G4VET4_SCHMA Loading...

E3 ubiquitin-protein ligase MARCHF5

AlphaFold DB , UniProt , Accession G4VET4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 281 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	43.1	Very low	47.2	Very low	240 Å²	240	150.7 Å²	150.7	100%	1.182	81%	0.812	S	S	*	*				0	122.4	0	-75.6	177.1	174.9	0	0	106.6	E3	M1-E3 PolarHBondContact O-N 3.46Å
2	L	45.3	Very low	47.4	Very low	178 Å²	178	149.8 Å²	149.8	93%	0.932	80%	0.804	S	S	*	*			trans	-74.6	115	-175.7	-77.9	153.1	0	0	0	109.6	Q4	L2-Q4 PolarHBondContact O-N 3.49Å
3	E	44.6	Very low	47.8	Very low	191 Å²	191	145.1 Å²	145.1	89%	0.893	79%	0.786	S	S	*	*			trans	-73.2	105.4	170.9	-70.3	179.9	147.1	0	0	108.8	M1 S5	M1-E3 PolarHBondContact O-N 3.46Å; E3-S5 PolarHBondContact O-N 3.05Å; E3-S5 VanDerWaalsContact O-N 3.15Å
4	Q	45.9	Very low	48.7	Very low	181 Å²	181	148.1 Å²	148.1	85%	0.846	79%	0.788	S	S	*	*			trans	-73.7	100.1	171.7	-75.8	177.8	-20.1	0	0	108.9	L2 V6	L2-Q4 PolarHBondContact O-N 3.49Å; Q4-V6 PolarHBondContact O-N 2.74Å; Q4-V6 VanDerWaalsContact O-N 3.09Å
5	S	48.9	Very low	50.1	Low	112 Å²	112	144.5 Å²	144.5	78%	0.783	77%	0.765	S	S	*	*			trans	-67.4	102.6	168.7	58.5	0	0	0	0	109.3	E3 N7	E3-S5 PolarHBondContact O-N 3.05Å; E3-S5 VanDerWaalsContact O-N 3.15Å; S5-N7 PolarHBondContact O-N 3.07Å; S5-N7 VanDerWaalsContact O-N 3.09Å
6	V	51.2	Low	52	Low	124 Å²	124	142 Å²	142	75%	0.752	75%	0.752	S	S	*	*			trans	-66.9	106.7	170.1	-179.5	0	0	0	0	107.6	Q4 V8	Q4-V6 PolarHBondContact O-N 2.74Å; Q4-V6 VanDerWaalsContact O-N 3.09Å; V6-V8 VanDerWaalsContact C-N 3.29Å; V6-V8 HydrophobicContact CG1-CG2 3.99Å; V6-V8 PolarHBondContact O-N 3.41Å
7	N	46.1	Very low	54.1	Low	152 Å²	152	136.3 Å²	136.3	81%	0.813	72%	0.719	S	S	*	*			trans	-71	87.4	172.6	-171.5	-6.6	0	0	0	108.5	S5 S9	S5-N7 PolarHBondContact O-N 3.07Å; S5-N7 VanDerWaalsContact O-N 3.09Å; N7-S9 PolarHBondContact O-N 2.99Å
8	V	46.8	Very low	56.1	Low	116 Å²	116	131 Å²	131	70%	0.703	69%	0.693	S	S	*	*			trans	-73.8	86.2	168.8	-176.1	0	0	0	0	106.8	V6	V6-V8 VanDerWaalsContact C-N 3.29Å; V6-V8 HydrophobicContact CG1-CG2 3.99Å; V6-V8 PolarHBondContact O-N 3.41Å
9	S	47.6	Very low	58	Low	89 Å²	89	124.1 Å²	124.1	62%	0.622	66%	0.657	S	S	*	*			trans	-57.6	125.8	161.1	178.1	0	0	0	0	107	N7 F11	N7-S9 PolarHBondContact O-N 2.99Å; S9-F11 PolarHBondContact O-N 3.43Å; S9-F11 VanDerWaalsContact O-N 3.09Å
10	P	50.8	Low	59.6	Low	95 Å²	95	121.3 Å²	121.3	62%	0.617	64%	0.637	S	S	*	*			trans	-58.6	122.1	180	21.7	-30.1	0	0	0	108.5	I12	P10-I12 VanDerWaalsContact C-N 3.25Å; P10-I12 PolarHBondContact O-N 3.46Å
11	F	48.6	Very low	61.2	Low	180 Å²	180	118.2 Å²	118.2	79%	0.789	62%	0.62	S	S	*	*			trans	-63.2	93.6	168.1	-178.8	-94.8	0	0	0	106.7	S9 P13	S9-F11 PolarHBondContact O-N 3.43Å; S9-F11 VanDerWaalsContact O-N 3.09Å; F11-P13 HydrophobicContact CD1-CB 4.34Å; F11-P13 HydrophobicContact CD1-CG 4.26Å; F11-P13 HydrophobicContact CE1-CB 3.95Å; F11-P13 HydrophobicContact CE1-CG 4.32Å; F11-P13 WeakPolarHBondContact O-CD 3.25Å
12	I	49.5	Very low	63.5	Low	140 Å²	140	109.4 Å²	109.4	72%	0.718	58%	0.582	S	S	*	*			trans	-72.5	107.5	167	-58.9	170.9	0	0	0	104	P10 K14	P10-I12 VanDerWaalsContact C-N 3.25Å; P10-I12 PolarHBondContact O-N 3.46Å; I12-K14 PolarHBondContact O-N 2.95Å
13	P	53.1	Low	65.6	Low	88 Å²	88	107.1 Å²	107.1	57%	0.571	57%	0.57	S	S	*	*			trans	-60.5	119	176.6	-5.4	19.2	0	0	0	106.1	F11 E15	F11-P13 HydrophobicContact CD1-CB 4.34Å; F11-P13 HydrophobicContact CD1-CG 4.26Å; F11-P13 HydrophobicContact CE1-CB 3.95Å; F11-P13 HydrophobicContact CE1-CG 4.32Å; F11-P13 WeakPolarHBondContact O-CD 3.25Å; P13-E15 PolarHBondContact O-N 3.21Å
14	K	60.8	Low	67.7	Low	188 Å²	188	100 Å²	100	82%	0.817	54%	0.542	S	S	*	.			trans	-58.1	111.2	164.9	-85.5	-177.6	174.8	178.8	0	105.5	I12 D16	I12-K14 PolarHBondContact O-N 2.95Å; K14-D16 PolarHBondContact O-N 3.42Å
15	E	69.2	Low	69.6	Low	94 Å²	94	92.3 Å²	92.3	44%	0.439	51%	0.507	S	S	.	.			trans	-71.6	102.9	176.2	-170.8	180	-172.9	0	0	106.8	P13 K17 K46	P13-E15 PolarHBondContact O-N 3.21Å; E15-K17 PolarHBondContact O-N 2.82Å; E15-K17 VanDerWaalsContact O-N 3.07Å; E15-K46 VanDerWaalsContact OE1-CE 3.31Å; E15-K46 WeakPolarHBondContact OE1-CE 3.37Å; E15-K46 IonicContact OE1-NZ 3.67Å; E15-K46 PolarHBondContact OE1-NZ 3.39Å; E15-K46 WeakPolarHBondContact OE2-CE 3.31Å; E15-K46 IonicContact OE2-NZ 2.59Å; E15-K46 PolarHBondContact OE2-NZ 3.44Å
16	D	80.9	Confident	71.3	Confident	104 Å²	104	91 Å²	91	56%	0.556	49%	0.489	S	S	*	.			trans	-56.6	115.8	177.4	-67	-32.5	0	0	0	108.8	K14	K14-D16 PolarHBondContact O-N 3.42Å
17	K	87.8	Confident	72.6	Confident	45 Å²	45	90.4 Å²	90.4	20%	0.196	49%	0.485	C	S	.	.			trans	-76.2	130.5	179.3	-53.2	175.5	-163.8	126.2	0	107.9	E15 S25 E26 W35 W47	E15-K17 PolarHBondContact O-N 2.82Å; E15-K17 VanDerWaalsContact O-N 3.07Å; K17-S25 CarbonylContact O-C 3.38Å; K17-S25 VanDerWaalsContact O-CA 3.3Å; K17-S25 WeakPolarHBondContact O-CA 3.25Å; K17-E26 HydrophobicContact CB-CB 4.25Å; K17-E26 WeakPolarHBondContact CD-OE2 3.38Å; K17-E26 WeakPolarHBondContact CE-OE2 3.36Å; K17-E26 WeakPolarHBondContact CG-OE2 3.49Å; K17-E26 VanDerWaalsContact NZ-CD 3.3Å; K17-E26 IonicContact NZ-OE1 3.06Å; K17-E26 PolarHBondContact NZ-OE1 3.08Å; K17-E26 IonicContact NZ-OE2 2.8Å; K17-E26 PolarHBondContact NZ-OE2 3.3Å; K17-E26 PolarHBondContact O-N 3.36Å; K17-W35 HydrophobicContact CB-CD2 4.09Å; K17-W35 HydrophobicContact CB-CE3 3.85Å; K17-W35 HydrophobicContact CB-CH2 3.77Å; K17-W35 HydrophobicContact CB-CZ2 4.03Å; K17-W35 HydrophobicContact CB-CZ3 3.68Å; K17-W35 HydrophobicContact CD-CB 4.4Å; K17-W35 HydrophobicContact CD-CD2 3.9Å; K17-W35 HydrophobicContact CD-CE3 4.25Å; K17-W35 HydrophobicContact CD-CG 3.97Å; K17-W35 WeakPolarHBondContact O-CH2 3.41Å; K17-W47 HydrophobicContact CB-CB 4.22Å; K17-W47 HydrophobicContact CB-CD2 4.15Å; K17-W47 HydrophobicContact CB-CG 3.94Å; K17-W47 HydrophobicContact CD-CD2 3.93Å; K17-W47 HydrophobicContact CD-CE3 3.78Å; K17-W47 HydrophobicContact CD-CH2 3.99Å; K17-W47 HydrophobicContact CD-CZ2 4.16Å; K17-W47 HydrophobicContact CD-CZ3 3.79Å; K17-W47 HydrophobicContact CG-CD2 3.77Å; K17-W47 HydrophobicContact CG-CE3 4.17Å; K17-W47 HydrophobicContact CG-CG 4.05Å; K17-W47 HydrophobicContact CG-CH2 4.41Å; K17-W47 HydrophobicContact CG-CZ2 4.07Å; K17-W47 HydrophobicContact CG-CZ3 4.45Å
18	T	90.1	Very high	74	Confident	41 Å²	41	89.6 Å²	89.6	25%	0.252	48%	0.481	S	S	.	.	B	Isolated β-bridge	trans	-124.2	127.9	173.5	-54.9	0	0	0	0	108.5	W20 L23	T18-W20 PolarHBondContact O-N 3.45Å; T18-L23 WeakPolarHBondContact CG2-O 3.3Å
19	C	91.7	Very high	75.1	Confident	0 Å²	0	85.2 Å²	85.2	0%	0	46%	0.459	C	S	.	.			trans	-73.3	119	178.3	176.6	0	0	0	0	109.4	I21 C22 L23 S24 W35 H49	C19-I21 PolarHBondContact O-N 3.14Å; C19-I21 VanDerWaalsContact O-N 3.14Å; C19-C22 VanDerWaalsContact SG-SG 3.62Å; C19-L23 WeakPolarHBondContact O-CA 3.49Å; C19-L23 PolarHBondContact O-N 3.41Å; C19-S24 PolarHBondContact N-O 3.26Å; C19-W35 HydrophobicContact CB-CH2 4.12Å; C19-W35 HydrophobicContact CB-CZ3 3.97Å; C19-H49 VanDerWaalsContact CB-CE1 3.48Å; C19-H49 WeakPolarHBondContact CB-CE1 3.46Å; C19-H49 WeakPolarHBondContact CB-ND1 3.42Å; C19-H49 PolarHBondContact SG-N 3.38Å; C19-H49 PolarHBondContact SG-ND1 2.92Å
20	W	90.8	Very high	76.4	Confident	67 Å²	67	86.7 Å²	86.7	25%	0.254	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15	-178.4	68.7	-96.6	0	0	0	114.5	T18 L45 W47 W56	T18-W20 PolarHBondContact O-N 3.45Å; W20-L45 HydrophobicContact CB-CD2 4.14Å; W20-W47 VanDerWaalsContact CD1-O 3.29Å; W20-W47 PolarHBondContact N-O 3.25Å; W20-W56 HydrophobicContact CH2-CD2 4.19Å; W20-W56 HydrophobicContact CH2-CG 4.49Å; W20-W56 HydrophobicContact CH2-CZ2 4.4Å
21	I	92	Very high	77.4	Confident	57 Å²	57	88.3 Å²	88.3	29%	0.292	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-52.5	178.6	-62.4	176.6	0	0	0	111.6	C19 V48 C52 W56	C19-I21 PolarHBondContact O-N 3.14Å; C19-I21 VanDerWaalsContact O-N 3.14Å; I21-V48 HydrophobicContact CB-CG2 4.45Å; I21-V48 HydrophobicContact CD1-CG2 3.49Å; I21-V48 VanDerWaalsContact CD1-CG2 3.49Å; I21-V48 HydrophobicContact CG1-CG2 3.82Å; I21-C52 HydrophobicContact CB-CB 4.04Å; I21-C52 HydrophobicContact CD1-CB 3.99Å; I21-C52 WeakPolarHBondContact CD1-O 3.35Å; I21-C52 HydrophobicContact CG2-CB 4.09Å; I21-W56 HydrophobicContact CD1-CB 3.8Å; I21-W56 HydrophobicContact CD1-CG 4.21Å
22	C	91.5	Very high	78.8	Confident	55 Å²	55	83.9 Å²	83.9	37%	0.372	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-2.7	-176.6	72.3	0	0	0	0	113.9	C19 S24 H49	C19-C22 VanDerWaalsContact SG-SG 3.62Å; C22-S24 PolarHBondContact O-N 3.03Å; C22-S24 PolarHBondContact O-OG 3.35Å; C22-S24 PolarHBondContact SG-OG 3.03Å; C22-S24 VanDerWaalsContact SG-OG 3.33Å; C22-H49 PolarHBondContact SG-CE1 3.28Å; C22-H49 PolarHBondContact SG-ND1 2.93Å
23	L	90.4	Very high	80.4	Confident	131 Å²	131	79.6 Å²	79.6	69%	0.686	45%	0.449	S	S	*	.			trans	60.9	6.2	179.2	-52.1	178.1	0	0	0	115.5	T18 C19	T18-L23 WeakPolarHBondContact CG2-O 3.3Å; C19-L23 WeakPolarHBondContact O-CA 3.49Å; C19-L23 PolarHBondContact O-N 3.41Å
24	S	87.7	Confident	82.2	Confident	42 Å²	42	81.2 Å²	81.2	29%	0.294	45%	0.452	S	S	.	.			trans	-74.7	134.2	176.2	-42.9	0	0	0	0	110.9	C19 C22	C19-S24 PolarHBondContact N-O 3.26Å; C22-S24 PolarHBondContact O-N 3.03Å; C22-S24 PolarHBondContact O-OG 3.35Å; C22-S24 PolarHBondContact SG-OG 3.03Å; C22-S24 VanDerWaalsContact SG-OG 3.33Å
25	S	86.1	Confident	83.6	Confident	18 Å²	18	74.7 Å²	74.7	13%	0.126	42%	0.422	C	S	.	.	B	Isolated β-bridge	trans	-78.7	164.9	171.5	75.7	0	0	0	0	111.3	K17 V27 D28 G29	K17-S25 CarbonylContact O-C 3.38Å; K17-S25 VanDerWaalsContact O-CA 3.3Å; K17-S25 WeakPolarHBondContact O-CA 3.25Å; S25-V27 PolarHBondContact O-N 2.78Å; S25-V27 PolarHBondContact OG-N 3.44Å; S25-D28 PolarHBondContact O-N 3.12Å; S25-D28 PolarHBondContact OG-N 2.84Å; S25-D28 VanDerWaalsContact OG-N 3.11Å; S25-D28 PolarHBondContact OG-OD2 2.94Å; S25-G29 WeakPolarHBondContact O-CA 3.35Å; S25-G29 PolarHBondContact O-N 3.15Å
26	E	84.3	Confident	84.7	Confident	85 Å²	85	71 Å²	71	40%	0.397	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.3	171.2	-173.7	166.4	-159.7	0	0	112.3	K17 W35	K17-E26 HydrophobicContact CB-CB 4.25Å; K17-E26 WeakPolarHBondContact CD-OE2 3.38Å; K17-E26 WeakPolarHBondContact CE-OE2 3.36Å; K17-E26 WeakPolarHBondContact CG-OE2 3.49Å; K17-E26 VanDerWaalsContact NZ-CD 3.3Å; K17-E26 IonicContact NZ-OE1 3.06Å; K17-E26 PolarHBondContact NZ-OE1 3.08Å; K17-E26 IonicContact NZ-OE2 2.8Å; K17-E26 PolarHBondContact NZ-OE2 3.3Å; K17-E26 PolarHBondContact O-N 3.36Å; E26-W35 HydrophobicContact CB-CZ2 4.02Å
27	V	77.9	Confident	85.2	Confident	111 Å²	111	72.3 Å²	72.3	67%	0.673	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-39.2	-179.1	-165.6	0	0	0	0	111.6	S25	S25-V27 PolarHBondContact O-N 2.78Å; S25-V27 PolarHBondContact OG-N 3.44Å
28	D	76.7	Confident	85.4	Confident	135 Å²	135	72.2 Å²	72.2	72%	0.722	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-19.3	-179.9	-53.1	-50.7	0	0	0	112.7	S25	S25-D28 PolarHBondContact O-N 3.12Å; S25-D28 PolarHBondContact OG-N 2.84Å; S25-D28 VanDerWaalsContact OG-N 3.11Å; S25-D28 PolarHBondContact OG-OD2 2.94Å
29	G	69.3	Low	85.5	Confident	24 Å²	24	71.1 Å²	71.1	25%	0.247	40%	0.402	C	S	.	.	S	Bend	trans	-85.5	160.7	-169.3	0	0	0	0	0	114.9	S25 S31	S25-G29 WeakPolarHBondContact O-CA 3.35Å; S25-G29 PolarHBondContact O-N 3.15Å; G29-S31 PolarHBondContact O-N 3.14Å
30	N	74.2	Confident	85.5	Confident	121 Å²	121	81.1 Å²	81.1	65%	0.647	44%	0.439	S	S	*	.			trans	-67	122.2	169.8	-121.3	1.2	0	0	0	109.8	A32 N33	N30-A32 PolarHBondContact O-N 3.25Å; N30-N33 PolarHBondContact O-N 2.98Å
31	S	72.2	Confident	85.6	Confident	129 Å²	129	78.7 Å²	78.7	90%	0.902	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-13.9	179.1	57.8	0	0	0	0	114.3	G29 N33	G29-S31 PolarHBondContact O-N 3.14Å; S31-N33 VanDerWaalsContact C-N 3.33Å
32	A	78.4	Confident	85.4	Confident	87 Å²	87	86.8 Å²	86.8	72%	0.719	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-15.1	175.4	0	0	0	0	0	114.2	N30 L34	N30-A32 PolarHBondContact O-N 3.25Å; A32-L34 PolarHBondContact O-N 3Å
33	N	83.6	Confident	85.2	Confident	50 Å²	50	85.8 Å²	85.8	27%	0.267	46%	0.459	S	S	.	.	S	Bend	trans	-76.4	118.2	-178.8	-71.3	-33	0	0	0	111.1	N30 S31 W35 H49	N30-N33 PolarHBondContact O-N 2.98Å; S31-N33 VanDerWaalsContact C-N 3.33Å; N33-W35 PolarHBondContact O-N 3.45Å; N33-H49 HydrophobicContact CB-CB 4.43Å
34	L	90.3	Very high	84.9	Confident	121 Å²	121	82.4 Å²	82.4	63%	0.634	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-67.1	127.3	174.4	-173.2	69.7	0	0	0	110.4	A32 H49 Q50	A32-L34 PolarHBondContact O-N 3Å; L34-H49 CarbonylContact O-C 3.59Å; L34-H49 WeakPolarHBondContact O-CA 3.41Å; L34-Q50 HydrophobicContact CB-CB 4.05Å; L34-Q50 HydrophobicContact CD2-CB 4.24Å; L34-Q50 HydrophobicContact CD2-CG 4.31Å; L34-Q50 HydrophobicContact CG-CB 4.4Å; L34-Q50 WeakPolarHBondContact O-CB 3.26Å; L34-Q50 PolarHBondContact O-N 3.23Å
35	W	91.3	Very high	84.9	Confident	51 Å²	51	84.4 Å²	84.4	19%	0.193	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	139.7	175.7	-69.7	88.7	0	0	0	111.3	K17 C19 E26 N33 W47 H49	K17-W35 HydrophobicContact CB-CD2 4.09Å; K17-W35 HydrophobicContact CB-CE3 3.85Å; K17-W35 HydrophobicContact CB-CH2 3.77Å; K17-W35 HydrophobicContact CB-CZ2 4.03Å; K17-W35 HydrophobicContact CB-CZ3 3.68Å; K17-W35 HydrophobicContact CD-CB 4.4Å; K17-W35 HydrophobicContact CD-CD2 3.9Å; K17-W35 HydrophobicContact CD-CE3 4.25Å; K17-W35 HydrophobicContact CD-CG 3.97Å; K17-W35 WeakPolarHBondContact O-CH2 3.41Å; C19-W35 HydrophobicContact CB-CH2 4.12Å; C19-W35 HydrophobicContact CB-CZ3 3.97Å; E26-W35 HydrophobicContact CB-CZ2 4.02Å; N33-W35 PolarHBondContact O-N 3.45Å; W35-W47 HydrophobicContact CB-CE3 4.4Å; W35-W47 HydrophobicContact CE3-CB 3.93Å; W35-W47 HydrophobicContact CZ3-CB 3.91Å; W35-H49 AromaticContact CE2-CD2 3.83Å; W35-H49 AromaticContact CE2-NE2 3.81Å; W35-H49 AromaticContact CH2-NE2 3.53Å; W35-H49 AromaticContact CZ2-CD2 3.84Å; W35-H49 AromaticContact CZ2-NE2 3.35Å; W35-H49 VanDerWaalsContact CZ2-NE2 3.35Å; W35-H49 WeakPolarHBondContact CZ2-NE2 3.41Å
36	S	91.3	Very high	85.1	Confident	17 Å²	17	84.4 Å²	84.4	12%	0.119	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	155	179.8	69.7	0	0	0	0	111.4	V48 Q50	S36-V48 PolarHBondContact N-O 3.35Å; S36-V48 PolarHBondContact O-N 3.07Å; S36-V48 VanDerWaalsContact O-N 3.1Å; S36-V48 WeakPolarHBondContact OG-CG1 3.12Å; S36-V48 PolarHBondContact OG-O 3.01Å; S36-Q50 VanDerWaalsContact CB-OE1 3.3Å
37	R	91.4	Very high	85.4	Confident	132 Å²	132	82 Å²	82	50%	0.498	44%	0.441	S	S	.	.			trans	-134.5	74.3	178.1	-60.9	175.6	79.8	167.1	-16.1	110.3	C39 K46 W47	R37-C39 VanDerWaalsContact C-N 3.32Å; R37-C39 PolarHBondContact O-N 3.25Å; R37-K46 WeakPolarHBondContact CA-O 3.03Å; R37-K46 WeakPolarHBondContact CG-O 3Å; R37-K46 VanDerWaalsContact CZ-CE 3.46Å; R37-K46 VanDerWaalsContact NH2-CD 3.26Å; R37-K46 VanDerWaalsContact NH2-CE 3.29Å; R37-W47 VanDerWaalsContact CD-CH2 3.48Å; R37-W47 HydrophobicContact CG-CD2 3.93Å; R37-W47 HydrophobicContact CG-CE3 3.33Å; R37-W47 HydrophobicContact CG-CH2 4.18Å; R37-W47 HydrophobicContact CG-CZ3 3.5Å; R37-W47 VanDerWaalsContact CG-CZ3 3.5Å; R37-W47 VanDerWaalsContact NH1-CZ2 3.25Å
38	P	91.2	Very high	86.2	Confident	43 Å²	43	76.7 Å²	76.7	28%	0.279	41%	0.409	S	S	.	.			trans	-80.5	-7	-171.2	36.6	-43.1	0	0	0	114.1	V48 L53 Y79	P38-V48 HydrophobicContact CG-CG1 4.23Å; P38-L53 HydrophobicContact CB-CD2 4Å; P38-L53 HydrophobicContact CG-CD1 4.37Å; P38-L53 HydrophobicContact CG-CD2 3.6Å; P38-Y79 HydrophobicContact CB-CD1 3.64Å; P38-Y79 HydrophobicContact CB-CE1 3.72Å; P38-Y79 HydrophobicContact CG-CD1 4.03Å; P38-Y79 HydrophobicContact CG-CE1 3.57Å
39	C	93	Very high	87	Confident	17 Å²	17	70.5 Å²	70.5	12%	0.115	38%	0.376	C	S	.	.	S	Bend	trans	-129.5	172.6	-176.3	66.9	0	0	0	0	113.8	R37 C41 C72 Y79	R37-C39 VanDerWaalsContact C-N 3.32Å; R37-C39 PolarHBondContact O-N 3.25Å; C39-C41 VanDerWaalsContact C-N 3.32Å; C39-C41 PolarHBondContact O-N 3.48Å; C39-C41 VanDerWaalsContact SG-SG 3.65Å; C39-C72 HydrophobicContact CB-CB 3.83Å; C39-Y79 HydrophobicContact CB-CE1 3.93Å
40	R	91.9	Very high	88.1	Confident	210 Å²	210	72.4 Å²	72.4	79%	0.792	38%	0.379	S	S	*	.			trans	-87.2	10.3	178.3	-61.5	-179.2	-178.3	-178.6	1.2	114.4	T77	R40-T77 HydrophobicContact CG-CG2 4.33Å
41	C	92.4	Very high	89.1	Confident	16 Å²	16	69.3 Å²	69.3	11%	0.108	36%	0.364	C	S	.	.			trans	-60.6	153.7	176.9	-69.6	0	0	0	0	111.3	C39 L45 K46	C39-C41 VanDerWaalsContact C-N 3.32Å; C39-C41 PolarHBondContact O-N 3.48Å; C39-C41 VanDerWaalsContact SG-SG 3.65Å; C41-L45 HydrophobicContact CB-CB 4.21Å; C41-K46 HydrophobicContact CB-CB 4.5Å; C41-K46 WeakPolarHBondContact O-CB 3.49Å
42	R	89.1	Confident	90.1	Very high	228 Å²	228	64.1 Å²	64.1	86%	0.86	33%	0.327	S	S	*	.			trans	-109.8	160.7	177.8	-62	-174.5	179.7	-157.8	0.8	110.3
43	G	86.9	Confident	90.9	Very high	34 Å²	34	60.3 Å²	60.3	35%	0.351	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	66	-151.6	-179.7	0	0	0	0	0	113.7	L45 K46	G43-L45 PolarHBondContact O-N 3.02Å; G43-L45 VanDerWaalsContact O-N 3.15Å; G43-K46 WeakPolarHBondContact O-CD 3.34Å; G43-K46 WeakPolarHBondContact O-CG 3.47Å; G43-K46 PolarHBondContact O-N 3.49Å
44	A	83.8	Confident	91.3	Very high	60 Å²	60	62.8 Å²	62.8	50%	0.496	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-56.8	-31.7	-176.4	0	0	0	0	0	113.8	K46 W47	A44-K46 PolarHBondContact O-N 2.96Å; A44-K46 VanDerWaalsContact O-N 3.1Å; A44-W47 PolarHBondContact O-N 2.91Å
45	L	86.8	Confident	91.5	Very high	83 Å²	83	66 Å²	66	44%	0.435	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-68.1	-10.1	-177.6	-64.1	171.1	0	0	0	114.5	W20 C41 G43 I74	W20-L45 HydrophobicContact CB-CD2 4.14Å; C41-L45 HydrophobicContact CB-CB 4.21Å; G43-L45 PolarHBondContact O-N 3.02Å; G43-L45 VanDerWaalsContact O-N 3.15Å; L45-I74 HydrophobicContact CD1-CD1 3.77Å; L45-I74 HydrophobicContact CD2-CD1 4.19Å; L45-I74 HydrophobicContact CG-CD1 4.42Å
