G4LUA8_SCHMA Loading...

Protein RER1

Involved in the retention or retrieval of proteins localized in the endoplasmic reticulum from the early Golgi compartment.

AlphaFold DB , UniProt , Accession G4LUA8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 183 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	54.8	Low	54.5	Low	194 Å²	194	129.2 Å²	129.2	96%	0.956	64%	0.643	S	S	*	*				0	-29.7	0	-147.2	68.9	167.3	0	0	111.1	Y3	M1-Y3 PolarHBondContact O-N 3.37Å
2	D	59.3	Low	54.9	Low	120 Å²	120	126.8 Å²	126.8	64%	0.642	65%	0.648	S	S	*	*	H	α-helix	trans	-71.1	-26.1	-172	-48.5	-64.7	0	0	0	115.7	T5 Q6	D2-T5 VanDerWaalsContact CA-OG1 3.31Å; D2-T5 WeakPolarHBondContact CA-OG1 3.34Å; D2-T5 PolarHBondContact O-N 3.48Å; D2-T5 PolarHBondContact O-OG1 2.97Å; D2-Q6 WeakPolarHBondContact O-CB 3.46Å; D2-Q6 PolarHBondContact O-N 2.72Å
3	Y	57.7	Low	55.7	Low	200 Å²	200	124.2 Å²	124.2	78%	0.784	65%	0.648	S	S	*	*	H	α-helix	trans	-64.2	-42.9	177.8	-106.5	-88.6	0	0	0	112.6	M1 Q6 E7	M1-Y3 PolarHBondContact O-N 3.37Å; Y3-Q6 PolarHBondContact O-N 2.88Å; Y3-E7 PolarHBondContact O-N 3.15Å
4	Y	54.5	Low	56.7	Low	182 Å²	182	122.4 Å²	122.4	71%	0.714	63%	0.633	S	S	*	*	H	α-helix	trans	-69.2	-38	178.5	-70.4	-79.8	0	0	0	111.7	Q6 E7 V8	Y4-Q6 VanDerWaalsContact C-N 3.29Å; Y4-Q6 PolarHBondContact O-N 3.01Å; Y4-E7 PolarHBondContact O-N 2.77Å; Y4-V8 WeakPolarHBondContact O-CB 3.28Å; Y4-V8 VanDerWaalsContact O-CG2 3.23Å; Y4-V8 WeakPolarHBondContact O-CG2 3.42Å; Y4-V8 PolarHBondContact O-N 3.27Å
5	T	55.6	Low	58.3	Low	63 Å²	63	119.9 Å²	119.9	39%	0.387	63%	0.627	S	S	.	*	H	α-helix	trans	-67.7	-30.6	176	46.5	0	0	0	0	111.9	D2 V8 Q9	D2-T5 VanDerWaalsContact CA-OG1 3.31Å; D2-T5 WeakPolarHBondContact CA-OG1 3.34Å; D2-T5 PolarHBondContact O-N 3.48Å; D2-T5 PolarHBondContact O-OG1 2.97Å; T5-V8 PolarHBondContact O-N 2.73Å; T5-Q9 WeakPolarHBondContact O-CB 3.41Å; T5-Q9 VanDerWaalsContact O-CG 3.28Å; T5-Q9 WeakPolarHBondContact O-CG 3.3Å; T5-Q9 PolarHBondContact O-N 3.29Å; T5-Q9 PolarHBondContact O-OE1 3.41Å
6	Q	51.7	Low	59.7	Low	137 Å²	137	121.3 Å²	121.3	64%	0.64	63%	0.629	S	S	*	*	H	α-helix	trans	-72	-38.1	177	-143.5	170	-41	0	0	112.8	D2 Y3 Y4 S10	D2-Q6 WeakPolarHBondContact O-CB 3.46Å; D2-Q6 PolarHBondContact O-N 2.72Å; Y3-Q6 PolarHBondContact O-N 2.88Å; Y4-Q6 VanDerWaalsContact C-N 3.29Å; Y4-Q6 PolarHBondContact O-N 3.01Å; Q6-S10 WeakPolarHBondContact O-CB 3.31Å; Q6-S10 PolarHBondContact O-N 2.94Å; Q6-S10 PolarHBondContact O-OG 3.49Å
7	E	52.7	Low	61	Low	139 Å²	139	123.1 Å²	123.1	65%	0.65	63%	0.632	S	S	*	*	H	α-helix	trans	-67.8	-41.3	171	-80.3	-168.2	159.5	0	0	112	Y3 Y4 S10 S11	Y3-E7 PolarHBondContact O-N 3.15Å; Y4-E7 PolarHBondContact O-N 2.77Å; E7-S10 PolarHBondContact O-OG 2.92Å; E7-S10 VanDerWaalsContact O-OG 3.07Å; E7-S11 PolarHBondContact O-N 3.26Å; E7-S11 PolarHBondContact O-OG 3.34Å
8	V	54.4	Low	62.1	Low	97 Å²	97	119.3 Å²	119.3	59%	0.588	62%	0.615	S	S	*	*	H	α-helix	trans	-68.9	-36.2	176.9	177.6	0	0	0	0	111.5	Y4 T5 S11 S12	Y4-V8 WeakPolarHBondContact O-CB 3.28Å; Y4-V8 VanDerWaalsContact O-CG2 3.23Å; Y4-V8 WeakPolarHBondContact O-CG2 3.42Å; Y4-V8 PolarHBondContact O-N 3.27Å; T5-V8 PolarHBondContact O-N 2.73Å; V8-S11 WeakPolarHBondContact CA-OG 3.41Å; V8-S11 PolarHBondContact O-OG 3.49Å; V8-S12 VanDerWaalsContact O-CB 3.3Å; V8-S12 WeakPolarHBondContact O-CB 3.4Å; V8-S12 PolarHBondContact O-N 2.95Å; V8-S12 VanDerWaalsContact O-N 3.09Å
9	Q	50.2	Low	63.2	Low	133 Å²	133	120.9 Å²	120.9	62%	0.621	61%	0.612	S	S	*	*	H	α-helix	trans	-74.2	-35.8	176.1	-78.8	178.8	-82.4	0	0	112.8	T5 S11 S12 S13	T5-Q9 WeakPolarHBondContact O-CB 3.41Å; T5-Q9 VanDerWaalsContact O-CG 3.28Å; T5-Q9 WeakPolarHBondContact O-CG 3.3Å; T5-Q9 PolarHBondContact O-N 3.29Å; T5-Q9 PolarHBondContact O-OE1 3.41Å; Q9-S11 VanDerWaalsContact C-N 3.29Å; Q9-S11 PolarHBondContact O-N 3.37Å; Q9-S12 PolarHBondContact O-N 3.21Å; Q9-S13 WeakPolarHBondContact O-CB 3.46Å; Q9-S13 PolarHBondContact O-N 3.3Å; Q9-S13 PolarHBondContact O-OG 3.33Å
10	S	54.5	Low	64.2	Low	77 Å²	77	121.3 Å²	121.3	54%	0.538	61%	0.61	S	S	.	*	H	α-helix	trans	-68.6	-28.3	176.1	69.4	0	0	0	0	112.8	Q6 E7	Q6-S10 WeakPolarHBondContact O-CB 3.31Å; Q6-S10 PolarHBondContact O-N 2.94Å; Q6-S10 PolarHBondContact O-OG 3.49Å; E7-S10 PolarHBondContact O-OG 2.92Å; E7-S10 VanDerWaalsContact O-OG 3.07Å
11	S	54	Low	64.9	Low	79 Å²	79	117.8 Å²	117.8	55%	0.552	60%	0.596	S	S	*	*	H	α-helix	trans	-80	-32.2	173.1	51.5	0	0	0	0	113.3	E7 V8 Q9	E7-S11 PolarHBondContact O-N 3.26Å; E7-S11 PolarHBondContact O-OG 3.34Å; V8-S11 WeakPolarHBondContact CA-OG 3.41Å; V8-S11 PolarHBondContact O-OG 3.49Å; Q9-S11 VanDerWaalsContact C-N 3.29Å; Q9-S11 PolarHBondContact O-N 3.37Å
12	S	59.1	Low	66.3	Low	100 Å²	100	112.6 Å²	112.6	70%	0.699	57%	0.57	S	S	*	*	H	α-helix	trans	-79.2	-23.8	-177.5	-169.4	0	0	0	0	114.4	V8 Q9 K14	V8-S12 VanDerWaalsContact O-CB 3.3Å; V8-S12 WeakPolarHBondContact O-CB 3.4Å; V8-S12 PolarHBondContact O-N 2.95Å; V8-S12 VanDerWaalsContact O-N 3.09Å; Q9-S12 PolarHBondContact O-N 3.21Å; S12-K14 PolarHBondContact O-N 2.87Å
13	S	65.4	Low	67.4	Low	93 Å²	93	111 Å²	111	65%	0.65	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	20.6	-172.5	51.9	0	0	0	0	115.3	Q9	Q9-S13 WeakPolarHBondContact O-CB 3.46Å; Q9-S13 PolarHBondContact O-N 3.3Å; Q9-S13 PolarHBondContact O-OG 3.33Å
14	K	69.6	Low	68.4	Low	100 Å²	100	108 Å²	108	44%	0.435	56%	0.555	S	S	.	*	S	Bend	trans	-77.6	133.5	173.3	-70.4	-175.1	178.6	-177	0	110.2	S12 E16 V18 E22	S12-K14 PolarHBondContact O-N 2.87Å; K14-E16 PolarHBondContact O-N 3.24Å; K14-V18 HydrophobicContact CD-CG1 4.41Å; K14-E22 IonicContact NZ-OE1 3.25Å; K14-E22 PolarHBondContact NZ-OE1 2.96Å; K14-E22 IonicContact NZ-OE2 3.53Å
15	P	80.9	Confident	69.5	Low	84 Å²	84	102.6 Å²	102.6	55%	0.545	54%	0.541	S	S	.	.			trans	-58.9	142.2	178.1	6	-7.2	0	0	0	110.8	F17 V18 R19	P15-F17 PolarHBondContact O-N 2.99Å; P15-V18 HydrophobicContact CB-CG2 4.47Å; P15-V18 HydrophobicContact CG-CB 4.29Å; P15-V18 HydrophobicContact CG-CG2 3.71Å; P15-V18 WeakPolarHBondContact O-CA 3.46Å; P15-V18 WeakPolarHBondContact O-CB 3.33Å; P15-V18 PolarHBondContact O-N 2.87Å; P15-R19 PolarHBondContact O-N 3.46Å; P15-R19 VanDerWaalsContact O-N 3.15Å
16	E	81.6	Confident	70.7	Confident	142 Å²	142	105.4 Å²	105.4	66%	0.664	55%	0.55	S	S	*	.	H	α-helix	trans	-49	-37.4	-179.4	-74	-68.9	148.7	0	0	112.8	K14 V18 R19 F20	K14-E16 PolarHBondContact O-N 3.24Å; E16-V18 PolarHBondContact O-N 3.21Å; E16-R19 PolarHBondContact O-N 2.91Å; E16-F20 WeakPolarHBondContact O-CB 3.24Å; E16-F20 PolarHBondContact O-N 3.41Å
17	F	80.8	Confident	72.1	Confident	153 Å²	153	104.6 Å²	104.6	67%	0.671	55%	0.546	S	S	*	.	H	α-helix	trans	-61.9	-42.4	175.5	-179.6	-101	0	0	0	112.9	P15 R19 F20 C21	P15-F17 PolarHBondContact O-N 2.99Å; F17-R19 VanDerWaalsContact C-N 3.34Å; F17-F20 PolarHBondContact O-N 3.12Å; F17-C21 VanDerWaalsContact CZ-SG 3.58Å; F17-C21 WeakPolarHBondContact O-CB 3.43Å; F17-C21 PolarHBondContact O-N 3.04Å; F17-C21 PolarHBondContact O-SG 2.86Å
18	V	80.3	Confident	73.3	Confident	54 Å²	54	103.8 Å²	103.8	33%	0.327	54%	0.54	S	S	.	.	H	α-helix	trans	-65	-43.4	177.4	174.1	0	0	0	0	109.7	K14 P15 E16 F20 C21 E22	K14-V18 HydrophobicContact CD-CG1 4.41Å; P15-V18 HydrophobicContact CB-CG2 4.47Å; P15-V18 HydrophobicContact CG-CB 4.29Å; P15-V18 HydrophobicContact CG-CG2 3.71Å; P15-V18 WeakPolarHBondContact O-CA 3.46Å; P15-V18 WeakPolarHBondContact O-CB 3.33Å; P15-V18 PolarHBondContact O-N 2.87Å; E16-V18 PolarHBondContact O-N 3.21Å; V18-F20 VanDerWaalsContact C-N 3.34Å; V18-F20 PolarHBondContact O-N 3.43Å; V18-C21 PolarHBondContact O-N 3.21Å; V18-E22 HydrophobicContact CG1-CG 4.26Å; V18-E22 WeakPolarHBondContact O-CB 3.5Å; V18-E22 VanDerWaalsContact O-CG 3.29Å; V18-E22 WeakPolarHBondContact O-CG 3.24Å; V18-E22 PolarHBondContact O-N 3.35Å
19	R	83	Confident	74.5	Confident	151 Å²	151	102.1 Å²	102.1	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-59.6	-44.6	175.2	-173.6	-177.7	176.2	-167.6	0.7	111.5	P15 E16 F17 E22 V23	P15-R19 PolarHBondContact O-N 3.46Å; P15-R19 VanDerWaalsContact O-N 3.15Å; E16-R19 PolarHBondContact O-N 2.91Å; F17-R19 VanDerWaalsContact C-N 3.34Å; R19-E22 PolarHBondContact O-N 3.18Å; R19-V23 VanDerWaalsContact O-CG2 3.28Å; R19-V23 WeakPolarHBondContact O-CG2 3.35Å; R19-V23 PolarHBondContact O-N 3.46Å
20	F	84	Confident	76	Confident	127 Å²	127	100.3 Å²	100.3	56%	0.557	52%	0.518	S	S	*	.	H	α-helix	trans	-61.9	-44.1	176.8	-177.4	-98.2	0	0	0	112.3	E16 F17 V18 V23 K24	E16-F20 WeakPolarHBondContact O-CB 3.24Å; E16-F20 PolarHBondContact O-N 3.41Å; F17-F20 PolarHBondContact O-N 3.12Å; V18-F20 VanDerWaalsContact C-N 3.34Å; V18-F20 PolarHBondContact O-N 3.43Å; F20-V23 PolarHBondContact O-N 3.47Å; F20-K24 WeakPolarHBondContact O-CB 3.49Å; F20-K24 PolarHBondContact O-N 2.93Å
21	C	78.7	Confident	77.2	Confident	49 Å²	49	100.5 Å²	100.5	33%	0.331	52%	0.516	S	S	.	.	H	α-helix	trans	-62.9	-41.7	174.6	-75.5	0	0	0	0	112.4	F17 V18 K24 T25	F17-C21 VanDerWaalsContact CZ-SG 3.58Å; F17-C21 WeakPolarHBondContact O-CB 3.43Å; F17-C21 PolarHBondContact O-N 3.04Å; F17-C21 PolarHBondContact O-SG 2.86Å; V18-C21 PolarHBondContact O-N 3.21Å; C21-K24 PolarHBondContact O-N 3.3Å; C21-T25 VanDerWaalsContact O-CB 3.26Å; C21-T25 WeakPolarHBondContact O-CB 3.48Å; C21-T25 PolarHBondContact O-N 2.97Å; C21-T25 PolarHBondContact O-OG1 2.65Å
22	E	83.6	Confident	78.3	Confident	85 Å²	85	98.5 Å²	98.5	40%	0.397	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-47.1	176.5	-76	177.7	161.6	0	0	111	K14 V18 R19 T25 Q26	K14-E22 IonicContact NZ-OE1 3.25Å; K14-E22 PolarHBondContact NZ-OE1 2.96Å; K14-E22 IonicContact NZ-OE2 3.53Å; V18-E22 HydrophobicContact CG1-CG 4.26Å; V18-E22 WeakPolarHBondContact O-CB 3.5Å; V18-E22 VanDerWaalsContact O-CG 3.29Å; V18-E22 WeakPolarHBondContact O-CG 3.24Å; V18-E22 PolarHBondContact O-N 3.35Å; R19-E22 PolarHBondContact O-N 3.18Å; E22-T25 PolarHBondContact O-N 3.04Å; E22-Q26 WeakPolarHBondContact O-CB 3.19Å; E22-Q26 PolarHBondContact O-N 3.38Å
23	V	83.7	Confident	79.2	Confident	86 Å²	86	97.4 Å²	97.4	52%	0.521	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-45.8	177.9	171.8	0	0	0	0	111.3	R19 F20 T25 Q26 H27	R19-V23 VanDerWaalsContact O-CG2 3.28Å; R19-V23 WeakPolarHBondContact O-CG2 3.35Å; R19-V23 PolarHBondContact O-N 3.46Å; F20-V23 PolarHBondContact O-N 3.47Å; V23-T25 VanDerWaalsContact C-N 3.31Å; V23-T25 PolarHBondContact O-N 3.22Å; V23-Q26 PolarHBondContact O-N 3.06Å; V23-H27 WeakPolarHBondContact O-CB 3.32Å; V23-H27 PolarHBondContact O-N 3.28Å
24	K	78.5	Confident	80.1	Confident	137 Å²	137	97.3 Å²	97.3	60%	0.596	49%	0.485	S	S	*	.	H	α-helix	trans	-62.8	-40.4	177.5	-176.6	-179	-83.8	-172.6	0	111.4	F20 C21 H27 F28	F20-K24 WeakPolarHBondContact O-CB 3.49Å; F20-K24 PolarHBondContact O-N 2.93Å; C21-K24 PolarHBondContact O-N 3.3Å; K24-H27 PolarHBondContact O-N 3.44Å; K24-F28 PolarHBondContact O-N 3.42Å
25	T	76.9	Confident	80.9	Confident	69 Å²	69	100.4 Å²	100.4	42%	0.423	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-42.8	177.1	-59.7	0	0	0	0	111.2	C21 E22 V23 F28 Y29	C21-T25 VanDerWaalsContact O-CB 3.26Å; C21-T25 WeakPolarHBondContact O-CB 3.48Å; C21-T25 PolarHBondContact O-N 2.97Å; C21-T25 PolarHBondContact O-OG1 2.65Å; E22-T25 PolarHBondContact O-N 3.04Å; V23-T25 VanDerWaalsContact C-N 3.31Å; V23-T25 PolarHBondContact O-N 3.22Å; T25-F28 WeakPolarHBondContact O-CB 3.37Å; T25-F28 PolarHBondContact O-N 3.23Å; T25-Y29 HydrophobicContact CG2-CD2 3.9Å; T25-Y29 HydrophobicContact CG2-CE2 3.41Å; T25-Y29 VanDerWaalsContact CG2-CE2 3.41Å; T25-Y29 WeakPolarHBondContact O-CD2 3.24Å; T25-Y29 PolarHBondContact O-N 3.47Å; T25-Y29 VanDerWaalsContact O-N 3.09Å
26	Q	82	Confident	81.1	Confident	121 Å²	121	98 Å²	98	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-62.7	-45.3	175.6	-176.8	172.5	-16.4	0	0	111.4	E22 V23 F28 Y29 D30	E22-Q26 WeakPolarHBondContact O-CB 3.19Å; E22-Q26 PolarHBondContact O-N 3.38Å; V23-Q26 PolarHBondContact O-N 3.06Å; Q26-F28 VanDerWaalsContact C-N 3.28Å; Q26-F28 PolarHBondContact O-N 3.16Å; Q26-Y29 WeakPolarHBondContact O-CA 3.45Å; Q26-Y29 WeakPolarHBondContact O-CB 3.18Å; Q26-Y29 PolarHBondContact O-N 3.11Å; Q26-D30 VanDerWaalsContact O-CG 3.29Å; Q26-D30 PolarHBondContact O-N 3.07Å
27	H	80.2	Confident	81.5	Confident	121 Å²	121	96.8 Å²	96.8	56%	0.56	49%	0.485	S	S	*	.	H	α-helix	trans	-58.5	-40.8	175.3	-175	-59.1	0	0	0	111.9	V23 K24 Y29 D30 V31	V23-H27 WeakPolarHBondContact O-CB 3.32Å; V23-H27 PolarHBondContact O-N 3.28Å; K24-H27 PolarHBondContact O-N 3.44Å; H27-Y29 VanDerWaalsContact C-N 3.35Å; H27-D30 PolarHBondContact O-N 2.87Å; H27-V31 WeakPolarHBondContact O-CG2 3.25Å; H27-V31 PolarHBondContact O-N 2.91Å; H27-V31 VanDerWaalsContact O-N 3.08Å
