F639 HydrophobicContact CD2-CD1 3.79Å; L576-F639 HydrophobicContact CD2-CE1 3.68Å; P635-F639 PolarHBondContact O-N 3.19Å; P635-F639 VanDerWaalsContact O-N 3.15Å; E636-F639 WeakPolarHBondContact O-CB 3.36Å; E636-F639 PolarHBondContact O-N 3.11Å; L637-F639 VanDerWaalsContact C-N 3.26Å; L637-F639 PolarHBondContact O-N 3.27Å; F639-I641 PolarHBondContact O-N 3.36Å; F639-R642 PolarHBondContact O-N 2.94Å; F639-Y643 VanDerWaalsContact O-CB 3.31Å; F639-Y643 WeakPolarHBondContact O-CB 3.43Å; F639-Y643 PolarHBondContact O-N 3.33Å; F639-L665 HydrophobicContact CD2-CD2 3.38Å; F639-L665 HydrophobicContact CE2-CB 4.21Å; F639-L665 HydrophobicContact CE2-CD2 3.5Å; F639-L665 HydrophobicContact CE2-CG 4.41Å; F639-L665 HydrophobicContact CG-CD2 4.11Å; F639-L665 HydrophobicContact CZ-CD2 4.29Å; F639-L665 WeakPolarHBondContact O-CD2 3.33Å; F639-L694 HydrophobicContact CB-CD2 4.32Å; F639-I696 HydrophobicContact CD2-CD1 3.21Å; F639-I696 HydrophobicContact CD2-CG1 4.28Å; F639-I696 HydrophobicContact CE2-CD1 3.38Å; F639-I696 HydrophobicContact CE2-CG1 4.45Å; F639-I696 HydrophobicContact CE2-CG2 4.39Å; F639-I696 HydrophobicContact CG-CD1 3.91Å; F639-I696 HydrophobicContact CZ-CD1 4.2Å; F639-I696 HydrophobicContact CZ-CG2 4.36Å; F639-L700 HydrophobicContact CE1-CD2 3.75Å; F639-L700 HydrophobicContact CZ-CD2 3.77Å; F639-L700 HydrophobicContact CZ-CG 4.07Å; F639-L704 HydrophobicContact CE2-CD1 3.87Å; F639-L704 HydrophobicContact CZ-CD1 3.91Å
640	L	84.3	Confident	75.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.9	-40.6	-179.9	-72.1	170.6	0	0	0	112.6	A572 L576 V600 L603 A604 I607 E636 L637 Y643 A644	A572-L640 HydrophobicContact CB-CD1 3.59Å; L576-L640 HydrophobicContact CD1-CG 4.5Å; L576-L640 HydrophobicContact CD2-CD2 4Å; L576-L640 HydrophobicContact CG-CD2 4.44Å; V600-L640 HydrophobicContact CG1-CD2 3.87Å; L603-L640 HydrophobicContact CD2-CD1 3.72Å; L603-L640 HydrophobicContact CD2-CD2 4.43Å; L603-L640 HydrophobicContact CG-CD1 4.4Å; A604-L640 HydrophobicContact CB-CB 4.34Å; A604-L640 HydrophobicContact CB-CD2 4.15Å; A604-L640 VanDerWaalsContact CB-O 3.32Å; A604-L640 WeakPolarHBondContact CB-O 3.5Å; I607-L640 HydrophobicContact CD1-CB 4.22Å; I607-L640 HydrophobicContact CD1-CD1 3.61Å; E636-L640 PolarHBondContact O-N 3.49Å; E636-L640 VanDerWaalsContact O-N 3.07Å; L637-L640 PolarHBondContact O-N 2.97Å; L640-Y643 WeakPolarHBondContact O-CB 3.16Å; L640-Y643 PolarHBondContact O-N 2.94Å; L640-A644 PolarHBondContact O-N 2.93Å
641	I	82.6	Confident	77.3	Confident	25 Å²	25	44.3 Å²	44.3	13%	0.128	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-49.6	176.6	-70.9	165.7	0	0	0	110.4	I607 L608 L633 L637 F639 Y643 A644 E645	I607-I641 HydrophobicContact CG2-CD1 4.27Å; I607-I641 HydrophobicContact CG2-CG1 3.79Å; L608-I641 HydrophobicContact CD1-CG2 4.13Å; L633-I641 HydrophobicContact CD2-CD1 3.52Å; L637-I641 HydrophobicContact CD2-CD1 4.48Å; L637-I641 HydrophobicContact CG-CD1 4.28Å; L637-I641 WeakPolarHBondContact O-CG1 3.48Å; L637-I641 PolarHBondContact O-N 2.78Å; F639-I641 PolarHBondContact O-N 3.36Å; I641-Y643 VanDerWaalsContact C-N 3.26Å; I641-Y643 PolarHBondContact O-N 3.47Å; I641-A644 PolarHBondContact O-N 3.21Å; I641-E645 WeakPolarHBondContact O-CG 3.43Å; I641-E645 PolarHBondContact O-N 2.9Å
642	R	81.6	Confident	78.7	Confident	76 Å²	76	48.5 Å²	48.5	29%	0.287	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-35.1	177.6	-72.1	175.2	-176.2	-113.4	2.8	111.9	A638 F639 E645 L646 D664 L665	A638-R642 WeakPolarHBondContact O-CB 3.25Å; A638-R642 WeakPolarHBondContact O-CG 3.42Å; A638-R642 PolarHBondContact O-N 3.42Å; A638-R642 VanDerWaalsContact O-N 3.13Å; F639-R642 PolarHBondContact O-N 2.94Å; R642-E645 PolarHBondContact O-N 3.24Å; R642-L646 PolarHBondContact O-N 3.4Å; R642-D664 VanDerWaalsContact NH1-CG 3.28Å; R642-D664 IonicContact NH1-OD2 2.97Å; R642-D664 PolarHBondContact NH1-OD2 3.48Å; R642-L665 HydrophobicContact CB-CD2 3.48Å; R642-L665 VanDerWaalsContact CB-CD2 3.48Å; R642-L665 HydrophobicContact CB-CG 4.02Å
643	Y	84.3	Confident	79.9	Confident	19 Å²	19	42.2 Å²	42.2	8%	0.075	23%	0.232	C	C	.	.	H	α-helix	trans	-65.5	-42.5	175.5	-175.3	-105.2	0	0	0	111.9	V600 A601 A604 F639 L640 I641 L646 Q647 L665 R703 L704	V600-Y643 HydrophobicContact CG1-CD1 4.19Å; V600-Y643 HydrophobicContact CG1-CE1 4.04Å; A601-Y643 HydrophobicContact CB-CE1 4.27Å; A604-Y643 HydrophobicContact CB-CD1 3.79Å; F639-Y643 VanDerWaalsContact O-CB 3.31Å; F639-Y643 WeakPolarHBondContact O-CB 3.43Å; F639-Y643 PolarHBondContact O-N 3.33Å; L640-Y643 WeakPolarHBondContact O-CB 3.16Å; L640-Y643 PolarHBondContact O-N 2.94Å; I641-Y643 VanDerWaalsContact C-N 3.26Å; I641-Y643 PolarHBondContact O-N 3.47Å; Y643-L646 WeakPolarHBondContact O-CB 3.49Å; Y643-L646 PolarHBondContact O-N 3.32Å; Y643-Q647 HydrophobicContact CE1-CG 4.34Å; Y643-Q647 VanDerWaalsContact CE1-NE2 3.28Å; Y643-Q647 WeakPolarHBondContact O-CG 3.37Å; Y643-Q647 PolarHBondContact O-N 3.24Å; Y643-L665 HydrophobicContact CD2-CD1 4.43Å; Y643-R703 PolarHBondContact OH-NH2 3.43Å; Y643-L704 HydrophobicContact CD2-CD2 3.73Å; Y643-L704 HydrophobicContact CE2-CD2 3.62Å
644	A	84.4	Confident	80.9	Confident	5 Å²	5	41.9 Å²	41.9	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-64.7	-40.1	174.3	0	0	0	0	0	112.3	A604 L608 L640 I641 L646 Q647 Q648	A604-A644 HydrophobicContact CB-CB 3.87Å; A604-A644 WeakPolarHBondContact O-CB 3.11Å; L608-A644 HydrophobicContact CB-CB 3.68Å; L608-A644 HydrophobicContact CD2-CB 3.54Å; L608-A644 HydrophobicContact CG-CB 4.17Å; L640-A644 PolarHBondContact O-N 2.93Å; I641-A644 PolarHBondContact O-N 3.21Å; A644-L646 VanDerWaalsContact C-N 3.34Å; A644-Q647 PolarHBondContact O-N 3.16Å; A644-Q648 PolarHBondContact O-N 3.36Å
645	E	84	Confident	81.2	Confident	47 Å²	47	42.8 Å²	42.8	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-39.8	175.7	-69.7	175.6	140	0	0	111.6	L608 I641 R642 Q647 Q648 S649 R661	L608-E645 HydrophobicContact CD1-CG 4.01Å; L608-E645 HydrophobicContact CD2-CG 4.15Å; I641-E645 WeakPolarHBondContact O-CG 3.43Å; I641-E645 PolarHBondContact O-N 2.9Å; R642-E645 PolarHBondContact O-N 3.24Å; E645-Q647 PolarHBondContact O-N 3.3Å; E645-Q648 WeakPolarHBondContact O-CB 3.27Å; E645-Q648 PolarHBondContact O-N 3.06Å; E645-S649 PolarHBondContact O-N 3.23Å; E645-S649 PolarHBondContact O-OG 3.05Å; E645-R661 IonicContact OE2-CZ 2.69Å; E645-R661 IonicContact OE2-NH1 3.92Å; E645-R661 PolarHBondContact OE2-NH1 3.1Å; E645-R661 IonicContact OE2-NH2 3.65Å
646	L	85.3	Confident	81.5	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-47.9	171.8	170.6	62.2	0	0	0	111.6	R642 Y643 A644 Q648 S649 F650 A658 R661 I662 L665 L704	R642-L646 PolarHBondContact O-N 3.4Å; Y643-L646 WeakPolarHBondContact O-CB 3.49Å; Y643-L646 PolarHBondContact O-N 3.32Å; A644-L646 VanDerWaalsContact C-N 3.34Å; L646-Q648 PolarHBondContact O-N 3.06Å; L646-S649 PolarHBondContact O-N 3.42Å; L646-F650 HydrophobicContact CD1-CD2 3.9Å; L646-F650 HydrophobicContact CD1-CE2 3.44Å; L646-F650 VanDerWaalsContact CD1-CE2 3.44Å; L646-F650 HydrophobicContact CD1-CZ 4.05Å; L646-F650 HydrophobicContact CD2-CE2 4.17Å; L646-F650 HydrophobicContact CG-CD2 4Å; L646-F650 HydrophobicContact CG-CE2 3.68Å; L646-F650 VanDerWaalsContact O-CD2 3.32Å; L646-F650 WeakPolarHBondContact O-CD2 3.36Å; L646-F650 PolarHBondContact O-N 3.49Å; L646-F650 VanDerWaalsContact O-N 3.08Å; L646-A658 HydrophobicContact CD1-CB 3.95Å; L646-A658 VanDerWaalsContact CD1-O 3.25Å; L646-A658 WeakPolarHBondContact CD1-O 3.49Å; L646-R661 HydrophobicContact CB-CB 4.19Å; L646-R661 HydrophobicContact CD1-CB 4.27Å; L646-I662 HydrophobicContact CD1-CD1 4.11Å; L646-I662 HydrophobicContact CD1-CG1 3.59Å; L646-I662 HydrophobicContact CD2-CG1 3.67Å; L646-I662 HydrophobicContact CG-CG1 4.29Å; L646-L665 HydrophobicContact CB-CD1 4.15Å; L646-L665 HydrophobicContact CD2-CD1 3.75Å; L646-L704 HydrophobicContact CD2-CD2 3.78Å
647	Q	82.9	Confident	81.6	Confident	51 Å²	51	44.3 Å²	44.3	24%	0.238	24%	0.243	C	C	.	.	H	α-helix	trans	-60.8	-36.6	177.6	-70.2	-176	-31.7	0	0	112	Y643 A644 E645 F650 N651	Y643-Q647 HydrophobicContact CE1-CG 4.34Å; Y643-Q647 VanDerWaalsContact CE1-NE2 3.28Å; Y643-Q647 WeakPolarHBondContact O-CG 3.37Å; Y643-Q647 PolarHBondContact O-N 3.24Å; A644-Q647 PolarHBondContact O-N 3.16Å; E645-Q647 PolarHBondContact O-N 3.3Å; Q647-F650 PolarHBondContact O-N 2.81Å; Q647-N651 PolarHBondContact O-N 3.13Å; Q647-N651 VanDerWaalsContact O-N 3.15Å; Q647-N651 PolarHBondContact O-ND2 3.34Å
648	Q	82.2	Confident	81.9	Confident	60 Å²	60	44.3 Å²	44.3	28%	0.28	24%	0.243	S	C	.	.	H	α-helix	trans	-67.9	-43.3	175.3	-164.1	-172.3	-16.1	0	0	112	A644 E645 L646 F650 N651 D652	A644-Q648 PolarHBondContact O-N 3.36Å; E645-Q648 WeakPolarHBondContact O-CB 3.27Å; E645-Q648 PolarHBondContact O-N 3.06Å; L646-Q648 PolarHBondContact O-N 3.06Å; Q648-F650 VanDerWaalsContact C-N 3.25Å; Q648-F650 PolarHBondContact O-N 3.5Å; Q648-N651 CarbonylContact O-C 3.59Å; Q648-N651 WeakPolarHBondContact O-CA 3.43Å; Q648-N651 WeakPolarHBondContact O-CB 3.43Å; Q648-N651 PolarHBondContact O-N 3.07Å; Q648-D652 WeakPolarHBondContact CG-OD2 3.38Å; Q648-D652 PolarHBondContact NE2-OD2 3.18Å; Q648-D652 WeakPolarHBondContact O-CB 3.32Å; Q648-D652 PolarHBondContact O-N 3.47Å
649	S	83.5	Confident	82.1	Confident	18 Å²	18	42.9 Å²	42.9	13%	0.126	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-39.5	175.2	-64.8	0	0	0	0	112.1	E645 L646 D652 G653 D654	E645-S649 PolarHBondContact O-N 3.23Å; E645-S649 PolarHBondContact O-OG 3.05Å; L646-S649 PolarHBondContact O-N 3.42Å; S649-D652 PolarHBondContact O-N 3.02Å; S649-G653 PolarHBondContact O-N 3.4Å; S649-G653 VanDerWaalsContact O-N 3.08Å; S649-D654 PolarHBondContact O-N 3.05Å