46	K	90.8	Very high	91.6	Very high	19 Å²	19	65 Å²	65	8%	0.083	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-82.5	-17.8	-179.3	81.3	-158.9	-177	-176.2	0	113.5	E15 R37 C41 G43 A44	E15-K46 VanDerWaalsContact OE1-CE 3.31Å; E15-K46 WeakPolarHBondContact OE1-CE 3.37Å; E15-K46 IonicContact OE1-NZ 3.67Å; E15-K46 PolarHBondContact OE1-NZ 3.39Å; E15-K46 WeakPolarHBondContact OE2-CE 3.31Å; E15-K46 IonicContact OE2-NZ 2.59Å; E15-K46 PolarHBondContact OE2-NZ 3.44Å; R37-K46 WeakPolarHBondContact CA-O 3.03Å; R37-K46 WeakPolarHBondContact CG-O 3Å; R37-K46 VanDerWaalsContact CZ-CE 3.46Å; R37-K46 VanDerWaalsContact NH2-CD 3.26Å; R37-K46 VanDerWaalsContact NH2-CE 3.29Å; C41-K46 HydrophobicContact CB-CB 4.5Å; C41-K46 WeakPolarHBondContact O-CB 3.49Å; G43-K46 WeakPolarHBondContact O-CD 3.34Å; G43-K46 WeakPolarHBondContact O-CG 3.47Å; G43-K46 PolarHBondContact O-N 3.49Å; A44-K46 PolarHBondContact O-N 2.96Å; A44-K46 VanDerWaalsContact O-N 3.1Å
47	W	91.7	Very high	91.7	Very high	34 Å²	34	65 Å²	65	13%	0.129	30%	0.303	C	S	.	.			trans	-104.7	134.3	-172.4	-64.8	115.2	0	0	0	111.3	K17 W20 W35 R37 A44	K17-W47 HydrophobicContact CB-CB 4.22Å; K17-W47 HydrophobicContact CB-CD2 4.15Å; K17-W47 HydrophobicContact CB-CG 3.94Å; K17-W47 HydrophobicContact CD-CD2 3.93Å; K17-W47 HydrophobicContact CD-CE3 3.78Å; K17-W47 HydrophobicContact CD-CH2 3.99Å; K17-W47 HydrophobicContact CD-CZ2 4.16Å; K17-W47 HydrophobicContact CD-CZ3 3.79Å; K17-W47 HydrophobicContact CG-CD2 3.77Å; K17-W47 HydrophobicContact CG-CE3 4.17Å; K17-W47 HydrophobicContact CG-CG 4.05Å; K17-W47 HydrophobicContact CG-CH2 4.41Å; K17-W47 HydrophobicContact CG-CZ2 4.07Å; K17-W47 HydrophobicContact CG-CZ3 4.45Å; W20-W47 VanDerWaalsContact CD1-O 3.29Å; W20-W47 PolarHBondContact N-O 3.25Å; W35-W47 HydrophobicContact CB-CE3 4.4Å; W35-W47 HydrophobicContact CE3-CB 3.93Å; W35-W47 HydrophobicContact CZ3-CB 3.91Å; R37-W47 VanDerWaalsContact CD-CH2 3.48Å; R37-W47 HydrophobicContact CG-CD2 3.93Å; R37-W47 HydrophobicContact CG-CE3 3.33Å; R37-W47 HydrophobicContact CG-CH2 4.18Å; R37-W47 HydrophobicContact CG-CZ3 3.5Å; R37-W47 VanDerWaalsContact CG-CZ3 3.5Å; R37-W47 VanDerWaalsContact NH1-CZ2 3.25Å; A44-W47 PolarHBondContact O-N 2.91Å
48	V	93.6	Very high	91.7	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	143.2	177.3	66.2	0	0	0	0	110.2	I21 S36 P38 C52 L53	I21-V48 HydrophobicContact CB-CG2 4.45Å; I21-V48 HydrophobicContact CD1-CG2 3.49Å; I21-V48 VanDerWaalsContact CD1-CG2 3.49Å; I21-V48 HydrophobicContact CG1-CG2 3.82Å; S36-V48 PolarHBondContact N-O 3.35Å; S36-V48 PolarHBondContact O-N 3.07Å; S36-V48 VanDerWaalsContact O-N 3.1Å; S36-V48 WeakPolarHBondContact OG-CG1 3.12Å; S36-V48 PolarHBondContact OG-O 3.01Å; P38-V48 HydrophobicContact CG-CG1 4.23Å; V48-C52 HydrophobicContact CG2-CB 4.35Å; V48-L53 HydrophobicContact CG1-CB 3.97Å; V48-L53 HydrophobicContact CG1-CD1 4.3Å; V48-L53 HydrophobicContact CG1-CD2 4Å; V48-L53 HydrophobicContact CG1-CG 4.31Å; V48-L53 HydrophobicContact CG2-CB 4.02Å
49	H	93.9	Very high	91.8	Very high	4 Å²	4	66.4 Å²	66.4	2%	0.019	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	137.4	170.3	-55.4	129.5	0	0	0	110	C19 C22 N33 L34 W35 T51 C52 L53	C19-H49 VanDerWaalsContact CB-CE1 3.48Å; C19-H49 WeakPolarHBondContact CB-CE1 3.46Å; C19-H49 WeakPolarHBondContact CB-ND1 3.42Å; C19-H49 PolarHBondContact SG-N 3.38Å; C19-H49 PolarHBondContact SG-ND1 2.92Å; C22-H49 PolarHBondContact SG-CE1 3.28Å; C22-H49 PolarHBondContact SG-ND1 2.93Å; N33-H49 HydrophobicContact CB-CB 4.43Å; L34-H49 CarbonylContact O-C 3.59Å; L34-H49 WeakPolarHBondContact O-CA 3.41Å; W35-H49 AromaticContact CE2-CD2 3.83Å; W35-H49 AromaticContact CE2-NE2 3.81Å; W35-H49 AromaticContact CH2-NE2 3.53Å; W35-H49 AromaticContact CZ2-CD2 3.84Å; W35-H49 AromaticContact CZ2-NE2 3.35Å; W35-H49 VanDerWaalsContact CZ2-NE2 3.35Å; W35-H49 WeakPolarHBondContact CZ2-NE2 3.41Å; H49-T51 VanDerWaalsContact C-N 3.25Å; H49-T51 PolarHBondContact O-N 2.93Å; H49-C52 HydrophobicContact CB-CB 3.96Å; H49-C52 PolarHBondContact O-N 2.96Å; H49-C52 VanDerWaalsContact O-N 3.17Å; H49-L53 WeakPolarHBondContact O-CB 3.29Å; H49-L53 PolarHBondContact O-N 3.05Å
50	Q	93.4	Very high	91.7	Very high	65 Å²	65	67 Å²	67	30%	0.304	32%	0.321	S	S	.	.	H	α-helix	trans	-55.3	-42.8	177.9	-176.4	65.2	12.7	0	0	111.5	L34 S36 L53 Q54	L34-Q50 HydrophobicContact CB-CB 4.05Å; L34-Q50 HydrophobicContact CD2-CB 4.24Å; L34-Q50 HydrophobicContact CD2-CG 4.31Å; L34-Q50 HydrophobicContact CG-CB 4.4Å; L34-Q50 WeakPolarHBondContact O-CB 3.26Å; L34-Q50 PolarHBondContact O-N 3.23Å; S36-Q50 VanDerWaalsContact CB-OE1 3.3Å; Q50-L53 PolarHBondContact O-N 3.45Å; Q50-Q54 WeakPolarHBondContact O-CB 3.48Å; Q50-Q54 VanDerWaalsContact O-CG 3.26Å; Q50-Q54 WeakPolarHBondContact O-CG 3.41Å; Q50-Q54 PolarHBondContact O-N 3.39Å
51	T	93.5	Very high	91.6	Very high	56 Å²	56	58.4 Å²	58.4	34%	0.344	29%	0.29	S	S	.	.	H	α-helix	trans	-67.7	-41.2	178.7	51.5	0	0	0	0	112.5	H49 Q54 R55	H49-T51 VanDerWaalsContact C-N 3.25Å; H49-T51 PolarHBondContact O-N 2.93Å; T51-Q54 PolarHBondContact O-N 3.48Å; T51-R55 WeakPolarHBondContact O-CG 3.42Å; T51-R55 PolarHBondContact O-N 2.89Å; T51-R55 VanDerWaalsContact O-N 3.08Å
52	C	94	Very high	91.4	Very high	19 Å²	19	66 Å²	66	13%	0.128	32%	0.323	C	S	.	.	H	α-helix	trans	-62.6	-45.3	174.5	-67.2	0	0	0	0	111	I21 V48 H49 R55 W56	I21-C52 HydrophobicContact CB-CB 4.04Å; I21-C52 HydrophobicContact CD1-CB 3.99Å; I21-C52 WeakPolarHBondContact CD1-O 3.35Å; I21-C52 HydrophobicContact CG2-CB 4.09Å; V48-C52 HydrophobicContact CG2-CB 4.35Å; H49-C52 HydrophobicContact CB-CB 3.96Å; H49-C52 PolarHBondContact O-N 2.96Å; H49-C52 VanDerWaalsContact O-N 3.17Å; C52-R55 PolarHBondContact O-N 3.24Å; C52-W56 WeakPolarHBondContact O-CB 3.39Å; C52-W56 PolarHBondContact O-N 3.47Å
53	L	94.1	Very high	91.3	Very high	8 Å²	8	59.4 Å²	59.4	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-64	-44.3	178.9	-178.1	66.6	0	0	0	111.6	P38 V48 H49 Q50 R55 W56 I57	P38-L53 HydrophobicContact CB-CD2 4Å; P38-L53 HydrophobicContact CG-CD1 4.37Å; P38-L53 HydrophobicContact CG-CD2 3.6Å; V48-L53 HydrophobicContact CG1-CB 3.97Å; V48-L53 HydrophobicContact CG1-CD1 4.3Å; V48-L53 HydrophobicContact CG1-CD2 4Å; V48-L53 HydrophobicContact CG1-CG 4.31Å; V48-L53 HydrophobicContact CG2-CB 4.02Å; H49-L53 WeakPolarHBondContact O-CB 3.29Å; H49-L53 PolarHBondContact O-N 3.05Å; Q50-L53 PolarHBondContact O-N 3.45Å; L53-R55 PolarHBondContact O-N 2.82Å; L53-W56 HydrophobicContact CD1-CE3 4.37Å; L53-W56 PolarHBondContact O-N 3.24Å; L53-I57 HydrophobicContact CD1-CD1 4.15Å; L53-I57 HydrophobicContact CD1-CG1 4.34Å; L53-I57 HydrophobicContact CD2-CD1 4.38Å; L53-I57 HydrophobicContact CG-CD1 3.82Å; L53-I57 HydrophobicContact CG-CG1 4.38Å; L53-I57 WeakPolarHBondContact O-CB 3.28Å; L53-I57 VanDerWaalsContact O-CG1 3.27Å; L53-I57 WeakPolarHBondContact O-CG1 3.26Å; L53-I57 PolarHBondContact O-N 3.43Å
54	Q	93.4	Very high	91.2	Very high	101 Å²	101	64.4 Å²	64.4	47%	0.472	32%	0.32	S	S	.	.	H	α-helix	trans	-60.2	-43.2	177.1	-78.8	175	-28.2	0	0	112.4	Q50 T51 I57 S58	Q50-Q54 WeakPolarHBondContact O-CB 3.48Å; Q50-Q54 VanDerWaalsContact O-CG 3.26Å; Q50-Q54 WeakPolarHBondContact O-CG 3.41Å; Q50-Q54 PolarHBondContact O-N 3.39Å; T51-Q54 PolarHBondContact O-N 3.48Å; Q54-I57 PolarHBondContact O-N 3.28Å; Q54-S58 WeakPolarHBondContact O-CB 3.47Å; Q54-S58 PolarHBondContact O-N 2.86Å; Q54-S58 PolarHBondContact O-OG 2.93Å
55	R	93.6	Very high	91.1	Very high	188 Å²	188	63 Å²	63	71%	0.709	31%	0.311	S	S	*	.	H	α-helix	trans	-62.7	-47.2	176.1	-73	176.6	-175.4	171.1	2	111.6	T51 C52 L53 I57 S58 E59	T51-R55 WeakPolarHBondContact O-CG 3.42Å; T51-R55 PolarHBondContact O-N 2.89Å; T51-R55 VanDerWaalsContact O-N 3.08Å; C52-R55 PolarHBondContact O-N 3.24Å; L53-R55 PolarHBondContact O-N 2.82Å; R55-I57 PolarHBondContact O-N 3.46Å; R55-S58 WeakPolarHBondContact O-CB 3.38Å; R55-S58 PolarHBondContact O-N 3.21Å; R55-E59 PolarHBondContact O-N 2.96Å
56	W	93.4	Very high	90.9	Very high	31 Å²	31	64.6 Å²	64.6	12%	0.117	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-42.4	177.9	179.3	87.6	0	0	0	112.1	W20 I21 C52 L53 S58 E59 Q60 I70 Q73 Y79	W20-W56 HydrophobicContact CH2-CD2 4.19Å; W20-W56 HydrophobicContact CH2-CG 4.49Å; W20-W56 HydrophobicContact CH2-CZ2 4.4Å; I21-W56 HydrophobicContact CD1-CB 3.8Å; I21-W56 HydrophobicContact CD1-CG 4.21Å; C52-W56 WeakPolarHBondContact O-CB 3.39Å; C52-W56 PolarHBondContact O-N 3.47Å; L53-W56 HydrophobicContact CD1-CE3 4.37Å; L53-W56 PolarHBondContact O-N 3.24Å; W56-S58 VanDerWaalsContact C-N 3.33Å; W56-S58 PolarHBondContact O-N 2.76Å; W56-E59 PolarHBondContact O-N 3.33Å; W56-Q60 HydrophobicContact CD2-CG 4.09Å; W56-Q60 HydrophobicContact CE3-CG 4.19Å; W56-Q60 HydrophobicContact CH2-CG 3.88Å; W56-Q60 HydrophobicContact CZ2-CG 3.78Å; W56-Q60 HydrophobicContact CZ3-CG 4.07Å; W56-Q60 WeakPolarHBondContact O-CG 3.3Å; W56-Q60 PolarHBondContact O-N 3.2Å; W56-I70 HydrophobicContact CH2-CG2 3.86Å; W56-I70 HydrophobicContact CZ3-CG2 3.61Å; W56-Q73 HydrophobicContact CZ2-CG 4.32Å; W56-Y79 HydrophobicContact CH2-CE2 4.15Å; W56-Y79 HydrophobicContact CZ3-CD2 4.26Å; W56-Y79 AromaticContact CZ3-CE2 3.66Å; W56-Y79 HydrophobicContact CZ3-CE2 3.66Å
57	I	93.3	Very high	90.4	Very high	16 Å²	16	69.2 Å²	69.2	8%	0.082	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-46.4	173.6	-75.5	172.2	0	0	0	110.4	L53 Q54 R55 E59 Q60 Q61 I70 I81	L53-I57 HydrophobicContact CD1-CD1 4.15Å; L53-I57 HydrophobicContact CD1-CG1 4.34Å; L53-I57 HydrophobicContact CD2-CD1 4.38Å; L53-I57 HydrophobicContact CG-CD1 3.82Å; L53-I57 HydrophobicContact CG-CG1 4.38Å; L53-I57 WeakPolarHBondContact O-CB 3.28Å; L53-I57 VanDerWaalsContact O-CG1 3.27Å; L53-I57 WeakPolarHBondContact O-CG1 3.26Å; L53-I57 PolarHBondContact O-N 3.43Å; Q54-I57 PolarHBondContact O-N 3.28Å; R55-I57 PolarHBondContact O-N 3.46Å; I57-E59 VanDerWaalsContact C-N 3.3Å; I57-E59 PolarHBondContact O-N 3.4Å; I57-Q60 PolarHBondContact O-N 2.96Å; I57-Q60 VanDerWaalsContact O-N 3.14Å; I57-Q61 HydrophobicContact CG2-CG 4.36Å; I57-Q61 WeakPolarHBondContact O-CG 3.4Å; I57-Q61 PolarHBondContact O-N 2.97Å; I57-I70 HydrophobicContact CB-CD1 4.33Å; I57-I70 HydrophobicContact CG1-CD1 4.49Å; I57-I70 HydrophobicContact CG2-CD1 3.76Å; I57-I81 HydrophobicContact CD1-CD1 4.07Å; I57-I81 HydrophobicContact CD1-CG1 4.27Å; I57-I81 HydrophobicContact CG2-CD1 3.72Å
58	S	92.4	Very high	90.1	Very high	71 Å²	71	71.7 Å²	71.7	50%	0.497	37%	0.367	S	S	.	.	H	α-helix	trans	-59.7	-40.4	179.9	-55.9	0	0	0	0	112	Q54 R55 W56 Q61 H62	Q54-S58 WeakPolarHBondContact O-CB 3.47Å; Q54-S58 PolarHBondContact O-N 2.86Å; Q54-S58 PolarHBondContact O-OG 2.93Å; R55-S58 WeakPolarHBondContact O-CB 3.38Å; R55-S58 PolarHBondContact O-N 3.21Å; W56-S58 VanDerWaalsContact C-N 3.33Å; W56-S58 PolarHBondContact O-N 2.76Å; S58-Q61 PolarHBondContact O-N 3.35Å; S58-H62 WeakPolarHBondContact O-CB 3.46Å; S58-H62 PolarHBondContact O-N 3.34Å
59	E	92.5	Very high	89.7	Confident	134 Å²	134	76.5 Å²	76.5	63%	0.626	40%	0.401	S	S	*	.	H	α-helix	trans	-66	-41	175.5	-173.9	174.5	-163.9	0	0	112.2	R55 W56 I57 Q61 H62 S63	R55-E59 PolarHBondContact O-N 2.96Å; W56-E59 PolarHBondContact O-N 3.33Å; I57-E59 VanDerWaalsContact C-N 3.3Å; I57-E59 PolarHBondContact O-N 3.4Å; E59-Q61 PolarHBondContact O-N 3.26Å; E59-H62 PolarHBondContact O-N 3.03Å; E59-S63 PolarHBondContact O-N 2.91Å; E59-S63 PolarHBondContact O-OG 2.9Å
60	Q	90.3	Very high	89.6	Confident	30 Å²	30	76.7 Å²	76.7	14%	0.14	40%	0.402	C	S	.	.	H	α-helix	trans	-64.5	-38.8	174.1	-65.6	-59.4	-36.3	0	0	112	W56 I57 S63 R64 I70	W56-Q60 HydrophobicContact CD2-CG 4.09Å; W56-Q60 HydrophobicContact CE3-CG 4.19Å; W56-Q60 HydrophobicContact CH2-CG 3.88Å; W56-Q60 HydrophobicContact CZ2-CG 3.78Å; W56-Q60 HydrophobicContact CZ3-CG 4.07Å; W56-Q60 WeakPolarHBondContact O-CG 3.3Å; W56-Q60 PolarHBondContact O-N 3.2Å; I57-Q60 PolarHBondContact O-N 2.96Å; I57-Q60 VanDerWaalsContact O-N 3.14Å; Q60-S63 PolarHBondContact O-OG 2.86Å; Q60-R64 WeakPolarHBondContact O-CB 3.36Å; Q60-R64 WeakPolarHBondContact O-CG 3.26Å; Q60-R64 PolarHBondContact O-N 3.35Å; Q60-I70 HydrophobicContact CB-CD1 3.88Å; Q60-I70 HydrophobicContact CB-CG1 4.39Å
61	Q	90.6	Very high	89.6	Confident	30 Å²	30	75.3 Å²	75.3	14%	0.14	40%	0.399	C	S	.	.	H	α-helix	trans	-73.4	-32.2	177.3	-67.1	-174.2	-56.8	0	0	112.7	I57 S58 E59 S63 G65 E66 I70 Y83	I57-Q61 HydrophobicContact CG2-CG 4.36Å; I57-Q61 WeakPolarHBondContact O-CG 3.4Å; I57-Q61 PolarHBondContact O-N 2.97Å; S58-Q61 PolarHBondContact O-N 3.35Å; E59-Q61 PolarHBondContact O-N 3.26Å; Q61-S63 VanDerWaalsContact C-N 3.28Å; Q61-S63 PolarHBondContact O-N 3.46Å; Q61-G65 CarbonylContact O-C 3.16Å; Q61-G65 WeakPolarHBondContact O-CA 3.37Å; Q61-G65 PolarHBondContact O-N 2.88Å; Q61-E66 PolarHBondContact NE2-O 3Å; Q61-I70 HydrophobicContact CG-CD1 3.38Å; Q61-I70 HydrophobicContact CG-CG1 4.43Å; Q61-Y83 PolarHBondContact NE2-OH 3.43Å; Q61-Y83 PolarHBondContact OE1-OH 3.45Å; Q61-Y83 VanDerWaalsContact OE1-OH 3.1Å
62	H	88.7	Confident	89.5	Confident	176 Å²	176	73 Å²	73	82%	0.815	39%	0.385	S	S	*	.	H	α-helix	trans	-60.6	-39.7	175.4	-175.9	69.1	0	0	0	112	S58 E59	S58-H62 WeakPolarHBondContact O-CB 3.46Å; S58-H62 PolarHBondContact O-N 3.34Å; E59-H62 PolarHBondContact O-N 3.03Å
63	S	85.8	Confident	89.3	Confident	88 Å²	88	78.5 Å²	78.5	62%	0.615	41%	0.409	S	S	*	.	H	α-helix	trans	-81.4	-37	179.5	57.1	0	0	0	0	113.7	E59 Q60 Q61	E59-S63 PolarHBondContact O-N 2.91Å; E59-S63 PolarHBondContact O-OG 2.9Å; Q60-S63 PolarHBondContact O-OG 2.86Å; Q61-S63 VanDerWaalsContact C-N 3.28Å; Q61-S63 PolarHBondContact O-N 3.46Å
64	R	85.5	Confident	89.2	Confident	139 Å²	139	83.6 Å²	83.6	53%	0.525	44%	0.435	S	S	.	.	H	α-helix	trans	-99.9	-15.6	-172.8	-60.9	178.1	-176.9	-161.1	-2	114.1	Q60 N68	Q60-R64 WeakPolarHBondContact O-CB 3.36Å; Q60-R64 WeakPolarHBondContact O-CG 3.26Å; Q60-R64 PolarHBondContact O-N 3.35Å; R64-N68 HydrophobicContact CB-CB 4.34Å; R64-N68 PolarHBondContact O-ND2 3.37Å
65	G	82.6	Confident	89.2	Confident	30 Å²	30	80.9 Å²	80.9	31%	0.309	43%	0.427	S	S	.	.			trans	89.2	148.2	-167.7	0	0	0	0	0	112.7	Q61 S67 N68	Q61-G65 CarbonylContact O-C 3.16Å; Q61-G65 WeakPolarHBondContact O-CA 3.37Å; Q61-G65 PolarHBondContact O-N 2.88Å; G65-S67 VanDerWaalsContact C-N 3.3Å; G65-S67 PolarHBondContact O-N 3.29Å; G65-N68 PolarHBondContact O-N 2.89Å
66	E	82.3	Confident	89.1	Confident	117 Å²	117	77.4 Å²	77.4	55%	0.547	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-30	-174.4	-173.1	170.7	-165.9	0	0	113.6	Q61 N68	Q61-E66 PolarHBondContact NE2-O 3Å; E66-N68 VanDerWaalsContact C-N 3.26Å; E66-N68 PolarHBondContact O-N 3.42Å
67	S	79.7	Confident	89.1	Confident	117 Å²	117	77.1 Å²	77.1	82%	0.818	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.3	-177.7	59.6	0	0	0	0	114.8	G65	G65-S67 VanDerWaalsContact C-N 3.3Å; G65-S67 PolarHBondContact O-N 3.29Å
68	N	85.5	Confident	89	Confident	86 Å²	86	80.2 Å²	80.2	46%	0.46	45%	0.445	S	S	.	.	S	Bend	trans	-87.6	126.3	-176.9	-78.9	-28.6	0	0	0	111.1	R64 G65 E66 I70	R64-N68 HydrophobicContact CB-CB 4.34Å; R64-N68 PolarHBondContact O-ND2 3.37Å; G65-N68 PolarHBondContact O-N 2.89Å; E66-N68 VanDerWaalsContact C-N 3.26Å; E66-N68 PolarHBondContact O-N 3.42Å; N68-I70 PolarHBondContact O-N 2.88Å
69	S	85.9	Confident	89	Confident	101 Å²	101	77.7 Å²	77.7	71%	0.706	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-63.1	126.8	177.5	62.5	0	0	0	0	110.7
70	I	91.4	Very high	89	Confident	7 Å²	7	78.9 Å²	78.9	4%	0.036	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-94.2	123.3	177.1	-60.1	169.2	0	0	0	108.6	W56 I57 Q60 Q61 N68 Y79 I81	W56-I70 HydrophobicContact CH2-CG2 3.86Å; W56-I70 HydrophobicContact CZ3-CG2 3.61Å; I57-I70 HydrophobicContact CB-CD1 4.33Å; I57-I70 HydrophobicContact CG1-CD1 4.49Å; I57-I70 HydrophobicContact CG2-CD1 3.76Å; Q60-I70 HydrophobicContact CB-CD1 3.88Å; Q60-I70 HydrophobicContact CB-CG1 4.39Å; Q61-I70 HydrophobicContact CG-CD1 3.38Å; Q61-I70 HydrophobicContact CG-CG1 4.43Å; N68-I70 PolarHBondContact O-N 2.88Å; I70-Y79 HydrophobicContact CB-CD2 4.29Å; I70-Y79 HydrophobicContact CG2-CD2 3.76Å; I70-Y79 HydrophobicContact CG2-CE2 4.18Å; I70-Y79 WeakPolarHBondContact O-CB 3.27Å; I70-Y79 WeakPolarHBondContact O-CD2 3.48Å; I70-Y79 PolarHBondContact O-N 3.25Å; I70-I81 HydrophobicContact CD1-CD1 4.35Å
71	S	92.5	Very high	89	Confident	36 Å²	36	80.4 Å²	80.4	25%	0.252	44%	0.442	S	S	.	.	B	Isolated β-bridge	trans	-108.5	155.9	173.8	62.7	0	0	0	0	111.9	Q73 N76 T77	S71-Q73 PolarHBondContact O-N 2.91Å; S71-N76 WeakPolarHBondContact CB-OD1 3.48Å; S71-N76 PolarHBondContact OG-OD1 3.03Å; S71-T77 CarbonylContact C-O 3.46Å; S71-T77 WeakPolarHBondContact CA-O 3.21Å
72	C	92.6	Very high	88.9	Confident	7 Å²	7	85 Å²	85	5%	0.047	47%	0.472	C	S	.	.			trans	-61.3	129	171	178.2	0	0	0	0	110.2	C39 I74 N76 T77 Y79	C39-C72 HydrophobicContact CB-CB 3.83Å; C72-I74 PolarHBondContact O-N 2.97Å; C72-I74 VanDerWaalsContact O-N 3.14Å; C72-N76 WeakPolarHBondContact O-CA 3.44Å; C72-N76 PolarHBondContact O-N 3.29Å; C72-T77 PolarHBondContact N-O 2.72Å; C72-Y79 WeakPolarHBondContact CA-OH 3.42Å; C72-Y79 HydrophobicContact CB-CE1 3.95Å; C72-Y79 HydrophobicContact CB-CE2 4.47Å; C72-Y79 WeakPolarHBondContact CB-OH 3.43Å
73	Q	90.1	Very high	88.9	Confident	135 Å²	135	81.6 Å²	81.6	63%	0.631	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.6	-176.2	-63.7	179	-24.4	0	0	114.4	W56 S71	W56-Q73 HydrophobicContact CZ2-CG 4.32Å; S71-Q73 PolarHBondContact O-N 2.91Å
74	I	90.9	Very high	89	Confident	115 Å²	115	82.4 Å²	82.4	59%	0.59	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-52.6	-174.2	-56.2	178.6	0	0	0	111	L45 C72	L45-I74 HydrophobicContact CD1-CD1 3.77Å; L45-I74 HydrophobicContact CD2-CD1 4.19Å; L45-I74 HydrophobicContact CG-CD1 4.42Å; C72-I74 PolarHBondContact O-N 2.97Å; C72-I74 VanDerWaalsContact O-N 3.14Å
75	C	93.2	Very high	88.9	Confident	45 Å²	45	83.9 Å²	83.9	30%	0.304	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	1.1	-176.9	67.2	0	0	0	0	113.9	T77	C75-T77 PolarHBondContact O-N 3Å; C75-T77 PolarHBondContact SG-OG1 2.6Å
76	N	91.8	Very high	88.9	Confident	115 Å²	115	85.2 Å²	85.2	62%	0.615	48%	0.478	S	S	*	.			trans	53	19.8	-177.1	-158.7	33	0	0	0	115.2	S71 C72 P78	S71-N76 WeakPolarHBondContact CB-OD1 3.48Å; S71-N76 PolarHBondContact OG-OD1 3.03Å; C72-N76 WeakPolarHBondContact O-CA 3.44Å; C72-N76 PolarHBondContact O-N 3.29Å; N76-P78 WeakPolarHBondContact O-CD 3.47Å
77	T	93.5	Very high	89.3	Confident	25 Å²	25	82.2 Å²	82.2	15%	0.153	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-69.7	122.5	174.9	-60.1	0	0	0	0	108.6	R40 S71 C72 C75 Y79	R40-T77 HydrophobicContact CG-CG2 4.33Å; S71-T77 CarbonylContact C-O 3.46Å; S71-T77 WeakPolarHBondContact CA-O 3.21Å; C72-T77 PolarHBondContact N-O 2.72Å; C75-T77 PolarHBondContact O-N 3Å; C75-T77 PolarHBondContact SG-OG1 2.6Å; T77-Y79 PolarHBondContact O-N 3.14Å