28	F	77.2	Confident	82	Confident	122 Å²	122	91.7 Å²	91.7	54%	0.535	48%	0.475	S	S	.	.	H	α-helix	trans	-60.4	-45.5	174.9	-177.7	-104.6	0	0	0	111.3	K24 T25 Q26 D30 V31 L32	K24-F28 PolarHBondContact O-N 3.42Å; T25-F28 WeakPolarHBondContact O-CB 3.37Å; T25-F28 PolarHBondContact O-N 3.23Å; Q26-F28 VanDerWaalsContact C-N 3.28Å; Q26-F28 PolarHBondContact O-N 3.16Å; F28-D30 PolarHBondContact O-N 2.9Å; F28-V31 PolarHBondContact O-N 3.11Å; F28-L32 HydrophobicContact CD1-CD1 3.51Å; F28-L32 HydrophobicContact CD2-CD1 3.88Å; F28-L32 HydrophobicContact CE1-CD1 3.18Å; F28-L32 HydrophobicContact CE2-CD1 3.58Å; F28-L32 HydrophobicContact CG-CD1 3.87Å; F28-L32 HydrophobicContact CZ-CD1 3.23Å; F28-L32 VanDerWaalsContact O-CD1 3.31Å; F28-L32 WeakPolarHBondContact O-CD1 3.3Å; F28-L32 PolarHBondContact O-N 3.05Å; F28-L32 VanDerWaalsContact O-N 3.16Å
29	Y	80.2	Confident	82.5	Confident	61 Å²	61	89.9 Å²	89.9	24%	0.239	46%	0.463	C	S	.	.	H	α-helix	trans	-61.7	-40.3	175.3	-72.9	-58.9	0	0	0	113	T25 Q26 H27 V31 L32 T33 L111 N115	T25-Y29 HydrophobicContact CG2-CD2 3.9Å; T25-Y29 HydrophobicContact CG2-CE2 3.41Å; T25-Y29 VanDerWaalsContact CG2-CE2 3.41Å; T25-Y29 WeakPolarHBondContact O-CD2 3.24Å; T25-Y29 PolarHBondContact O-N 3.47Å; T25-Y29 VanDerWaalsContact O-N 3.09Å; Q26-Y29 WeakPolarHBondContact O-CA 3.45Å; Q26-Y29 WeakPolarHBondContact O-CB 3.18Å; Q26-Y29 PolarHBondContact O-N 3.11Å; H27-Y29 VanDerWaalsContact C-N 3.35Å; Y29-V31 VanDerWaalsContact C-N 3.33Å; Y29-V31 PolarHBondContact O-N 3.11Å; Y29-L32 PolarHBondContact O-N 3.03Å; Y29-T33 PolarHBondContact O-N 3.4Å; Y29-T33 PolarHBondContact O-OG1 3.42Å; Y29-L111 HydrophobicContact CD1-CD2 3.67Å; Y29-L111 HydrophobicContact CD1-CG 3.9Å; Y29-L111 HydrophobicContact CG-CD2 4.11Å; Y29-L111 WeakPolarHBondContact O-CD2 3.47Å; Y29-N115 HydrophobicContact CE1-CB 4.32Å; Y29-N115 PolarHBondContact OH-ND2 3.35Å
30	D	82.2	Confident	83	Confident	95 Å²	95	87 Å²	87	51%	0.508	45%	0.452	S	S	.	.	H	α-helix	trans	-64.1	-38.5	179.6	-66	-22.9	0	0	0	111.5	Q26 H27 F28 T33	Q26-D30 VanDerWaalsContact O-CG 3.29Å; Q26-D30 PolarHBondContact O-N 3.07Å; H27-D30 PolarHBondContact O-N 2.87Å; F28-D30 PolarHBondContact O-N 2.9Å; D30-T33 WeakPolarHBondContact O-CB 3.43Å; D30-T33 PolarHBondContact O-N 3.43Å
31	V	80.3	Confident	83.5	Confident	82 Å²	82	84.6 Å²	84.6	50%	0.497	45%	0.45	S	S	.	.	H	α-helix	trans	-69.7	-33	176.7	173.8	0	0	0	0	112.9	H27 F28 Y29 P34	H27-V31 WeakPolarHBondContact O-CG2 3.25Å; H27-V31 PolarHBondContact O-N 2.91Å; H27-V31 VanDerWaalsContact O-N 3.08Å; F28-V31 PolarHBondContact O-N 3.11Å; Y29-V31 VanDerWaalsContact C-N 3.33Å; Y29-V31 PolarHBondContact O-N 3.11Å; V31-P34 WeakPolarHBondContact O-CD 3.33Å
32	L	75.9	Confident	84.2	Confident	36 Å²	36	86.9 Å²	86.9	19%	0.188	45%	0.454	C	S	.	.	H	α-helix	trans	-81.2	-14.9	177.7	-89.9	130.1	0	0	0	113.9	F28 Y29 R39 L111 W114	F28-L32 HydrophobicContact CD1-CD1 3.51Å; F28-L32 HydrophobicContact CD2-CD1 3.88Å; F28-L32 HydrophobicContact CE1-CD1 3.18Å; F28-L32 HydrophobicContact CE2-CD1 3.58Å; F28-L32 HydrophobicContact CG-CD1 3.87Å; F28-L32 HydrophobicContact CZ-CD1 3.23Å; F28-L32 VanDerWaalsContact O-CD1 3.31Å; F28-L32 WeakPolarHBondContact O-CD1 3.3Å; F28-L32 PolarHBondContact O-N 3.05Å; F28-L32 VanDerWaalsContact O-N 3.16Å; Y29-L32 PolarHBondContact O-N 3.03Å; L32-R39 HydrophobicContact CD2-CG 4.07Å; L32-R39 WeakPolarHBondContact O-CD 3.03Å; L32-R39 PolarHBondContact O-NE 2.82Å; L32-L111 HydrophobicContact CB-CD1 4.29Å; L32-W114 HydrophobicContact CD2-CH2 3.9Å; L32-W114 HydrophobicContact CD2-CZ3 3.91Å
33	T	78.1	Confident	84.8	Confident	77 Å²	77	83 Å²	83	47%	0.472	44%	0.437	S	S	.	.	S	Bend	trans	-56.6	-47.7	-177.6	-65.9	0	0	0	0	114.2	Y29 D30 Y35	Y29-T33 PolarHBondContact O-N 3.4Å; Y29-T33 PolarHBondContact O-OG1 3.42Å; D30-T33 WeakPolarHBondContact O-CB 3.43Å; D30-T33 PolarHBondContact O-N 3.43Å; T33-Y35 PolarHBondContact O-N 3.49Å
34	P	84.7	Confident	85.4	Confident	91 Å²	91	82.1 Å²	82.1	59%	0.591	43%	0.431	S	S	*	.	S	Bend	trans	-68.2	-30.4	-174	24	-33.7	0	0	0	114.2	V31 A36	V31-P34 WeakPolarHBondContact O-CD 3.33Å; P34-A36 PolarHBondContact O-N 2.9Å; P34-A36 VanDerWaalsContact O-N 3.09Å
35	Y	85.4	Confident	86.2	Confident	165 Å²	165	80.8 Å²	80.8	65%	0.647	43%	0.43	S	S	*	.			trans	-91.1	57.3	-170.6	-57	-70	0	0	0	113.4	T33 V37 G38 R39	T33-Y35 PolarHBondContact O-N 3.49Å; Y35-V37 PolarHBondContact O-N 3.36Å; Y35-G38 PolarHBondContact O-N 3.19Å; Y35-R39 WeakPolarHBondContact O-CB 3.22Å; Y35-R39 VanDerWaalsContact O-CG 3.29Å; Y35-R39 WeakPolarHBondContact O-CG 3.23Å; Y35-R39 PolarHBondContact O-N 2.87Å
36	A	86	Confident	87.2	Confident	35 Å²	35	78.3 Å²	78.3	29%	0.289	41%	0.414	S	S	.	.	H	α-helix	trans	-59.5	-47.2	-177.6	0	0	0	0	0	113.5	P34 G38 R39 W40	P34-A36 PolarHBondContact O-N 2.9Å; P34-A36 VanDerWaalsContact O-N 3.09Å; A36-G38 PolarHBondContact O-N 3.31Å; A36-R39 WeakPolarHBondContact O-CB 3.13Å; A36-R39 PolarHBondContact O-N 2.84Å; A36-W40 PolarHBondContact O-N 3.47Å; A36-W40 VanDerWaalsContact O-N 3.09Å
37	V	90.1	Very high	87.8	Confident	116 Å²	116	75.8 Å²	75.8	70%	0.703	40%	0.404	S	S	*	.	H	α-helix	trans	-62.8	-46.5	-179.5	-178.7	0	0	0	0	111.1	Y35 R39 W40 C41	Y35-V37 PolarHBondContact O-N 3.36Å; V37-R39 VanDerWaalsContact C-N 3.33Å; V37-R39 PolarHBondContact O-N 3.39Å; V37-W40 PolarHBondContact O-N 3.41Å; V37-C41 WeakPolarHBondContact O-CB 3.24Å; V37-C41 PolarHBondContact O-N 2.84Å; V37-C41 PolarHBondContact O-SG 3.37Å; V37-C41 VanDerWaalsContact O-SG 3.41Å
38	G	91.3	Very high	88.6	Confident	45 Å²	45	76 Å²	76	46%	0.464	40%	0.404	S	S	.	.	H	α-helix	trans	-59.9	-42.1	178.5	0	0	0	0	0	112.8	Y35 A36 C41 F42	Y35-G38 PolarHBondContact O-N 3.19Å; A36-G38 PolarHBondContact O-N 3.31Å; G38-C41 PolarHBondContact O-N 2.89Å; G38-F42 WeakPolarHBondContact O-CB 3.42Å; G38-F42 PolarHBondContact O-N 3.26Å
39	R	90.6	Very high	89.6	Confident	16 Å²	16	75.1 Å²	75.1	6%	0.06	40%	0.4	C	S	.	.	H	α-helix	trans	-55.7	-53.4	173.2	-78.1	-170.6	-61.5	106.4	-2.5	111.5	L32 Y35 A36 V37 F42 T43 E110 W114	L32-R39 HydrophobicContact CD2-CG 4.07Å; L32-R39 WeakPolarHBondContact O-CD 3.03Å; L32-R39 PolarHBondContact O-NE 2.82Å; Y35-R39 WeakPolarHBondContact O-CB 3.22Å; Y35-R39 VanDerWaalsContact O-CG 3.29Å; Y35-R39 WeakPolarHBondContact O-CG 3.23Å; Y35-R39 PolarHBondContact O-N 2.87Å; A36-R39 WeakPolarHBondContact O-CB 3.13Å; A36-R39 PolarHBondContact O-N 2.84Å; V37-R39 VanDerWaalsContact C-N 3.33Å; V37-R39 PolarHBondContact O-N 3.39Å; R39-F42 WeakPolarHBondContact O-CB 3.5Å; R39-F42 PolarHBondContact O-N 2.91Å; R39-T43 PolarHBondContact O-N 2.8Å; R39-T43 VanDerWaalsContact O-N 3.09Å; R39-T43 PolarHBondContact O-OG1 3.28Å; R39-E110 IonicContact CZ-OE1 3.91Å; R39-E110 IonicContact NH1-OE1 3.73Å; R39-E110 IonicContact NH2-OE1 3.49Å; R39-E110 PolarHBondContact NH2-OE1 3.34Å; R39-E110 VanDerWaalsContact NH2-OE1 3.14Å; R39-W114 HydrophobicContact CB-CD2 3.92Å; R39-W114 VanDerWaalsContact CB-CE2 3.42Å; R39-W114 HydrophobicContact CB-CG 4.35Å; R39-W114 HydrophobicContact CB-CH2 4.24Å; R39-W114 HydrophobicContact CB-CZ2 3.61Å; R39-W114 HydrophobicContact CG-CD2 4.16Å; R39-W114 HydrophobicContact CG-CE3 4.25Å; R39-W114 HydrophobicContact CG-CH2 3.8Å; R39-W114 HydrophobicContact CG-CZ2 3.69Å; R39-W114 HydrophobicContact CG-CZ3 4.08Å; R39-W114 PolarHBondContact O-NE1 3.43Å
40	W	93	Very high	90.3	Very high	90 Å²	90	72.6 Å²	72.6	34%	0.341	39%	0.39	S	S	.	.	H	α-helix	trans	-66.1	-40	-178.3	-74.1	110.5	0	0	0	112.6	A36 V37 F42 T43 V44 E110 F113 W114	A36-W40 PolarHBondContact O-N 3.47Å; A36-W40 VanDerWaalsContact O-N 3.09Å; V37-W40 PolarHBondContact O-N 3.41Å; W40-F42 VanDerWaalsContact C-N 3.31Å; W40-F42 PolarHBondContact O-N 3.45Å; W40-T43 VanDerWaalsContact CA-OG1 3.3Å; W40-T43 WeakPolarHBondContact CA-OG1 3.39Å; W40-T43 PolarHBondContact O-N 3.31Å; W40-T43 PolarHBondContact O-OG1 2.9Å; W40-V44 WeakPolarHBondContact O-CB 3.46Å; W40-V44 VanDerWaalsContact O-CG2 3.28Å; W40-V44 WeakPolarHBondContact O-CG2 3.19Å; W40-V44 PolarHBondContact O-N 3.2Å; W40-E110 HydrophobicContact CZ2-CG 4.01Å; W40-E110 PolarHBondContact NE1-OE1 3.27Å; W40-F113 AromaticContact CH2-CD1 3.67Å; W40-F113 HydrophobicContact CH2-CD1 3.67Å; W40-F113 AromaticContact CH2-CE1 3.53Å; W40-F113 HydrophobicContact CH2-CE1 3.53Å; W40-F113 HydrophobicContact CZ2-CD1 4.14Å; W40-F113 HydrophobicContact CZ2-CE1 4.33Å; W40-F113 HydrophobicContact CZ3-CE1 4.44Å; W40-W114 AromaticContact CD2-CD1 3.99Å; W40-W114 HydrophobicContact CH2-CB 4.36Å; W40-W114 HydrophobicContact CZ2-CB 4.2Å
41	C	94.8	Very high	91	Very high	77 Å²	77	71.8 Å²	71.8	52%	0.52	39%	0.385	S	S	.	.	H	α-helix	trans	-56.9	-44.3	172.1	-76.7	0	0	0	0	111.8	V37 G38 V44 L45	V37-C41 WeakPolarHBondContact O-CB 3.24Å; V37-C41 PolarHBondContact O-N 2.84Å; V37-C41 PolarHBondContact O-SG 3.37Å; V37-C41 VanDerWaalsContact O-SG 3.41Å; G38-C41 PolarHBondContact O-N 2.89Å; C41-V44 PolarHBondContact O-N 3.41Å; C41-L45 WeakPolarHBondContact O-CB 3.45Å; C41-L45 PolarHBondContact O-N 3.47Å
42	F	94.4	Very high	91.7	Very high	97 Å²	97	72.5 Å²	72.5	43%	0.425	39%	0.385	S	S	.	.	H	α-helix	trans	-61.6	-45.9	177	179.3	-107.2	0	0	0	112.3	G38 R39 W40 V44 L45 L46 W114 T118	G38-F42 WeakPolarHBondContact O-CB 3.42Å; G38-F42 PolarHBondContact O-N 3.26Å; R39-F42 WeakPolarHBondContact O-CB 3.5Å; R39-F42 PolarHBondContact O-N 2.91Å; W40-F42 VanDerWaalsContact C-N 3.31Å; W40-F42 PolarHBondContact O-N 3.45Å; F42-V44 PolarHBondContact O-N 3.5Å; F42-L45 WeakPolarHBondContact O-CB 3.5Å; F42-L45 PolarHBondContact O-N 3.26Å; F42-L46 HydrophobicContact CD1-CD1 4.05Å; F42-L46 HydrophobicContact CE1-CD1 3.49Å; F42-L46 VanDerWaalsContact CE1-CD1 3.49Å; F42-L46 HydrophobicContact CE1-CG 4.28Å; F42-L46 HydrophobicContact CZ-CD1 3.76Å; F42-L46 HydrophobicContact CZ-CD2 4.47Å; F42-L46 HydrophobicContact CZ-CG 4.2Å; F42-L46 PolarHBondContact O-N 3.21Å; F42-W114 HydrophobicContact CD1-CZ2 4.24Å; F42-T118 HydrophobicContact CD1-CG2 4.1Å; F42-T118 HydrophobicContact CE1-CG2 3.73Å
43	T	94.7	Very high	92.6	Very high	4 Å²	4	74.1 Å²	74.1	3%	0.025	39%	0.388	C	S	.	.	H	α-helix	trans	-63.1	-40.2	175.6	38.4	0	0	0	0	113.2	R39 W40 L45 L46 I47 W114 T118	R39-T43 PolarHBondContact O-N 2.8Å; R39-T43 VanDerWaalsContact O-N 3.09Å; R39-T43 PolarHBondContact O-OG1 3.28Å; W40-T43 VanDerWaalsContact CA-OG1 3.3Å; W40-T43 WeakPolarHBondContact CA-OG1 3.39Å; W40-T43 PolarHBondContact O-N 3.31Å; W40-T43 PolarHBondContact O-OG1 2.9Å; T43-L45 VanDerWaalsContact C-N 3.32Å; T43-L45 PolarHBondContact O-N 3.03Å; T43-L46 PolarHBondContact O-N 3.46Å; T43-I47 VanDerWaalsContact O-CG1 3.3Å; T43-I47 WeakPolarHBondContact O-CG1 3.45Å; T43-I47 PolarHBondContact O-N 2.8Å; T43-W114 HydrophobicContact CG2-CZ2 4.46Å; T43-W114 PolarHBondContact OG1-NE1 3.17Å; T43-T118 HydrophobicContact CG2-CG2 4.26Å; T43-T118 WeakPolarHBondContact CG2-OG1 3.26Å
44	V	96.1	Very high	93.4	Very high	67 Å²	67	71.8 Å²	71.8	41%	0.406	37%	0.373	S	S	.	.	H	α-helix	trans	-63.4	-42.2	177.8	167.3	0	0	0	0	110.2	W40 C41 F42 L46 I47 F48	W40-V44 WeakPolarHBondContact O-CB 3.46Å; W40-V44 VanDerWaalsContact O-CG2 3.28Å; W40-V44 WeakPolarHBondContact O-CG2 3.19Å; W40-V44 PolarHBondContact O-N 3.2Å; C41-V44 PolarHBondContact O-N 3.41Å; F42-V44 PolarHBondContact O-N 3.5Å; V44-L46 PolarHBondContact O-N 3.32Å; V44-I47 WeakPolarHBondContact O-CB 3.45Å; V44-I47 PolarHBondContact O-N 3.41Å; V44-F48 HydrophobicContact CG1-CD2 3.61Å; V44-F48 HydrophobicContact CG1-CE2 3.39Å; V44-F48 WeakPolarHBondContact O-CD2 3.5Å; V44-F48 PolarHBondContact O-N 2.91Å
45	L	96.7	Very high	93.8	Very high	109 Å²	109	72.3 Å²	72.3	57%	0.571	37%	0.37	S	S	*	.	H	α-helix	trans	-59.3	-45.3	174.3	-174.3	156.4	0	0	0	111.6	C41 F42 T43 I47 F48 F49	C41-L45 WeakPolarHBondContact O-CB 3.45Å; C41-L45 PolarHBondContact O-N 3.47Å; F42-L45 WeakPolarHBondContact O-CB 3.5Å; F42-L45 PolarHBondContact O-N 3.26Å; T43-L45 VanDerWaalsContact C-N 3.32Å; T43-L45 PolarHBondContact O-N 3.03Å; L45-I47 VanDerWaalsContact C-N 3.34Å; L45-I47 PolarHBondContact O-N 3.5Å; L45-F48 PolarHBondContact O-N 3.31Å; L45-F49 WeakPolarHBondContact O-CB 3.46Å; L45-F49 PolarHBondContact O-N 2.94Å
46	L	96.7	Very high	94.2	Very high	18 Å²	18	70.4 Å²	70.4	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-39	175.6	-72.5	176.8	0	0	0	112.7	F42 T43 V44 F49 Y50 T118 L122 I125	F42-L46 HydrophobicContact CD1-CD1 4.05Å; F42-L46 HydrophobicContact CE1-CD1 3.49Å; F42-L46 VanDerWaalsContact CE1-CD1 3.49Å; F42-L46 HydrophobicContact CE1-CG 4.28Å; F42-L46 HydrophobicContact CZ-CD1 3.76Å; F42-L46 HydrophobicContact CZ-CD2 4.47Å; F42-L46 HydrophobicContact CZ-CG 4.2Å; F42-L46 PolarHBondContact O-N 3.21Å; T43-L46 PolarHBondContact O-N 3.46Å; V44-L46 PolarHBondContact O-N 3.32Å; L46-F49 PolarHBondContact O-N 2.91Å; L46-Y50 WeakPolarHBondContact O-CB 3.3Å; L46-Y50 PolarHBondContact O-N 2.72Å; L46-T118 HydrophobicContact CD1-CG2 3.92Å; L46-L122 HydrophobicContact CD1-CD2 4.02Å; L46-L122 HydrophobicContact CD1-CG 4.22Å; L46-L122 HydrophobicContact CD2-CD2 4.09Å; L46-I125 HydrophobicContact CD2-CD1 4.09Å