650	F	80.9	Confident	82.2	Confident	68 Å²	68	45.3 Å²	45.3	30%	0.298	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-40.6	173.1	-77.3	-56.2	0	0	0	113	L646 Q647 Q648 G653 A658 I662 E707 L711	L646-F650 HydrophobicContact CD1-CD2 3.9Å; L646-F650 HydrophobicContact CD1-CE2 3.44Å; L646-F650 VanDerWaalsContact CD1-CE2 3.44Å; L646-F650 HydrophobicContact CD1-CZ 4.05Å; L646-F650 HydrophobicContact CD2-CE2 4.17Å; L646-F650 HydrophobicContact CG-CD2 4Å; L646-F650 HydrophobicContact CG-CE2 3.68Å; L646-F650 VanDerWaalsContact O-CD2 3.32Å; L646-F650 WeakPolarHBondContact O-CD2 3.36Å; L646-F650 PolarHBondContact O-N 3.49Å; L646-F650 VanDerWaalsContact O-N 3.08Å; Q647-F650 PolarHBondContact O-N 2.81Å; Q648-F650 VanDerWaalsContact C-N 3.25Å; Q648-F650 PolarHBondContact O-N 3.5Å; F650-G653 PolarHBondContact O-N 3Å; F650-A658 HydrophobicContact CD1-CB 4.2Å; F650-A658 HydrophobicContact CE1-CB 4.07Å; F650-A658 HydrophobicContact CZ-CB 4.34Å; F650-I662 HydrophobicContact CZ-CD1 3.97Å; F650-E707 HydrophobicContact CE2-CB 4.25Å; F650-E707 HydrophobicContact CZ-CB 3.95Å; F650-L711 HydrophobicContact CE1-CD1 3.91Å; F650-L711 HydrophobicContact CE1-CD2 4.1Å; F650-L711 HydrophobicContact CE1-CG 4.18Å; F650-L711 HydrophobicContact CZ-CD1 4.34Å
651	N	80.4	Confident	82.2	Confident	140 Å²	140	49.2 Å²	49.2	75%	0.749	26%	0.259	S	S	*	.	H	α-helix	trans	-69.6	-36.1	177	-69.4	-25.4	0	0	0	112.5	Q647 Q648 G653	Q647-N651 PolarHBondContact O-N 3.13Å; Q647-N651 VanDerWaalsContact O-N 3.15Å; Q647-N651 PolarHBondContact O-ND2 3.34Å; Q648-N651 CarbonylContact O-C 3.59Å; Q648-N651 WeakPolarHBondContact O-CA 3.43Å; Q648-N651 WeakPolarHBondContact O-CB 3.43Å; Q648-N651 PolarHBondContact O-N 3.07Å; N651-G653 VanDerWaalsContact C-N 3.25Å; N651-G653 PolarHBondContact O-N 2.66Å
652	D	80.3	Confident	82.4	Confident	112 Å²	112	48 Å²	48	60%	0.599	25%	0.253	S	S	*	.	H	α-helix	trans	-79.1	-9	-179.8	-66.9	-16.4	0	0	0	112.2	Q648 S649 D654	Q648-D652 WeakPolarHBondContact CG-OD2 3.38Å; Q648-D652 PolarHBondContact NE2-OD2 3.18Å; Q648-D652 WeakPolarHBondContact O-CB 3.32Å; Q648-D652 PolarHBondContact O-N 3.47Å; S649-D652 PolarHBondContact O-N 3.02Å; D652-D654 VanDerWaalsContact C-N 3.28Å; D652-D654 PolarHBondContact O-N 3.46Å
653	G	78.4	Confident	82.5	Confident	51 Å²	51	45.3 Å²	45.3	53%	0.526	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	9.5	-179	0	0	0	0	0	114.6	S649 F650 N651 C655	S649-G653 PolarHBondContact O-N 3.4Å; S649-G653 VanDerWaalsContact O-N 3.08Å; F650-G653 PolarHBondContact O-N 3Å; N651-G653 VanDerWaalsContact C-N 3.25Å; N651-G653 PolarHBondContact O-N 2.66Å; G653-C655 PolarHBondContact O-N 2.9Å
654	D	82.3	Confident	82.5	Confident	81 Å²	81	47.4 Å²	47.4	43%	0.433	26%	0.257	S	S	.	.			trans	-77.9	86.2	177.6	180	13.1	0	0	0	110.6	S649 D652 E656 G657 A658	S649-D654 PolarHBondContact O-N 3.05Å; D652-D654 VanDerWaalsContact C-N 3.28Å; D652-D654 PolarHBondContact O-N 3.46Å; D654-E656 PolarHBondContact OD1-N 3.47Å; D654-G657 PolarHBondContact OD1-N 2.91Å; D654-G657 WeakPolarHBondContact OD2-CA 3.47Å; D654-A658 VanDerWaalsContact O-CB 3.29Å; D654-A658 WeakPolarHBondContact O-CB 3.44Å; D654-A658 PolarHBondContact O-N 3.45Å
655	C	78.9	Confident	82.4	Confident	32 Å²	32	47.2 Å²	47.2	22%	0.216	26%	0.255	C	S	.	.	H	α-helix	trans	-67.4	-34.4	-177.3	-62.6	0	0	0	0	112.6	G653 V659 L711 C716	G653-C655 PolarHBondContact O-N 2.9Å; C655-V659 VanDerWaalsContact O-CG2 3.28Å; C655-V659 WeakPolarHBondContact O-CG2 3.4Å; C655-V659 PolarHBondContact O-N 2.94Å; C655-L711 HydrophobicContact CB-CD2 4.19Å; C655-C716 HydrophobicContact CB-CB 3.94Å
656	E	77.6	Confident	82.2	Confident	91 Å²	91	45.5 Å²	45.5	43%	0.425	25%	0.247	S	C	.	.	H	α-helix	trans	-74.5	-45.7	-178	-170	175.6	-175.1	0	0	110.5	D654 A658 V659 D660 R718	D654-E656 PolarHBondContact OD1-N 3.47Å; E656-A658 VanDerWaalsContact C-N 3.33Å; E656-A658 PolarHBondContact O-N 2.82Å; E656-V659 PolarHBondContact O-N 3.11Å; E656-D660 PolarHBondContact O-N 3.39Å; E656-R718 IonicContact OE1-CZ 2.84Å; E656-R718 IonicContact OE1-NH1 3.88Å; E656-R718 PolarHBondContact OE1-NH1 2.7Å
657	G	80.7	Confident	81.7	Confident	17 Å²	17	49.6 Å²	49.6	18%	0.175	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-38.6	173.9	0	0	0	0	0	112.7	D654 V659 D660 R661	D654-G657 PolarHBondContact OD1-N 2.91Å; D654-G657 WeakPolarHBondContact OD2-CA 3.47Å; G657-V659 VanDerWaalsContact C-N 3.34Å; G657-V659 PolarHBondContact O-N 3.44Å; G657-D660 PolarHBondContact O-N 2.93Å; G657-R661 WeakPolarHBondContact O-CG 3.42Å; G657-R661 PolarHBondContact O-N 3.47Å
658	A	82.9	Confident	80.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-41.9	175.8	0	0	0	0	0	112.2	L646 F650 D654 E656 R661 I662	L646-A658 HydrophobicContact CD1-CB 3.95Å; L646-A658 VanDerWaalsContact CD1-O 3.25Å; L646-A658 WeakPolarHBondContact CD1-O 3.49Å; F650-A658 HydrophobicContact CD1-CB 4.2Å; F650-A658 HydrophobicContact CE1-CB 4.07Å; F650-A658 HydrophobicContact CZ-CB 4.34Å; D654-A658 VanDerWaalsContact O-CB 3.29Å; D654-A658 WeakPolarHBondContact O-CB 3.44Å; D654-A658 PolarHBondContact O-N 3.45Å; E656-A658 VanDerWaalsContact C-N 3.33Å; E656-A658 PolarHBondContact O-N 2.82Å; A658-R661 PolarHBondContact O-N 3.13Å; A658-I662 WeakPolarHBondContact O-CG1 3.33Å; A658-I662 PolarHBondContact O-N 3.25Å
659	V	84.3	Confident	79.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-46.9	178.2	172.9	0	0	0	0	111.2	C655 E656 G657 R661 I662 I663 L711 L717 Q721 L725	C655-V659 VanDerWaalsContact O-CG2 3.28Å; C655-V659 WeakPolarHBondContact O-CG2 3.4Å; C655-V659 PolarHBondContact O-N 2.94Å; E656-V659 PolarHBondContact O-N 3.11Å; G657-V659 VanDerWaalsContact C-N 3.34Å; G657-V659 PolarHBondContact O-N 3.44Å; V659-R661 PolarHBondContact O-N 3.26Å; V659-I662 PolarHBondContact O-N 2.92Å; V659-I662 VanDerWaalsContact O-N 3.14Å; V659-I663 HydrophobicContact CG1-CD1 3.89Å; V659-I663 HydrophobicContact CG1-CG1 4.45Å; V659-I663 WeakPolarHBondContact O-CG1 3.49Å; V659-I663 PolarHBondContact O-N 3.44Å; V659-L711 HydrophobicContact CG2-CD1 3.6Å; V659-L717 HydrophobicContact CB-CD2 4.05Å; V659-L717 HydrophobicContact CG1-CD2 3.46Å; V659-L717 VanDerWaalsContact CG1-CD2 3.46Å; V659-L717 HydrophobicContact CG2-CD2 3.42Å; V659-L717 VanDerWaalsContact CG2-CD2 3.42Å; V659-L717 HydrophobicContact CG2-CG 4.46Å; V659-Q721 HydrophobicContact CG1-CB 3.93Å; V659-Q721 HydrophobicContact CG1-CG 4.1Å; V659-L725 HydrophobicContact CG1-CD1 4.23Å
660	D	84.5	Confident	77.8	Confident	56 Å²	56	51 Å²	51	30%	0.299	29%	0.29	S	S	.	.	H	α-helix	trans	-58.3	-39.6	178.2	-78.5	-23.5	0	0	0	110.7	E656 G657 I663 D664 R718 Q721	E656-D660 PolarHBondContact O-N 3.39Å; G657-D660 PolarHBondContact O-N 2.93Å; D660-I663 PolarHBondContact O-N 3.13Å; D660-D664 WeakPolarHBondContact O-CB 3.37Å; D660-D664 PolarHBondContact O-N 2.9Å; D660-R718 IonicContact OD1-NH2 3.9Å; D660-R718 PolarHBondContact OD1-NH2 3.17Å; D660-R718 IonicContact OD2-NH1 3.18Å; D660-R718 IonicContact OD2-NH2 3.58Å; D660-Q721 PolarHBondContact OD1-NE2 3.35Å
661	R	84.8	Confident	75.9	Confident	81 Å²	81	50.1 Å²	50.1	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-70.5	-35.2	176	-63.3	-46.6	-176.7	113	6.3	113.9	E645 L646 G657 A658 V659 D664 L665	E645-R661 IonicContact OE2-CZ 2.69Å; E645-R661 IonicContact OE2-NH1 3.92Å; E645-R661 PolarHBondContact OE2-NH1 3.1Å; E645-R661 IonicContact OE2-NH2 3.65Å; L646-R661 HydrophobicContact CB-CB 4.19Å; L646-R661 HydrophobicContact CD1-CB 4.27Å; G657-R661 WeakPolarHBondContact O-CG 3.42Å; G657-R661 PolarHBondContact O-N 3.47Å; A658-R661 PolarHBondContact O-N 3.13Å; V659-R661 PolarHBondContact O-N 3.26Å; R661-D664 PolarHBondContact O-N 3.33Å; R661-L665 WeakPolarHBondContact O-CB 3.39Å; R661-L665 WeakPolarHBondContact O-CD1 3.35Å; R661-L665 VanDerWaalsContact O-CG 3.25Å; R661-L665 WeakPolarHBondContact O-CG 3.23Å; R661-L665 PolarHBondContact O-N 3.16Å
662	I	85.5	Confident	73.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-47.3	172.2	-70.9	167.2	0	0	0	110	L646 F650 A658 V659 D664 L665 L666 E707 V708 L711 L725	L646-I662 HydrophobicContact CD1-CD1 4.11Å; L646-I662 HydrophobicContact CD1-CG1 3.59Å; L646-I662 HydrophobicContact CD2-CG1 3.67Å; L646-I662 HydrophobicContact CG-CG1 4.29Å; F650-I662 HydrophobicContact CZ-CD1 3.97Å; A658-I662 WeakPolarHBondContact O-CG1 3.33Å; A658-I662 PolarHBondContact O-N 3.25Å; V659-I662 PolarHBondContact O-N 2.92Å; V659-I662 VanDerWaalsContact O-N 3.14Å; I662-D664 VanDerWaalsContact C-N 3.33Å; I662-D664 PolarHBondContact O-N 3.19Å; I662-L665 PolarHBondContact O-N 3.13Å; I662-L666 HydrophobicContact CG2-CD1 3.66Å; I662-L666 HydrophobicContact CG2-CG 4.3Å; I662-L666 WeakPolarHBondContact O-CB 3.44Å; I662-L666 VanDerWaalsContact O-CG 3.28Å; I662-L666 WeakPolarHBondContact O-CG 3.35Å; I662-L666 PolarHBondContact O-N 3.34Å; I662-E707 HydrophobicContact CD1-CB 4.44Å; I662-V708 HydrophobicContact CD1-CG2 3.83Å; I662-V708 HydrophobicContact CG2-CG2 3.85Å; I662-L711 HydrophobicContact CD1-CD1 4.49Å; I662-L725 HydrophobicContact CG2-CD2 4.19Å
663	I	84.6	Confident	71.5	Confident	20 Å²	20	47.5 Å²	47.5	10%	0.103	29%	0.293	C	S	.	.	H	α-helix	trans	-58.5	-49	178.3	-71.3	170.4	0	0	0	109.9	V659 D660 L665 L666 V667 Q721 V724 L725	V659-I663 HydrophobicContact CG1-CD1 3.89Å; V659-I663 HydrophobicContact CG1-CG1 4.45Å; V659-I663 WeakPolarHBondContact O-CG1 3.49Å; V659-I663 PolarHBondContact O-N 3.44Å; D660-I663 PolarHBondContact O-N 3.13Å; I663-L665 VanDerWaalsContact C-N 3.34Å; I663-L665 PolarHBondContact O-N 3.27Å; I663-L666 PolarHBondContact O-N 3.43Å; I663-L666 VanDerWaalsContact O-N 3.16Å; I663-V667 HydrophobicContact CG2-CG2 4.1Å; I663-V667 WeakPolarHBondContact O-CB 3.3Å; I663-V667 VanDerWaalsContact O-CG2 3.29Å; I663-V667 WeakPolarHBondContact O-CG2 3.37Å; I663-V667 PolarHBondContact O-N 3.43Å; I663-Q721 HydrophobicContact CD1-CB 3.65Å; I663-Q721 HydrophobicContact CD1-CG 3.85Å; I663-V724 HydrophobicContact CG1-CG1 4.47Å; I663-V724 HydrophobicContact CG2-CB 4.42Å; I663-V724 HydrophobicContact CG2-CG1 3.55Å; I663-L725 HydrophobicContact CD1-CG 4.15Å; I663-L725 HydrophobicContact CG1-CD2 3.76Å; I663-L725 HydrophobicContact CG1-CG 3.87Å
664	D	83.4	Confident	69.2	Low	63 Å²	63	52.3 Å²	52.3	34%	0.337	31%	0.306	S	S	.	.	H	α-helix	trans	-55.3	-47	176.8	-93	3.5	0	0	0	112.3	R642 D660 R661 I662 L666 T668	R642-D664 VanDerWaalsContact NH1-CG 3.28Å; R642-D664 IonicContact NH1-OD2 2.97Å; R642-D664 PolarHBondContact NH1-OD2 3.48Å; D660-D664 WeakPolarHBondContact O-CB 3.37Å; D660-D664 PolarHBondContact O-N 2.9Å; R661-D664 PolarHBondContact O-N 3.33Å; I662-D664 VanDerWaalsContact C-N 3.33Å; I662-D664 PolarHBondContact O-N 3.19Å; D664-L666 VanDerWaalsContact C-N 3.31Å; D664-L666 PolarHBondContact O-N 3.25Å; D664-T668 VanDerWaalsContact O-CB 3.29Å; D664-T668 WeakPolarHBondContact O-CB 3.24Å; D664-T668 VanDerWaalsContact O-CG2 3.24Å; D664-T668 WeakPolarHBondContact O-CG2 3.39Å; D664-T668 PolarHBondContact O-N 3.15Å; D664-T668 PolarHBondContact O-OG1 3.06Å