78	P	92	Very high	89.8	Confident	80 Å²	80	84.8 Å²	84.8	52%	0.519	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-65	132.8	175.4	27.6	-33.5	0	0	0	109.8	N76	N76-P78 WeakPolarHBondContact O-CD 3.47Å
79	Y	92.3	Very high	90.2	Very high	19 Å²	19	87.7 Å²	87.7	8%	0.075	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-75.8	132.9	174.3	-63.4	-44.4	0	0	0	110.1	P38 C39 W56 I70 C72 T77 I81	P38-Y79 HydrophobicContact CB-CD1 3.64Å; P38-Y79 HydrophobicContact CB-CE1 3.72Å; P38-Y79 HydrophobicContact CG-CD1 4.03Å; P38-Y79 HydrophobicContact CG-CE1 3.57Å; C39-Y79 HydrophobicContact CB-CE1 3.93Å; W56-Y79 HydrophobicContact CH2-CE2 4.15Å; W56-Y79 HydrophobicContact CZ3-CD2 4.26Å; W56-Y79 AromaticContact CZ3-CE2 3.66Å; W56-Y79 HydrophobicContact CZ3-CE2 3.66Å; I70-Y79 HydrophobicContact CB-CD2 4.29Å; I70-Y79 HydrophobicContact CG2-CD2 3.76Å; I70-Y79 HydrophobicContact CG2-CE2 4.18Å; I70-Y79 WeakPolarHBondContact O-CB 3.27Å; I70-Y79 WeakPolarHBondContact O-CD2 3.48Å; I70-Y79 PolarHBondContact O-N 3.25Å; C72-Y79 WeakPolarHBondContact CA-OH 3.42Å; C72-Y79 HydrophobicContact CB-CE1 3.95Å; C72-Y79 HydrophobicContact CB-CE2 4.47Å; C72-Y79 WeakPolarHBondContact CB-OH 3.43Å; T77-Y79 PolarHBondContact O-N 3.14Å; Y79-I81 PolarHBondContact O-N 2.9Å
80	I	91.1	Very high	90.4	Very high	158 Å²	158	87.8 Å²	87.8	81%	0.81	47%	0.47	S	S	*	.			trans	-91.2	100.4	176.2	-56.7	170.9	0	0	0	107	V82	I80-V82 HydrophobicContact CG2-CG2 4.3Å
81	I	90.5	Very high	90.3	Very high	62 Å²	62	91.7 Å²	91.7	32%	0.318	49%	0.491	S	S	.	.			trans	-101.4	115	178.9	-54.5	166.4	0	0	0	107.2	I57 I70 Y79 Y83	I57-I81 HydrophobicContact CD1-CD1 4.07Å; I57-I81 HydrophobicContact CD1-CG1 4.27Å; I57-I81 HydrophobicContact CG2-CD1 3.72Å; I70-I81 HydrophobicContact CD1-CD1 4.35Å; Y79-I81 PolarHBondContact O-N 2.9Å; I81-Y83 HydrophobicContact CB-CE2 4.21Å; I81-Y83 HydrophobicContact CG2-CD2 4.21Å; I81-Y83 HydrophobicContact CG2-CE1 4.37Å; I81-Y83 HydrophobicContact CG2-CE2 3.58Å
82	V	89.8	Confident	90.4	Very high	126 Å²	126	95.3 Å²	95.3	76%	0.764	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-100.2	116.5	177.3	-178	0	0	0	0	108.1	I80	I80-V82 HydrophobicContact CG2-CG2 4.3Å
83	Y	87.5	Confident	90.4	Very high	105 Å²	105	98.9 Å²	98.9	41%	0.412	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-88.2	138.7	172.3	-65.3	-89.2	0	0	0	109.2	Q61 I81	Q61-Y83 PolarHBondContact NE2-OH 3.43Å; Q61-Y83 PolarHBondContact OE1-OH 3.45Å; Q61-Y83 VanDerWaalsContact OE1-OH 3.1Å; I81-Y83 HydrophobicContact CB-CE2 4.21Å; I81-Y83 HydrophobicContact CG2-CD2 4.21Å; I81-Y83 HydrophobicContact CG2-CE1 4.37Å; I81-Y83 HydrophobicContact CG2-CE2 3.58Å
84	P	88.2	Confident	90.5	Very high	106 Å²	106	96.9 Å²	96.9	69%	0.688	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-65.4	139.1	175.6	27.7	-33.1	0	0	0	110.2	C86	P84-C86 PolarHBondContact O-N 2.91Å
85	D	84.3	Confident	90.5	Very high	170 Å²	170	94.5 Å²	94.5	91%	0.909	50%	0.504	S	S	*	.			trans	-63.9	105.6	174	-69.5	-41.4	0	0	0	109.5
86	C	82.1	Confident	90.6	Very high	57 Å²	57	95.2 Å²	95.2	39%	0.385	51%	0.508	S	S	.	.			trans	-83	125.2	169	-58.1	0	0	0	0	108.1	P84 Y90	P84-C86 PolarHBondContact O-N 2.91Å; C86-Y90 HydrophobicContact CB-CD1 3.51Å; C86-Y90 HydrophobicContact CB-CD2 3.81Å; C86-Y90 HydrophobicContact CB-CE1 4.26Å; C86-Y90 HydrophobicContact CB-CE2 4.5Å; C86-Y90 HydrophobicContact CB-CG 3.25Å
87	G	90.9	Very high	90.7	Very high	54 Å²	54	94.1 Å²	94.1	56%	0.557	50%	0.501	S	S	*	.			trans	-60.3	176.4	-174.9	0	0	0	0	0	114.1	F89 Y90	G87-F89 PolarHBondContact O-N 2.89Å; G87-Y90 WeakPolarHBondContact O-CB 3.26Å; G87-Y90 PolarHBondContact O-N 2.84Å
88	F	90.2	Very high	90.7	Very high	172 Å²	172	98.5 Å²	98.5	75%	0.754	52%	0.52	S	S	*	.	H	α-helix	trans	-46.1	-37.6	-176.4	173.3	-100.4	0	0	0	114.9	Y90 N91 F92	F88-Y90 VanDerWaalsContact C-N 3.29Å; F88-Y90 PolarHBondContact O-N 2.9Å; F88-N91 PolarHBondContact O-N 3.44Å; F88-F92 PolarHBondContact O-N 2.85Å
89	F	92.9	Very high	90.8	Very high	146 Å²	146	99.6 Å²	99.6	64%	0.64	52%	0.521	S	S	*	.	H	α-helix	trans	-59.9	-36.1	178.3	-172.4	-111.3	0	0	0	113.1	G87 F92 L93	G87-F89 PolarHBondContact O-N 2.89Å; F89-F92 PolarHBondContact O-N 3.45Å; F89-L93 HydrophobicContact CD1-CD1 3.71Å; F89-L93 HydrophobicContact CD1-CG 4.21Å; F89-L93 HydrophobicContact CE1-CD1 3.32Å; F89-L93 HydrophobicContact CE1-CD2 4.41Å; F89-L93 HydrophobicContact CE1-CG 3.94Å; F89-L93 HydrophobicContact CE2-CD2 4.46Å; F89-L93 HydrophobicContact CE2-CG 4.4Å; F89-L93 HydrophobicContact CZ-CD1 3.84Å; F89-L93 HydrophobicContact CZ-CD2 4.07Å; F89-L93 HydrophobicContact CZ-CG 4.03Å; F89-L93 WeakPolarHBondContact O-CB 3.39Å; F89-L93 VanDerWaalsContact O-CG 3.29Å; F89-L93 WeakPolarHBondContact O-CG 3.33Å; F89-L93 PolarHBondContact O-N 2.94Å
90	Y	91.4	Very high	90.9	Very high	104 Å²	104	102.4 Å²	102.4	41%	0.408	54%	0.54	S	S	.	.	H	α-helix	trans	-64.8	-47.1	175.4	172	-92.6	0	0	0	111.7	C86 G87 F88 F92 L93 Q94	C86-Y90 HydrophobicContact CB-CD1 3.51Å; C86-Y90 HydrophobicContact CB-CD2 3.81Å; C86-Y90 HydrophobicContact CB-CE1 4.26Å; C86-Y90 HydrophobicContact CB-CE2 4.5Å; C86-Y90 HydrophobicContact CB-CG 3.25Å; G87-Y90 WeakPolarHBondContact O-CB 3.26Å; G87-Y90 PolarHBondContact O-N 2.84Å; F88-Y90 VanDerWaalsContact C-N 3.29Å; F88-Y90 PolarHBondContact O-N 2.9Å; Y90-F92 VanDerWaalsContact C-N 3.29Å; Y90-F92 PolarHBondContact O-N 2.99Å; Y90-L93 PolarHBondContact O-N 3.45Å; Y90-Q94 WeakPolarHBondContact O-CB 3.46Å; Y90-Q94 PolarHBondContact O-N 3.45Å
91	N	89.1	Confident	91.1	Very high	89 Å²	89	101.9 Å²	101.9	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-38.3	178.3	-67.4	-31.1	0	0	0	111.7	F88 Q94 S95	F88-N91 PolarHBondContact O-N 3.44Å; N91-Q94 PolarHBondContact O-N 3.37Å; N91-S95 WeakPolarHBondContact O-CB 3.38Å; N91-S95 PolarHBondContact O-N 3.47Å
92	F	93.8	Very high	91.2	Very high	111 Å²	111	102.3 Å²	102.3	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-62.7	-49.3	173.5	175.7	-103.7	0	0	0	111.6	F88 F89 Y90 Q94 S95 V96	F88-F92 PolarHBondContact O-N 2.85Å; F89-F92 PolarHBondContact O-N 3.45Å; Y90-F92 VanDerWaalsContact C-N 3.29Å; Y90-F92 PolarHBondContact O-N 2.99Å; F92-Q94 VanDerWaalsContact C-N 3.33Å; F92-Q94 PolarHBondContact O-N 3.38Å; F92-S95 WeakPolarHBondContact O-CB 3.24Å; F92-S95 PolarHBondContact O-N 3.44Å; F92-V96 HydrophobicContact CD1-CG2 4.43Å; F92-V96 HydrophobicContact CD2-CG2 4.47Å; F92-V96 HydrophobicContact CE1-CG2 4Å; F92-V96 HydrophobicContact CE2-CG2 4.04Å; F92-V96 HydrophobicContact CZ-CG2 3.79Å; F92-V96 WeakPolarHBondContact O-CG2 3.48Å; F92-V96 PolarHBondContact O-N 3.38Å
93	L	93.5	Very high	91.5	Very high	83 Å²	83	100.7 Å²	100.7	44%	0.435	52%	0.523	S	S	.	.	H	α-helix	trans	-60.3	-41.9	176.3	-73.6	-179.8	0	0	0	112.1	F89 Y90 S95 V96 D97	F89-L93 HydrophobicContact CD1-CD1 3.71Å; F89-L93 HydrophobicContact CD1-CG 4.21Å; F89-L93 HydrophobicContact CE1-CD1 3.32Å; F89-L93 HydrophobicContact CE1-CD2 4.41Å; F89-L93 HydrophobicContact CE1-CG 3.94Å; F89-L93 HydrophobicContact CE2-CD2 4.46Å; F89-L93 HydrophobicContact CE2-CG 4.4Å; F89-L93 HydrophobicContact CZ-CD1 3.84Å; F89-L93 HydrophobicContact CZ-CD2 4.07Å; F89-L93 HydrophobicContact CZ-CG 4.03Å; F89-L93 WeakPolarHBondContact O-CB 3.39Å; F89-L93 VanDerWaalsContact O-CG 3.29Å; F89-L93 WeakPolarHBondContact O-CG 3.33Å; F89-L93 PolarHBondContact O-N 2.94Å; Y90-L93 PolarHBondContact O-N 3.45Å; L93-S95 VanDerWaalsContact C-N 3.33Å; L93-S95 PolarHBondContact O-N 2.84Å; L93-V96 PolarHBondContact O-N 3.17Å; L93-D97 WeakPolarHBondContact O-CB 3.37Å; L93-D97 PolarHBondContact O-N 2.66Å
94	Q	91.5	Very high	91.8	Very high	92 Å²	92	98.6 Å²	98.6	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-64	-38.9	177.3	-170.4	177.9	31.5	0	0	111.6	Y90 N91 F92 D97 Q98	Y90-Q94 WeakPolarHBondContact O-CB 3.46Å; Y90-Q94 PolarHBondContact O-N 3.45Å; N91-Q94 PolarHBondContact O-N 3.37Å; F92-Q94 VanDerWaalsContact C-N 3.33Å; F92-Q94 PolarHBondContact O-N 3.38Å; Q94-D97 PolarHBondContact O-N 3.43Å; Q94-Q98 WeakPolarHBondContact O-CB 3.25Å; Q94-Q98 PolarHBondContact O-N 3.43Å
95	S	91.7	Very high	92.2	Very high	65 Å²	65	100.8 Å²	100.8	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-65.1	-44.6	174.2	-174.9	0	0	0	0	111.8	N91 F92 L93 Q98 I99	N91-S95 WeakPolarHBondContact O-CB 3.38Å; N91-S95 PolarHBondContact O-N 3.47Å; F92-S95 WeakPolarHBondContact O-CB 3.24Å; F92-S95 PolarHBondContact O-N 3.44Å; L93-S95 VanDerWaalsContact C-N 3.33Å; L93-S95 PolarHBondContact O-N 2.84Å; S95-Q98 PolarHBondContact O-N 3.19Å; S95-I99 VanDerWaalsContact O-CG1 3.3Å; S95-I99 WeakPolarHBondContact O-CG1 3.47Å; S95-I99 PolarHBondContact O-N 2.86Å
96	V	95.2	Very high	92.7	Very high	61 Å²	61	97.3 Å²	97.3	37%	0.37	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-43.6	175.7	171.7	0	0	0	0	111.2	F92 L93 I99 T100	F92-V96 HydrophobicContact CD1-CG2 4.43Å; F92-V96 HydrophobicContact CD2-CG2 4.47Å; F92-V96 HydrophobicContact CE1-CG2 4Å; F92-V96 HydrophobicContact CE2-CG2 4.04Å; F92-V96 HydrophobicContact CZ-CG2 3.79Å; F92-V96 WeakPolarHBondContact O-CG2 3.48Å; F92-V96 PolarHBondContact O-N 3.38Å; L93-V96 PolarHBondContact O-N 3.17Å; V96-I99 PolarHBondContact O-N 3.31Å; V96-T100 VanDerWaalsContact O-CB 3.23Å; V96-T100 WeakPolarHBondContact O-CB 3.34Å; V96-T100 PolarHBondContact O-N 2.86Å; V96-T100 PolarHBondContact O-OG1 2.79Å
97	D	93.4	Very high	93.4	Very high	91 Å²	91	99.1 Å²	99.1	49%	0.487	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-46.9	176.5	-177.4	67.7	0	0	0	111.1	L93 Q94 I99 T100 R101	L93-D97 WeakPolarHBondContact O-CB 3.37Å; L93-D97 PolarHBondContact O-N 2.66Å; Q94-D97 PolarHBondContact O-N 3.43Å; D97-I99 PolarHBondContact O-N 2.86Å; D97-T100 PolarHBondContact O-N 2.73Å; D97-R101 WeakPolarHBondContact O-CB 3.4Å; D97-R101 PolarHBondContact O-N 3.46Å
98	Q	93	Very high	93.6	Very high	117 Å²	117	99.9 Å²	99.9	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-43.1	179.2	-175.1	65.3	3.9	0	0	112.5	Q94 S95 R101 S102	Q94-Q98 WeakPolarHBondContact O-CB 3.25Å; Q94-Q98 PolarHBondContact O-N 3.43Å; S95-Q98 PolarHBondContact O-N 3.19Å; Q98-R101 PolarHBondContact O-N 3.33Å; Q98-S102 PolarHBondContact O-N 3.32Å
99	I	95	Very high	93.9	Very high	103 Å²	103	92.8 Å²	92.8	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-45.7	175.1	-69.7	166.7	0	0	0	110.1	S95 V96 D97 R101 S102 L103	S95-I99 VanDerWaalsContact O-CG1 3.3Å; S95-I99 WeakPolarHBondContact O-CG1 3.47Å; S95-I99 PolarHBondContact O-N 2.86Å; V96-I99 PolarHBondContact O-N 3.31Å; D97-I99 PolarHBondContact O-N 2.86Å; I99-R101 VanDerWaalsContact C-N 3.32Å; I99-R101 PolarHBondContact O-N 3.21Å; I99-S102 PolarHBondContact O-N 2.91Å; I99-L103 VanDerWaalsContact O-CB 3.26Å; I99-L103 WeakPolarHBondContact O-CB 3.42Å; I99-L103 PolarHBondContact O-N 3.38Å
100	T	95.1	Very high	94.1	Very high	79 Å²	79	88 Å²	88	49%	0.485	48%	0.475	S	S	.	.	H	α-helix	trans	-61.8	-42	179.8	-58.8	0	0	0	0	110.9	V96 D97 S104	V96-T100 VanDerWaalsContact O-CB 3.23Å; V96-T100 WeakPolarHBondContact O-CB 3.34Å; V96-T100 PolarHBondContact O-N 2.86Å; V96-T100 PolarHBondContact O-OG1 2.79Å; D97-T100 PolarHBondContact O-N 2.73Å; T100-S104 WeakPolarHBondContact O-CB 3.33Å; T100-S104 PolarHBondContact O-N 3.29Å
101	R	94.3	Very high	94.4	Very high	146 Å²	146	88.5 Å²	88.5	55%	0.551	48%	0.483	S	S	*	.	H	α-helix	trans	-61	-48.4	175.2	178.4	176.3	-94.4	162.5	-5.5	111.3	D97 Q98 I99 S104 F105	D97-R101 WeakPolarHBondContact O-CB 3.4Å; D97-R101 PolarHBondContact O-N 3.46Å; Q98-R101 PolarHBondContact O-N 3.33Å; I99-R101 VanDerWaalsContact C-N 3.32Å; I99-R101 PolarHBondContact O-N 3.21Å; R101-S104 PolarHBondContact O-N 3.4Å; R101-F105 HydrophobicContact CG-CD2 4.2Å; R101-F105 HydrophobicContact CG-CE2 3.78Å; R101-F105 WeakPolarHBondContact O-CD2 3.35Å; R101-F105 PolarHBondContact O-N 3.41Å
102	S	92.7	Very high	94.8	Very high	72 Å²	72	88.1 Å²	88.1	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-62.9	-48.1	178.3	-177.1	0	0	0	0	112	Q98 I99 S104 F105 V106	Q98-S102 PolarHBondContact O-N 3.32Å; I99-S102 PolarHBondContact O-N 2.91Å; S102-S104 VanDerWaalsContact C-N 3.33Å; S102-S104 PolarHBondContact O-N 3.38Å; S102-F105 PolarHBondContact O-N 2.86Å; S102-V106 PolarHBondContact O-N 2.94Å
103	L	95.2	Very high	94.9	Very high	91 Å²	91	90.4 Å²	90.4	48%	0.476	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-40.3	179.5	-175.4	63.6	0	0	0	111.4	I99 F105 V106 L107	I99-L103 VanDerWaalsContact O-CB 3.26Å; I99-L103 WeakPolarHBondContact O-CB 3.42Å; I99-L103 PolarHBondContact O-N 3.38Å; L103-F105 VanDerWaalsContact C-N 3.33Å; L103-F105 PolarHBondContact O-N 2.79Å; L103-V106 PolarHBondContact O-N 2.99Å; L103-L107 HydrophobicContact CD1-CD1 4.2Å; L103-L107 HydrophobicContact CD1-CD2 4.44Å; L103-L107 HydrophobicContact CD1-CG 3.99Å; L103-L107 HydrophobicContact CD2-CD1 4.17Å; L103-L107 HydrophobicContact CG-CD1 3.72Å; L103-L107 HydrophobicContact CG-CG 3.97Å; L103-L107 WeakPolarHBondContact O-CB 3.41Å; L103-L107 VanDerWaalsContact O-CG 3.26Å; L103-L107 WeakPolarHBondContact O-CG 3.28Å; L103-L107 PolarHBondContact O-N 3.4Å
104	S	95.4	Very high	95.1	Very high	61 Å²	61	88.2 Å²	88.2	43%	0.427	49%	0.488	S	S	.	.	H	α-helix	trans	-57.4	-44.9	177	179.1	0	0	0	0	111.8	T100 R101 S102 T108	T100-S104 WeakPolarHBondContact O-CB 3.33Å; T100-S104 PolarHBondContact O-N 3.29Å; R101-S104 PolarHBondContact O-N 3.4Å; S102-S104 VanDerWaalsContact C-N 3.33Å; S102-S104 PolarHBondContact O-N 3.38Å; S104-T108 VanDerWaalsContact O-CB 3.23Å; S104-T108 WeakPolarHBondContact O-CB 3.39Å; S104-T108 PolarHBondContact O-N 3.23Å; S104-T108 PolarHBondContact O-OG1 3.39Å
105	F	94.9	Very high	95.3	Very high	152 Å²	152	86.9 Å²	86.9	67%	0.667	49%	0.489	S	S	*	.	H	α-helix	trans	-64.1	-42.9	176.2	-75.3	-64.1	0	0	0	112.5	R101 S102 L103 T108 G109	R101-F105 HydrophobicContact CG-CD2 4.2Å; R101-F105 HydrophobicContact CG-CE2 3.78Å; R101-F105 WeakPolarHBondContact O-CD2 3.35Å; R101-F105 PolarHBondContact O-N 3.41Å; S102-F105 PolarHBondContact O-N 2.86Å; L103-F105 VanDerWaalsContact C-N 3.33Å; L103-F105 PolarHBondContact O-N 2.79Å; F105-T108 PolarHBondContact O-N 3.33Å; F105-G109 PolarHBondContact O-N 3.14Å
106	V	95.1	Very high	95.5	Very high	98 Å²	98	90.7 Å²	90.7	59%	0.594	50%	0.497	S	S	*	.	H	α-helix	trans	-65.1	-47.1	178.3	174.5	0	0	0	0	111.3	S102 L103 G109 G110	S102-V106 PolarHBondContact O-N 2.94Å; L103-V106 PolarHBondContact O-N 2.99Å; V106-G109 PolarHBondContact O-N 3.08Å; V106-G110 PolarHBondContact O-N 3.3Å
107	L	96.7	Very high	95.6	Very high	94 Å²	94	92.5 Å²	92.5	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-43.9	177.9	-71.6	178.2	0	0	0	111.2	L103 G110 I111	L103-L107 HydrophobicContact CD1-CD1 4.2Å; L103-L107 HydrophobicContact CD1-CD2 4.44Å; L103-L107 HydrophobicContact CD1-CG 3.99Å; L103-L107 HydrophobicContact CD2-CD1 4.17Å; L103-L107 HydrophobicContact CG-CD1 3.72Å; L103-L107 HydrophobicContact CG-CG 3.97Å; L103-L107 WeakPolarHBondContact O-CB 3.41Å; L103-L107 VanDerWaalsContact O-CG 3.26Å; L103-L107 WeakPolarHBondContact O-CG 3.28Å; L103-L107 PolarHBondContact O-N 3.4Å; L107-G110 PolarHBondContact O-N 2.83Å; L107-I111 WeakPolarHBondContact O-CB 3.23Å; L107-I111 VanDerWaalsContact O-CG1 3.23Å; L107-I111 WeakPolarHBondContact O-CG1 3.26Å; L107-I111 PolarHBondContact O-N 3.2Å
108	T	96.6	Very high	95.8	Very high	70 Å²	70	96 Å²	96	43%	0.429	51%	0.505	S	S	.	.	H	α-helix	trans	-60.7	-47.8	177.5	-59.7	0	0	0	0	110.9	S104 F105 G110 I111 I112	S104-T108 VanDerWaalsContact O-CB 3.23Å; S104-T108 WeakPolarHBondContact O-CB 3.39Å; S104-T108 PolarHBondContact O-N 3.23Å; S104-T108 PolarHBondContact O-OG1 3.39Å; F105-T108 PolarHBondContact O-N 3.33Å; T108-G110 PolarHBondContact O-N 3.15Å; T108-I111 PolarHBondContact O-N 3.37Å; T108-I112 HydrophobicContact CG2-CD1 3.89Å; T108-I112 VanDerWaalsContact O-CG1 3.25Å; T108-I112 WeakPolarHBondContact O-CG1 3.28Å; T108-I112 PolarHBondContact O-N 3.21Å
109	G	95.9	Very high	96	Very high	24 Å²	24	94 Å²	94	25%	0.247	50%	0.504	C	S	.	.	H	α-helix	trans	-58.3	-48.5	174.5	0	0	0	0	0	112.1	F105 V106 I111 I112 F113	F105-G109 PolarHBondContact O-N 3.14Å; V106-G109 PolarHBondContact O-N 3.08Å; G109-I111 PolarHBondContact O-N 3.02Å; G109-I112 PolarHBondContact O-N 3.31Å; G109-F113 WeakPolarHBondContact O-CD2 3.15Å; G109-F113 PolarHBondContact O-N 3.42Å
110	G	96.8	Very high	96.1	Very high	46 Å²	46	90.3 Å²	90.3	47%	0.474	49%	0.488	S	S	.	.	H	α-helix	trans	-59.2	-43.1	178.3	0	0	0	0	0	113.5	V106 L107 T108 G114	V106-G110 PolarHBondContact O-N 3.3Å; L107-G110 PolarHBondContact O-N 2.83Å; T108-G110 PolarHBondContact O-N 3.15Å; G110-G114 WeakPolarHBondContact O-CA 3.21Å; G110-G114 PolarHBondContact O-N 3.35Å
111	I	97.6	Very high	96.2	Very high	113 Å²	113	87 Å²	87	58%	0.579	47%	0.468	S	S	*	.	H	α-helix	trans	-64.4	-44	176.5	-69.9	165	0	0	0	110.7	L107 T108 G109 S115	L107-I111 WeakPolarHBondContact O-CB 3.23Å; L107-I111 VanDerWaalsContact O-CG1 3.23Å; L107-I111 WeakPolarHBondContact O-CG1 3.26Å; L107-I111 PolarHBondContact O-N 3.2Å; T108-I111 PolarHBondContact O-N 3.37Å; G109-I111 PolarHBondContact O-N 3.02Å; I111-S115 VanDerWaalsContact O-CB 3.23Å; I111-S115 WeakPolarHBondContact O-CB 3.33Å; I111-S115 PolarHBondContact O-N 3.39Å; I111-S115 PolarHBondContact O-OG 2.95Å
112	I	97.8	Very high	96.3	Very high	82 Å²	82	83.2 Å²	83.2	42%	0.421	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-56.5	179.1	-70	170.4	0	0	0	110.2	T108 G109 G114 S115 F116	T108-I112 HydrophobicContact CG2-CD1 3.89Å; T108-I112 VanDerWaalsContact O-CG1 3.25Å; T108-I112 WeakPolarHBondContact O-CG1 3.28Å; T108-I112 PolarHBondContact O-N 3.21Å; G109-I112 PolarHBondContact O-N 3.31Å; I112-G114 PolarHBondContact O-N 3.38Å; I112-S115 PolarHBondContact O-N 3.44Å; I112-F116 HydrophobicContact CG2-CD2 3.74Å; I112-F116 HydrophobicContact CG2-CE2 3.52Å; I112-F116 WeakPolarHBondContact O-CD2 3.33Å; I112-F116 PolarHBondContact O-N 3.49Å
113	F	96.1	Very high	96.5	Very high	158 Å²	158	82 Å²	82	69%	0.693	45%	0.446	S	S	*	.	H	α-helix	trans	-64.2	-39.2	-179.2	-75.8	-71.7	0	0	0	112.6	G109 F116 Y117	G109-F113 WeakPolarHBondContact O-CD2 3.15Å; G109-F113 PolarHBondContact O-N 3.42Å; F113-F116 PolarHBondContact O-N 2.9Å; F113-Y117 WeakPolarHBondContact O-CB 3.23Å; F113-Y117 PolarHBondContact O-N 2.91Å