47	I	96.2	Very high	94.3	Very high	68 Å²	68	70.7 Å²	70.7	35%	0.349	37%	0.368	S	S	.	.	H	α-helix	trans	-62.3	-46.9	174.8	-69.9	166.5	0	0	0	110.3	T43 V44 L45 F49 Y50 I51 L121	T43-I47 VanDerWaalsContact O-CG1 3.3Å; T43-I47 WeakPolarHBondContact O-CG1 3.45Å; T43-I47 PolarHBondContact O-N 2.8Å; V44-I47 WeakPolarHBondContact O-CB 3.45Å; V44-I47 PolarHBondContact O-N 3.41Å; L45-I47 VanDerWaalsContact C-N 3.34Å; L45-I47 PolarHBondContact O-N 3.5Å; I47-F49 PolarHBondContact O-N 3.48Å; I47-Y50 PolarHBondContact O-N 2.86Å; I47-I51 HydrophobicContact CG2-CD1 3.69Å; I47-I51 HydrophobicContact CG2-CG1 4.33Å; I47-I51 VanDerWaalsContact O-CG1 3.32Å; I47-I51 WeakPolarHBondContact O-CG1 3.39Å; I47-I51 PolarHBondContact O-N 2.88Å; I47-L121 HydrophobicContact CD1-CD1 4.16Å; I47-L121 HydrophobicContact CG1-CD1 3.54Å; I47-L121 HydrophobicContact CG1-CD2 3.87Å; I47-L121 HydrophobicContact CG1-CG 4.38Å
48	F	96.9	Very high	94.2	Very high	126 Å²	126	71.8 Å²	71.8	55%	0.553	37%	0.365	S	S	*	.	H	α-helix	trans	-59.6	-46.6	176.9	-83.6	-65.1	0	0	0	111.9	V44 L45 Y50 I51 I52	V44-F48 HydrophobicContact CG1-CD2 3.61Å; V44-F48 HydrophobicContact CG1-CE2 3.39Å; V44-F48 WeakPolarHBondContact O-CD2 3.5Å; V44-F48 PolarHBondContact O-N 2.91Å; L45-F48 PolarHBondContact O-N 3.31Å; F48-Y50 VanDerWaalsContact C-N 3.31Å; F48-Y50 PolarHBondContact O-N 3.24Å; F48-I51 PolarHBondContact O-N 3.34Å; F48-I52 VanDerWaalsContact O-CG1 3.3Å; F48-I52 WeakPolarHBondContact O-CG1 3.38Å; F48-I52 PolarHBondContact O-N 2.88Å
49	F	96.7	Very high	94.1	Very high	103 Å²	103	69.8 Å²	69.8	45%	0.452	34%	0.344	S	S	.	.	H	α-helix	trans	-57.7	-45	175.6	177.5	-98.9	0	0	0	111.8	L45 L46 I47 I52 R53 I125	L45-F49 WeakPolarHBondContact O-CB 3.46Å; L45-F49 PolarHBondContact O-N 2.94Å; L46-F49 PolarHBondContact O-N 2.91Å; I47-F49 PolarHBondContact O-N 3.48Å; F49-I52 PolarHBondContact O-N 2.8Å; F49-R53 WeakPolarHBondContact O-CB 3.45Å; F49-R53 PolarHBondContact O-N 3.18Å; F49-I125 HydrophobicContact CD1-CD1 3.93Å; F49-I125 HydrophobicContact CD1-CG1 4.29Å; F49-I125 HydrophobicContact CD1-CG2 4.44Å; F49-I125 HydrophobicContact CE1-CD1 4.42Å; F49-I125 HydrophobicContact CE1-CG1 4.5Å; F49-I125 HydrophobicContact CE1-CG2 3.86Å
50	Y	96.3	Very high	94.2	Very high	7 Å²	7	69.8 Å²	69.8	3%	0.027	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-45.2	176.8	-178.2	-98.3	0	0	0	112.5	L46 I47 F48 I52 R53 I54 T64 M67 I125 T128	L46-Y50 WeakPolarHBondContact O-CB 3.3Å; L46-Y50 PolarHBondContact O-N 2.72Å; I47-Y50 PolarHBondContact O-N 2.86Å; F48-Y50 VanDerWaalsContact C-N 3.31Å; F48-Y50 PolarHBondContact O-N 3.24Å; Y50-I52 PolarHBondContact O-N 3.25Å; Y50-R53 WeakPolarHBondContact O-CB 3.26Å; Y50-R53 PolarHBondContact O-N 3.4Å; Y50-I54 HydrophobicContact CD1-CG1 4.15Å; Y50-I54 HydrophobicContact CE1-CD1 4.38Å; Y50-I54 HydrophobicContact CE1-CG1 3.71Å; Y50-I54 HydrophobicContact CE2-CD1 4.28Å; Y50-I54 HydrophobicContact CE2-CG1 4.21Å; Y50-I54 WeakPolarHBondContact O-CG1 3.33Å; Y50-I54 PolarHBondContact O-N 2.88Å; Y50-T64 HydrophobicContact CE1-CG2 4.31Å; Y50-T64 VanDerWaalsContact OH-CA 3.25Å; Y50-T64 WeakPolarHBondContact OH-CA 3.23Å; Y50-T64 PolarHBondContact OH-N 2.78Å; Y50-T64 PolarHBondContact OH-OG1 3.41Å; Y50-T64 VanDerWaalsContact OH-OG1 3.05Å; Y50-M67 HydrophobicContact CD1-CE 3.83Å; Y50-M67 HydrophobicContact CD1-SD 4.09Å; Y50-M67 HydrophobicContact CE1-CE 3.34Å; Y50-M67 HydrophobicContact CE1-SD 3.71Å; Y50-M67 HydrophobicContact CE2-SD 4.29Å; Y50-I125 HydrophobicContact CD2-CG1 3.77Å; Y50-I125 HydrophobicContact CG-CG1 4.46Å; Y50-T128 HydrophobicContact CE2-CG2 3.85Å
51	I	95.3	Very high	94.2	Very high	79 Å²	79	67.9 Å²	67.9	41%	0.405	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-47.1	177.7	-69.9	168.2	0	0	0	110.7	I47 F48 R53 I54 I55	I47-I51 HydrophobicContact CG2-CD1 3.69Å; I47-I51 HydrophobicContact CG2-CG1 4.33Å; I47-I51 VanDerWaalsContact O-CG1 3.32Å; I47-I51 WeakPolarHBondContact O-CG1 3.39Å; I47-I51 PolarHBondContact O-N 2.88Å; F48-I51 PolarHBondContact O-N 3.34Å; I51-R53 VanDerWaalsContact C-N 3.28Å; I51-R53 PolarHBondContact O-N 3.46Å; I51-I54 PolarHBondContact O-N 3.48Å; I51-I55 HydrophobicContact CG2-CD1 3.67Å; I51-I55 HydrophobicContact CG2-CG1 4.35Å; I51-I55 VanDerWaalsContact O-CG1 3.31Å; I51-I55 WeakPolarHBondContact O-CG1 3.5Å; I51-I55 PolarHBondContact O-N 3.21Å
52	I	96.2	Very high	94.1	Very high	97 Å²	97	66.7 Å²	66.7	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-57.3	-44.8	176.3	-69.6	165.7	0	0	0	110.2	F48 F49 Y50 I54 I55 I56	F48-I52 VanDerWaalsContact O-CG1 3.3Å; F48-I52 WeakPolarHBondContact O-CG1 3.38Å; F48-I52 PolarHBondContact O-N 2.88Å; F49-I52 PolarHBondContact O-N 2.8Å; Y50-I52 PolarHBondContact O-N 3.25Å; I52-I54 PolarHBondContact O-N 2.93Å; I52-I55 PolarHBondContact O-N 3.33Å; I52-I56 HydrophobicContact CG2-CD1 3.76Å; I52-I56 WeakPolarHBondContact O-CG1 3.36Å; I52-I56 PolarHBondContact O-N 3.47Å
53	R	94.9	Very high	94.2	Very high	69 Å²	69	62.7 Å²	62.7	26%	0.26	31%	0.313	S	S	.	.	H	α-helix	trans	-60.6	-45.6	178.5	-179.4	63.2	179	145.5	5.6	112.3	F49 Y50 I51 I56 T57	F49-R53 WeakPolarHBondContact O-CB 3.45Å; F49-R53 PolarHBondContact O-N 3.18Å; Y50-R53 WeakPolarHBondContact O-CB 3.26Å; Y50-R53 PolarHBondContact O-N 3.4Å; I51-R53 VanDerWaalsContact C-N 3.28Å; I51-R53 PolarHBondContact O-N 3.46Å; R53-I56 PolarHBondContact O-N 2.87Å; R53-T57 PolarHBondContact NH1-OG1 3.49Å; R53-T57 WeakPolarHBondContact O-CB 3.42Å; R53-T57 PolarHBondContact O-N 2.82Å; R53-T57 PolarHBondContact O-OG1 2.86Å
54	I	93.9	Very high	94.2	Very high	28 Å²	28	64.7 Å²	64.7	14%	0.144	33%	0.325	C	S	.	.	H	α-helix	trans	-66.2	-40.3	177.9	-66.4	-62.4	0	0	0	111.6	Y50 I51 I52 I56 T57 Q58 T128	Y50-I54 HydrophobicContact CD1-CG1 4.15Å; Y50-I54 HydrophobicContact CE1-CD1 4.38Å; Y50-I54 HydrophobicContact CE1-CG1 3.71Å; Y50-I54 HydrophobicContact CE2-CD1 4.28Å; Y50-I54 HydrophobicContact CE2-CG1 4.21Å; Y50-I54 WeakPolarHBondContact O-CG1 3.33Å; Y50-I54 PolarHBondContact O-N 2.88Å; I51-I54 PolarHBondContact O-N 3.48Å; I52-I54 PolarHBondContact O-N 2.93Å; I54-I56 PolarHBondContact O-N 2.91Å; I54-T57 PolarHBondContact O-N 3.26Å; I54-Q58 PolarHBondContact O-N 3.37Å; I54-T128 HydrophobicContact CD1-CG2 4.01Å
55	I	93.3	Very high	94.1	Very high	103 Å²	103	64 Å²	64	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-64.2	-39.2	176.2	-68.6	169.7	0	0	0	111.4	I51 I52 Q58	I51-I55 HydrophobicContact CG2-CD1 3.67Å; I51-I55 HydrophobicContact CG2-CG1 4.35Å; I51-I55 VanDerWaalsContact O-CG1 3.31Å; I51-I55 WeakPolarHBondContact O-CG1 3.5Å; I51-I55 PolarHBondContact O-N 3.21Å; I52-I55 PolarHBondContact O-N 3.33Å; I55-Q58 WeakPolarHBondContact O-CG 3.5Å; I55-Q58 PolarHBondContact O-NE2 3.03Å
56	I	93.9	Very high	94.1	Very high	124 Å²	124	63 Å²	63	64%	0.636	31%	0.314	S	S	*	.	H	α-helix	trans	-70.4	-40.6	178	-69	167.9	0	0	0	111.1	I52 R53 I54	I52-I56 HydrophobicContact CG2-CD1 3.76Å; I52-I56 WeakPolarHBondContact O-CG1 3.36Å; I52-I56 PolarHBondContact O-N 3.47Å; R53-I56 PolarHBondContact O-N 2.87Å; I54-I56 PolarHBondContact O-N 2.91Å
57	T	89.5	Confident	94.1	Very high	42 Å²	42	63.1 Å²	63.1	26%	0.258	31%	0.314	S	S	.	.	H	α-helix	trans	-86.2	-20.3	-170.9	-40.6	0	0	0	0	112.6	R53 I54 G59 Y60	R53-T57 PolarHBondContact NH1-OG1 3.49Å; R53-T57 WeakPolarHBondContact O-CB 3.42Å; R53-T57 PolarHBondContact O-N 2.82Å; R53-T57 PolarHBondContact O-OG1 2.86Å; I54-T57 PolarHBondContact O-N 3.26Å; T57-G59 PolarHBondContact O-N 2.92Å; T57-G59 VanDerWaalsContact O-N 3.15Å; T57-Y60 HydrophobicContact CG2-CD2 3.93Å; T57-Y60 HydrophobicContact CG2-CE2 3.47Å; T57-Y60 VanDerWaalsContact CG2-CE2 3.47Å
58	Q	88.1	Confident	94	Very high	138 Å²	138	60.5 Å²	60.5	65%	0.645	30%	0.304	S	S	*	.			trans	50.1	38.3	178.2	-64.1	-69.7	-39.8	0	0	113.1	I54 I55	I54-Q58 PolarHBondContact O-N 3.37Å; I55-Q58 WeakPolarHBondContact O-CG 3.5Å; I55-Q58 PolarHBondContact O-NE2 3.03Å
59	G	89.1	Confident	94	Very high	3 Å²	3	56.6 Å²	56.6	3%	0.031	29%	0.289	C	S	.	.			trans	-152.2	-162.7	-175.4	0	0	0	0	0	111.7	T57 H61 D134	T57-G59 PolarHBondContact O-N 2.92Å; T57-G59 VanDerWaalsContact O-N 3.15Å; G59-H61 PolarHBondContact O-N 3.22Å; G59-D134 WeakPolarHBondContact CA-OD1 3.42Å
60	Y	92	Very high	94	Very high	16 Å²	16	55.3 Å²	55.3	6%	0.063	28%	0.283	C	S	.	.			trans	57.9	33.9	176.6	-55.4	-91.2	0	0	0	113.9	T57 V62 V63 T64 T128 L133 D134	T57-Y60 HydrophobicContact CG2-CD2 3.93Å; T57-Y60 HydrophobicContact CG2-CE2 3.47Å; T57-Y60 VanDerWaalsContact CG2-CE2 3.47Å; Y60-V62 PolarHBondContact O-N 3.45Å; Y60-V63 HydrophobicContact CD1-CG2 4.21Å; Y60-V63 PolarHBondContact O-N 2.97Å; Y60-T64 PolarHBondContact O-N 2.75Å; Y60-T64 PolarHBondContact O-OG1 3.24Å; Y60-T64 VanDerWaalsContact O-OG1 3.11Å; Y60-T128 HydrophobicContact CG-CG2 4.35Å; Y60-T128 PolarHBondContact OH-O 2.87Å; Y60-L133 HydrophobicContact CD1-CB 4.43Å; Y60-D134 HydrophobicContact CD1-CB 4.19Å; Y60-D134 HydrophobicContact CE1-CB 3.87Å; Y60-D134 HydrophobicContact CE2-CB 4.17Å; Y60-D134 PolarHBondContact N-OD1 3.03Å
61	H	92.6	Very high	94	Very high	50 Å²	50	57.1 Å²	57.1	23%	0.231	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-37.2	178.3	-58.9	-50.1	0	0	0	112.1	G59 T64 Y65 W139 L142	G59-H61 PolarHBondContact O-N 3.22Å; H61-T64 PolarHBondContact O-N 3.27Å; H61-Y65 WeakPolarHBondContact O-CB 3.33Å; H61-Y65 PolarHBondContact O-N 2.76Å; H61-W139 HydrophobicContact CB-CB 4.39Å; H61-L142 HydrophobicContact CB-CD1 4.37Å
62	V	93.6	Very high	94	Very high	52 Å²	52	53.6 Å²	53.6	32%	0.315	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-45.6	177.1	-179	0	0	0	0	111	Y60 T64 Y65 V66 V137	Y60-V62 PolarHBondContact O-N 3.45Å; V62-T64 PolarHBondContact O-N 3.27Å; V62-Y65 PolarHBondContact O-N 3.09Å; V62-V66 HydrophobicContact CG1-CG2 4.41Å; V62-V66 WeakPolarHBondContact O-CG2 3.5Å; V62-V66 PolarHBondContact O-N 3.5Å; V62-V137 HydrophobicContact CG2-CB 4.34Å; V62-V137 HydrophobicContact CG2-CG2 3.57Å
63	V	95.4	Very high	93.9	Very high	13 Å²	13	52.4 Å²	52.4	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-46.9	177.9	-178.6	0	0	0	0	110.3	Y60 Y65 V66 M67 C127 L133	Y60-V63 HydrophobicContact CD1-CG2 4.21Å; Y60-V63 PolarHBondContact O-N 2.97Å; V63-Y65 VanDerWaalsContact C-N 3.29Å; V63-Y65 PolarHBondContact O-N 3.44Å; V63-V66 PolarHBondContact O-N 3.4Å; V63-M67 VanDerWaalsContact O-CB 3.3Å; V63-M67 WeakPolarHBondContact O-CB 3.23Å; V63-M67 PolarHBondContact O-N 3.44Å; V63-C127 HydrophobicContact CG1-CB 3.92Å; V63-C127 HydrophobicContact CG2-CB 4.38Å; V63-L133 HydrophobicContact CG2-CB 3.87Å; V63-L133 HydrophobicContact CG2-CD1 4.19Å
64	T	94.8	Very high	93.8	Very high	46 Å²	46	51.9 Å²	51.9	28%	0.282	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-41	177.5	-53.9	0	0	0	0	111.5	Y50 Y60 H61 V62 G68	Y50-T64 HydrophobicContact CE1-CG2 4.31Å; Y50-T64 VanDerWaalsContact OH-CA 3.25Å; Y50-T64 WeakPolarHBondContact OH-CA 3.23Å; Y50-T64 PolarHBondContact OH-N 2.78Å; Y50-T64 PolarHBondContact OH-OG1 3.41Å; Y50-T64 VanDerWaalsContact OH-OG1 3.05Å; Y60-T64 PolarHBondContact O-N 2.75Å; Y60-T64 PolarHBondContact O-OG1 3.24Å; Y60-T64 VanDerWaalsContact O-OG1 3.11Å; H61-T64 PolarHBondContact O-N 3.27Å; V62-T64 PolarHBondContact O-N 3.27Å; T64-G68 PolarHBondContact O-N 3.09Å
65	Y	94.9	Very high	93.8	Very high	52 Å²	52	53.4 Å²	53.4	20%	0.204	28%	0.276	C	S	.	.	H	α-helix	trans	-66.9	-46.6	178.5	175.1	-105.2	0	0	0	112.5	H61 V62 V63 G68 I69 L142 Y145 F146	H61-Y65 WeakPolarHBondContact O-CB 3.33Å; H61-Y65 PolarHBondContact O-N 2.76Å; V62-Y65 PolarHBondContact O-N 3.09Å; V63-Y65 VanDerWaalsContact C-N 3.29Å; V63-Y65 PolarHBondContact O-N 3.44Å; Y65-G68 PolarHBondContact O-N 2.95Å; Y65-I69 HydrophobicContact CD1-CD1 4.01Å; Y65-I69 HydrophobicContact CD2-CD1 4.38Å; Y65-I69 HydrophobicContact CE1-CD1 3.37Å; Y65-I69 HydrophobicContact CE1-CG1 4.47Å; Y65-I69 HydrophobicContact CE2-CD1 3.8Å; Y65-I69 HydrophobicContact CE2-CG1 4.3Å; Y65-I69 HydrophobicContact CG-CD1 4.48Å; Y65-I69 WeakPolarHBondContact O-CG1 3.43Å; Y65-I69 PolarHBondContact O-N 3.37Å; Y65-I69 WeakPolarHBondContact OH-CD1 3.14Å; Y65-L142 HydrophobicContact CD1-CD2 4.01Å; Y65-L142 HydrophobicContact CD2-CB 4.2Å; Y65-L142 HydrophobicContact CD2-CD2 4.01Å; Y65-L142 HydrophobicContact CE1-CD2 4.01Å; Y65-L142 HydrophobicContact CE2-CD2 4.01Å; Y65-L142 HydrophobicContact CG-CD2 3.99Å; Y65-Y145 HydrophobicContact CE2-CD1 4.18Å; Y65-Y145 WeakPolarHBondContact OH-CD1 3.33Å; Y65-Y145 WeakPolarHBondContact OH-CE1 3.49Å; Y65-F146 HydrophobicContact CD2-CB 4.38Å; Y65-F146 HydrophobicContact CE2-CB 4.18Å
66	V	96	Very high	93.7	Very high	90 Å²	90	49.3 Å²	49.3	55%	0.545	26%	0.255	S	S	.	.	H	α-helix	trans	-62.3	-44.3	176.2	172.7	0	0	0	0	110.7	V62 V63 G68 I69 F70	V62-V66 HydrophobicContact CG1-CG2 4.41Å; V62-V66 WeakPolarHBondContact O-CG2 3.5Å; V62-V66 PolarHBondContact O-N 3.5Å; V63-V66 PolarHBondContact O-N 3.4Å; V66-G68 VanDerWaalsContact C-N 3.34Å; V66-G68 PolarHBondContact O-N 3.42Å; V66-I69 PolarHBondContact O-N 3.01Å; V66-F70 WeakPolarHBondContact O-CB 3.46Å; V66-F70 PolarHBondContact O-N 2.89Å
