A0A3Q0KI24_SCHMA Loading...

Dymeclin

AlphaFold DB , UniProt , Accession A0A3Q0KI24, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 787 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	28.4	Very low	32.4	Very low	253 Å²	253	104.3 Å²	104.3	100%	1.246	61%	0.61	S	S	*	*				0	115.9	0	-64.7	-169.8	-169.7	0	0	107.5
2	G	31.3	Very low	33.5	Very low	72 Å²	72	101.3 Å²	101.3	74%	0.742	60%	0.599	S	S	*	*			trans	136.6	-16.3	170.6	0	0	0	0	0	118.5
3	S	28.8	Very low	34.8	Very low	97 Å²	97	104.7 Å²	104.7	68%	0.678	60%	0.601	S	S	*	*	S	Bend	trans	-98.4	-7.1	-172.7	53.7	0	0	0	0	116.2	S6	S3-S6 PolarHBondContact O-OG 3.27Å
4	S	30	Very low	37	Very low	93 Å²	93	99.8 Å²	99.8	65%	0.65	57%	0.572	S	S	*	*	S	Bend	trans	-91.6	-20.1	-174.8	-43.9	0	0	0	0	114.2
5	Y	25.5	Very low	39.7	Very low	197 Å²	197	103.8 Å²	103.8	77%	0.773	58%	0.584	S	S	*	*	H	α-helix	trans	-83.2	-23.8	-179.9	-93	-87.5	0	0	0	113.4	T7	Y5-T7 PolarHBondContact O-N 3.2Å
6	S	28.7	Very low	42.3	Very low	76 Å²	76	99.1 Å²	99.1	53%	0.531	56%	0.559	S	S	.	*	H	α-helix	trans	-73.7	-22.9	-172.6	55.8	0	0	0	0	114.2	S3	S3-S6 PolarHBondContact O-OG 3.27Å
7	T	33	Very low	44.6	Very low	98 Å²	98	93.9 Å²	93.9	60%	0.601	53%	0.53	S	S	*	.	H	α-helix	trans	-82.9	-33.1	-180	-6.2	0	0	0	0	112.4	Y5 N10	Y5-T7 PolarHBondContact O-N 3.2Å; T7-N10 PolarHBondContact O-N 3.14Å
8	L	31.1	Very low	46.8	Very low	51 Å²	51	92.4 Å²	92.4	27%	0.267	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-37.4	176	-97.4	84.1	0	0	0	113.1	N10 V11 D51	L8-N10 PolarHBondContact O-N 3.2Å; L8-V11 PolarHBondContact O-N 3.11Å; L8-D51 HydrophobicContact CD1-CB 4.41Å; L8-D51 WeakPolarHBondContact CD1-OD2 3.46Å; L8-D51 HydrophobicContact CD2-CB 3.48Å; L8-D51 VanDerWaalsContact CD2-CB 3.48Å; L8-D51 WeakPolarHBondContact CD2-OD1 3.48Å; L8-D51 HydrophobicContact CG-CB 3.78Å
9	V	33	Very low	49	Very low	97 Å²	97	94.4 Å²	94.4	59%	0.588	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-12.2	179.5	176.4	0	0	0	0	111.9	S12	V9-S12 PolarHBondContact O-OG 3.04Å
10	N	40.5	Very low	51.1	Low	78 Å²	78	89.8 Å²	89.8	42%	0.417	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-5.7	-179.5	-81.6	-17.4	0	0	0	115.4	T7 L8 S12 K13	T7-N10 PolarHBondContact O-N 3.14Å; L8-N10 PolarHBondContact O-N 3.2Å; N10-S12 PolarHBondContact O-N 3.41Å; N10-K13 WeakPolarHBondContact O-CA 3.48Å; N10-K13 WeakPolarHBondContact O-CB 3.26Å; N10-K13 PolarHBondContact O-N 2.83Å; N10-K13 WeakPolarHBondContact OD1-CD 3.15Å; N10-K13 PolarHBondContact OD1-NZ 2.78Å
11	V	45.9	Very low	53	Low	35 Å²	35	85.7 Å²	85.7	21%	0.212	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-65.3	-32.6	174.1	179.6	0	0	0	0	111	L8 K13 D14 L17 L59	L8-V11 PolarHBondContact O-N 3.11Å; V11-K13 PolarHBondContact O-N 3.06Å; V11-K13 VanDerWaalsContact O-N 3.12Å; V11-D14 WeakPolarHBondContact O-CB 3.48Å; V11-D14 PolarHBondContact O-N 3.45Å; V11-D14 VanDerWaalsContact O-N 3.15Å; V11-L17 HydrophobicContact CG1-CD2 4.18Å; V11-L59 HydrophobicContact CG1-CD1 4.41Å
12	S	45.5	Very low	56	Low	68 Å²	68	74.6 Å²	74.6	48%	0.476	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-65.2	-10	171.6	57.6	0	0	0	0	113.8	V9 N10 Q18	V9-S12 PolarHBondContact O-OG 3.04Å; N10-S12 PolarHBondContact O-N 3.41Å; S12-Q18 PolarHBondContact O-NE2 3.48Å
13	K	50.6	Low	59	Low	146 Å²	146	74.1 Å²	74.1	64%	0.635	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-103.2	3.4	175.8	-60.7	-172.7	-173.9	162.7	0	114	N10 V11 E15	N10-K13 WeakPolarHBondContact O-CA 3.48Å; N10-K13 WeakPolarHBondContact O-CB 3.26Å; N10-K13 PolarHBondContact O-N 2.83Å; N10-K13 WeakPolarHBondContact OD1-CD 3.15Å; N10-K13 PolarHBondContact OD1-NZ 2.78Å; V11-K13 PolarHBondContact O-N 3.06Å; V11-K13 VanDerWaalsContact O-N 3.12Å; K13-E15 VanDerWaalsContact C-N 3.33Å; K13-E15 PolarHBondContact O-N 3.21Å
14	D	66.1	Low	62.1	Low	36 Å²	36	74.9 Å²	74.9	19%	0.193	40%	0.398	C	S	.	.			trans	-70.7	92.9	174.1	-168.4	-12.9	0	0	0	108.7	V11 P16 L17 Q18	V11-D14 WeakPolarHBondContact O-CB 3.48Å; V11-D14 PolarHBondContact O-N 3.45Å; V11-D14 VanDerWaalsContact O-N 3.15Å; D14-P16 VanDerWaalsContact C-N 3.33Å; D14-P16 WeakPolarHBondContact OD1-CD 3.31Å; D14-L17 HydrophobicContact CB-CB 4Å; D14-L17 PolarHBondContact O-N 3.4Å; D14-Q18 PolarHBondContact O-N 2.98Å
15	E	76.5	Confident	65.1	Low	160 Å²	160	73.1 Å²	73.1	75%	0.748	40%	0.395	S	S	*	.	H	α-helix	trans	-52.1	-45	-175.8	174.8	-179.8	-172.2	0	0	112.4	K13 L17 Q18 R19	K13-E15 VanDerWaalsContact C-N 3.33Å; K13-E15 PolarHBondContact O-N 3.21Å; E15-L17 PolarHBondContact O-N 3.41Å; E15-Q18 PolarHBondContact O-N 3.47Å; E15-R19 WeakPolarHBondContact O-CB 3.33Å; E15-R19 PolarHBondContact O-N 2.82Å
16	P	81.2	Confident	68.4	Low	29 Å²	29	63.9 Å²	63.9	19%	0.188	36%	0.359	C	S	.	.	H	α-helix	trans	-51.8	-54.1	168.5	-30	32.6	0	0	0	113.8	D14 Q18 R19 F20 Y32 F36	D14-P16 VanDerWaalsContact C-N 3.33Å; D14-P16 WeakPolarHBondContact OD1-CD 3.31Å; P16-Q18 VanDerWaalsContact C-N 3.33Å; P16-Q18 PolarHBondContact O-N 3.17Å; P16-R19 WeakPolarHBondContact O-CB 3.42Å; P16-R19 PolarHBondContact O-N 3.47Å; P16-R19 VanDerWaalsContact O-N 3.15Å; P16-F20 PolarHBondContact O-N 3.01Å; P16-F20 VanDerWaalsContact O-N 3.11Å; P16-Y32 HydrophobicContact CB-CE2 4.36Å; P16-Y32 PolarHBondContact O-OH 3.06Å; P16-F36 HydrophobicContact CB-CB 4.18Å; P16-F36 HydrophobicContact CB-CD2 3.51Å; P16-F36 HydrophobicContact CB-CE2 4.29Å; P16-F36 HydrophobicContact CB-CG 4.17Å
17	L	82.5	Confident	71.5	Confident	11 Å²	11	63.4 Å²	63.4	6%	0.058	36%	0.355	C	S	.	.	H	α-helix	trans	-63.8	-38.5	-177.8	-175.5	60.7	0	0	0	112.2	V11 D14 E15 R19 F20 V21 F36 F52 L59	V11-L17 HydrophobicContact CG1-CD2 4.18Å; D14-L17 HydrophobicContact CB-CB 4Å; D14-L17 PolarHBondContact O-N 3.4Å; E15-L17 PolarHBondContact O-N 3.41Å; L17-R19 VanDerWaalsContact C-N 3.31Å; L17-R19 PolarHBondContact O-N 2.78Å; L17-F20 HydrophobicContact CD1-CD1 4.41Å; L17-F20 WeakPolarHBondContact O-CB 3.49Å; L17-F20 PolarHBondContact O-N 3.35Å; L17-V21 PolarHBondContact O-N 3.19Å; L17-V21 VanDerWaalsContact O-N 3.14Å; L17-F36 HydrophobicContact CB-CE2 4.07Å; L17-F36 HydrophobicContact CD1-CE2 4.06Å; L17-F36 HydrophobicContact CD1-CZ 3.74Å; L17-F52 HydrophobicContact CD2-CE2 4.25Å; L17-F52 HydrophobicContact CD2-CZ 4.42Å; L17-L59 HydrophobicContact CD2-CD1 3.71Å; L17-L59 HydrophobicContact CG-CD1 4.28Å
18	Q	83.9	Confident	74.3	Confident	67 Å²	67	59.7 Å²	59.7	31%	0.313	33%	0.333	S	S	.	.	H	α-helix	trans	-60.7	-40.7	174.5	-74.2	-66.3	-4.9	0	0	112	S12 D14 E15 P16 F20 V21 G22	S12-Q18 PolarHBondContact O-NE2 3.48Å; D14-Q18 PolarHBondContact O-N 2.98Å; E15-Q18 PolarHBondContact O-N 3.47Å; P16-Q18 VanDerWaalsContact C-N 3.33Å; P16-Q18 PolarHBondContact O-N 3.17Å; Q18-F20 VanDerWaalsContact C-N 3.33Å; Q18-F20 PolarHBondContact O-N 3.08Å; Q18-V21 WeakPolarHBondContact O-CG2 3.43Å; Q18-V21 PolarHBondContact O-N 2.98Å; Q18-G22 PolarHBondContact O-N 3.46Å
19	R	89.2	Confident	77.1	Confident	129 Å²	129	64.3 Å²	64.3	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.7	-170.7	173.7	176.8	-173.4	0.6	112	E15 P16 L17 G22 I26 Y32	E15-R19 WeakPolarHBondContact O-CB 3.33Å; E15-R19 PolarHBondContact O-N 2.82Å; P16-R19 WeakPolarHBondContact O-CB 3.42Å; P16-R19 PolarHBondContact O-N 3.47Å; P16-R19 VanDerWaalsContact O-N 3.15Å; L17-R19 VanDerWaalsContact C-N 3.31Å; L17-R19 PolarHBondContact O-N 2.78Å; R19-G22 PolarHBondContact O-N 3.07Å; R19-I26 HydrophobicContact CG-CD1 4.19Å; R19-Y32 HydrophobicContact CB-CE2 3.95Å; R19-Y32 HydrophobicContact CG-CE2 4.07Å
20	F	90.4	Very high	80	Confident	3 Å²	3	61.4 Å²	61.4	1%	0.013	34%	0.341	C	S	.	.	H	α-helix	trans	-62.1	-44	176	172.7	-113.6	0	0	0	112.3	P16 L17 Q18 G22 Y32 W33 F36 L63 N72 I73 L76 I107	P16-F20 PolarHBondContact O-N 3.01Å; P16-F20 VanDerWaalsContact O-N 3.11Å; L17-F20 HydrophobicContact CD1-CD1 4.41Å; L17-F20 WeakPolarHBondContact O-CB 3.49Å; L17-F20 PolarHBondContact O-N 3.35Å; Q18-F20 VanDerWaalsContact C-N 3.33Å; Q18-F20 PolarHBondContact O-N 3.08Å; F20-G22 VanDerWaalsContact C-N 3.3Å; F20-Y32 WeakPolarHBondContact CB-OH 3.49Å; F20-Y32 PolarHBondContact N-OH 3.28Å; F20-W33 AromaticContact CD2-CH2 3.83Å; F20-W33 HydrophobicContact CD2-CH2 3.83Å; F20-W33 AromaticContact CD2-CZ3 3.72Å; F20-W33 HydrophobicContact CD2-CZ3 3.72Å; F20-W33 HydrophobicContact CE2-CH2 4.06Å; F20-W33 HydrophobicContact CE2-CZ3 4.08Å; F20-F36 HydrophobicContact CB-CE1 4.09Å; F20-F36 HydrophobicContact CB-CZ 4.29Å; F20-F36 HydrophobicContact CG-CE1 4.19Å; F20-L63 HydrophobicContact CD1-CD1 4.24Å; F20-L63 HydrophobicContact CE1-CD1 3.83Å; F20-L63 HydrophobicContact CE1-CD2 3.77Å; F20-L63 HydrophobicContact CE1-CG 4.46Å; F20-L63 HydrophobicContact CZ-CD1 4.02Å; F20-L63 HydrophobicContact CZ-CD2 4.2Å; F20-N72 HydrophobicContact CD2-CB 4.01Å; F20-N72 HydrophobicContact CE2-CB 4.02Å; F20-N72 PolarHBondContact O-ND2 3.19Å; F20-I73 HydrophobicContact CZ-CG1 4.35Å; F20-L76 HydrophobicContact CE2-CB 4.37Å; F20-L76 HydrophobicContact CE2-CD2 3.96Å; F20-L76 HydrophobicContact CZ-CD2 3.99Å; F20-I107 HydrophobicContact CD1-CG2 4.29Å; F20-I107 HydrophobicContact CE1-CG2 3.64Å; F20-I107 HydrophobicContact CZ-CG2 3.93Å
21	V	90.5	Very high	82.5	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.024	36%	0.359	C	S	.	.	H	α-helix	trans	-84.2	-4.4	-180	-52	0	0	0	0	113.8	L17 Q18 L59 D62 L63 N66	L17-V21 PolarHBondContact O-N 3.19Å; L17-V21 VanDerWaalsContact O-N 3.14Å; Q18-V21 WeakPolarHBondContact O-CG2 3.43Å; Q18-V21 PolarHBondContact O-N 2.98Å; V21-L59 HydrophobicContact CG1-CB 4.33Å; V21-L59 WeakPolarHBondContact CG1-O 3.46Å; V21-L59 HydrophobicContact CG2-CD2 3.74Å; V21-D62 HydrophobicContact CG2-CB 4.48Å; V21-L63 HydrophobicContact CB-CB 4.04Å; V21-L63 HydrophobicContact CB-CD1 4.43Å; V21-L63 HydrophobicContact CG1-CB 3.93Å; V21-L63 HydrophobicContact CG1-CD1 4.29Å; V21-N66 WeakPolarHBondContact O-CB 3.4Å; V21-N66 PolarHBondContact O-ND2 3.18Å
22	G	91.9	Very high	84.7	Confident	19 Å²	19	64.6 Å²	64.6	20%	0.196	35%	0.351	C	S	.	.	S	Bend	trans	-75.7	-178.1	-178	0	0	0	0	0	114.6	Q18 R19 F20 N66 S70	Q18-G22 PolarHBondContact O-N 3.46Å; R19-G22 PolarHBondContact O-N 3.07Å; F20-G22 VanDerWaalsContact C-N 3.3Å; G22-N66 WeakPolarHBondContact O-CB 3.44Å; G22-S70 WeakPolarHBondContact O-CB 3.34Å; G22-S70 PolarHBondContact O-OG 3.39Å
23	T	93.7	Very high	87	Confident	63 Å²	63	61.4 Å²	61.4	39%	0.387	33%	0.329	S	S	.	.	S	Bend	trans	-81.4	-19.9	-177.7	50.5	0	0	0	0	113.9	N66 S70	T23-N66 HydrophobicContact CG2-CB 4.25Å; T23-S70 WeakPolarHBondContact O-CB 3.34Å
24	D	93.8	Very high	89	Confident	113 Å²	113	57.7 Å²	57.7	60%	0.604	31%	0.314	S	S	*	.	S	Bend	trans	-82	132.9	-176.3	-62.5	-27	0	0	0	111.3	S70 N72	D24-S70 WeakPolarHBondContact O-CB 3.24Å; D24-N72 PolarHBondContact O-ND2 3.36Å; D24-N72 VanDerWaalsContact O-ND2 3.12Å; D24-N72 PolarHBondContact O-OD1 2.83Å
25	G	93.3	Very high	90	Very high	56 Å²	56	62.4 Å²	62.4	58%	0.577	34%	0.335	S	S	*	.			trans	-76.9	131.8	178.5	0	0	0	0	0	112.8	S70	G25-S70 WeakPolarHBondContact CA-O 3.45Å
26	I	95.1	Very high	90.5	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.015	30%	0.3	C	S	.	.			trans	-106.2	117.3	179.8	-55.8	163	0	0	0	108.4	R19 Y32 W33 N72 N75	R19-I26 HydrophobicContact CG-CD1 4.19Å; I26-Y32 HydrophobicContact CD1-CD1 3.97Å; I26-Y32 HydrophobicContact CD1-CE1 3.54Å; I26-Y32 HydrophobicContact CG2-CD1 3.54Å; I26-Y32 HydrophobicContact CG2-CE1 4.18Å; I26-Y32 HydrophobicContact CG2-CG 4.14Å; I26-W33 HydrophobicContact CB-CH2 4.23Å; I26-W33 HydrophobicContact CB-CZ2 3.7Å; I26-W33 HydrophobicContact CD1-CH2 4.19Å; I26-W33 HydrophobicContact CD1-CZ2 4.49Å; I26-W33 HydrophobicContact CG2-CD2 4.27Å; I26-W33 HydrophobicContact CG2-CH2 4.19Å; I26-W33 HydrophobicContact CG2-CZ2 3.49Å; I26-W33 VanDerWaalsContact CG2-CZ2 3.49Å; I26-N72 PolarHBondContact N-OD1 2.89Å; I26-N75 VanDerWaalsContact O-CB 3.23Å; I26-N75 WeakPolarHBondContact O-CB 3.42Å; I26-N75 PolarHBondContact O-ND2 2.89Å
27	S	93.9	Very high	90.8	Very high	65 Å²	65	53.5 Å²	53.5	46%	0.455	29%	0.291	S	S	.	.			trans	-60.4	142.2	178.6	176.7	0	0	0	0	111.7	N29 S30 W33	S27-N29 PolarHBondContact O-N 3.49Å; S27-N29 VanDerWaalsContact O-N 3.12Å; S27-N29 PolarHBondContact OG-N 3.24Å; S27-S30 WeakPolarHBondContact O-CB 3.45Å; S27-S30 PolarHBondContact O-N 3.1Å; S27-W33 PolarHBondContact O-NE1 3.24Å
28	P	91.3	Very high	90.9	Very high	21 Å²	21	55.7 Å²	55.7	14%	0.136	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.7	175.1	-20.2	27.5	0	0	0	114.1	S30 N75 Q78 F79	P28-S30 VanDerWaalsContact C-N 3.35Å; P28-N75 HydrophobicContact CG-CB 3.97Å; P28-Q78 HydrophobicContact CB-CB 3.88Å; P28-Q78 HydrophobicContact CG-CB 4.02Å; P28-F79 WeakPolarHBondContact O-CD2 2.96Å
29	N	91.5	Very high	90.3	Very high	148 Å²	148	53.8 Å²	53.8	79%	0.791	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	7.1	-179.1	-60.6	-26.4	0	0	0	113.1	S27	S27-N29 PolarHBondContact O-N 3.49Å; S27-N29 VanDerWaalsContact O-N 3.12Å; S27-N29 PolarHBondContact OG-N 3.24Å
30	S	93.1	Very high	89.3	Confident	35 Å²	35	48.8 Å²	48.8	25%	0.245	29%	0.285	C	S	.	.			trans	-69.3	136	-178.4	-172.2	0	0	0	0	111.5	S27 P28 Y32 W33	S27-S30 WeakPolarHBondContact O-CB 3.45Å; S27-S30 PolarHBondContact O-N 3.1Å; P28-S30 VanDerWaalsContact C-N 3.35Å; S30-Y32 PolarHBondContact O-N 3.42Å; S30-Y32 VanDerWaalsContact OG-CB 3.3Å; S30-Y32 WeakPolarHBondContact OG-CB 3.31Å; S30-Y32 PolarHBondContact OG-N 3.39Å; S30-W33 PolarHBondContact O-N 2.88Å
31	E	91.8	Very high	87.5	Confident	170 Å²	170	50.6 Å²	50.6	79%	0.794	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.2	172	-66	-178.7	173.1	0	0	112.4	W33 M34 E35	E31-W33 PolarHBondContact O-N 2.99Å; E31-W33 VanDerWaalsContact O-N 3.11Å; E31-M34 WeakPolarHBondContact O-CB 3.4Å; E31-M34 PolarHBondContact O-N 2.86Å; E31-E35 PolarHBondContact O-N 3.38Å