114	G	96.7	Very high	96.6	Very high	38 Å²	38	77.7 Å²	77.7	39%	0.392	42%	0.423	S	S	.	.	H	α-helix	trans	-61.7	-42.2	175.2	0	0	0	0	0	112.5	G110 I112 Y117 W118	G110-G114 WeakPolarHBondContact O-CA 3.21Å; G110-G114 PolarHBondContact O-N 3.35Å; I112-G114 PolarHBondContact O-N 3.38Å; G114-Y117 PolarHBondContact O-N 3.12Å; G114-W118 WeakPolarHBondContact O-CB 3.31Å; G114-W118 PolarHBondContact O-N 2.97Å
115	S	97.2	Very high	96.6	Very high	64 Å²	64	75.7 Å²	75.7	45%	0.448	41%	0.41	S	S	.	.	H	α-helix	trans	-65.3	-42.2	176.6	-60.3	0	0	0	0	111.9	I111 I112 S119	I111-S115 VanDerWaalsContact O-CB 3.23Å; I111-S115 WeakPolarHBondContact O-CB 3.33Å; I111-S115 PolarHBondContact O-N 3.39Å; I111-S115 PolarHBondContact O-OG 2.95Å; I112-S115 PolarHBondContact O-N 3.44Å; S115-S119 VanDerWaalsContact O-CB 3.27Å; S115-S119 WeakPolarHBondContact O-CB 3.28Å; S115-S119 PolarHBondContact O-N 2.92Å; S115-S119 PolarHBondContact O-OG 2.94Å
116	F	95.9	Very high	96.7	Very high	144 Å²	144	71.5 Å²	71.5	63%	0.632	40%	0.397	S	S	*	.	H	α-helix	trans	-62.5	-45.6	174.6	-80.8	-65.3	0	0	0	111.9	I112 F113 S119 A120	I112-F116 HydrophobicContact CG2-CD2 3.74Å; I112-F116 HydrophobicContact CG2-CE2 3.52Å; I112-F116 WeakPolarHBondContact O-CD2 3.33Å; I112-F116 PolarHBondContact O-N 3.49Å; F113-F116 PolarHBondContact O-N 2.9Å; F116-S119 PolarHBondContact O-N 2.87Å; F116-A120 WeakPolarHBondContact O-CB 3.47Å; F116-A120 PolarHBondContact O-N 3.26Å
117	Y	96.9	Very high	96.7	Very high	100 Å²	100	67.3 Å²	67.3	39%	0.392	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-49.7	177.2	174	-99.1	0	0	0	111.6	F113 G114 S119 A120 V121 L150 P154	F113-Y117 WeakPolarHBondContact O-CB 3.23Å; F113-Y117 PolarHBondContact O-N 2.91Å; G114-Y117 PolarHBondContact O-N 3.12Å; Y117-S119 VanDerWaalsContact C-N 3.32Å; Y117-S119 PolarHBondContact O-N 2.79Å; Y117-A120 WeakPolarHBondContact O-CB 3.33Å; Y117-A120 PolarHBondContact O-N 2.94Å; Y117-A120 VanDerWaalsContact O-N 3.12Å; Y117-V121 HydrophobicContact CD1-CG2 4.09Å; Y117-V121 HydrophobicContact CD2-CG2 4.41Å; Y117-V121 HydrophobicContact CE1-CG2 3.65Å; Y117-V121 HydrophobicContact CE2-CG2 4Å; Y117-V121 HydrophobicContact CG-CG2 4.45Å; Y117-V121 WeakPolarHBondContact O-CG2 3.48Å; Y117-V121 PolarHBondContact O-N 3.08Å; Y117-L150 PolarHBondContact OH-O 3.49Å; Y117-P154 HydrophobicContact CD2-CB 4.4Å; Y117-P154 HydrophobicContact CD2-CG 4.3Å; Y117-P154 HydrophobicContact CE2-CB 4.28Å; Y117-P154 HydrophobicContact CE2-CG 3.7Å
118	W	97.3	Very high	96.7	Very high	165 Å²	165	63.9 Å²	63.9	63%	0.625	36%	0.355	S	S	*	.	H	α-helix	trans	-64.8	-36.9	-179.2	-168.1	-107	0	0	0	112.7	G114 A120 V121 T122	G114-W118 WeakPolarHBondContact O-CB 3.31Å; G114-W118 PolarHBondContact O-N 2.97Å; W118-A120 VanDerWaalsContact C-N 3.35Å; W118-V121 PolarHBondContact O-N 3.27Å; W118-T122 WeakPolarHBondContact O-CB 3.45Å; W118-T122 PolarHBondContact O-N 3.39Å; W118-T122 PolarHBondContact O-OG1 3.38Å
119	S	96.6	Very high	96.6	Very high	75 Å²	75	63.3 Å²	63.3	52%	0.524	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-42.9	172.8	-60.3	0	0	0	0	111.3	S115 F116 Y117 T122 Y123	S115-S119 VanDerWaalsContact O-CB 3.27Å; S115-S119 WeakPolarHBondContact O-CB 3.28Å; S115-S119 PolarHBondContact O-N 2.92Å; S115-S119 PolarHBondContact O-OG 2.94Å; F116-S119 PolarHBondContact O-N 2.87Å; Y117-S119 VanDerWaalsContact C-N 3.32Å; Y117-S119 PolarHBondContact O-N 2.79Å; S119-T122 PolarHBondContact O-N 2.98Å; S119-Y123 VanDerWaalsContact O-CB 3.29Å; S119-Y123 WeakPolarHBondContact O-CB 3.31Å; S119-Y123 PolarHBondContact O-N 3.46Å
120	A	97.1	Very high	96.5	Very high	24 Å²	24	64.6 Å²	64.6	20%	0.198	35%	0.348	C	S	.	.	H	α-helix	trans	-65.9	-42.1	176.6	0	0	0	0	0	112.4	F116 Y117 W118 Y123 G124 P154 P157	F116-A120 WeakPolarHBondContact O-CB 3.47Å; F116-A120 PolarHBondContact O-N 3.26Å; Y117-A120 WeakPolarHBondContact O-CB 3.33Å; Y117-A120 PolarHBondContact O-N 2.94Å; Y117-A120 VanDerWaalsContact O-N 3.12Å; W118-A120 VanDerWaalsContact C-N 3.35Å; A120-Y123 PolarHBondContact O-N 2.92Å; A120-G124 PolarHBondContact O-N 2.86Å; A120-P154 HydrophobicContact CB-CB 3.73Å; A120-P157 HydrophobicContact CB-CG 3.88Å
121	V	97.1	Very high	96.4	Very high	11 Å²	11	64.2 Å²	64.2	7%	0.067	34%	0.336	C	S	.	.	H	α-helix	trans	-59.3	-49.8	174	172	0	0	0	0	110.4	Y117 W118 Y123 G124 A125 L153 P154	Y117-V121 HydrophobicContact CD1-CG2 4.09Å; Y117-V121 HydrophobicContact CD2-CG2 4.41Å; Y117-V121 HydrophobicContact CE1-CG2 3.65Å; Y117-V121 HydrophobicContact CE2-CG2 4Å; Y117-V121 HydrophobicContact CG-CG2 4.45Å; Y117-V121 WeakPolarHBondContact O-CG2 3.48Å; Y117-V121 PolarHBondContact O-N 3.08Å; W118-V121 PolarHBondContact O-N 3.27Å; V121-Y123 PolarHBondContact O-N 3.02Å; V121-G124 PolarHBondContact O-N 2.7Å; V121-A125 PolarHBondContact O-N 3.23Å; V121-L153 HydrophobicContact CG1-CB 4.32Å; V121-L153 HydrophobicContact CG1-CD2 4.04Å; V121-P154 HydrophobicContact CG2-CB 4.11Å; V121-P154 HydrophobicContact CG2-CG 3.96Å
122	T	96.4	Very high	96.2	Very high	66 Å²	66	63.8 Å²	63.8	41%	0.405	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-45.7	-179.9	-58.3	0	0	0	0	111.1	W118 S119 G124 A125 V126	W118-T122 WeakPolarHBondContact O-CB 3.45Å; W118-T122 PolarHBondContact O-N 3.39Å; W118-T122 PolarHBondContact O-OG1 3.38Å; S119-T122 PolarHBondContact O-N 2.98Å; T122-G124 VanDerWaalsContact C-N 3.32Å; T122-G124 PolarHBondContact O-N 3.47Å; T122-A125 PolarHBondContact O-N 2.81Å; T122-V126 WeakPolarHBondContact O-CG2 3.4Å; T122-V126 PolarHBondContact O-N 3.47Å
123	Y	97.3	Very high	95.9	Very high	46 Å²	46	61.4 Å²	61.4	18%	0.18	32%	0.323	C	S	.	.	H	α-helix	trans	-61.2	-41.6	175.7	177.8	-82.3	0	0	0	111.8	S119 A120 V121 V126 T127 P157 L160 L221 P224	S119-Y123 VanDerWaalsContact O-CB 3.29Å; S119-Y123 WeakPolarHBondContact O-CB 3.31Å; S119-Y123 PolarHBondContact O-N 3.46Å; A120-Y123 PolarHBondContact O-N 2.92Å; V121-Y123 PolarHBondContact O-N 3.02Å; Y123-V126 PolarHBondContact O-N 3.25Å; Y123-T127 WeakPolarHBondContact CE1-OG1 3.42Å; Y123-T127 WeakPolarHBondContact O-CB 3.3Å; Y123-T127 PolarHBondContact O-N 2.73Å; Y123-T127 PolarHBondContact O-OG1 2.9Å; Y123-P157 HydrophobicContact CD1-CB 3.51Å; Y123-P157 HydrophobicContact CD1-CG 3.78Å; Y123-P157 HydrophobicContact CE1-CB 3.82Å; Y123-P157 HydrophobicContact CE1-CG 4.46Å; Y123-P157 HydrophobicContact CG-CB 4.35Å; Y123-L160 HydrophobicContact CE1-CD1 3.89Å; Y123-L221 HydrophobicContact CD1-CD2 4.19Å; Y123-L221 HydrophobicContact CD2-CD2 4.22Å; Y123-L221 HydrophobicContact CE1-CD2 3.76Å; Y123-L221 HydrophobicContact CE2-CB 3.79Å; Y123-L221 HydrophobicContact CE2-CD2 3.78Å; Y123-L221 HydrophobicContact CE2-CG 4.3Å; Y123-L221 HydrophobicContact CG-CD2 4.41Å; Y123-L221 VanDerWaalsContact OH-CA 3.23Å; Y123-L221 WeakPolarHBondContact OH-CA 3.14Å; Y123-L221 PolarHBondContact OH-O 3.43Å; Y123-P224 VanDerWaalsContact OH-CD 3.26Å; Y123-P224 WeakPolarHBondContact OH-CD 3.41Å; Y123-P224 WeakPolarHBondContact OH-CG 3.4Å
124	G	97.1	Very high	95.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59	-48	174.1	0	0	0	0	0	112.3	A120 V121 T122 V126 T127 V128 L153	A120-G124 PolarHBondContact O-N 2.86Å; V121-G124 PolarHBondContact O-N 2.7Å; T122-G124 VanDerWaalsContact C-N 3.32Å; T122-G124 PolarHBondContact O-N 3.47Å; G124-V126 PolarHBondContact O-N 2.88Å; G124-T127 WeakPolarHBondContact O-CB 3.49Å; G124-T127 PolarHBondContact O-N 3.03Å; G124-V128 WeakPolarHBondContact O-CG2 3.29Å; G124-V128 PolarHBondContact O-N 3.14Å; G124-L153 WeakPolarHBondContact CA-O 3.27Å
125	A	96.7	Very high	95.6	Very high	19 Å²	19	68.5 Å²	68.5	16%	0.157	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-47	176.2	0	0	0	0	0	112	V121 T122 T127 V128 M129 M141 L153	V121-A125 PolarHBondContact O-N 3.23Å; T122-A125 PolarHBondContact O-N 2.81Å; A125-T127 VanDerWaalsContact C-N 3.31Å; A125-T127 PolarHBondContact O-N 3.43Å; A125-V128 PolarHBondContact O-N 3.39Å; A125-M129 WeakPolarHBondContact O-CG 3.13Å; A125-M129 PolarHBondContact O-N 3.2Å; A125-M141 HydrophobicContact CB-SD 4.06Å; A125-L153 HydrophobicContact CB-CD2 3.73Å
126	V	96	Very high	95.4	Very high	65 Å²	65	71 Å²	71	39%	0.394	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-42.1	176.6	171.5	0	0	0	0	110.7	T122 Y123 G124 V128 M129 Q130	T122-V126 WeakPolarHBondContact O-CG2 3.4Å; T122-V126 PolarHBondContact O-N 3.47Å; Y123-V126 PolarHBondContact O-N 3.25Å; G124-V126 PolarHBondContact O-N 2.88Å; V126-V128 PolarHBondContact O-N 2.99Å; V126-M129 CarbonylContact O-C 3.4Å; V126-M129 PolarHBondContact O-N 3.48Å; V126-Q130 HydrophobicContact CG1-CG 4.24Å; V126-Q130 WeakPolarHBondContact O-CB 3.47Å; V126-Q130 VanDerWaalsContact O-CG 3.28Å; V126-Q130 WeakPolarHBondContact O-CG 3.43Å; V126-Q130 PolarHBondContact O-N 3.34Å
127	T	96	Very high	95.3	Very high	9 Å²	9	64.2 Å²	64.2	6%	0.055	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-44	176.7	-61.1	0	0	0	0	111.5	Y123 G124 A125 M129 Q130 V131 I156 P224	Y123-T127 WeakPolarHBondContact CE1-OG1 3.42Å; Y123-T127 WeakPolarHBondContact O-CB 3.3Å; Y123-T127 PolarHBondContact O-N 2.73Å; Y123-T127 PolarHBondContact O-OG1 2.9Å; G124-T127 WeakPolarHBondContact O-CB 3.49Å; G124-T127 PolarHBondContact O-N 3.03Å; A125-T127 VanDerWaalsContact C-N 3.31Å; A125-T127 PolarHBondContact O-N 3.43Å; T127-M129 VanDerWaalsContact C-N 3.35Å; T127-M129 PolarHBondContact O-N 3.41Å; T127-Q130 PolarHBondContact O-N 2.73Å; T127-V131 HydrophobicContact CG2-CG2 4.37Å; T127-V131 VanDerWaalsContact O-CG2 3.26Å; T127-V131 WeakPolarHBondContact O-CG2 3.35Å; T127-V131 PolarHBondContact O-N 3.24Å; T127-I156 HydrophobicContact CG2-CG2 3.74Å; T127-P224 HydrophobicContact CG2-CB 3.8Å; T127-P224 HydrophobicContact CG2-CG 3.85Å
128	V	95.8	Very high	95.2	Very high	22 Å²	22	61.8 Å²	61.8	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-60.8	-44.8	174.9	172.2	0	0	0	0	110.8	G124 A125 V126 Q130 V131 Y132 M141 I156	G124-V128 WeakPolarHBondContact O-CG2 3.29Å; G124-V128 PolarHBondContact O-N 3.14Å; A125-V128 PolarHBondContact O-N 3.39Å; V126-V128 PolarHBondContact O-N 2.99Å; V128-Q130 VanDerWaalsContact C-N 3.33Å; V128-Q130 PolarHBondContact O-N 3.46Å; V128-V131 PolarHBondContact O-N 2.77Å; V128-Y132 HydrophobicContact CG1-CD2 3.91Å; V128-Y132 HydrophobicContact CG1-CE2 4.41Å; V128-Y132 WeakPolarHBondContact O-CD2 3.27Å; V128-Y132 PolarHBondContact O-N 3.42Å; V128-M141 HydrophobicContact CG1-CG 4.15Å; V128-M141 HydrophobicContact CG1-SD 4.49Å; V128-I156 HydrophobicContact CG2-CD1 3.74Å
129	M	94.9	Very high	95.2	Very high	58 Å²	58	59.5 Å²	59.5	29%	0.286	30%	0.303	S	S	.	.	H	α-helix	trans	-65.1	-34.2	176.8	-67.4	-172.4	-167.9	0	0	113	A125 V126 T127 G133 L138 M141	A125-M129 WeakPolarHBondContact O-CG 3.13Å; A125-M129 PolarHBondContact O-N 3.2Å; V126-M129 CarbonylContact O-C 3.4Å; V126-M129 PolarHBondContact O-N 3.48Å; T127-M129 VanDerWaalsContact C-N 3.35Å; T127-M129 PolarHBondContact O-N 3.41Å; M129-G133 CarbonylContact O-C 3.54Å; M129-G133 WeakPolarHBondContact O-CA 3.45Å; M129-G133 PolarHBondContact O-N 2.9Å; M129-L138 HydrophobicContact CE-CD2 3.79Å; M129-L138 HydrophobicContact CE-CG 4.28Å; M129-M141 HydrophobicContact CE-CE 3.55Å; M129-M141 HydrophobicContact CG-CE 4Å
130	Q	94.3	Very high	95	Very high	52 Å²	52	57.4 Å²	57.4	24%	0.243	29%	0.291	C	S	.	.	H	α-helix	trans	-68.3	-42.2	175.5	-75.1	176	-20.9	0	0	111.6	V126 T127 V128 T225	V126-Q130 HydrophobicContact CG1-CG 4.24Å; V126-Q130 WeakPolarHBondContact O-CB 3.47Å; V126-Q130 VanDerWaalsContact O-CG 3.28Å; V126-Q130 WeakPolarHBondContact O-CG 3.43Å; V126-Q130 PolarHBondContact O-N 3.34Å; T127-Q130 PolarHBondContact O-N 2.73Å; V128-Q130 VanDerWaalsContact C-N 3.33Å; V128-Q130 PolarHBondContact O-N 3.46Å; Q130-T225 PolarHBondContact NE2-OG1 3.34Å
131	V	93.8	Very high	94.9	Very high	38 Å²	38	57.6 Å²	57.6	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-75.2	-46.6	-175.9	174.6	0	0	0	0	112.4	T127 V128 T242 V245	T127-V131 HydrophobicContact CG2-CG2 4.37Å; T127-V131 VanDerWaalsContact O-CG2 3.26Å; T127-V131 WeakPolarHBondContact O-CG2 3.35Å; T127-V131 PolarHBondContact O-N 3.24Å; V128-V131 PolarHBondContact O-N 2.77Å; V131-T242 HydrophobicContact CG1-CG2 4.33Å; V131-V245 HydrophobicContact CG2-CG1 4.21Å
132	Y	92.8	Very high	94.8	Very high	104 Å²	104	66.8 Å²	66.8	41%	0.408	32%	0.321	S	S	.	.	H	α-helix	trans	-90.2	-14.2	-178.4	-70.6	-83	0	0	0	113.2	V128 Q136 T242	V128-Y132 HydrophobicContact CG1-CD2 3.91Å; V128-Y132 HydrophobicContact CG1-CE2 4.41Å; V128-Y132 WeakPolarHBondContact O-CD2 3.27Å; V128-Y132 PolarHBondContact O-N 3.42Å; Y132-Q136 PolarHBondContact O-OE1 3.43Å; Y132-T242 HydrophobicContact CD1-CG2 3.78Å; Y132-T242 HydrophobicContact CE1-CG2 3.63Å
133	G	91.3	Very high	94.7	Very high	31 Å²	31	70 Å²	70	32%	0.32	34%	0.335	S	S	.	.			trans	80.9	163.7	-165.9	0	0	0	0	0	112.2	M129 R135 G137	M129-G133 CarbonylContact O-C 3.54Å; M129-G133 WeakPolarHBondContact O-CA 3.45Å; M129-G133 PolarHBondContact O-N 2.9Å; G133-R135 PolarHBondContact O-N 3.35Å; G133-G137 WeakPolarHBondContact O-CA 3.43Å; G133-G137 PolarHBondContact O-N 3.22Å
134	H	92.5	Very high	94.5	Very high	127 Å²	127	70.4 Å²	70.4	59%	0.588	34%	0.342	S	S	*	.	H	α-helix	trans	-59.9	-50.8	-168	-176.7	69.2	0	0	0	114.2	L138	H134-L138 WeakPolarHBondContact O-CB 3.37Å; H134-L138 WeakPolarHBondContact O-CG 3.33Å; H134-L138 PolarHBondContact O-N 3.1Å; H134-L138 VanDerWaalsContact O-N 3.08Å
135	R	93.7	Very high	94.5	Very high	219 Å²	219	75.6 Å²	75.6	83%	0.826	37%	0.37	S	S	*	.	H	α-helix	trans	-69.3	-49.7	-176.4	-74.6	-174.2	164.5	161.2	-3.3	112.8	G133 L138 Q139	G133-R135 PolarHBondContact O-N 3.35Å; R135-L138 PolarHBondContact O-N 3.4Å; R135-Q139 PolarHBondContact O-N 3.26Å
136	Q	93.2	Very high	94.4	Very high	117 Å²	117	79.1 Å²	79.1	55%	0.547	39%	0.392	S	S	.	.	H	α-helix	trans	-69.5	-36.9	-179.3	-67.6	177.7	-1.9	0	0	111.4	Y132 Q139 A140	Y132-Q136 PolarHBondContact O-OE1 3.43Å; Q136-Q139 PolarHBondContact O-N 3.49Å; Q136-A140 WeakPolarHBondContact O-CB 3.29Å; Q136-A140 PolarHBondContact O-N 2.89Å
137	G	94.2	Very high	94.2	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-64.1	-43	175.1	0	0	0	0	0	112.9	G133 Q139 A140 M141	G133-G137 WeakPolarHBondContact O-CA 3.43Å; G133-G137 PolarHBondContact O-N 3.22Å; G137-Q139 VanDerWaalsContact C-N 3.35Å; G137-A140 PolarHBondContact O-N 3.49Å; G137-M141 WeakPolarHBondContact O-CG 3.24Å; G137-M141 PolarHBondContact O-N 2.86Å
138	L	95.2	Very high	94.2	Very high	49 Å²	49	85 Å²	85	26%	0.257	43%	0.425	S	S	.	.	H	α-helix	trans	-62.3	-41.9	172.6	-79.8	170.8	0	0	0	111.9	M129 H134 R135 M141 R142	M129-L138 HydrophobicContact CE-CD2 3.79Å; M129-L138 HydrophobicContact CE-CG 4.28Å; H134-L138 WeakPolarHBondContact O-CB 3.37Å; H134-L138 WeakPolarHBondContact O-CG 3.33Å; H134-L138 PolarHBondContact O-N 3.1Å; H134-L138 VanDerWaalsContact O-N 3.08Å; R135-L138 PolarHBondContact O-N 3.4Å; L138-M141 HydrophobicContact CD2-CE 4.16Å; L138-M141 PolarHBondContact O-N 2.94Å; L138-R142 VanDerWaalsContact O-CG 3.31Å; L138-R142 WeakPolarHBondContact O-CG 3.49Å; L138-R142 PolarHBondContact O-N 2.77Å
139	Q	96.3	Very high	94.1	Very high	117 Å²	117	85.9 Å²	85.9	55%	0.547	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-43.4	176.3	-173.9	175.1	-2	0	0	111.5	R135 Q136 G137 M141 R142 L143	R135-Q139 PolarHBondContact O-N 3.26Å; Q136-Q139 PolarHBondContact O-N 3.49Å; G137-Q139 VanDerWaalsContact C-N 3.35Å; Q139-M141 VanDerWaalsContact C-N 3.34Å; Q139-M141 PolarHBondContact O-N 3.27Å; Q139-R142 PolarHBondContact O-N 3.49Å; Q139-L143 HydrophobicContact CG-CD1 3.92Å; Q139-L143 HydrophobicContact CG-CG 4.4Å; Q139-L143 WeakPolarHBondContact O-CB 3.35Å; Q139-L143 VanDerWaalsContact O-CG 3.25Å; Q139-L143 WeakPolarHBondContact O-CG 3.49Å; Q139-L143 PolarHBondContact O-N 2.63Å
140	A	92.8	Very high	94.1	Very high	32 Å²	32	87.2 Å²	87.2	26%	0.264	44%	0.437	S	S	.	.	H	α-helix	trans	-59.9	-43	176.3	0	0	0	0	0	112.1	Q136 G137 L143 T144	Q136-A140 WeakPolarHBondContact O-CB 3.29Å; Q136-A140 PolarHBondContact O-N 2.89Å; G137-A140 PolarHBondContact O-N 3.49Å; A140-L143 PolarHBondContact O-N 3.13Å; A140-T144 PolarHBondContact O-N 3.4Å; A140-T144 PolarHBondContact O-OG1 2.93Å
141	M	94.8	Very high	94.1	Very high	27 Å²	27	90.5 Å²	90.5	13%	0.133	46%	0.455	C	S	.	.	H	α-helix	trans	-66.8	-38.6	175.4	-74.3	-172.8	-68.5	0	0	112.5	A125 V128 M129 G137 L138 Q139 L143 T144 L149 L153	A125-M141 HydrophobicContact CB-SD 4.06Å; V128-M141 HydrophobicContact CG1-CG 4.15Å; V128-M141 HydrophobicContact CG1-SD 4.49Å; M129-M141 HydrophobicContact CE-CE 3.55Å; M129-M141 HydrophobicContact CG-CE 4Å; G137-M141 WeakPolarHBondContact O-CG 3.24Å; G137-M141 PolarHBondContact O-N 2.86Å; L138-M141 HydrophobicContact CD2-CE 4.16Å; L138-M141 PolarHBondContact O-N 2.94Å; Q139-M141 VanDerWaalsContact C-N 3.34Å; Q139-M141 PolarHBondContact O-N 3.27Å; M141-L143 VanDerWaalsContact C-N 3.32Å; M141-L143 PolarHBondContact O-N 2.66Å; M141-T144 PolarHBondContact O-N 2.69Å; M141-L149 HydrophobicContact CB-CD1 3.89Å; M141-L149 HydrophobicContact CG-CD1 4.31Å; M141-L149 VanDerWaalsContact O-CD1 3.26Å; M141-L149 WeakPolarHBondContact O-CD1 3.48Å; M141-L153 HydrophobicContact SD-CD2 4.38Å
142	R	95	Very high	94.2	Very high	204 Å²	204	89.6 Å²	89.6	77%	0.77	45%	0.454	S	S	*	.	H	α-helix	trans	-67.5	-30.7	176.6	-74.2	175.8	-171.1	171.2	2.2	113.6	L138 Q139 T144	L138-R142 VanDerWaalsContact O-CG 3.31Å; L138-R142 WeakPolarHBondContact O-CG 3.49Å; L138-R142 PolarHBondContact O-N 2.77Å; Q139-R142 PolarHBondContact O-N 3.49Å; R142-T144 VanDerWaalsContact C-N 3.32Å
143	L	94.8	Very high	94.3	Very high	134 Å²	134	85.3 Å²	85.3	70%	0.702	44%	0.438	S	S	*	.	H	α-helix	trans	-83	-11.3	179.5	-68.4	172.7	0	0	0	113	Q139 A140 M141	Q139-L143 HydrophobicContact CG-CD1 3.92Å; Q139-L143 HydrophobicContact CG-CG 4.4Å; Q139-L143 WeakPolarHBondContact O-CB 3.35Å; Q139-L143 VanDerWaalsContact O-CG 3.25Å; Q139-L143 WeakPolarHBondContact O-CG 3.49Å; Q139-L143 PolarHBondContact O-N 2.63Å; A140-L143 PolarHBondContact O-N 3.13Å; M141-L143 VanDerWaalsContact C-N 3.32Å; M141-L143 PolarHBondContact O-N 2.66Å
144	T	94.3	Very high	94.6	Very high	54 Å²	54	84.8 Å²	84.8	33%	0.331	43%	0.428	S	S	.	.	S	Bend	trans	-90	136.7	179.2	-57.9	0	0	0	0	109.6	A140 M141 R142 L148 L149	A140-T144 PolarHBondContact O-N 3.4Å; A140-T144 PolarHBondContact O-OG1 2.93Å; M141-T144 PolarHBondContact O-N 2.69Å; R142-T144 VanDerWaalsContact C-N 3.32Å; T144-L148 HydrophobicContact CG2-CB 4.1Å; T144-L148 HydrophobicContact CG2-CD2 3.95Å; T144-L148 HydrophobicContact CG2-CG 3.96Å; T144-L149 HydrophobicContact CG2-CB 4.28Å