67	M	95.6	Very high	93.4	Very high	19 Å²	19	44.8 Å²	44.8	9%	0.094	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-46.6	173.4	-174.3	-166.4	71.6	0	0	111	Y50 V63 F70 L71 L121 S124	Y50-M67 HydrophobicContact CD1-CE 3.83Å; Y50-M67 HydrophobicContact CD1-SD 4.09Å; Y50-M67 HydrophobicContact CE1-CE 3.34Å; Y50-M67 HydrophobicContact CE1-SD 3.71Å; Y50-M67 HydrophobicContact CE2-SD 4.29Å; V63-M67 VanDerWaalsContact O-CB 3.3Å; V63-M67 WeakPolarHBondContact O-CB 3.23Å; V63-M67 PolarHBondContact O-N 3.44Å; M67-F70 PolarHBondContact O-N 3.24Å; M67-L71 HydrophobicContact CE-CD1 4.32Å; M67-L71 HydrophobicContact CG-CD1 4.18Å; M67-L71 WeakPolarHBondContact O-CB 2.95Å; M67-L71 WeakPolarHBondContact O-CG 3.48Å; M67-L71 PolarHBondContact O-N 3.25Å; M67-L121 HydrophobicContact CE-CD2 4.49Å; M67-L121 HydrophobicContact SD-CD2 3.64Å; M67-S124 WeakPolarHBondContact CB-OG 3.49Å; M67-S124 WeakPolarHBondContact CG-OG 3.32Å
68	G	96	Very high	93.4	Very high	14 Å²	14	45.1 Å²	45.1	14%	0.144	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-46.9	178.1	0	0	0	0	0	112.7	T64 Y65 V66 F70 L71 L72 F146	T64-G68 PolarHBondContact O-N 3.09Å; Y65-G68 PolarHBondContact O-N 2.95Å; V66-G68 VanDerWaalsContact C-N 3.34Å; V66-G68 PolarHBondContact O-N 3.42Å; G68-F70 VanDerWaalsContact C-N 3.32Å; G68-F70 PolarHBondContact O-N 3.3Å; G68-L71 PolarHBondContact O-N 2.95Å; G68-L72 WeakPolarHBondContact O-CB 3.39Å; G68-L72 PolarHBondContact O-N 3.5Å; G68-F146 VanDerWaalsContact C-CE2 3.46Å
69	I	96.1	Very high	93.2	Very high	43 Å²	43	41.1 Å²	41.1	22%	0.221	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-43.1	175.6	-74.1	178.4	0	0	0	110.9	Y65 V66 L72 N73 F146	Y65-I69 HydrophobicContact CD1-CD1 4.01Å; Y65-I69 HydrophobicContact CD2-CD1 4.38Å; Y65-I69 HydrophobicContact CE1-CD1 3.37Å; Y65-I69 HydrophobicContact CE1-CG1 4.47Å; Y65-I69 HydrophobicContact CE2-CD1 3.8Å; Y65-I69 HydrophobicContact CE2-CG1 4.3Å; Y65-I69 HydrophobicContact CG-CD1 4.48Å; Y65-I69 WeakPolarHBondContact O-CG1 3.43Å; Y65-I69 PolarHBondContact O-N 3.37Å; Y65-I69 WeakPolarHBondContact OH-CD1 3.14Å; V66-I69 PolarHBondContact O-N 3.01Å; I69-L72 PolarHBondContact O-N 3.18Å; I69-N73 WeakPolarHBondContact O-CB 3.44Å; I69-N73 PolarHBondContact O-N 2.9Å; I69-N73 PolarHBondContact O-ND2 2.9Å; I69-F146 HydrophobicContact CG1-CD2 4.22Å; I69-F146 HydrophobicContact CG1-CE2 4.38Å
70	F	96.6	Very high	93	Very high	76 Å²	76	42.1 Å²	42.1	33%	0.333	22%	0.219	S	C	.	.	H	α-helix	trans	-61.4	-48	177.7	-179.1	-90.5	0	0	0	111.4	V66 M67 G68 L72 N73 R74 C120	V66-F70 WeakPolarHBondContact O-CB 3.46Å; V66-F70 PolarHBondContact O-N 2.89Å; M67-F70 PolarHBondContact O-N 3.24Å; G68-F70 VanDerWaalsContact C-N 3.32Å; G68-F70 PolarHBondContact O-N 3.3Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 2.85Å; F70-N73 PolarHBondContact O-N 3.27Å; F70-R74 HydrophobicContact CD1-CG 3.98Å; F70-R74 HydrophobicContact CE1-CG 3.52Å; F70-R74 HydrophobicContact CE2-CG 4.49Å; F70-R74 HydrophobicContact CZ-CG 3.82Å; F70-R74 WeakPolarHBondContact O-CG 3.3Å; F70-R74 PolarHBondContact O-N 3.33Å; F70-C120 HydrophobicContact CD1-CB 3.54Å; F70-C120 WeakPolarHBondContact CD1-SG 3.28Å; F70-C120 HydrophobicContact CE1-CB 3.48Å; F70-C120 VanDerWaalsContact CE1-CB 3.48Å; F70-C120 HydrophobicContact CZ-CB 4.41Å
71	L	95.7	Very high	92.2	Very high	45 Å²	45	42.2 Å²	42.2	24%	0.236	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-41	177.1	-71.3	175.4	0	0	0	111.7	M67 G68 R74 L75 C117	M67-L71 HydrophobicContact CE-CD1 4.32Å; M67-L71 HydrophobicContact CG-CD1 4.18Å; M67-L71 WeakPolarHBondContact O-CB 2.95Å; M67-L71 WeakPolarHBondContact O-CG 3.48Å; M67-L71 PolarHBondContact O-N 3.25Å; G68-L71 PolarHBondContact O-N 2.95Å; L71-R74 PolarHBondContact O-N 2.93Å; L71-L75 VanDerWaalsContact O-CB 3.31Å; L71-L75 WeakPolarHBondContact O-CB 3.28Å; L71-L75 PolarHBondContact O-N 2.9Å; L71-C117 HydrophobicContact CD2-CB 3.9Å; L71-C117 VanDerWaalsContact CD2-SG 3.54Å
72	L	95.2	Very high	91	Very high	6 Å²	6	45 Å²	45	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-46.4	174.9	178.8	55.2	0	0	0	111.7	G68 I69 F70 R74 L75 I76 F146 L149 F150	G68-L72 WeakPolarHBondContact O-CB 3.39Å; G68-L72 PolarHBondContact O-N 3.5Å; I69-L72 PolarHBondContact O-N 3.18Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 2.85Å; L72-R74 VanDerWaalsContact C-N 3.33Å; L72-R74 PolarHBondContact O-N 3.42Å; L72-L75 HydrophobicContact CD1-CD2 4.47Å; L72-L75 PolarHBondContact O-N 3.45Å; L72-I76 HydrophobicContact CD1-CD1 4.11Å; L72-I76 HydrophobicContact CD1-CG1 4.3Å; L72-I76 HydrophobicContact CG-CD1 4.03Å; L72-I76 VanDerWaalsContact O-CG1 3.31Å; L72-I76 WeakPolarHBondContact O-CG1 3.3Å; L72-I76 PolarHBondContact O-N 2.87Å; L72-F146 HydrophobicContact CB-CE2 4.46Å; L72-F146 HydrophobicContact CD2-CE2 4.25Å; L72-L149 HydrophobicContact CD2-CD2 3.34Å; L72-F150 HydrophobicContact CD1-CD2 3.36Å; L72-F150 HydrophobicContact CD1-CE2 3.72Å; L72-F150 HydrophobicContact CD1-CG 4.37Å; L72-F150 HydrophobicContact CD2-CB 4.16Å; L72-F150 HydrophobicContact CD2-CD2 4.11Å; L72-F150 HydrophobicContact CG-CD2 4.31Å
73	N	94.3	Very high	89.5	Confident	71 Å²	71	45.7 Å²	45.7	38%	0.38	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-40.5	176.7	-75.7	-29.7	0	0	0	112	I69 F70 I76 D77	I69-N73 WeakPolarHBondContact O-CB 3.44Å; I69-N73 PolarHBondContact O-N 2.9Å; I69-N73 PolarHBondContact O-ND2 2.9Å; F70-N73 PolarHBondContact O-N 3.27Å; N73-I76 PolarHBondContact O-N 3.47Å; N73-D77 PolarHBondContact O-N 3.47Å
74	R	93.8	Very high	87.7	Confident	58 Å²	58	49.3 Å²	49.3	22%	0.219	26%	0.257	C	S	.	.	H	α-helix	trans	-66.6	-37.9	174.9	-67.2	-55.8	97.2	-144.4	-13.4	111.8	F70 L71 L72 D77 F78 F113	F70-R74 HydrophobicContact CD1-CG 3.98Å; F70-R74 HydrophobicContact CE1-CG 3.52Å; F70-R74 HydrophobicContact CE2-CG 4.49Å; F70-R74 HydrophobicContact CZ-CG 3.82Å; F70-R74 WeakPolarHBondContact O-CG 3.3Å; F70-R74 PolarHBondContact O-N 3.33Å; L71-R74 PolarHBondContact O-N 2.93Å; L72-R74 VanDerWaalsContact C-N 3.33Å; L72-R74 PolarHBondContact O-N 3.42Å; R74-D77 IonicContact CZ-OD2 3.14Å; R74-D77 IonicContact NH1-OD2 2.71Å; R74-D77 PolarHBondContact NH1-OD2 3.23Å; R74-D77 IonicContact NH2-OD2 3.07Å; R74-D77 PolarHBondContact NH2-OD2 3.34Å; R74-D77 PolarHBondContact O-N 3.43Å; R74-F78 WeakPolarHBondContact O-CB 3.29Å; R74-F78 PolarHBondContact O-N 3.35Å; R74-F113 HydrophobicContact CB-CD2 3.97Å; R74-F113 HydrophobicContact CB-CE2 3.86Å
75	L	92.4	Very high	85.7	Confident	60 Å²	60	49.2 Å²	49.2	31%	0.314	26%	0.256	S	S	.	.	H	α-helix	trans	-66.1	-39.6	176.4	-177.2	131.1	0	0	0	111.5	L71 L72 F78 L79 M154	L71-L75 VanDerWaalsContact O-CB 3.31Å; L71-L75 WeakPolarHBondContact O-CB 3.28Å; L71-L75 PolarHBondContact O-N 2.9Å; L72-L75 HydrophobicContact CD1-CD2 4.47Å; L72-L75 PolarHBondContact O-N 3.45Å; L75-F78 WeakPolarHBondContact O-CB 3.31Å; L75-F78 PolarHBondContact O-N 3.47Å; L75-L79 HydrophobicContact CD2-CD1 3.9Å; L75-L79 HydrophobicContact CG-CD1 4.45Å; L75-L79 WeakPolarHBondContact O-CG 3.42Å; L75-L79 PolarHBondContact O-N 3.24Å; L75-M154 HydrophobicContact CD2-CE 4.19Å; L75-M154 HydrophobicContact CD2-SD 3.59Å; L75-M154 VanDerWaalsContact CD2-SD 3.59Å
76	I	91.4	Very high	83.8	Confident	18 Å²	18	54.1 Å²	54.1	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-47.5	172.8	-69.8	163	0	0	0	110.8	L72 N73 F78 L79 S80 T153 Q157	L72-I76 HydrophobicContact CD1-CD1 4.11Å; L72-I76 HydrophobicContact CD1-CG1 4.3Å; L72-I76 HydrophobicContact CG-CD1 4.03Å; L72-I76 VanDerWaalsContact O-CG1 3.31Å; L72-I76 WeakPolarHBondContact O-CG1 3.3Å; L72-I76 PolarHBondContact O-N 2.87Å; N73-I76 PolarHBondContact O-N 3.47Å; I76-F78 PolarHBondContact O-N 2.86Å; I76-L79 PolarHBondContact O-N 2.97Å; I76-S80 VanDerWaalsContact O-CB 3.28Å; I76-S80 WeakPolarHBondContact O-CB 3.24Å; I76-S80 PolarHBondContact O-N 2.93Å; I76-T153 HydrophobicContact CD1-CG2 4.14Å; I76-Q157 HydrophobicContact CG1-CG 4.32Å; I76-Q157 HydrophobicContact CG2-CG 3.8Å
77	D	88.6	Confident	81.6	Confident	28 Å²	28	55.2 Å²	55.2	15%	0.15	29%	0.288	C	S	.	.	H	α-helix	trans	-64	-29.2	176.1	-86.3	-29.8	0	0	0	112.5	N73 R74 K107 L108	N73-D77 PolarHBondContact O-N 3.47Å; R74-D77 IonicContact CZ-OD2 3.14Å; R74-D77 IonicContact NH1-OD2 2.71Å; R74-D77 PolarHBondContact NH1-OD2 3.23Å; R74-D77 IonicContact NH2-OD2 3.07Å; R74-D77 PolarHBondContact NH2-OD2 3.34Å; R74-D77 PolarHBondContact O-N 3.43Å; D77-K107 WeakPolarHBondContact O-CB 3.43Å; D77-K107 IonicContact OD1-NZ 2.81Å; D77-K107 PolarHBondContact OD1-NZ 2.88Å; D77-L108 HydrophobicContact CB-CB 4.4Å; D77-L108 HydrophobicContact CB-CD2 4.4Å; D77-L108 PolarHBondContact O-N 3.38Å
78	F	88.5	Confident	79.4	Confident	49 Å²	49	58.6 Å²	58.6	22%	0.215	31%	0.314	C	S	.	.	H	α-helix	trans	-70.3	-38.8	173.9	179.1	-103.3	0	0	0	112.3	R74 L75 I76 R106 E110 F113	R74-F78 WeakPolarHBondContact O-CB 3.29Å; R74-F78 PolarHBondContact O-N 3.35Å; L75-F78 WeakPolarHBondContact O-CB 3.31Å; L75-F78 PolarHBondContact O-N 3.47Å; I76-F78 PolarHBondContact O-N 2.86Å; F78-R106 VanDerWaalsContact CE2-NH1 3.28Å; F78-R106 VanDerWaalsContact CZ-NH1 3.25Å; F78-E110 HydrophobicContact CE2-CB 4.25Å; F78-F113 HydrophobicContact CB-CD2 3.97Å; F78-F113 HydrophobicContact CB-CE2 4.2Å; F78-F113 HydrophobicContact CB-CG 4.15Å; F78-F113 HydrophobicContact CD2-CB 3.92Å; F78-F113 AromaticContact CD2-CD1 3.85Å; F78-F113 HydrophobicContact CD2-CD1 3.85Å; F78-F113 AromaticContact CD2-CG 3.84Å; F78-F113 HydrophobicContact CD2-CG 3.84Å; F78-F113 HydrophobicContact CE2-CD1 4.15Å; F78-F113 HydrophobicContact CG-CD1 4.08Å; F78-F113 HydrophobicContact CG-CD2 4.4Å; F78-F113 HydrophobicContact CG-CE1 4.34Å; F78-F113 HydrophobicContact CG-CG 4.11Å
79	L	85.2	Confident	77.2	Confident	54 Å²	54	63.4 Å²	63.4	28%	0.283	34%	0.34	S	S	.	.	H	α-helix	trans	-77.4	-28.8	175.7	-67.6	171.5	0	0	0	112.5	L75 I76 M154 M161	L75-L79 HydrophobicContact CD2-CD1 3.9Å; L75-L79 HydrophobicContact CG-CD1 4.45Å; L75-L79 WeakPolarHBondContact O-CG 3.42Å; L75-L79 PolarHBondContact O-N 3.24Å; I76-L79 PolarHBondContact O-N 2.97Å; L79-M154 HydrophobicContact CD1-CE 3.58Å; L79-M154 HydrophobicContact CD1-SD 4.07Å; L79-M161 HydrophobicContact CB-SD 4.38Å; L79-M161 WeakPolarHBondContact O-CE 3.47Å
80	S	83.4	Confident	74.8	Confident	25 Å²	25	67.3 Å²	67.3	18%	0.175	36%	0.362	C	S	.	.	S	Bend	trans	-66.7	131.6	-176.2	-168.6	0	0	0	0	111.7	I76 K107	I76-S80 VanDerWaalsContact O-CB 3.28Å; I76-S80 WeakPolarHBondContact O-CB 3.24Å; I76-S80 PolarHBondContact O-N 2.93Å; S80-K107 WeakPolarHBondContact O-CB 3.29Å; S80-K107 PolarHBondContact O-N 3.14Å
81	P	75.2	Confident	72.4	Confident	18 Å²	18	72.4 Å²	72.4	12%	0.117	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-72.8	152.3	175.7	29.6	-33.4	0	0	0	111.7	Y166	P81-Y166 HydrophobicContact CB-CD1 3.76Å; P81-Y166 HydrophobicContact CB-CE1 3.68Å; P81-Y166 HydrophobicContact CB-CG 4.38Å; P81-Y166 HydrophobicContact CG-CD1 3.99Å; P81-Y166 HydrophobicContact CG-CD2 4.15Å; P81-Y166 HydrophobicContact CG-CE1 3.78Å; P81-Y166 HydrophobicContact CG-CE2 3.81Å; P81-Y166 HydrophobicContact CG-CG 4.23Å
82	K	67.6	Low	70.1	Confident	108 Å²	108	76.6 Å²	76.6	47%	0.47	41%	0.414	S	S	.	.	S	Bend	trans	-73.7	-32.8	173.2	-77.5	-172.5	177.3	166.7	0	114	V84 L105 R106 K107	K82-V84 PolarHBondContact O-N 3.4Å; K82-V84 VanDerWaalsContact O-N 3.15Å; K82-L105 WeakPolarHBondContact CB-O 3.26Å; K82-L105 HydrophobicContact CD-CB 4.17Å; K82-L105 WeakPolarHBondContact CG-O 3.4Å; K82-L105 PolarHBondContact N-O 2.96Å; K82-R106 WeakPolarHBondContact CE-O 3.38Å; K82-K107 WeakPolarHBondContact CE-O 3.46Å; K82-K107 HydrophobicContact CG-CB 4.1Å
83	I	61.8	Low	67.6	Low	66 Å²	66	82.9 Å²	82.9	34%	0.338	45%	0.447	S	S	.	.			trans	-82.7	102.9	-167.9	-55.3	164.6	0	0	0	107	R102 Y166	I83-R102 HydrophobicContact CD1-CB 4.47Å; I83-Y166 PolarHBondContact O-OH 3.24Å
84	V	58	Low	65.2	Low	90 Å²	90	85.6 Å²	85.6	55%	0.545	47%	0.468	S	S	.	.			trans	-79.5	123.6	168.8	-173.6	0	0	0	0	106.3	K82 E86	K82-V84 PolarHBondContact O-N 3.4Å; K82-V84 VanDerWaalsContact O-N 3.15Å; V84-E86 HydrophobicContact CG1-CB 4.23Å; V84-E86 HydrophobicContact CG1-CG 4.08Å; V84-E86 PolarHBondContact O-N 3.36Å
85	P	53.5	Low	62.9	Low	43 Å²	43	88.4 Å²	88.4	28%	0.279	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-65.8	-6.3	-174.2	24.2	-32.7	0	0	0	114.1	T87 S88 Y164	P85-T87 VanDerWaalsContact C-N 3.3Å; P85-T87 PolarHBondContact O-N 3.36Å; P85-S88 PolarHBondContact O-N 3.45Å; P85-S88 PolarHBondContact O-OG 3.09Å; P85-Y164 HydrophobicContact CB-CE1 4.27Å; P85-Y164 HydrophobicContact CG-CD1 4.16Å; P85-Y164 HydrophobicContact CG-CE1 3.68Å
86	E	55.2	Low	60.6	Low	156 Å²	156	94.5 Å²	94.5	73%	0.729	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-78.1	-7.9	-172.1	-60.3	-177.7	-159.8	0	0	114.4	V84 T89	V84-E86 HydrophobicContact CG1-CB 4.23Å; V84-E86 HydrophobicContact CG1-CG 4.08Å; V84-E86 PolarHBondContact O-N 3.36Å; E86-T89 PolarHBondContact O-OG1 3.02Å
87	T	49.6	Very low	58.3	Low	112 Å²	112	99.4 Å²	99.4	69%	0.687	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-95.3	2.8	175.3	-42.4	0	0	0	0	113	P85 T89	P85-T87 VanDerWaalsContact C-N 3.3Å; P85-T87 PolarHBondContact O-N 3.36Å; T87-T89 PolarHBondContact O-N 3.05Å