32	Y	93.7	Very high	85.2	Confident	11 Å²	11	55 Å²	55	4%	0.043	34%	0.336	C	S	.	.	H	α-helix	trans	-47.2	-41.1	174.1	166.1	-89	0	0	0	112.8	P16 R19 F20 I26 S30 M34 E35 F36	P16-Y32 HydrophobicContact CB-CE2 4.36Å; P16-Y32 PolarHBondContact O-OH 3.06Å; R19-Y32 HydrophobicContact CB-CE2 3.95Å; R19-Y32 HydrophobicContact CG-CE2 4.07Å; F20-Y32 WeakPolarHBondContact CB-OH 3.49Å; F20-Y32 PolarHBondContact N-OH 3.28Å; I26-Y32 HydrophobicContact CD1-CD1 3.97Å; I26-Y32 HydrophobicContact CD1-CE1 3.54Å; I26-Y32 HydrophobicContact CG2-CD1 3.54Å; I26-Y32 HydrophobicContact CG2-CE1 4.18Å; I26-Y32 HydrophobicContact CG2-CG 4.14Å; S30-Y32 PolarHBondContact O-N 3.42Å; S30-Y32 VanDerWaalsContact OG-CB 3.3Å; S30-Y32 WeakPolarHBondContact OG-CB 3.31Å; S30-Y32 PolarHBondContact OG-N 3.39Å; Y32-M34 VanDerWaalsContact C-N 3.29Å; Y32-M34 PolarHBondContact O-N 2.73Å; Y32-E35 PolarHBondContact O-N 2.73Å; Y32-F36 HydrophobicContact CD1-CB 4.43Å; Y32-F36 HydrophobicContact CE1-CB 3.94Å; Y32-F36 AromaticContact CE1-CD1 3.91Å; Y32-F36 HydrophobicContact CE1-CD1 3.91Å; Y32-F36 HydrophobicContact CE1-CG 4.16Å; Y32-F36 HydrophobicContact CE2-CB 4.19Å; Y32-F36 AromaticContact CZ-CG 3.94Å; Y32-F36 WeakPolarHBondContact O-CB 3.16Å; Y32-F36 PolarHBondContact O-N 2.91Å
33	W	94.2	Very high	82.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-37.4	-176.7	-64.5	119	0	0	0	112	F20 I26 S27 S30 E31 F36 L37 N72 N75 L76 F79	F20-W33 AromaticContact CD2-CH2 3.83Å; F20-W33 HydrophobicContact CD2-CH2 3.83Å; F20-W33 AromaticContact CD2-CZ3 3.72Å; F20-W33 HydrophobicContact CD2-CZ3 3.72Å; F20-W33 HydrophobicContact CE2-CH2 4.06Å; F20-W33 HydrophobicContact CE2-CZ3 4.08Å; I26-W33 HydrophobicContact CB-CH2 4.23Å; I26-W33 HydrophobicContact CB-CZ2 3.7Å; I26-W33 HydrophobicContact CD1-CH2 4.19Å; I26-W33 HydrophobicContact CD1-CZ2 4.49Å; I26-W33 HydrophobicContact CG2-CD2 4.27Å; I26-W33 HydrophobicContact CG2-CH2 4.19Å; I26-W33 HydrophobicContact CG2-CZ2 3.49Å; I26-W33 VanDerWaalsContact CG2-CZ2 3.49Å; S27-W33 PolarHBondContact O-NE1 3.24Å; S30-W33 PolarHBondContact O-N 2.88Å; E31-W33 PolarHBondContact O-N 2.99Å; E31-W33 VanDerWaalsContact O-N 3.11Å; W33-F36 HydrophobicContact CE3-CD1 4.32Å; W33-F36 HydrophobicContact CZ3-CD1 4.46Å; W33-L37 VanDerWaalsContact O-CB 3.24Å; W33-L37 WeakPolarHBondContact O-CB 3.39Å; W33-L37 WeakPolarHBondContact O-CG 3.48Å; W33-L37 PolarHBondContact O-N 3.39Å; W33-N72 HydrophobicContact CH2-CB 4.49Å; W33-N75 HydrophobicContact CZ2-CB 4.22Å; W33-L76 HydrophobicContact CE3-CD1 3.9Å; W33-L76 HydrophobicContact CH2-CB 3.84Å; W33-L76 HydrophobicContact CZ2-CB 4.36Å; W33-L76 HydrophobicContact CZ3-CB 4.01Å; W33-L76 HydrophobicContact CZ3-CD1 3.89Å; W33-L76 HydrophobicContact CZ3-CG 4.42Å; W33-F79 HydrophobicContact CB-CD1 3.91Å; W33-F79 HydrophobicContact CB-CD2 3.65Å; W33-F79 HydrophobicContact CB-CE1 3.78Å; W33-F79 HydrophobicContact CB-CE2 3.48Å; W33-F79 VanDerWaalsContact CB-CE2 3.48Å; W33-F79 HydrophobicContact CB-CG 3.85Å; W33-F79 HydrophobicContact CB-CZ 3.54Å; W33-F79 AromaticContact CD1-CD2 3.69Å; W33-F79 AromaticContact CD1-CG 3.87Å; W33-F79 HydrophobicContact CG-CB 4.29Å; W33-F79 HydrophobicContact CG-CD1 4.17Å; W33-F79 AromaticContact CG-CD2 3.84Å; W33-F79 HydrophobicContact CG-CD2 3.84Å; W33-F79 HydrophobicContact CG-CE2 4.19Å; W33-F79 AromaticContact CG-CG 3.82Å; W33-F79 HydrophobicContact CG-CG 3.82Å
34	M	91.6	Very high	79.7	Confident	68 Å²	68	57.3 Å²	57.3	34%	0.335	35%	0.346	S	S	.	.	H	α-helix	trans	-68	-46.4	177.6	-61.5	-69.7	-68.1	0	0	110.2	E31 Y32 S38 F79 K83 I100	E31-M34 WeakPolarHBondContact O-CB 3.4Å; E31-M34 PolarHBondContact O-N 2.86Å; Y32-M34 VanDerWaalsContact C-N 3.29Å; Y32-M34 PolarHBondContact O-N 2.73Å; M34-S38 WeakPolarHBondContact O-CB 3.21Å; M34-S38 PolarHBondContact O-N 2.99Å; M34-S38 PolarHBondContact O-OG 3.24Å; M34-F79 HydrophobicContact CG-CE2 4.39Å; M34-F79 HydrophobicContact CG-CZ 4.37Å; M34-F79 HydrophobicContact SD-CE2 4.09Å; M34-F79 HydrophobicContact SD-CZ 3.76Å; M34-K83 HydrophobicContact SD-CD 4.36Å; M34-I100 HydrophobicContact CE-CD1 3.28Å; M34-I100 HydrophobicContact SD-CD1 3.6Å; M34-I100 HydrophobicContact SD-CG2 4.33Å
35	E	87.8	Confident	76.7	Confident	135 Å²	135	61 Å²	61	63%	0.631	36%	0.357	S	S	*	.	H	α-helix	trans	-61.7	-50.2	178.3	-176.2	-179.3	-173.5	0	0	111.7	E31 Y32 S38 S39	E31-E35 PolarHBondContact O-N 3.38Å; Y32-E35 PolarHBondContact O-N 2.73Å; E35-S38 PolarHBondContact O-N 3.29Å; E35-S39 WeakPolarHBondContact O-CB 3.39Å; E35-S39 PolarHBondContact O-N 3.16Å; E35-S39 VanDerWaalsContact O-N 3.14Å
36	F	87.1	Confident	73.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.009	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-51.8	179.7	172.6	-136.6	0	0	0	111.8	P16 L17 F20 Y32 W33 S38 S39 V40 I107	P16-F36 HydrophobicContact CB-CB 4.18Å; P16-F36 HydrophobicContact CB-CD2 3.51Å; P16-F36 HydrophobicContact CB-CE2 4.29Å; P16-F36 HydrophobicContact CB-CG 4.17Å; L17-F36 HydrophobicContact CB-CE2 4.07Å; L17-F36 HydrophobicContact CD1-CE2 4.06Å; L17-F36 HydrophobicContact CD1-CZ 3.74Å; F20-F36 HydrophobicContact CB-CE1 4.09Å; F20-F36 HydrophobicContact CB-CZ 4.29Å; F20-F36 HydrophobicContact CG-CE1 4.19Å; Y32-F36 HydrophobicContact CD1-CB 4.43Å; Y32-F36 HydrophobicContact CE1-CB 3.94Å; Y32-F36 AromaticContact CE1-CD1 3.91Å; Y32-F36 HydrophobicContact CE1-CD1 3.91Å; Y32-F36 HydrophobicContact CE1-CG 4.16Å; Y32-F36 HydrophobicContact CE2-CB 4.19Å; Y32-F36 AromaticContact CZ-CG 3.94Å; Y32-F36 WeakPolarHBondContact O-CB 3.16Å; Y32-F36 PolarHBondContact O-N 2.91Å; W33-F36 HydrophobicContact CE3-CD1 4.32Å; W33-F36 HydrophobicContact CZ3-CD1 4.46Å; F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 2.82Å; F36-S39 PolarHBondContact O-N 3.23Å; F36-S39 VanDerWaalsContact O-N 3.14Å; F36-S39 PolarHBondContact O-OG 3.49Å; F36-V40 HydrophobicContact CD2-CG2 4.36Å; F36-V40 HydrophobicContact CE2-CG2 4.07Å; F36-V40 WeakPolarHBondContact O-CG2 3.38Å; F36-V40 PolarHBondContact O-N 2.89Å; F36-I107 HydrophobicContact CE1-CD1 3.71Å; F36-I107 HydrophobicContact CE2-CD1 4.38Å; F36-I107 HydrophobicContact CZ-CD1 3.54Å
37	L	87.5	Confident	70.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-74.5	-22	-174.1	-63.7	174.2	0	0	0	112.9	W33 L76 F79 I100 N103 I107	W33-L37 VanDerWaalsContact O-CB 3.24Å; W33-L37 WeakPolarHBondContact O-CB 3.39Å; W33-L37 WeakPolarHBondContact O-CG 3.48Å; W33-L37 PolarHBondContact O-N 3.39Å; L37-L76 HydrophobicContact CD1-CD1 4.3Å; L37-F79 HydrophobicContact CD1-CD1 4.15Å; L37-F79 HydrophobicContact CD1-CE1 3.56Å; L37-F79 HydrophobicContact CD1-CZ 4.44Å; L37-I100 HydrophobicContact CB-CB 4.37Å; L37-I100 HydrophobicContact CB-CG1 4.31Å; L37-I100 HydrophobicContact CB-CG2 4.02Å; L37-I100 HydrophobicContact CD1-CG2 3.87Å; L37-N103 HydrophobicContact CB-CB 4.49Å; L37-N103 HydrophobicContact CD2-CB 4.33Å; L37-N103 PolarHBondContact O-ND2 2.81Å; L37-I107 HydrophobicContact CD2-CD1 3.54Å
38	S	83.5	Confident	68.1	Low	57 Å²	57	63.7 Å²	63.7	40%	0.399	37%	0.367	S	S	.	.	H	α-helix	trans	-74.4	-29.4	170.4	-56.2	0	0	0	0	112.2	M34 E35 F36	M34-S38 WeakPolarHBondContact O-CB 3.21Å; M34-S38 PolarHBondContact O-N 2.99Å; M34-S38 PolarHBondContact O-OG 3.24Å; E35-S38 PolarHBondContact O-N 3.29Å; F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 2.82Å
39	S	72.7	Confident	65.6	Low	27 Å²	27	64.1 Å²	64.1	19%	0.189	37%	0.368	C	S	.	.	H	α-helix	trans	-83.2	-21.8	-176.8	74	0	0	0	0	114.6	E35 F36 G41 S42	E35-S39 WeakPolarHBondContact O-CB 3.39Å; E35-S39 PolarHBondContact O-N 3.16Å; E35-S39 VanDerWaalsContact O-N 3.14Å; F36-S39 PolarHBondContact O-N 3.23Å; F36-S39 VanDerWaalsContact O-N 3.14Å; F36-S39 PolarHBondContact O-OG 3.49Å; S39-G41 PolarHBondContact O-N 3.17Å; S39-S42 PolarHBondContact O-N 3.01Å; S39-S42 PolarHBondContact O-OG 3.42Å
40	V	66.7	Low	63	Low	24 Å²	24	59.6 Å²	59.6	15%	0.145	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-30.1	-179.7	172.6	0	0	0	0	112.9	F36 T44 N103 I107	F36-V40 HydrophobicContact CD2-CG2 4.36Å; F36-V40 HydrophobicContact CE2-CG2 4.07Å; F36-V40 WeakPolarHBondContact O-CG2 3.38Å; F36-V40 PolarHBondContact O-N 2.89Å; V40-T44 PolarHBondContact O-OG1 3.13Å; V40-N103 HydrophobicContact CB-CB 4.4Å; V40-N103 HydrophobicContact CG1-CB 4.44Å; V40-I107 HydrophobicContact CG2-CD1 3.86Å
41	G	52.8	Low	60.5	Low	41 Å²	41	60.1 Å²	60.1	42%	0.423	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-20.6	178.3	0	0	0	0	0	116.1	S39 T44	S39-G41 PolarHBondContact O-N 3.17Å; G41-T44 PolarHBondContact O-OG1 2.97Å
42	S	42.3	Very low	58.3	Low	98 Å²	98	54 Å²	54	69%	0.685	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-20.4	-172.8	64.4	0	0	0	0	113.6	S39	S39-S42 PolarHBondContact O-N 3.01Å; S39-S42 PolarHBondContact O-OG 3.42Å
43	T	35	Very low	56.1	Low	95 Å²	95	56.2 Å²	56.2	58%	0.583	33%	0.325	S	S	*	.	S	Bend	trans	-92.8	-6.9	179.9	49.7	0	0	0	0	114.1	K45	T43-K45 PolarHBondContact O-N 3.25Å
44	T	35.4	Very low	53.9	Low	34 Å²	34	63 Å²	63	21%	0.209	36%	0.355	C	S	.	.			trans	-103.4	75.2	-172.2	34	0	0	0	0	113.2	V40 G41 S46 L49	V40-T44 PolarHBondContact O-OG1 3.13Å; G41-T44 PolarHBondContact O-OG1 2.97Å; T44-S46 PolarHBondContact O-N 3.4Å; T44-L49 HydrophobicContact CG2-CD1 4.28Å
45	K	31.3	Very low	52	Low	190 Å²	190	61.8 Å²	61.8	83%	0.826	36%	0.355	S	S	*	.			trans	-63.4	102.2	154.7	-74.1	-175.6	178.5	177.8	0	108.5	T43 S47	T43-K45 PolarHBondContact O-N 3.25Å; K45-S47 PolarHBondContact O-N 3.33Å
46	S	33.2	Very low	50.7	Low	67 Å²	67	55.7 Å²	55.7	47%	0.469	33%	0.327	S	S	.	.	S	Bend	trans	27.6	-6.2	160.4	67.1	0	0	0	0	123.9	T44 I235	T44-S46 PolarHBondContact O-N 3.4Å; S46-I235 WeakPolarHBondContact O-CD1 3.22Å
47	S	29.6	Very low	50	Low	88 Å²	88	62 Å²	62	62%	0.615	36%	0.355	S	S	*	.	S	Bend	trans	-125.6	9.3	-170.3	71.4	0	0	0	0	116.3	K45	K45-S47 PolarHBondContact O-N 3.33Å
48	S	38.6	Very low	49.8	Very low	27 Å²	27	66.3 Å²	66.3	19%	0.189	38%	0.381	C	S	.	.			trans	-126.4	5.5	-168.6	57.4	0	0	0	0	117.5	D51 F52	S48-D51 CarbonylContact O-C 3.36Å; S48-D51 WeakPolarHBondContact O-CB 3.42Å; S48-D51 PolarHBondContact O-N 3.02Å; S48-F52 PolarHBondContact O-N 3.27Å; S48-F52 VanDerWaalsContact O-N 3.14Å
49	L	38.9	Very low	49.8	Very low	29 Å²	29	64.2 Å²	64.2	15%	0.152	37%	0.365	C	S	.	.	S	Bend	trans	-81.3	-25.8	179.5	-102.1	135.1	0	0	0	114.2	T44 D51 F52 Y232 I235	T44-L49 HydrophobicContact CG2-CD1 4.28Å; L49-D51 PolarHBondContact O-N 3.39Å; L49-F52 HydrophobicContact CD2-CB 4.28Å; L49-F52 HydrophobicContact CG-CB 4.44Å; L49-F52 VanDerWaalsContact O-CB 3.26Å; L49-F52 WeakPolarHBondContact O-CB 3.15Å; L49-F52 PolarHBondContact O-N 3.24Å; L49-Y232 HydrophobicContact CD1-CD2 4.02Å; L49-Y232 HydrophobicContact CD1-CE1 4.32Å; L49-Y232 HydrophobicContact CD1-CE2 3.34Å; L49-I235 HydrophobicContact CB-CB 4.44Å; L49-I235 HydrophobicContact CB-CG2 3.25Å
50	I	37.3	Very low	50.6	Low	53 Å²	53	63.7 Å²	63.7	27%	0.272	36%	0.36	S	S	.	.	H	α-helix	trans	-61.1	-31.3	166.5	-61	177.9	0	0	0	110	I235 A238 A239 I242	I50-I235 HydrophobicContact CD1-CG1 4.15Å; I50-I235 HydrophobicContact CG1-CB 4.27Å; I50-I235 HydrophobicContact CG1-CG1 4.02Å; I50-I235 HydrophobicContact CG1-CG2 3.71Å; I50-A238 HydrophobicContact CD1-CB 3.77Å; I50-A238 HydrophobicContact CG1-CB 4.47Å; I50-A239 HydrophobicContact CG1-CB 4.13Å; I50-I242 HydrophobicContact CD1-CD1 4.44Å
51	D	39.5	Very low	51.7	Low	46 Å²	46	69.1 Å²	69.1	25%	0.246	38%	0.382	C	S	.	.	H	α-helix	trans	-81.7	-14.5	174.5	-57.3	-52.9	0	0	0	112.3	L8 S48 L49 A55	L8-D51 HydrophobicContact CD1-CB 4.41Å; L8-D51 WeakPolarHBondContact CD1-OD2 3.46Å; L8-D51 HydrophobicContact CD2-CB 3.48Å; L8-D51 VanDerWaalsContact CD2-CB 3.48Å; L8-D51 WeakPolarHBondContact CD2-OD1 3.48Å; L8-D51 HydrophobicContact CG-CB 3.78Å; S48-D51 CarbonylContact O-C 3.36Å; S48-D51 WeakPolarHBondContact O-CB 3.42Å; S48-D51 PolarHBondContact O-N 3.02Å; L49-D51 PolarHBondContact O-N 3.39Å; D51-A55 VanDerWaalsContact O-CA 3.31Å; D51-A55 WeakPolarHBondContact O-CA 3.41Å; D51-A55 WeakPolarHBondContact O-CB 3.03Å; D51-A55 PolarHBondContact O-N 3.35Å
52	F	45.8	Very low	53.6	Low	41 Å²	41	69.8 Å²	69.8	18%	0.18	38%	0.376	C	S	.	.	H	α-helix	trans	-66.8	-51.1	-179.4	-162.3	-106.4	0	0	0	111.6	L17 S48 L49 K54 N56 L110	L17-F52 HydrophobicContact CD2-CE2 4.25Å; L17-F52 HydrophobicContact CD2-CZ 4.42Å; S48-F52 PolarHBondContact O-N 3.27Å; S48-F52 VanDerWaalsContact O-N 3.14Å; L49-F52 HydrophobicContact CD2-CB 4.28Å; L49-F52 HydrophobicContact CG-CB 4.44Å; L49-F52 VanDerWaalsContact O-CB 3.26Å; L49-F52 WeakPolarHBondContact O-CB 3.15Å; L49-F52 PolarHBondContact O-N 3.24Å; F52-K54 PolarHBondContact O-N 3.25Å; F52-N56 WeakPolarHBondContact CD1-ND2 3.45Å; F52-N56 VanDerWaalsContact CD2-ND2 3.27Å; F52-N56 WeakPolarHBondContact CD2-ND2 3.42Å; F52-N56 WeakPolarHBondContact CE1-ND2 3.28Å; F52-N56 WeakPolarHBondContact CE2-ND2 3.41Å; F52-N56 WeakPolarHBondContact CG-ND2 3.33Å; F52-N56 WeakPolarHBondContact CZ-ND2 3.23Å; F52-N56 WeakPolarHBondContact O-CA 3.37Å; F52-N56 WeakPolarHBondContact O-CB 3.28Å; F52-N56 PolarHBondContact O-N 3.19Å; F52-N56 PolarHBondContact O-ND2 3.14Å; F52-N56 VanDerWaalsContact O-ND2 3.09Å; F52-N56 PolarHBondContact O-OD1 3.32Å; F52-L110 HydrophobicContact CD1-CD1 3.72Å; F52-L110 HydrophobicContact CE1-CD1 3.52Å
53	E	47.7	Very low	56	Low	58 Å²	58	65.2 Å²	65.2	27%	0.271	34%	0.344	S	S	.	.	H	α-helix	trans	-69.5	-37.2	179.6	-161.4	175.7	-173.4	0	0	112.4	K57 K113	E53-K57 WeakPolarHBondContact O-CG 3.47Å; E53-K57 PolarHBondContact O-N 3Å; E53-K113 IonicContact OE1-NZ 3.04Å; E53-K113 PolarHBondContact OE1-NZ 3.5Å
54	K	48.7	Very low	58.8	Low	143 Å²	143	63.4 Å²	63.4	62%	0.622	33%	0.328	S	S	*	.	H	α-helix	trans	-71.2	-46.5	176.7	-77.7	-177	-179.3	175.7	0	112.7	F52 N56 K57	F52-K54 PolarHBondContact O-N 3.25Å; K54-N56 VanDerWaalsContact C-N 3.29Å; K54-K57 PolarHBondContact O-N 3.48Å
55	A	50.9	Low	61.7	Low	42 Å²	42	68.8 Å²	68.8	35%	0.347	35%	0.348	S	S	.	.	H	α-helix	trans	-68.2	-30.1	175.4	0	0	0	0	0	111.5	D51	D51-A55 VanDerWaalsContact O-CA 3.31Å; D51-A55 WeakPolarHBondContact O-CA 3.41Å; D51-A55 WeakPolarHBondContact O-CB 3.03Å; D51-A55 PolarHBondContact O-N 3.35Å