145	D	95.2	Very high	94.7	Very high	109 Å²	109	81.4 Å²	81.4	58%	0.583	42%	0.417	S	S	*	.			trans	-56.6	137.4	178.8	-64.8	-36.4	0	0	0	111.5	P147 L148 L149	D145-P147 VanDerWaalsContact C-CD 3.48Å; D145-P147 HydrophobicContact CB-CG 4.42Å; D145-L148 HydrophobicContact CB-CB 4.35Å; D145-L148 PolarHBondContact O-N 3.26Å; D145-L149 PolarHBondContact O-N 2.73Å
146	P	94.4	Very high	94.8	Very high	94 Å²	94	73.1 Å²	73.1	61%	0.61	39%	0.388	S	S	*	.	H	α-helix	trans	-50.1	-45.1	-178.7	-26.6	33.3	0	0	0	115.8	L149 L150	P146-L149 PolarHBondContact O-N 2.83Å; P146-L150 WeakPolarHBondContact O-CG 3.3Å; P146-L150 PolarHBondContact O-N 2.95Å
147	P	93.5	Very high	94.9	Very high	94 Å²	94	68.1 Å²	68.1	61%	0.61	37%	0.366	S	S	*	.	H	α-helix	trans	-67.4	-36.7	178.5	26.1	-35	0	0	0	112.6	D145 L149 L150 L151	D145-P147 VanDerWaalsContact C-CD 3.48Å; D145-P147 HydrophobicContact CB-CG 4.42Å; P147-L149 VanDerWaalsContact C-N 3.32Å; P147-L150 PolarHBondContact O-N 3.03Å; P147-L151 WeakPolarHBondContact O-CB 3.27Å; P147-L151 PolarHBondContact O-N 3.37Å
148	L	94.4	Very high	94.9	Very high	104 Å²	104	72.9 Å²	72.9	55%	0.545	39%	0.391	S	S	.	.	H	α-helix	trans	-68.8	-34.2	176.7	-179.5	59.8	0	0	0	111.2	T144 D145 G152	T144-L148 HydrophobicContact CG2-CB 4.1Å; T144-L148 HydrophobicContact CG2-CD2 3.95Å; T144-L148 HydrophobicContact CG2-CG 3.96Å; D145-L148 HydrophobicContact CB-CB 4.35Å; D145-L148 PolarHBondContact O-N 3.26Å; L148-G152 VanDerWaalsContact O-CA 3.26Å; L148-G152 WeakPolarHBondContact O-CA 3.22Å; L148-G152 PolarHBondContact O-N 3.46Å
149	L	94.6	Very high	94.9	Very high	40 Å²	40	74.1 Å²	74.1	21%	0.209	40%	0.403	C	S	.	.	H	α-helix	trans	-66.1	-48.5	173.6	-170.2	156.9	0	0	0	110.9	M141 T144 D145 P146 P147 L151 G152 L153	M141-L149 HydrophobicContact CB-CD1 3.89Å; M141-L149 HydrophobicContact CG-CD1 4.31Å; M141-L149 VanDerWaalsContact O-CD1 3.26Å; M141-L149 WeakPolarHBondContact O-CD1 3.48Å; T144-L149 HydrophobicContact CG2-CB 4.28Å; D145-L149 PolarHBondContact O-N 2.73Å; P146-L149 PolarHBondContact O-N 2.83Å; P147-L149 VanDerWaalsContact C-N 3.32Å; L149-L151 VanDerWaalsContact C-N 3.3Å; L149-L151 PolarHBondContact O-N 2.9Å; L149-G152 PolarHBondContact O-N 3.44Å; L149-L153 HydrophobicContact CD2-CD1 4Å; L149-L153 HydrophobicContact CD2-CD2 3.66Å; L149-L153 HydrophobicContact CD2-CG 4.41Å; L149-L153 HydrophobicContact CG-CD1 3.71Å; L149-L153 HydrophobicContact CG-CD2 4.25Å; L149-L153 WeakPolarHBondContact O-CB 3.38Å; L149-L153 WeakPolarHBondContact O-CD1 3.48Å; L149-L153 PolarHBondContact O-N 3.36Å
150	L	94.1	Very high	94.8	Very high	85 Å²	85	70 Å²	70	45%	0.445	39%	0.385	S	S	.	.	H	α-helix	trans	-62.1	-35.7	178.6	-74.9	172.3	0	0	0	113	Y117 P146 P147 P154	Y117-L150 PolarHBondContact OH-O 3.49Å; P146-L150 WeakPolarHBondContact O-CG 3.3Å; P146-L150 PolarHBondContact O-N 2.95Å; P147-L150 PolarHBondContact O-N 3.03Å; L150-P154 VanDerWaalsContact O-CD 3.23Å; L150-P154 WeakPolarHBondContact O-CD 3.42Å; L150-P154 WeakPolarHBondContact O-CG 3.12Å
151	L	95.4	Very high	94.8	Very high	121 Å²	121	69.5 Å²	69.5	63%	0.634	38%	0.378	S	S	*	.	H	α-helix	trans	-80.6	-41.3	175.2	-177.2	60.7	0	0	0	112.1	P147 L149 P154 T155	P147-L151 WeakPolarHBondContact O-CB 3.27Å; P147-L151 PolarHBondContact O-N 3.37Å; L149-L151 VanDerWaalsContact C-N 3.3Å; L149-L151 PolarHBondContact O-N 2.9Å; L151-P154 WeakPolarHBondContact O-CD 3.49Å; L151-P154 WeakPolarHBondContact O-CG 3.42Å; L151-T155 VanDerWaalsContact O-CG2 3.24Å; L151-T155 WeakPolarHBondContact O-CG2 3.39Å
152	G	95	Very high	94.6	Very high	19 Å²	19	73 Å²	73	20%	0.196	40%	0.397	C	S	.	.	H	α-helix	trans	-74.7	-42.8	-170.3	0	0	0	0	0	113.9	L148 L149 T155	L148-G152 VanDerWaalsContact O-CA 3.26Å; L148-G152 WeakPolarHBondContact O-CA 3.22Å; L148-G152 PolarHBondContact O-N 3.46Å; L149-G152 PolarHBondContact O-N 3.44Å; G152-T155 PolarHBondContact O-N 2.95Å; G152-T155 VanDerWaalsContact O-N 3.14Å; G152-T155 PolarHBondContact O-OG1 3.17Å
153	L	96.2	Very high	94.3	Very high	15 Å²	15	66.3 Å²	66.3	8%	0.079	39%	0.385	C	S	.	.	H	α-helix	trans	-56.3	-50.5	-179.5	-91.1	57.9	0	0	0	114.1	V121 G124 A125 M141 L149 T155 I156 P157	V121-L153 HydrophobicContact CG1-CB 4.32Å; V121-L153 HydrophobicContact CG1-CD2 4.04Å; G124-L153 WeakPolarHBondContact CA-O 3.27Å; A125-L153 HydrophobicContact CB-CD2 3.73Å; M141-L153 HydrophobicContact SD-CD2 4.38Å; L149-L153 HydrophobicContact CD2-CD1 4Å; L149-L153 HydrophobicContact CD2-CD2 3.66Å; L149-L153 HydrophobicContact CD2-CG 4.41Å; L149-L153 HydrophobicContact CG-CD1 3.71Å; L149-L153 HydrophobicContact CG-CD2 4.25Å; L149-L153 WeakPolarHBondContact O-CB 3.38Å; L149-L153 WeakPolarHBondContact O-CD1 3.48Å; L149-L153 PolarHBondContact O-N 3.36Å; L153-T155 PolarHBondContact O-N 3.29Å; L153-I156 WeakPolarHBondContact O-CB 3.42Å; L153-I156 PolarHBondContact O-N 2.9Å; L153-I156 VanDerWaalsContact O-N 3.17Å; L153-P157 VanDerWaalsContact O-CD 3.28Å; L153-P157 WeakPolarHBondContact O-CD 3.13Å
154	P	96.4	Very high	94	Very high	19 Å²	19	61 Å²	61	12%	0.123	36%	0.357	C	S	.	.	H	α-helix	trans	-70.8	-17.2	179.8	27.6	-33.7	0	0	0	113.2	Y117 A120 V121 L150 L151 I156 P157	Y117-P154 HydrophobicContact CD2-CB 4.4Å; Y117-P154 HydrophobicContact CD2-CG 4.3Å; Y117-P154 HydrophobicContact CE2-CB 4.28Å; Y117-P154 HydrophobicContact CE2-CG 3.7Å; A120-P154 HydrophobicContact CB-CB 3.73Å; V121-P154 HydrophobicContact CG2-CB 4.11Å; V121-P154 HydrophobicContact CG2-CG 3.96Å; L150-P154 VanDerWaalsContact O-CD 3.23Å; L150-P154 WeakPolarHBondContact O-CD 3.42Å; L150-P154 WeakPolarHBondContact O-CG 3.12Å; L151-P154 WeakPolarHBondContact O-CD 3.49Å; L151-P154 WeakPolarHBondContact O-CG 3.42Å; P154-I156 VanDerWaalsContact C-N 3.27Å; P154-I156 PolarHBondContact O-N 2.96Å; P154-P157 VanDerWaalsContact O-CD 3.31Å; P154-P157 WeakPolarHBondContact O-CD 3.23Å; P154-P157 WeakPolarHBondContact O-CG 3.39Å
155	T	95.3	Very high	93.5	Very high	56 Å²	56	60.9 Å²	60.9	34%	0.344	36%	0.361	S	S	.	.	H	α-helix	trans	-69.7	-25.2	172.2	65.9	0	0	0	0	112.4	L151 G152 L153 L158 C159	L151-T155 VanDerWaalsContact O-CG2 3.24Å; L151-T155 WeakPolarHBondContact O-CG2 3.39Å; G152-T155 PolarHBondContact O-N 2.95Å; G152-T155 VanDerWaalsContact O-N 3.14Å; G152-T155 PolarHBondContact O-OG1 3.17Å; L153-T155 PolarHBondContact O-N 3.29Å; T155-L158 PolarHBondContact O-N 3.25Å; T155-C159 VanDerWaalsContact O-CB 3.28Å; T155-C159 WeakPolarHBondContact O-CB 3.37Å; T155-C159 PolarHBondContact O-N 3.09Å; T155-C159 PolarHBondContact O-SG 3.18Å
156	I	95.7	Very high	92.8	Very high	45 Å²	45	58.8 Å²	58.8	23%	0.231	35%	0.352	C	S	.	.	H	α-helix	trans	-59.1	-57.8	178.5	-60.2	171	0	0	0	112.1	T127 V128 L153 P154 L158 C159 L160	T127-I156 HydrophobicContact CG2-CG2 3.74Å; V128-I156 HydrophobicContact CG2-CD1 3.74Å; L153-I156 WeakPolarHBondContact O-CB 3.42Å; L153-I156 PolarHBondContact O-N 2.9Å; L153-I156 VanDerWaalsContact O-N 3.17Å; P154-I156 VanDerWaalsContact C-N 3.27Å; P154-I156 PolarHBondContact O-N 2.96Å; I156-L158 VanDerWaalsContact C-N 3.3Å; I156-L158 PolarHBondContact O-N 2.97Å; I156-C159 PolarHBondContact O-N 3.28Å; I156-L160 HydrophobicContact CG2-CD1 4.2Å; I156-L160 VanDerWaalsContact O-CG 3.31Å; I156-L160 WeakPolarHBondContact O-CG 3.4Å; I156-L160 PolarHBondContact O-N 2.85Å
157	P	96.1	Very high	92	Very high	12 Å²	12	58.9 Å²	58.9	8%	0.078	34%	0.344	C	S	.	.	H	α-helix	trans	-61.8	-36.8	175.8	19.6	-28.5	0	0	0	112.8	A120 Y123 L153 P154 L160 V161 L221	A120-P157 HydrophobicContact CB-CG 3.88Å; Y123-P157 HydrophobicContact CD1-CB 3.51Å; Y123-P157 HydrophobicContact CD1-CG 3.78Å; Y123-P157 HydrophobicContact CE1-CB 3.82Å; Y123-P157 HydrophobicContact CE1-CG 4.46Å; Y123-P157 HydrophobicContact CG-CB 4.35Å; L153-P157 VanDerWaalsContact O-CD 3.28Å; L153-P157 WeakPolarHBondContact O-CD 3.13Å; P154-P157 VanDerWaalsContact O-CD 3.31Å; P154-P157 WeakPolarHBondContact O-CD 3.23Å; P154-P157 WeakPolarHBondContact O-CG 3.39Å; P157-L160 PolarHBondContact O-N 3.44Å; P157-V161 WeakPolarHBondContact O-CG2 3.37Å; P157-V161 PolarHBondContact O-N 3.41Å; P157-L221 HydrophobicContact CB-CD2 3.81Å
158	L	93.9	Very high	91.1	Very high	101 Å²	101	58.3 Å²	58.3	53%	0.529	33%	0.33	S	S	.	.	H	α-helix	trans	-60.9	-50	176.9	179.7	62.4	0	0	0	111.2	T155 I156 L160 V161 L162	T155-L158 PolarHBondContact O-N 3.25Å; I156-L158 VanDerWaalsContact C-N 3.3Å; I156-L158 PolarHBondContact O-N 2.97Å; L158-L160 VanDerWaalsContact C-N 3.31Å; L158-L160 PolarHBondContact O-N 3.45Å; L158-V161 PolarHBondContact O-N 3.02Å; L158-L162 HydrophobicContact CD1-CD1 4.1Å; L158-L162 HydrophobicContact CD1-CG 4.21Å; L158-L162 HydrophobicContact CG-CD1 3.94Å; L158-L162 HydrophobicContact CG-CG 4.43Å; L158-L162 WeakPolarHBondContact O-CB 3.37Å; L158-L162 VanDerWaalsContact O-CG 3.27Å; L158-L162 WeakPolarHBondContact O-CG 3.44Å; L158-L162 PolarHBondContact O-N 2.98Å
159	C	94.8	Very high	90.2	Very high	74 Å²	74	54.5 Å²	54.5	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-60.7	-39	176.1	-71.7	0	0	0	0	111.9	T155 I156 A163	T155-C159 VanDerWaalsContact O-CB 3.28Å; T155-C159 WeakPolarHBondContact O-CB 3.37Å; T155-C159 PolarHBondContact O-N 3.09Å; T155-C159 PolarHBondContact O-SG 3.18Å; I156-C159 PolarHBondContact O-N 3.28Å; C159-A163 WeakPolarHBondContact O-CB 3.37Å; C159-A163 PolarHBondContact O-N 3.43Å
160	L	93.6	Very high	89.2	Confident	32 Å²	32	53.8 Å²	53.8	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-43.8	176	-73.8	171.2	0	0	0	112.3	Y123 I156 P157 L158 K164 L223 P224	Y123-L160 HydrophobicContact CE1-CD1 3.89Å; I156-L160 HydrophobicContact CG2-CD1 4.2Å; I156-L160 VanDerWaalsContact O-CG 3.31Å; I156-L160 WeakPolarHBondContact O-CG 3.4Å; I156-L160 PolarHBondContact O-N 2.85Å; P157-L160 PolarHBondContact O-N 3.44Å; L158-L160 VanDerWaalsContact C-N 3.31Å; L158-L160 PolarHBondContact O-N 3.45Å; L160-K164 WeakPolarHBondContact O-CG 3.12Å; L160-K164 PolarHBondContact O-N 2.93Å; L160-K164 VanDerWaalsContact O-N 3.08Å; L160-L223 HydrophobicContact CD2-CD2 4.04Å; L160-P224 HydrophobicContact CD1-CG 3.53Å; L160-P224 HydrophobicContact CD2-CG 4.47Å
161	V	93.2	Very high	88.4	Confident	20 Å²	20	58 Å²	58	12%	0.121	32%	0.318	C	S	.	.	H	α-helix	trans	-66.9	-46.2	177.1	172.9	0	0	0	0	110.5	P157 L158 A163 K164 A165 L216 F217 A220	P157-V161 WeakPolarHBondContact O-CG2 3.37Å; P157-V161 PolarHBondContact O-N 3.41Å; L158-V161 PolarHBondContact O-N 3.02Å; V161-A163 PolarHBondContact O-N 3.45Å; V161-K164 CarbonylContact O-C 3.55Å; V161-K164 PolarHBondContact O-N 3Å; V161-A165 WeakPolarHBondContact O-CB 3.3Å; V161-A165 PolarHBondContact O-N 2.8Å; V161-L216 HydrophobicContact CG1-CD2 4.5Å; V161-F217 HydrophobicContact CG1-CD1 4.5Å; V161-F217 HydrophobicContact CG1-CE1 4.13Å; V161-F217 HydrophobicContact CG1-CZ 4.42Å; V161-F217 HydrophobicContact CG2-CD1 3.8Å; V161-F217 HydrophobicContact CG2-CE1 3.89Å; V161-A220 HydrophobicContact CB-CB 4.48Å; V161-A220 HydrophobicContact CG2-CB 3.91Å
162	L	91.6	Very high	87.6	Confident	101 Å²	101	55.4 Å²	55.4	53%	0.529	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-43.3	177.4	-70	174.9	0	0	0	111.9	L158 K164 A165 V166	L158-L162 HydrophobicContact CD1-CD1 4.1Å; L158-L162 HydrophobicContact CD1-CG 4.21Å; L158-L162 HydrophobicContact CG-CD1 3.94Å; L158-L162 HydrophobicContact CG-CG 4.43Å; L158-L162 WeakPolarHBondContact O-CB 3.37Å; L158-L162 VanDerWaalsContact O-CG 3.27Å; L158-L162 WeakPolarHBondContact O-CG 3.44Å; L158-L162 PolarHBondContact O-N 2.98Å; L162-K164 VanDerWaalsContact C-N 3.29Å; L162-K164 PolarHBondContact O-N 3.24Å; L162-A165 WeakPolarHBondContact O-CB 3.23Å; L162-A165 PolarHBondContact O-N 3.06Å; L162-V166 PolarHBondContact O-N 3.26Å
163	A	88.8	Confident	86.6	Confident	63 Å²	63	55 Å²	55	52%	0.521	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-35	176.8	0	0	0	0	0	112.4	C159 V161	C159-A163 WeakPolarHBondContact O-CB 3.37Å; C159-A163 PolarHBondContact O-N 3.43Å; V161-A163 PolarHBondContact O-N 3.45Å
164	K	86.6	Confident	85.6	Confident	24 Å²	24	59.1 Å²	59.1	10%	0.104	32%	0.318	C	S	.	.	H	α-helix	trans	-79.4	-27.3	174.5	-76.4	-63.8	-172.5	71.3	0	113.9	L160 V161 L162 V166 L216 S219 A220 L223	L160-K164 WeakPolarHBondContact O-CG 3.12Å; L160-K164 PolarHBondContact O-N 2.93Å; L160-K164 VanDerWaalsContact O-N 3.08Å; V161-K164 CarbonylContact O-C 3.55Å; V161-K164 PolarHBondContact O-N 3Å; L162-K164 VanDerWaalsContact C-N 3.29Å; L162-K164 PolarHBondContact O-N 3.24Å; K164-V166 PolarHBondContact O-N 2.99Å; K164-L216 HydrophobicContact CB-CD1 3.67Å; K164-S219 PolarHBondContact NZ-O 3.27Å; K164-A220 HydrophobicContact CB-CB 4.02Å; K164-A220 HydrophobicContact CG-CB 3.84Å; K164-L223 VanDerWaalsContact CE-CD1 3.46Å
165	A	85.5	Confident	84.8	Confident	50 Å²	50	62.3 Å²	62.3	41%	0.413	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-29.9	174.7	0	0	0	0	0	111.1	V161 L162 Q167 L216	V161-A165 WeakPolarHBondContact O-CB 3.3Å; V161-A165 PolarHBondContact O-N 2.8Å; L162-A165 WeakPolarHBondContact O-CB 3.23Å; L162-A165 PolarHBondContact O-N 3.06Å; A165-Q167 PolarHBondContact O-N 2.8Å; A165-L216 HydrophobicContact CB-CD2 4.2Å
166	V	80.9	Confident	84.1	Confident	66 Å²	66	64 Å²	64	40%	0.4	33%	0.334	S	S	.	.	S	Bend	trans	-68.4	99	166	-176.9	0	0	0	0	108.4	L162 K164 W168	L162-V166 PolarHBondContact O-N 3.26Å; K164-V166 PolarHBondContact O-N 2.99Å; V166-W168 PolarHBondContact O-N 2.79Å
167	Q	75.8	Confident	82.9	Confident	96 Å²	96	65.5 Å²	65.5	45%	0.449	34%	0.336	S	S	.	.			trans	-68.6	65.6	177.5	-59.7	-176.9	8	0	0	112.1	A165 E169 S170 R171	A165-Q167 PolarHBondContact O-N 2.8Å; Q167-E169 PolarHBondContact O-N 2.79Å; Q167-E169 VanDerWaalsContact O-N 3.14Å; Q167-S170 PolarHBondContact O-N 2.71Å; Q167-S170 PolarHBondContact OE1-OG 3.17Å; Q167-R171 PolarHBondContact O-N 3.35Å
168	W	75.9	Confident	81.7	Confident	81 Å²	81	68 Å²	68	31%	0.307	35%	0.349	S	S	.	.	H	α-helix	trans	-57.4	-29.9	-178	65.6	-93	0	0	0	112.2	V166 R171 L172 L253	V166-W168 PolarHBondContact O-N 2.79Å; W168-R171 PolarHBondContact O-N 3.39Å; W168-L172 HydrophobicContact CE3-CB 4.5Å; W168-L172 HydrophobicContact CE3-CD2 4.13Å; W168-L172 HydrophobicContact CZ3-CD2 3.81Å; W168-L172 WeakPolarHBondContact O-CB 3.43Å; W168-L172 PolarHBondContact O-N 3.28Å; W168-L253 HydrophobicContact CZ2-CD2 4.46Å
169	E	74	Confident	80.9	Confident	25 Å²	25	69.3 Å²	69.3	12%	0.117	35%	0.352	C	S	.	.	H	α-helix	trans	-61.8	-42.5	174.6	57.2	-170	-148.2	0	0	112.8	Q167 L172 L173 K256 T260 R264	Q167-E169 PolarHBondContact O-N 2.79Å; Q167-E169 VanDerWaalsContact O-N 3.14Å; E169-L172 PolarHBondContact O-N 3.01Å; E169-L173 WeakPolarHBondContact O-CB 3.31Å; E169-L173 VanDerWaalsContact O-CG 3.27Å; E169-L173 WeakPolarHBondContact O-CG 3.27Å; E169-L173 PolarHBondContact O-N 2.83Å; E169-K256 IonicContact OE2-NZ 2.7Å; E169-K256 PolarHBondContact OE2-NZ 3.21Å; E169-T260 HydrophobicContact CG-CG2 4.43Å; E169-R264 IonicContact OE1-CZ 3.7Å; E169-R264 IonicContact OE1-NH2 2.93Å; E169-R264 PolarHBondContact OE1-NH2 2.96Å
170	S	74.4	Confident	80	Confident	24 Å²	24	68.4 Å²	68.4	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-67	-45.1	177	-50.6	0	0	0	0	110.2	Q167 L172 L173 I174 R264	Q167-S170 PolarHBondContact O-N 2.71Å; Q167-S170 PolarHBondContact OE1-OG 3.17Å; S170-L172 VanDerWaalsContact C-N 3.35Å; S170-L172 PolarHBondContact O-N 3.24Å; S170-L173 PolarHBondContact O-N 2.87Å; S170-I174 VanDerWaalsContact O-CG1 3.3Å; S170-I174 WeakPolarHBondContact O-CG1 3.43Å; S170-I174 PolarHBondContact O-N 3.44Å; S170-R264 VanDerWaalsContact CA-NH1 3.33Å; S170-R264 PolarHBondContact OG-NH1 3.34Å; S170-R264 PolarHBondContact OG-NH2 3.38Å
171	R	76.9	Confident	78.9	Confident	175 Å²	175	67.8 Å²	67.8	66%	0.66	34%	0.341	S	S	*	.	H	α-helix	trans	-63.8	-41	176.8	-63.6	-174.4	-178.2	178.9	0.4	111.9	Q167 W168 I174 L175	Q167-R171 PolarHBondContact O-N 3.35Å; W168-R171 PolarHBondContact O-N 3.39Å; R171-I174 PolarHBondContact O-N 2.87Å; R171-L175 WeakPolarHBondContact O-CB 3.29Å; R171-L175 PolarHBondContact O-N 3.5Å
172	L	79.2	Confident	77.7	Confident	65 Å²	65	75.7 Å²	75.7	34%	0.34	37%	0.368	S	S	.	.	H	α-helix	trans	-67.9	-37.6	178.1	-174	66.6	0	0	0	111.3	W168 E169 S170 L175 W176 I261	W168-L172 HydrophobicContact CE3-CB 4.5Å; W168-L172 HydrophobicContact CE3-CD2 4.13Å; W168-L172 HydrophobicContact CZ3-CD2 3.81Å; W168-L172 WeakPolarHBondContact O-CB 3.43Å; W168-L172 PolarHBondContact O-N 3.28Å; E169-L172 PolarHBondContact O-N 3.01Å; S170-L172 VanDerWaalsContact C-N 3.35Å; S170-L172 PolarHBondContact O-N 3.24Å; L172-L175 PolarHBondContact O-N 3.49Å; L172-W176 WeakPolarHBondContact O-CA 3.39Å; L172-W176 WeakPolarHBondContact O-CB 3.46Å; L172-W176 PolarHBondContact O-N 3.39Å; L172-I261 HydrophobicContact CD2-CD1 3.98Å
173	L	73.2	Confident	77	Confident	11 Å²	11	75.4 Å²	75.4	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-61.8	-47.3	173	-81.3	166.3	0	0	0	112.3	E169 S170 L175 W176 R177 I261 R264	E169-L173 WeakPolarHBondContact O-CB 3.31Å; E169-L173 VanDerWaalsContact O-CG 3.27Å; E169-L173 WeakPolarHBondContact O-CG 3.27Å; E169-L173 PolarHBondContact O-N 2.83Å; S170-L173 PolarHBondContact O-N 2.87Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 3.26Å; L173-W176 HydrophobicContact CD2-CE3 4.29Å; L173-W176 PolarHBondContact O-N 3.38Å; L173-R177 WeakPolarHBondContact O-CB 3.47Å; L173-R177 WeakPolarHBondContact O-CG 3.3Å; L173-R177 PolarHBondContact O-N 3.38Å; L173-I261 HydrophobicContact CD1-CG1 4.3Å; L173-I261 HydrophobicContact CD2-CB 3.92Å; L173-I261 HydrophobicContact CD2-CG1 3.71Å; L173-I261 HydrophobicContact CD2-CG2 3.57Å; L173-I261 HydrophobicContact CG-CB 4.49Å; L173-I261 HydrophobicContact CG-CG1 3.81Å; L173-R264 HydrophobicContact CD1-CB 4.13Å; L173-R264 HydrophobicContact CD1-CG 4.37Å
174	I	75.8	Confident	76.2	Confident	102 Å²	102	77.1 Å²	77.1	52%	0.523	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-47	177.2	-65.8	164	0	0	0	109.5	S170 R171 W176 N178	S170-I174 VanDerWaalsContact O-CG1 3.3Å; S170-I174 WeakPolarHBondContact O-CG1 3.43Å; S170-I174 PolarHBondContact O-N 3.44Å; R171-I174 PolarHBondContact O-N 2.87Å; I174-W176 PolarHBondContact O-N 3.05Å; I174-N178 VanDerWaalsContact O-CB 3.23Å; I174-N178 WeakPolarHBondContact O-CB 3.49Å; I174-N178 VanDerWaalsContact O-CG 3.3Å; I174-N178 PolarHBondContact O-N 2.99Å