88	S	49.7	Very low	56.2	Low	90 Å²	90	102.7 Å²	102.7	63%	0.629	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	21.8	170.1	68.9	0	0	0	0	113.3	P85 D90	P85-S88 PolarHBondContact O-N 3.45Å; P85-S88 PolarHBondContact O-OG 3.09Å; S88-D90 PolarHBondContact O-N 3.42Å
89	T	50.5	Low	54.4	Low	115 Å²	115	109.5 Å²	109.5	71%	0.706	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-7.4	169.9	-16.4	0	0	0	0	112.5	E86 T87 E91	E86-T89 PolarHBondContact O-OG1 3.02Å; T87-T89 PolarHBondContact O-N 3.05Å; T89-E91 PolarHBondContact O-N 3.22Å
90	D	45.5	Very low	52.6	Low	126 Å²	126	113.1 Å²	113.1	67%	0.674	63%	0.625	S	S	*	*	S	Bend	trans	-74.6	84.5	167.1	-62.4	-22.5	0	0	0	108.4	S88 V92	S88-D90 PolarHBondContact O-N 3.42Å; D90-V92 WeakPolarHBondContact O-CG2 3.48Å; D90-V92 PolarHBondContact O-N 3.04Å
91	E	45.5	Very low	50.8	Low	182 Å²	182	116.8 Å²	116.8	85%	0.85	64%	0.638	S	S	*	*			trans	22.4	36.1	140.7	-61.3	-176.5	153.4	0	0	120.2	T89 L93	T89-E91 PolarHBondContact O-N 3.22Å; E91-L93 PolarHBondContact O-N 3.14Å
92	V	47.7	Very low	49.9	Very low	134 Å²	134	122.6 Å²	122.6	81%	0.812	66%	0.658	S	S	*	*			trans	-83	104.7	170.7	-172.5	0	0	0	0	108.3	D90	D90-V92 WeakPolarHBondContact O-CG2 3.48Å; D90-V92 PolarHBondContact O-N 3.04Å
93	L	43.1	Very low	49.2	Very low	138 Å²	138	120.7 Å²	120.7	72%	0.723	66%	0.656	S	S	*	*			trans	-42.9	139.5	176	-82.7	79.5	0	0	0	111.6	E91 T95	E91-L93 PolarHBondContact O-N 3.14Å; L93-T95 PolarHBondContact O-N 3.45Å
94	P	43.1	Very low	48.8	Very low	127 Å²	127	121.6 Å²	121.6	83%	0.825	66%	0.658	S	S	*	*			trans	-72.5	76.1	-177.4	31.8	-35.3	0	0	0	110.5	K96	P94-K96 PolarHBondContact O-N 2.84Å; P94-K96 VanDerWaalsContact O-N 3.08Å
95	T	46.3	Very low	48.9	Very low	117 Å²	117	122 Å²	122	72%	0.718	66%	0.657	S	S	*	*			trans	-77.8	97	167.9	-42.1	0	0	0	0	106.4	L93 S97	L93-T95 PolarHBondContact O-N 3.45Å; T95-S97 PolarHBondContact O-N 3.28Å
96	K	43.5	Very low	49.8	Very low	189 Å²	189	125.5 Å²	125.5	82%	0.822	66%	0.664	S	S	*	*	S	Bend	trans	-44.7	133.7	165.6	-72.8	-178.9	175	179.6	0	108.1	P94	P94-K96 PolarHBondContact O-N 2.84Å; P94-K96 VanDerWaalsContact O-N 3.08Å
97	S	42.3	Very low	50.7	Low	120 Å²	120	123 Å²	123	84%	0.839	65%	0.651	S	S	*	*			trans	82.5	59.1	176.5	77.1	0	0	0	0	117.9	T95	T95-S97 PolarHBondContact O-N 3.28Å
98	S	45	Very low	52.1	Low	98 Å²	98	118.8 Å²	118.8	69%	0.685	62%	0.624	S	S	*	*				-147.7	111.1	124.6	55.6	0	0	0	0	107.1	E100	S98-E100 PolarHBondContact O-N 3.29Å
99	E	50.8	Low	53.7	Low	192 Å²	192	117 Å²	117	90%	0.897	61%	0.61	S	S	*	*			trans	-62.8	83.4	160.4	-66.3	-162.4	170.2	0	0	105.9	F101	E99-F101 VanDerWaalsContact C-N 3.32Å; E99-F101 PolarHBondContact O-N 3.49Å
100	E	47.7	Very low	55.5	Low	129 Å²	129	114.1 Å²	114.1	60%	0.603	59%	0.589	S	S	*	*			trans	-58	104.7	176.1	-173.4	-176	-158.1	0	0	105.6	S98 R102	S98-E100 PolarHBondContact O-N 3.29Å; E100-R102 PolarHBondContact O-N 3.38Å; E100-R102 IonicContact OE2-CZ 2.88Å; E100-R102 IonicContact OE2-NE 2.72Å; E100-R102 PolarHBondContact OE2-NE 2.96Å; E100-R102 IonicContact OE2-NH2 2.83Å; E100-R102 PolarHBondContact OE2-NH2 3Å
101	F	45.6	Very low	57.5	Low	103 Å²	103	109.6 Å²	109.6	45%	0.452	56%	0.564	S	S	.	*			trans	-67.9	98.2	-173.9	-177.6	-93.4	0	0	0	107.6	E99 P103 T170 K173	E99-F101 VanDerWaalsContact C-N 3.32Å; E99-F101 PolarHBondContact O-N 3.49Å; F101-P103 HydrophobicContact CE1-CB 4.07Å; F101-P103 WeakPolarHBondContact O-CD 3.31Å; F101-T170 HydrophobicContact CZ-CG2 4.06Å; F101-K173 HydrophobicContact CE1-CG 4.24Å; F101-K173 HydrophobicContact CE2-CG 3.66Å; F101-K173 HydrophobicContact CZ-CD 4.11Å; F101-K173 HydrophobicContact CZ-CG 3.41Å; F101-K173 VanDerWaalsContact CZ-CG 3.41Å
102	R	55	Low	59.5	Low	140 Å²	140	106.4 Å²	106.4	53%	0.528	55%	0.548	S	S	.	.			trans	-91.6	97.2	174.2	-64.9	-177.4	-173.9	-166.4	0.3	107.5	I83 E100 F104	I83-R102 HydrophobicContact CD1-CB 4.47Å; E100-R102 PolarHBondContact O-N 3.38Å; E100-R102 IonicContact OE2-CZ 2.88Å; E100-R102 IonicContact OE2-NE 2.72Å; E100-R102 PolarHBondContact OE2-NE 2.96Å; E100-R102 IonicContact OE2-NH2 2.83Å; E100-R102 PolarHBondContact OE2-NH2 3Å; R102-F104 PolarHBondContact O-N 3.46Å
103	P	53.1	Low	61.6	Low	68 Å²	68	101 Å²	101	44%	0.442	51%	0.514	S	S	.	.			trans	-54.5	136.8	174.4	22	-31.6	0	0	0	109.1	F101 L105	F101-P103 HydrophobicContact CE1-CB 4.07Å; F101-P103 WeakPolarHBondContact O-CD 3.31Å; P103-L105 HydrophobicContact CG-CD1 4.32Å; P103-L105 VanDerWaalsContact O-CD1 3.3Å; P103-L105 WeakPolarHBondContact O-CD1 3.2Å; P103-L105 PolarHBondContact O-N 2.98Å
104	F	54.7	Low	64	Low	85 Å²	85	95.3 Å²	95.3	37%	0.373	48%	0.482	S	S	.	.			trans	-66.5	100.2	-178.9	-69	-77	0	0	0	110.4	R102 R106 Y166 L167	R102-F104 PolarHBondContact O-N 3.46Å; F104-R106 PolarHBondContact O-N 3.38Å; F104-Y166 AromaticContact CD1-CD1 3.92Å; F104-Y166 HydrophobicContact CD1-CD1 3.92Å; F104-Y166 VanDerWaalsContact CE1-CA 3.45Å; F104-Y166 AromaticContact CE1-CD1 3.6Å; F104-Y166 HydrophobicContact CE1-CD1 3.6Å; F104-Y166 HydrophobicContact CE1-CG 4.14Å; F104-L167 HydrophobicContact CD2-CB 4.23Å; F104-L167 WeakPolarHBondContact CD2-O 3.18Å; F104-L167 HydrophobicContact CE2-CB 3.5Å; F104-L167 HydrophobicContact CE2-CD1 3.93Å; F104-L167 HydrophobicContact CE2-CG 4.34Å; F104-L167 WeakPolarHBondContact CE2-O 3.23Å; F104-L167 WeakPolarHBondContact CG-O 3.28Å; F104-L167 HydrophobicContact CZ-CB 3.95Å; F104-L167 HydrophobicContact CZ-CD1 3.92Å
105	L	59.3	Low	66.3	Low	99 Å²	99	90.7 Å²	90.7	52%	0.518	45%	0.451	S	S	.	.			trans	-82.6	103.2	166.1	-78.9	90.6	0	0	0	108.8	K82 P103	K82-L105 WeakPolarHBondContact CB-O 3.26Å; K82-L105 HydrophobicContact CD-CB 4.17Å; K82-L105 WeakPolarHBondContact CG-O 3.4Å; K82-L105 PolarHBondContact N-O 2.96Å; P103-L105 HydrophobicContact CG-CD1 4.32Å; P103-L105 VanDerWaalsContact O-CD1 3.3Å; P103-L105 WeakPolarHBondContact O-CD1 3.2Å; P103-L105 PolarHBondContact O-N 2.98Å
106	R	73.1	Confident	68.5	Low	115 Å²	115	87 Å²	87	43%	0.434	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-59.1	141.3	169.9	-10.7	179.8	-162.4	161	6.8	109.9	F78 K82 F104 L108	F78-R106 VanDerWaalsContact CE2-NH1 3.28Å; F78-R106 VanDerWaalsContact CZ-NH1 3.25Å; K82-R106 WeakPolarHBondContact CE-O 3.38Å; F104-R106 PolarHBondContact O-N 3.38Å; R106-L108 VanDerWaalsContact C-N 3.33Å; R106-L108 PolarHBondContact O-N 2.71Å
107	K	73.1	Confident	71	Confident	104 Å²	104	78.5 Å²	78.5	45%	0.452	39%	0.394	S	S	.	.	S	Bend	trans	-58.7	-45.1	-179.7	-172.3	-176	176.1	-161.5	0	111.9	D77 S80 K82	D77-K107 WeakPolarHBondContact O-CB 3.43Å; D77-K107 IonicContact OD1-NZ 2.81Å; D77-K107 PolarHBondContact OD1-NZ 2.88Å; S80-K107 WeakPolarHBondContact O-CB 3.29Å; S80-K107 PolarHBondContact O-N 3.14Å; K82-K107 WeakPolarHBondContact CE-O 3.46Å; K82-K107 HydrophobicContact CG-CB 4.1Å
108	L	78.9	Confident	73.5	Confident	23 Å²	23	73.1 Å²	73.1	12%	0.12	36%	0.356	C	S	.	.	S	Bend	trans	-104.2	119.2	174.7	-153.4	67.2	0	0	0	111.1	D77 R106 K112 F113	D77-L108 HydrophobicContact CB-CB 4.4Å; D77-L108 HydrophobicContact CB-CD2 4.4Å; D77-L108 PolarHBondContact O-N 3.38Å; R106-L108 VanDerWaalsContact C-N 3.33Å; R106-L108 PolarHBondContact O-N 2.71Å; L108-K112 HydrophobicContact CD1-CB 4.3Å; L108-K112 HydrophobicContact CG-CB 4.46Å; L108-F113 HydrophobicContact CD2-CB 3.76Å; L108-F113 HydrophobicContact CD2-CD2 3.98Å; L108-F113 HydrophobicContact CD2-CG 4.35Å; L108-F113 HydrophobicContact CG-CB 4.2Å
109	P	84.3	Confident	75.9	Confident	53 Å²	53	72.1 Å²	72.1	34%	0.344	34%	0.342	S	S	.	.			trans	-67.6	147.3	171.9	29.3	-32.7	0	0	0	109.9	L111 K112 F113	P109-L111 VanDerWaalsContact C-N 3.27Å; P109-L111 PolarHBondContact O-N 3Å; P109-K112 HydrophobicContact CG-CB 3.88Å; P109-K112 HydrophobicContact CG-CD 3.65Å; P109-K112 HydrophobicContact CG-CG 3.71Å; P109-K112 PolarHBondContact O-N 2.79Å; P109-F113 PolarHBondContact O-N 3.42Å
110	E	87.2	Confident	78.1	Confident	55 Å²	55	63.7 Å²	63.7	26%	0.257	30%	0.304	S	S	.	.	H	α-helix	trans	-53.7	-41.1	-174.9	-173.2	-163.7	132.1	0	0	113.2	R39 W40 F78 K112 F113 W114	R39-E110 IonicContact CZ-OE1 3.91Å; R39-E110 IonicContact NH1-OE1 3.73Å; R39-E110 IonicContact NH2-OE1 3.49Å; R39-E110 PolarHBondContact NH2-OE1 3.34Å; R39-E110 VanDerWaalsContact NH2-OE1 3.14Å; W40-E110 HydrophobicContact CZ2-CG 4.01Å; W40-E110 PolarHBondContact NE1-OE1 3.27Å; F78-E110 HydrophobicContact CE2-CB 4.25Å; E110-K112 PolarHBondContact O-N 2.81Å; E110-F113 WeakPolarHBondContact O-CB 3.41Å; E110-F113 PolarHBondContact O-N 3.19Å; E110-W114 WeakPolarHBondContact O-CB 3.33Å; E110-W114 PolarHBondContact O-N 2.98Å
111	L	87.6	Confident	80.5	Confident	30 Å²	30	57.7 Å²	57.7	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-40.9	-179.5	-175.1	62.9	0	0	0	112.1	Y29 L32 P109 W114 N115	Y29-L111 HydrophobicContact CD1-CD2 3.67Å; Y29-L111 HydrophobicContact CD1-CG 3.9Å; Y29-L111 HydrophobicContact CG-CD2 4.11Å; Y29-L111 WeakPolarHBondContact O-CD2 3.47Å; L32-L111 HydrophobicContact CB-CD1 4.29Å; P109-L111 VanDerWaalsContact C-N 3.27Å; P109-L111 PolarHBondContact O-N 3Å; L111-W114 HydrophobicContact CD1-CE3 4.29Å; L111-N115 WeakPolarHBondContact O-CB 3.47Å; L111-N115 PolarHBondContact O-N 2.9Å
112	K	87.9	Confident	82.9	Confident	116 Å²	116	56.7 Å²	56.7	50%	0.504	28%	0.275	S	S	.	.	H	α-helix	trans	-69.8	-40.6	175.7	-67.9	-173.8	-177.6	-176.5	0	111.1	L108 P109 E110 N115 S116	L108-K112 HydrophobicContact CD1-CB 4.3Å; L108-K112 HydrophobicContact CG-CB 4.46Å; P109-K112 HydrophobicContact CG-CB 3.88Å; P109-K112 HydrophobicContact CG-CD 3.65Å; P109-K112 HydrophobicContact CG-CG 3.71Å; P109-K112 PolarHBondContact O-N 2.79Å; E110-K112 PolarHBondContact O-N 2.81Å; K112-N115 PolarHBondContact O-N 3.43Å; K112-S116 WeakPolarHBondContact O-CB 3.42Å; K112-S116 PolarHBondContact O-N 2.9Å; K112-S116 PolarHBondContact O-OG 2.85Å; K112-S116 VanDerWaalsContact O-OG 3.14Å
113	F	91.6	Very high	84.9	Confident	21 Å²	21	54.7 Å²	54.7	9%	0.092	27%	0.274	C	S	.	.	H	α-helix	trans	-55.5	-53.3	174.2	174.1	-121.7	0	0	0	110.9	W40 R74 F78 L108 P109 E110 N115 S116 C117	W40-F113 AromaticContact CH2-CD1 3.67Å; W40-F113 HydrophobicContact CH2-CD1 3.67Å; W40-F113 AromaticContact CH2-CE1 3.53Å; W40-F113 HydrophobicContact CH2-CE1 3.53Å; W40-F113 HydrophobicContact CZ2-CD1 4.14Å; W40-F113 HydrophobicContact CZ2-CE1 4.33Å; W40-F113 HydrophobicContact CZ3-CE1 4.44Å; R74-F113 HydrophobicContact CB-CD2 3.97Å; R74-F113 HydrophobicContact CB-CE2 3.86Å; F78-F113 HydrophobicContact CB-CD2 3.97Å; F78-F113 HydrophobicContact CB-CE2 4.2Å; F78-F113 HydrophobicContact CB-CG 4.15Å; F78-F113 HydrophobicContact CD2-CB 3.92Å; F78-F113 AromaticContact CD2-CD1 3.85Å; F78-F113 HydrophobicContact CD2-CD1 3.85Å; F78-F113 AromaticContact CD2-CG 3.84Å; F78-F113 HydrophobicContact CD2-CG 3.84Å; F78-F113 HydrophobicContact CE2-CD1 4.15Å; F78-F113 HydrophobicContact CG-CD1 4.08Å; F78-F113 HydrophobicContact CG-CD2 4.4Å; F78-F113 HydrophobicContact CG-CE1 4.34Å; F78-F113 HydrophobicContact CG-CG 4.11Å; L108-F113 HydrophobicContact CD2-CB 3.76Å; L108-F113 HydrophobicContact CD2-CD2 3.98Å; L108-F113 HydrophobicContact CD2-CG 4.35Å; L108-F113 HydrophobicContact CG-CB 4.2Å; P109-F113 PolarHBondContact O-N 3.42Å; E110-F113 WeakPolarHBondContact O-CB 3.41Å; E110-F113 PolarHBondContact O-N 3.19Å; F113-N115 PolarHBondContact O-N 3.31Å; F113-S116 PolarHBondContact O-N 3.06Å; F113-C117 PolarHBondContact O-N 3.16Å; F113-C117 PolarHBondContact O-SG 3.38Å
114	W	93.2	Very high	86.9	Confident	18 Å²	18	51.9 Å²	51.9	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-58.6	-47	177.9	174.5	82	0	0	0	112.7	L32 R39 W40 F42 T43 E110 L111 S116 C117 T118	L32-W114 HydrophobicContact CD2-CH2 3.9Å; L32-W114 HydrophobicContact CD2-CZ3 3.91Å; R39-W114 HydrophobicContact CB-CD2 3.92Å; R39-W114 VanDerWaalsContact CB-CE2 3.42Å; R39-W114 HydrophobicContact CB-CG 4.35Å; R39-W114 HydrophobicContact CB-CH2 4.24Å; R39-W114 HydrophobicContact CB-CZ2 3.61Å; R39-W114 HydrophobicContact CG-CD2 4.16Å; R39-W114 HydrophobicContact CG-CE3 4.25Å; R39-W114 HydrophobicContact CG-CH2 3.8Å; R39-W114 HydrophobicContact CG-CZ2 3.69Å; R39-W114 HydrophobicContact CG-CZ3 4.08Å; R39-W114 PolarHBondContact O-NE1 3.43Å; W40-W114 AromaticContact CD2-CD1 3.99Å; W40-W114 HydrophobicContact CH2-CB 4.36Å; W40-W114 HydrophobicContact CZ2-CB 4.2Å; F42-W114 HydrophobicContact CD1-CZ2 4.24Å; T43-W114 HydrophobicContact CG2-CZ2 4.46Å; T43-W114 PolarHBondContact OG1-NE1 3.17Å; E110-W114 WeakPolarHBondContact O-CB 3.33Å; E110-W114 PolarHBondContact O-N 2.98Å; L111-W114 HydrophobicContact CD1-CE3 4.29Å; W114-S116 PolarHBondContact O-N 3.31Å; W114-C117 PolarHBondContact O-N 3.26Å; W114-T118 WeakPolarHBondContact O-CB 3.44Å; W114-T118 PolarHBondContact O-N 3.07Å; W114-T118 PolarHBondContact O-OG1 3.19Å
115	N	91.5	Very high	88.9	Confident	29 Å²	29	48.6 Å²	48.6	16%	0.155	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-44.8	-179.5	-171.2	37.8	0	0	0	111.6	Y29 L111 K112 F113 C117 T118 I119	Y29-N115 HydrophobicContact CE1-CB 4.32Å; Y29-N115 PolarHBondContact OH-ND2 3.35Å; L111-N115 WeakPolarHBondContact O-CB 3.47Å; L111-N115 PolarHBondContact O-N 2.9Å; K112-N115 PolarHBondContact O-N 3.43Å; F113-N115 PolarHBondContact O-N 3.31Å; N115-C117 VanDerWaalsContact C-N 3.34Å; N115-C117 PolarHBondContact O-N 3.01Å; N115-T118 PolarHBondContact O-N 2.99Å; N115-I119 WeakPolarHBondContact O-CB 3.45Å; N115-I119 WeakPolarHBondContact O-CG1 3.38Å; N115-I119 PolarHBondContact O-N 3.06Å; N115-I119 WeakPolarHBondContact OD1-CD1 3.32Å