56	N	60.9	Low	64.8	Low	7 Å²	7	61.1 Å²	61.1	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-88	3.6	178.6	-59.9	-11.7	0	0	0	113.7	F52 K54 T58 L59 L60	F52-N56 WeakPolarHBondContact CD1-ND2 3.45Å; F52-N56 VanDerWaalsContact CD2-ND2 3.27Å; F52-N56 WeakPolarHBondContact CD2-ND2 3.42Å; F52-N56 WeakPolarHBondContact CE1-ND2 3.28Å; F52-N56 WeakPolarHBondContact CE2-ND2 3.41Å; F52-N56 WeakPolarHBondContact CG-ND2 3.33Å; F52-N56 WeakPolarHBondContact CZ-ND2 3.23Å; F52-N56 WeakPolarHBondContact O-CA 3.37Å; F52-N56 WeakPolarHBondContact O-CB 3.28Å; F52-N56 PolarHBondContact O-N 3.19Å; F52-N56 PolarHBondContact O-ND2 3.14Å; F52-N56 VanDerWaalsContact O-ND2 3.09Å; F52-N56 PolarHBondContact O-OD1 3.32Å; K54-N56 VanDerWaalsContact C-N 3.29Å; N56-T58 PolarHBondContact O-N 2.73Å; N56-L59 HydrophobicContact CB-CB 4.12Å; N56-L59 HydrophobicContact CB-CD1 4.4Å; N56-L59 PolarHBondContact O-N 2.97Å; N56-L59 VanDerWaalsContact O-N 3.14Å; N56-L59 WeakPolarHBondContact OD1-CD1 3.37Å; N56-L60 HydrophobicContact CB-CD1 4.29Å; N56-L60 HydrophobicContact CB-CG 4.23Å; N56-L60 VanDerWaalsContact O-CB 3.25Å; N56-L60 WeakPolarHBondContact O-CB 3.49Å; N56-L60 VanDerWaalsContact O-CG 3.28Å; N56-L60 WeakPolarHBondContact O-CG 3.26Å; N56-L60 PolarHBondContact O-N 2.71Å
57	K	72	Confident	67.7	Low	135 Å²	135	58 Å²	58	59%	0.587	29%	0.294	S	S	*	.	H	α-helix	trans	-55.7	-38.3	171.3	-76.2	-168.2	178.9	-175.8	0	111.1	E53 K54 K61	E53-K57 WeakPolarHBondContact O-CG 3.47Å; E53-K57 PolarHBondContact O-N 3Å; K54-K57 PolarHBondContact O-N 3.48Å; K57-K61 WeakPolarHBondContact O-CB 3.24Å; K57-K61 PolarHBondContact O-N 3.31Å
58	T	82.1	Confident	70.7	Confident	91 Å²	91	56.6 Å²	56.6	56%	0.558	28%	0.28	S	S	*	.	H	α-helix	trans	-67.8	-50.2	173.6	-49.9	0	0	0	0	111	N56 L60 K61 D62	N56-T58 PolarHBondContact O-N 2.73Å; T58-L60 PolarHBondContact O-N 3.35Å; T58-K61 CarbonylContact O-C 3.55Å; T58-K61 WeakPolarHBondContact O-CA 3.31Å; T58-K61 WeakPolarHBondContact O-CB 3.41Å; T58-K61 PolarHBondContact O-N 2.93Å; T58-K61 VanDerWaalsContact O-N 3.1Å; T58-D62 VanDerWaalsContact O-CG 3.28Å; T58-D62 PolarHBondContact O-N 3.18Å
59	L	84.1	Confident	73.3	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-38.3	179.8	-70	170.8	0	0	0	113.5	V11 L17 V21 N56 D62 L63	V11-L59 HydrophobicContact CG1-CD1 4.41Å; L17-L59 HydrophobicContact CD2-CD1 3.71Å; L17-L59 HydrophobicContact CG-CD1 4.28Å; V21-L59 HydrophobicContact CG1-CB 4.33Å; V21-L59 WeakPolarHBondContact CG1-O 3.46Å; V21-L59 HydrophobicContact CG2-CD2 3.74Å; N56-L59 HydrophobicContact CB-CB 4.12Å; N56-L59 HydrophobicContact CB-CD1 4.4Å; N56-L59 PolarHBondContact O-N 2.97Å; N56-L59 VanDerWaalsContact O-N 3.14Å; N56-L59 WeakPolarHBondContact OD1-CD1 3.37Å; L59-D62 PolarHBondContact O-N 2.65Å; L59-L63 WeakPolarHBondContact O-CB 3.35Å; L59-L63 PolarHBondContact O-N 2.88Å
60	L	89	Confident	75.9	Confident	17 Å²	17	61.1 Å²	61.1	9%	0.089	30%	0.297	C	S	.	.	H	α-helix	trans	-73.6	-31.8	176	-68.5	169	0	0	0	111.5	N56 T58 L63 K64 Y114	N56-L60 HydrophobicContact CB-CD1 4.29Å; N56-L60 HydrophobicContact CB-CG 4.23Å; N56-L60 VanDerWaalsContact O-CB 3.25Å; N56-L60 WeakPolarHBondContact O-CB 3.49Å; N56-L60 VanDerWaalsContact O-CG 3.28Å; N56-L60 WeakPolarHBondContact O-CG 3.26Å; N56-L60 PolarHBondContact O-N 2.71Å; T58-L60 PolarHBondContact O-N 3.35Å; L60-L63 HydrophobicContact CD2-CD2 4.17Å; L60-K64 WeakPolarHBondContact O-CB 3.42Å; L60-K64 PolarHBondContact O-N 3.38Å; L60-Y114 HydrophobicContact CB-CD1 3.82Å; L60-Y114 HydrophobicContact CB-CD2 3.75Å; L60-Y114 HydrophobicContact CB-CE1 4.07Å; L60-Y114 HydrophobicContact CB-CE2 3.99Å; L60-Y114 HydrophobicContact CB-CG 3.66Å; L60-Y114 HydrophobicContact CD1-CD2 3.96Å; L60-Y114 HydrophobicContact CD1-CG 4.13Å; L60-Y114 HydrophobicContact CG-CD2 4.47Å; L60-Y114 HydrophobicContact CG-CG 4.37Å; L60-Y114 VanDerWaalsContact O-CE1 3.3Å; L60-Y114 WeakPolarHBondContact O-CE1 3.47Å
61	K	91.4	Very high	78.6	Confident	137 Å²	137	61.1 Å²	61.1	60%	0.596	29%	0.294	S	S	*	.	H	α-helix	trans	-64.1	-45.1	169.1	-174.5	-178.2	179.3	-177.7	0	110.5	K57 T58 K64 K65	K57-K61 WeakPolarHBondContact O-CB 3.24Å; K57-K61 PolarHBondContact O-N 3.31Å; T58-K61 CarbonylContact O-C 3.55Å; T58-K61 WeakPolarHBondContact O-CA 3.31Å; T58-K61 WeakPolarHBondContact O-CB 3.41Å; T58-K61 PolarHBondContact O-N 2.93Å; T58-K61 VanDerWaalsContact O-N 3.1Å; K61-K64 PolarHBondContact O-N 3.08Å; K61-K65 PolarHBondContact O-N 3.13Å
62	D	91.6	Very high	81.3	Confident	55 Å²	55	59 Å²	59	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-64.4	-43.8	176.3	-65.2	-25	0	0	0	110.7	V21 T58 L59 K64 K65 N66	V21-D62 HydrophobicContact CG2-CB 4.48Å; T58-D62 VanDerWaalsContact O-CG 3.28Å; T58-D62 PolarHBondContact O-N 3.18Å; L59-D62 PolarHBondContact O-N 2.65Å; D62-K64 PolarHBondContact O-N 3.15Å; D62-K65 PolarHBondContact O-N 2.91Å; D62-K65 VanDerWaalsContact O-N 3.11Å; D62-N66 VanDerWaalsContact O-CB 3.3Å; D62-N66 WeakPolarHBondContact O-CB 3.41Å; D62-N66 PolarHBondContact O-N 3.39Å; D62-N66 PolarHBondContact O-ND2 2.83Å
63	L	92.9	Very high	83.6	Confident	3 Å²	3	57 Å²	57	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-58.2	-47.1	172.4	-177.1	67.4	0	0	0	111.3	F20 V21 L59 L60 K65 N66 N67 I73 S111	F20-L63 HydrophobicContact CD1-CD1 4.24Å; F20-L63 HydrophobicContact CE1-CD1 3.83Å; F20-L63 HydrophobicContact CE1-CD2 3.77Å; F20-L63 HydrophobicContact CE1-CG 4.46Å; F20-L63 HydrophobicContact CZ-CD1 4.02Å; F20-L63 HydrophobicContact CZ-CD2 4.2Å; V21-L63 HydrophobicContact CB-CB 4.04Å; V21-L63 HydrophobicContact CB-CD1 4.43Å; V21-L63 HydrophobicContact CG1-CB 3.93Å; V21-L63 HydrophobicContact CG1-CD1 4.29Å; L59-L63 WeakPolarHBondContact O-CB 3.35Å; L59-L63 PolarHBondContact O-N 2.88Å; L60-L63 HydrophobicContact CD2-CD2 4.17Å; L63-K65 VanDerWaalsContact C-N 3.27Å; L63-K65 PolarHBondContact O-N 2.85Å; L63-N66 PolarHBondContact O-N 2.94Å; L63-N67 HydrophobicContact CD1-CB 4.18Å; L63-N67 HydrophobicContact CG-CB 4.48Å; L63-N67 WeakPolarHBondContact O-CA 3.27Å; L63-N67 WeakPolarHBondContact O-CB 3.43Å; L63-N67 PolarHBondContact O-N 3.31Å; L63-I73 HydrophobicContact CD1-CD1 4.47Å; L63-I73 HydrophobicContact CD1-CG1 4.28Å; L63-I73 HydrophobicContact CD2-CD1 4.05Å; L63-I73 HydrophobicContact CD2-CG1 4.4Å; L63-I73 HydrophobicContact CG-CD1 4.2Å; L63-S111 WeakPolarHBondContact CD2-OG 3.21Å
64	K	94.5	Very high	85.9	Confident	57 Å²	57	54.2 Å²	54.2	25%	0.248	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-38.1	175.7	175.8	-174.8	165.9	-172	0	111.3	L60 K61 D62 Y114 L115 H118 H127	L60-K64 WeakPolarHBondContact O-CB 3.42Å; L60-K64 PolarHBondContact O-N 3.38Å; K61-K64 PolarHBondContact O-N 3.08Å; D62-K64 PolarHBondContact O-N 3.15Å; K64-Y114 HydrophobicContact CB-CD1 4.41Å; K64-Y114 HydrophobicContact CB-CE1 3.96Å; K64-Y114 HydrophobicContact CD-CE1 4.08Å; K64-L115 HydrophobicContact CB-CD2 3.85Å; K64-L115 HydrophobicContact CG-CD2 3.84Å; K64-H118 HydrophobicContact CD-CB 4.27Å; K64-H118 PolarHBondContact NZ-O 3.34Å; K64-H127 PolarHBondContact O-CE1 3.28Å
65	K	95.1	Very high	88.1	Confident	146 Å²	146	48.6 Å²	48.6	64%	0.635	24%	0.238	S	C	*	.	H	α-helix	trans	-70.3	-53.4	177.2	-175.5	175.6	178.5	171.5	0	111.2	K61 D62 L63	K61-K65 PolarHBondContact O-N 3.13Å; D62-K65 PolarHBondContact O-N 2.91Å; D62-K65 VanDerWaalsContact O-N 3.11Å; L63-K65 VanDerWaalsContact C-N 3.27Å; L63-K65 PolarHBondContact O-N 2.85Å
66	N	96.1	Very high	90.2	Very high	30 Å²	30	46.6 Å²	46.6	16%	0.16	22%	0.221	C	C	.	.	H	α-helix	trans	-83.6	-28.7	-166.6	-60.3	-25.4	0	0	0	113.6	V21 G22 T23 D62 L63 L68 Q69 S70	V21-N66 WeakPolarHBondContact O-CB 3.4Å; V21-N66 PolarHBondContact O-ND2 3.18Å; G22-N66 WeakPolarHBondContact O-CB 3.44Å; T23-N66 HydrophobicContact CG2-CB 4.25Å; D62-N66 VanDerWaalsContact O-CB 3.3Å; D62-N66 WeakPolarHBondContact O-CB 3.41Å; D62-N66 PolarHBondContact O-N 3.39Å; D62-N66 PolarHBondContact O-ND2 2.83Å; L63-N66 PolarHBondContact O-N 2.94Å; N66-L68 PolarHBondContact O-N 3.33Å; N66-L68 VanDerWaalsContact O-N 3.08Å; N66-Q69 WeakPolarHBondContact O-CA 3.45Å; N66-Q69 PolarHBondContact O-N 3.16Å; N66-S70 PolarHBondContact O-N 2.85Å; N66-S70 PolarHBondContact O-OG 3.3Å
67	N	95.3	Very high	91.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-21.3	-176.2	-179.4	61.5	0	0	0	113.7	L63 Q69 S70 R71 N72 I73 H127	L63-N67 HydrophobicContact CD1-CB 4.18Å; L63-N67 HydrophobicContact CG-CB 4.48Å; L63-N67 WeakPolarHBondContact O-CA 3.27Å; L63-N67 WeakPolarHBondContact O-CB 3.43Å; L63-N67 PolarHBondContact O-N 3.31Å; N67-Q69 PolarHBondContact O-N 3.21Å; N67-S70 WeakPolarHBondContact CA-OG 3.47Å; N67-R71 WeakPolarHBondContact O-CA 3.42Å; N67-R71 PolarHBondContact O-N 2.71Å; N67-N72 PolarHBondContact OD1-N 2.83Å; N67-I73 HydrophobicContact CB-CD1 4.41Å; N67-I73 WeakPolarHBondContact ND2-CD1 3.47Å; N67-I73 PolarHBondContact OD1-N 3.2Å; N67-H127 PolarHBondContact ND2-ND1 2.86Å; N67-H127 PolarHBondContact ND2-O 2.99Å; N67-H127 VanDerWaalsContact ND2-O 3.1Å
68	L	92.6	Very high	93	Very high	60 Å²	60	43.2 Å²	43.2	31%	0.314	21%	0.207	S	C	.	.	H	α-helix	trans	-61.6	-32.9	170.7	-84.6	-167.3	0	0	0	113.4	N66 R71 R123	N66-L68 PolarHBondContact O-N 3.33Å; N66-L68 VanDerWaalsContact O-N 3.08Å; L68-R71 VanDerWaalsContact O-CZ 3.22Å; L68-R71 PolarHBondContact O-NE 2.89Å; L68-R71 PolarHBondContact O-NH2 2.72Å; L68-R71 VanDerWaalsContact O-NH2 3.14Å; L68-R123 VanDerWaalsContact CD1-NH1 3.34Å; L68-R123 VanDerWaalsContact CG-NH1 3.26Å
69	Q	92.7	Very high	93.7	Very high	146 Å²	146	39.5 Å²	39.5	68%	0.682	18%	0.183	S	C	*	.	H	α-helix	trans	-93.1	-51.2	177.9	-179.4	178.6	-6.2	0	0	110.8	N66 N67 R71	N66-Q69 WeakPolarHBondContact O-CA 3.45Å; N66-Q69 PolarHBondContact O-N 3.16Å; N67-Q69 PolarHBondContact O-N 3.21Å; Q69-R71 PolarHBondContact O-N 3.27Å
70	S	94.4	Very high	94.4	Very high	4 Å²	4	39 Å²	39	3%	0.028	18%	0.18	C	C	.	.	H	α-helix	trans	-72	-28.9	-173.9	63.2	0	0	0	0	113.6	G22 T23 D24 G25 N66 N67 N72	G22-S70 WeakPolarHBondContact O-CB 3.34Å; G22-S70 PolarHBondContact O-OG 3.39Å; T23-S70 WeakPolarHBondContact O-CB 3.34Å; D24-S70 WeakPolarHBondContact O-CB 3.24Å; G25-S70 WeakPolarHBondContact CA-O 3.45Å; N66-S70 PolarHBondContact O-N 2.85Å; N66-S70 PolarHBondContact O-OG 3.3Å; N67-S70 WeakPolarHBondContact CA-OG 3.47Å; S70-N72 PolarHBondContact O-N 3.25Å; S70-N72 PolarHBondContact O-OD1 3.49Å; S70-N72 PolarHBondContact OG-ND2 2.88Å
71	R	93.6	Very high	94.8	Very high	54 Å²	54	39.7 Å²	39.7	20%	0.204	18%	0.184	C	C	.	.			trans	56.9	30	-176.7	-53.5	-63.6	179.2	169.5	-9.8	113.1	N67 L68 Q69 I73 P74 N75 S126 S129	N67-R71 WeakPolarHBondContact O-CA 3.42Å; N67-R71 PolarHBondContact O-N 2.71Å; L68-R71 VanDerWaalsContact O-CZ 3.22Å; L68-R71 PolarHBondContact O-NE 2.89Å; L68-R71 PolarHBondContact O-NH2 2.72Å; L68-R71 VanDerWaalsContact O-NH2 3.14Å; Q69-R71 PolarHBondContact O-N 3.27Å; R71-I73 PolarHBondContact O-N 3.41Å; R71-P74 HydrophobicContact CB-CG 4.07Å; R71-P74 VanDerWaalsContact O-CD 3.25Å; R71-P74 WeakPolarHBondContact O-CD 3.41Å; R71-P74 VanDerWaalsContact O-CG 3.29Å; R71-P74 WeakPolarHBondContact O-CG 3.37Å; R71-N75 WeakPolarHBondContact O-CB 3.35Å; R71-N75 PolarHBondContact O-N 2.98Å; R71-N75 PolarHBondContact O-ND2 3.24Å; R71-S126 PolarHBondContact NH1-O 3.28Å; R71-S129 PolarHBondContact NH1-O 3.15Å
72	N	94.8	Very high	95	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-69	-32.8	-177.5	-71.7	-16.6	0	0	0	113.7	F20 D24 I26 W33 N67 S70 L76	F20-N72 HydrophobicContact CD2-CB 4.01Å; F20-N72 HydrophobicContact CE2-CB 4.02Å; F20-N72 PolarHBondContact O-ND2 3.19Å; D24-N72 PolarHBondContact O-ND2 3.36Å; D24-N72 VanDerWaalsContact O-ND2 3.12Å; D24-N72 PolarHBondContact O-OD1 2.83Å; I26-N72 PolarHBondContact N-OD1 2.89Å; W33-N72 HydrophobicContact CH2-CB 4.49Å; N67-N72 PolarHBondContact OD1-N 2.83Å; S70-N72 PolarHBondContact O-N 3.25Å; S70-N72 PolarHBondContact O-OD1 3.49Å; S70-N72 PolarHBondContact OG-ND2 2.88Å; N72-L76 VanDerWaalsContact O-CB 3.28Å; N72-L76 WeakPolarHBondContact O-CB 3.35Å; N72-L76 PolarHBondContact O-N 3.17Å
73	I	95.6	Very high	95.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-54.3	175.7	-65.3	179.5	0	0	0	112.2	F20 L63 N67 R71 N75 L76 I77 L108 L115 F128	F20-I73 HydrophobicContact CZ-CG1 4.35Å; L63-I73 HydrophobicContact CD1-CD1 4.47Å; L63-I73 HydrophobicContact CD1-CG1 4.28Å; L63-I73 HydrophobicContact CD2-CD1 4.05Å; L63-I73 HydrophobicContact CD2-CG1 4.4Å; L63-I73 HydrophobicContact CG-CD1 4.2Å; N67-I73 HydrophobicContact CB-CD1 4.41Å; N67-I73 WeakPolarHBondContact ND2-CD1 3.47Å; N67-I73 PolarHBondContact OD1-N 3.2Å; R71-I73 PolarHBondContact O-N 3.41Å; I73-N75 VanDerWaalsContact C-N 3.25Å; I73-N75 PolarHBondContact O-N 2.65Å; I73-L76 WeakPolarHBondContact O-CB 3.5Å; I73-L76 PolarHBondContact O-N 3.45Å; I73-I77 HydrophobicContact CG2-CD1 4.19Å; I73-I77 WeakPolarHBondContact O-CG1 3.45Å; I73-I77 PolarHBondContact O-N 3.09Å; I73-L108 HydrophobicContact CG2-CD1 4.02Å; I73-L115 HydrophobicContact CD1-CD1 3.6Å; I73-F128 HydrophobicContact CG2-CD1 4.04Å; I73-F128 HydrophobicContact CG2-CE1 3.71Å; I73-F128 HydrophobicContact CG2-CZ 4.42Å
74	P	94.8	Very high	95.5	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-31.7	179.2	22.4	-31.5	0	0	0	112.1	R71 I77 Q78 H127 V130 V141	R71-P74 HydrophobicContact CB-CG 4.07Å; R71-P74 VanDerWaalsContact O-CD 3.25Å; R71-P74 WeakPolarHBondContact O-CD 3.41Å; R71-P74 VanDerWaalsContact O-CG 3.29Å; R71-P74 WeakPolarHBondContact O-CG 3.37Å; P74-I77 PolarHBondContact O-N 3.4Å; P74-Q78 WeakPolarHBondContact O-CG 3.22Å; P74-Q78 PolarHBondContact O-N 2.86Å; P74-H127 VanDerWaalsContact CD-O 3.29Å; P74-H127 WeakPolarHBondContact CD-O 3.35Å; P74-V130 HydrophobicContact CB-CG2 3.76Å; P74-V130 HydrophobicContact CG-CG2 4.48Å; P74-V141 HydrophobicContact CB-CG1 4.48Å; P74-V141 HydrophobicContact CB-CG2 4.39Å