175	L	80.1	Confident	75.7	Confident	85 Å²	85	83 Å²	83	45%	0.445	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-44	176.2	-172.9	72.3	0	0	0	111.9	R171 L172 L173 H179 I180	R171-L175 WeakPolarHBondContact O-CB 3.29Å; R171-L175 PolarHBondContact O-N 3.5Å; L172-L175 PolarHBondContact O-N 3.49Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 3.26Å; L175-H179 HydrophobicContact CD1-CB 4.41Å; L175-H179 WeakPolarHBondContact O-CB 3.23Å; L175-H179 PolarHBondContact O-N 3.19Å; L175-I180 PolarHBondContact O-N 3.48Å
176	W	79.6	Confident	74.9	Confident	93 Å²	93	82.9 Å²	82.9	35%	0.352	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-46.8	-178.6	-178.2	62.3	0	0	0	111.2	L172 L173 I174 I180 S181 I261 E265	L172-W176 WeakPolarHBondContact O-CA 3.39Å; L172-W176 WeakPolarHBondContact O-CB 3.46Å; L172-W176 PolarHBondContact O-N 3.39Å; L173-W176 HydrophobicContact CD2-CE3 4.29Å; L173-W176 PolarHBondContact O-N 3.38Å; I174-W176 PolarHBondContact O-N 3.05Å; W176-I180 HydrophobicContact CB-CD1 4.32Å; W176-I180 VanDerWaalsContact CD1-CG2 3.43Å; W176-I180 HydrophobicContact CG-CB 4.34Å; W176-I180 CarbonylContact O-C 3.59Å; W176-I180 WeakPolarHBondContact O-CA 3.21Å; W176-I180 WeakPolarHBondContact O-CB 3.48Å; W176-I180 PolarHBondContact O-N 3.45Å; W176-I180 VanDerWaalsContact O-N 3.15Å; W176-S181 WeakPolarHBondContact O-CB 3.26Å; W176-S181 PolarHBondContact O-N 3.44Å; W176-I261 HydrophobicContact CE3-CG2 4.46Å; W176-I261 HydrophobicContact CZ3-CG2 4.27Å; W176-E265 HydrophobicContact CZ3-CG 4.2Å; W176-E265 WeakPolarHBondContact CZ3-OE1 3.33Å
177	R	70.3	Confident	74.2	Confident	75 Å²	75	84.7 Å²	84.7	28%	0.283	39%	0.394	S	S	.	.	H	α-helix	trans	-69.9	-43	179.1	-70	175.7	172.7	-173.2	-7.9	112.3	L173 S181 E265	L173-R177 WeakPolarHBondContact O-CB 3.47Å; L173-R177 WeakPolarHBondContact O-CG 3.3Å; L173-R177 PolarHBondContact O-N 3.38Å; R177-S181 VanDerWaalsContact O-CB 3.3Å; R177-S181 WeakPolarHBondContact O-CB 3.43Å; R177-S181 PolarHBondContact O-OG 3.29Å; R177-E265 IonicContact CZ-OE1 2.71Å; R177-E265 IonicContact CZ-OE2 3.77Å; R177-E265 IonicContact NE-OE1 3.05Å; R177-E265 PolarHBondContact NE-OE1 3.48Å; R177-E265 IonicContact NE-OE2 2.79Å; R177-E265 IonicContact NH2-OE1 3.97Å; R177-E265 PolarHBondContact NH2-OE1 2.97Å; R177-E265 IonicContact NH2-OE2 3.13Å; R177-E265 PolarHBondContact NH2-OE2 2.76Å
178	N	72.6	Confident	74	Confident	64 Å²	64	86.7 Å²	86.7	34%	0.342	41%	0.407	S	S	.	.	H	α-helix	trans	-76	-41.5	-176.1	-71	-4.3	0	0	0	113.2	I174 R182	I174-N178 VanDerWaalsContact O-CB 3.23Å; I174-N178 WeakPolarHBondContact O-CB 3.49Å; I174-N178 VanDerWaalsContact O-CG 3.3Å; I174-N178 PolarHBondContact O-N 2.99Å; N178-R182 WeakPolarHBondContact O-CD 3.25Å; N178-R182 PolarHBondContact O-NE 3.29Å
179	H	76.2	Confident	73.8	Confident	129 Å²	129	90.1 Å²	90.1	60%	0.597	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-53.9	-171.8	-68.7	74.3	0	0	0	112.5	L175 S181 R182	L175-H179 HydrophobicContact CD1-CB 4.41Å; L175-H179 WeakPolarHBondContact O-CB 3.23Å; L175-H179 PolarHBondContact O-N 3.19Å; H179-S181 PolarHBondContact O-N 3.24Å; H179-R182 PolarHBondContact O-N 2.99Å
180	I	75.4	Confident	73.4	Confident	55 Å²	55	94.4 Å²	94.4	28%	0.282	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-70.2	-39.3	-171.8	-61.1	173.4	0	0	0	111	L175 W176 R182 L183 I186	L175-I180 PolarHBondContact O-N 3.48Å; W176-I180 HydrophobicContact CB-CD1 4.32Å; W176-I180 VanDerWaalsContact CD1-CG2 3.43Å; W176-I180 HydrophobicContact CG-CB 4.34Å; W176-I180 CarbonylContact O-C 3.59Å; W176-I180 WeakPolarHBondContact O-CA 3.21Å; W176-I180 WeakPolarHBondContact O-CB 3.48Å; W176-I180 PolarHBondContact O-N 3.45Å; W176-I180 VanDerWaalsContact O-N 3.15Å; I180-R182 PolarHBondContact O-N 2.94Å; I180-R182 VanDerWaalsContact O-N 3.14Å; I180-L183 HydrophobicContact CG2-CD1 4.4Å; I180-L183 WeakPolarHBondContact O-CB 3.48Å; I180-L183 WeakPolarHBondContact O-CG 3.45Å; I180-L183 PolarHBondContact O-N 2.97Å; I180-L183 VanDerWaalsContact O-N 3.08Å; I180-I186 HydrophobicContact CG2-CD1 3.26Å; I180-I186 WeakPolarHBondContact O-CD1 3.48Å
181	S	70.5	Confident	72.7	Confident	20 Å²	20	102.2 Å²	102.2	14%	0.14	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-65	-18.9	-179.7	103.7	0	0	0	0	112.8	W176 R177 H179 L183 R190	W176-S181 WeakPolarHBondContact O-CB 3.26Å; W176-S181 PolarHBondContact O-N 3.44Å; R177-S181 VanDerWaalsContact O-CB 3.3Å; R177-S181 WeakPolarHBondContact O-CB 3.43Å; R177-S181 PolarHBondContact O-OG 3.29Å; H179-S181 PolarHBondContact O-N 3.24Å; S181-L183 VanDerWaalsContact C-N 3.3Å; S181-R190 VanDerWaalsContact C-NH2 3.32Å; S181-R190 PolarHBondContact O-NH2 3.33Å; S181-R190 PolarHBondContact OG-NH2 2.86Å; S181-R190 VanDerWaalsContact OG-NH2 3.13Å
182	R	69.6	Low	72	Confident	186 Å²	186	103.6 Å²	103.6	70%	0.702	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-80.9	-8.9	176.7	-66.7	-170.6	178.2	-167.9	0.6	113.5	N178 H179 I180 Q187	N178-R182 WeakPolarHBondContact O-CD 3.25Å; N178-R182 PolarHBondContact O-NE 3.29Å; H179-R182 PolarHBondContact O-N 2.99Å; I180-R182 PolarHBondContact O-N 2.94Å; I180-R182 VanDerWaalsContact O-N 3.14Å; R182-Q187 PolarHBondContact O-NE2 2.96Å
183	L	76	Confident	71.2	Confident	94 Å²	94	106 Å²	106	49%	0.492	49%	0.49	S	S	.	.	S	Bend	trans	-69.2	134.6	177.8	-64.1	171.3	0	0	0	110.8	I180 S181 F185 I186 Q187	I180-L183 HydrophobicContact CG2-CD1 4.4Å; I180-L183 WeakPolarHBondContact O-CB 3.48Å; I180-L183 WeakPolarHBondContact O-CG 3.45Å; I180-L183 PolarHBondContact O-N 2.97Å; I180-L183 VanDerWaalsContact O-N 3.08Å; S181-L183 VanDerWaalsContact C-N 3.3Å; L183-F185 VanDerWaalsContact C-N 3.26Å; L183-F185 PolarHBondContact O-N 2.82Å; L183-I186 HydrophobicContact CD1-CD1 4.47Å; L183-I186 PolarHBondContact O-N 3.48Å; L183-Q187 PolarHBondContact O-N 3.44Å
184	P	72.5	Confident	70.6	Confident	100 Å²	100	108.9 Å²	108.9	65%	0.649	51%	0.505	S	S	*	.	H	α-helix	trans	-60.6	-34.2	-172.8	22.6	-33.3	0	0	0	112.9	I186 Q187 L188	P184-I186 VanDerWaalsContact C-N 3.3Å; P184-I186 PolarHBondContact O-N 2.8Å; P184-Q187 PolarHBondContact O-N 3.2Å; P184-L188 PolarHBondContact O-N 3.41Å
185	F	74.8	Confident	69.8	Low	146 Å²	146	106.4 Å²	106.4	64%	0.64	50%	0.495	S	S	*	.	H	α-helix	trans	-62.6	-34.8	176.9	-172.7	-99.6	0	0	0	113	L183 F189	L183-F185 VanDerWaalsContact C-N 3.26Å; L183-F185 PolarHBondContact O-N 2.82Å; F185-F189 HydrophobicContact CD1-CE2 4.47Å; F185-F189 HydrophobicContact CE1-CD2 4.45Å; F185-F189 AromaticContact CE1-CE2 3.89Å; F185-F189 HydrophobicContact CE1-CE2 3.89Å; F185-F189 HydrophobicContact CE2-CE2 4.39Å; F185-F189 AromaticContact CZ-CE2 3.84Å; F185-F189 HydrophobicContact CZ-CE2 3.84Å; F185-F189 WeakPolarHBondContact O-CD2 3.31Å
186	I	68.8	Low	68.9	Low	49 Å²	49	108.8 Å²	108.8	25%	0.251	51%	0.514	S	S	.	.	H	α-helix	trans	-83.3	-29.4	-178.4	-63.8	178.6	0	0	0	110.9	I180 L183 P184 L188 F189 R190	I180-I186 HydrophobicContact CG2-CD1 3.26Å; I180-I186 WeakPolarHBondContact O-CD1 3.48Å; L183-I186 HydrophobicContact CD1-CD1 4.47Å; L183-I186 PolarHBondContact O-N 3.48Å; P184-I186 VanDerWaalsContact C-N 3.3Å; P184-I186 PolarHBondContact O-N 2.8Å; I186-L188 PolarHBondContact O-N 3.47Å; I186-F189 PolarHBondContact O-N 2.71Å; I186-R190 PolarHBondContact O-N 3.2Å
187	Q	67.4	Low	67.8	Low	103 Å²	103	111.2 Å²	111.2	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-33.3	172	-67.7	-178.8	-4.8	0	0	112	R182 L183 P184 F189 R190	R182-Q187 PolarHBondContact O-NE2 2.96Å; L183-Q187 PolarHBondContact O-N 3.44Å; P184-Q187 PolarHBondContact O-N 3.2Å; Q187-F189 VanDerWaalsContact C-N 3.25Å; Q187-F189 PolarHBondContact O-N 3.25Å; Q187-R190 PolarHBondContact O-N 3.3Å; Q187-R190 VanDerWaalsContact O-N 3.1Å
188	L	70.9	Confident	67	Low	138 Å²	138	111 Å²	111	72%	0.723	53%	0.531	S	S	*	.	H	α-helix	trans	-59.6	-35.9	175.7	-173.4	66.8	0	0	0	112.6	P184 I186	P184-L188 PolarHBondContact O-N 3.41Å; I186-L188 PolarHBondContact O-N 3.47Å
189	F	71.6	Confident	66.2	Low	154 Å²	154	111.9 Å²	111.9	68%	0.675	54%	0.539	S	S	*	.	H	α-helix	trans	-88.1	-7.5	178	-70.8	-79.6	0	0	0	113.5	F185 I186 Q187 R191	F185-F189 HydrophobicContact CD1-CE2 4.47Å; F185-F189 HydrophobicContact CE1-CD2 4.45Å; F185-F189 AromaticContact CE1-CE2 3.89Å; F185-F189 HydrophobicContact CE1-CE2 3.89Å; F185-F189 HydrophobicContact CE2-CE2 4.39Å; F185-F189 AromaticContact CZ-CE2 3.84Å; F185-F189 HydrophobicContact CZ-CE2 3.84Å; F185-F189 WeakPolarHBondContact O-CD2 3.31Å; I186-F189 PolarHBondContact O-N 2.71Å; Q187-F189 VanDerWaalsContact C-N 3.25Å; Q187-F189 PolarHBondContact O-N 3.25Å; F189-R191 PolarHBondContact O-N 2.82Å
190	R	64.8	Low	65.2	Low	115 Å²	115	111.9 Å²	111.9	43%	0.434	54%	0.543	S	S	.	.	S	Bend	trans	-77.2	118.2	-179.6	-171.7	178.2	-59.1	161.1	13.2	109.9	S181 I186 Q187 K192	S181-R190 VanDerWaalsContact C-NH2 3.32Å; S181-R190 PolarHBondContact O-NH2 3.33Å; S181-R190 PolarHBondContact OG-NH2 2.86Å; S181-R190 VanDerWaalsContact OG-NH2 3.13Å; I186-R190 PolarHBondContact O-N 3.2Å; Q187-R190 PolarHBondContact O-N 3.3Å; Q187-R190 VanDerWaalsContact O-N 3.1Å; R190-K192 PolarHBondContact O-N 3.27Å
191	R	61.2	Low	63.9	Low	187 Å²	187	115.8 Å²	115.8	71%	0.706	57%	0.565	S	S	*	*			trans	-61.3	122.1	170.6	-169.5	-176.3	-77.3	-179.1	-6.2	108.7	F189 D193 L194	F189-R191 PolarHBondContact O-N 2.82Å; R191-D193 HydrophobicContact CG-CB 4.33Å; R191-D193 WeakPolarHBondContact CG-OD2 3.41Å; R191-D193 PolarHBondContact O-N 2.91Å; R191-D193 VanDerWaalsContact O-N 3.17Å; R191-L194 HydrophobicContact CB-CD1 3.83Å; R191-L194 HydrophobicContact CG-CD1 4.43Å; R191-L194 PolarHBondContact O-N 3.16Å
192	K	62.2	Low	63	Low	205 Å²	205	120.1 Å²	120.1	89%	0.891	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-20.5	-177.8	-82.8	-177.4	175.2	179.2	0	113.7	R190 L194	R190-K192 PolarHBondContact O-N 3.27Å; K192-L194 PolarHBondContact O-N 3.04Å
193	D	61.2	Low	62	Low	115 Å²	115	117.2 Å²	117.2	62%	0.615	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-5.5	-177.6	-47.5	-42.6	0	0	0	113.8	R191 Y273	R191-D193 HydrophobicContact CG-CB 4.33Å; R191-D193 WeakPolarHBondContact CG-OD2 3.41Å; R191-D193 PolarHBondContact O-N 2.91Å; R191-D193 VanDerWaalsContact O-N 3.17Å; D193-Y273 PolarHBondContact O-OH 2.68Å
194	L	61.8	Low	61	Low	72 Å²	72	118.7 Å²	118.7	38%	0.377	60%	0.595	S	S	.	*	S	Bend	trans	-79	138.6	178.4	-87.9	82.2	0	0	0	111.5	R191 K192 T196 I269	R191-L194 HydrophobicContact CB-CD1 3.83Å; R191-L194 HydrophobicContact CG-CD1 4.43Å; R191-L194 PolarHBondContact O-N 3.16Å; K192-L194 PolarHBondContact O-N 3.04Å; L194-T196 PolarHBondContact O-N 3.06Å; L194-I269 HydrophobicContact CD2-CD1 4.1Å
195	P	58.6	Low	60	Low	50 Å²	50	121.6 Å²	121.6	33%	0.325	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-60.2	135.9	178.3	23	-32	0	0	0	112	Y268 C272	P195-Y268 HydrophobicContact CG-CE1 4.25Å; P195-C272 HydrophobicContact CB-CB 4.45Å; P195-C272 HydrophobicContact CG-CB 3.76Å
196	T	60.6	Low	59.1	Low	135 Å²	135	120.2 Å²	120.2	83%	0.828	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-75.4	127.8	174.4	-50.6	0	0	0	0	110	L194	L194-T196 PolarHBondContact O-N 3.06Å
197	W	57.2	Low	58.3	Low	144 Å²	144	127.1 Å²	127.1	55%	0.545	62%	0.622	S	S	.	*	S	Bend	trans	-63.2	147.9	175.6	-179.8	89.2	0	0	0	111.8
198	P	54.3	Low	57.8	Low	70 Å²	70	127 Å²	127	46%	0.455	63%	0.63	S	S	.	*			cis	-105.5	135.9	4.6	22.1	-4.4	0	0	0	113.3	N200	P198-N200 PolarHBondContact O-N 3.31Å
199	V	55.3	Low	57.4	Low	83 Å²	83	125.4 Å²	125.4	50%	0.503	62%	0.619	S	S	.	*			trans	-68.4	122.1	140	179.8	0	0	0	0	103.6	D201	V199-D201 PolarHBondContact O-N 3.26Å
200	N	54.2	Low	57.2	Low	129 Å²	129	125 Å²	125	69%	0.69	62%	0.623	S	S	*	*			trans	-36.4	135	175.1	-77.2	-20.2	0	0	0	109	P198 V202	P198-N200 PolarHBondContact O-N 3.31Å; N200-V202 HydrophobicContact CB-CG2 4.41Å; N200-V202 PolarHBondContact O-N 3.31Å
201	D	49.1	Very low	57.6	Low	137 Å²	137	123 Å²	123	73%	0.733	63%	0.626	S	S	*	*			trans	-58.1	68.4	175.6	-71.1	-49.4	0	0	0	109.8	V199 D203	V199-D201 PolarHBondContact O-N 3.26Å; D201-D203 PolarHBondContact O-N 2.65Å
202	V	51.5	Low	58.6	Low	110 Å²	110	116 Å²	116	67%	0.667	60%	0.603	S	S	*	*			trans	-74.5	76.5	168.3	-179.2	0	0	0	0	103.8	N200 I204	N200-V202 HydrophobicContact CB-CG2 4.41Å; N200-V202 PolarHBondContact O-N 3.31Å; V202-I204 PolarHBondContact O-N 2.82Å
203	D	48.3	Very low	59.8	Low	125 Å²	125	110 Å²	110	67%	0.668	58%	0.58	S	S	*	*	S	Bend	trans	35.8	44.6	149.1	-55.7	-38.7	0	0	0	115.6	D201 E205	D201-D203 PolarHBondContact O-N 2.65Å; D203-E205 PolarHBondContact O-N 3.4Å
204	I	55.8	Low	61.2	Low	125 Å²	125	108.4 Å²	108.4	64%	0.641	58%	0.576	S	S	*	*			trans	-84.5	30.2	143.5	-34.7	173.3	0	0	0	107.5	V202 L206 I271	V202-I204 PolarHBondContact O-N 2.82Å; I204-L206 PolarHBondContact O-N 2.95Å; I204-I271 HydrophobicContact CD1-CD1 3.42Å; I204-I271 VanDerWaalsContact CD1-CD1 3.42Å
205	E	50.5	Low	62.6	Low	161 Å²	161	113 Å²	113	75%	0.752	59%	0.588	S	S	*	*			trans	-55.9	92.4	140.1	-69.7	-162.5	159.4	0	0	105.1	D203 R207	D203-E205 PolarHBondContact O-N 3.4Å; E205-R207 PolarHBondContact O-N 2.99Å
206	L	55.5	Low	64	Low	117 Å²	117	112.9 Å²	112.9	61%	0.613	59%	0.585	S	S	*	*			trans	-57.7	83.4	165.6	-174.7	77.4	0	0	0	105	I204 P208	I204-L206 PolarHBondContact O-N 2.95Å; L206-P208 WeakPolarHBondContact O-CD 3.44Å
207	R	52.8	Low	65.5	Low	194 Å²	194	111 Å²	111	73%	0.732	57%	0.565	S	S	*	*			trans	-47.6	120.3	169.1	-168.9	178.5	-165.8	-139.3	4.1	103.4	E205 E209	E205-R207 PolarHBondContact O-N 2.99Å; R207-E209 PolarHBondContact O-N 3.42Å
208	P	57	Low	67.2	Low	102 Å²	102	108.4 Å²	108.4	66%	0.662	57%	0.568	S	S	*	*			trans	-59.8	99.7	-178	20.2	-29.6	0	0	0	106.6	L206	L206-P208 WeakPolarHBondContact O-CD 3.44Å
209	E	63	Low	68.9	Low	104 Å²	104	106.9 Å²	106.9	49%	0.486	56%	0.559	S	S	.	*			trans	-67	146.6	-179.7	-77.2	-64.4	133.4	0	0	106.3	R207 S211 D212	R207-E209 PolarHBondContact O-N 3.42Å; E209-S211 WeakPolarHBondContact CB-OG 3.26Å; E209-S211 PolarHBondContact O-N 3.21Å; E209-D212 PolarHBondContact O-N 3.45Å
210	L	65.7	Low	70.7	Confident	144 Å²	144	102.9 Å²	102.9	75%	0.754	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-52.8	-25.4	176.6	-167.9	73.2	0	0	0	111.6	D212 I213	L210-D212 VanDerWaalsContact C-N 3.27Å; L210-D212 PolarHBondContact O-N 2.71Å; L210-I213 HydrophobicContact CD1-CD1 3.56Å; L210-I213 HydrophobicContact CG-CD1 4.44Å; L210-I213 PolarHBondContact O-N 2.58Å
211	S	74.6	Confident	72.7	Confident	73 Å²	73	99.4 Å²	99.4	51%	0.51	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-65	-18.3	175.6	67.3	0	0	0	0	115.4	E209	E209-S211 WeakPolarHBondContact CB-OG 3.26Å; E209-S211 PolarHBondContact O-N 3.21Å
212	D	82.4	Confident	74.8	Confident	41 Å²	41	94.7 Å²	94.7	22%	0.219	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	-87.8	-14.7	179.2	-73.1	-35.9	0	0	0	113.4	E209 L210 R215 L216	E209-D212 PolarHBondContact O-N 3.45Å; L210-D212 VanDerWaalsContact C-N 3.27Å; L210-D212 PolarHBondContact O-N 2.71Å; D212-R215 WeakPolarHBondContact O-CB 3.09Å; D212-R215 PolarHBondContact O-N 3.44Å; D212-R215 IonicContact OD1-CZ 2.67Å; D212-R215 IonicContact OD1-NH1 2.78Å; D212-R215 PolarHBondContact OD1-NH1 2.84Å; D212-L216 PolarHBondContact O-N 2.93Å
213	I	86.8	Confident	76.9	Confident	80 Å²	80	90.8 Å²	90.8	41%	0.41	47%	0.471	S	S	.	.	H	α-helix	trans	-58.1	-51.2	179.4	-63.6	179.4	0	0	0	111.5	L210 R215 L216 F217	L210-I213 HydrophobicContact CD1-CD1 3.56Å; L210-I213 HydrophobicContact CG-CD1 4.44Å; L210-I213 PolarHBondContact O-N 2.58Å; I213-R215 VanDerWaalsContact C-N 3.26Å; I213-R215 PolarHBondContact O-N 3.43Å; I213-L216 WeakPolarHBondContact O-CB 3.23Å; I213-L216 PolarHBondContact O-N 2.82Å; I213-F217 HydrophobicContact CG2-CD2 3.7Å; I213-F217 HydrophobicContact CG2-CE2 3.54Å; I213-F217 VanDerWaalsContact O-CD2 3.27Å; I213-F217 WeakPolarHBondContact O-CD2 3.3Å; I213-F217 PolarHBondContact O-N 3.42Å; I213-F217 VanDerWaalsContact O-N 3.09Å
214	P	90.7	Very high	79.1	Confident	80 Å²	80	85.2 Å²	85.2	52%	0.519	44%	0.441	S	S	.	.	H	α-helix	trans	-59.6	-36.2	178.2	-24	35.1	0	0	0	113	F217 C218	P214-F217 PolarHBondContact O-N 3.32Å; P214-C218 WeakPolarHBondContact O-CB 3.38Å; P214-C218 PolarHBondContact O-N 2.83Å; P214-C218 PolarHBondContact O-SG 3.3Å
215	R	89.8	Confident	81	Confident	168 Å²	168	82.1 Å²	82.1	63%	0.634	43%	0.428	S	S	*	.	H	α-helix	trans	-67.5	-39.8	178.6	-63.9	174.8	176	168.6	-4.4	111.7	D212 I213 S219	D212-R215 WeakPolarHBondContact O-CB 3.09Å; D212-R215 PolarHBondContact O-N 3.44Å; D212-R215 IonicContact OD1-CZ 2.67Å; D212-R215 IonicContact OD1-NH1 2.78Å; D212-R215 PolarHBondContact OD1-NH1 2.84Å; I213-R215 VanDerWaalsContact C-N 3.26Å; I213-R215 PolarHBondContact O-N 3.43Å; R215-S219 VanDerWaalsContact O-CB 3.31Å; R215-S219 WeakPolarHBondContact O-CB 3.49Å; R215-S219 PolarHBondContact O-N 2.81Å; R215-S219 PolarHBondContact O-OG 3.22Å
216	L	89.1	Confident	83.2	Confident	49 Å²	49	76.9 Å²	76.9	26%	0.257	41%	0.405	S	S	.	.	H	α-helix	trans	-59.3	-50.6	173.7	175.4	62.1	0	0	0	110.5	V161 K164 A165 D212 I213 S219 A220	V161-L216 HydrophobicContact CG1-CD2 4.5Å; K164-L216 HydrophobicContact CB-CD1 3.67Å; A165-L216 HydrophobicContact CB-CD2 4.2Å; D212-L216 PolarHBondContact O-N 2.93Å; I213-L216 WeakPolarHBondContact O-CB 3.23Å; I213-L216 PolarHBondContact O-N 2.82Å; L216-S219 PolarHBondContact O-N 3.47Å; L216-S219 PolarHBondContact O-OG 3.49Å; L216-A220 VanDerWaalsContact O-CB 3.24Å; L216-A220 WeakPolarHBondContact O-CB 3.36Å; L216-A220 PolarHBondContact O-N 3.48Å
217	F	92	Very high	85.2	Confident	95 Å²	95	71.6 Å²	71.6	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-60	-51.5	177.3	-81.2	-77.5	0	0	0	112.3	V161 I213 P214 S219 A220 L221	V161-F217 HydrophobicContact CG1-CD1 4.5Å; V161-F217 HydrophobicContact CG1-CE1 4.13Å; V161-F217 HydrophobicContact CG1-CZ 4.42Å; V161-F217 HydrophobicContact CG2-CD1 3.8Å; V161-F217 HydrophobicContact CG2-CE1 3.89Å; I213-F217 HydrophobicContact CG2-CD2 3.7Å; I213-F217 HydrophobicContact CG2-CE2 3.54Å; I213-F217 VanDerWaalsContact O-CD2 3.27Å; I213-F217 WeakPolarHBondContact O-CD2 3.3Å; I213-F217 PolarHBondContact O-N 3.42Å; I213-F217 VanDerWaalsContact O-N 3.09Å; P214-F217 PolarHBondContact O-N 3.32Å; F217-S219 VanDerWaalsContact C-N 3.35Å; F217-S219 PolarHBondContact O-N 3.43Å; F217-A220 PolarHBondContact O-N 2.69Å; F217-L221 WeakPolarHBondContact O-CB 3.4Å; F217-L221 VanDerWaalsContact O-CG 3.29Å; F217-L221 WeakPolarHBondContact O-CG 3.24Å; F217-L221 PolarHBondContact O-N 2.95Å