116	S	93.8	Very high	90.6	Very high	39 Å²	39	50 Å²	50	27%	0.273	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-41.5	175.8	-65.1	0	0	0	0	112.4	K112 F113 W114 C120	K112-S116 WeakPolarHBondContact O-CB 3.42Å; K112-S116 PolarHBondContact O-N 2.9Å; K112-S116 PolarHBondContact O-OG 2.85Å; K112-S116 VanDerWaalsContact O-OG 3.14Å; F113-S116 PolarHBondContact O-N 3.06Å; W114-S116 PolarHBondContact O-N 3.31Å; S116-C120 VanDerWaalsContact O-CB 3.24Å; S116-C120 WeakPolarHBondContact O-CB 3.46Å; S116-C120 PolarHBondContact O-N 3.44Å
117	C	95.5	Very high	91.6	Very high	12 Å²	12	45.8 Å²	45.8	8%	0.081	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-45.6	174.6	-69.6	0	0	0	0	111.8	L71 F113 W114 N115 C120 L121	L71-C117 HydrophobicContact CD2-CB 3.9Å; L71-C117 VanDerWaalsContact CD2-SG 3.54Å; F113-C117 PolarHBondContact O-N 3.16Å; F113-C117 PolarHBondContact O-SG 3.38Å; W114-C117 PolarHBondContact O-N 3.26Å; N115-C117 VanDerWaalsContact C-N 3.34Å; N115-C117 PolarHBondContact O-N 3.01Å; C117-C120 PolarHBondContact O-N 2.89Å; C117-L121 WeakPolarHBondContact O-CB 3.38Å; C117-L121 WeakPolarHBondContact O-CG 2.96Å; C117-L121 PolarHBondContact O-N 3.11Å
118	T	95.3	Very high	92.6	Very high	7 Å²	7	40.9 Å²	40.9	4%	0.043	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-48.2	180	-50.9	0	0	0	0	111.6	F42 T43 L46 W114 N115 L121 L122	F42-T118 HydrophobicContact CD1-CG2 4.1Å; F42-T118 HydrophobicContact CE1-CG2 3.73Å; T43-T118 HydrophobicContact CG2-CG2 4.26Å; T43-T118 WeakPolarHBondContact CG2-OG1 3.26Å; L46-T118 HydrophobicContact CD1-CG2 3.92Å; W114-T118 WeakPolarHBondContact O-CB 3.44Å; W114-T118 PolarHBondContact O-N 3.07Å; W114-T118 PolarHBondContact O-OG1 3.19Å; N115-T118 PolarHBondContact O-N 2.99Å; T118-L121 PolarHBondContact O-N 2.76Å; T118-L122 HydrophobicContact CG2-CD1 4.39Å; T118-L122 WeakPolarHBondContact O-CG 3.29Å; T118-L122 PolarHBondContact O-N 3.2Å
119	I	95.7	Very high	93.2	Very high	77 Å²	77	45.7 Å²	45.7	40%	0.395	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-43.9	178.2	-68.6	170	0	0	0	110.5	N115 L121 L122 I123	N115-I119 WeakPolarHBondContact O-CB 3.45Å; N115-I119 WeakPolarHBondContact O-CG1 3.38Å; N115-I119 PolarHBondContact O-N 3.06Å; N115-I119 WeakPolarHBondContact OD1-CD1 3.32Å; I119-L121 VanDerWaalsContact C-N 3.32Å; I119-L121 PolarHBondContact O-N 3.26Å; I119-L122 PolarHBondContact O-N 3.21Å; I119-I123 HydrophobicContact CG2-CD1 3.69Å; I119-I123 HydrophobicContact CG2-CG1 4.33Å; I119-I123 VanDerWaalsContact O-CG1 3.3Å; I119-I123 WeakPolarHBondContact O-CG1 3.37Å; I119-I123 PolarHBondContact O-N 3.31Å
120	C	97	Very high	93.6	Very high	15 Å²	15	46 Å²	46	10%	0.101	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-41.8	177	177.2	0	0	0	0	112.1	F70 S116 C117 I123 S124	F70-C120 HydrophobicContact CD1-CB 3.54Å; F70-C120 WeakPolarHBondContact CD1-SG 3.28Å; F70-C120 HydrophobicContact CE1-CB 3.48Å; F70-C120 VanDerWaalsContact CE1-CB 3.48Å; F70-C120 HydrophobicContact CZ-CB 4.41Å; S116-C120 VanDerWaalsContact O-CB 3.24Å; S116-C120 WeakPolarHBondContact O-CB 3.46Å; S116-C120 PolarHBondContact O-N 3.44Å; C117-C120 PolarHBondContact O-N 2.89Å; C120-I123 PolarHBondContact O-N 2.88Å; C120-S124 VanDerWaalsContact O-CB 3.26Å; C120-S124 WeakPolarHBondContact O-CB 3.27Å; C120-S124 PolarHBondContact O-N 3.43Å; C120-S124 PolarHBondContact O-OG 3.45Å
121	L	96.7	Very high	93.6	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-46.4	174.6	-78.2	162.5	0	0	0	111.7	I47 M67 C117 T118 I119 I123 S124 I125	I47-L121 HydrophobicContact CD1-CD1 4.16Å; I47-L121 HydrophobicContact CG1-CD1 3.54Å; I47-L121 HydrophobicContact CG1-CD2 3.87Å; I47-L121 HydrophobicContact CG1-CG 4.38Å; M67-L121 HydrophobicContact CE-CD2 4.49Å; M67-L121 HydrophobicContact SD-CD2 3.64Å; C117-L121 WeakPolarHBondContact O-CB 3.38Å; C117-L121 WeakPolarHBondContact O-CG 2.96Å; C117-L121 PolarHBondContact O-N 3.11Å; T118-L121 PolarHBondContact O-N 2.76Å; I119-L121 VanDerWaalsContact C-N 3.32Å; I119-L121 PolarHBondContact O-N 3.26Å; L121-I123 PolarHBondContact O-N 3.29Å; L121-S124 PolarHBondContact O-N 2.97Å; L121-I125 WeakPolarHBondContact O-CB 3.35Å; L121-I125 VanDerWaalsContact O-CG1 3.26Å; L121-I125 WeakPolarHBondContact O-CG1 3.31Å; L121-I125 PolarHBondContact O-N 3.14Å
122	L	96.9	Very high	93.7	Very high	82 Å²	82	53.9 Å²	53.9	43%	0.429	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-44.2	177.8	-72.1	173.5	0	0	0	112.2	L46 T118 I119 S124 I125 F126	L46-L122 HydrophobicContact CD1-CD2 4.02Å; L46-L122 HydrophobicContact CD1-CG 4.22Å; L46-L122 HydrophobicContact CD2-CD2 4.09Å; T118-L122 HydrophobicContact CG2-CD1 4.39Å; T118-L122 WeakPolarHBondContact O-CG 3.29Å; T118-L122 PolarHBondContact O-N 3.2Å; I119-L122 PolarHBondContact O-N 3.21Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.39Å; L122-I125 PolarHBondContact O-N 3.36Å; L122-F126 WeakPolarHBondContact O-CB 3.41Å; L122-F126 PolarHBondContact O-N 3.07Å
123	I	96.6	Very high	93.8	Very high	98 Å²	98	50.4 Å²	50.4	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-43.2	174.7	-67.7	169.2	0	0	0	110	I119 C120 L121 F126 C127	I119-I123 HydrophobicContact CG2-CD1 3.69Å; I119-I123 HydrophobicContact CG2-CG1 4.33Å; I119-I123 VanDerWaalsContact O-CG1 3.3Å; I119-I123 WeakPolarHBondContact O-CG1 3.37Å; I119-I123 PolarHBondContact O-N 3.31Å; C120-I123 PolarHBondContact O-N 2.88Å; L121-I123 PolarHBondContact O-N 3.29Å; I123-F126 WeakPolarHBondContact O-CB 3.17Å; I123-F126 PolarHBondContact O-N 3.33Å; I123-C127 WeakPolarHBondContact O-CB 3.31Å; I123-C127 PolarHBondContact O-N 3.29Å; I123-C127 PolarHBondContact O-SG 3.08Å
124	S	95.9	Very high	93.8	Very high	9 Å²	9	52.9 Å²	52.9	6%	0.063	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-40.8	-179.9	-60.8	0	0	0	0	111.6	M67 C120 L121 L122 C127 T128	M67-S124 WeakPolarHBondContact CB-OG 3.49Å; M67-S124 WeakPolarHBondContact CG-OG 3.32Å; C120-S124 VanDerWaalsContact O-CB 3.26Å; C120-S124 WeakPolarHBondContact O-CB 3.27Å; C120-S124 PolarHBondContact O-N 3.43Å; C120-S124 PolarHBondContact O-OG 3.45Å; L121-S124 PolarHBondContact O-N 2.97Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.39Å; S124-C127 WeakPolarHBondContact O-CB 3.49Å; S124-C127 PolarHBondContact O-N 2.99Å; S124-T128 WeakPolarHBondContact O-CG2 3.5Å; S124-T128 PolarHBondContact O-N 3.29Å; S124-T128 VanDerWaalsContact O-N 3.11Å
125	I	95.4	Very high	93.6	Very high	17 Å²	17	55.5 Å²	55.5	9%	0.087	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-49.2	171	-70.9	162.9	0	0	0	109.9	L46 F49 Y50 L121 L122 C127 T128 F129	L46-I125 HydrophobicContact CD2-CD1 4.09Å; F49-I125 HydrophobicContact CD1-CD1 3.93Å; F49-I125 HydrophobicContact CD1-CG1 4.29Å; F49-I125 HydrophobicContact CD1-CG2 4.44Å; F49-I125 HydrophobicContact CE1-CD1 4.42Å; F49-I125 HydrophobicContact CE1-CG1 4.5Å; F49-I125 HydrophobicContact CE1-CG2 3.86Å; Y50-I125 HydrophobicContact CD2-CG1 3.77Å; Y50-I125 HydrophobicContact CG-CG1 4.46Å; L121-I125 WeakPolarHBondContact O-CB 3.35Å; L121-I125 VanDerWaalsContact O-CG1 3.26Å; L121-I125 WeakPolarHBondContact O-CG1 3.31Å; L121-I125 PolarHBondContact O-N 3.14Å; L122-I125 PolarHBondContact O-N 3.36Å; I125-C127 VanDerWaalsContact C-N 3.3Å; I125-C127 PolarHBondContact O-N 3.31Å; I125-T128 PolarHBondContact O-N 2.88Å; I125-T128 PolarHBondContact O-OG1 2.83Å; I125-F129 HydrophobicContact CG2-CE2 4.01Å; I125-F129 VanDerWaalsContact O-CD2 3.24Å; I125-F129 WeakPolarHBondContact O-CD2 3.16Å; I125-F129 WeakPolarHBondContact O-CE2 3.15Å
126	F	95.5	Very high	93.6	Very high	129 Å²	129	60.4 Å²	60.4	57%	0.566	33%	0.326	S	S	*	.	H	α-helix	trans	-58.1	-42.9	176.6	-178	-103.1	0	0	0	112	L122 I123 T128 F129 L130	L122-F126 WeakPolarHBondContact O-CB 3.41Å; L122-F126 PolarHBondContact O-N 3.07Å; I123-F126 WeakPolarHBondContact O-CB 3.17Å; I123-F126 PolarHBondContact O-N 3.33Å; F126-T128 VanDerWaalsContact C-N 3.26Å; F126-T128 PolarHBondContact O-N 3.09Å; F126-F129 WeakPolarHBondContact O-CB 2.83Å; F126-F129 PolarHBondContact O-N 3.44Å; F126-L130 HydrophobicContact CE1-CD1 4.23Å
127	C	94.9	Very high	93.4	Very high	25 Å²	25	61.1 Å²	61.1	17%	0.169	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-29.4	175.4	-73.8	0	0	0	0	113.5	V63 I123 S124 I125 F129 L130 L133	V63-C127 HydrophobicContact CG1-CB 3.92Å; V63-C127 HydrophobicContact CG2-CB 4.38Å; I123-C127 WeakPolarHBondContact O-CB 3.31Å; I123-C127 PolarHBondContact O-N 3.29Å; I123-C127 PolarHBondContact O-SG 3.08Å; S124-C127 WeakPolarHBondContact O-CB 3.49Å; S124-C127 PolarHBondContact O-N 2.99Å; I125-C127 VanDerWaalsContact C-N 3.3Å; I125-C127 PolarHBondContact O-N 3.31Å; C127-F129 PolarHBondContact O-N 2.72Å; C127-L130 PolarHBondContact O-N 3.28Å; C127-L133 HydrophobicContact CB-CD1 3.55Å
128	T	92.6	Very high	93.3	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.006	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-7.6	174.5	67.1	0	0	0	0	114.3	Y50 I54 Y60 S124 I125 F126	Y50-T128 HydrophobicContact CE2-CG2 3.85Å; I54-T128 HydrophobicContact CD1-CG2 4.01Å; Y60-T128 HydrophobicContact CG-CG2 4.35Å; Y60-T128 PolarHBondContact OH-O 2.87Å; S124-T128 WeakPolarHBondContact O-CG2 3.5Å; S124-T128 PolarHBondContact O-N 3.29Å; S124-T128 VanDerWaalsContact O-N 3.11Å; I125-T128 PolarHBondContact O-N 2.88Å; I125-T128 PolarHBondContact O-OG1 2.83Å; F126-T128 VanDerWaalsContact C-N 3.26Å; F126-T128 PolarHBondContact O-N 3.09Å
129	F	92.3	Very high	93.1	Very high	124 Å²	124	74.3 Å²	74.3	54%	0.544	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-12	170.4	-63.6	-79.9	0	0	0	112.8	I125 F126 C127	I125-F129 HydrophobicContact CG2-CE2 4.01Å; I125-F129 VanDerWaalsContact O-CD2 3.24Å; I125-F129 WeakPolarHBondContact O-CD2 3.16Å; I125-F129 WeakPolarHBondContact O-CE2 3.15Å; F126-F129 WeakPolarHBondContact O-CB 2.83Å; F126-F129 PolarHBondContact O-N 3.44Å; C127-F129 PolarHBondContact O-N 2.72Å
130	L	92.1	Very high	93	Very high	59 Å²	59	73 Å²	73	31%	0.309	38%	0.377	S	S	.	.			trans	-92	105.1	-178.7	-58.2	175	0	0	0	109.5	F126 C127 F132 L133	F126-L130 HydrophobicContact CE1-CD1 4.23Å; C127-L130 PolarHBondContact O-N 3.28Å; L130-F132 HydrophobicContact CB-CD1 3.89Å; L130-F132 HydrophobicContact CB-CE1 3.77Å; L130-F132 HydrophobicContact CD1-CE1 3.86Å; L130-F132 HydrophobicContact CD1-CZ 4.46Å; L130-F132 HydrophobicContact CG-CE1 4.3Å; L130-F132 PolarHBondContact O-N 2.93Å; L130-F132 VanDerWaalsContact O-N 3.11Å; L130-L133 HydrophobicContact CB-CD1 4.21Å; L130-L133 HydrophobicContact CB-CG 4.5Å; L130-L133 HydrophobicContact CD1-CD1 4.2Å; L130-L133 PolarHBondContact O-N 3.43Å; L130-L133 VanDerWaalsContact O-N 3.16Å
131	S	87.6	Confident	92.9	Very high	100 Å²	100	77.4 Å²	77.4	70%	0.699	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-59.4	-25.4	-175.4	-48.4	0	0	0	0	114.3	L133 D134	S131-L133 VanDerWaalsContact C-N 3.26Å; S131-L133 PolarHBondContact O-N 2.78Å; S131-D134 PolarHBondContact O-N 3.34Å
132	F	90.2	Very high	92.8	Very high	151 Å²	151	78.8 Å²	78.8	66%	0.662	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-69.5	-21.1	-179.5	82.8	-94.6	0	0	0	113.8	L130 D134	L130-F132 HydrophobicContact CB-CD1 3.89Å; L130-F132 HydrophobicContact CB-CE1 3.77Å; L130-F132 HydrophobicContact CD1-CE1 3.86Å; L130-F132 HydrophobicContact CD1-CZ 4.46Å; L130-F132 HydrophobicContact CG-CE1 4.3Å; L130-F132 PolarHBondContact O-N 2.93Å; L130-F132 VanDerWaalsContact O-N 3.11Å; F132-D134 VanDerWaalsContact C-N 3.26Å
133	L	90.2	Very high	92.7	Very high	44 Å²	44	78.8 Å²	78.8	23%	0.23	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-82.2	-6.2	179.1	-70.3	173.8	0	0	0	112.8	Y60 V63 C127 L130 S131 V135	Y60-L133 HydrophobicContact CD1-CB 4.43Å; V63-L133 HydrophobicContact CG2-CB 3.87Å; V63-L133 HydrophobicContact CG2-CD1 4.19Å; C127-L133 HydrophobicContact CB-CD1 3.55Å; L130-L133 HydrophobicContact CB-CD1 4.21Å; L130-L133 HydrophobicContact CB-CG 4.5Å; L130-L133 HydrophobicContact CD1-CD1 4.2Å; L130-L133 PolarHBondContact O-N 3.43Å; L130-L133 VanDerWaalsContact O-N 3.16Å; S131-L133 VanDerWaalsContact C-N 3.26Å; S131-L133 PolarHBondContact O-N 2.78Å; L133-V135 VanDerWaalsContact C-N 3.33Å; L133-V135 PolarHBondContact O-N 2.9Å; L133-V135 VanDerWaalsContact O-N 3.12Å
134	D	90.5	Very high	92.7	Very high	73 Å²	73	80.8 Å²	80.8	39%	0.39	42%	0.418	S	S	.	.			trans	-85.2	77.8	175.4	-164.5	27.5	0	0	0	110.5	G59 Y60 S131 F132	G59-D134 WeakPolarHBondContact CA-OD1 3.42Å; Y60-D134 HydrophobicContact CD1-CB 4.19Å; Y60-D134 HydrophobicContact CE1-CB 3.87Å; Y60-D134 HydrophobicContact CE2-CB 4.17Å; Y60-D134 PolarHBondContact N-OD1 3.03Å; S131-D134 PolarHBondContact O-N 3.34Å; F132-D134 VanDerWaalsContact C-N 3.26Å