75	N	95	Very high	95.6	Very high	25 Å²	25	34.6 Å²	34.6	13%	0.134	17%	0.174	C	C	.	.	H	α-helix	trans	-69.3	-38.9	174.6	-66.6	-11.5	0	0	0	112.4	I26 P28 W33 R71 I73 I77 Q78 F79	I26-N75 VanDerWaalsContact O-CB 3.23Å; I26-N75 WeakPolarHBondContact O-CB 3.42Å; I26-N75 PolarHBondContact O-ND2 2.89Å; P28-N75 HydrophobicContact CG-CB 3.97Å; W33-N75 HydrophobicContact CZ2-CB 4.22Å; R71-N75 WeakPolarHBondContact O-CB 3.35Å; R71-N75 PolarHBondContact O-N 2.98Å; R71-N75 PolarHBondContact O-ND2 3.24Å; I73-N75 VanDerWaalsContact C-N 3.25Å; I73-N75 PolarHBondContact O-N 2.65Å; N75-I77 VanDerWaalsContact C-N 3.31Å; N75-I77 PolarHBondContact O-N 3.27Å; N75-Q78 PolarHBondContact O-N 3.43Å; N75-F79 PolarHBondContact O-N 3.2Å
76	L	95.8	Very high	95.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-42.4	169.9	173.9	62.4	0	0	0	110.9	F20 W33 L37 N72 I73 Q78 F79 L80 I107 L108	F20-L76 HydrophobicContact CE2-CB 4.37Å; F20-L76 HydrophobicContact CE2-CD2 3.96Å; F20-L76 HydrophobicContact CZ-CD2 3.99Å; W33-L76 HydrophobicContact CE3-CD1 3.9Å; W33-L76 HydrophobicContact CH2-CB 3.84Å; W33-L76 HydrophobicContact CZ2-CB 4.36Å; W33-L76 HydrophobicContact CZ3-CB 4.01Å; W33-L76 HydrophobicContact CZ3-CD1 3.89Å; W33-L76 HydrophobicContact CZ3-CG 4.42Å; L37-L76 HydrophobicContact CD1-CD1 4.3Å; N72-L76 VanDerWaalsContact O-CB 3.28Å; N72-L76 WeakPolarHBondContact O-CB 3.35Å; N72-L76 PolarHBondContact O-N 3.17Å; I73-L76 WeakPolarHBondContact O-CB 3.5Å; I73-L76 PolarHBondContact O-N 3.45Å; L76-Q78 PolarHBondContact O-N 3.24Å; L76-F79 HydrophobicContact CD1-CD1 4.44Å; L76-F79 PolarHBondContact O-N 3.17Å; L76-L80 HydrophobicContact CD1-CD1 3.87Å; L76-L80 HydrophobicContact CD1-CG 4.01Å; L76-L80 HydrophobicContact CD2-CD1 4.48Å; L76-L80 HydrophobicContact CG-CD1 3.81Å; L76-L80 HydrophobicContact CG-CG 4.37Å; L76-L80 WeakPolarHBondContact O-CB 3.4Å; L76-L80 VanDerWaalsContact O-CG 3.26Å; L76-L80 WeakPolarHBondContact O-CG 3.41Å; L76-L80 PolarHBondContact O-N 3.18Å; L76-I107 HydrophobicContact CD2-CG2 4.13Å; L76-L108 HydrophobicContact CD2-CB 4.33Å
77	I	96.7	Very high	95.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-43.9	176.6	-66.2	167.2	0	0	0	111.1	I73 P74 N75 L80 I81 L108 F128 V141 L145	I73-I77 HydrophobicContact CG2-CD1 4.19Å; I73-I77 WeakPolarHBondContact O-CG1 3.45Å; I73-I77 PolarHBondContact O-N 3.09Å; P74-I77 PolarHBondContact O-N 3.4Å; N75-I77 VanDerWaalsContact C-N 3.31Å; N75-I77 PolarHBondContact O-N 3.27Å; I77-L80 PolarHBondContact O-N 3.25Å; I77-I81 HydrophobicContact CG2-CD1 3.8Å; I77-I81 HydrophobicContact CG2-CG1 4.26Å; I77-I81 WeakPolarHBondContact O-CB 3.35Å; I77-I81 VanDerWaalsContact O-CG1 3.31Å; I77-I81 WeakPolarHBondContact O-CG1 3.22Å; I77-I81 PolarHBondContact O-N 2.88Å; I77-L108 HydrophobicContact CD1-CD1 4.05Å; I77-L108 HydrophobicContact CD1-CD2 4.5Å; I77-L108 HydrophobicContact CG1-CD1 3.77Å; I77-L108 HydrophobicContact CG1-CD2 3.74Å; I77-L108 HydrophobicContact CG1-CG 4.44Å; I77-F128 HydrophobicContact CD1-CD1 3.58Å; I77-F128 HydrophobicContact CD1-CE1 3.79Å; I77-V141 HydrophobicContact CB-CG1 3.61Å; I77-V141 HydrophobicContact CD1-CG1 3.89Å; I77-V141 HydrophobicContact CG1-CG1 4.37Å; I77-V141 HydrophobicContact CG2-CG1 3.29Å; I77-L145 HydrophobicContact CD1-CD2 4.38Å; I77-L145 HydrophobicContact CG1-CD2 4.36Å; I77-L145 HydrophobicContact CG2-CB 3.89Å; I77-L145 HydrophobicContact CG2-CD1 4.08Å; I77-L145 HydrophobicContact CG2-CD2 4.02Å; I77-L145 HydrophobicContact CG2-CG 4.2Å
78	Q	94.9	Very high	95.8	Very high	71 Å²	71	32.6 Å²	32.6	33%	0.332	17%	0.167	S	C	.	.	H	α-helix	trans	-62.6	-42.5	176.8	-73.1	179.9	-2.6	0	0	112	P28 P74 N75 L76 I81 S82	P28-Q78 HydrophobicContact CB-CB 3.88Å; P28-Q78 HydrophobicContact CG-CB 4.02Å; P74-Q78 WeakPolarHBondContact O-CG 3.22Å; P74-Q78 PolarHBondContact O-N 2.86Å; N75-Q78 PolarHBondContact O-N 3.43Å; L76-Q78 PolarHBondContact O-N 3.24Å; Q78-I81 PolarHBondContact O-N 3.48Å; Q78-S82 PolarHBondContact O-N 3.02Å; Q78-S82 VanDerWaalsContact O-N 3.15Å
79	F	96.7	Very high	95.9	Very high	13 Å²	13	33.9 Å²	33.9	6%	0.057	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-47.5	172.4	172.3	-95.1	0	0	0	111.5	P28 W33 M34 L37 N75 L76 I81 S82 K83 I100	P28-F79 WeakPolarHBondContact O-CD2 2.96Å; W33-F79 HydrophobicContact CB-CD1 3.91Å; W33-F79 HydrophobicContact CB-CD2 3.65Å; W33-F79 HydrophobicContact CB-CE1 3.78Å; W33-F79 HydrophobicContact CB-CE2 3.48Å; W33-F79 VanDerWaalsContact CB-CE2 3.48Å; W33-F79 HydrophobicContact CB-CG 3.85Å; W33-F79 HydrophobicContact CB-CZ 3.54Å; W33-F79 AromaticContact CD1-CD2 3.69Å; W33-F79 AromaticContact CD1-CG 3.87Å; W33-F79 HydrophobicContact CG-CB 4.29Å; W33-F79 HydrophobicContact CG-CD1 4.17Å; W33-F79 AromaticContact CG-CD2 3.84Å; W33-F79 HydrophobicContact CG-CD2 3.84Å; W33-F79 HydrophobicContact CG-CE2 4.19Å; W33-F79 AromaticContact CG-CG 3.82Å; W33-F79 HydrophobicContact CG-CG 3.82Å; M34-F79 HydrophobicContact CG-CE2 4.39Å; M34-F79 HydrophobicContact CG-CZ 4.37Å; M34-F79 HydrophobicContact SD-CE2 4.09Å; M34-F79 HydrophobicContact SD-CZ 3.76Å; L37-F79 HydrophobicContact CD1-CD1 4.15Å; L37-F79 HydrophobicContact CD1-CE1 3.56Å; L37-F79 HydrophobicContact CD1-CZ 4.44Å; N75-F79 PolarHBondContact O-N 3.2Å; L76-F79 HydrophobicContact CD1-CD1 4.44Å; L76-F79 PolarHBondContact O-N 3.17Å; F79-I81 PolarHBondContact O-N 3.39Å; F79-S82 WeakPolarHBondContact O-CB 3.16Å; F79-S82 PolarHBondContact O-N 3.41Å; F79-K83 HydrophobicContact CD1-CG 4.31Å; F79-K83 HydrophobicContact CE1-CG 3.78Å; F79-K83 HydrophobicContact CE2-CD 4.45Å; F79-K83 HydrophobicContact CE2-CG 4.07Å; F79-K83 HydrophobicContact CZ-CD 4.13Å; F79-K83 HydrophobicContact CZ-CG 3.67Å; F79-K83 PolarHBondContact O-N 3.45Å; F79-I100 HydrophobicContact CE1-CG2 3.74Å; F79-I100 HydrophobicContact CZ-CG2 3.81Å
80	L	98.1	Very high	95.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67	-36.8	179.7	-70.1	168.4	0	0	0	112.7	L76 I77 S82 K83 M84 L105 L108	L76-L80 HydrophobicContact CD1-CD1 3.87Å; L76-L80 HydrophobicContact CD1-CG 4.01Å; L76-L80 HydrophobicContact CD2-CD1 4.48Å; L76-L80 HydrophobicContact CG-CD1 3.81Å; L76-L80 HydrophobicContact CG-CG 4.37Å; L76-L80 WeakPolarHBondContact O-CB 3.4Å; L76-L80 VanDerWaalsContact O-CG 3.26Å; L76-L80 WeakPolarHBondContact O-CG 3.41Å; L76-L80 PolarHBondContact O-N 3.18Å; I77-L80 PolarHBondContact O-N 3.25Å; L80-S82 VanDerWaalsContact C-N 3.27Å; L80-S82 PolarHBondContact O-N 2.91Å; L80-K83 PolarHBondContact O-N 3.16Å; L80-M84 HydrophobicContact CB-CE 4.18Å; L80-M84 VanDerWaalsContact O-CB 3.3Å; L80-M84 WeakPolarHBondContact O-CB 3.1Å; L80-M84 WeakPolarHBondContact O-CE 3.4Å; L80-M84 VanDerWaalsContact O-CG 3.24Å; L80-M84 WeakPolarHBondContact O-CG 3.08Å; L80-M84 PolarHBondContact O-N 3.32Å; L80-L105 HydrophobicContact CD1-CD2 4.21Å; L80-L108 HydrophobicContact CD1-CB 4.38Å; L80-L108 HydrophobicContact CD1-CD2 4.07Å
81	I	97.1	Very high	95.4	Very high	32 Å²	32	34.7 Å²	34.7	16%	0.164	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-44.1	172.8	-77.3	167.7	0	0	0	110.2	I77 Q78 F79 S85 C144 L145 V148	I77-I81 HydrophobicContact CG2-CD1 3.8Å; I77-I81 HydrophobicContact CG2-CG1 4.26Å; I77-I81 WeakPolarHBondContact O-CB 3.35Å; I77-I81 VanDerWaalsContact O-CG1 3.31Å; I77-I81 WeakPolarHBondContact O-CG1 3.22Å; I77-I81 PolarHBondContact O-N 2.88Å; Q78-I81 PolarHBondContact O-N 3.48Å; F79-I81 PolarHBondContact O-N 3.39Å; I81-S85 VanDerWaalsContact O-CB 3.24Å; I81-S85 WeakPolarHBondContact O-CB 3.48Å; I81-S85 PolarHBondContact O-N 2.93Å; I81-S85 PolarHBondContact O-OG 3.42Å; I81-C144 HydrophobicContact CD1-CB 3.98Å; I81-L145 HydrophobicContact CD1-CB 4.34Å; I81-L145 HydrophobicContact CG1-CD1 4.32Å; I81-V148 HydrophobicContact CG1-CG2 4.4Å; I81-V148 HydrophobicContact CG2-CG2 4.12Å
82	S	96.3	Very high	95.2	Very high	66 Å²	66	38.3 Å²	38.3	46%	0.462	23%	0.228	S	C	.	.	H	α-helix	trans	-61.1	-51.8	176.2	-174.3	0	0	0	0	111.4	Q78 F79 L80 M84 S85 E86	Q78-S82 PolarHBondContact O-N 3.02Å; Q78-S82 VanDerWaalsContact O-N 3.15Å; F79-S82 WeakPolarHBondContact O-CB 3.16Å; F79-S82 PolarHBondContact O-N 3.41Å; L80-S82 VanDerWaalsContact C-N 3.27Å; L80-S82 PolarHBondContact O-N 2.91Å; S82-M84 PolarHBondContact O-N 2.86Å; S82-S85 PolarHBondContact O-N 3.43Å; S82-E86 PolarHBondContact O-N 2.99Å
83	K	97.2	Very high	94.8	Very high	30 Å²	30	39.8 Å²	39.8	13%	0.13	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-41.5	-178.5	-67.3	-70.8	146.9	-158.8	0	113.6	M34 F79 L80 S85 E86 L87 T97	M34-K83 HydrophobicContact SD-CD 4.36Å; F79-K83 HydrophobicContact CD1-CG 4.31Å; F79-K83 HydrophobicContact CE1-CG 3.78Å; F79-K83 HydrophobicContact CE2-CD 4.45Å; F79-K83 HydrophobicContact CE2-CG 4.07Å; F79-K83 HydrophobicContact CZ-CD 4.13Å; F79-K83 HydrophobicContact CZ-CG 3.67Å; F79-K83 PolarHBondContact O-N 3.45Å; L80-K83 PolarHBondContact O-N 3.16Å; K83-S85 VanDerWaalsContact C-N 3.35Å; K83-E86 IonicContact NZ-OE2 2.78Å; K83-E86 PolarHBondContact NZ-OE2 3.34Å; K83-E86 WeakPolarHBondContact O-CB 3.47Å; K83-E86 PolarHBondContact O-N 3.48Å; K83-L87 WeakPolarHBondContact O-CG 3.14Å; K83-L87 PolarHBondContact O-N 3.49Å; K83-T97 HydrophobicContact CB-CG2 4.46Å; K83-T97 HydrophobicContact CD-CG2 3.99Å
84	M	98	Very high	94.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.7	-38.1	174.8	-69.4	-172.9	-69	0	0	111.5	L80 S82 E86 L87 I88 L105 L145 V148 L149 L152	L80-M84 HydrophobicContact CB-CE 4.18Å; L80-M84 VanDerWaalsContact O-CB 3.3Å; L80-M84 WeakPolarHBondContact O-CB 3.1Å; L80-M84 WeakPolarHBondContact O-CE 3.4Å; L80-M84 VanDerWaalsContact O-CG 3.24Å; L80-M84 WeakPolarHBondContact O-CG 3.08Å; L80-M84 PolarHBondContact O-N 3.32Å; S82-M84 PolarHBondContact O-N 2.86Å; M84-E86 VanDerWaalsContact C-N 3.35Å; M84-L87 PolarHBondContact O-N 2.92Å; M84-I88 VanDerWaalsContact O-CD1 3.3Å; M84-I88 WeakPolarHBondContact O-CD1 3.47Å; M84-I88 WeakPolarHBondContact O-CG1 3.43Å; M84-I88 PolarHBondContact O-N 3.01Å; M84-L105 HydrophobicContact CE-CD2 4.3Å; M84-L105 HydrophobicContact SD-CD1 4.14Å; M84-L105 HydrophobicContact SD-CD2 4Å; M84-L105 HydrophobicContact SD-CG 4.46Å; M84-L145 HydrophobicContact CE-CD1 3.7Å; M84-V148 HydrophobicContact CB-CG1 3.69Å; M84-V148 HydrophobicContact CE-CG1 3.9Å; M84-V148 HydrophobicContact SD-CG1 4.49Å; M84-L149 HydrophobicContact CE-CD2 4.11Å; M84-L149 HydrophobicContact SD-CD2 3.76Å; M84-L152 HydrophobicContact CB-CD1 3.91Å; M84-L152 HydrophobicContact CG-CD1 3.52Å; M84-L152 HydrophobicContact SD-CD1 3.63Å
85	S	97	Very high	94.3	Very high	50 Å²	50	49.3 Å²	49.3	35%	0.35	29%	0.286	S	S	.	.	H	α-helix	trans	-66.2	-38.1	176.2	-58.9	0	0	0	0	112.1	I81 S82 K83 I88 A89	I81-S85 VanDerWaalsContact O-CB 3.24Å; I81-S85 WeakPolarHBondContact O-CB 3.48Å; I81-S85 PolarHBondContact O-N 2.93Å; I81-S85 PolarHBondContact O-OG 3.42Å; S82-S85 PolarHBondContact O-N 3.43Å; K83-S85 VanDerWaalsContact C-N 3.35Å; S85-I88 PolarHBondContact O-N 3.21Å; S85-A89 WeakPolarHBondContact O-CB 3.43Å; S85-A89 PolarHBondContact O-N 3.46Å
86	E	96	Very high	94.1	Very high	87 Å²	87	53.4 Å²	53.4	41%	0.407	31%	0.308	S	S	.	.	H	α-helix	trans	-58	-49.1	171.5	-176.6	-178.3	169.4	0	0	110.9	S82 K83 M84 I88 A89 S90	S82-E86 PolarHBondContact O-N 2.99Å; K83-E86 IonicContact NZ-OE2 2.78Å; K83-E86 PolarHBondContact NZ-OE2 3.34Å; K83-E86 WeakPolarHBondContact O-CB 3.47Å; K83-E86 PolarHBondContact O-N 3.48Å; M84-E86 VanDerWaalsContact C-N 3.35Å; E86-I88 PolarHBondContact O-N 3.3Å; E86-A89 PolarHBondContact O-N 3.21Å; E86-S90 VanDerWaalsContact O-CB 3.27Å; E86-S90 WeakPolarHBondContact O-CB 3.47Å; E86-S90 PolarHBondContact O-N 2.96Å
87	L	97.3	Very high	94	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-63	-38.1	176.9	-70.5	172.8	0	0	0	113.4	K83 M84 I93 T97 V98 A101 L156 L165	K83-L87 WeakPolarHBondContact O-CG 3.14Å; K83-L87 PolarHBondContact O-N 3.49Å; M84-L87 PolarHBondContact O-N 2.92Å; L87-I93 HydrophobicContact CD2-CG2 4.3Å; L87-T97 HydrophobicContact CD1-CG2 4.15Å; L87-T97 HydrophobicContact CD2-CG2 3.74Å; L87-T97 HydrophobicContact CG-CG2 3.72Å; L87-V98 HydrophobicContact CD1-CG2 4.3Å; L87-V98 HydrophobicContact CD2-CG2 3.75Å; L87-A101 HydrophobicContact CD1-CB 3.89Å; L87-L156 HydrophobicContact CB-CD1 4.18Å; L87-L165 HydrophobicContact CD1-CD2 3.74Å
88	I	96.3	Very high	93.7	Very high	42 Å²	42	53.9 Å²	53.9	22%	0.215	31%	0.311	C	S	.	.	H	α-helix	trans	-70.1	-34.6	178.7	-67.7	158.7	0	0	0	111.5	M84 S85 E86 V148 R151 L152 N155	M84-I88 VanDerWaalsContact O-CD1 3.3Å; M84-I88 WeakPolarHBondContact O-CD1 3.47Å; M84-I88 WeakPolarHBondContact O-CG1 3.43Å; M84-I88 PolarHBondContact O-N 3.01Å; S85-I88 PolarHBondContact O-N 3.21Å; E86-I88 PolarHBondContact O-N 3.3Å; I88-V148 HydrophobicContact CD1-CG1 4.29Å; I88-R151 HydrophobicContact CD1-CB 3.93Å; I88-L152 HydrophobicContact CD1-CB 4.03Å; I88-L152 HydrophobicContact CG1-CB 4.33Å; I88-N155 HydrophobicContact CG2-CB 4.08Å
89	A	94.6	Very high	93.4	Very high	86 Å²	86	53.9 Å²	53.9	71%	0.711	31%	0.313	S	S	*	.	H	α-helix	trans	-89.1	-25	-175.7	0	0	0	0	0	113.6	S85 E86	S85-A89 WeakPolarHBondContact O-CB 3.43Å; S85-A89 PolarHBondContact O-N 3.46Å; E86-A89 PolarHBondContact O-N 3.21Å
90	S	91.5	Very high	93.2	Very high	49 Å²	49	53.3 Å²	53.3	34%	0.343	31%	0.311	S	S	.	.			trans	-78.5	131.9	-177.8	-171.1	0	0	0	0	111.8	E86 D92	E86-S90 VanDerWaalsContact O-CB 3.27Å; E86-S90 WeakPolarHBondContact O-CB 3.47Å; E86-S90 PolarHBondContact O-N 2.96Å; S90-D92 VanDerWaalsContact C-N 3.33Å; S90-D92 PolarHBondContact OG-N 3.4Å; S90-D92 PolarHBondContact OG-O 3.2Å
91	P	85.4	Confident	93	Very high	118 Å²	118	53.3 Å²	53.3	77%	0.766	31%	0.311	S	S	*	.	S	Bend	trans	-70.9	-30.5	169.9	29.4	-33.4	0	0	0	112.2
92	D	89.3	Confident	92.7	Very high	131 Å²	131	53.6 Å²	53.6	70%	0.701	31%	0.311	S	S	*	.	S	Bend	trans	-100.4	111.7	178.6	-63.6	-44.9	0	0	0	109.4	S90 C94	S90-D92 VanDerWaalsContact C-N 3.33Å; S90-D92 PolarHBondContact OG-N 3.4Å; S90-D92 PolarHBondContact OG-O 3.2Å; D92-C94 PolarHBondContact O-N 2.69Å