665	L	83.9	Confident	66.7	Low	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-32.1	179.7	-74.8	164.5	0	0	0	113.1	F639 R642 Y643 L646 R661 I662 I663 L704	F639-L665 HydrophobicContact CD2-CD2 3.38Å; F639-L665 HydrophobicContact CE2-CB 4.21Å; F639-L665 HydrophobicContact CE2-CD2 3.5Å; F639-L665 HydrophobicContact CE2-CG 4.41Å; F639-L665 HydrophobicContact CG-CD2 4.11Å; F639-L665 HydrophobicContact CZ-CD2 4.29Å; F639-L665 WeakPolarHBondContact O-CD2 3.33Å; R642-L665 HydrophobicContact CB-CD2 3.48Å; R642-L665 VanDerWaalsContact CB-CD2 3.48Å; R642-L665 HydrophobicContact CB-CG 4.02Å; Y643-L665 HydrophobicContact CD2-CD1 4.43Å; L646-L665 HydrophobicContact CB-CD1 4.15Å; L646-L665 HydrophobicContact CD2-CD1 3.75Å; R661-L665 WeakPolarHBondContact O-CB 3.39Å; R661-L665 WeakPolarHBondContact O-CD1 3.35Å; R661-L665 VanDerWaalsContact O-CG 3.25Å; R661-L665 WeakPolarHBondContact O-CG 3.23Å; R661-L665 PolarHBondContact O-N 3.16Å; I662-L665 PolarHBondContact O-N 3.13Å; I663-L665 VanDerWaalsContact C-N 3.34Å; I663-L665 PolarHBondContact O-N 3.27Å; L665-L704 HydrophobicContact CB-CD1 4.02Å; L665-L704 HydrophobicContact CD1-CD2 4.13Å
666	L	79.2	Confident	64.2	Low	12 Å²	12	57.1 Å²	57.1	6%	0.063	33%	0.332	C	S	.	.	H	α-helix	trans	-78.6	-40.9	179.2	-70.4	171.9	0	0	0	112.2	I662 I663 D664 K701 L704 L705 L725 A728 L732	I662-L666 HydrophobicContact CG2-CD1 3.66Å; I662-L666 HydrophobicContact CG2-CG 4.3Å; I662-L666 WeakPolarHBondContact O-CB 3.44Å; I662-L666 VanDerWaalsContact O-CG 3.28Å; I662-L666 WeakPolarHBondContact O-CG 3.35Å; I662-L666 PolarHBondContact O-N 3.34Å; I663-L666 PolarHBondContact O-N 3.43Å; I663-L666 VanDerWaalsContact O-N 3.16Å; D664-L666 VanDerWaalsContact C-N 3.31Å; D664-L666 PolarHBondContact O-N 3.25Å; L666-K701 HydrophobicContact CD2-CB 3.93Å; L666-K701 HydrophobicContact CD2-CG 4.48Å; L666-K701 WeakPolarHBondContact CD2-O 3.37Å; L666-L704 HydrophobicContact CD2-CB 4.17Å; L666-L705 HydrophobicContact CD1-CD1 3.58Å; L666-L725 HydrophobicContact CD1-CD2 4.15Å; L666-A728 HydrophobicContact CB-CB 4.35Å; L666-A728 HydrophobicContact CD1-CB 4.37Å; L666-L732 HydrophobicContact CD2-CD1 4.24Å
667	V	74.9	Confident	61.8	Low	88 Å²	88	58.8 Å²	58.8	53%	0.533	35%	0.349	S	S	.	.	H	α-helix	trans	-83.7	-30.6	-173.4	177.3	0	0	0	0	112.6	I663 S669 V724	I663-V667 HydrophobicContact CG2-CG2 4.1Å; I663-V667 WeakPolarHBondContact O-CB 3.3Å; I663-V667 VanDerWaalsContact O-CG2 3.29Å; I663-V667 WeakPolarHBondContact O-CG2 3.37Å; I663-V667 PolarHBondContact O-N 3.43Å; V667-S669 PolarHBondContact O-N 3.29Å; V667-S669 VanDerWaalsContact O-N 3.14Å; V667-V724 HydrophobicContact CG2-CG1 4Å
668	T	64.1	Low	59.3	Low	64 Å²	64	65.4 Å²	65.4	39%	0.393	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	3.4	-177.3	53	0	0	0	0	115	D664	D664-T668 VanDerWaalsContact O-CB 3.29Å; D664-T668 WeakPolarHBondContact O-CB 3.24Å; D664-T668 VanDerWaalsContact O-CG2 3.24Å; D664-T668 WeakPolarHBondContact O-CG2 3.39Å; D664-T668 PolarHBondContact O-N 3.15Å; D664-T668 PolarHBondContact O-OG1 3.06Å
669	S	56	Low	56.7	Low	8 Å²	8	70.9 Å²	70.9	6%	0.056	42%	0.419	C	S	.	.	S	Bend	trans	-111.3	103.1	-176.2	-176	0	0	0	0	110.7	V667 G671 I696 K701	V667-S669 PolarHBondContact O-N 3.29Å; V667-S669 VanDerWaalsContact O-N 3.14Å; S669-G671 PolarHBondContact O-N 3.37Å; S669-I696 VanDerWaalsContact CB-CD1 3.49Å; S669-I696 VanDerWaalsContact OG-CD1 3.25Å; S669-I696 WeakPolarHBondContact OG-CD1 3.41Å; S669-I696 WeakPolarHBondContact OG-CG1 3.46Å; S669-K701 PolarHBondContact O-NZ 3.27Å; S669-K701 VanDerWaalsContact O-NZ 3.14Å; S669-K701 WeakPolarHBondContact OG-CE 3.49Å; S669-K701 PolarHBondContact OG-NZ 2.8Å; S669-K701 VanDerWaalsContact OG-NZ 3.15Å
670	P	45.8	Very low	53.9	Low	88 Å²	88	75.5 Å²	75.5	57%	0.571	46%	0.457	S	S	*	.			trans	-59.4	136.5	-178.3	-2	9.3	0	0	0	110.2
671	G	42.6	Very low	51.2	Low	48 Å²	48	76.3 Å²	76.3	50%	0.495	48%	0.479	S	S	.	.			trans	-53.8	150	-179.9	0	0	0	0	0	112.7	S669 S673	S669-G671 PolarHBondContact O-N 3.37Å; G671-S673 PolarHBondContact O-N 2.9Å
672	N	38.5	Very low	48.4	Very low	91 Å²	91	80.8 Å²	80.8	49%	0.487	50%	0.503	S	S	.	.			trans	-53.6	95	177.9	-97.8	-9.6	0	0	0	110.8	L674	N672-L674 PolarHBondContact O-N 2.96Å; N672-L674 VanDerWaalsContact O-N 3.11Å
673	S	29	Very low	45.6	Very low	106 Å²	106	87.3 Å²	87.3	74%	0.741	54%	0.538	S	S	*	.			trans	-74.2	104.4	162.5	61.5	0	0	0	0	107.6	G671 I675	G671-S673 PolarHBondContact O-N 2.9Å; S673-I675 PolarHBondContact O-N 2.93Å
674	L	30.9	Very low	42.9	Very low	152 Å²	152	97 Å²	97	80%	0.796	58%	0.575	S	S	*	*			trans	-45.3	105.2	173.2	-164	83.9	0	0	0	110.7	N672 T676	N672-L674 PolarHBondContact O-N 2.96Å; N672-L674 VanDerWaalsContact O-N 3.11Å; L674-T676 HydrophobicContact CD2-CG2 4.16Å; L674-T676 PolarHBondContact O-N 2.87Å
675	I	28.1	Very low	40.2	Very low	110 Å²	110	100.4 Å²	100.4	56%	0.564	60%	0.598	S	S	*	*			trans	-82.9	105	158.4	-61.5	177.2	0	0	0	105.4	S673 T677 L692	S673-I675 PolarHBondContact O-N 2.93Å; I675-T677 PolarHBondContact O-N 2.68Å; I675-L692 HydrophobicContact CD1-CD2 4.49Å
676	T	27.2	Very low	37.5	Very low	104 Å²	104	105.7 Å²	105.7	64%	0.638	64%	0.635	S	S	*	*			trans	-56	103.4	165.3	43	0	0	0	0	108.9	L674 N678	L674-T676 HydrophobicContact CD2-CG2 4.16Å; L674-T676 PolarHBondContact O-N 2.87Å; T676-N678 PolarHBondContact O-N 2.99Å; T676-N678 VanDerWaalsContact O-N 3.09Å
677	T	28.1	Very low	35	Very low	127 Å²	127	111.1 Å²	111.1	78%	0.779	67%	0.674	S	S	*	*			trans	-71.6	97.9	167.1	49.6	0	0	0	0	108.2	I675 S679	I675-T677 PolarHBondContact O-N 2.68Å; T677-S679 PolarHBondContact O-N 3.25Å
678	N	26.8	Very low	32.7	Very low	155 Å²	155	111.1 Å²	111.1	83%	0.829	68%	0.678	S	S	*	*			trans	-70.9	115.3	157.4	-82.5	-15.7	0	0	0	107.9	T676 A680	T676-N678 PolarHBondContact O-N 2.99Å; T676-N678 VanDerWaalsContact O-N 3.09Å; N678-A680 PolarHBondContact O-N 3.28Å
679	S	27.9	Very low	30.9	Very low	116 Å²	116	115.4 Å²	115.4	81%	0.811	70%	0.704	S	S	*	*			trans	-63	118.7	165.6	51.7	0	0	0	0	110.2	T677	T677-S679 PolarHBondContact O-N 3.25Å
680	A	26.9	Very low	29.6	Very low	97 Å²	97	120.1 Å²	120.1	80%	0.802	73%	0.733	S	S	*	*				162.8	119.4	128.3	0	0	0	0	0	110.9	N678	N678-A680 PolarHBondContact O-N 3.28Å
681	G	27	Very low	28.7	Very low	73 Å²	73	120 Å²	120	75%	0.753	75%	0.748	S	S	*	*			trans	85	124.7	144.2	0	0	0	0	0	118.8
682	Q	26.6	Very low	28.4	Very low	175 Å²	175	122.7 Å²	122.7	82%	0.818	75%	0.75	S	S	*	*			trans	96	112	146.6	-66.1	-174	-74.9	0	0	120.8
683	D	25.5	Very low	28.5	Very low	137 Å²	137	120.9 Å²	120.9	73%	0.733	75%	0.753	S	S	*	*				80.3	110.5	128.9	-57	-24.2	0	0	0	120.6	T685	D683-T685 PolarHBondContact O-N 3.29Å
684	Y	29.1	Very low	29.6	Very low	224 Å²	224	116.9 Å²	116.9	88%	0.878	72%	0.723	S	S	*	*			trans	-54.1	119.4	159.8	-74.1	-95.3	0	0	0	110.5
685	T	26.8	Very low	30.9	Very low	133 Å²	133	117.4 Å²	117.4	82%	0.816	71%	0.714	S	S	*	*			trans	152.6	105.1	136.4	44.1	0	0	0	0	109.4	D683	D683-T685 PolarHBondContact O-N 3.29Å
686	S	26.3	Very low	32.7	Very low	111 Å²	111	112.4 Å²	112.4	78%	0.776	69%	0.689	S	S	*	*			trans	162.5	129.6	137.8	48.7	0	0	0	0	110.4	S688	S686-S688 PolarHBondContact O-N 3.3Å
687	S	26.6	Very low	34.7	Very low	126 Å²	126	109 Å²	109	88%	0.881	67%	0.669	S	S	*	*			trans	-52.9	112.6	166.8	48.5	0	0	0	0	111.4
688	S	26.3	Very low	36.7	Very low	89 Å²	89	103.8 Å²	103.8	62%	0.622	64%	0.636	S	S	*	*			trans	-140.4	115.8	153.2	56.1	0	0	0	0	109.1	S686 T690	S686-S688 PolarHBondContact O-N 3.3Å; S688-T690 VanDerWaalsContact C-N 3.28Å; S688-T690 PolarHBondContact O-N 2.87Å
689	T	27.5	Very low	38.7	Very low	153 Å²	153	99.1 Å²	99.1	94%	0.939	61%	0.607	S	S	*	*			trans	-59.7	86.6	168.9	39.2	0	0	0	0	109.3
690	T	29.2	Very low	41	Very low	107 Å²	107	93.7 Å²	93.7	66%	0.656	57%	0.569	S	S	*	*			trans	-91	115.9	161.2	42.3	0	0	0	0	106.7	S688 L692	S688-T690 VanDerWaalsContact C-N 3.28Å; S688-T690 PolarHBondContact O-N 2.87Å; T690-L692 PolarHBondContact O-N 3.34Å
691	G	26.8	Very low	43.4	Very low	86 Å²	86	89.8 Å²	89.8	89%	0.887	53%	0.534	S	S	*	.			trans	-61.1	95.3	-179.2	0	0	0	0	0	110.7	G693	G691-G693 PolarHBondContact O-N 2.92Å
692	L	35	Very low	45.8	Very low	104 Å²	104	86.3 Å²	86.3	55%	0.545	50%	0.498	S	S	.	.			trans	-72.7	106.7	164.3	-82.6	145.8	0	0	0	106.4	I675 T690	I675-L692 HydrophobicContact CD1-CD2 4.49Å; T690-L692 PolarHBondContact O-N 3.34Å
693	G	41.9	Very low	48.1	Very low	53 Å²	53	79.4 Å²	79.4	55%	0.546	47%	0.465	S	S	.	.			trans	-57.5	144.8	171.8	0	0	0	0	0	111.1	G691 R695	G691-G693 PolarHBondContact O-N 2.92Å; G693-R695 PolarHBondContact O-N 2.93Å
694	L	51.2	Low	50.6	Low	22 Å²	22	73 Å²	73	12%	0.115	43%	0.43	C	S	.	.			trans	-28.5	99.7	177	-125.6	152.8	0	0	0	113	P635 F639 I696	P635-L694 HydrophobicContact CB-CB 4.23Å; P635-L694 HydrophobicContact CB-CD1 3.23Å; P635-L694 HydrophobicContact CB-CG 3.52Å; P635-L694 HydrophobicContact CG-CG 4.42Å; P635-L694 WeakPolarHBondContact O-CD1 3.44Å; F639-L694 HydrophobicContact CB-CD2 4.32Å; L694-I696 VanDerWaalsContact C-N 3.34Å; L694-I696 HydrophobicContact CD2-CD1 3.51Å; L694-I696 HydrophobicContact CD2-CG1 3.17Å; L694-I696 PolarHBondContact O-N 3.15Å; L694-I696 VanDerWaalsContact O-N 3.17Å
695	R	58.4	Low	53.1	Low	163 Å²	163	62.3 Å²	62.3	62%	0.615	39%	0.388	S	S	*	.			trans	-87.1	70.2	173.5	-80.9	-169.1	176.9	-172.4	0.6	110.4	G693 P697	G693-R695 PolarHBondContact O-N 2.93Å; R695-P697 WeakPolarHBondContact O-CD 3.31Å