135	V	89.9	Confident	92.7	Very high	73 Å²	73	86.3 Å²	86.3	44%	0.442	44%	0.438	S	S	.	.			trans	-94.4	129.1	177.8	-178.5	0	0	0	0	109.2	L133 V137	L133-V135 VanDerWaalsContact C-N 3.33Å; L133-V135 PolarHBondContact O-N 2.9Å; L133-V135 VanDerWaalsContact O-N 3.12Å; V135-V137 HydrophobicContact CB-CG2 4.35Å; V135-V137 HydrophobicContact CG1-CG2 4Å; V135-V137 PolarHBondContact O-N 3.01Å
136	P	90.5	Very high	92.7	Very high	131 Å²	131	88.2 Å²	88.2	85%	0.851	45%	0.446	S	S	*	.			trans	-68.2	103.4	176.4	28.1	-34	0	0	0	109.7
137	V	90.9	Very high	92.8	Very high	54 Å²	54	86.1 Å²	86.1	33%	0.327	44%	0.443	S	S	.	.			trans	-119.7	143.4	176.9	-176.3	0	0	0	0	109.1	V62 V135 W139 L142	V62-V137 HydrophobicContact CG2-CB 4.34Å; V62-V137 HydrophobicContact CG2-CG2 3.57Å; V135-V137 HydrophobicContact CB-CG2 4.35Å; V135-V137 HydrophobicContact CG1-CG2 4Å; V135-V137 PolarHBondContact O-N 3.01Å; V137-W139 VanDerWaalsContact C-N 3.28Å; V137-W139 PolarHBondContact O-N 3.32Å; V137-L142 HydrophobicContact CB-CD1 4.16Å; V137-L142 HydrophobicContact CG1-CD1 3.58Å; V137-L142 HydrophobicContact CG1-CG 4.14Å
138	F	92.1	Very high	92.8	Very high	147 Å²	147	90.1 Å²	90.1	65%	0.645	46%	0.462	S	S	*	.			trans	-66.4	85.1	178.4	-170.6	-108.1	0	0	0	111.2	P140 I141	F138-P140 VanDerWaalsContact C-N 3.34Å; F138-P140 HydrophobicContact CD1-CG 4.37Å; F138-P140 HydrophobicContact CE1-CB 4.06Å; F138-P140 HydrophobicContact CE1-CG 3.91Å; F138-P140 HydrophobicContact CE2-CG 4.23Å; F138-P140 HydrophobicContact CZ-CB 4.36Å; F138-P140 HydrophobicContact CZ-CG 3.83Å; F138-P140 VanDerWaalsContact O-CD 3.28Å; F138-P140 WeakPolarHBondContact O-CD 3.36Å; F138-P140 VanDerWaalsContact O-N 3.12Å; F138-I141 HydrophobicContact CB-CG2 4.47Å; F138-I141 HydrophobicContact CD1-CB 3.92Å; F138-I141 HydrophobicContact CD1-CG2 4.13Å; F138-I141 WeakPolarHBondContact O-CG2 3.5Å; F138-I141 PolarHBondContact O-N 3.15Å
139	W	90.7	Very high	93	Very high	150 Å²	150	92 Å²	92	57%	0.568	47%	0.472	S	S	*	.	H	α-helix	trans	-51.1	-32.3	-172.9	73.6	-57.5	0	0	0	117	H61 V137 I141 L142 V143	H61-W139 HydrophobicContact CB-CB 4.39Å; V137-W139 VanDerWaalsContact C-N 3.28Å; V137-W139 PolarHBondContact O-N 3.32Å; W139-I141 VanDerWaalsContact C-N 3.3Å; W139-I141 PolarHBondContact O-N 3.14Å; W139-L142 WeakPolarHBondContact O-CB 3.45Å; W139-L142 PolarHBondContact O-N 2.88Å; W139-V143 WeakPolarHBondContact O-CG2 3.07Å; W139-V143 PolarHBondContact O-N 2.99Å
140	P	94.7	Very high	93.1	Very high	48 Å²	48	90.2 Å²	90.2	31%	0.312	47%	0.465	S	S	.	.	H	α-helix	trans	-68.6	-32	-177.5	-16.6	35.3	0	0	0	111.5	F138 L142 V143 M144	F138-P140 VanDerWaalsContact C-N 3.34Å; F138-P140 HydrophobicContact CD1-CG 4.37Å; F138-P140 HydrophobicContact CE1-CB 4.06Å; F138-P140 HydrophobicContact CE1-CG 3.91Å; F138-P140 HydrophobicContact CE2-CG 4.23Å; F138-P140 HydrophobicContact CZ-CB 4.36Å; F138-P140 HydrophobicContact CZ-CG 3.83Å; F138-P140 VanDerWaalsContact O-CD 3.28Å; F138-P140 WeakPolarHBondContact O-CD 3.36Å; F138-P140 VanDerWaalsContact O-N 3.12Å; P140-L142 VanDerWaalsContact C-N 3.34Å; P140-V143 PolarHBondContact O-N 3.45Å; P140-M144 WeakPolarHBondContact O-CB 3.31Å; P140-M144 VanDerWaalsContact O-CG 3.24Å; P140-M144 WeakPolarHBondContact O-CG 3.38Å; P140-M144 PolarHBondContact O-N 3.26Å
141	I	95.1	Very high	93.3	Very high	109 Å²	109	93.9 Å²	93.9	56%	0.559	48%	0.475	S	S	*	.	H	α-helix	trans	-68.4	-37.2	176.7	-156.5	169.6	0	0	0	111.3	F138 W139 M144 Y145	F138-I141 HydrophobicContact CB-CG2 4.47Å; F138-I141 HydrophobicContact CD1-CB 3.92Å; F138-I141 HydrophobicContact CD1-CG2 4.13Å; F138-I141 WeakPolarHBondContact O-CG2 3.5Å; F138-I141 PolarHBondContact O-N 3.15Å; W139-I141 VanDerWaalsContact C-N 3.3Å; W139-I141 PolarHBondContact O-N 3.14Å; I141-M144 PolarHBondContact O-N 2.92Å; I141-Y145 VanDerWaalsContact O-CB 3.24Å; I141-Y145 WeakPolarHBondContact O-CB 3.34Å; I141-Y145 PolarHBondContact O-N 3.43Å
142	L	93.7	Very high	93.7	Very high	31 Å²	31	93 Å²	93	16%	0.162	47%	0.466	C	S	.	.	H	α-helix	trans	-64.9	-43.4	176	-72.8	170.3	0	0	0	110.8	H61 Y65 V137 W139 P140 Y145 F146	H61-L142 HydrophobicContact CB-CD1 4.37Å; Y65-L142 HydrophobicContact CD1-CD2 4.01Å; Y65-L142 HydrophobicContact CD2-CB 4.2Å; Y65-L142 HydrophobicContact CD2-CD2 4.01Å; Y65-L142 HydrophobicContact CE1-CD2 4.01Å; Y65-L142 HydrophobicContact CE2-CD2 4.01Å; Y65-L142 HydrophobicContact CG-CD2 3.99Å; V137-L142 HydrophobicContact CB-CD1 4.16Å; V137-L142 HydrophobicContact CG1-CD1 3.58Å; V137-L142 HydrophobicContact CG1-CG 4.14Å; W139-L142 WeakPolarHBondContact O-CB 3.45Å; W139-L142 PolarHBondContact O-N 2.88Å; P140-L142 VanDerWaalsContact C-N 3.34Å; L142-Y145 PolarHBondContact O-N 3.48Å; L142-F146 VanDerWaalsContact O-CB 3.23Å; L142-F146 WeakPolarHBondContact O-CB 3.12Å; L142-F146 PolarHBondContact O-N 2.72Å
143	V	94.5	Very high	93.8	Very high	81 Å²	81	87.4 Å²	87.4	49%	0.491	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-48.4	176.6	173.5	0	0	0	0	110.7	W139 P140 Y145 F146 V147	W139-V143 WeakPolarHBondContact O-CG2 3.07Å; W139-V143 PolarHBondContact O-N 2.99Å; P140-V143 PolarHBondContact O-N 3.45Å; V143-Y145 VanDerWaalsContact C-N 3.33Å; V143-Y145 PolarHBondContact O-N 2.92Å; V143-F146 PolarHBondContact O-N 3.3Å; V143-V147 HydrophobicContact CG1-CG2 4.36Å; V143-V147 WeakPolarHBondContact O-CG2 3.46Å; V143-V147 PolarHBondContact O-N 2.83Å
144	M	96.8	Very high	93.9	Very high	140 Å²	140	86.7 Å²	86.7	69%	0.69	44%	0.44	S	S	*	.	H	α-helix	trans	-60.9	-43.6	178.5	-71.3	-66.9	-93.4	0	0	111.6	P140 I141 V147 L148	P140-M144 WeakPolarHBondContact O-CB 3.31Å; P140-M144 VanDerWaalsContact O-CG 3.24Å; P140-M144 WeakPolarHBondContact O-CG 3.38Å; P140-M144 PolarHBondContact O-N 3.26Å; I141-M144 PolarHBondContact O-N 2.92Å; M144-V147 PolarHBondContact O-N 3.44Å; M144-L148 WeakPolarHBondContact O-CB 3.26Å; M144-L148 PolarHBondContact O-N 3.31Å
145	Y	95.7	Very high	94	Very high	125 Å²	125	89.1 Å²	89.1	49%	0.49	45%	0.447	S	S	.	.	H	α-helix	trans	-62.8	-44.4	175.3	-175.9	-90.8	0	0	0	111.7	Y65 I141 L142 V143 L148 L149	Y65-Y145 HydrophobicContact CE2-CD1 4.18Å; Y65-Y145 WeakPolarHBondContact OH-CD1 3.33Å; Y65-Y145 WeakPolarHBondContact OH-CE1 3.49Å; I141-Y145 VanDerWaalsContact O-CB 3.24Å; I141-Y145 WeakPolarHBondContact O-CB 3.34Å; I141-Y145 PolarHBondContact O-N 3.43Å; L142-Y145 PolarHBondContact O-N 3.48Å; V143-Y145 VanDerWaalsContact C-N 3.33Å; V143-Y145 PolarHBondContact O-N 2.92Å; Y145-L148 PolarHBondContact O-N 2.85Å; Y145-L149 HydrophobicContact CD1-CD1 4.44Å; Y145-L149 HydrophobicContact CE1-CB 4.44Å; Y145-L149 HydrophobicContact CE1-CD1 3.6Å; Y145-L149 VanDerWaalsContact O-CB 3.24Å; Y145-L149 WeakPolarHBondContact O-CB 3.09Å; Y145-L149 PolarHBondContact O-N 2.82Å
146	F	96.3	Very high	93.9	Very high	58 Å²	58	95 Å²	95	25%	0.254	46%	0.461	S	S	.	.	H	α-helix	trans	-61.8	-45	178.1	-178.6	-98.4	0	0	0	111.9	Y65 G68 I69 L72 L142 V143 L149 F150	Y65-F146 HydrophobicContact CD2-CB 4.38Å; Y65-F146 HydrophobicContact CE2-CB 4.18Å; G68-F146 VanDerWaalsContact C-CE2 3.46Å; I69-F146 HydrophobicContact CG1-CD2 4.22Å; I69-F146 HydrophobicContact CG1-CE2 4.38Å; L72-F146 HydrophobicContact CB-CE2 4.46Å; L72-F146 HydrophobicContact CD2-CE2 4.25Å; L142-F146 VanDerWaalsContact O-CB 3.23Å; L142-F146 WeakPolarHBondContact O-CB 3.12Å; L142-F146 PolarHBondContact O-N 2.72Å; V143-F146 PolarHBondContact O-N 3.3Å; F146-L149 PolarHBondContact O-N 2.73Å; F146-F150 WeakPolarHBondContact O-CB 3.44Å; F146-F150 PolarHBondContact O-N 2.81Å
147	V	96.8	Very high	93.8	Very high	84 Å²	84	90.6 Å²	90.6	51%	0.509	43%	0.429	S	S	.	.	H	α-helix	trans	-64	-43.9	177.5	171.5	0	0	0	0	111.1	V143 M144 F150 Y151	V143-V147 HydrophobicContact CG1-CG2 4.36Å; V143-V147 WeakPolarHBondContact O-CG2 3.46Å; V143-V147 PolarHBondContact O-N 2.83Å; M144-V147 PolarHBondContact O-N 3.44Å; V147-F150 PolarHBondContact O-N 2.96Å; V147-Y151 WeakPolarHBondContact O-CB 3.39Å; V147-Y151 PolarHBondContact O-N 3.17Å
148	L	96.7	Very high	93.6	Very high	109 Å²	109	92 Å²	92	57%	0.571	43%	0.434	S	S	*	.	H	α-helix	trans	-61.3	-48.2	176.2	-177.9	69.6	0	0	0	111.1	M144 Y145 Y151 V152	M144-L148 WeakPolarHBondContact O-CB 3.26Å; M144-L148 PolarHBondContact O-N 3.31Å; Y145-L148 PolarHBondContact O-N 2.85Å; L148-Y151 PolarHBondContact O-N 3.05Å; L148-V152 WeakPolarHBondContact O-CG2 3.44Å; L148-V152 PolarHBondContact O-N 3.49Å
149	L	95	Very high	93.3	Very high	41 Å²	41	88.5 Å²	88.5	22%	0.215	43%	0.428	C	S	.	.	H	α-helix	trans	-60.7	-49.5	178.3	-172.8	156.3	0	0	0	110.1	L72 Y145 F146 Y151 V152 T153	L72-L149 HydrophobicContact CD2-CD2 3.34Å; Y145-L149 HydrophobicContact CD1-CD1 4.44Å; Y145-L149 HydrophobicContact CE1-CB 4.44Å; Y145-L149 HydrophobicContact CE1-CD1 3.6Å; Y145-L149 VanDerWaalsContact O-CB 3.24Å; Y145-L149 WeakPolarHBondContact O-CB 3.09Å; Y145-L149 PolarHBondContact O-N 2.82Å; F146-L149 PolarHBondContact O-N 2.73Å; L149-Y151 VanDerWaalsContact C-N 3.33Å; L149-Y151 PolarHBondContact O-N 2.89Å; L149-V152 PolarHBondContact O-N 3.25Å; L149-T153 HydrophobicContact CD2-CG2 3.78Å; L149-T153 HydrophobicContact CG-CG2 4.33Å; L149-T153 WeakPolarHBondContact O-CB 3.14Å; L149-T153 WeakPolarHBondContact O-CG2 3.49Å; L149-T153 PolarHBondContact O-N 3.02Å; L149-T153 PolarHBondContact O-OG1 3.34Å
150	F	95.8	Very high	92.9	Very high	87 Å²	87	84.7 Å²	84.7	38%	0.382	42%	0.416	S	S	.	.	H	α-helix	trans	-52.9	-50.1	175.8	179.8	-89.1	0	0	0	111.5	L72 F146 V147 T153 M154	L72-F150 HydrophobicContact CD1-CD2 3.36Å; L72-F150 HydrophobicContact CD1-CE2 3.72Å; L72-F150 HydrophobicContact CD1-CG 4.37Å; L72-F150 HydrophobicContact CD2-CB 4.16Å; L72-F150 HydrophobicContact CD2-CD2 4.11Å; L72-F150 HydrophobicContact CG-CD2 4.31Å; F146-F150 WeakPolarHBondContact O-CB 3.44Å; F146-F150 PolarHBondContact O-N 2.81Å; V147-F150 PolarHBondContact O-N 2.96Å; F150-T153 PolarHBondContact O-N 3.16Å; F150-T153 PolarHBondContact O-OG1 3.43Å; F150-M154 HydrophobicContact CD1-CG 4.2Å; F150-M154 HydrophobicContact CD2-CG 4.29Å; F150-M154 HydrophobicContact CE1-CG 3.88Å; F150-M154 HydrophobicContact CE2-CG 3.96Å; F150-M154 HydrophobicContact CG-CG 4.38Å; F150-M154 HydrophobicContact CZ-CG 3.74Å; F150-M154 VanDerWaalsContact O-CB 3.23Å; F150-M154 WeakPolarHBondContact O-CB 3.4Å; F150-M154 VanDerWaalsContact O-CG 3.23Å; F150-M154 WeakPolarHBondContact O-CG 3.48Å; F150-M154 PolarHBondContact O-N 2.97Å
151	Y	96.6	Very high	92.3	Very high	135 Å²	135	84 Å²	84	53%	0.529	41%	0.409	S	S	.	.	H	α-helix	trans	-61.3	-49.5	179.5	175.1	-105.5	0	0	0	111.8	V147 L148 L149 T153 M154 K155	V147-Y151 WeakPolarHBondContact O-CB 3.39Å; V147-Y151 PolarHBondContact O-N 3.17Å; L148-Y151 PolarHBondContact O-N 3.05Å; L149-Y151 VanDerWaalsContact C-N 3.33Å; L149-Y151 PolarHBondContact O-N 2.89Å; Y151-T153 PolarHBondContact O-N 3.31Å; Y151-M154 PolarHBondContact O-N 2.83Å; Y151-K155 HydrophobicContact CE1-CD 4.17Å; Y151-K155 WeakPolarHBondContact O-CB 3.29Å; Y151-K155 PolarHBondContact O-N 3.15Å
152	V	95.6	Very high	91.5	Very high	82 Å²	82	84.1 Å²	84.1	50%	0.497	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-46	179.8	171.2	0	0	0	0	110.9	L148 L149 R156	L148-V152 WeakPolarHBondContact O-CG2 3.44Å; L148-V152 PolarHBondContact O-N 3.49Å; L149-V152 PolarHBondContact O-N 3.25Å; V152-R156 WeakPolarHBondContact O-CB 3.4Å; V152-R156 PolarHBondContact O-N 3.5Å
153	T	92.8	Very high	90.9	Very high	34 Å²	34	90 Å²	90	21%	0.209	43%	0.434	C	S	.	.	H	α-helix	trans	-65.9	-45.4	-179.5	54.4	0	0	0	0	111.5	I76 L149 F150 Y151 R156 Q157	I76-T153 HydrophobicContact CD1-CG2 4.14Å; L149-T153 HydrophobicContact CD2-CG2 3.78Å; L149-T153 HydrophobicContact CG-CG2 4.33Å; L149-T153 WeakPolarHBondContact O-CB 3.14Å; L149-T153 WeakPolarHBondContact O-CG2 3.49Å; L149-T153 PolarHBondContact O-N 3.02Å; L149-T153 PolarHBondContact O-OG1 3.34Å; F150-T153 PolarHBondContact O-N 3.16Å; F150-T153 PolarHBondContact O-OG1 3.43Å; Y151-T153 PolarHBondContact O-N 3.31Å; T153-R156 PolarHBondContact O-N 2.8Å; T153-Q157 VanDerWaalsContact O-CG 3.29Å; T153-Q157 WeakPolarHBondContact O-CG 3.46Å; T153-Q157 PolarHBondContact O-N 3.3Å
154	M	91.9	Very high	90	Very high	29 Å²	29	91 Å²	91	14%	0.143	43%	0.43	C	S	.	.	H	α-helix	trans	-67.8	-42.4	-179.9	-72.7	-59.7	-61.4	0	0	111.7	L75 L79 F150 Y151 R156 Q157 I158	L75-M154 HydrophobicContact CD2-CE 4.19Å; L75-M154 HydrophobicContact CD2-SD 3.59Å; L75-M154 VanDerWaalsContact CD2-SD 3.59Å; L79-M154 HydrophobicContact CD1-CE 3.58Å; L79-M154 HydrophobicContact CD1-SD 4.07Å; F150-M154 HydrophobicContact CD1-CG 4.2Å; F150-M154 HydrophobicContact CD2-CG 4.29Å; F150-M154 HydrophobicContact CE1-CG 3.88Å; F150-M154 HydrophobicContact CE2-CG 3.96Å; F150-M154 HydrophobicContact CG-CG 4.38Å; F150-M154 HydrophobicContact CZ-CG 3.74Å; F150-M154 VanDerWaalsContact O-CB 3.23Å; F150-M154 WeakPolarHBondContact O-CB 3.4Å; F150-M154 VanDerWaalsContact O-CG 3.23Å; F150-M154 WeakPolarHBondContact O-CG 3.48Å; F150-M154 PolarHBondContact O-N 2.97Å; Y151-M154 PolarHBondContact O-N 2.83Å; M154-R156 VanDerWaalsContact C-N 3.31Å; M154-R156 PolarHBondContact O-N 2.8Å; M154-Q157 PolarHBondContact O-N 3.39Å; M154-I158 HydrophobicContact CE-CD1 4.26Å; M154-I158 WeakPolarHBondContact O-CB 3.3Å; M154-I158 VanDerWaalsContact O-CG1 3.26Å; M154-I158 WeakPolarHBondContact O-CG1 3.28Å; M154-I158 PolarHBondContact O-N 3.33Å