93	I	87.9	Confident	92.3	Very high	31 Å²	31	50.6 Å²	50.6	16%	0.159	29%	0.29	C	S	.	.			trans	-79.8	105.4	-177.2	-59.6	175.2	0	0	0	109.1	L87 E95 V98 L156 P157 T162	L87-I93 HydrophobicContact CD2-CG2 4.3Å; I93-E95 PolarHBondContact O-N 2.58Å; I93-V98 HydrophobicContact CG2-CG2 3.36Å; I93-L156 HydrophobicContact CD1-CD1 4.03Å; I93-L156 HydrophobicContact CG1-CD1 4.37Å; I93-P157 HydrophobicContact CD1-CB 4.43Å; I93-P157 HydrophobicContact CD1-CG 4.26Å; I93-T162 HydrophobicContact CD1-CG2 4.11Å; I93-T162 HydrophobicContact CG2-CG2 3.85Å
94	C	90.7	Very high	92	Very high	59 Å²	59	49.2 Å²	49.2	40%	0.399	28%	0.284	S	S	.	.			trans	-72.6	118.6	177.3	177.2	0	0	0	0	111.5	D92 D96 T97 V98	D92-C94 PolarHBondContact O-N 2.69Å; C94-D96 VanDerWaalsContact C-N 3.34Å; C94-D96 PolarHBondContact O-N 3.46Å; C94-T97 PolarHBondContact O-N 2.87Å; C94-T97 VanDerWaalsContact O-N 3.1Å; C94-V98 WeakPolarHBondContact O-CG2 3.47Å; C94-V98 PolarHBondContact O-N 3.01Å
95	E	89.1	Confident	91.8	Very high	140 Å²	140	49.2 Å²	49.2	65%	0.654	28%	0.284	S	S	*	.	H	α-helix	trans	-57.3	-42.6	-178	-68.3	-171.6	167.1	0	0	113	I93 T97 V98 L99	I93-E95 PolarHBondContact O-N 2.58Å; E95-T97 VanDerWaalsContact C-N 3.29Å; E95-T97 PolarHBondContact O-N 3Å; E95-V98 WeakPolarHBondContact O-CB 3.29Å; E95-V98 PolarHBondContact O-N 2.94Å; E95-L99 PolarHBondContact O-N 2.91Å
96	D	90	Very high	91.4	Very high	112 Å²	112	47.4 Å²	47.4	60%	0.599	27%	0.27	S	S	*	.	H	α-helix	trans	-61.5	-39.8	177.8	-67.6	-26.6	0	0	0	111.4	C94 L99 I100	C94-D96 VanDerWaalsContact C-N 3.34Å; C94-D96 PolarHBondContact O-N 3.46Å; D96-L99 PolarHBondContact O-N 3.19Å; D96-I100 WeakPolarHBondContact O-CB 3.45Å; D96-I100 WeakPolarHBondContact O-CD1 3.41Å; D96-I100 WeakPolarHBondContact O-CG1 3.41Å; D96-I100 PolarHBondContact O-N 3.09Å
97	T	93.7	Very high	91	Very high	6 Å²	6	43.6 Å²	43.6	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-70	-36.7	179.2	-55.6	0	0	0	0	111.2	K83 L87 C94 E95 A101	K83-T97 HydrophobicContact CB-CG2 4.46Å; K83-T97 HydrophobicContact CD-CG2 3.99Å; L87-T97 HydrophobicContact CD1-CG2 4.15Å; L87-T97 HydrophobicContact CD2-CG2 3.74Å; L87-T97 HydrophobicContact CG-CG2 3.72Å; C94-T97 PolarHBondContact O-N 2.87Å; C94-T97 VanDerWaalsContact O-N 3.1Å; E95-T97 VanDerWaalsContact C-N 3.29Å; E95-T97 PolarHBondContact O-N 3Å; T97-A101 VanDerWaalsContact O-CB 3.32Å; T97-A101 WeakPolarHBondContact O-CB 3.37Å; T97-A101 PolarHBondContact O-N 3.1Å
98	V	91.7	Very high	90.8	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.024	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-47.9	173.3	173.3	0	0	0	0	110.9	L87 I93 C94 E95 I100 A101 Q102 N161 T162 L165	L87-V98 HydrophobicContact CD1-CG2 4.3Å; L87-V98 HydrophobicContact CD2-CG2 3.75Å; I93-V98 HydrophobicContact CG2-CG2 3.36Å; C94-V98 WeakPolarHBondContact O-CG2 3.47Å; C94-V98 PolarHBondContact O-N 3.01Å; E95-V98 WeakPolarHBondContact O-CB 3.29Å; E95-V98 PolarHBondContact O-N 2.94Å; V98-I100 PolarHBondContact O-N 3.28Å; V98-A101 PolarHBondContact O-N 3.46Å; V98-Q102 VanDerWaalsContact O-CB 3.29Å; V98-Q102 WeakPolarHBondContact O-CB 3.5Å; V98-Q102 PolarHBondContact O-N 2.9Å; V98-N161 VanDerWaalsContact CG1-O 3.22Å; V98-N161 WeakPolarHBondContact CG1-O 3.38Å; V98-T162 HydrophobicContact CG1-CG2 4.47Å; V98-T162 HydrophobicContact CG2-CG2 4.12Å; V98-L165 HydrophobicContact CG1-CB 4.21Å; V98-L165 HydrophobicContact CG1-CD2 4.05Å
99	L	88.1	Confident	90.6	Very high	70 Å²	70	42.1 Å²	42.1	37%	0.366	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-45.8	178.6	180	61.9	0	0	0	111.6	E95 D96 Q102 N103	E95-L99 PolarHBondContact O-N 2.91Å; D96-L99 PolarHBondContact O-N 3.19Å; L99-Q102 PolarHBondContact O-N 3.44Å; L99-N103 WeakPolarHBondContact O-CB 3.28Å; L99-N103 VanDerWaalsContact O-CG 3.32Å; L99-N103 PolarHBondContact O-N 3.04Å
100	I	91.4	Very high	90.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-47.6	177.9	-73.2	169.3	0	0	0	111	M34 L37 F79 D96 V98 Q102 G104	M34-I100 HydrophobicContact CE-CD1 3.28Å; M34-I100 HydrophobicContact SD-CD1 3.6Å; M34-I100 HydrophobicContact SD-CG2 4.33Å; L37-I100 HydrophobicContact CB-CB 4.37Å; L37-I100 HydrophobicContact CB-CG1 4.31Å; L37-I100 HydrophobicContact CB-CG2 4.02Å; L37-I100 HydrophobicContact CD1-CG2 3.87Å; F79-I100 HydrophobicContact CE1-CG2 3.74Å; F79-I100 HydrophobicContact CZ-CG2 3.81Å; D96-I100 WeakPolarHBondContact O-CB 3.45Å; D96-I100 WeakPolarHBondContact O-CD1 3.41Å; D96-I100 WeakPolarHBondContact O-CG1 3.41Å; D96-I100 PolarHBondContact O-N 3.09Å; V98-I100 PolarHBondContact O-N 3.28Å; I100-Q102 VanDerWaalsContact C-N 3.34Å; I100-Q102 PolarHBondContact O-N 3.44Å; I100-G104 PolarHBondContact O-N 3.25Å
101	A	94.8	Very high	90.4	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-44.2	177.4	0	0	0	0	0	111.2	L87 T97 V98 G104 L105 L165	L87-A101 HydrophobicContact CD1-CB 3.89Å; T97-A101 VanDerWaalsContact O-CB 3.32Å; T97-A101 WeakPolarHBondContact O-CB 3.37Å; T97-A101 PolarHBondContact O-N 3.1Å; V98-A101 PolarHBondContact O-N 3.46Å; A101-G104 PolarHBondContact O-N 3.08Å; A101-L105 VanDerWaalsContact O-CG 3.3Å; A101-L105 WeakPolarHBondContact O-CG 3.42Å; A101-L105 PolarHBondContact O-N 3.23Å; A101-L165 HydrophobicContact CB-CD1 3.86Å; A101-L165 HydrophobicContact CB-CD2 4.28Å
102	Q	90.9	Very high	90.8	Very high	37 Å²	37	31.3 Å²	31.3	17%	0.173	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-50.6	179.6	179.8	-175.5	-53.9	0	0	111.6	V98 L99 I100 G104 L105 L106 L165	V98-Q102 VanDerWaalsContact O-CB 3.29Å; V98-Q102 WeakPolarHBondContact O-CB 3.5Å; V98-Q102 PolarHBondContact O-N 2.9Å; L99-Q102 PolarHBondContact O-N 3.44Å; I100-Q102 VanDerWaalsContact C-N 3.34Å; I100-Q102 PolarHBondContact O-N 3.44Å; Q102-G104 VanDerWaalsContact C-N 3.31Å; Q102-G104 PolarHBondContact O-N 3.5Å; Q102-L105 PolarHBondContact O-N 2.93Å; Q102-L106 PolarHBondContact O-N 2.92Å; Q102-L165 HydrophobicContact CB-CB 4.28Å; Q102-L165 HydrophobicContact CB-CD1 4.2Å
103	N	86.9	Confident	90.9	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-38.1	179.7	-70.5	-14.2	0	0	0	111.5	L37 V40 L99 L106 I107	L37-N103 HydrophobicContact CB-CB 4.49Å; L37-N103 HydrophobicContact CD2-CB 4.33Å; L37-N103 PolarHBondContact O-ND2 2.81Å; V40-N103 HydrophobicContact CB-CB 4.4Å; V40-N103 HydrophobicContact CG1-CB 4.44Å; L99-N103 WeakPolarHBondContact O-CB 3.28Å; L99-N103 VanDerWaalsContact O-CG 3.32Å; L99-N103 PolarHBondContact O-N 3.04Å; N103-L106 WeakPolarHBondContact O-CB 3.38Å; N103-L106 PolarHBondContact O-N 3.16Å; N103-I107 WeakPolarHBondContact O-CG1 3.39Å; N103-I107 PolarHBondContact O-N 2.84Å
104	G	91.6	Very high	91	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.1	-41.4	176.9	0	0	0	0	0	112.9	I100 A101 Q102 L106 I107 L108	I100-G104 PolarHBondContact O-N 3.25Å; A101-G104 PolarHBondContact O-N 3.08Å; Q102-G104 VanDerWaalsContact C-N 3.31Å; Q102-G104 PolarHBondContact O-N 3.5Å; G104-L106 VanDerWaalsContact C-N 3.32Å; G104-L106 PolarHBondContact O-N 2.94Å; G104-I107 PolarHBondContact O-N 3.36Å; G104-L108 VanDerWaalsContact O-CB 3.27Å; G104-L108 WeakPolarHBondContact O-CB 3.4Å; G104-L108 PolarHBondContact O-N 3.43Å
105	L	94.2	Very high	91.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.5	-37.3	173.9	-67.6	-179.3	0	0	0	111.7	L80 M84 A101 Q102 L108 R109 L149 L165 E168 A169 L172	L80-L105 HydrophobicContact CD1-CD2 4.21Å; M84-L105 HydrophobicContact CE-CD2 4.3Å; M84-L105 HydrophobicContact SD-CD1 4.14Å; M84-L105 HydrophobicContact SD-CD2 4Å; M84-L105 HydrophobicContact SD-CG 4.46Å; A101-L105 VanDerWaalsContact O-CG 3.3Å; A101-L105 WeakPolarHBondContact O-CG 3.42Å; A101-L105 PolarHBondContact O-N 3.23Å; Q102-L105 PolarHBondContact O-N 2.93Å; L105-L108 PolarHBondContact O-N 3.31Å; L105-R109 WeakPolarHBondContact O-CB 3.45Å; L105-R109 PolarHBondContact O-N 2.73Å; L105-L149 HydrophobicContact CD1-CD2 4.26Å; L105-L149 HydrophobicContact CD2-CD2 3.91Å; L105-L165 HydrophobicContact CD1-CD1 3.67Å; L105-E168 HydrophobicContact CB-CB 4.38Å; L105-E168 HydrophobicContact CB-CG 3.5Å; L105-E168 VanDerWaalsContact CB-CG 3.5Å; L105-A169 HydrophobicContact CD1-CB 4.14Å; L105-L172 HydrophobicContact CD2-CD2 3.66Å
106	L	87.1	Confident	91.2	Very high	12 Å²	12	16 Å²	16	6%	0.063	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-53	173.5	169.4	61.6	0	0	0	112.1	Q102 N103 G104 L108 R109 L110 E168 W236	Q102-L106 PolarHBondContact O-N 2.92Å; N103-L106 WeakPolarHBondContact O-CB 3.38Å; N103-L106 PolarHBondContact O-N 3.16Å; G104-L106 VanDerWaalsContact C-N 3.32Å; G104-L106 PolarHBondContact O-N 2.94Å; L106-L108 VanDerWaalsContact C-N 3.27Å; L106-L108 PolarHBondContact O-N 3.25Å; L106-R109 PolarHBondContact O-N 2.64Å; L106-L110 HydrophobicContact CD1-CD1 4.07Å; L106-L110 HydrophobicContact CD1-CG 4.24Å; L106-L110 HydrophobicContact CG-CD1 4.39Å; L106-L110 WeakPolarHBondContact O-CG 3.47Å; L106-L110 PolarHBondContact O-N 2.9Å; L106-E168 VanDerWaalsContact CA-OE1 3.28Å; L106-E168 WeakPolarHBondContact CA-OE1 3.45Å; L106-E168 HydrophobicContact CB-CG 4.29Å; L106-W236 HydrophobicContact CD1-CH2 3.76Å; L106-W236 HydrophobicContact CD1-CZ2 4.13Å
107	I	88.7	Confident	91.2	Very high	8 Å²	8	11.7 Å²	11.7	4%	0.041	6%	0.057	C	C	.	.	H	α-helix	trans	-60.4	-42.1	178.3	-72.4	161.6	0	0	0	110.3	F20 F36 L37 V40 L76 N103 G104 L110 S111	F20-I107 HydrophobicContact CD1-CG2 4.29Å; F20-I107 HydrophobicContact CE1-CG2 3.64Å; F20-I107 HydrophobicContact CZ-CG2 3.93Å; F36-I107 HydrophobicContact CE1-CD1 3.71Å; F36-I107 HydrophobicContact CE2-CD1 4.38Å; F36-I107 HydrophobicContact CZ-CD1 3.54Å; L37-I107 HydrophobicContact CD2-CD1 3.54Å; V40-I107 HydrophobicContact CG2-CD1 3.86Å; L76-I107 HydrophobicContact CD2-CG2 4.13Å; N103-I107 WeakPolarHBondContact O-CG1 3.39Å; N103-I107 PolarHBondContact O-N 2.84Å; G104-I107 PolarHBondContact O-N 3.36Å; I107-L110 PolarHBondContact O-N 3.21Å; I107-S111 WeakPolarHBondContact O-CB 3.19Å; I107-S111 PolarHBondContact O-N 3.04Å; I107-S111 PolarHBondContact O-OG 3.42Å
108	L	93.9	Very high	91.1	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62	-45	176.3	-179	60.3	0	0	0	111.4	I73 L76 I77 L80 G104 L105 L106 L110 S111 V112 L145 L172	I73-L108 HydrophobicContact CG2-CD1 4.02Å; L76-L108 HydrophobicContact CD2-CB 4.33Å; I77-L108 HydrophobicContact CD1-CD1 4.05Å; I77-L108 HydrophobicContact CD1-CD2 4.5Å; I77-L108 HydrophobicContact CG1-CD1 3.77Å; I77-L108 HydrophobicContact CG1-CD2 3.74Å; I77-L108 HydrophobicContact CG1-CG 4.44Å; L80-L108 HydrophobicContact CD1-CB 4.38Å; L80-L108 HydrophobicContact CD1-CD2 4.07Å; G104-L108 VanDerWaalsContact O-CB 3.27Å; G104-L108 WeakPolarHBondContact O-CB 3.4Å; G104-L108 PolarHBondContact O-N 3.43Å; L105-L108 PolarHBondContact O-N 3.31Å; L106-L108 VanDerWaalsContact C-N 3.27Å; L106-L108 PolarHBondContact O-N 3.25Å; L108-L110 PolarHBondContact O-N 3.22Å; L108-S111 PolarHBondContact O-N 3.45Å; L108-V112 HydrophobicContact CD1-CG2 3.79Å; L108-V112 HydrophobicContact CG-CG2 4.11Å; L108-V112 WeakPolarHBondContact O-CB 3.34Å; L108-V112 WeakPolarHBondContact O-CG2 3.31Å; L108-V112 PolarHBondContact O-N 2.87Å; L108-L145 HydrophobicContact CD2-CD2 4.07Å; L108-L172 HydrophobicContact CD2-CD1 4.44Å; L108-L172 HydrophobicContact CD2-CD2 3.74Å; L108-L172 HydrophobicContact CG-CD1 4.11Å; L108-L172 HydrophobicContact CG-CD2 4.24Å
109	R	92.2	Very high	91.1	Very high	16 Å²	16	15.4 Å²	15.4	6%	0.06	8%	0.075	C	C	.	.	H	α-helix	trans	-60.5	-45.3	178.8	-177.2	176.2	57.4	78.6	8.6	112	L105 L106 S111 V112 K113 E168 L172 V175	L105-R109 WeakPolarHBondContact O-CB 3.45Å; L105-R109 PolarHBondContact O-N 2.73Å; L106-R109 PolarHBondContact O-N 2.64Å; R109-S111 VanDerWaalsContact C-N 3.34Å; R109-V112 PolarHBondContact O-N 3.13Å; R109-K113 VanDerWaalsContact O-CB 3.25Å; R109-K113 WeakPolarHBondContact O-CB 3.5Å; R109-K113 PolarHBondContact O-N 3.39Å; R109-E168 WeakPolarHBondContact CB-OE1 3.35Å; R109-E168 WeakPolarHBondContact CD-OE1 3.18Å; R109-E168 IonicContact CZ-OE1 3.75Å; R109-E168 IonicContact CZ-OE2 3.39Å; R109-E168 IonicContact NE-OE1 3.78Å; R109-E168 PolarHBondContact NE-OE1 3.34Å; R109-E168 IonicContact NE-OE2 3.97Å; R109-E168 PolarHBondContact NE-OE2 2.86Å; R109-E168 IonicContact NH2-OE1 2.67Å; R109-E168 IonicContact NH2-OE2 3.3Å; R109-E168 PolarHBondContact NH2-OE2 3.11Å; R109-L172 HydrophobicContact CB-CB 4.39Å; R109-L172 HydrophobicContact CB-CD1 3.83Å; R109-L172 HydrophobicContact CG-CD1 4.36Å; R109-V175 HydrophobicContact CG-CB 4.14Å; R109-V175 HydrophobicContact CG-CG2 3.64Å
110	L	88.1	Confident	91.2	Very high	23 Å²	23	14.1 Å²	14.1	12%	0.12	7%	0.072	C	C	.	.	H	α-helix	trans	-62.6	-43	177	-66.2	174	0	0	0	111.4	F52 L106 I107 L108 Y114	F52-L110 HydrophobicContact CD1-CD1 3.72Å; F52-L110 HydrophobicContact CE1-CD1 3.52Å; L106-L110 HydrophobicContact CD1-CD1 4.07Å; L106-L110 HydrophobicContact CD1-CG 4.24Å; L106-L110 HydrophobicContact CG-CD1 4.39Å; L106-L110 WeakPolarHBondContact O-CG 3.47Å; L106-L110 PolarHBondContact O-N 2.9Å; I107-L110 PolarHBondContact O-N 3.21Å; L108-L110 PolarHBondContact O-N 3.22Å; L110-Y114 WeakPolarHBondContact O-CB 3.39Å; L110-Y114 PolarHBondContact O-N 3.09Å
111	S	92.3	Very high	91.1	Very high	3 Å²	3	16.4 Å²	16.4	2%	0.021	8%	0.082	C	C	.	.	H	α-helix	trans	-63.1	-49.5	177.5	-56.1	0	0	0	0	111.8	L63 I107 L108 R109 K113 Y114 L115	L63-S111 WeakPolarHBondContact CD2-OG 3.21Å; I107-S111 WeakPolarHBondContact O-CB 3.19Å; I107-S111 PolarHBondContact O-N 3.04Å; I107-S111 PolarHBondContact O-OG 3.42Å; L108-S111 PolarHBondContact O-N 3.45Å; R109-S111 VanDerWaalsContact C-N 3.34Å; S111-K113 PolarHBondContact O-N 3.05Å; S111-Y114 PolarHBondContact O-N 3.21Å; S111-L115 WeakPolarHBondContact O-CG 3.37Å; S111-L115 PolarHBondContact O-N 3.37Å