696	I	66.6	Low	55.5	Low	6 Å²	6	56.5 Å²	56.5	3%	0.031	35%	0.354	C	S	.	.			trans	-73.3	124.3	165.7	-52.2	-174.5	0	0	0	107.7	F639 S669 L694 T698 L700 K701	F639-I696 HydrophobicContact CD2-CD1 3.21Å; F639-I696 HydrophobicContact CD2-CG1 4.28Å; F639-I696 HydrophobicContact CE2-CD1 3.38Å; F639-I696 HydrophobicContact CE2-CG1 4.45Å; F639-I696 HydrophobicContact CE2-CG2 4.39Å; F639-I696 HydrophobicContact CG-CD1 3.91Å; F639-I696 HydrophobicContact CZ-CD1 4.2Å; F639-I696 HydrophobicContact CZ-CG2 4.36Å; S669-I696 VanDerWaalsContact CB-CD1 3.49Å; S669-I696 VanDerWaalsContact OG-CD1 3.25Å; S669-I696 WeakPolarHBondContact OG-CD1 3.41Å; S669-I696 WeakPolarHBondContact OG-CG1 3.46Å; L694-I696 VanDerWaalsContact C-N 3.34Å; L694-I696 HydrophobicContact CD2-CD1 3.51Å; L694-I696 HydrophobicContact CD2-CG1 3.17Å; L694-I696 PolarHBondContact O-N 3.15Å; L694-I696 VanDerWaalsContact O-N 3.17Å; I696-T698 PolarHBondContact O-N 3.16Å; I696-L700 HydrophobicContact CG2-CB 4.03Å; I696-L700 HydrophobicContact CG2-CD2 3.88Å; I696-L700 HydrophobicContact CG2-CG 4.01Å; I696-K701 HydrophobicContact CB-CG 4.42Å; I696-K701 HydrophobicContact CG2-CG 3.84Å
697	P	69.2	Low	57.9	Low	32 Å²	32	54.5 Å²	54.5	21%	0.208	33%	0.333	C	S	.	.			trans	-57.5	134.2	174.1	-19.4	29	0	0	0	110.9	L576 R695 R699 L700 K701	L576-P697 WeakPolarHBondContact O-CG 3.45Å; R695-P697 WeakPolarHBondContact O-CD 3.31Å; P697-R699 PolarHBondContact O-N 3.11Å; P697-L700 HydrophobicContact CB-CB 4.43Å; P697-L700 WeakPolarHBondContact O-CB 3.41Å; P697-L700 PolarHBondContact O-N 3.34Å; P697-K701 PolarHBondContact O-N 3.28Å
698	T	69.8	Low	60.2	Low	17 Å²	17	48.6 Å²	48.6	10%	0.104	29%	0.291	C	S	.	.	H	α-helix	trans	-51.8	-33.7	176.9	-42.4	0	0	0	0	111.8	I696 K701 I702 L732 D735 L736	I696-T698 PolarHBondContact O-N 3.16Å; T698-K701 PolarHBondContact O-N 3.43Å; T698-I702 HydrophobicContact CG2-CD1 4.28Å; T698-I702 WeakPolarHBondContact O-CD1 3.5Å; T698-I702 VanDerWaalsContact O-CG1 3.27Å; T698-I702 WeakPolarHBondContact O-CG1 3.46Å; T698-I702 PolarHBondContact O-N 3.37Å; T698-L732 HydrophobicContact CG2-CD2 4.11Å; T698-D735 HydrophobicContact CG2-CB 3.95Å; T698-L736 HydrophobicContact CG2-CG 4.38Å
699	R	68.9	Low	62.3	Low	58 Å²	58	48.8 Å²	48.8	22%	0.219	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-36.3	176.2	-69.5	-171	171.2	176.5	-1.5	114.1	N580 P697 I702 R703 T745 M749	N580-R699 WeakPolarHBondContact O-CD 3.28Å; N580-R699 PolarHBondContact O-NH1 3.4Å; P697-R699 PolarHBondContact O-N 3.11Å; R699-I702 PolarHBondContact O-N 3.3Å; R699-R703 PolarHBondContact O-N 3.39Å; R699-T745 PolarHBondContact NH2-OG1 3.27Å; R699-M749 HydrophobicContact CB-CE 4.3Å; R699-M749 HydrophobicContact CG-CE 4.08Å
700	L	75.2	Confident	64.4	Low	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-67.9	-40.9	175.3	176.6	53.4	0	0	0	110.7	L576 F639 I696 P697 I702 R703 L704	L576-L700 HydrophobicContact CD2-CD2 3.76Å; F639-L700 HydrophobicContact CE1-CD2 3.75Å; F639-L700 HydrophobicContact CZ-CD2 3.77Å; F639-L700 HydrophobicContact CZ-CG 4.07Å; I696-L700 HydrophobicContact CG2-CB 4.03Å; I696-L700 HydrophobicContact CG2-CD2 3.88Å; I696-L700 HydrophobicContact CG2-CG 4.01Å; P697-L700 HydrophobicContact CB-CB 4.43Å; P697-L700 WeakPolarHBondContact O-CB 3.41Å; P697-L700 PolarHBondContact O-N 3.34Å; L700-I702 VanDerWaalsContact C-N 3.3Å; L700-I702 PolarHBondContact O-N 3.36Å; L700-R703 WeakPolarHBondContact O-CB 3.38Å; L700-R703 PolarHBondContact O-N 2.96Å; L700-L704 WeakPolarHBondContact O-CG 3.2Å; L700-L704 PolarHBondContact O-N 3.46Å
701	K	78.1	Confident	66.3	Low	15 Å²	15	42.9 Å²	42.9	7%	0.065	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-39.4	172.6	-60.9	-172.3	-179.7	-172.6	0	112	L666 S669 I696 P697 T698 L704 L705 L732	L666-K701 HydrophobicContact CD2-CB 3.93Å; L666-K701 HydrophobicContact CD2-CG 4.48Å; L666-K701 WeakPolarHBondContact CD2-O 3.37Å; S669-K701 PolarHBondContact O-NZ 3.27Å; S669-K701 VanDerWaalsContact O-NZ 3.14Å; S669-K701 WeakPolarHBondContact OG-CE 3.49Å; S669-K701 PolarHBondContact OG-NZ 2.8Å; S669-K701 VanDerWaalsContact OG-NZ 3.15Å; I696-K701 HydrophobicContact CB-CG 4.42Å; I696-K701 HydrophobicContact CG2-CG 3.84Å; P697-K701 PolarHBondContact O-N 3.28Å; T698-K701 PolarHBondContact O-N 3.43Å; K701-L704 WeakPolarHBondContact O-CB 3.4Å; K701-L704 PolarHBondContact O-N 3.4Å; K701-L705 PolarHBondContact O-N 3.37Å; K701-L732 HydrophobicContact CB-CD1 4.06Å; K701-L732 HydrophobicContact CB-CD2 3.45Å; K701-L732 VanDerWaalsContact CB-CD2 3.45Å; K701-L732 HydrophobicContact CB-CG 4.4Å; K701-L732 HydrophobicContact CD-CD2 3.65Å; K701-L732 HydrophobicContact CG-CD2 4.18Å
702	I	76	Confident	68.2	Low	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.5	-38	176	-64.5	157.8	0	0	0	111.6	T698 R699 L700 L705 A706 L736 M749 L752 L753	T698-I702 HydrophobicContact CG2-CD1 4.28Å; T698-I702 WeakPolarHBondContact O-CD1 3.5Å; T698-I702 VanDerWaalsContact O-CG1 3.27Å; T698-I702 WeakPolarHBondContact O-CG1 3.46Å; T698-I702 PolarHBondContact O-N 3.37Å; R699-I702 PolarHBondContact O-N 3.3Å; L700-I702 VanDerWaalsContact C-N 3.3Å; L700-I702 PolarHBondContact O-N 3.36Å; I702-L705 PolarHBondContact O-N 3.08Å; I702-A706 WeakPolarHBondContact O-CB 3.47Å; I702-A706 PolarHBondContact O-N 3.24Å; I702-L736 HydrophobicContact CD1-CD1 3.46Å; I702-L736 VanDerWaalsContact CD1-CD1 3.46Å; I702-L736 HydrophobicContact CD1-CD2 4Å; I702-L736 HydrophobicContact CD1-CG 3.83Å; I702-L736 HydrophobicContact CG1-CD1 4.34Å; I702-M749 HydrophobicContact CB-CE 3.71Å; I702-M749 HydrophobicContact CD1-CE 3.62Å; I702-M749 HydrophobicContact CG1-CE 4.28Å; I702-M749 HydrophobicContact CG2-CE 3.45Å; I702-M749 VanDerWaalsContact CG2-CE 3.45Å; I702-M749 HydrophobicContact CG2-SD 3.84Å; I702-L752 HydrophobicContact CG2-CD2 4.27Å; I702-L753 HydrophobicContact CG1-CD2 4.45Å; I702-L753 HydrophobicContact CG2-CD2 4.26Å
703	R	75.4	Confident	69.7	Low	30 Å²	30	38.2 Å²	38.2	11%	0.113	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-47.7	172.6	-177.1	175.8	67.1	-173.2	-7.5	111.4	D579 F582 S597 Y643 R699 L700 L705 A706 E707	D579-R703 IonicContact OD2-CZ 3.56Å; D579-R703 IonicContact OD2-NH1 3.04Å; D579-R703 IonicContact OD2-NH2 3.63Å; D579-R703 PolarHBondContact OD2-NH2 3.32Å; F582-R703 HydrophobicContact CE2-CB 4.12Å; F582-R703 HydrophobicContact CE2-CG 4.44Å; S597-R703 PolarHBondContact O-NH1 2.91Å; Y643-R703 PolarHBondContact OH-NH2 3.43Å; R699-R703 PolarHBondContact O-N 3.39Å; L700-R703 WeakPolarHBondContact O-CB 3.38Å; L700-R703 PolarHBondContact O-N 2.96Å; R703-L705 VanDerWaalsContact C-N 3.27Å; R703-L705 PolarHBondContact O-N 3.44Å; R703-A706 WeakPolarHBondContact O-CB 3.37Å; R703-A706 PolarHBondContact O-N 3.01Å; R703-E707 PolarHBondContact O-N 2.77Å; R703-E707 VanDerWaalsContact O-N 3.15Å
704	L	79.3	Confident	70.9	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-56.4	-42.8	176.3	-71.8	170.9	0	0	0	112.1	F639 Y643 L646 L665 L666 L700 K701 A706 E707	F639-L704 HydrophobicContact CE2-CD1 3.87Å; F639-L704 HydrophobicContact CZ-CD1 3.91Å; Y643-L704 HydrophobicContact CD2-CD2 3.73Å; Y643-L704 HydrophobicContact CE2-CD2 3.62Å; L646-L704 HydrophobicContact CD2-CD2 3.78Å; L665-L704 HydrophobicContact CB-CD1 4.02Å; L665-L704 HydrophobicContact CD1-CD2 4.13Å; L666-L704 HydrophobicContact CD2-CB 4.17Å; L700-L704 WeakPolarHBondContact O-CG 3.2Å; L700-L704 PolarHBondContact O-N 3.46Å; K701-L704 WeakPolarHBondContact O-CB 3.4Å; K701-L704 PolarHBondContact O-N 3.4Å; L704-A706 VanDerWaalsContact C-N 3.32Å; L704-A706 PolarHBondContact O-N 2.9Å; L704-E707 PolarHBondContact O-N 3.08Å
705	L	80.4	Confident	71.7	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-33	176.5	-160.1	87.7	0	0	0	112.3	L666 K701 I702 R703 E707 V708 L725 L729 L732 L753 I756	L666-L705 HydrophobicContact CD1-CD1 3.58Å; K701-L705 PolarHBondContact O-N 3.37Å; I702-L705 PolarHBondContact O-N 3.08Å; R703-L705 VanDerWaalsContact C-N 3.27Å; R703-L705 PolarHBondContact O-N 3.44Å; L705-E707 VanDerWaalsContact C-N 3.32Å; L705-E707 PolarHBondContact O-N 2.89Å; L705-V708 VanDerWaalsContact O-CB 3.31Å; L705-V708 WeakPolarHBondContact O-CB 3.39Å; L705-V708 WeakPolarHBondContact O-CG2 3.37Å; L705-V708 PolarHBondContact O-N 2.87Å; L705-L725 HydrophobicContact CD1-CD2 4.34Å; L705-L729 HydrophobicContact CD2-CB 3.95Å; L705-L729 HydrophobicContact CD2-CD1 3.84Å; L705-L729 HydrophobicContact CD2-CG 3.85Å; L705-L732 HydrophobicContact CB-CD1 4.49Å; L705-L732 HydrophobicContact CD2-CD1 4.37Å; L705-L753 HydrophobicContact CD2-CD2 3.48Å; L705-L753 VanDerWaalsContact CD2-CD2 3.48Å; L705-I756 HydrophobicContact CD2-CD1 4.36Å; L705-I756 HydrophobicContact CD2-CG2 4.19Å; L705-I756 HydrophobicContact CG-CG2 4.39Å
706	A	78.2	Confident	72.2	Confident	12 Å²	12	43 Å²	43	10%	0.099	22%	0.217	C	C	.	.	H	α-helix	trans	-68.3	-29.7	177.5	0	0	0	0	0	112.7	F582 I702 R703 L704 V708 R709 L752 I756	F582-A706 HydrophobicContact CZ-CB 4.13Å; I702-A706 WeakPolarHBondContact O-CB 3.47Å; I702-A706 PolarHBondContact O-N 3.24Å; R703-A706 WeakPolarHBondContact O-CB 3.37Å; R703-A706 PolarHBondContact O-N 3.01Å; L704-A706 VanDerWaalsContact C-N 3.32Å; L704-A706 PolarHBondContact O-N 2.9Å; A706-V708 PolarHBondContact O-N 3.12Å; A706-R709 WeakPolarHBondContact O-CB 3.44Å; A706-R709 PolarHBondContact O-N 3.32Å; A706-L752 HydrophobicContact CB-CD2 4.2Å; A706-I756 HydrophobicContact CB-CD1 4.2Å
707	E	76	Confident	72.7	Confident	69 Å²	69	43.2 Å²	43.2	32%	0.322	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-28.5	174.8	-66.8	-60.9	156.8	0	0	112.4	F650 I662 R703 L704 L705 R709 H710	F650-E707 HydrophobicContact CE2-CB 4.25Å; F650-E707 HydrophobicContact CZ-CB 3.95Å; I662-E707 HydrophobicContact CD1-CB 4.44Å; R703-E707 PolarHBondContact O-N 2.77Å; R703-E707 VanDerWaalsContact O-N 3.15Å; L704-E707 PolarHBondContact O-N 3.08Å; L705-E707 VanDerWaalsContact C-N 3.32Å; L705-E707 PolarHBondContact O-N 2.89Å; E707-R709 PolarHBondContact O-N 3.01Å; E707-R709 VanDerWaalsContact O-N 3.13Å; E707-H710 PolarHBondContact O-N 3.41Å; E707-H710 VanDerWaalsContact O-N 3.15Å; E707-H710 IonicContact OE2-CD2 3.27Å