218	C	92.3	Very high	87.2	Confident	89 Å²	89	63.2 Å²	63.2	60%	0.601	35%	0.349	S	S	*	.	H	α-helix	trans	-58.4	-45.3	180	-72	0	0	0	0	112.1	P214 A222	P214-C218 WeakPolarHBondContact O-CB 3.38Å; P214-C218 PolarHBondContact O-N 2.83Å; P214-C218 PolarHBondContact O-SG 3.3Å; C218-A222 WeakPolarHBondContact O-CB 3.48Å; C218-A222 PolarHBondContact O-N 3.37Å
219	S	90.7	Very high	89.1	Confident	38 Å²	38	62.1 Å²	62.1	27%	0.266	34%	0.339	S	S	.	.	H	α-helix	trans	-73.4	-27.8	-178.8	70.9	0	0	0	0	113.4	K164 R215 L216 F217	K164-S219 PolarHBondContact NZ-O 3.27Å; R215-S219 VanDerWaalsContact O-CB 3.31Å; R215-S219 WeakPolarHBondContact O-CB 3.49Å; R215-S219 PolarHBondContact O-N 2.81Å; R215-S219 PolarHBondContact O-OG 3.22Å; L216-S219 PolarHBondContact O-N 3.47Å; L216-S219 PolarHBondContact O-OG 3.49Å; F217-S219 VanDerWaalsContact C-N 3.35Å; F217-S219 PolarHBondContact O-N 3.43Å
220	A	93.5	Very high	90.6	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-73.6	-47.3	173.5	0	0	0	0	0	111.6	V161 K164 L216 F217 L223	V161-A220 HydrophobicContact CB-CB 4.48Å; V161-A220 HydrophobicContact CG2-CB 3.91Å; K164-A220 HydrophobicContact CB-CB 4.02Å; K164-A220 HydrophobicContact CG-CB 3.84Å; L216-A220 VanDerWaalsContact O-CB 3.24Å; L216-A220 WeakPolarHBondContact O-CB 3.36Å; L216-A220 PolarHBondContact O-N 3.48Å; F217-A220 PolarHBondContact O-N 2.69Å; A220-L223 VanDerWaalsContact O-CB 3.28Å; A220-L223 WeakPolarHBondContact O-CB 3.36Å; A220-L223 PolarHBondContact O-N 2.98Å
221	L	94.6	Very high	92.1	Very high	56 Å²	56	52.5 Å²	52.5	29%	0.293	29%	0.292	S	S	.	.	H	α-helix	trans	-77.1	-23	-177	-60.7	176.8	0	0	0	113.2	Y123 P157 F217 L223	Y123-L221 HydrophobicContact CD1-CD2 4.19Å; Y123-L221 HydrophobicContact CD2-CD2 4.22Å; Y123-L221 HydrophobicContact CE1-CD2 3.76Å; Y123-L221 HydrophobicContact CE2-CB 3.79Å; Y123-L221 HydrophobicContact CE2-CD2 3.78Å; Y123-L221 HydrophobicContact CE2-CG 4.3Å; Y123-L221 HydrophobicContact CG-CD2 4.41Å; Y123-L221 VanDerWaalsContact OH-CA 3.23Å; Y123-L221 WeakPolarHBondContact OH-CA 3.14Å; Y123-L221 PolarHBondContact OH-O 3.43Å; P157-L221 HydrophobicContact CB-CD2 3.81Å; F217-L221 WeakPolarHBondContact O-CB 3.4Å; F217-L221 VanDerWaalsContact O-CG 3.29Å; F217-L221 WeakPolarHBondContact O-CG 3.24Å; F217-L221 PolarHBondContact O-N 2.95Å; L221-L223 VanDerWaalsContact C-N 3.27Å; L221-L223 PolarHBondContact O-N 3.18Å
222	A	94.8	Very high	93	Very high	37 Å²	37	53.4 Å²	53.4	31%	0.306	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-16.3	171.5	0	0	0	0	0	112.9	C218 T225 I226	C218-A222 WeakPolarHBondContact O-CB 3.48Å; C218-A222 PolarHBondContact O-N 3.37Å; A222-T225 PolarHBondContact O-N 3.18Å; A222-I226 HydrophobicContact CB-CD1 3.78Å; A222-I226 HydrophobicContact CB-CG1 4.41Å; A222-I226 WeakPolarHBondContact O-CB 3.38Å; A222-I226 VanDerWaalsContact O-CG1 3.25Å; A222-I226 WeakPolarHBondContact O-CG1 3.23Å; A222-I226 PolarHBondContact O-N 3.04Å
223	L	94.6	Very high	93.6	Very high	29 Å²	29	56.6 Å²	56.6	15%	0.152	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-49.4	-171.4	-179.8	152.1	0	0	0	113.2	L160 K164 A220 L221 T225 I226 S227 L253	L160-L223 HydrophobicContact CD2-CD2 4.04Å; K164-L223 VanDerWaalsContact CE-CD1 3.46Å; A220-L223 VanDerWaalsContact O-CB 3.28Å; A220-L223 WeakPolarHBondContact O-CB 3.36Å; A220-L223 PolarHBondContact O-N 2.98Å; L221-L223 VanDerWaalsContact C-N 3.27Å; L221-L223 PolarHBondContact O-N 3.18Å; L223-T225 PolarHBondContact O-N 2.95Å; L223-I226 PolarHBondContact O-N 3.02Å; L223-S227 VanDerWaalsContact O-CB 3.27Å; L223-S227 WeakPolarHBondContact O-CB 3.38Å; L223-S227 PolarHBondContact O-N 3.24Å; L223-S227 PolarHBondContact O-OG 3.38Å; L223-L253 HydrophobicContact CD1-CD2 4.13Å
224	P	95.5	Very high	94	Very high	7 Å²	7	57.8 Å²	57.8	5%	0.045	31%	0.311	C	S	.	.	H	α-helix	trans	-63.6	-41	-178.4	-24.9	37.3	0	0	0	112.7	Y123 T127 L160 S227 T228	Y123-P224 VanDerWaalsContact OH-CD 3.26Å; Y123-P224 WeakPolarHBondContact OH-CD 3.41Å; Y123-P224 WeakPolarHBondContact OH-CG 3.4Å; T127-P224 HydrophobicContact CG2-CB 3.8Å; T127-P224 HydrophobicContact CG2-CG 3.85Å; L160-P224 HydrophobicContact CD1-CG 3.53Å; L160-P224 HydrophobicContact CD2-CG 4.47Å; P224-S227 PolarHBondContact O-N 3.25Å; P224-T228 WeakPolarHBondContact O-CB 3.08Å; P224-T228 PolarHBondContact O-N 3.46Å; P224-T228 PolarHBondContact O-OG1 2.86Å
225	T	96	Very high	94.2	Very high	60 Å²	60	56.6 Å²	56.6	37%	0.368	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-49.4	176.2	-52.9	0	0	0	0	111	Q130 A222 L223 S227 T228 V229	Q130-T225 PolarHBondContact NE2-OG1 3.34Å; A222-T225 PolarHBondContact O-N 3.18Å; L223-T225 PolarHBondContact O-N 2.95Å; T225-S227 VanDerWaalsContact C-N 3.34Å; T225-S227 PolarHBondContact O-N 3.21Å; T225-T228 PolarHBondContact O-N 2.79Å; T225-V229 WeakPolarHBondContact O-CG2 3.24Å; T225-V229 PolarHBondContact O-N 3.34Å
226	I	96.5	Very high	94.2	Very high	52 Å²	52	55.7 Å²	55.7	27%	0.267	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-43.3	178.1	-66.8	167	0	0	0	110.8	A222 L223 T228 V229 L230 Y252	A222-I226 HydrophobicContact CB-CD1 3.78Å; A222-I226 HydrophobicContact CB-CG1 4.41Å; A222-I226 WeakPolarHBondContact O-CB 3.38Å; A222-I226 VanDerWaalsContact O-CG1 3.25Å; A222-I226 WeakPolarHBondContact O-CG1 3.23Å; A222-I226 PolarHBondContact O-N 3.04Å; L223-I226 PolarHBondContact O-N 3.02Å; I226-T228 VanDerWaalsContact C-N 3.29Å; I226-T228 PolarHBondContact O-N 3.47Å; I226-V229 PolarHBondContact O-N 2.7Å; I226-L230 HydrophobicContact CG2-CD1 3.68Å; I226-L230 HydrophobicContact CG2-CG 4.24Å; I226-L230 WeakPolarHBondContact O-CB 3.29Å; I226-L230 WeakPolarHBondContact O-CG 3.37Å; I226-L230 PolarHBondContact O-N 2.81Å; I226-Y252 HydrophobicContact CD1-CE2 4.08Å; I226-Y252 HydrophobicContact CG2-CD1 4.43Å; I226-Y252 HydrophobicContact CG2-CD2 3.52Å; I226-Y252 HydrophobicContact CG2-CE2 3.93Å; I226-Y252 HydrophobicContact CG2-CG 3.79Å
227	S	96.6	Very high	94.4	Very high	5 Å²	5	64.9 Å²	64.9	4%	0.035	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-41	178.3	-56.8	0	0	0	0	111.3	L223 P224 T225 G231 G249	L223-S227 VanDerWaalsContact O-CB 3.27Å; L223-S227 WeakPolarHBondContact O-CB 3.38Å; L223-S227 PolarHBondContact O-N 3.24Å; L223-S227 PolarHBondContact O-OG 3.38Å; P224-S227 PolarHBondContact O-N 3.25Å; T225-S227 VanDerWaalsContact C-N 3.34Å; T225-S227 PolarHBondContact O-N 3.21Å; S227-G231 PolarHBondContact O-N 2.93Å; S227-G249 WeakPolarHBondContact OG-CA 3.46Å
228	T	95.4	Very high	94.4	Very high	19 Å²	19	61.8 Å²	61.8	12%	0.117	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-48.3	177.7	-55.4	0	0	0	0	111.3	P224 T225 I226 G231 H232 V245	P224-T228 WeakPolarHBondContact O-CB 3.08Å; P224-T228 PolarHBondContact O-N 3.46Å; P224-T228 PolarHBondContact O-OG1 2.86Å; T225-T228 PolarHBondContact O-N 2.79Å; I226-T228 VanDerWaalsContact C-N 3.29Å; I226-T228 PolarHBondContact O-N 3.47Å; T228-G231 PolarHBondContact O-N 3.48Å; T228-H232 PolarHBondContact O-CD2 3.4Å; T228-H232 VanDerWaalsContact O-CD2 3.25Å; T228-H232 PolarHBondContact O-N 2.91Å; T228-V245 HydrophobicContact CG2-CG2 4.34Å
229	V	95.7	Very high	94.2	Very high	78 Å²	78	66.6 Å²	66.6	47%	0.473	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-50.6	178.3	171.5	0	0	0	0	111	T225 I226 G231 H232 L233	T225-V229 WeakPolarHBondContact O-CG2 3.24Å; T225-V229 PolarHBondContact O-N 3.34Å; I226-V229 PolarHBondContact O-N 2.7Å; V229-G231 VanDerWaalsContact C-N 3.34Å; V229-G231 PolarHBondContact O-N 2.98Å; V229-H232 PolarHBondContact O-N 3.3Å; V229-L233 HydrophobicContact CG1-CD1 3.76Å; V229-L233 HydrophobicContact CG1-CG 4.37Å; V229-L233 VanDerWaalsContact O-CG 3.3Å; V229-L233 WeakPolarHBondContact O-CG 3.42Å; V229-L233 PolarHBondContact O-N 2.78Å
230	L	96	Very high	94.2	Very high	47 Å²	47	67.7 Å²	67.7	25%	0.246	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-38	178.7	-71.6	173.6	0	0	0	112.4	I226 H232 L233 L234 Y252	I226-L230 HydrophobicContact CG2-CD1 3.68Å; I226-L230 HydrophobicContact CG2-CG 4.24Å; I226-L230 WeakPolarHBondContact O-CB 3.29Å; I226-L230 WeakPolarHBondContact O-CG 3.37Å; I226-L230 PolarHBondContact O-N 2.81Å; L230-H232 VanDerWaalsContact C-N 3.34Å; L230-H232 PolarHBondContact O-N 2.88Å; L230-L233 PolarHBondContact O-N 3.39Å; L230-L234 HydrophobicContact CD2-CD1 4.2Å; L230-L234 WeakPolarHBondContact O-CB 3.33Å; L230-L234 PolarHBondContact O-N 3.47Å; L230-Y252 HydrophobicContact CD1-CD2 4.35Å; L230-Y252 HydrophobicContact CD1-CG 4.46Å
231	G	95.7	Very high	94	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-56	-48.6	172.6	0	0	0	0	0	111.8	S227 T228 V229 F235 R244	S227-G231 PolarHBondContact O-N 2.93Å; T228-G231 PolarHBondContact O-N 3.48Å; V229-G231 VanDerWaalsContact C-N 3.34Å; V229-G231 PolarHBondContact O-N 2.98Å; G231-F235 CarbonylContact O-C 3.59Å; G231-F235 WeakPolarHBondContact O-CA 3.39Å; G231-F235 WeakPolarHBondContact O-CB 3.4Å; G231-F235 PolarHBondContact O-N 3.34Å; G231-R244 VanDerWaalsContact C-CG 3.42Å; G231-R244 VanDerWaalsContact CA-O 3.26Å; G231-R244 WeakPolarHBondContact CA-O 3.45Å; G231-R244 WeakPolarHBondContact O-CD 3.47Å; G231-R244 WeakPolarHBondContact O-CG 3.38Å
232	H	93.6	Very high	93.8	Very high	91 Å²	91	68.7 Å²	68.7	42%	0.421	35%	0.351	S	S	.	.	H	α-helix	trans	-70.1	-29	178.3	-84.4	-78.7	0	0	0	114.3	T228 V229 L230 K236 R244	T228-H232 PolarHBondContact O-CD2 3.4Å; T228-H232 VanDerWaalsContact O-CD2 3.25Å; T228-H232 PolarHBondContact O-N 2.91Å; V229-H232 PolarHBondContact O-N 3.3Å; L230-H232 VanDerWaalsContact C-N 3.34Å; L230-H232 PolarHBondContact O-N 2.88Å; H232-K236 VanDerWaalsContact O-CE 3.25Å; H232-K236 WeakPolarHBondContact O-CE 3.43Å; H232-K236 WeakPolarHBondContact O-CG 3.36Å; H232-R244 PolarHBondContact CE1-NH1 3.14Å; H232-R244 PolarHBondContact ND1-NH1 2.87Å; H232-R244 VanDerWaalsContact ND1-NH1 3.14Å
233	L	94.8	Very high	93.7	Very high	109 Å²	109	71.4 Å²	71.4	57%	0.571	36%	0.358	S	S	*	.	H	α-helix	trans	-82.2	-49.1	179.5	-69.4	176.3	0	0	0	112.2	V229 L230	V229-L233 HydrophobicContact CG1-CD1 3.76Å; V229-L233 HydrophobicContact CG1-CG 4.37Å; V229-L233 VanDerWaalsContact O-CG 3.3Å; V229-L233 WeakPolarHBondContact O-CG 3.42Å; V229-L233 PolarHBondContact O-N 2.78Å; L230-L233 PolarHBondContact O-N 3.39Å
234	L	95.2	Very high	93.7	Very high	104 Å²	104	72.1 Å²	72.1	55%	0.545	36%	0.358	S	S	.	.	H	α-helix	trans	-90.5	-33.8	-171.1	-59.5	177.3	0	0	0	113.1	L230 T251	L230-L234 HydrophobicContact CD2-CD1 4.2Å; L230-L234 WeakPolarHBondContact O-CB 3.33Å; L230-L234 PolarHBondContact O-N 3.47Å; L234-T251 HydrophobicContact CD1-CG2 3.99Å
235	F	94.7	Very high	93.7	Very high	56 Å²	56	72.3 Å²	72.3	25%	0.246	36%	0.359	C	S	.	.			trans	-115.5	39	-170.3	-58.1	-75.7	0	0	0	113	G231 R237 V238 R244 L247 T251	G231-F235 CarbonylContact O-C 3.59Å; G231-F235 WeakPolarHBondContact O-CA 3.39Å; G231-F235 WeakPolarHBondContact O-CB 3.4Å; G231-F235 PolarHBondContact O-N 3.34Å; F235-R237 PolarHBondContact O-N 3.38Å; F235-R237 VanDerWaalsContact O-N 3.07Å; F235-V238 HydrophobicContact CB-CG2 4.09Å; F235-V238 WeakPolarHBondContact O-CB 3.43Å; F235-V238 PolarHBondContact O-N 3.06Å; F235-R244 HydrophobicContact CB-CG 4.1Å; F235-L247 HydrophobicContact CB-CD1 4.43Å; F235-L247 HydrophobicContact CD1-CB 4.26Å; F235-L247 HydrophobicContact CD1-CD1 3.87Å; F235-L247 HydrophobicContact CD2-CB 3.68Å; F235-L247 HydrophobicContact CE1-CB 4.3Å; F235-L247 HydrophobicContact CE1-CD1 4.27Å; F235-L247 HydrophobicContact CE2-CB 3.73Å; F235-L247 HydrophobicContact CG-CB 3.96Å; F235-L247 HydrophobicContact CG-CD1 4.06Å; F235-L247 HydrophobicContact CZ-CB 4.04Å; F235-T251 WeakPolarHBondContact CE2-OG1 3.44Å; F235-T251 WeakPolarHBondContact CZ-OG1 3.2Å
236	K	90.6	Very high	93.6	Very high	148 Å²	148	75.4 Å²	75.4	64%	0.643	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-31.6	178.4	-68.8	-177.7	-176.7	-178.1	0	113.9	H232 V238	H232-K236 VanDerWaalsContact O-CE 3.25Å; H232-K236 WeakPolarHBondContact O-CE 3.43Å; H232-K236 WeakPolarHBondContact O-CG 3.36Å; K236-V238 VanDerWaalsContact C-N 3.28Å; K236-V238 PolarHBondContact O-N 3.3Å
237	R	93.1	Very high	93.6	Very high	242 Å²	242	74.9 Å²	74.9	91%	0.913	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-20.7	-178.3	-166.4	173.7	-178.5	171.7	0.8	113.5	F235 Q239	F235-R237 PolarHBondContact O-N 3.38Å; F235-R237 VanDerWaalsContact O-N 3.07Å; R237-Q239 PolarHBondContact O-N 3Å
238	V	91.5	Very high	93.6	Very high	30 Å²	30	74.6 Å²	74.6	18%	0.182	37%	0.369	C	S	.	.			trans	-77.7	120.9	-179.1	177.6	0	0	0	0	109.5	F235 K236 H243 R244 L247	F235-V238 HydrophobicContact CB-CG2 4.09Å; F235-V238 WeakPolarHBondContact O-CB 3.43Å; F235-V238 PolarHBondContact O-N 3.06Å; K236-V238 VanDerWaalsContact C-N 3.28Å; K236-V238 PolarHBondContact O-N 3.3Å; V238-H243 HydrophobicContact CG1-CB 3.95Å; V238-H243 VanDerWaalsContact CG1-ND1 3.3Å; V238-H243 WeakPolarHBondContact CG1-ND1 3.46Å; V238-R244 HydrophobicContact CB-CB 4.28Å; V238-R244 HydrophobicContact CG1-CB 4.18Å; V238-R244 PolarHBondContact O-NE 2.94Å; V238-R244 VanDerWaalsContact O-NE 3.14Å; V238-R244 PolarHBondContact O-NH2 3.04Å; V238-L247 HydrophobicContact CG2-CD1 3.86Å
239	Q	88.6	Confident	93.6	Very high	191 Å²	191	74.1 Å²	74.1	89%	0.893	37%	0.367	S	S	*	.			trans	-73.5	-40.9	-175.7	-65.4	-178.9	-0.6	0	0	113	R237 A241	R237-Q239 PolarHBondContact O-N 3Å; Q239-A241 PolarHBondContact O-N 3.1Å
240	S	90.4	Very high	93.6	Very high	60 Å²	60	76.1 Å²	76.1	42%	0.42	38%	0.375	S	S	.	.			trans	-72.4	124.5	178.8	175.6	0	0	0	0	111.4	T242 R244	S240-T242 PolarHBondContact OG-OG1 3.37Å; S240-T242 VanDerWaalsContact OG-OG1 3.12Å; S240-R244 WeakPolarHBondContact O-CB 3.38Å; S240-R244 PolarHBondContact O-N 2.75Å
241	A	89.3	Confident	93.5	Very high	31 Å²	31	76.1 Å²	76.1	26%	0.256	38%	0.376	S	S	.	.	H	α-helix	trans	-61.5	-45.1	179.4	0	0	0	0	0	111.9	Q239 H243 R244 V245	Q239-A241 PolarHBondContact O-N 3.1Å; A241-H243 PolarHBondContact O-N 3.35Å; A241-R244 WeakPolarHBondContact O-CB 3.27Å; A241-R244 PolarHBondContact O-N 3.3Å; A241-V245 WeakPolarHBondContact O-CG2 3.36Å; A241-V245 PolarHBondContact O-N 3.06Å
242	T	90.6	Very high	93.5	Very high	46 Å²	46	78.3 Å²	78.3	28%	0.282	39%	0.385	S	S	.	.	H	α-helix	trans	-62.6	-47.2	-179.6	56.3	0	0	0	0	111.3	V131 Y132 S240 R244 V245 L246	V131-T242 HydrophobicContact CG1-CG2 4.33Å; Y132-T242 HydrophobicContact CD1-CG2 3.78Å; Y132-T242 HydrophobicContact CE1-CG2 3.63Å; S240-T242 PolarHBondContact OG-OG1 3.37Å; S240-T242 VanDerWaalsContact OG-OG1 3.12Å; T242-R244 VanDerWaalsContact C-N 3.29Å; T242-R244 PolarHBondContact O-N 3.46Å; T242-V245 PolarHBondContact O-N 3.37Å; T242-L246 WeakPolarHBondContact O-CB 3.26Å; T242-L246 VanDerWaalsContact O-CG 3.29Å; T242-L246 WeakPolarHBondContact O-CG 3.4Å; T242-L246 PolarHBondContact O-N 3.5Å
243	H	93.4	Very high	93.5	Very high	94 Å²	94	76.5 Å²	76.5	44%	0.435	38%	0.378	S	S	.	.	H	α-helix	trans	-62.5	-39.2	178.5	-171.2	-112.7	0	0	0	111.7	V238 A241 L246 L247	V238-H243 HydrophobicContact CG1-CB 3.95Å; V238-H243 VanDerWaalsContact CG1-ND1 3.3Å; V238-H243 WeakPolarHBondContact CG1-ND1 3.46Å; A241-H243 PolarHBondContact O-N 3.35Å; H243-L246 PolarHBondContact O-N 3.45Å; H243-L247 WeakPolarHBondContact O-CG 3.36Å; H243-L247 PolarHBondContact O-N 3.08Å
244	R	95	Very high	93.3	Very high	45 Å²	45	73 Å²	73	17%	0.17	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-45.6	176.2	-173.8	-171.2	-61.7	171.8	-0.4	112	G231 H232 F235 V238 S240 A241 T242 G248	G231-R244 VanDerWaalsContact C-CG 3.42Å; G231-R244 VanDerWaalsContact CA-O 3.26Å; G231-R244 WeakPolarHBondContact CA-O 3.45Å; G231-R244 WeakPolarHBondContact O-CD 3.47Å; G231-R244 WeakPolarHBondContact O-CG 3.38Å; H232-R244 PolarHBondContact CE1-NH1 3.14Å; H232-R244 PolarHBondContact ND1-NH1 2.87Å; H232-R244 VanDerWaalsContact ND1-NH1 3.14Å; F235-R244 HydrophobicContact CB-CG 4.1Å; V238-R244 HydrophobicContact CB-CB 4.28Å; V238-R244 HydrophobicContact CG1-CB 4.18Å; V238-R244 PolarHBondContact O-NE 2.94Å; V238-R244 VanDerWaalsContact O-NE 3.14Å; V238-R244 PolarHBondContact O-NH2 3.04Å; S240-R244 WeakPolarHBondContact O-CB 3.38Å; S240-R244 PolarHBondContact O-N 2.75Å; A241-R244 WeakPolarHBondContact O-CB 3.27Å; A241-R244 PolarHBondContact O-N 3.3Å; T242-R244 VanDerWaalsContact C-N 3.29Å; T242-R244 PolarHBondContact O-N 3.46Å; R244-G248 PolarHBondContact O-N 3.21Å
245	V	95	Very high	93.2	Very high	11 Å²	11	71.8 Å²	71.8	7%	0.067	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-41.1	178.2	176.8	0	0	0	0	110.9	V131 T228 A241 T242 L247 G248 G249	V131-V245 HydrophobicContact CG2-CG1 4.21Å; T228-V245 HydrophobicContact CG2-CG2 4.34Å; A241-V245 WeakPolarHBondContact O-CG2 3.36Å; A241-V245 PolarHBondContact O-N 3.06Å; T242-V245 PolarHBondContact O-N 3.37Å; V245-L247 PolarHBondContact O-N 3.42Å; V245-G248 PolarHBondContact O-N 3.36Å; V245-G249 PolarHBondContact O-N 3.32Å
246	L	94.6	Very high	93.1	Very high	124 Å²	124	71.6 Å²	71.6	65%	0.649	36%	0.364	S	S	*	.	H	α-helix	trans	-60.5	-44.6	176.2	-72.9	173.2	0	0	0	112.2	T242 H243 G249 L250	T242-L246 WeakPolarHBondContact O-CB 3.26Å; T242-L246 VanDerWaalsContact O-CG 3.29Å; T242-L246 WeakPolarHBondContact O-CG 3.4Å; T242-L246 PolarHBondContact O-N 3.5Å; H243-L246 PolarHBondContact O-N 3.45Å; L246-G249 PolarHBondContact O-N 3.49Å; L246-L250 WeakPolarHBondContact O-CB 3.49Å; L246-L250 PolarHBondContact O-N 2.81Å
247	L	96	Very high	93	Very high	41 Å²	41	64.7 Å²	64.7	22%	0.215	34%	0.335	C	S	.	.	H	α-helix	trans	-62.5	-43.3	175	-72.5	173.3	0	0	0	111.7	F235 V238 H243 V245 G249 L250 T251	F235-L247 HydrophobicContact CB-CD1 4.43Å; F235-L247 HydrophobicContact CD1-CB 4.26Å; F235-L247 HydrophobicContact CD1-CD1 3.87Å; F235-L247 HydrophobicContact CD2-CB 3.68Å; F235-L247 HydrophobicContact CE1-CB 4.3Å; F235-L247 HydrophobicContact CE1-CD1 4.27Å; F235-L247 HydrophobicContact CE2-CB 3.73Å; F235-L247 HydrophobicContact CG-CB 3.96Å; F235-L247 HydrophobicContact CG-CD1 4.06Å; F235-L247 HydrophobicContact CZ-CB 4.04Å; V238-L247 HydrophobicContact CG2-CD1 3.86Å; H243-L247 WeakPolarHBondContact O-CG 3.36Å; H243-L247 PolarHBondContact O-N 3.08Å; V245-L247 PolarHBondContact O-N 3.42Å; L247-G249 VanDerWaalsContact C-N 3.32Å; L247-G249 PolarHBondContact O-N 3.02Å; L247-L250 PolarHBondContact O-N 3.46Å; L247-T251 PolarHBondContact O-N 2.97Å; L247-T251 PolarHBondContact O-OG1 3.46Å
248	G	96.7	Very high	92.8	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.6	-42.3	174.4	0	0	0	0	0	112.9	R244 V245 Y252	R244-G248 PolarHBondContact O-N 3.21Å; V245-G248 PolarHBondContact O-N 3.36Å; G248-Y252 WeakPolarHBondContact O-CB 3.36Å; G248-Y252 PolarHBondContact O-N 2.84Å