112	V	93.7	Very high	90.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.2	-45.4	179.7	172.9	0	0	0	0	110.6	L108 R109 Y114 L115 M116 F124 F128 L172 V175 F176	L108-V112 HydrophobicContact CD1-CG2 3.79Å; L108-V112 HydrophobicContact CG-CG2 4.11Å; L108-V112 WeakPolarHBondContact O-CB 3.34Å; L108-V112 WeakPolarHBondContact O-CG2 3.31Å; L108-V112 PolarHBondContact O-N 2.87Å; R109-V112 PolarHBondContact O-N 3.13Å; V112-Y114 PolarHBondContact O-N 2.93Å; V112-L115 PolarHBondContact O-N 3.31Å; V112-M116 WeakPolarHBondContact O-CB 3.5Å; V112-M116 PolarHBondContact O-N 3.49Å; V112-F124 HydrophobicContact CG1-CE2 4.09Å; V112-F124 HydrophobicContact CG1-CZ 4.06Å; V112-F128 HydrophobicContact CG2-CE1 4.22Å; V112-F128 HydrophobicContact CG2-CZ 4.04Å; V112-L172 HydrophobicContact CG2-CD1 4.4Å; V112-V175 HydrophobicContact CB-CG1 4.27Å; V112-V175 HydrophobicContact CG1-CG1 3.86Å; V112-F176 HydrophobicContact CB-CE1 4.42Å; V112-F176 HydrophobicContact CB-CZ 4.32Å; V112-F176 HydrophobicContact CG1-CD1 3.63Å; V112-F176 HydrophobicContact CG1-CD2 4.28Å; V112-F176 HydrophobicContact CG1-CE1 3.56Å; V112-F176 HydrophobicContact CG1-CE2 4.22Å; V112-F176 HydrophobicContact CG1-CG 3.99Å; V112-F176 HydrophobicContact CG1-CZ 3.87Å; V112-F176 HydrophobicContact CG2-CE1 3.87Å; V112-F176 HydrophobicContact CG2-CE2 3.95Å; V112-F176 HydrophobicContact CG2-CZ 3.44Å; V112-F176 VanDerWaalsContact CG2-CZ 3.44Å
113	K	91.5	Very high	90.8	Very high	4 Å²	4	22.1 Å²	22.1	2%	0.017	12%	0.119	C	C	.	.	H	α-helix	trans	-56.8	-49.9	177.1	178.9	-177.1	172.3	-73.7	0	111.1	E53 R109 S111 M116 E117 V175 I741 H742	E53-K113 IonicContact OE1-NZ 3.04Å; E53-K113 PolarHBondContact OE1-NZ 3.5Å; R109-K113 VanDerWaalsContact O-CB 3.25Å; R109-K113 WeakPolarHBondContact O-CB 3.5Å; R109-K113 PolarHBondContact O-N 3.39Å; S111-K113 PolarHBondContact O-N 3.05Å; K113-M116 WeakPolarHBondContact O-CB 3.47Å; K113-M116 PolarHBondContact O-N 2.89Å; K113-E117 WeakPolarHBondContact CE-OE1 3.45Å; K113-E117 IonicContact NZ-OE1 2.87Å; K113-E117 PolarHBondContact NZ-OE1 3.33Å; K113-E117 VanDerWaalsContact NZ-OE1 3.12Å; K113-E117 IonicContact NZ-OE2 3.65Å; K113-E117 PolarHBondContact NZ-OE2 3.33Å; K113-E117 WeakPolarHBondContact O-CG 3.32Å; K113-E117 PolarHBondContact O-N 3.49Å; K113-V175 HydrophobicContact CB-CG1 3.75Å; K113-I741 HydrophobicContact CD-CG2 4.07Å; K113-H742 WeakPolarHBondContact CE-O 3.33Å; K113-H742 PolarHBondContact NZ-O 3.38Å
114	Y	90.8	Very high	91.1	Very high	30 Å²	30	22.5 Å²	22.5	12%	0.118	12%	0.121	C	C	.	.	H	α-helix	trans	-61.8	-47.1	179.8	-175.9	-91.5	0	0	0	112	L60 K64 L110 S111 V112 M116 E117 H118	L60-Y114 HydrophobicContact CB-CD1 3.82Å; L60-Y114 HydrophobicContact CB-CD2 3.75Å; L60-Y114 HydrophobicContact CB-CE1 4.07Å; L60-Y114 HydrophobicContact CB-CE2 3.99Å; L60-Y114 HydrophobicContact CB-CG 3.66Å; L60-Y114 HydrophobicContact CD1-CD2 3.96Å; L60-Y114 HydrophobicContact CD1-CG 4.13Å; L60-Y114 HydrophobicContact CG-CD2 4.47Å; L60-Y114 HydrophobicContact CG-CG 4.37Å; L60-Y114 VanDerWaalsContact O-CE1 3.3Å; L60-Y114 WeakPolarHBondContact O-CE1 3.47Å; K64-Y114 HydrophobicContact CB-CD1 4.41Å; K64-Y114 HydrophobicContact CB-CE1 3.96Å; K64-Y114 HydrophobicContact CD-CE1 4.08Å; L110-Y114 WeakPolarHBondContact O-CB 3.39Å; L110-Y114 PolarHBondContact O-N 3.09Å; S111-Y114 PolarHBondContact O-N 3.21Å; V112-Y114 PolarHBondContact O-N 2.93Å; Y114-M116 VanDerWaalsContact C-N 3.29Å; Y114-M116 PolarHBondContact O-N 3.44Å; Y114-E117 PolarHBondContact O-N 2.99Å; Y114-E117 VanDerWaalsContact O-N 3.15Å; Y114-H118 AromaticContact CD2-CD2 3.55Å; Y114-H118 AromaticContact CD2-NE2 3.87Å; Y114-H118 HydrophobicContact CE1-CB 4.37Å; Y114-H118 AromaticContact CE1-CD2 3.97Å; Y114-H118 AromaticContact CE2-CD2 3.39Å; Y114-H118 WeakPolarHBondContact CE2-CD2 3.49Å; Y114-H118 AromaticContact CE2-NE2 3.49Å; Y114-H118 WeakPolarHBondContact CE2-NE2 3.31Å; Y114-H118 AromaticContact CG-CD2 3.91Å; Y114-H118 AromaticContact CZ-CD2 3.61Å; Y114-H118 AromaticContact CZ-NE2 3.98Å; Y114-H118 WeakPolarHBondContact O-CB 3.43Å; Y114-H118 PolarHBondContact O-CD2 3.35Å; Y114-H118 VanDerWaalsContact O-CD2 3.25Å; Y114-H118 PolarHBondContact O-N 2.94Å
115	L	93	Very high	91.1	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-60	-41.8	176.7	-69	180	0	0	0	111.7	K64 I73 S111 V112 E117 H118 C119 F124 H127 F128	K64-L115 HydrophobicContact CB-CD2 3.85Å; K64-L115 HydrophobicContact CG-CD2 3.84Å; I73-L115 HydrophobicContact CD1-CD1 3.6Å; S111-L115 WeakPolarHBondContact O-CG 3.37Å; S111-L115 PolarHBondContact O-N 3.37Å; V112-L115 PolarHBondContact O-N 3.31Å; L115-E117 VanDerWaalsContact C-N 3.3Å; L115-E117 PolarHBondContact O-N 2.77Å; L115-H118 PolarHBondContact O-N 3.47Å; L115-C119 WeakPolarHBondContact O-CB 3.49Å; L115-C119 PolarHBondContact O-N 2.98Å; L115-C119 PolarHBondContact O-SG 3.42Å; L115-F124 HydrophobicContact CB-CD2 3.86Å; L115-F124 HydrophobicContact CB-CE2 4.14Å; L115-H127 HydrophobicContact CD1-CB 3.76Å; L115-F128 HydrophobicContact CD1-CE2 4.47Å; L115-F128 HydrophobicContact CD1-CZ 4.44Å
116	M	91.1	Very high	91	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.015	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-32.5	177.5	-177.4	-172.6	67.8	0	0	112.4	V112 K113 Y114 F124 V175 S178 R179 Y182 F743	V112-M116 WeakPolarHBondContact O-CB 3.5Å; V112-M116 PolarHBondContact O-N 3.49Å; K113-M116 WeakPolarHBondContact O-CB 3.47Å; K113-M116 PolarHBondContact O-N 2.89Å; Y114-M116 VanDerWaalsContact C-N 3.29Å; Y114-M116 PolarHBondContact O-N 3.44Å; M116-F124 HydrophobicContact CB-CD2 4.37Å; M116-F124 HydrophobicContact CB-CE2 4.13Å; M116-V175 HydrophobicContact CE-CG1 4.39Å; M116-S178 WeakPolarHBondContact CE-OG 3.16Å; M116-S178 PolarHBondContact SD-OG 2.89Å; M116-R179 HydrophobicContact CG-CB 4.14Å; M116-R179 HydrophobicContact CG-CG 4.49Å; M116-R179 PolarHBondContact O-NH1 2.92Å; M116-R179 HydrophobicContact SD-CB 4Å; M116-R179 PolarHBondContact SD-N 3.13Å; M116-R179 VanDerWaalsContact SD-N 3.36Å; M116-Y182 HydrophobicContact CE-CE2 3.88Å; M116-Y182 HydrophobicContact SD-CE2 4.49Å; M116-F743 HydrophobicContact CE-CD1 4.31Å; M116-F743 HydrophobicContact CE-CE1 4.21Å
117	E	90.2	Very high	91.3	Very high	22 Å²	22	24.3 Å²	24.3	10%	0.103	13%	0.132	C	C	.	.	H	α-helix	trans	-80.3	-20.2	177.4	-74.4	174.2	155.9	0	0	113.4	K113 Y114 L115 Y182 F743 K744	K113-E117 WeakPolarHBondContact CE-OE1 3.45Å; K113-E117 IonicContact NZ-OE1 2.87Å; K113-E117 PolarHBondContact NZ-OE1 3.33Å; K113-E117 VanDerWaalsContact NZ-OE1 3.12Å; K113-E117 IonicContact NZ-OE2 3.65Å; K113-E117 PolarHBondContact NZ-OE2 3.33Å; K113-E117 WeakPolarHBondContact O-CG 3.32Å; K113-E117 PolarHBondContact O-N 3.49Å; Y114-E117 PolarHBondContact O-N 2.99Å; Y114-E117 VanDerWaalsContact O-N 3.15Å; L115-E117 VanDerWaalsContact C-N 3.3Å; L115-E117 PolarHBondContact O-N 2.77Å; E117-Y182 HydrophobicContact CG-CE1 4.4Å; E117-Y182 WeakPolarHBondContact CG-OH 3.38Å; E117-Y182 PolarHBondContact OE1-OH 2.7Å; E117-F743 WeakPolarHBondContact OE1-CA 3.5Å; E117-K744 HydrophobicContact CB-CB 4.48Å; E117-K744 HydrophobicContact CG-CB 4.07Å; E117-K744 PolarHBondContact OE1-N 3.35Å
118	H	90.5	Very high	91.5	Very high	75 Å²	75	24 Å²	24	35%	0.347	13%	0.13	S	C	.	.	H	α-helix	trans	-125.6	6.4	-168.8	-69.7	-76.7	0	0	0	115.2	K64 Y114 L115	K64-H118 HydrophobicContact CD-CB 4.27Å; K64-H118 PolarHBondContact NZ-O 3.34Å; Y114-H118 AromaticContact CD2-CD2 3.55Å; Y114-H118 AromaticContact CD2-NE2 3.87Å; Y114-H118 HydrophobicContact CE1-CB 4.37Å; Y114-H118 AromaticContact CE1-CD2 3.97Å; Y114-H118 AromaticContact CE2-CD2 3.39Å; Y114-H118 WeakPolarHBondContact CE2-CD2 3.49Å; Y114-H118 AromaticContact CE2-NE2 3.49Å; Y114-H118 WeakPolarHBondContact CE2-NE2 3.31Å; Y114-H118 AromaticContact CG-CD2 3.91Å; Y114-H118 AromaticContact CZ-CD2 3.61Å; Y114-H118 AromaticContact CZ-NE2 3.98Å; Y114-H118 WeakPolarHBondContact O-CB 3.43Å; Y114-H118 PolarHBondContact O-CD2 3.35Å; Y114-H118 VanDerWaalsContact O-CD2 3.25Å; Y114-H118 PolarHBondContact O-N 2.94Å; L115-H118 PolarHBondContact O-N 3.47Å
119	C	92	Very high	91	Very high	12 Å²	12	24.5 Å²	24.5	8%	0.081	13%	0.133	C	C	.	.	S	Bend	trans	-127.7	152	178.4	-58.2	0	0	0	0	111.7	L115 R123 F124 R179	L115-C119 WeakPolarHBondContact O-CB 3.49Å; L115-C119 PolarHBondContact O-N 2.98Å; L115-C119 PolarHBondContact O-SG 3.42Å; C119-R123 HydrophobicContact CB-CB 4.06Å; C119-R123 HydrophobicContact CB-CG 4.15Å; C119-F124 HydrophobicContact CB-CB 4.23Å; C119-R179 PolarHBondContact O-NH1 3.35Å; C119-R179 PolarHBondContact O-NH2 3.45Å
120	S	90.5	Very high	90.1	Very high	43 Å²	43	25.3 Å²	25.3	30%	0.301	14%	0.14	S	C	.	.			trans	-63.8	164.5	158.9	67.2	0	0	0	0	110.2	A122 R123 F124	S120-A122 PolarHBondContact O-N 2.96Å; S120-R123 PolarHBondContact O-N 2.97Å; S120-R123 VanDerWaalsContact OG-CB 3.31Å; S120-R123 WeakPolarHBondContact OG-CB 3.39Å; S120-R123 PolarHBondContact OG-N 3.34Å; S120-F124 WeakPolarHBondContact O-CB 3.3Å; S120-F124 PolarHBondContact O-N 2.95Å
121	E	88.3	Confident	89	Confident	50 Å²	50	31 Å²	31	23%	0.234	17%	0.171	C	C	.	.	H	α-helix	trans	-64	-43.1	-177.3	-175.5	164.1	-153.5	0	0	111.9	R123 F124 F125 K183 Q191	E121-R123 PolarHBondContact O-N 3.18Å; E121-F124 WeakPolarHBondContact O-CB 3.42Å; E121-F124 PolarHBondContact O-N 3.43Å; E121-F125 HydrophobicContact CG-CD2 4.04Å; E121-F125 HydrophobicContact CG-CE2 3.67Å; E121-F125 WeakPolarHBondContact O-CD2 3.41Å; E121-F125 PolarHBondContact O-N 3.47Å; E121-F125 VanDerWaalsContact O-N 3.09Å; E121-K183 IonicContact OE1-NZ 2.8Å; E121-K183 WeakPolarHBondContact OE2-CE 3.2Å; E121-K183 IonicContact OE2-NZ 2.57Å; E121-K183 PolarHBondContact OE2-NZ 3.49Å; E121-Q191 PolarHBondContact OE1-N 2.89Å
122	A	89	Confident	87.4	Confident	79 Å²	79	33 Å²	33	65%	0.653	19%	0.185	S	C	*	.	H	α-helix	trans	-60.7	-45.7	174.8	0	0	0	0	0	111.9	S120 F124 F125 S126	S120-A122 PolarHBondContact O-N 2.96Å; A122-F124 VanDerWaalsContact C-N 3.35Å; A122-F124 PolarHBondContact O-N 3.31Å; A122-F125 PolarHBondContact O-N 3.01Å; A122-S126 PolarHBondContact O-N 2.93Å; A122-S126 VanDerWaalsContact O-N 3.08Å
123	R	92	Very high	85.5	Confident	78 Å²	78	39.7 Å²	39.7	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-66	-36.8	178	-170.1	71.9	177.1	73.6	13.2	111.8	L68 C119 S120 E121 S126 H127	L68-R123 VanDerWaalsContact CD1-NH1 3.34Å; L68-R123 VanDerWaalsContact CG-NH1 3.26Å; C119-R123 HydrophobicContact CB-CB 4.06Å; C119-R123 HydrophobicContact CB-CG 4.15Å; S120-R123 PolarHBondContact O-N 2.97Å; S120-R123 VanDerWaalsContact OG-CB 3.31Å; S120-R123 WeakPolarHBondContact OG-CB 3.39Å; S120-R123 PolarHBondContact OG-N 3.34Å; E121-R123 PolarHBondContact O-N 3.18Å; R123-S126 PolarHBondContact NH1-OG 2.92Å; R123-S126 WeakPolarHBondContact O-CB 3.49Å; R123-S126 PolarHBondContact O-N 3.44Å; R123-S126 PolarHBondContact O-OG 2.87Å; R123-H127 PolarHBondContact NH1-CD2 3.45Å; R123-H127 PolarHBondContact NH1-CE1 3.03Å; R123-H127 PolarHBondContact NH1-NE2 3.4Å; R123-H127 PolarHBondContact O-CD2 2.97Å
124	F	93.2	Very high	83.8	Confident	13 Å²	13	46.7 Å²	46.7	6%	0.057	26%	0.261	C	S	.	.	H	α-helix	trans	-56.9	-50.3	172.3	174	-94.5	0	0	0	110.8	V112 L115 M116 C119 S120 E121 A122 S126 H127 F128 I142 F176 V192	V112-F124 HydrophobicContact CG1-CE2 4.09Å; V112-F124 HydrophobicContact CG1-CZ 4.06Å; L115-F124 HydrophobicContact CB-CD2 3.86Å; L115-F124 HydrophobicContact CB-CE2 4.14Å; M116-F124 HydrophobicContact CB-CD2 4.37Å; M116-F124 HydrophobicContact CB-CE2 4.13Å; C119-F124 HydrophobicContact CB-CB 4.23Å; S120-F124 WeakPolarHBondContact O-CB 3.3Å; S120-F124 PolarHBondContact O-N 2.95Å; E121-F124 WeakPolarHBondContact O-CB 3.42Å; E121-F124 PolarHBondContact O-N 3.43Å; A122-F124 VanDerWaalsContact C-N 3.35Å; A122-F124 PolarHBondContact O-N 3.31Å; F124-S126 VanDerWaalsContact C-N 3.3Å; F124-S126 PolarHBondContact O-N 3Å; F124-H127 WeakPolarHBondContact O-CB 3.4Å; F124-H127 PolarHBondContact O-N 3.43Å; F124-H127 VanDerWaalsContact O-N 3.17Å; F124-F128 HydrophobicContact CD1-CD2 4.48Å; F124-F128 AromaticContact CD1-CE2 4Å; F124-F128 HydrophobicContact CD1-CE2 4Å; F124-F128 HydrophobicContact CD2-CE2 4.05Å; F124-F128 HydrophobicContact CE1-CD2 4.27Å; F124-F128 AromaticContact CE1-CE2 3.62Å; F124-F128 HydrophobicContact CE1-CE2 3.62Å; F124-F128 HydrophobicContact CE1-CZ 4.26Å; F124-F128 AromaticContact CE2-CE2 3.69Å; F124-F128 HydrophobicContact CE2-CE2 3.69Å; F124-F128 AromaticContact CE2-CZ 3.96Å; F124-F128 HydrophobicContact CE2-CZ 3.96Å; F124-F128 HydrophobicContact CG-CE2 4.2Å; F124-F128 HydrophobicContact CZ-CD2 4.49Å; F124-F128 AromaticContact CZ-CE2 3.46Å; F124-F128 HydrophobicContact CZ-CE2 3.46Å; F124-F128 VanDerWaalsContact CZ-CE2 3.46Å; F124-F128 AromaticContact CZ-CZ 3.71Å; F124-F128 HydrophobicContact CZ-CZ 3.71Å; F124-F128 WeakPolarHBondContact O-CD2 3.35Å; F124-F128 WeakPolarHBondContact O-CE2 3.35Å; F124-I142 HydrophobicContact CE1-CD1 4.3Å; F124-F176 HydrophobicContact CZ-CD1 4.1Å; F124-F176 AromaticContact CZ-CE1 3.98Å; F124-F176 HydrophobicContact CZ-CE1 3.98Å; F124-V192 HydrophobicContact CE1-CG2 4.31Å
125	F	91.6	Very high	81.9	Confident	22 Å²	22	46.7 Å²	46.7	10%	0.096	27%	0.27	C	S	.	.	H	α-helix	trans	-64.3	-30.8	178.9	-77	-63.5	0	0	0	114.2	E121 A122 H127 F128 C138 L139 I142 Q191 V192	E121-F125 HydrophobicContact CG-CD2 4.04Å; E121-F125 HydrophobicContact CG-CE2 3.67Å; E121-F125 WeakPolarHBondContact O-CD2 3.41Å; E121-F125 PolarHBondContact O-N 3.47Å; E121-F125 VanDerWaalsContact O-N 3.09Å; A122-F125 PolarHBondContact O-N 3.01Å; F125-H127 PolarHBondContact O-N 3.42Å; F125-H127 VanDerWaalsContact O-N 3.12Å; F125-F128 PolarHBondContact O-N 2.88Å; F125-C138 HydrophobicContact CB-CB 4.19Å; F125-L139 HydrophobicContact CD1-CD2 4.2Å; F125-L139 HydrophobicContact CE1-CD2 3.53Å; F125-L139 HydrophobicContact CE1-CG 4.31Å; F125-L139 HydrophobicContact CZ-CD2 3.98Å; F125-I142 HydrophobicContact CD1-CD1 4.2Å; F125-I142 HydrophobicContact CE1-CD1 4.01Å; F125-Q191 HydrophobicContact CE2-CB 3.73Å; F125-Q191 HydrophobicContact CE2-CG 4.17Å; F125-Q191 HydrophobicContact CZ-CB 3.68Å; F125-Q191 HydrophobicContact CZ-CG 3.94Å; F125-V192 HydrophobicContact CE1-CG2 3.88Å; F125-V192 HydrophobicContact CZ-CG2 3.69Å