708	V	75.5	Confident	73.2	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-58.8	-27.7	173.5	-176.5	0	0	0	0	111.2	I662 L705 A706 H710 L711 L712 L725 L760	I662-V708 HydrophobicContact CD1-CG2 3.83Å; I662-V708 HydrophobicContact CG2-CG2 3.85Å; L705-V708 VanDerWaalsContact O-CB 3.31Å; L705-V708 WeakPolarHBondContact O-CB 3.39Å; L705-V708 WeakPolarHBondContact O-CG2 3.37Å; L705-V708 PolarHBondContact O-N 2.87Å; A706-V708 PolarHBondContact O-N 3.12Å; V708-H710 PolarHBondContact O-N 3.21Å; V708-H710 VanDerWaalsContact O-N 3.14Å; V708-L711 WeakPolarHBondContact O-CA 3.49Å; V708-L711 WeakPolarHBondContact O-CB 3.29Å; V708-L711 PolarHBondContact O-N 2.93Å; V708-L712 HydrophobicContact CG1-CD1 4.35Å; V708-L712 HydrophobicContact CG1-CD2 4.27Å; V708-L712 HydrophobicContact CG1-CG 4.13Å; V708-L712 WeakPolarHBondContact O-CG 3.33Å; V708-L712 PolarHBondContact O-N 2.88Å; V708-L712 VanDerWaalsContact O-N 3.14Å; V708-L725 HydrophobicContact CG1-CD1 4.03Å; V708-L725 HydrophobicContact CG2-CD1 4.45Å; V708-L725 HydrophobicContact CG2-CD2 4.16Å; V708-L760 HydrophobicContact CG1-CD2 4.35Å
709	R	70.4	Confident	73.8	Confident	93 Å²	93	51.2 Å²	51.2	35%	0.351	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-58.7	-30	179.9	-167.8	178.8	175	-162	-6.6	112.7	A706 E707 L711	A706-R709 WeakPolarHBondContact O-CB 3.44Å; A706-R709 PolarHBondContact O-N 3.32Å; E707-R709 PolarHBondContact O-N 3.01Å; E707-R709 VanDerWaalsContact O-N 3.13Å; R709-L711 PolarHBondContact O-N 2.95Å
710	H	70.5	Confident	74.5	Confident	130 Å²	130	52.3 Å²	52.3	60%	0.602	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-75	-15	176.4	-63.3	-60.9	0	0	0	113.4	E707 V708	E707-H710 PolarHBondContact O-N 3.41Å; E707-H710 VanDerWaalsContact O-N 3.15Å; E707-H710 IonicContact OE2-CD2 3.27Å; V708-H710 PolarHBondContact O-N 3.21Å; V708-H710 VanDerWaalsContact O-N 3.14Å
711	L	70.1	Confident	75	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.031	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-17.3	-178.5	-56	177.7	0	0	0	112.8	F650 C655 V659 I662 V708 R709	F650-L711 HydrophobicContact CE1-CD1 3.91Å; F650-L711 HydrophobicContact CE1-CD2 4.1Å; F650-L711 HydrophobicContact CE1-CG 4.18Å; F650-L711 HydrophobicContact CZ-CD1 4.34Å; C655-L711 HydrophobicContact CB-CD2 4.19Å; V659-L711 HydrophobicContact CG2-CD1 3.6Å; I662-L711 HydrophobicContact CD1-CD1 4.49Å; V708-L711 WeakPolarHBondContact O-CA 3.49Å; V708-L711 WeakPolarHBondContact O-CB 3.29Å; V708-L711 PolarHBondContact O-N 2.93Å; R709-L711 PolarHBondContact O-N 2.95Å
712	L	66.9	Low	75.2	Confident	29 Å²	29	51.7 Å²	51.7	15%	0.152	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	134.3	177.1	-64.4	165.7	0	0	0	111	V708 L717 L760 E763	V708-L712 HydrophobicContact CG1-CD1 4.35Å; V708-L712 HydrophobicContact CG1-CD2 4.27Å; V708-L712 HydrophobicContact CG1-CG 4.13Å; V708-L712 WeakPolarHBondContact O-CG 3.33Å; V708-L712 PolarHBondContact O-N 2.88Å; V708-L712 VanDerWaalsContact O-N 3.14Å; L712-L717 HydrophobicContact CD2-CD1 3.47Å; L712-L717 VanDerWaalsContact CD2-CD1 3.47Å; L712-L717 HydrophobicContact CG-CD1 4.42Å; L712-L760 HydrophobicContact CD1-CG 4.45Å; L712-L760 HydrophobicContact CD2-CD2 3.72Å; L712-L760 HydrophobicContact CD2-CG 4.21Å; L712-E763 HydrophobicContact CD2-CB 4.24Å; L712-E763 HydrophobicContact CD2-CG 3.78Å
713	G	65.4	Low	75.6	Confident	63 Å²	63	55.5 Å²	55.5	65%	0.649	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-1.1	-179.4	0	0	0	0	0	114.9	E763	G713-E763 WeakPolarHBondContact CA-OE1 3.26Å; G713-E763 PolarHBondContact N-OE1 3.06Å
714	R	67.3	Low	76.2	Confident	171 Å²	171	56.8 Å²	56.8	65%	0.645	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	6.8	-176.1	-67.3	-175.6	174.5	-179.4	-0.1	114.5	C716	R714-C716 VanDerWaalsContact CB-SG 3.52Å; R714-C716 PolarHBondContact O-N 3.26Å; R714-C716 PolarHBondContact O-SG 3.23Å; R714-C716 VanDerWaalsContact O-SG 3.38Å
715	N	68	Low	76.5	Confident	130 Å²	130	56.8 Å²	56.8	70%	0.695	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	27.8	-173.5	-66	-13.2	0	0	0	113.9
716	C	69.4	Low	76.7	Confident	38 Å²	38	58.1 Å²	58.1	26%	0.257	29%	0.286	S	S	.	.			trans	-89.1	-1.1	-179	-58.6	0	0	0	0	113.6	C655 R714	C655-C716 HydrophobicContact CB-CB 3.94Å; R714-C716 VanDerWaalsContact CB-SG 3.52Å; R714-C716 PolarHBondContact O-N 3.26Å; R714-C716 PolarHBondContact O-SG 3.23Å; R714-C716 VanDerWaalsContact O-SG 3.38Å
717	L	75.9	Confident	77.1	Confident	11 Å²	11	61 Å²	61	6%	0.058	30%	0.303	C	S	.	.			trans	-109.3	124.7	-171.6	-70.1	161.2	0	0	0	110.5	V659 L712 V722 L725 E763	V659-L717 HydrophobicContact CB-CD2 4.05Å; V659-L717 HydrophobicContact CG1-CD2 3.46Å; V659-L717 VanDerWaalsContact CG1-CD2 3.46Å; V659-L717 HydrophobicContact CG2-CD2 3.42Å; V659-L717 VanDerWaalsContact CG2-CD2 3.42Å; V659-L717 HydrophobicContact CG2-CG 4.46Å; L712-L717 HydrophobicContact CD2-CD1 3.47Å; L712-L717 VanDerWaalsContact CD2-CD1 3.47Å; L712-L717 HydrophobicContact CG-CD1 4.42Å; L717-V722 HydrophobicContact CB-CG2 3.68Å; L717-V722 HydrophobicContact CD1-CG2 4.34Å; L717-V722 HydrophobicContact CG-CG2 4.48Å; L717-L725 HydrophobicContact CD2-CD1 4.16Å; L717-E763 HydrophobicContact CD1-CG 4.47Å
718	R	81	Confident	77.4	Confident	97 Å²	97	58.1 Å²	58.1	37%	0.366	29%	0.29	S	S	.	.			trans	-74.8	153.2	170.2	-54.9	-169.6	-58.4	-111.6	-6	110.1	E656 D660 D720 Q721 V722	E656-R718 IonicContact OE1-CZ 2.84Å; E656-R718 IonicContact OE1-NH1 3.88Å; E656-R718 PolarHBondContact OE1-NH1 2.7Å; D660-R718 IonicContact OD1-NH2 3.9Å; D660-R718 PolarHBondContact OD1-NH2 3.17Å; D660-R718 IonicContact OD2-NH1 3.18Å; D660-R718 IonicContact OD2-NH2 3.58Å; R718-D720 VanDerWaalsContact C-N 3.32Å; R718-D720 WeakPolarHBondContact CB-OD1 3.38Å; R718-D720 IonicContact NE-OD1 3.11Å; R718-D720 IonicContact NE-OD2 2.68Å; R718-D720 IonicContact NH2-OD2 3.62Å; R718-D720 PolarHBondContact O-N 2.58Å; R718-Q721 HydrophobicContact CB-CG 4.18Å; R718-Q721 WeakPolarHBondContact O-CB 3.28Å; R718-Q721 PolarHBondContact O-N 2.98Å; R718-Q721 VanDerWaalsContact O-N 3.07Å; R718-V722 PolarHBondContact O-N 3.49Å; R718-V722 VanDerWaalsContact O-N 3.11Å
719	R	81.3	Confident	78	Confident	120 Å²	120	58.1 Å²	58.1	45%	0.453	29%	0.29	S	S	.	.	H	α-helix	trans	-57.4	-43.7	-176.9	178.9	179	164.2	-176.1	-2.8	112.7	Q721 V722 E723	R719-Q721 VanDerWaalsContact C-N 3.3Å; R719-Q721 PolarHBondContact O-N 3.21Å; R719-V722 PolarHBondContact O-N 3.08Å; R719-E723 IonicContact CZ-OE1 2.62Å; R719-E723 IonicContact NE-OE1 2.94Å; R719-E723 PolarHBondContact NE-OE1 3.35Å; R719-E723 IonicContact NH2-OE1 3.43Å; R719-E723 PolarHBondContact NH2-OE1 3.32Å; R719-E723 WeakPolarHBondContact O-CG 3.38Å; R719-E723 PolarHBondContact O-N 3.37Å
720	D	83.9	Confident	78.6	Confident	81 Å²	81	58.3 Å²	58.3	43%	0.433	30%	0.297	S	S	.	.	H	α-helix	trans	-57.6	-42	175.7	55.8	-52	0	0	0	111.8	R718 E723 V724	R718-D720 VanDerWaalsContact C-N 3.32Å; R718-D720 WeakPolarHBondContact CB-OD1 3.38Å; R718-D720 IonicContact NE-OD1 3.11Å; R718-D720 IonicContact NE-OD2 2.68Å; R718-D720 IonicContact NH2-OD2 3.62Å; R718-D720 PolarHBondContact O-N 2.58Å; D720-E723 PolarHBondContact O-N 3.4Å; D720-V724 WeakPolarHBondContact O-CG2 3.31Å; D720-V724 PolarHBondContact O-N 2.76Å; D720-V724 VanDerWaalsContact O-N 3.11Å
721	Q	85	Confident	79.2	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.009	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-43	178.1	-65.5	171.8	-29.6	0	0	111.8	V659 D660 I663 R718 R719 V724 L725	V659-Q721 HydrophobicContact CG1-CB 3.93Å; V659-Q721 HydrophobicContact CG1-CG 4.1Å; D660-Q721 PolarHBondContact OD1-NE2 3.35Å; I663-Q721 HydrophobicContact CD1-CB 3.65Å; I663-Q721 HydrophobicContact CD1-CG 3.85Å; R718-Q721 HydrophobicContact CB-CG 4.18Å; R718-Q721 WeakPolarHBondContact O-CB 3.28Å; R718-Q721 PolarHBondContact O-N 2.98Å; R718-Q721 VanDerWaalsContact O-N 3.07Å; R719-Q721 VanDerWaalsContact C-N 3.3Å; R719-Q721 PolarHBondContact O-N 3.21Å; Q721-V724 PolarHBondContact O-N 2.72Å; Q721-L725 WeakPolarHBondContact O-CB 3.46Å; Q721-L725 VanDerWaalsContact O-CG 3.27Å; Q721-L725 WeakPolarHBondContact O-CG 3.34Å; Q721-L725 PolarHBondContact O-N 3.17Å
722	V	83.4	Confident	79.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-41.4	178.7	-176.8	0	0	0	0	111.3	L717 R718 R719 V724 L725 I726 L760 L764	L717-V722 HydrophobicContact CB-CG2 3.68Å; L717-V722 HydrophobicContact CD1-CG2 4.34Å; L717-V722 HydrophobicContact CG-CG2 4.48Å; R718-V722 PolarHBondContact O-N 3.49Å; R718-V722 VanDerWaalsContact O-N 3.11Å; R719-V722 PolarHBondContact O-N 3.08Å; V722-V724 PolarHBondContact O-N 3.15Å; V722-L725 PolarHBondContact O-N 3.29Å; V722-I726 HydrophobicContact CG1-CD1 4.02Å; V722-I726 WeakPolarHBondContact O-CG1 3.3Å; V722-I726 PolarHBondContact O-N 3.23Å; V722-L760 HydrophobicContact CG1-CB 4.38Å; V722-L760 HydrophobicContact CG1-CD2 4.1Å; V722-L760 WeakPolarHBondContact CG1-O 3.42Å; V722-L764 HydrophobicContact CB-CD1 4.27Å; V722-L764 HydrophobicContact CG1-CB 3.74Å; V722-L764 HydrophobicContact CG1-CD1 3.88Å; V722-L764 HydrophobicContact CG1-CG 4.4Å
723	E	85.1	Confident	80.3	Confident	81 Å²	81	60.9 Å²	60.9	38%	0.379	31%	0.305	S	S	.	.	H	α-helix	trans	-61.8	-42.7	177.2	-72.2	177.9	-173.3	0	0	111.5	R719 D720 I726 T727 L764	R719-E723 IonicContact CZ-OE1 2.62Å; R719-E723 IonicContact NE-OE1 2.94Å; R719-E723 PolarHBondContact NE-OE1 3.35Å; R719-E723 IonicContact NH2-OE1 3.43Å; R719-E723 PolarHBondContact NH2-OE1 3.32Å; R719-E723 WeakPolarHBondContact O-CG 3.38Å; R719-E723 PolarHBondContact O-N 3.37Å; D720-E723 PolarHBondContact O-N 3.4Å; E723-I726 PolarHBondContact O-N 2.85Å; E723-T727 PolarHBondContact O-N 2.97Å; E723-T727 VanDerWaalsContact O-N 3.11Å; E723-T727 PolarHBondContact O-OG1 3.47Å; E723-L764 HydrophobicContact CG-CD1 3.57Å
724	V	86.7	Confident	80.9	Confident	56 Å²	56	60.2 Å²	60.2	34%	0.339	29%	0.293	S	S	.	.	H	α-helix	trans	-67.6	-41.4	177.1	177.1	0	0	0	0	111.7	I663 V667 D720 Q721 V722 I726 T727 A728	I663-V724 HydrophobicContact CG1-CG1 4.47Å; I663-V724 HydrophobicContact CG2-CB 4.42Å; I663-V724 HydrophobicContact CG2-CG1 3.55Å; V667-V724 HydrophobicContact CG2-CG1 4Å; D720-V724 WeakPolarHBondContact O-CG2 3.31Å; D720-V724 PolarHBondContact O-N 2.76Å; D720-V724 VanDerWaalsContact O-N 3.11Å; Q721-V724 PolarHBondContact O-N 2.72Å; V722-V724 PolarHBondContact O-N 3.15Å; V724-I726 PolarHBondContact O-N 3.38Å; V724-T727 WeakPolarHBondContact O-CB 3.34Å; V724-T727 PolarHBondContact O-N 3.33Å; V724-T727 VanDerWaalsContact O-N 3.15Å; V724-A728 PolarHBondContact O-N 3.12Å