155	K	91.9	Very high	88.6	Confident	123 Å²	123	94.3 Å²	94.3	54%	0.535	44%	0.435	S	S	.	.	H	α-helix	trans	-58.2	-44.6	175	-177.8	177.5	-180	177.7	0	111.3	Y151 S159	Y151-K155 HydrophobicContact CE1-CD 4.17Å; Y151-K155 WeakPolarHBondContact O-CB 3.29Å; Y151-K155 PolarHBondContact O-N 3.15Å; K155-S159 WeakPolarHBondContact O-CB 3.42Å; K155-S159 PolarHBondContact O-N 2.73Å
156	R	88.3	Confident	87.2	Confident	196 Å²	196	89.9 Å²	89.9	74%	0.74	42%	0.417	S	S	*	.	H	α-helix	trans	-62.2	-46.4	176.8	-177.2	177.3	178	178.7	0.1	111.6	V152 T153 M154 S159 H160	V152-R156 WeakPolarHBondContact O-CB 3.4Å; V152-R156 PolarHBondContact O-N 3.5Å; T153-R156 PolarHBondContact O-N 2.8Å; M154-R156 VanDerWaalsContact C-N 3.31Å; M154-R156 PolarHBondContact O-N 2.8Å; R156-S159 PolarHBondContact O-N 3.2Å; R156-H160 WeakPolarHBondContact O-CB 3.48Å; R156-H160 PolarHBondContact O-N 2.83Å
157	Q	87	Confident	85.6	Confident	39 Å²	39	91.3 Å²	91.3	18%	0.182	43%	0.427	C	S	.	.	H	α-helix	trans	-64.8	-46.6	-179.8	-69.5	-58.5	-23.8	0	0	112	I76 T153 M154 S159 H160 M161	I76-Q157 HydrophobicContact CG1-CG 4.32Å; I76-Q157 HydrophobicContact CG2-CG 3.8Å; T153-Q157 VanDerWaalsContact O-CG 3.29Å; T153-Q157 WeakPolarHBondContact O-CG 3.46Å; T153-Q157 PolarHBondContact O-N 3.3Å; M154-Q157 PolarHBondContact O-N 3.39Å; Q157-S159 PolarHBondContact O-N 3.4Å; Q157-H160 PolarHBondContact O-N 2.92Å; Q157-M161 VanDerWaalsContact O-CG 3.31Å; Q157-M161 WeakPolarHBondContact O-CG 3.33Å; Q157-M161 PolarHBondContact O-N 3.09Å
158	I	86.9	Confident	83.9	Confident	84 Å²	84	92.7 Å²	92.7	43%	0.431	44%	0.438	S	S	.	.	H	α-helix	trans	-62.9	-43.9	177.7	-66.7	166.2	0	0	0	110.6	M154 H160 M161 I162	M154-I158 HydrophobicContact CE-CD1 4.26Å; M154-I158 WeakPolarHBondContact O-CB 3.3Å; M154-I158 VanDerWaalsContact O-CG1 3.26Å; M154-I158 WeakPolarHBondContact O-CG1 3.28Å; M154-I158 PolarHBondContact O-N 3.33Å; I158-H160 VanDerWaalsContact C-N 3.35Å; I158-H160 PolarHBondContact O-N 3.08Å; I158-M161 PolarHBondContact O-N 3.37Å; I158-M161 VanDerWaalsContact O-N 3.17Å; I158-I162 HydrophobicContact CG2-CD1 3.58Å; I158-I162 HydrophobicContact CG2-CG1 4.22Å; I158-I162 WeakPolarHBondContact O-CB 3.05Å; I158-I162 VanDerWaalsContact O-CG1 3.27Å; I158-I162 WeakPolarHBondContact O-CG1 3.5Å; I158-I162 PolarHBondContact O-N 2.94Å
159	S	86.8	Confident	82.1	Confident	73 Å²	73	94.8 Å²	94.8	51%	0.51	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-43.7	177.2	-178.5	0	0	0	0	112.3	K155 R156 Q157 I162 K163	K155-S159 WeakPolarHBondContact O-CB 3.42Å; K155-S159 PolarHBondContact O-N 2.73Å; R156-S159 PolarHBondContact O-N 3.2Å; Q157-S159 PolarHBondContact O-N 3.4Å; S159-I162 PolarHBondContact O-N 3.17Å; S159-K163 WeakPolarHBondContact O-CB 3.4Å; S159-K163 PolarHBondContact O-N 3.07Å
160	H	82.2	Confident	80.2	Confident	71 Å²	71	97 Å²	97	33%	0.329	46%	0.458	S	S	.	.	H	α-helix	trans	-62.4	-45	173.9	-176.1	-88.8	0	0	0	111.5	R156 Q157 I158 I162 K163 Y164 Y166	R156-H160 WeakPolarHBondContact O-CB 3.48Å; R156-H160 PolarHBondContact O-N 2.83Å; Q157-H160 PolarHBondContact O-N 2.92Å; I158-H160 VanDerWaalsContact C-N 3.35Å; I158-H160 PolarHBondContact O-N 3.08Å; H160-I162 VanDerWaalsContact C-N 3.34Å; H160-I162 PolarHBondContact O-N 3.45Å; H160-K163 PolarHBondContact O-N 3.19Å; H160-Y164 AromaticContact CD2-CD2 3.81Å; H160-Y164 AromaticContact CD2-CE2 3.58Å; H160-Y164 AromaticContact CE1-CD2 3.72Å; H160-Y164 AromaticContact CE1-CE2 3.96Å; H160-Y164 AromaticContact NE2-CD2 3.54Å; H160-Y164 AromaticContact NE2-CE2 3.31Å; H160-Y164 VanDerWaalsContact NE2-CE2 3.31Å; H160-Y164 WeakPolarHBondContact NE2-CE2 3.5Å; H160-Y164 WeakPolarHBondContact O-CD2 3.3Å; H160-Y164 PolarHBondContact O-N 3.49Å; H160-Y166 AromaticContact CE1-CE2 4Å
161	M	81.2	Confident	78	Confident	32 Å²	32	102.5 Å²	102.5	16%	0.158	48%	0.477	C	S	.	.	H	α-helix	trans	-61.2	-42.1	178.7	-71.4	-174.7	99.3	0	0	112.3	L79 Q157 I158 R165 Y166	L79-M161 HydrophobicContact CB-SD 4.38Å; L79-M161 WeakPolarHBondContact O-CE 3.47Å; Q157-M161 VanDerWaalsContact O-CG 3.31Å; Q157-M161 WeakPolarHBondContact O-CG 3.33Å; Q157-M161 PolarHBondContact O-N 3.09Å; I158-M161 PolarHBondContact O-N 3.37Å; I158-M161 VanDerWaalsContact O-N 3.17Å; M161-R165 PolarHBondContact O-N 2.97Å; M161-Y166 PolarHBondContact O-N 3Å
162	I	79.9	Confident	75.9	Confident	113 Å²	113	99.2 Å²	99.2	58%	0.579	49%	0.485	S	S	*	.	H	α-helix	trans	-67.4	-45.6	177.2	-67.4	169.3	0	0	0	111.1	I158 S159 H160 Y164 R165	I158-I162 HydrophobicContact CG2-CD1 3.58Å; I158-I162 HydrophobicContact CG2-CG1 4.22Å; I158-I162 WeakPolarHBondContact O-CB 3.05Å; I158-I162 VanDerWaalsContact O-CG1 3.27Å; I158-I162 WeakPolarHBondContact O-CG1 3.5Å; I158-I162 PolarHBondContact O-N 2.94Å; S159-I162 PolarHBondContact O-N 3.17Å; H160-I162 VanDerWaalsContact C-N 3.34Å; H160-I162 PolarHBondContact O-N 3.45Å; I162-Y164 VanDerWaalsContact C-N 3.28Å; I162-Y164 PolarHBondContact O-N 2.75Å; I162-R165 PolarHBondContact O-N 2.92Å
163	K	80.3	Confident	73.6	Confident	155 Å²	155	101.6 Å²	101.6	67%	0.674	49%	0.488	S	S	*	.	H	α-helix	trans	-56.6	-42.8	-178.1	-179	177.2	179.8	-176.4	0	112.2	S159 H160	S159-K163 WeakPolarHBondContact O-CB 3.4Å; S159-K163 PolarHBondContact O-N 3.07Å; H160-K163 PolarHBondContact O-N 3.19Å
164	Y	75	Confident	71.6	Confident	101 Å²	101	104.8 Å²	104.8	40%	0.396	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	14	-179.2	-70.7	-80.9	0	0	0	113.1	P85 H160 I162 Y166	P85-Y164 HydrophobicContact CB-CE1 4.27Å; P85-Y164 HydrophobicContact CG-CD1 4.16Å; P85-Y164 HydrophobicContact CG-CE1 3.68Å; H160-Y164 AromaticContact CD2-CD2 3.81Å; H160-Y164 AromaticContact CD2-CE2 3.58Å; H160-Y164 AromaticContact CE1-CD2 3.72Å; H160-Y164 AromaticContact CE1-CE2 3.96Å; H160-Y164 AromaticContact NE2-CD2 3.54Å; H160-Y164 AromaticContact NE2-CE2 3.31Å; H160-Y164 VanDerWaalsContact NE2-CE2 3.31Å; H160-Y164 WeakPolarHBondContact NE2-CE2 3.5Å; H160-Y164 WeakPolarHBondContact O-CD2 3.3Å; H160-Y164 PolarHBondContact O-N 3.49Å; I162-Y164 VanDerWaalsContact C-N 3.28Å; I162-Y164 PolarHBondContact O-N 2.75Å; Y164-Y166 VanDerWaalsContact CB-CD2 3.48Å; Y164-Y166 HydrophobicContact CD2-CE2 4.19Å; Y164-Y166 AromaticContact CG-CE2 3.84Å; Y164-Y166 HydrophobicContact CG-CE2 3.84Å; Y164-Y166 PolarHBondContact O-N 3.47Å; Y164-Y166 VanDerWaalsContact O-N 3.14Å
165	R	68.1	Low	69.7	Low	210 Å²	210	114.5 Å²	114.5	79%	0.792	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	39.9	175.1	-63.4	-71.9	-169.5	166.8	1.2	113.3	M161 I162 L167	M161-R165 PolarHBondContact O-N 2.97Å; I162-R165 PolarHBondContact O-N 2.92Å; R165-L167 PolarHBondContact O-N 3.39Å
166	Y	66.5	Low	67.9	Low	32 Å²	32	117.9 Å²	117.9	13%	0.125	56%	0.562	C	S	.	*			trans	-72.3	118.2	173	-63.6	-83.5	0	0	0	109	P81 I83 F104 H160 M161 Y164 P168	P81-Y166 HydrophobicContact CB-CD1 3.76Å; P81-Y166 HydrophobicContact CB-CE1 3.68Å; P81-Y166 HydrophobicContact CB-CG 4.38Å; P81-Y166 HydrophobicContact CG-CD1 3.99Å; P81-Y166 HydrophobicContact CG-CD2 4.15Å; P81-Y166 HydrophobicContact CG-CE1 3.78Å; P81-Y166 HydrophobicContact CG-CE2 3.81Å; P81-Y166 HydrophobicContact CG-CG 4.23Å; I83-Y166 PolarHBondContact O-OH 3.24Å; F104-Y166 AromaticContact CD1-CD1 3.92Å; F104-Y166 HydrophobicContact CD1-CD1 3.92Å; F104-Y166 VanDerWaalsContact CE1-CA 3.45Å; F104-Y166 AromaticContact CE1-CD1 3.6Å; F104-Y166 HydrophobicContact CE1-CD1 3.6Å; F104-Y166 HydrophobicContact CE1-CG 4.14Å; H160-Y166 AromaticContact CE1-CE2 4Å; M161-Y166 PolarHBondContact O-N 3Å; Y164-Y166 VanDerWaalsContact CB-CD2 3.48Å; Y164-Y166 HydrophobicContact CD2-CE2 4.19Å; Y164-Y166 AromaticContact CG-CE2 3.84Å; Y164-Y166 HydrophobicContact CG-CE2 3.84Å; Y164-Y166 PolarHBondContact O-N 3.47Å; Y164-Y166 VanDerWaalsContact O-N 3.14Å; Y166-P168 WeakPolarHBondContact O-CD 3.45Å
167	L	62.5	Low	66.3	Low	88 Å²	88	117.2 Å²	117.2	46%	0.461	57%	0.567	S	S	.	*			trans	-82.8	116.1	170.7	-64.1	96.9	0	0	0	109.1	F104 R165 F169	F104-L167 HydrophobicContact CD2-CB 4.23Å; F104-L167 WeakPolarHBondContact CD2-O 3.18Å; F104-L167 HydrophobicContact CE2-CB 3.5Å; F104-L167 HydrophobicContact CE2-CD1 3.93Å; F104-L167 HydrophobicContact CE2-CG 4.34Å; F104-L167 WeakPolarHBondContact CE2-O 3.23Å; F104-L167 WeakPolarHBondContact CG-O 3.28Å; F104-L167 HydrophobicContact CZ-CB 3.95Å; F104-L167 HydrophobicContact CZ-CD1 3.92Å; R165-L167 PolarHBondContact O-N 3.39Å; L167-F169 PolarHBondContact O-N 2.93Å
168	P	61.1	Low	64.5	Low	113 Å²	113	120.7 Å²	120.7	73%	0.734	60%	0.596	S	S	*	*	S	Bend	trans	-67.5	-22.5	177.5	27.5	-34.5	0	0	0	112.5	Y166	Y166-P168 WeakPolarHBondContact O-CD 3.45Å
169	F	59	Low	63	Low	153 Å²	153	124 Å²	124	67%	0.671	61%	0.614	S	S	*	*	S	Bend	trans	-123.1	134.9	-175.9	-125	-95.7	0	0	0	109.5	L167 Y171	L167-F169 PolarHBondContact O-N 2.93Å; F169-Y171 HydrophobicContact CD1-CD2 4.17Å; F169-Y171 PolarHBondContact O-N 2.87Å
170	T	55.3	Low	61.5	Low	88 Å²	88	123 Å²	123	54%	0.54	62%	0.616	S	S	.	*			trans	-66.1	22.8	-178.7	-11.6	0	0	0	0	114.6	F101 G172 K173	F101-T170 HydrophobicContact CZ-CG2 4.06Å; T170-G172 PolarHBondContact O-N 2.66Å; T170-G172 VanDerWaalsContact O-N 3.11Å; T170-K173 HydrophobicContact CG2-CD 4.41Å; T170-K173 HydrophobicContact CG2-CG 4.32Å
171	Y	48.9	Very low	60.1	Low	202 Å²	202	128 Å²	128	79%	0.792	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	107.8	175.2	-117.8	-92.5	0	0	0	108.3	F169	F169-Y171 HydrophobicContact CD1-CD2 4.17Å; F169-Y171 PolarHBondContact O-N 2.87Å
172	G	52.8	Low	58.7	Low	66 Å²	66	136.3 Å²	136.3	68%	0.68	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	122.3	15.2	176.9	0	0	0	0	0	116.4	T170 P174	T170-G172 PolarHBondContact O-N 2.66Å; T170-G172 VanDerWaalsContact O-N 3.11Å; G172-P174 WeakPolarHBondContact O-CD 3.31Å
173	K	48	Very low	57.8	Low	131 Å²	131	144 Å²	144	57%	0.57	71%	0.706	S	S	*	*			trans	-51.6	116	163.5	-88.6	-180	177.3	-176.6	0	108.8	F101 T170 R175	F101-K173 HydrophobicContact CE1-CG 4.24Å; F101-K173 HydrophobicContact CE2-CG 3.66Å; F101-K173 HydrophobicContact CZ-CD 4.11Å; F101-K173 HydrophobicContact CZ-CG 3.41Å; F101-K173 VanDerWaalsContact CZ-CG 3.41Å; T170-K173 HydrophobicContact CG2-CD 4.41Å; T170-K173 HydrophobicContact CG2-CG 4.32Å; K173-R175 PolarHBondContact O-N 3.2Å
174	P	50.8	Low	56.6	Low	101 Å²	101	143.5 Å²	143.5	66%	0.656	71%	0.708	S	S	*	*			trans	-62.8	114.4	167.7	16.9	-15.7	0	0	0	106.4	G172 H176	G172-P174 WeakPolarHBondContact O-CD 3.31Å; P174-H176 PolarHBondContact O-N 2.75Å; P174-H176 VanDerWaalsContact O-N 3.17Å
175	R	52.2	Low	55.7	Low	234 Å²	234	145.7 Å²	145.7	88%	0.883	72%	0.724	S	S	*	*			trans	-63.5	118.7	171	-63.9	176.6	77.3	155.5	1.6	104.7	K173 Q177	K173-R175 PolarHBondContact O-N 3.2Å; R175-Q177 VanDerWaalsContact C-N 3.32Å; R175-Q177 PolarHBondContact O-N 3.44Å
176	H	53.9	Low	55	Low	194 Å²	194	142.1 Å²	142.1	90%	0.898	72%	0.721	S	S	*	*			trans	-53.9	105.1	168.9	-81.9	80.6	0	0	0	106.6	P174 S178	P174-H176 PolarHBondContact O-N 2.75Å; P174-H176 VanDerWaalsContact O-N 3.17Å; H176-S178 VanDerWaalsContact C-N 3.27Å; H176-S178 PolarHBondContact O-N 3.49Å
177	Q	53.8	Low	54.3	Low	182 Å²	182	148.6 Å²	148.6	85%	0.85	76%	0.756	S	S	*	*			trans	-70.4	99.2	169.9	-160	169.9	12.3	0	0	103.5	R175 N179	R175-Q177 VanDerWaalsContact C-N 3.32Å; R175-Q177 PolarHBondContact O-N 3.44Å; Q177-N179 VanDerWaalsContact C-N 3.26Å; Q177-N179 PolarHBondContact O-N 3.45Å
178	S	50.2	Low	53.8	Low	112 Å²	112	152.4 Å²	152.4	78%	0.783	77%	0.774	S	S	*	*			trans	-53.8	102.6	167.7	174	0	0	0	0	105.2	H176 G180	H176-S178 VanDerWaalsContact C-N 3.27Å; H176-S178 PolarHBondContact O-N 3.49Å; S178-G180 PolarHBondContact O-N 3.04Å
179	N	54.3	Low	53.3	Low	152 Å²	152	155 Å²	155	81%	0.813	78%	0.777	S	S	*	*			trans	-70.4	89.7	176.4	-155.8	24	0	0	0	104.2	Q177 M181	Q177-N179 VanDerWaalsContact C-N 3.26Å; Q177-N179 PolarHBondContact O-N 3.45Å; N179-M181 PolarHBondContact O-N 3.35Å
180	G	55.8	Low	52.9	Low	53 Å²	53	155.1 Å²	155.1	55%	0.546	78%	0.784	S	S	.	*			trans	-52.6	111.4	176.8	0	0	0	0	0	106.9	S178 K182	S178-G180 PolarHBondContact O-N 3.04Å; G180-K182 VanDerWaalsContact C-N 3.35Å; G180-K182 PolarHBondContact O-N 2.93Å
181	M	53.1	Low	52.7	Low	175 Å²	175	160.3 Å²	160.3	86%	0.862	80%	0.803	S	S	*	*			trans	-51.8	104.4	167.9	-108.7	172.7	-86.8	0	0	106.4	N179 F183	N179-M181 PolarHBondContact O-N 3.35Å; M181-F183 PolarHBondContact O-N 3.44Å
182	K	51.5	Low	53	Low	207 Å²	207	156.8 Å²	156.8	90%	0.9	80%	0.804	S	S	*	*			trans	-71.8	117.9	164.6	-88.6	-172.5	170.9	-174.9	0	106.2	G180	G180-K182 VanDerWaalsContact C-N 3.35Å; G180-K182 PolarHBondContact O-N 2.93Å
183	F	59.8	Low	53	Low	275 Å²	275	165.1 Å²	165.1	100%	1.206	82%	0.815	S	S	*	*			trans	-60.1	0	165.8	-68.5	-88.3	0	0	0	110.9	M181	M181-F183 PolarHBondContact O-N 3.44Å

Retrieved 183 of 183 residues in 246 ms (Link to these results)

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