126	S	91.4	Very high	79.7	Confident	28 Å²	28	51.6 Å²	51.6	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-22.6	176.3	75.9	0	0	0	0	113.6	R71 A122 R123 F124 F128 S129	R71-S126 PolarHBondContact NH1-O 3.28Å; A122-S126 PolarHBondContact O-N 2.93Å; A122-S126 VanDerWaalsContact O-N 3.08Å; R123-S126 PolarHBondContact NH1-OG 2.92Å; R123-S126 WeakPolarHBondContact O-CB 3.49Å; R123-S126 PolarHBondContact O-N 3.44Å; R123-S126 PolarHBondContact O-OG 2.87Å; F124-S126 VanDerWaalsContact C-N 3.3Å; F124-S126 PolarHBondContact O-N 3Å; S126-F128 VanDerWaalsContact C-N 3.33Å; S126-S129 PolarHBondContact O-OG 2.91Å
127	H	94.2	Very high	78	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-12.4	176.4	-78.6	-65.1	0	0	0	114.6	K64 N67 P74 L115 R123 F124 F125	K64-H127 PolarHBondContact O-CE1 3.28Å; N67-H127 PolarHBondContact ND2-ND1 2.86Å; N67-H127 PolarHBondContact ND2-O 2.99Å; N67-H127 VanDerWaalsContact ND2-O 3.1Å; P74-H127 VanDerWaalsContact CD-O 3.29Å; P74-H127 WeakPolarHBondContact CD-O 3.35Å; L115-H127 HydrophobicContact CD1-CB 3.76Å; R123-H127 PolarHBondContact NH1-CD2 3.45Å; R123-H127 PolarHBondContact NH1-CE1 3.03Å; R123-H127 PolarHBondContact NH1-NE2 3.4Å; R123-H127 PolarHBondContact O-CD2 2.97Å; F124-H127 WeakPolarHBondContact O-CB 3.4Å; F124-H127 PolarHBondContact O-N 3.43Å; F124-H127 VanDerWaalsContact O-N 3.17Å; F125-H127 PolarHBondContact O-N 3.42Å; F125-H127 VanDerWaalsContact O-N 3.12Å
128	F	93	Very high	76.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.333	C	S	.	.	S	Bend	trans	-110.4	0.6	-178	-59	-89.7	0	0	0	112.9	I73 I77 V112 L115 F124 F125 S126 V130 I142 F176	I73-F128 HydrophobicContact CG2-CD1 4.04Å; I73-F128 HydrophobicContact CG2-CE1 3.71Å; I73-F128 HydrophobicContact CG2-CZ 4.42Å; I77-F128 HydrophobicContact CD1-CD1 3.58Å; I77-F128 HydrophobicContact CD1-CE1 3.79Å; V112-F128 HydrophobicContact CG2-CE1 4.22Å; V112-F128 HydrophobicContact CG2-CZ 4.04Å; L115-F128 HydrophobicContact CD1-CE2 4.47Å; L115-F128 HydrophobicContact CD1-CZ 4.44Å; F124-F128 HydrophobicContact CD1-CD2 4.48Å; F124-F128 AromaticContact CD1-CE2 4Å; F124-F128 HydrophobicContact CD1-CE2 4Å; F124-F128 HydrophobicContact CD2-CE2 4.05Å; F124-F128 HydrophobicContact CE1-CD2 4.27Å; F124-F128 AromaticContact CE1-CE2 3.62Å; F124-F128 HydrophobicContact CE1-CE2 3.62Å; F124-F128 HydrophobicContact CE1-CZ 4.26Å; F124-F128 AromaticContact CE2-CE2 3.69Å; F124-F128 HydrophobicContact CE2-CE2 3.69Å; F124-F128 AromaticContact CE2-CZ 3.96Å; F124-F128 HydrophobicContact CE2-CZ 3.96Å; F124-F128 HydrophobicContact CG-CE2 4.2Å; F124-F128 HydrophobicContact CZ-CD2 4.49Å; F124-F128 AromaticContact CZ-CE2 3.46Å; F124-F128 HydrophobicContact CZ-CE2 3.46Å; F124-F128 VanDerWaalsContact CZ-CE2 3.46Å; F124-F128 AromaticContact CZ-CZ 3.71Å; F124-F128 HydrophobicContact CZ-CZ 3.71Å; F124-F128 WeakPolarHBondContact O-CD2 3.35Å; F124-F128 WeakPolarHBondContact O-CE2 3.35Å; F125-F128 PolarHBondContact O-N 2.88Å; S126-F128 VanDerWaalsContact C-N 3.33Å; F128-V130 PolarHBondContact O-N 2.83Å; F128-I142 HydrophobicContact CB-CD1 4.1Å; F128-I142 HydrophobicContact CB-CG1 4.23Å; F128-I142 HydrophobicContact CD1-CD1 3.9Å; F128-I142 HydrophobicContact CD1-CG1 3.87Å; F128-I142 HydrophobicContact CD2-CD1 3.83Å; F128-I142 HydrophobicContact CE1-CD1 4.28Å; F128-I142 HydrophobicContact CE1-CG1 4.41Å; F128-I142 HydrophobicContact CE2-CD1 4.22Å; F128-I142 HydrophobicContact CG-CD1 3.67Å; F128-I142 HydrophobicContact CG-CG1 4Å; F128-I142 HydrophobicContact CZ-CD1 4.43Å; F128-F176 HydrophobicContact CE1-CE1 4.22Å; F128-F176 HydrophobicContact CE1-CZ 4.21Å; F128-F176 HydrophobicContact CZ-CE1 4.13Å; F128-F176 HydrophobicContact CZ-CZ 4.49Å
129	S	83.1	Confident	74.5	Confident	11 Å²	11	56.8 Å²	56.8	8%	0.077	33%	0.326	C	S	.	.			trans	-66	133.5	176.4	-28.7	0	0	0	0	111	R71 S126 C138	R71-S129 PolarHBondContact NH1-O 3.15Å; S126-S129 PolarHBondContact O-OG 2.91Å; S129-C138 PolarHBondContact OG-SG 3.1Å
130	V	72.3	Confident	73.7	Confident	33 Å²	33	57.8 Å²	57.8	20%	0.2	33%	0.333	C	S	.	.			trans	-106.9	140.5	170.1	176.8	0	0	0	0	108.5	P74 F128 S132 V141	P74-V130 HydrophobicContact CB-CG2 3.76Å; P74-V130 HydrophobicContact CG-CG2 4.48Å; F128-V130 PolarHBondContact O-N 2.83Å; V130-S132 PolarHBondContact O-N 3.25Å; V130-V141 HydrophobicContact CB-CG2 4.36Å; V130-V141 HydrophobicContact CG2-CG2 3.29Å
131	N	65.7	Low	73.6	Confident	143 Å²	143	56 Å²	56	77%	0.765	32%	0.32	S	S	*	.			trans	-66.1	114.3	173.9	-66.9	-18.9	0	0	0	109
132	S	57.7	Low	73.6	Confident	45 Å²	45	53.8 Å²	53.8	32%	0.315	31%	0.309	S	S	.	.			trans	-123.2	142.3	174.3	172.3	0	0	0	0	109	V130 E134 G135	V130-S132 PolarHBondContact O-N 3.25Å; S132-E134 PolarHBondContact O-N 3.44Å; S132-E134 VanDerWaalsContact O-N 3.16Å; S132-E134 PolarHBondContact OG-N 3.17Å; S132-G135 WeakPolarHBondContact CB-O 3.17Å; S132-G135 PolarHBondContact O-N 3.02Å; S132-G135 VanDerWaalsContact O-N 3.12Å
133	P	55.5	Low	73.5	Confident	141 Å²	141	52.2 Å²	52.2	92%	0.916	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.8	173.5	22.9	-31.7	0	0	0	113.2
134	E	54.2	Low	73.5	Confident	150 Å²	150	51.4 Å²	51.4	70%	0.701	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	13.9	178	-61.7	-176.2	-166.8	0	0	114	S132 R137	S132-E134 PolarHBondContact O-N 3.44Å; S132-E134 VanDerWaalsContact O-N 3.16Å; S132-E134 PolarHBondContact OG-N 3.17Å; E134-R137 IonicContact OE2-CZ 3.9Å; E134-R137 IonicContact OE2-NH2 2.7Å; E134-R137 PolarHBondContact OE2-NH2 3.45Å
135	G	51.8	Low	73.6	Confident	30 Å²	30	50.8 Å²	50.8	31%	0.309	29%	0.292	S	S	.	.			trans	93.9	168.9	-179	0	0	0	0	0	114.4	S132 R137	S132-G135 WeakPolarHBondContact CB-O 3.17Å; S132-G135 PolarHBondContact O-N 3.02Å; S132-G135 VanDerWaalsContact O-N 3.12Å; G135-R137 PolarHBondContact O-N 3.39Å
136	P	47.4	Very low	73.9	Confident	106 Å²	106	50 Å²	50	69%	0.688	29%	0.288	S	S	*	.			trans	-69.6	112.4	-173.3	26.9	-32.9	0	0	0	111.7
137	R	53.4	Low	74.1	Confident	135 Å²	135	49.7 Å²	49.7	51%	0.509	29%	0.285	S	S	.	.			trans	-99.1	73	171.1	-59.6	-175.5	-173	177.9	-1.4	110.5	E134 G135 L139 S140	E134-R137 IonicContact OE2-CZ 3.9Å; E134-R137 IonicContact OE2-NH2 2.7Å; E134-R137 PolarHBondContact OE2-NH2 3.45Å; G135-R137 PolarHBondContact O-N 3.39Å; R137-L139 VanDerWaalsContact C-N 3.28Å; R137-L139 PolarHBondContact O-N 2.95Å; R137-S140 VanDerWaalsContact O-CB 3.31Å; R137-S140 WeakPolarHBondContact O-CB 3.5Å; R137-S140 PolarHBondContact O-N 2.89Å; R137-S140 PolarHBondContact O-OG 3.33Å
138	C	51	Low	74.3	Confident	37 Å²	37	50.6 Å²	50.6	25%	0.25	29%	0.291	C	S	.	.	H	α-helix	trans	-54.2	-38.6	-175.4	-61.3	0	0	0	0	114.4	F125 S129 S140	F125-C138 HydrophobicContact CB-CB 4.19Å; S129-C138 PolarHBondContact OG-SG 3.1Å; C138-S140 VanDerWaalsContact C-N 3.32Å
139	L	57.3	Low	74.6	Confident	37 Å²	37	50.6 Å²	50.6	19%	0.194	29%	0.291	C	S	.	.	H	α-helix	trans	-75	-19.1	178.4	-79.3	159.3	0	0	0	113.2	F125 R137 V141 I142 E143 Q191	F125-L139 HydrophobicContact CD1-CD2 4.2Å; F125-L139 HydrophobicContact CE1-CD2 3.53Å; F125-L139 HydrophobicContact CE1-CG 4.31Å; F125-L139 HydrophobicContact CZ-CD2 3.98Å; R137-L139 VanDerWaalsContact C-N 3.28Å; R137-L139 PolarHBondContact O-N 2.95Å; L139-V141 VanDerWaalsContact C-N 3.34Å; L139-V141 PolarHBondContact O-N 3.39Å; L139-I142 PolarHBondContact O-N 3.33Å; L139-E143 HydrophobicContact CB-CG 4.21Å; L139-E143 WeakPolarHBondContact O-CB 3.47Å; L139-E143 WeakPolarHBondContact O-CG 3.45Å; L139-E143 PolarHBondContact O-N 2.9Å; L139-Q191 HydrophobicContact CD1-CG 4.22Å; L139-Q191 HydrophobicContact CD2-CG 4Å
140	S	75.8	Confident	75.3	Confident	33 Å²	33	50 Å²	50	23%	0.231	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-39.4	-168.4	63	0	0	0	0	113.8	R137 C138 C144	R137-S140 VanDerWaalsContact O-CB 3.31Å; R137-S140 WeakPolarHBondContact O-CB 3.5Å; R137-S140 PolarHBondContact O-N 2.89Å; R137-S140 PolarHBondContact O-OG 3.33Å; C138-S140 VanDerWaalsContact C-N 3.32Å; S140-C144 WeakPolarHBondContact O-CB 3.17Å; S140-C144 PolarHBondContact O-N 3.19Å; S140-C144 PolarHBondContact O-SG 3.35Å
141	V	86.8	Confident	76.6	Confident	6 Å²	6	54.8 Å²	54.8	4%	0.036	30%	0.301	C	S	.	.	H	α-helix	trans	-73.2	-44.7	-178.2	178.1	0	0	0	0	111.3	P74 I77 V130 L139 C144 L145	P74-V141 HydrophobicContact CB-CG1 4.48Å; P74-V141 HydrophobicContact CB-CG2 4.39Å; I77-V141 HydrophobicContact CB-CG1 3.61Å; I77-V141 HydrophobicContact CD1-CG1 3.89Å; I77-V141 HydrophobicContact CG1-CG1 4.37Å; I77-V141 HydrophobicContact CG2-CG1 3.29Å; V130-V141 HydrophobicContact CB-CG2 4.36Å; V130-V141 HydrophobicContact CG2-CG2 3.29Å; L139-V141 VanDerWaalsContact C-N 3.34Å; L139-V141 PolarHBondContact O-N 3.39Å; V141-C144 PolarHBondContact O-N 3.45Å; V141-L145 WeakPolarHBondContact O-CB 3.48Å; V141-L145 PolarHBondContact O-N 3.05Å
142	I	88.9	Confident	78.1	Confident	2 Å²	2	48 Å²	48	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-64	-43.4	176.2	-63.3	175.8	0	0	0	110.2	F124 F125 F128 L139 C144 L145 F146 F176 V192	F124-I142 HydrophobicContact CE1-CD1 4.3Å; F125-I142 HydrophobicContact CD1-CD1 4.2Å; F125-I142 HydrophobicContact CE1-CD1 4.01Å; F128-I142 HydrophobicContact CB-CD1 4.1Å; F128-I142 HydrophobicContact CB-CG1 4.23Å; F128-I142 HydrophobicContact CD1-CD1 3.9Å; F128-I142 HydrophobicContact CD1-CG1 3.87Å; F128-I142 HydrophobicContact CD2-CD1 3.83Å; F128-I142 HydrophobicContact CE1-CD1 4.28Å; F128-I142 HydrophobicContact CE1-CG1 4.41Å; F128-I142 HydrophobicContact CE2-CD1 4.22Å; F128-I142 HydrophobicContact CG-CD1 3.67Å; F128-I142 HydrophobicContact CG-CG1 4Å; F128-I142 HydrophobicContact CZ-CD1 4.43Å; L139-I142 PolarHBondContact O-N 3.33Å; I142-C144 PolarHBondContact O-N 3.2Å; I142-L145 WeakPolarHBondContact O-CB 3.46Å; I142-L145 PolarHBondContact O-N 2.87Å; I142-L145 VanDerWaalsContact O-N 3.1Å; I142-F146 HydrophobicContact CG2-CD2 3.69Å; I142-F146 HydrophobicContact CG2-CE2 3.62Å; I142-F146 WeakPolarHBondContact O-CD2 3.15Å; I142-F146 PolarHBondContact O-N 3.08Å; I142-F146 VanDerWaalsContact O-N 3.12Å; I142-F176 HydrophobicContact CD1-CE1 4.09Å; I142-F176 HydrophobicContact CG1-CE1 4.34Å; I142-V192 HydrophobicContact CG2-CG1 4.38Å
143	E	87.1	Confident	80.1	Confident	47 Å²	47	45.8 Å²	45.8	22%	0.22	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-24.9	175.4	-77.7	-178.2	-179.8	0	0	113.7	L139 P147 S195 K200	L139-E143 HydrophobicContact CB-CG 4.21Å; L139-E143 WeakPolarHBondContact O-CB 3.47Å; L139-E143 WeakPolarHBondContact O-CG 3.45Å; L139-E143 PolarHBondContact O-N 2.9Å; E143-P147 WeakPolarHBondContact O-CD 3.42Å; E143-P147 VanDerWaalsContact O-CG 3.29Å; E143-P147 WeakPolarHBondContact O-CG 3.41Å; E143-S195 WeakPolarHBondContact CG-OG 3.49Å; E143-K200 IonicContact OE2-NZ 3.87Å; E143-K200 PolarHBondContact OE2-NZ 3.16Å
144	C	91.7	Very high	82.1	Confident	61 Å²	61	39.7 Å²	39.7	41%	0.412	21%	0.21	S	C	.	.	H	α-helix	trans	-85.4	-32.9	171.7	-67.7	0	0	0	0	112.1	I81 S140 V141 I142 V148	I81-C144 HydrophobicContact CD1-CB 3.98Å; S140-C144 WeakPolarHBondContact O-CB 3.17Å; S140-C144 PolarHBondContact O-N 3.19Å; S140-C144 PolarHBondContact O-SG 3.35Å; V141-C144 PolarHBondContact O-N 3.45Å; I142-C144 PolarHBondContact O-N 3.2Å; C144-V148 WeakPolarHBondContact O-CG2 3.44Å
145	L	96.6	Very high	84.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-49.6	-179.3	174.5	60.1	0	0	0	112.3	I77 I81 M84 L108 V141 I142 V148 L149 F176	I77-L145 HydrophobicContact CD1-CD2 4.38Å; I77-L145 HydrophobicContact CG1-CD2 4.36Å; I77-L145 HydrophobicContact CG2-CB 3.89Å; I77-L145 HydrophobicContact CG2-CD1 4.08Å; I77-L145 HydrophobicContact CG2-CD2 4.02Å; I77-L145 HydrophobicContact CG2-CG 4.2Å; I81-L145 HydrophobicContact CD1-CB 4.34Å; I81-L145 HydrophobicContact CG1-CD1 4.32Å; M84-L145 HydrophobicContact CE-CD1 3.7Å; L108-L145 HydrophobicContact CD2-CD2 4.07Å; V141-L145 WeakPolarHBondContact O-CB 3.48Å; V141-L145 PolarHBondContact O-N 3.05Å; I142-L145 WeakPolarHBondContact O-CB 3.46Å; I142-L145 PolarHBondContact O-N 2.87Å; I142-L145 VanDerWaalsContact O-N 3.1Å; L145-V148 PolarHBondContact O-N 3.24Å; L145-V148 VanDerWaalsContact O-N 3.09Å; L145-L149 HydrophobicContact CD1-CD1 3.92Å; L145-L149 HydrophobicContact CD1-CD2 4.32Å; L145-L149 HydrophobicContact CD1-CG 3.81Å; L145-L149 HydrophobicContact CD2-CD1 4.23Å; L145-L149 HydrophobicContact CG-CD1 3.72Å; L145-L149 HydrophobicContact CG-CG 4.1Å; L145-L149 PolarHBondContact O-N 3.13Å; L145-F176 HydrophobicContact CD2-CE2 3.85Å; L145-F176 HydrophobicContact CD2-CZ 4.12Å
146	F	96.7	Very high	86.3	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.018	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-45.1	-174.7	-89.1	-83.7	0	0	0	114.3	I142 V148 L149 F150 C173 F176 V192 V196 C201	I142-F146 HydrophobicContact CG2-CD2 3.69Å; I142-F146 HydrophobicContact CG2-CE2 3.62Å; I142-F146 WeakPolarHBondContact O-CD2 3.15Å; I142-F146 PolarHBondContact O-N 3.08Å; I142-F146 VanDerWaalsContact O-N 3.12Å; F146-V148 PolarHBondContact O-N 3.38Å; F146-L149 PolarHBondContact O-N 2.95Å; F146-F150 HydrophobicContact CD1-CE1 4.05Å; F146-F150 HydrophobicContact CD1-CZ 4.1Å; F146-F150 WeakPolarHBondContact O-CB 3.44Å; F146-F150 WeakPolarHBondContact O-CG 3.49Å; F146-F150 PolarHBondContact O-N 3.08Å; F146-C173 HydrophobicContact CE1-CB 4.37Å; F146-F176 HydrophobicContact CE2-CB 4.14Å; F146-F176 HydrophobicContact CE2-CD2 4.28Å; F146-F176 HydrophobicContact CE2-CG 4.1Å; F146-F176 HydrophobicContact CZ-CB 3.55Å; F146-F176 HydrophobicContact CZ-CD2 4.13Å; F146-F176 AromaticContact CZ-CG 3.94Å; F146-F176 HydrophobicContact CZ-CG 3.94Å; F146-V192 HydrophobicContact CE2-CG1 3.54Å; F146-V192 HydrophobicContact CZ-CG1 3.77Å; F146-V196 HydrophobicContact CB-CG2 4.36Å; F146-V196 HydrophobicContact CD1-CG1 4.38Å; F146-V196 HydrophobicContact CD1-CG2 3.47Å; F146-V196 VanDerWaalsContact CD1-CG2 3.47Å; F146-V196 HydrophobicContact CD2-CG2 3.73Å; F146-V196 HydrophobicContact CE1-CG1 4.47Å; F146-V196 HydrophobicContact CE1-CG2 3.44Å; F146-V196 VanDerWaalsContact CE1-CG2 3.44Å; F146-V196 HydrophobicContact CE2-CG2 3.71Å; F146-V196 HydrophobicContact CG-CG2 3.6Å; F146-V196 HydrophobicContact CZ-CG2 3.55Å; F146-C201 VanDerWaalsContact CB-SG 3.54Å