725	L	85.6	Confident	81.3	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-37.5	177.3	-73.8	169	0	0	0	112.7	V659 I662 I663 L666 L705 V708 L717 Q721 V722 T727 L729 L760	V659-L725 HydrophobicContact CG1-CD1 4.23Å; I662-L725 HydrophobicContact CG2-CD2 4.19Å; I663-L725 HydrophobicContact CD1-CG 4.15Å; I663-L725 HydrophobicContact CG1-CD2 3.76Å; I663-L725 HydrophobicContact CG1-CG 3.87Å; L666-L725 HydrophobicContact CD1-CD2 4.15Å; L705-L725 HydrophobicContact CD1-CD2 4.34Å; V708-L725 HydrophobicContact CG1-CD1 4.03Å; V708-L725 HydrophobicContact CG2-CD1 4.45Å; V708-L725 HydrophobicContact CG2-CD2 4.16Å; L717-L725 HydrophobicContact CD2-CD1 4.16Å; Q721-L725 WeakPolarHBondContact O-CB 3.46Å; Q721-L725 VanDerWaalsContact O-CG 3.27Å; Q721-L725 WeakPolarHBondContact O-CG 3.34Å; Q721-L725 PolarHBondContact O-N 3.17Å; V722-L725 PolarHBondContact O-N 3.29Å; L725-T727 VanDerWaalsContact C-N 3.32Å; L725-L729 VanDerWaalsContact O-CB 3.31Å; L725-L729 WeakPolarHBondContact O-CB 3.46Å; L725-L729 PolarHBondContact O-N 3.42Å; L725-L760 HydrophobicContact CB-CD1 4.08Å; L725-L760 HydrophobicContact CB-CD2 4.07Å; L725-L760 HydrophobicContact CD1-CD2 4.07Å
726	I	84.9	Confident	81.6	Confident	28 Å²	28	48.2 Å²	48.2	14%	0.144	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-41.6	173	-70.2	169.1	0	0	0	110.2	V722 E723 V724 L729 I730 L760 L764	V722-I726 HydrophobicContact CG1-CD1 4.02Å; V722-I726 WeakPolarHBondContact O-CG1 3.3Å; V722-I726 PolarHBondContact O-N 3.23Å; E723-I726 PolarHBondContact O-N 2.85Å; V724-I726 PolarHBondContact O-N 3.38Å; I726-L729 WeakPolarHBondContact O-CB 3.23Å; I726-L729 PolarHBondContact O-N 2.75Å; I726-I730 HydrophobicContact CG2-CD1 3.93Å; I726-I730 VanDerWaalsContact O-CG1 3.31Å; I726-I730 WeakPolarHBondContact O-CG1 3.47Å; I726-I730 PolarHBondContact O-N 2.94Å; I726-L760 HydrophobicContact CD1-CB 4.3Å; I726-L760 HydrophobicContact CG1-CB 3.88Å; I726-L760 HydrophobicContact CG1-CD1 4.26Å; I726-L764 HydrophobicContact CD1-CD1 4.08Å
727	T	86	Confident	81.8	Confident	74 Å²	74	51.3 Å²	51.3	45%	0.454	26%	0.256	S	S	.	.	H	α-helix	trans	-61.8	-49.4	178.1	-54.2	0	0	0	0	111	E723 V724 L725 L729 I730 E731	E723-T727 PolarHBondContact O-N 2.97Å; E723-T727 VanDerWaalsContact O-N 3.11Å; E723-T727 PolarHBondContact O-OG1 3.47Å; V724-T727 WeakPolarHBondContact O-CB 3.34Å; V724-T727 PolarHBondContact O-N 3.33Å; V724-T727 VanDerWaalsContact O-N 3.15Å; L725-T727 VanDerWaalsContact C-N 3.32Å; T727-L729 VanDerWaalsContact C-N 3.3Å; T727-L729 PolarHBondContact O-N 2.84Å; T727-I730 PolarHBondContact O-N 3.12Å; T727-I730 VanDerWaalsContact O-N 3.14Å; T727-E731 PolarHBondContact O-N 2.89Å; T727-E731 VanDerWaalsContact O-N 3.07Å
728	A	84	Confident	81.4	Confident	8 Å²	8	57.1 Å²	57.1	7%	0.066	29%	0.286	C	S	.	.	H	α-helix	trans	-61	-36.9	176.2	0	0	0	0	0	112.6	L666 V724 E731 L732	L666-A728 HydrophobicContact CB-CB 4.35Å; L666-A728 HydrophobicContact CD1-CB 4.37Å; V724-A728 PolarHBondContact O-N 3.12Å; A728-E731 PolarHBondContact O-N 2.82Å; A728-L732 WeakPolarHBondContact O-CB 3.41Å; A728-L732 VanDerWaalsContact O-CG 3.3Å; A728-L732 WeakPolarHBondContact O-CG 3.42Å; A728-L732 PolarHBondContact O-N 2.83Å
729	L	86.2	Confident	80.4	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-62.3	-42.4	175.2	-174.8	155	0	0	0	111.8	L705 L725 I726 T727 L732 R733 L753 I756 H757 L760	L705-L729 HydrophobicContact CD2-CB 3.95Å; L705-L729 HydrophobicContact CD2-CD1 3.84Å; L705-L729 HydrophobicContact CD2-CG 3.85Å; L725-L729 VanDerWaalsContact O-CB 3.31Å; L725-L729 WeakPolarHBondContact O-CB 3.46Å; L725-L729 PolarHBondContact O-N 3.42Å; I726-L729 WeakPolarHBondContact O-CB 3.23Å; I726-L729 PolarHBondContact O-N 2.75Å; T727-L729 VanDerWaalsContact C-N 3.3Å; T727-L729 PolarHBondContact O-N 2.84Å; L729-L732 PolarHBondContact O-N 3.16Å; L729-R733 PolarHBondContact O-N 2.74Å; L729-L753 HydrophobicContact CG-CD2 4.34Å; L729-I756 HydrophobicContact CD1-CB 4.09Å; L729-I756 HydrophobicContact CD1-CG2 3.78Å; L729-H757 HydrophobicContact CD1-CB 3.75Å; L729-H757 HydrophobicContact CD2-CB 3.83Å; L729-L760 HydrophobicContact CD1-CD1 4.08Å
730	I	83.9	Confident	79	Confident	97 Å²	97	54.6 Å²	54.6	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-64.9	-45.3	178.8	-68	164.7	0	0	0	110.2	I726 T727 L732 R733 A734	I726-I730 HydrophobicContact CG2-CD1 3.93Å; I726-I730 VanDerWaalsContact O-CG1 3.31Å; I726-I730 WeakPolarHBondContact O-CG1 3.47Å; I726-I730 PolarHBondContact O-N 2.94Å; T727-I730 PolarHBondContact O-N 3.12Å; T727-I730 VanDerWaalsContact O-N 3.14Å; I730-L732 PolarHBondContact O-N 3.34Å; I730-R733 WeakPolarHBondContact O-CB 3.33Å; I730-R733 PolarHBondContact O-N 3.36Å; I730-A734 PolarHBondContact O-N 3.19Å; I730-A734 VanDerWaalsContact O-N 3.1Å
731	E	83.1	Confident	77.4	Confident	118 Å²	118	57.6 Å²	57.6	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-59.8	-45.8	176.2	-69.8	178.1	175.1	0	0	111.7	T727 A728 R733 A734 D735	T727-E731 PolarHBondContact O-N 2.89Å; T727-E731 VanDerWaalsContact O-N 3.07Å; A728-E731 PolarHBondContact O-N 2.82Å; E731-R733 VanDerWaalsContact C-N 3.28Å; E731-R733 PolarHBondContact O-N 2.98Å; E731-A734 WeakPolarHBondContact O-CB 3.44Å; E731-A734 PolarHBondContact O-N 3.38Å; E731-A734 VanDerWaalsContact O-N 3.16Å; E731-D735 PolarHBondContact O-N 3.35Å
732	L	79.2	Confident	75.9	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-33.7	177.5	-74.6	173.5	0	0	0	113.4	L666 T698 K701 L705 A728 L729 I730 D735 L736	L666-L732 HydrophobicContact CD2-CD1 4.24Å; T698-L732 HydrophobicContact CG2-CD2 4.11Å; K701-L732 HydrophobicContact CB-CD1 4.06Å; K701-L732 HydrophobicContact CB-CD2 3.45Å; K701-L732 VanDerWaalsContact CB-CD2 3.45Å; K701-L732 HydrophobicContact CB-CG 4.4Å; K701-L732 HydrophobicContact CD-CD2 3.65Å; K701-L732 HydrophobicContact CG-CD2 4.18Å; L705-L732 HydrophobicContact CB-CD1 4.49Å; L705-L732 HydrophobicContact CD2-CD1 4.37Å; A728-L732 WeakPolarHBondContact O-CB 3.41Å; A728-L732 VanDerWaalsContact O-CG 3.3Å; A728-L732 WeakPolarHBondContact O-CG 3.42Å; A728-L732 PolarHBondContact O-N 2.83Å; L729-L732 PolarHBondContact O-N 3.16Å; I730-L732 PolarHBondContact O-N 3.34Å; L732-D735 PolarHBondContact O-N 2.94Å; L732-L736 PolarHBondContact O-N 2.79Å
733	R	80.3	Confident	74.3	Confident	93 Å²	93	68.4 Å²	68.4	35%	0.351	37%	0.365	S	S	.	.	H	α-helix	trans	-66.6	-42.8	175.3	-167.5	176.9	-171.7	155.5	6.7	110.9	L729 I730 E731 L736 D737	L729-R733 PolarHBondContact O-N 2.74Å; I730-R733 WeakPolarHBondContact O-CB 3.33Å; I730-R733 PolarHBondContact O-N 3.36Å; E731-R733 VanDerWaalsContact C-N 3.28Å; E731-R733 PolarHBondContact O-N 2.98Å; R733-L736 WeakPolarHBondContact O-CB 3.44Å; R733-L736 PolarHBondContact O-N 3.22Å; R733-D737 PolarHBondContact O-N 2.87Å; R733-D737 VanDerWaalsContact O-N 3.15Å
734	A	79.5	Confident	72.8	Confident	50 Å²	50	68.8 Å²	68.8	41%	0.413	38%	0.376	S	S	.	.	H	α-helix	trans	-62.8	-41.5	175.5	0	0	0	0	0	111.8	I730 E731 L736 D737 L738	I730-A734 PolarHBondContact O-N 3.19Å; I730-A734 VanDerWaalsContact O-N 3.1Å; E731-A734 WeakPolarHBondContact O-CB 3.44Å; E731-A734 PolarHBondContact O-N 3.38Å; E731-A734 VanDerWaalsContact O-N 3.16Å; A734-L736 PolarHBondContact O-N 3.38Å; A734-D737 PolarHBondContact O-N 3.4Å; A734-L738 WeakPolarHBondContact O-CG 3.22Å; A734-L738 PolarHBondContact O-N 3.48Å
735	D	75.2	Confident	71.4	Confident	37 Å²	37	68.5 Å²	68.5	20%	0.198	37%	0.374	C	S	.	.	H	α-helix	trans	-65	-35.6	177.1	-81.9	-6.8	0	0	0	113.2	T698 E731 L732 L738	T698-D735 HydrophobicContact CG2-CB 3.95Å; E731-D735 PolarHBondContact O-N 3.35Å; L732-D735 PolarHBondContact O-N 2.94Å; D735-L738 PolarHBondContact O-N 2.97Å
736	L	74.5	Confident	70.4	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.058	38%	0.378	C	S	.	.	H	α-helix	trans	-65.3	-42.4	174.1	-93.2	156.8	0	0	0	112.2	T698 I702 L732 R733 A734 L738 N739 M749 L753	T698-L736 HydrophobicContact CG2-CG 4.38Å; I702-L736 HydrophobicContact CD1-CD1 3.46Å; I702-L736 VanDerWaalsContact CD1-CD1 3.46Å; I702-L736 HydrophobicContact CD1-CD2 4Å; I702-L736 HydrophobicContact CD1-CG 3.83Å; I702-L736 HydrophobicContact CG1-CD1 4.34Å; L732-L736 PolarHBondContact O-N 2.79Å; R733-L736 WeakPolarHBondContact O-CB 3.44Å; R733-L736 PolarHBondContact O-N 3.22Å; A734-L736 PolarHBondContact O-N 3.38Å; L736-L738 PolarHBondContact O-N 3.14Å; L736-N739 PolarHBondContact O-N 2.98Å; L736-M749 HydrophobicContact CD2-CB 4.36Å; L736-L753 HydrophobicContact CD1-CD1 3.23Å
737	D	72	Confident	69.6	Low	104 Å²	104	71.1 Å²	71.1	56%	0.556	39%	0.394	S	S	*	.	H	α-helix	trans	-65.8	-24.7	-179.4	-71.7	-34.2	0	0	0	112	R733 A734 N739 H750	R733-D737 PolarHBondContact O-N 2.87Å; R733-D737 VanDerWaalsContact O-N 3.15Å; A734-D737 PolarHBondContact O-N 3.4Å; D737-N739 VanDerWaalsContact C-N 3.33Å; D737-H750 IonicContact OD1-CE1 2.87Å; D737-H750 PolarHBondContact OD1-CE1 3.47Å; D737-H750 IonicContact OD1-NE2 3.53Å; D737-H750 PolarHBondContact OD1-NE2 2.95Å
738	L	68.5	Low	68.9	Low	132 Å²	132	72 Å²	72	69%	0.691	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-7.8	177.2	-69.5	168	0	0	0	114.2	A734 D735 L736 P740	A734-L738 WeakPolarHBondContact O-CG 3.22Å; A734-L738 PolarHBondContact O-N 3.48Å; D735-L738 PolarHBondContact O-N 2.97Å; L736-L738 PolarHBondContact O-N 3.14Å; L738-P740 VanDerWaalsContact O-CD 3.24Å; L738-P740 WeakPolarHBondContact O-CD 3.2Å
739	N	59.5	Low	68.3	Low	87 Å²	87	72.1 Å²	72.1	47%	0.465	40%	0.395	S	S	.	.			trans	-117.7	81.4	-173.9	-122.5	-22.7	0	0	0	112	L736 D737 N741 N746	L736-N739 PolarHBondContact O-N 2.98Å; D737-N739 VanDerWaalsContact C-N 3.33Å; N739-N741 VanDerWaalsContact C-N 3.29Å; N739-N741 PolarHBondContact O-N 3.32Å; N739-N746 PolarHBondContact O-ND2 3.49Å; N739-N746 VanDerWaalsContact O-ND2 3.14Å
740	P	52.6	Low	67.9	Low	77 Å²	77	73.9 Å²	73.9	50%	0.5	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	0.1	-166.9	29.2	-35.4	0	0	0	115.8	L738 N742 M743	L738-P740 VanDerWaalsContact O-CD 3.24Å; L738-P740 WeakPolarHBondContact O-CD 3.2Å; P740-N742 VanDerWaalsContact C-N 3.29Å; P740-N742 PolarHBondContact O-N 3.43Å; P740-M743 HydrophobicContact CB-CE 4.21Å
741	N	50.7	Low	67.8	Low	145 Å²	145	71.8 Å²	71.8	78%	0.775	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	7.5	-167.4	-75.4	-12.8	0	0	0	115.9	N739	N739-N741 VanDerWaalsContact C-N 3.29Å; N739-N741 PolarHBondContact O-N 3.32Å