249	G	95.3	Very high	92.8	Very high	8 Å²	8	62.8 Å²	62.8	8%	0.082	34%	0.34	C	S	.	.	H	α-helix	trans	-66.1	-42.7	175.5	0	0	0	0	0	113.3	S227 V245 L246 L247 Y252 L253	S227-G249 WeakPolarHBondContact OG-CA 3.46Å; V245-G249 PolarHBondContact O-N 3.32Å; L246-G249 PolarHBondContact O-N 3.49Å; L247-G249 VanDerWaalsContact C-N 3.32Å; L247-G249 PolarHBondContact O-N 3.02Å; G249-Y252 PolarHBondContact O-N 3.14Å; G249-L253 WeakPolarHBondContact O-CB 3.46Å; G249-L253 WeakPolarHBondContact O-CG 3.43Å; G249-L253 PolarHBondContact O-N 3.47Å
250	L	94.5	Very high	92.7	Very high	121 Å²	121	55 Å²	55	63%	0.634	31%	0.306	S	S	*	.	H	α-helix	trans	-62.3	-44.2	175.9	-176.5	65.3	0	0	0	111.3	L246 L247 L253 G254	L246-L250 WeakPolarHBondContact O-CB 3.49Å; L246-L250 PolarHBondContact O-N 2.81Å; L247-L250 PolarHBondContact O-N 3.46Å; L250-L253 PolarHBondContact O-N 2.86Å; L250-G254 PolarHBondContact O-N 3.41Å
251	T	95.9	Very high	92.4	Very high	46 Å²	46	53.3 Å²	53.3	28%	0.282	29%	0.292	S	S	.	.	H	α-helix	trans	-61.6	-45.4	175.1	-58.4	0	0	0	0	111.5	L234 F235 L247 G254 V255	L234-T251 HydrophobicContact CD1-CG2 3.99Å; F235-T251 WeakPolarHBondContact CE2-OG1 3.44Å; F235-T251 WeakPolarHBondContact CZ-OG1 3.2Å; L247-T251 PolarHBondContact O-N 2.97Å; L247-T251 PolarHBondContact O-OG1 3.46Å; T251-G254 PolarHBondContact O-N 2.89Å; T251-V255 HydrophobicContact CG2-CG2 4.3Å; T251-V255 WeakPolarHBondContact O-CB 3.49Å; T251-V255 WeakPolarHBondContact O-CG2 3.41Å; T251-V255 PolarHBondContact O-N 2.87Å
252	Y	95.2	Very high	92.2	Very high	46 Å²	46	58.8 Å²	58.8	18%	0.18	31%	0.307	C	S	.	.	H	α-helix	trans	-59.1	-50.7	176.4	172.4	-109.6	0	0	0	112.3	I226 L230 G248 G249 G254 V255 K256	I226-Y252 HydrophobicContact CD1-CE2 4.08Å; I226-Y252 HydrophobicContact CG2-CD1 4.43Å; I226-Y252 HydrophobicContact CG2-CD2 3.52Å; I226-Y252 HydrophobicContact CG2-CE2 3.93Å; I226-Y252 HydrophobicContact CG2-CG 3.79Å; L230-Y252 HydrophobicContact CD1-CD2 4.35Å; L230-Y252 HydrophobicContact CD1-CG 4.46Å; G248-Y252 WeakPolarHBondContact O-CB 3.36Å; G248-Y252 PolarHBondContact O-N 2.84Å; G249-Y252 PolarHBondContact O-N 3.14Å; Y252-G254 VanDerWaalsContact C-N 3.31Å; Y252-G254 PolarHBondContact O-N 3.29Å; Y252-V255 PolarHBondContact O-N 2.9Å; Y252-K256 HydrophobicContact CE2-CB 4.36Å; Y252-K256 WeakPolarHBondContact O-CB 3.07Å; Y252-K256 PolarHBondContact O-N 3.42Å
253	L	92.2	Very high	91.9	Very high	53 Å²	53	63 Å²	63	28%	0.277	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-40.6	179.7	-72.4	173.1	0	0	0	111.5	W168 L223 G249 L250 G257	W168-L253 HydrophobicContact CZ2-CD2 4.46Å; L223-L253 HydrophobicContact CD1-CD2 4.13Å; G249-L253 WeakPolarHBondContact O-CB 3.46Å; G249-L253 WeakPolarHBondContact O-CG 3.43Å; G249-L253 PolarHBondContact O-N 3.47Å; L250-L253 PolarHBondContact O-N 2.86Å; L253-G257 WeakPolarHBondContact O-CA 3.49Å; L253-G257 PolarHBondContact O-N 2.78Å
254	G	91.8	Very high	91.3	Very high	35 Å²	35	61.6 Å²	61.6	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-62.1	-53.5	175.9	0	0	0	0	0	112.4	L250 T251 Y252 G257 L258	L250-G254 PolarHBondContact O-N 3.41Å; T251-G254 PolarHBondContact O-N 2.89Å; Y252-G254 VanDerWaalsContact C-N 3.31Å; Y252-G254 PolarHBondContact O-N 3.29Å; G254-G257 PolarHBondContact O-N 3.17Å; G254-L258 WeakPolarHBondContact O-CB 3.47Å; G254-L258 VanDerWaalsContact O-CG 3.3Å; G254-L258 WeakPolarHBondContact O-CG 3.17Å; G254-L258 PolarHBondContact O-N 3.5Å
255	V	93.5	Very high	90.6	Very high	79 Å²	79	60.9 Å²	60.9	48%	0.479	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-48.3	-180	172.8	0	0	0	0	111.2	T251 Y252 G257 L258 L259	T251-V255 HydrophobicContact CG2-CG2 4.3Å; T251-V255 WeakPolarHBondContact O-CB 3.49Å; T251-V255 WeakPolarHBondContact O-CG2 3.41Å; T251-V255 PolarHBondContact O-N 2.87Å; Y252-V255 PolarHBondContact O-N 2.9Å; V255-G257 VanDerWaalsContact C-N 3.35Å; V255-G257 PolarHBondContact O-N 3.07Å; V255-L258 PolarHBondContact O-N 3.4Å; V255-L259 HydrophobicContact CG1-CD1 3.95Å; V255-L259 HydrophobicContact CG1-CG 4.49Å; V255-L259 WeakPolarHBondContact O-CB 3.48Å; V255-L259 WeakPolarHBondContact O-CG 3.13Å; V255-L259 PolarHBondContact O-N 3.32Å
256	K	91.3	Very high	90.1	Very high	53 Å²	53	64 Å²	64	23%	0.23	32%	0.324	C	S	.	.	H	α-helix	trans	-60.6	-45.2	178.3	-176.4	-101.2	177.9	-172.1	0	111.1	E169 Y252 L259 T260	E169-K256 IonicContact OE2-NZ 2.7Å; E169-K256 PolarHBondContact OE2-NZ 3.21Å; Y252-K256 HydrophobicContact CE2-CB 4.36Å; Y252-K256 WeakPolarHBondContact O-CB 3.07Å; Y252-K256 PolarHBondContact O-N 3.42Å; K256-L259 PolarHBondContact O-N 3.33Å; K256-T260 WeakPolarHBondContact O-CB 3.42Å; K256-T260 PolarHBondContact O-N 2.9Å; K256-T260 PolarHBondContact O-OG1 2.98Å
257	G	89.2	Confident	89.5	Confident	2 Å²	2	62.1 Å²	62.1	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-60.2	-48.3	177.4	0	0	0	0	0	112.9	L253 G254 V255 L259 T260 I261	L253-G257 WeakPolarHBondContact O-CA 3.49Å; L253-G257 PolarHBondContact O-N 2.78Å; G254-G257 PolarHBondContact O-N 3.17Å; V255-G257 VanDerWaalsContact C-N 3.35Å; V255-G257 PolarHBondContact O-N 3.07Å; G257-L259 PolarHBondContact O-N 2.8Å; G257-T260 PolarHBondContact O-N 3.14Å; G257-I261 WeakPolarHBondContact O-CB 3.44Å; G257-I261 VanDerWaalsContact O-CG1 3.22Å; G257-I261 WeakPolarHBondContact O-CG1 3.16Å; G257-I261 PolarHBondContact O-N 3.35Å
258	L	89.4	Confident	88.6	Confident	122 Å²	122	62.5 Å²	62.5	64%	0.639	31%	0.311	S	S	*	.	H	α-helix	trans	-60.3	-44.2	177.1	-73.4	171.3	0	0	0	112	G254 V255 I261 Y262	G254-L258 WeakPolarHBondContact O-CB 3.47Å; G254-L258 VanDerWaalsContact O-CG 3.3Å; G254-L258 WeakPolarHBondContact O-CG 3.17Å; G254-L258 PolarHBondContact O-N 3.5Å; V255-L258 PolarHBondContact O-N 3.4Å; L258-I261 PolarHBondContact O-N 3.39Å; L258-Y262 VanDerWaalsContact O-CB 3.3Å; L258-Y262 WeakPolarHBondContact O-CB 3.35Å; L258-Y262 PolarHBondContact O-N 3.45Å
259	L	90.3	Very high	87.9	Confident	110 Å²	110	64.7 Å²	64.7	58%	0.576	32%	0.322	S	S	*	.	H	α-helix	trans	-63.8	-41.9	176.8	-72.2	172.8	0	0	0	112.1	V255 K256 G257 Y262 Y263	V255-L259 HydrophobicContact CG1-CD1 3.95Å; V255-L259 HydrophobicContact CG1-CG 4.49Å; V255-L259 WeakPolarHBondContact O-CB 3.48Å; V255-L259 WeakPolarHBondContact O-CG 3.13Å; V255-L259 PolarHBondContact O-N 3.32Å; K256-L259 PolarHBondContact O-N 3.33Å; G257-L259 PolarHBondContact O-N 2.8Å; L259-Y262 PolarHBondContact O-N 3.46Å; L259-Y263 VanDerWaalsContact O-CB 3.29Å; L259-Y263 WeakPolarHBondContact O-CB 3.47Å; L259-Y263 PolarHBondContact O-N 3.1Å
260	T	86.8	Confident	87.4	Confident	29 Å²	29	74.1 Å²	74.1	18%	0.178	36%	0.355	C	S	.	.	H	α-helix	trans	-66.8	-41.5	177.5	-60.2	0	0	0	0	112	E169 K256 G257 Y263 R264	E169-T260 HydrophobicContact CG-CG2 4.43Å; K256-T260 WeakPolarHBondContact O-CB 3.42Å; K256-T260 PolarHBondContact O-N 2.9Å; K256-T260 PolarHBondContact O-OG1 2.98Å; G257-T260 PolarHBondContact O-N 3.14Å; T260-Y263 PolarHBondContact O-N 3.49Å; T260-R264 WeakPolarHBondContact O-CG 3.47Å; T260-R264 PolarHBondContact O-N 2.8Å
261	I	84.4	Confident	86.8	Confident	23 Å²	23	72.6 Å²	72.6	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-57.2	-52.8	172.9	-74.9	168.1	0	0	0	109.9	L172 L173 W176 G257 L258 Y263 R264 E265	L172-I261 HydrophobicContact CD2-CD1 3.98Å; L173-I261 HydrophobicContact CD1-CG1 4.3Å; L173-I261 HydrophobicContact CD2-CB 3.92Å; L173-I261 HydrophobicContact CD2-CG1 3.71Å; L173-I261 HydrophobicContact CD2-CG2 3.57Å; L173-I261 HydrophobicContact CG-CB 4.49Å; L173-I261 HydrophobicContact CG-CG1 3.81Å; W176-I261 HydrophobicContact CE3-CG2 4.46Å; W176-I261 HydrophobicContact CZ3-CG2 4.27Å; G257-I261 WeakPolarHBondContact O-CB 3.44Å; G257-I261 VanDerWaalsContact O-CG1 3.22Å; G257-I261 WeakPolarHBondContact O-CG1 3.16Å; G257-I261 PolarHBondContact O-N 3.35Å; L258-I261 PolarHBondContact O-N 3.39Å; I261-Y263 PolarHBondContact O-N 3.19Å; I261-R264 PolarHBondContact O-N 3Å; I261-E265 WeakPolarHBondContact O-CG 3.3Å; I261-E265 PolarHBondContact O-N 3.42Å
262	Y	84.7	Confident	86	Confident	146 Å²	146	72.3 Å²	72.3	57%	0.573	35%	0.347	S	S	*	.	H	α-helix	trans	-61.5	-42.9	-179.6	-178.5	-108.4	0	0	0	112.7	L258 L259 R264 E265 L266	L258-Y262 VanDerWaalsContact O-CB 3.3Å; L258-Y262 WeakPolarHBondContact O-CB 3.35Å; L258-Y262 PolarHBondContact O-N 3.45Å; L259-Y262 PolarHBondContact O-N 3.46Å; Y262-R264 VanDerWaalsContact C-N 3.35Å; Y262-R264 PolarHBondContact O-N 3.36Å; Y262-E265 WeakPolarHBondContact O-CB 3.34Å; Y262-E265 PolarHBondContact O-N 3.26Å; Y262-L266 HydrophobicContact CD1-CD1 3.96Å; Y262-L266 HydrophobicContact CD1-CG 4.44Å; Y262-L266 HydrophobicContact CE1-CD1 3.42Å; Y262-L266 VanDerWaalsContact CE1-CD1 3.42Å; Y262-L266 HydrophobicContact CE1-CG 4.05Å; Y262-L266 HydrophobicContact CE2-CG 4.44Å; Y262-L266 WeakPolarHBondContact O-CG 3.11Å; Y262-L266 PolarHBondContact O-N 3.36Å
263	Y	84.7	Confident	85.4	Confident	136 Å²	136	76.7 Å²	76.7	53%	0.533	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-43.5	176.3	178.3	-104.4	0	0	0	112.1	L259 T260 I261 L266 Q267	L259-Y263 VanDerWaalsContact O-CB 3.29Å; L259-Y263 WeakPolarHBondContact O-CB 3.47Å; L259-Y263 PolarHBondContact O-N 3.1Å; T260-Y263 PolarHBondContact O-N 3.49Å; I261-Y263 PolarHBondContact O-N 3.19Å; Y263-L266 PolarHBondContact O-N 3.1Å; Y263-Q267 HydrophobicContact CD1-CG 4.31Å; Y263-Q267 HydrophobicContact CE1-CG 3.9Å; Y263-Q267 HydrophobicContact CE2-CG 4.33Å; Y263-Q267 WeakPolarHBondContact O-CG 3.5Å; Y263-Q267 PolarHBondContact O-N 2.78Å; Y263-Q267 PolarHBondContact OH-NE2 3.01Å; Y263-Q267 VanDerWaalsContact OH-NE2 3.16Å
264	R	82	Confident	85.1	Confident	63 Å²	63	83.2 Å²	83.2	24%	0.238	39%	0.385	C	S	.	.	H	α-helix	trans	-65.3	-37.4	176.6	-75.2	177.2	176.9	178.1	7.1	112.4	E169 S170 L173 T260 I261 Y262 Q267 Y268	E169-R264 IonicContact OE1-CZ 3.7Å; E169-R264 IonicContact OE1-NH2 2.93Å; E169-R264 PolarHBondContact OE1-NH2 2.96Å; S170-R264 VanDerWaalsContact CA-NH1 3.33Å; S170-R264 PolarHBondContact OG-NH1 3.34Å; S170-R264 PolarHBondContact OG-NH2 3.38Å; L173-R264 HydrophobicContact CD1-CB 4.13Å; L173-R264 HydrophobicContact CD1-CG 4.37Å; T260-R264 WeakPolarHBondContact O-CG 3.47Å; T260-R264 PolarHBondContact O-N 2.8Å; I261-R264 PolarHBondContact O-N 3Å; Y262-R264 VanDerWaalsContact C-N 3.35Å; Y262-R264 PolarHBondContact O-N 3.36Å; R264-Q267 PolarHBondContact O-N 3.11Å; R264-Y268 WeakPolarHBondContact O-CB 3.39Å; R264-Y268 PolarHBondContact O-N 3.06Å
265	E	78.6	Confident	84.8	Confident	30 Å²	30	90.1 Å²	90.1	14%	0.14	41%	0.407	C	S	.	.	H	α-helix	trans	-60.7	-45.5	171.5	-68.6	-60.1	152.3	0	0	111.7	W176 R177 I261 Y262 Q267 Y268 I269	W176-E265 HydrophobicContact CZ3-CG 4.2Å; W176-E265 WeakPolarHBondContact CZ3-OE1 3.33Å; R177-E265 IonicContact CZ-OE1 2.71Å; R177-E265 IonicContact CZ-OE2 3.77Å; R177-E265 IonicContact NE-OE1 3.05Å; R177-E265 PolarHBondContact NE-OE1 3.48Å; R177-E265 IonicContact NE-OE2 2.79Å; R177-E265 IonicContact NH2-OE1 3.97Å; R177-E265 PolarHBondContact NH2-OE1 2.97Å; R177-E265 IonicContact NH2-OE2 3.13Å; R177-E265 PolarHBondContact NH2-OE2 2.76Å; I261-E265 WeakPolarHBondContact O-CG 3.3Å; I261-E265 PolarHBondContact O-N 3.42Å; Y262-E265 WeakPolarHBondContact O-CB 3.34Å; Y262-E265 PolarHBondContact O-N 3.26Å; E265-Q267 PolarHBondContact O-N 3.27Å; E265-Y268 WeakPolarHBondContact O-CB 3.32Å; E265-Y268 PolarHBondContact O-N 3.07Å; E265-I269 VanDerWaalsContact O-CG1 3.31Å; E265-I269 WeakPolarHBondContact O-CG1 3.34Å; E265-I269 PolarHBondContact O-N 3.24Å
266	L	84.3	Confident	84.5	Confident	78 Å²	78	91.5 Å²	91.5	41%	0.408	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-41.6	177.5	-71.5	179.4	0	0	0	112.7	Y262 Y263 Y268 I269 R270	Y262-L266 HydrophobicContact CD1-CD1 3.96Å; Y262-L266 HydrophobicContact CD1-CG 4.44Å; Y262-L266 HydrophobicContact CE1-CD1 3.42Å; Y262-L266 VanDerWaalsContact CE1-CD1 3.42Å; Y262-L266 HydrophobicContact CE1-CG 4.05Å; Y262-L266 HydrophobicContact CE2-CG 4.44Å; Y262-L266 WeakPolarHBondContact O-CG 3.11Å; Y262-L266 PolarHBondContact O-N 3.36Å; Y263-L266 PolarHBondContact O-N 3.1Å; L266-Y268 VanDerWaalsContact C-N 3.34Å; L266-I269 PolarHBondContact O-N 2.67Å; L266-R270 WeakPolarHBondContact O-CB 3.47Å; L266-R270 PolarHBondContact O-N 3.15Å
267	Q	83.8	Confident	84.5	Confident	84 Å²	84	98.2 Å²	98.2	39%	0.393	45%	0.445	S	S	.	.	H	α-helix	trans	-61.9	-43.9	175.4	-73.7	-176	-57.1	0	0	111.5	Y263 R264 E265 R270 I271	Y263-Q267 HydrophobicContact CD1-CG 4.31Å; Y263-Q267 HydrophobicContact CE1-CG 3.9Å; Y263-Q267 HydrophobicContact CE2-CG 4.33Å; Y263-Q267 WeakPolarHBondContact O-CG 3.5Å; Y263-Q267 PolarHBondContact O-N 2.78Å; Y263-Q267 PolarHBondContact OH-NE2 3.01Å; Y263-Q267 VanDerWaalsContact OH-NE2 3.16Å; R264-Q267 PolarHBondContact O-N 3.11Å; E265-Q267 PolarHBondContact O-N 3.27Å; Q267-R270 WeakPolarHBondContact O-CB 3.45Å; Q267-R270 PolarHBondContact O-N 2.63Å; Q267-I271 WeakPolarHBondContact O-CG1 3.31Å; Q267-I271 PolarHBondContact O-N 2.84Å
268	Y	76.8	Confident	84.4	Confident	48 Å²	48	105 Å²	105	19%	0.188	48%	0.481	C	S	.	.	H	α-helix	trans	-59	-50.8	176.3	175.4	-98.7	0	0	0	111.5	P195 R264 E265 L266 R270 I271 C272	P195-Y268 HydrophobicContact CG-CE1 4.25Å; R264-Y268 WeakPolarHBondContact O-CB 3.39Å; R264-Y268 PolarHBondContact O-N 3.06Å; E265-Y268 WeakPolarHBondContact O-CB 3.32Å; E265-Y268 PolarHBondContact O-N 3.07Å; L266-Y268 VanDerWaalsContact C-N 3.34Å; Y268-R270 VanDerWaalsContact C-N 3.28Å; Y268-R270 PolarHBondContact O-N 2.96Å; Y268-I271 PolarHBondContact O-N 3.09Å; Y268-C272 VanDerWaalsContact CE1-SG 3.56Å; Y268-C272 PolarHBondContact O-N 3.05Å; Y268-C272 PolarHBondContact O-SG 2.59Å; Y268-C272 VanDerWaalsContact O-SG 3.4Å
269	I	80.5	Confident	84.4	Confident	46 Å²	46	109 Å²	109	24%	0.236	49%	0.489	C	S	.	.	H	α-helix	trans	-54.6	-46.7	176.2	-70.4	169.1	0	0	0	110.3	L194 E265 L266 I271 C272 Y273	L194-I269 HydrophobicContact CD2-CD1 4.1Å; E265-I269 VanDerWaalsContact O-CG1 3.31Å; E265-I269 WeakPolarHBondContact O-CG1 3.34Å; E265-I269 PolarHBondContact O-N 3.24Å; L266-I269 PolarHBondContact O-N 2.67Å; I269-I271 VanDerWaalsContact C-N 3.28Å; I269-I271 PolarHBondContact O-N 2.98Å; I269-C272 PolarHBondContact O-N 2.93Å; I269-Y273 HydrophobicContact CG2-CD2 3.66Å; I269-Y273 HydrophobicContact CG2-CE2 3.81Å; I269-Y273 VanDerWaalsContact O-CD2 3.24Å; I269-Y273 WeakPolarHBondContact O-CD2 3.17Å; I269-Y273 PolarHBondContact O-N 3.09Å
270	R	84.8	Confident	84.1	Confident	206 Å²	206	110.8 Å²	110.8	78%	0.777	50%	0.499	S	S	*	.	H	α-helix	trans	-59.8	-36.7	178.9	-173.2	178.2	179.3	-178.2	-0.1	113	L266 Q267 Y268 R274	L266-R270 WeakPolarHBondContact O-CB 3.47Å; L266-R270 PolarHBondContact O-N 3.15Å; Q267-R270 WeakPolarHBondContact O-CB 3.45Å; Q267-R270 PolarHBondContact O-N 2.63Å; Y268-R270 VanDerWaalsContact C-N 3.28Å; Y268-R270 PolarHBondContact O-N 2.96Å; R270-R274 PolarHBondContact O-N 3.01Å
271	I	82.1	Confident	83.6	Confident	90 Å²	90	121.4 Å²	121.4	46%	0.462	55%	0.547	S	S	.	.	H	α-helix	trans	-72.3	-42.4	177.4	-67.1	170.4	0	0	0	110.5	I204 Q267 Y268 I269 Y273 R274	I204-I271 HydrophobicContact CD1-CD1 3.42Å; I204-I271 VanDerWaalsContact CD1-CD1 3.42Å; Q267-I271 WeakPolarHBondContact O-CG1 3.31Å; Q267-I271 PolarHBondContact O-N 2.84Å; Y268-I271 PolarHBondContact O-N 3.09Å; I269-I271 VanDerWaalsContact C-N 3.28Å; I269-I271 PolarHBondContact O-N 2.98Å; I271-Y273 VanDerWaalsContact C-N 3.32Å; I271-Y273 PolarHBondContact O-N 3.09Å; I271-R274 VanDerWaalsContact O-CB 3.24Å; I271-R274 WeakPolarHBondContact O-CB 3.17Å; I271-R274 PolarHBondContact O-N 3.24Å
272	C	79.9	Confident	83.6	Confident	40 Å²	40	126.4 Å²	126.4	27%	0.27	57%	0.568	S	S	.	*	H	α-helix	trans	-63.2	-36	177.3	-66.6	0	0	0	0	113.2	P195 Y268 I269 R274	P195-C272 HydrophobicContact CB-CB 4.45Å; P195-C272 HydrophobicContact CG-CB 3.76Å; Y268-C272 VanDerWaalsContact CE1-SG 3.56Å; Y268-C272 PolarHBondContact O-N 3.05Å; Y268-C272 PolarHBondContact O-SG 2.59Å; Y268-C272 VanDerWaalsContact O-SG 3.4Å; I269-C272 PolarHBondContact O-N 2.93Å; C272-R274 VanDerWaalsContact C-N 3.34Å
273	Y	82.4	Confident	83.5	Confident	137 Å²	137	125.3 Å²	125.3	54%	0.537	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91	9.5	177.1	-71.5	-75.9	0	0	0	113.7	D193 I269 I271 Q275	D193-Y273 PolarHBondContact O-OH 2.68Å; I269-Y273 HydrophobicContact CG2-CD2 3.66Å; I269-Y273 HydrophobicContact CG2-CE2 3.81Å; I269-Y273 VanDerWaalsContact O-CD2 3.24Å; I269-Y273 WeakPolarHBondContact O-CD2 3.17Å; I269-Y273 PolarHBondContact O-N 3.09Å; I271-Y273 VanDerWaalsContact C-N 3.32Å; I271-Y273 PolarHBondContact O-N 3.09Å; Y273-Q275 PolarHBondContact O-N 3.15Å
274	R	85.2	Confident	83.4	Confident	191 Å²	191	124.7 Å²	124.7	72%	0.721	57%	0.57	S	S	*	*			trans	-63.9	119.8	174	172.2	-177.9	157.8	-170	-6.1	109	R270 I271 C272	R270-R274 PolarHBondContact O-N 3.01Å; I271-R274 VanDerWaalsContact O-CB 3.24Å; I271-R274 WeakPolarHBondContact O-CB 3.17Å; I271-R274 PolarHBondContact O-N 3.24Å; C272-R274 VanDerWaalsContact C-N 3.34Å
275	Q	86.2	Confident	83.5	Confident	179 Å²	179	128.4 Å²	128.4	84%	0.836	59%	0.589	S	S	*	*			trans	-105.7	134.2	169.6	-66.8	-179.5	-18.3	0	0	109.2	Y273	Y273-Q275 PolarHBondContact O-N 3.15Å
276	V	87.5	Confident	83.8	Confident	109 Å²	109	134.5 Å²	134.5	66%	0.661	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-95.1	117.1	167.4	-179.3	0	0	0	0	105.5
277	K	90.1	Very high	83.8	Confident	193 Å²	193	138.3 Å²	138.3	84%	0.839	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-71.4	138.3	175.1	-66.1	-174	176.6	-172.6	0	108.6
278	D	87.4	Confident	83.8	Confident	145 Å²	145	142.1 Å²	142.1	78%	0.775	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-65.9	153.8	169.1	-63.9	-43.4	0	0	0	109.7	D280	D278-D280 PolarHBondContact O-N 3.43Å
279	Y	90.3	Very high	84.3	Confident	207 Å²	207	149.4 Å²	149.4	81%	0.812	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-75.5	121	176.1	-175.8	-88.8	0	0	0	108.5
280	D	83.5	Confident	84.7	Confident	147 Å²	147	158 Å²	158	79%	0.786	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-78.3	118.3	173.4	-62.3	-41.3	0	0	0	108.5	D278	D278-D280 PolarHBondContact O-N 3.43Å
281	E	76.8	Confident	84.7	Confident	252 Å²	252	153.6 Å²	153.6	100%	1.178	72%	0.716	S	S	*	*			trans	-66.1	0	175.7	-69.2	-175	171.7	0	0	113.3

Retrieved 281 of 281 residues in 780 ms (Link to these results)

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