742	N	52.3	Low	67.7	Low	87 Å²	87	67.5 Å²	67.5	47%	0.465	38%	0.378	S	S	.	.			trans	-153.7	67.3	-179.5	-112.2	-18.7	0	0	0	113.1	P740 S744 T745 N746	P740-N742 VanDerWaalsContact C-N 3.29Å; P740-N742 PolarHBondContact O-N 3.43Å; N742-S744 PolarHBondContact O-N 3.22Å; N742-T745 WeakPolarHBondContact CB-OG1 3.12Å; N742-T745 PolarHBondContact O-N 3.17Å; N742-T745 PolarHBondContact O-OG1 3.04Å; N742-T745 VanDerWaalsContact O-OG1 3.07Å; N742-N746 WeakPolarHBondContact O-CB 3.47Å; N742-N746 PolarHBondContact O-N 2.78Å; N742-N746 VanDerWaalsContact O-N 3.12Å; N742-N746 PolarHBondContact O-OD1 3.47Å
743	M	49.9	Very low	67.8	Low	142 Å²	142	67.1 Å²	67.1	70%	0.7	38%	0.376	S	S	*	.	H	α-helix	trans	-55.6	-37.4	-170.9	-74.8	-70.7	172.6	0	0	115.4	P740 S747	P740-M743 HydrophobicContact CB-CE 4.21Å; M743-S747 PolarHBondContact O-N 3.42Å
744	S	53.5	Low	68	Low	89 Å²	89	65.5 Å²	65.5	62%	0.622	38%	0.376	S	S	*	.	H	α-helix	trans	-76	-37.7	-177.4	60.2	0	0	0	0	113.4	N742 N746 S747	N742-S744 PolarHBondContact O-N 3.22Å; S744-N746 VanDerWaalsContact C-N 3.32Å; S744-S747 PolarHBondContact O-OG 3.04Å
745	T	57.8	Low	68.1	Low	49 Å²	49	68.3 Å²	68.3	30%	0.301	38%	0.379	S	S	.	.	H	α-helix	trans	-74.7	-28.2	176.2	55.8	0	0	0	0	111.8	R699 N742 M749	R699-T745 PolarHBondContact NH2-OG1 3.27Å; N742-T745 WeakPolarHBondContact CB-OG1 3.12Å; N742-T745 PolarHBondContact O-N 3.17Å; N742-T745 PolarHBondContact O-OG1 3.04Å; N742-T745 VanDerWaalsContact O-OG1 3.07Å; T745-M749 VanDerWaalsContact O-CG 3.24Å; T745-M749 WeakPolarHBondContact O-CG 3.37Å; T745-M749 PolarHBondContact O-N 3.44Å
746	N	64	Low	68.5	Low	18 Å²	18	66.5 Å²	66.5	10%	0.096	37%	0.37	C	S	.	.	H	α-helix	trans	-70.2	-33.9	179	-70.5	-0.2	0	0	0	111.2	N739 N742 S744 M749 H750	N739-N746 PolarHBondContact O-ND2 3.49Å; N739-N746 VanDerWaalsContact O-ND2 3.14Å; N742-N746 WeakPolarHBondContact O-CB 3.47Å; N742-N746 PolarHBondContact O-N 2.78Å; N742-N746 VanDerWaalsContact O-N 3.12Å; N742-N746 PolarHBondContact O-OD1 3.47Å; S744-N746 VanDerWaalsContact C-N 3.32Å; N746-M749 PolarHBondContact O-N 2.75Å; N746-H750 PolarHBondContact O-CD2 3.34Å; N746-H750 PolarHBondContact O-N 2.68Å
747	S	68.9	Low	69	Low	68 Å²	68	68.8 Å²	68.8	48%	0.476	38%	0.38	S	S	.	.	H	α-helix	trans	-64	-43	176.9	64.8	0	0	0	0	112.8	M743 S744 M749 H750 S751	M743-S747 PolarHBondContact O-N 3.42Å; S744-S747 PolarHBondContact O-OG 3.04Å; S747-M749 VanDerWaalsContact C-N 3.34Å; S747-H750 PolarHBondContact O-N 3.34Å; S747-S751 PolarHBondContact O-N 3.5Å
748	D	70.3	Confident	69.6	Low	91 Å²	91	67.4 Å²	67.4	49%	0.487	38%	0.375	S	S	.	.	H	α-helix	trans	-65.2	-41.2	178.1	-70.8	-11.1	0	0	0	110.6	S751 L752	D748-S751 WeakPolarHBondContact O-CB 3.49Å; D748-S751 PolarHBondContact O-N 3.41Å; D748-S751 PolarHBondContact O-OG 2.76Å; D748-L752 PolarHBondContact O-N 2.87Å
749	M	72.2	Confident	70.4	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.059	36%	0.355	C	S	.	.	H	α-helix	trans	-65.8	-40.5	176.2	-68	-67.3	-107.2	0	0	112.4	F582 R699 I702 L736 T745 N746 S747 S751 L752 L753	F582-M749 HydrophobicContact CD2-CE 4.13Å; F582-M749 HydrophobicContact CD2-SD 4.14Å; R699-M749 HydrophobicContact CB-CE 4.3Å; R699-M749 HydrophobicContact CG-CE 4.08Å; I702-M749 HydrophobicContact CB-CE 3.71Å; I702-M749 HydrophobicContact CD1-CE 3.62Å; I702-M749 HydrophobicContact CG1-CE 4.28Å; I702-M749 HydrophobicContact CG2-CE 3.45Å; I702-M749 VanDerWaalsContact CG2-CE 3.45Å; I702-M749 HydrophobicContact CG2-SD 3.84Å; L736-M749 HydrophobicContact CD2-CB 4.36Å; T745-M749 VanDerWaalsContact O-CG 3.24Å; T745-M749 WeakPolarHBondContact O-CG 3.37Å; T745-M749 PolarHBondContact O-N 3.44Å; N746-M749 PolarHBondContact O-N 2.75Å; S747-M749 VanDerWaalsContact C-N 3.34Å; M749-S751 VanDerWaalsContact C-N 3.3Å; M749-S751 PolarHBondContact O-N 3.41Å; M749-L752 PolarHBondContact O-N 3.13Å; M749-L752 HydrophobicContact SD-CD2 4.45Å; M749-L753 WeakPolarHBondContact O-CG 3.02Å; M749-L753 PolarHBondContact O-N 3.11Å
750	H	78.5	Confident	71.5	Confident	37 Å²	37	58.8 Å²	58.8	17%	0.171	33%	0.333	C	S	.	.	H	α-helix	trans	-63.3	-37.4	172.4	-80.7	-65.3	0	0	0	112	D737 N746 S747 L752 T754	D737-H750 IonicContact OD1-CE1 2.87Å; D737-H750 PolarHBondContact OD1-CE1 3.47Å; D737-H750 IonicContact OD1-NE2 3.53Å; D737-H750 PolarHBondContact OD1-NE2 2.95Å; N746-H750 PolarHBondContact O-CD2 3.34Å; N746-H750 PolarHBondContact O-N 2.68Å; S747-H750 PolarHBondContact O-N 3.34Å; H750-L752 VanDerWaalsContact C-N 3.35Å; H750-T754 WeakPolarHBondContact O-CB 3.32Å; H750-T754 PolarHBondContact O-N 3.11Å; H750-T754 PolarHBondContact O-OG1 3.25Å
751	S	81.3	Confident	73	Confident	53 Å²	53	57.3 Å²	57.3	37%	0.371	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-42	175.5	90.6	0	0	0	0	111.2	S747 D748 M749 T754 K755	S747-S751 PolarHBondContact O-N 3.5Å; D748-S751 WeakPolarHBondContact O-CB 3.49Å; D748-S751 PolarHBondContact O-N 3.41Å; D748-S751 PolarHBondContact O-OG 2.76Å; M749-S751 VanDerWaalsContact C-N 3.3Å; M749-S751 PolarHBondContact O-N 3.41Å; S751-T754 PolarHBondContact O-N 2.86Å; S751-K755 WeakPolarHBondContact O-CG 3.36Å; S751-K755 PolarHBondContact O-N 3.48Å
752	L	80.3	Confident	74.5	Confident	28 Å²	28	57.5 Å²	57.5	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-64.1	-50	177.9	-178.6	66.4	0	0	0	110.9	F582 I702 A706 D748 M749 H750 T754 K755 I756	F582-L752 HydrophobicContact CE1-CD2 4.46Å; F582-L752 HydrophobicContact CE2-CD2 4.19Å; F582-L752 HydrophobicContact CZ-CD2 3.94Å; I702-L752 HydrophobicContact CG2-CD2 4.27Å; A706-L752 HydrophobicContact CB-CD2 4.2Å; D748-L752 PolarHBondContact O-N 2.87Å; M749-L752 PolarHBondContact O-N 3.13Å; M749-L752 HydrophobicContact SD-CD2 4.45Å; H750-L752 VanDerWaalsContact C-N 3.35Å; L752-T754 VanDerWaalsContact C-N 3.27Å; L752-T754 PolarHBondContact O-N 3.04Å; L752-K755 WeakPolarHBondContact O-CB 3.46Å; L752-K755 PolarHBondContact O-N 3.35Å; L752-K755 VanDerWaalsContact O-N 3.15Å; L752-I756 HydrophobicContact CD1-CD1 4.37Å; L752-I756 HydrophobicContact CG-CD1 4.02Å; L752-I756 WeakPolarHBondContact O-CG1 3.38Å; L752-I756 PolarHBondContact O-N 2.87Å
753	L	82	Confident	75.8	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-37.4	176.9	-71.3	175.4	0	0	0	112.1	I702 L705 L729 L736 M749 I756 H757	I702-L753 HydrophobicContact CG1-CD2 4.45Å; I702-L753 HydrophobicContact CG2-CD2 4.26Å; L705-L753 HydrophobicContact CD2-CD2 3.48Å; L705-L753 VanDerWaalsContact CD2-CD2 3.48Å; L729-L753 HydrophobicContact CG-CD2 4.34Å; L736-L753 HydrophobicContact CD1-CD1 3.23Å; M749-L753 WeakPolarHBondContact O-CG 3.02Å; M749-L753 PolarHBondContact O-N 3.11Å; L753-I756 PolarHBondContact O-N 3.43Å; L753-H757 WeakPolarHBondContact O-CB 3.34Å; L753-H757 PolarHBondContact O-N 2.95Å
754	T	83.8	Confident	77.3	Confident	58 Å²	58	49.1 Å²	49.1	36%	0.356	28%	0.278	S	S	.	.	H	α-helix	trans	-65.3	-42.5	176	-56.4	0	0	0	0	111.4	H750 S751 L752 H757 V758	H750-T754 WeakPolarHBondContact O-CB 3.32Å; H750-T754 PolarHBondContact O-N 3.11Å; H750-T754 PolarHBondContact O-OG1 3.25Å; S751-T754 PolarHBondContact O-N 2.86Å; L752-T754 VanDerWaalsContact C-N 3.27Å; L752-T754 PolarHBondContact O-N 3.04Å; T754-H757 PolarHBondContact O-N 2.81Å; T754-V758 WeakPolarHBondContact O-CG2 3.29Å; T754-V758 PolarHBondContact O-N 3.3Å
755	K	83.2	Confident	78.7	Confident	109 Å²	109	46.8 Å²	46.8	47%	0.474	27%	0.265	S	S	.	.	H	α-helix	trans	-62.3	-41.8	175.3	-72.6	173.1	-178.8	174.1	0	112	S751 L752 S759	S751-K755 WeakPolarHBondContact O-CG 3.36Å; S751-K755 PolarHBondContact O-N 3.48Å; L752-K755 WeakPolarHBondContact O-CB 3.46Å; L752-K755 PolarHBondContact O-N 3.35Å; L752-K755 VanDerWaalsContact O-N 3.15Å; K755-S759 PolarHBondContact O-N 2.83Å; K755-S759 VanDerWaalsContact O-N 3.15Å; K755-S759 PolarHBondContact O-OG 3.48Å
756	I	82.6	Confident	79.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-44.4	176.5	-64.3	165.6	0	0	0	110	L705 A706 L729 L752 L753 V758 S759 L760	L705-I756 HydrophobicContact CD2-CD1 4.36Å; L705-I756 HydrophobicContact CD2-CG2 4.19Å; L705-I756 HydrophobicContact CG-CG2 4.39Å; A706-I756 HydrophobicContact CB-CD1 4.2Å; L729-I756 HydrophobicContact CD1-CB 4.09Å; L729-I756 HydrophobicContact CD1-CG2 3.78Å; L752-I756 HydrophobicContact CD1-CD1 4.37Å; L752-I756 HydrophobicContact CG-CD1 4.02Å; L752-I756 WeakPolarHBondContact O-CG1 3.38Å; L752-I756 PolarHBondContact O-N 2.87Å; L753-I756 PolarHBondContact O-N 3.43Å; I756-V758 PolarHBondContact O-N 3.01Å; I756-S759 PolarHBondContact O-N 2.65Å; I756-S759 VanDerWaalsContact O-N 3.08Å; I756-L760 HydrophobicContact CG2-CD1 3.82Å; I756-L760 HydrophobicContact CG2-CG 4.32Å; I756-L760 PolarHBondContact O-N 2.81Å
757	H	85.4	Confident	80.3	Confident	59 Å²	59	46.8 Å²	46.8	27%	0.273	27%	0.267	S	S	.	.	H	α-helix	trans	-60.2	-46	179.2	-166.3	177.4	0	0	0	112	L729 L753 T754 S759 L760 A761	L729-H757 HydrophobicContact CD1-CB 3.75Å; L729-H757 HydrophobicContact CD2-CB 3.83Å; L753-H757 WeakPolarHBondContact O-CB 3.34Å; L753-H757 PolarHBondContact O-N 2.95Å; T754-H757 PolarHBondContact O-N 2.81Å; H757-S759 PolarHBondContact O-N 3.45Å; H757-L760 PolarHBondContact O-N 3.42Å; H757-A761 WeakPolarHBondContact O-CB 3.06Å; H757-A761 PolarHBondContact O-N 2.97Å
758	V	85	Confident	80.4	Confident	75 Å²	75	48.1 Å²	48.1	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-60.5	-37.7	175.8	172.4	0	0	0	0	111.3	T754 I756 K762	T754-V758 WeakPolarHBondContact O-CG2 3.29Å; T754-V758 PolarHBondContact O-N 3.3Å; I756-V758 PolarHBondContact O-N 3.01Å; V758-K762 WeakPolarHBondContact O-CG 3.49Å; V758-K762 PolarHBondContact O-N 3.19Å; V758-K762 VanDerWaalsContact O-N 3.11Å
759	S	83.7	Confident	80.1	Confident	37 Å²	37	51.8 Å²	51.8	26%	0.259	28%	0.276	S	S	.	.	H	α-helix	trans	-72.3	-41.8	-179.6	-55.2	0	0	0	0	111.9	K755 I756 H757 K762 E763	K755-S759 PolarHBondContact O-N 2.83Å; K755-S759 VanDerWaalsContact O-N 3.15Å; K755-S759 PolarHBondContact O-OG 3.48Å; I756-S759 PolarHBondContact O-N 2.65Å; I756-S759 VanDerWaalsContact O-N 3.08Å; H757-S759 PolarHBondContact O-N 3.45Å; S759-K762 WeakPolarHBondContact O-CB 3.28Å; S759-K762 PolarHBondContact O-N 3.48Å; S759-E763 PolarHBondContact O-N 3.22Å
760	L	83.7	Confident	79.3	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-39.7	173	-77.5	167.4	0	0	0	111.9	V708 L712 V722 L725 I726 L729 I756 H757 K762 E763 L764	V708-L760 HydrophobicContact CG1-CD2 4.35Å; L712-L760 HydrophobicContact CD1-CG 4.45Å; L712-L760 HydrophobicContact CD2-CD2 3.72Å; L712-L760 HydrophobicContact CD2-CG 4.21Å; V722-L760 HydrophobicContact CG1-CB 4.38Å; V722-L760 HydrophobicContact CG1-CD2 4.1Å; V722-L760 WeakPolarHBondContact CG1-O 3.42Å; L725-L760 HydrophobicContact CB-CD1 4.08Å; L725-L760 HydrophobicContact CB-CD2 4.07Å; L725-L760 HydrophobicContact CD1-CD2 4.07Å; I726-L760 HydrophobicContact CD1-CB 4.3Å; I726-L760 HydrophobicContact CG1-CB 3.88Å; I726-L760 HydrophobicContact CG1-CD1 4.26Å; L729-L760 HydrophobicContact CD1-CD1 4.08Å; I756-L760 HydrophobicContact CG2-CD1 3.82Å; I756-L760 HydrophobicContact CG2-CG 4.32Å; I756-L760 PolarHBondContact O-N 2.81Å; H757-L760 PolarHBondContact O-N 3.42Å; L760-K762 VanDerWaalsContact C-N 3.31Å; L760-K762 PolarHBondContact O-N 2.82Å; L760-E763 PolarHBondContact O-N 3.24Å; L760-L764 WeakPolarHBondContact O-CB 3.29Å; L760-L764 PolarHBondContact O-N 3.06Å
761	A	83.8	Confident	77.6	Confident	46 Å²	46	59 Å²	59	38%	0.38	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-36.2	176.3	0	0	0	0	0	112.2	H757 A765	H757-A761 WeakPolarHBondContact O-CB 3.06Å; H757-A761 PolarHBondContact O-N 2.97Å; A761-A765 WeakPolarHBondContact O-CB 3.29Å; A761-A765 PolarHBondContact O-N 2.93Å
762	K	82.5	Confident	75.3	Confident	148 Å²	148	61 Å²	61	64%	0.643	35%	0.346	S	S	*	.	H	α-helix	trans	-65.5	-42.1	172.9	-75.4	176.5	-179.7	-176.2	0	112	V758 S759 L760 A765 S766	V758-K762 WeakPolarHBondContact O-CG 3.49Å; V758-K762 PolarHBondContact O-N 3.19Å; V758-K762 VanDerWaalsContact O-N 3.11Å; S759-K762 WeakPolarHBondContact O-CB 3.28Å; S759-K762 PolarHBondContact O-N 3.48Å; L760-K762 VanDerWaalsContact C-N 3.31Å; L760-K762 PolarHBondContact O-N 2.82Å; K762-A765 PolarHBondContact O-N 3.44Å; K762-S766 PolarHBondContact O-N 2.97Å
763	E	80	Confident	72.9	Confident	13 Å²	13	67 Å²	67	6%	0.061	38%	0.378	C	S	.	.	H	α-helix	trans	-68.4	-39.6	175.2	-82.4	-69.7	-165.2	0	0	112.5	L712 G713 L717 S759 L760 A765 S766 T767	L712-E763 HydrophobicContact CD2-CB 4.24Å; L712-E763 HydrophobicContact CD2-CG 3.78Å; G713-E763 WeakPolarHBondContact CA-OE1 3.26Å; G713-E763 PolarHBondContact N-OE1 3.06Å; L717-E763 HydrophobicContact CD1-CG 4.47Å; S759-E763 PolarHBondContact O-N 3.22Å; L760-E763 PolarHBondContact O-N 3.24Å; E763-A765 VanDerWaalsContact C-N 3.26Å; E763-A765 PolarHBondContact O-N 3.17Å; E763-S766 WeakPolarHBondContact O-CB 3.34Å; E763-S766 PolarHBondContact O-N 3.39Å; E763-S766 VanDerWaalsContact O-N 3.07Å; E763-S766 PolarHBondContact O-OG 3.29Å; E763-S766 PolarHBondContact OE2-OG 2.97Å; E763-T767 WeakPolarHBondContact O-CG2 3.39Å; E763-T767 PolarHBondContact O-N 3.36Å
764	L	81.7	Confident	70.6	Confident	40 Å²	40	74.1 Å²	74.1	21%	0.209	42%	0.422	C	S	.	.	H	α-helix	trans	-56.8	-46	172.7	-169.6	116.4	0	0	0	110.3	V722 E723 I726 L760 S766 T767 F768	V722-L764 HydrophobicContact CB-CD1 4.27Å; V722-L764 HydrophobicContact CG1-CB 3.74Å; V722-L764 HydrophobicContact CG1-CD1 3.88Å; V722-L764 HydrophobicContact CG1-CG 4.4Å; E723-L764 HydrophobicContact CG-CD1 3.57Å; I726-L764 HydrophobicContact CD1-CD1 4.08Å; L760-L764 WeakPolarHBondContact O-CB 3.29Å; L760-L764 PolarHBondContact O-N 3.06Å; L764-S766 PolarHBondContact O-N 2.94Å; L764-T767 PolarHBondContact O-N 3.17Å; L764-T767 PolarHBondContact O-OG1 3.42Å; L764-F768 HydrophobicContact CD2-CE2 3.69Å; L764-F768 HydrophobicContact CG-CE2 3.99Å; L764-F768 WeakPolarHBondContact O-CD2 3.38Å
765	A	81.1	Confident	68.1	Low	41 Å²	41	78.4 Å²	78.4	34%	0.339	44%	0.441	S	S	.	.	H	α-helix	trans	-60.3	-42.4	175.2	0	0	0	0	0	112.2	A761 K762 E763 T767 F768 F769	A761-A765 WeakPolarHBondContact O-CB 3.29Å; A761-A765 PolarHBondContact O-N 2.93Å; K762-A765 PolarHBondContact O-N 3.44Å; E763-A765 VanDerWaalsContact C-N 3.26Å; E763-A765 PolarHBondContact O-N 3.17Å; A765-T767 VanDerWaalsContact C-N 3.29Å; A765-T767 PolarHBondContact O-N 2.85Å; A765-F768 PolarHBondContact O-N 3.43Å; A765-F769 WeakPolarHBondContact O-CD2 3.47Å
766	S	79.7	Confident	65.5	Low	38 Å²	38	78.6 Å²	78.6	27%	0.266	46%	0.456	S	S	.	.	H	α-helix	trans	-59.1	-39.3	178.5	85.9	0	0	0	0	111.8	K762 E763 L764 F768 F769 A770	K762-S766 PolarHBondContact O-N 2.97Å; E763-S766 WeakPolarHBondContact O-CB 3.34Å; E763-S766 PolarHBondContact O-N 3.39Å; E763-S766 VanDerWaalsContact O-N 3.07Å; E763-S766 PolarHBondContact O-OG 3.29Å; E763-S766 PolarHBondContact OE2-OG 2.97Å; L764-S766 PolarHBondContact O-N 2.94Å; S766-F768 PolarHBondContact O-N 2.74Å; S766-F769 PolarHBondContact O-N 2.97Å; S766-A770 PolarHBondContact O-N 3.46Å
767	T	75.8	Confident	63	Low	29 Å²	29	85.7 Å²	85.7	18%	0.178	49%	0.493	C	S	.	.	H	α-helix	trans	-64.3	-26.3	179.7	66.4	0	0	0	0	113.4	E763 L764 A765 F769	E763-T767 WeakPolarHBondContact O-CG2 3.39Å; E763-T767 PolarHBondContact O-N 3.36Å; L764-T767 PolarHBondContact O-N 3.17Å; L764-T767 PolarHBondContact O-OG1 3.42Å; A765-T767 VanDerWaalsContact C-N 3.29Å; A765-T767 PolarHBondContact O-N 2.85Å; T767-F769 VanDerWaalsContact C-N 3.33Å
768	F	71.1	Confident	60.6	Low	96 Å²	96	88.2 Å²	88.2	42%	0.421	52%	0.517	S	S	.	.	H	α-helix	trans	-74.9	-22.6	174.7	-72.5	-79.8	0	0	0	113.4	L764 A765 S766	L764-F768 HydrophobicContact CD2-CE2 3.69Å; L764-F768 HydrophobicContact CG-CE2 3.99Å; L764-F768 WeakPolarHBondContact O-CD2 3.38Å; A765-F768 PolarHBondContact O-N 3.43Å; S766-F768 PolarHBondContact O-N 2.74Å
769	F	64.8	Low	58.1	Low	168 Å²	168	89.6 Å²	89.6	74%	0.737	53%	0.528	S	S	*	.	H	α-helix	trans	-96.3	-11	-179.8	-63.8	-70.4	0	0	0	113.2	A765 S766 T767 T771	A765-F769 WeakPolarHBondContact O-CD2 3.47Å; S766-F769 PolarHBondContact O-N 2.97Å; T767-F769 VanDerWaalsContact C-N 3.33Å; F769-T771 PolarHBondContact O-N 2.93Å
770	A	56.3	Low	55.6	Low	82 Å²	82	93.5 Å²	93.5	68%	0.678	56%	0.555	S	S	*	*	S	Bend	trans	-73.3	-6.5	-179	0	0	0	0	0	114.4	S766 S772	S766-A770 PolarHBondContact O-N 3.46Å; A770-S772 PolarHBondContact O-N 2.95Å
771	T	41.8	Very low	53	Low	118 Å²	118	100.8 Å²	100.8	72%	0.724	59%	0.593	S	S	*	*	S	Bend	trans	-98	42.4	-177.6	52.2	0	0	0	0	113.3	F769	F769-T771 PolarHBondContact O-N 2.93Å
772	S	33.7	Very low	50.3	Low	95 Å²	95	103.2 Å²	103.2	66%	0.664	61%	0.607	S	S	*	*	S	Bend	trans	-163.1	117.6	165.3	-67.6	0	0	0	0	109	A770	A770-S772 PolarHBondContact O-N 2.95Å
773	D	30	Very low	47.9	Very low	154 Å²	154	101.6 Å²	101.6	82%	0.824	61%	0.612	S	S	*	*			trans	72.5	98.5	173.9	-54.3	-29.6	0	0	0	117.2
774	T	33.9	Very low	45.4	Very low	149 Å²	149	108.4 Å²	108.4	91%	0.914	65%	0.649	S	S	*	*				-172.8	130.5	118.4	23.6	0	0	0	0	113
775	I	31.2	Very low	42.9	Very low	148 Å²	148	111.9 Å²	111.9	76%	0.759	68%	0.676	S	S	*	*			trans	-58.5	146.8	172.1	-70	154.5	0	0	0	110.6	I777	I775-I777 PolarHBondContact O-N 2.9Å
776	S	27.8	Very low	40.4	Very low	114 Å²	114	118.6 Å²	118.6	80%	0.797	70%	0.703	S	S	*	*			trans	-50.4	108.1	170.6	54.5	0	0	0	0	111.9
777	I	30	Very low	38	Very low	149 Å²	149	122.9 Å²	122.9	76%	0.764	73%	0.727	S	S	*	*			trans	-127	110.8	159.2	-59	177.3	0	0	0	106.8	I775 P779	I775-I777 PolarHBondContact O-N 2.9Å; I777-P779 WeakPolarHBondContact O-CD 3.44Å
778	S	34.1	Very low	35.7	Very low	112 Å²	112	128.6 Å²	128.6	78%	0.783	76%	0.757	S	S	*	*			trans	-57.1	138.6	170.4	-33.1	0	0	0	0	110.3
779	P	34.2	Very low	33.6	Very low	104 Å²	104	129 Å²	129	68%	0.675	77%	0.767	S	S	*	*			trans	-119.6	108.6	153.4	27.7	-10.6	0	0	0	109.4	I777 L781	I777-P779 WeakPolarHBondContact O-CD 3.44Å; P779-L781 HydrophobicContact CB-CD1 4.24Å; P779-L781 PolarHBondContact O-N 3.33Å
780	S	29.8	Very low	31.9	Very low	119 Å²	119	127.4 Å²	127.4	83%	0.832	77%	0.766	S	S	*	*			trans	-58.9	119.2	146.2	52.2	0	0	0	0	108
781	L	30.2	Very low	30.5	Very low	153 Å²	153	133.6 Å²	133.6	80%	0.801	77%	0.772	S	S	*	*			trans	-142.6	121.9	161.7	-103.6	129.7	0	0	0	111.2	P779	P779-L781 HydrophobicContact CB-CD1 4.24Å; P779-L781 PolarHBondContact O-N 3.33Å
782	S	26.8	Very low	29.9	Very low	97 Å²	97	138.2 Å²	138.2	68%	0.678	79%	0.785	S	S	*	*			trans	-53.7	151.5	169.4	49.5	0	0	0	0	113.3	N784	S782-N784 PolarHBondContact O-N 2.89Å
783	P	31.4	Very low	29.8	Very low	115 Å²	115	140.4 Å²	140.4	75%	0.747	79%	0.791	S	S	*	*	S	Bend	trans	-80.5	117.2	170.4	33.2	-27.4	0	0	0	108.5
784	N	29.3	Very low	29.7	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	79%	0.79	S	S	*	*			trans	155.4	100.4	149.8	-82.5	-23.6	0	0	0	110.1	S782	S782-N784 PolarHBondContact O-N 2.89Å
785	S	28.3	Very low	29.5	Very low	113 Å²	113	139.2 Å²	139.2	79%	0.79	78%	0.783	S	S	*	*			trans	-176.7	126	133.4	59.7	0	0	0	0	112
786	M	27.9	Very low	29.4	Very low	181 Å²	181	138.6 Å²	138.6	89%	0.892	78%	0.784	S	S	*	*			trans	71.1	90.6	149.7	-59.6	-169	80.4	0	0	118.2	D788	M786-D788 PolarHBondContact O-N 3.29Å
787	V	30.4	Very low	29.5	Very low	128 Å²	128	140.2 Å²	140.2	78%	0.776	78%	0.783	S	S	*	*			trans	-55.4	115.3	147.5	174.7	0	0	0	0	108.4	T789	V787-T789 HydrophobicContact CG1-CG2 4.15Å; V787-T789 PolarHBondContact O-N 3.31Å
788	D	26.3	Very low	29.5	Very low	149 Å²	149	139.6 Å²	139.6	80%	0.797	79%	0.785	S	S	*	*			trans	-80.7	107.5	168.3	-131.9	-15.2	0	0	0	108.4	M786 N790	M786-D788 PolarHBondContact O-N 3.29Å; D788-N790 VanDerWaalsContact C-N 3.27Å; D788-N790 PolarHBondContact O-N 3.02Å
789	T	28.7	Very low	29.2	Very low	106 Å²	106	141.6 Å²	141.6	65%	0.65	79%	0.785	S	S	*	*			trans	-80.2	60.5	-173.3	47.7	0	0	0	0	112.2	V787	V787-T789 HydrophobicContact CG1-CG2 4.15Å; V787-T789 PolarHBondContact O-N 3.31Å
790	N	27.4	Very low	28.8	Very low	133 Å²	133	144.5 Å²	144.5	71%	0.711	79%	0.793	S	S	*	*			trans	-141.5	31.7	-179.4	-100.9	-18.3	0	0	0	115.1	D788	D788-N790 VanDerWaalsContact C-N 3.27Å; D788-N790 PolarHBondContact O-N 3.02Å
791	W	27.7	Very low	28.7	Very low	213 Å²	213	146.6 Å²	146.6	81%	0.807	79%	0.79	S	S	*	*			trans	-147.3	84.6	166.2	-73.8	85.9	0	0	0	109.6
792	H	29.9	Very low	28.6	Very low	215 Å²	215	146 Å²	146	100%	0.995	79%	0.789	S	S	*	*			trans	-83.8	0	166.2	-85.9	-52	0	0	0	111.3

Retrieved 792 of 792 residues in 1142.7 ms (Link to these results)

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