147	P	96.8	Very high	88.6	Confident	22 Å²	22	33.5 Å²	33.5	14%	0.143	17%	0.173	C	C	.	.	H	α-helix	trans	-57.6	-35.8	174.1	-27.4	34.8	0	0	0	113.1	E143 R151 K200 C201 L204	E143-P147 WeakPolarHBondContact O-CD 3.42Å; E143-P147 VanDerWaalsContact O-CG 3.29Å; E143-P147 WeakPolarHBondContact O-CG 3.41Å; P147-R151 WeakPolarHBondContact O-CB 3.44Å; P147-R151 WeakPolarHBondContact O-CG 3.26Å; P147-R151 PolarHBondContact O-N 3.27Å; P147-K200 HydrophobicContact CG-CB 4.17Å; P147-C201 VanDerWaalsContact CD-SG 3.56Å; P147-L204 HydrophobicContact CB-CD1 4.24Å
148	V	98.1	Very high	90.6	Very high	19 Å²	19	28 Å²	28	12%	0.115	15%	0.153	C	C	.	.	H	α-helix	trans	-73.7	-42.3	178.1	-179.6	0	0	0	0	110.9	I81 M84 I88 C144 L145 F146 F150 R151 L152	I81-V148 HydrophobicContact CG1-CG2 4.4Å; I81-V148 HydrophobicContact CG2-CG2 4.12Å; M84-V148 HydrophobicContact CB-CG1 3.69Å; M84-V148 HydrophobicContact CE-CG1 3.9Å; M84-V148 HydrophobicContact SD-CG1 4.49Å; I88-V148 HydrophobicContact CD1-CG1 4.29Å; C144-V148 WeakPolarHBondContact O-CG2 3.44Å; L145-V148 PolarHBondContact O-N 3.24Å; L145-V148 VanDerWaalsContact O-N 3.09Å; F146-V148 PolarHBondContact O-N 3.38Å; V148-F150 VanDerWaalsContact C-N 3.35Å; V148-F150 PolarHBondContact O-N 3.31Å; V148-R151 PolarHBondContact O-N 2.85Å; V148-L152 WeakPolarHBondContact O-CB 3.41Å; V148-L152 PolarHBondContact O-N 3.14Å
149	L	98.6	Very high	92.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-44.8	173.1	-73.3	172.9	0	0	0	111.7	M84 L105 L145 F146 L152 I153 A169 L172	M84-L149 HydrophobicContact CE-CD2 4.11Å; M84-L149 HydrophobicContact SD-CD2 3.76Å; L105-L149 HydrophobicContact CD1-CD2 4.26Å; L105-L149 HydrophobicContact CD2-CD2 3.91Å; L145-L149 HydrophobicContact CD1-CD1 3.92Å; L145-L149 HydrophobicContact CD1-CD2 4.32Å; L145-L149 HydrophobicContact CD1-CG 3.81Å; L145-L149 HydrophobicContact CD2-CD1 4.23Å; L145-L149 HydrophobicContact CG-CD1 3.72Å; L145-L149 HydrophobicContact CG-CG 4.1Å; L145-L149 PolarHBondContact O-N 3.13Å; F146-L149 PolarHBondContact O-N 2.95Å; L149-L152 WeakPolarHBondContact O-CB 3.2Å; L149-L152 PolarHBondContact O-N 3.33Å; L149-I153 VanDerWaalsContact O-CG1 3.32Å; L149-I153 WeakPolarHBondContact O-CG1 3.37Å; L149-I153 PolarHBondContact O-N 2.77Å; L149-A169 HydrophobicContact CD2-CB 4.1Å; L149-L172 HydrophobicContact CD1-CD2 3.99Å; L149-L172 HydrophobicContact CD1-CG 4.46Å; L149-L172 HydrophobicContact CD2-CD2 4.29Å
150	F	98.5	Very high	94.1	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-41.8	178.4	-73.1	1.1	0	0	0	111.4	F146 V148 L152 I153 T154 V196 C201 L204 L208 Y344	F146-F150 HydrophobicContact CD1-CE1 4.05Å; F146-F150 HydrophobicContact CD1-CZ 4.1Å; F146-F150 WeakPolarHBondContact O-CB 3.44Å; F146-F150 WeakPolarHBondContact O-CG 3.49Å; F146-F150 PolarHBondContact O-N 3.08Å; V148-F150 VanDerWaalsContact C-N 3.35Å; V148-F150 PolarHBondContact O-N 3.31Å; F150-L152 VanDerWaalsContact C-N 3.34Å; F150-L152 PolarHBondContact O-N 2.86Å; F150-I153 PolarHBondContact O-N 3.48Å; F150-T154 WeakPolarHBondContact O-CG2 3.18Å; F150-T154 PolarHBondContact O-N 3.2Å; F150-T154 PolarHBondContact O-OG1 2.86Å; F150-T154 VanDerWaalsContact O-OG1 3.1Å; F150-V196 HydrophobicContact CE2-CG1 3.99Å; F150-V196 HydrophobicContact CZ-CG1 3.74Å; F150-C201 HydrophobicContact CD2-CB 3.85Å; F150-C201 HydrophobicContact CE2-CB 3.68Å; F150-L204 HydrophobicContact CB-CD1 3.85Å; F150-L204 HydrophobicContact CD2-CB 4.48Å; F150-L204 HydrophobicContact CD2-CD1 4.29Å; F150-L208 HydrophobicContact CB-CD1 4.34Å; F150-L208 HydrophobicContact CD1-CD1 4.13Å; F150-L208 HydrophobicContact CD1-CD2 3.96Å; F150-L208 HydrophobicContact CD2-CD2 3.71Å; F150-L208 HydrophobicContact CE1-CD2 3.83Å; F150-L208 HydrophobicContact CE2-CD2 3.58Å; F150-L208 HydrophobicContact CG-CD1 4.16Å; F150-L208 HydrophobicContact CG-CD2 3.9Å; F150-L208 HydrophobicContact CZ-CD2 3.64Å; F150-Y344 HydrophobicContact CE2-CE1 4.34Å; F150-Y344 WeakPolarHBondContact CE2-OH 3.36Å
151	R	98.5	Very high	94.7	Very high	132 Å²	132	33.9 Å²	33.9	50%	0.498	18%	0.177	S	C	.	.	H	α-helix	trans	-64.5	-36	173.4	-74.6	174.6	-179.8	-155.2	0.7	112.7	I88 P147 V148 T154 N155	I88-R151 HydrophobicContact CD1-CB 3.93Å; P147-R151 WeakPolarHBondContact O-CB 3.44Å; P147-R151 WeakPolarHBondContact O-CG 3.26Å; P147-R151 PolarHBondContact O-N 3.27Å; V148-R151 PolarHBondContact O-N 2.85Å; R151-T154 WeakPolarHBondContact CA-OG1 3.31Å; R151-T154 PolarHBondContact O-N 2.94Å; R151-T154 PolarHBondContact O-OG1 3.14Å; R151-N155 WeakPolarHBondContact O-CA 3.25Å; R151-N155 WeakPolarHBondContact O-CB 3.28Å; R151-N155 PolarHBondContact O-N 3.16Å
152	L	98.5	Very high	95	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-50.6	172	-177.8	151.4	0	0	0	109.8	M84 I88 V148 L149 F150 T154 L156 L165 H166 A169	M84-L152 HydrophobicContact CB-CD1 3.91Å; M84-L152 HydrophobicContact CG-CD1 3.52Å; M84-L152 HydrophobicContact SD-CD1 3.63Å; I88-L152 HydrophobicContact CD1-CB 4.03Å; I88-L152 HydrophobicContact CG1-CB 4.33Å; V148-L152 WeakPolarHBondContact O-CB 3.41Å; V148-L152 PolarHBondContact O-N 3.14Å; L149-L152 WeakPolarHBondContact O-CB 3.2Å; L149-L152 PolarHBondContact O-N 3.33Å; F150-L152 VanDerWaalsContact C-N 3.34Å; F150-L152 PolarHBondContact O-N 2.86Å; L152-T154 VanDerWaalsContact C-N 3.29Å; L152-T154 PolarHBondContact O-N 3.07Å; L152-L156 HydrophobicContact CD2-CD2 4.33Å; L152-L156 HydrophobicContact CG-CB 4.36Å; L152-L156 HydrophobicContact CG-CD2 4.1Å; L152-L156 WeakPolarHBondContact O-CB 3.14Å; L152-L156 PolarHBondContact O-N 3.23Å; L152-L156 VanDerWaalsContact O-N 3.09Å; L152-L165 HydrophobicContact CD1-CD1 4.35Å; L152-L165 HydrophobicContact CD1-CD2 4.2Å; L152-L165 HydrophobicContact CD1-CG 4.27Å; L152-L165 HydrophobicContact CD2-CG 4.4Å; L152-H166 PolarHBondContact O-CE1 2.97Å; L152-A169 HydrophobicContact CD2-CB 3.95Å
153	I	98.6	Very high	95.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.1	-42.4	178.9	-69.8	167.8	0	0	0	111.1	L149 F150 A169 L208 R211 L212	L149-I153 VanDerWaalsContact O-CG1 3.32Å; L149-I153 WeakPolarHBondContact O-CG1 3.37Å; L149-I153 PolarHBondContact O-N 2.77Å; F150-I153 PolarHBondContact O-N 3.48Å; I153-A169 HydrophobicContact CD1-CB 4.29Å; I153-A169 HydrophobicContact CG1-CB 4.09Å; I153-L208 HydrophobicContact CB-CD1 4.33Å; I153-L208 HydrophobicContact CG2-CD1 3.89Å; I153-R211 HydrophobicContact CG2-CG 3.95Å; I153-R211 WeakPolarHBondContact O-CG 3.47Å; I153-L212 HydrophobicContact CG2-CD2 4.4Å
154	T	98.1	Very high	95.2	Very high	12 Å²	12	32.8 Å²	32.8	7%	0.074	17%	0.172	C	C	.	.	H	α-helix	trans	-82.3	-40.4	-174.7	59.3	0	0	0	0	114.2	F150 R151 L152 A207 L208 R211	F150-T154 WeakPolarHBondContact O-CG2 3.18Å; F150-T154 PolarHBondContact O-N 3.2Å; F150-T154 PolarHBondContact O-OG1 2.86Å; F150-T154 VanDerWaalsContact O-OG1 3.1Å; R151-T154 WeakPolarHBondContact CA-OG1 3.31Å; R151-T154 PolarHBondContact O-N 2.94Å; R151-T154 PolarHBondContact O-OG1 3.14Å; L152-T154 VanDerWaalsContact C-N 3.29Å; L152-T154 PolarHBondContact O-N 3.07Å; T154-A207 HydrophobicContact CG2-CB 4.05Å; T154-L208 HydrophobicContact CG2-CB 4.41Å; T154-L208 HydrophobicContact CG2-CD1 4.21Å; T154-R211 HydrophobicContact CG2-CB 4.1Å; T154-R211 PolarHBondContact O-NE 3.47Å; T154-R211 PolarHBondContact O-NH2 3.46Å
155	N	97.1	Very high	95.3	Very high	91 Å²	91	29.9 Å²	29.9	49%	0.487	15%	0.152	S	C	.	.	H	α-helix	trans	-104.8	-28.2	-165.2	-57.1	-3.5	0	0	0	113.6	I88 R151 P157	I88-N155 HydrophobicContact CG2-CB 4.08Å; R151-N155 WeakPolarHBondContact O-CA 3.25Å; R151-N155 WeakPolarHBondContact O-CB 3.28Å; R151-N155 PolarHBondContact O-N 3.16Å; N155-P157 WeakPolarHBondContact O-CD 3.39Å
156	L	97.5	Very high	95.3	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.152	C	C	.	.	S	Bend	trans	-70.8	127.5	175.6	-172.3	68.1	0	0	0	108.9	L87 I93 L152 T162 L165 H166	L87-L156 HydrophobicContact CB-CD1 4.18Å; I93-L156 HydrophobicContact CD1-CD1 4.03Å; I93-L156 HydrophobicContact CG1-CD1 4.37Å; L152-L156 HydrophobicContact CD2-CD2 4.33Å; L152-L156 HydrophobicContact CG-CB 4.36Å; L152-L156 HydrophobicContact CG-CD2 4.1Å; L152-L156 WeakPolarHBondContact O-CB 3.14Å; L152-L156 PolarHBondContact O-N 3.23Å; L152-L156 VanDerWaalsContact O-N 3.09Å; L156-T162 HydrophobicContact CD2-CG2 4.01Å; L156-T162 HydrophobicContact CG-CG2 4.25Å; L156-L165 HydrophobicContact CD2-CD2 3.76Å; L156-H166 PolarHBondContact O-CE1 3.49Å; L156-H166 PolarHBondContact O-NE2 2.79Å
157	P	96	Very high	95.1	Very high	65 Å²	65	29.9 Å²	29.9	42%	0.422	15%	0.153	S	C	.	.			trans	-61.9	136.4	175.6	-24.8	35	0	0	0	112.3	I93 N155 Q159 T162	I93-P157 HydrophobicContact CD1-CB 4.43Å; I93-P157 HydrophobicContact CD1-CG 4.26Å; N155-P157 WeakPolarHBondContact O-CD 3.39Å; P157-Q159 HydrophobicContact CB-CG 4.29Å; P157-Q159 PolarHBondContact O-N 3.14Å; P157-T162 PolarHBondContact O-OG1 3.07Å
158	I	95.1	Very high	94.9	Very high	20 Å²	20	29.1 Å²	29.1	10%	0.103	15%	0.147	C	C	.	.			trans	-81.6	107	173.9	-58.5	161.2	0	0	0	108.5	Y163 N215 L303	I158-Y163 HydrophobicContact CG2-CD2 4.26Å; I158-N215 WeakPolarHBondContact CD1-OD1 3.5Å; I158-L303 HydrophobicContact CD1-CD2 3.94Å; I158-L303 HydrophobicContact CG1-CD2 4.34Å; I158-L303 HydrophobicContact CG2-CD2 3.91Å
159	Q	92.8	Very high	94.9	Very high	92 Å²	92	28.2 Å²	28.2	43%	0.43	14%	0.142	S	C	.	.			trans	-129.2	172	-180	-65.2	-179	-13.4	0	0	109.2	P157 N161 T162 Y163	P157-Q159 HydrophobicContact CB-CG 4.29Å; P157-Q159 PolarHBondContact O-N 3.14Å; Q159-N161 VanDerWaalsContact C-N 3.28Å; Q159-N161 WeakPolarHBondContact CB-OD1 3.47Å; Q159-N161 PolarHBondContact O-N 2.97Å; Q159-T162 PolarHBondContact N-OG1 3.22Å; Q159-T162 PolarHBondContact O-N 3.32Å; Q159-T162 VanDerWaalsContact O-N 3.17Å; Q159-T162 PolarHBondContact O-OG1 3.03Å; Q159-Y163 WeakPolarHBondContact O-CB 3.36Å; Q159-Y163 PolarHBondContact O-N 3.33Å
160	D	89.1	Confident	94.9	Very high	87 Å²	87	28.2 Å²	28.2	47%	0.465	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-39.4	-176.6	-74	3.7	0	0	0	112.9	P223	D160-P223 HydrophobicContact CB-CB 3.85Å; D160-P223 HydrophobicContact CB-CG 3.99Å
161	N	87.4	Confident	94.7	Very high	51 Å²	51	28.7 Å²	28.7	27%	0.273	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-30.4	177.5	61.3	-9.5	0	0	0	113.2	V98 Q159	V98-N161 VanDerWaalsContact CG1-O 3.22Å; V98-N161 WeakPolarHBondContact CG1-O 3.38Å; Q159-N161 VanDerWaalsContact C-N 3.28Å; Q159-N161 WeakPolarHBondContact CB-OD1 3.47Å; Q159-N161 PolarHBondContact O-N 2.97Å
162	T	93.5	Very high	94.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-13.3	-179.4	63	0	0	0	0	114.2	I93 V98 L156 P157 Q159 L164 L165 H166	I93-T162 HydrophobicContact CD1-CG2 4.11Å; I93-T162 HydrophobicContact CG2-CG2 3.85Å; V98-T162 HydrophobicContact CG1-CG2 4.47Å; V98-T162 HydrophobicContact CG2-CG2 4.12Å; L156-T162 HydrophobicContact CD2-CG2 4.01Å; L156-T162 HydrophobicContact CG-CG2 4.25Å; P157-T162 PolarHBondContact O-OG1 3.07Å; Q159-T162 PolarHBondContact N-OG1 3.22Å; Q159-T162 PolarHBondContact O-N 3.32Å; Q159-T162 VanDerWaalsContact O-N 3.17Å; Q159-T162 PolarHBondContact O-OG1 3.03Å; T162-L164 VanDerWaalsContact C-N 3.34Å; T162-L164 PolarHBondContact O-N 3.2Å; T162-L165 WeakPolarHBondContact O-CB 3.26Å; T162-L165 PolarHBondContact O-N 3.47Å; T162-L165 VanDerWaalsContact O-N 3.1Å; T162-H166 PolarHBondContact O-CD2 3.34Å; T162-H166 VanDerWaalsContact O-CD2 3.24Å; T162-H166 PolarHBondContact O-N 3.09Å
163	Y	92	Very high	94.6	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.016	12%	0.12	C	C	.	.	H	α-helix	trans	-52.8	-46.7	-173.5	-173.3	-83.9	0	0	0	113.5	I158 Q159 H166 C167 R220 V222 P223 L302 L303	I158-Y163 HydrophobicContact CG2-CD2 4.26Å; Q159-Y163 WeakPolarHBondContact O-CB 3.36Å; Q159-Y163 PolarHBondContact O-N 3.33Å; Y163-H166 WeakPolarHBondContact O-CB 3.47Å; Y163-H166 PolarHBondContact O-N 3.21Å; Y163-C167 PolarHBondContact O-N 3.22Å; Y163-C167 VanDerWaalsContact O-N 3.1Å; Y163-C167 PolarHBondContact O-SG 3.48Å; Y163-R220 HydrophobicContact CE2-CB 4.32Å; Y163-R220 PolarHBondContact OH-O 3.36Å; Y163-V222 HydrophobicContact CE1-CB 4.5Å; Y163-V222 HydrophobicContact CE1-CG1 4.49Å; Y163-V222 HydrophobicContact CE1-CG2 4.08Å; Y163-P223 HydrophobicContact CD2-CG 4.3Å; Y163-P223 HydrophobicContact CG-CG 4.1Å; Y163-L302 HydrophobicContact CE1-CB 4.38Å; Y163-L303 HydrophobicContact CD2-CD2 4.31Å; Y163-L303 HydrophobicContact CE1-CB 4.29Å; Y163-L303 HydrophobicContact CE2-CB 3.86Å; Y163-L303 HydrophobicContact CE2-CD2 4.12Å; Y163-L303 PolarHBondContact OH-N 3.01Å
164	L	87.9	Confident	94.6	Very high	28 Å²	28	22.4 Å²	22.4	15%	0.147	12%	0.12	C	C	.	.	H	α-helix	trans	-73.6	-33.6	-179	-68.1	179.5	0	0	0	112.4	T162 H166 C167 E168 L226	T162-L164 VanDerWaalsContact C-N 3.34Å; T162-L164 PolarHBondContact O-N 3.2Å; L164-H166 VanDerWaalsContact C-N 3.32Å; L164-H166 PolarHBondContact O-N 2.92Å; L164-C167 WeakPolarHBondContact O-CB 3.4Å; L164-C167 PolarHBondContact O-N 2.93Å; L164-E168 WeakPolarHBondContact O-CB 3.42Å; L164-E168 PolarHBondContact O-N 3.01Å; L164-L226 HydrophobicContact CD1-CD1 3.85Å; L164-L226 HydrophobicContact CD1-CD2 4.02Å; L164-L226 HydrophobicContact CD2-CD1 4.37Å; L164-L226 HydrophobicContact CG-CD1 3.83Å
165	L	93.9	Very high	94.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-43.8	171.3	173.9	60.7	0	0	0	111	L87 V98 A101 Q102 L105 L152 L156 T162 E168 A169	L87-L165 HydrophobicContact CD1-CD2 3.74Å; V98-L165 HydrophobicContact CG1-CB 4.21Å; V98-L165 HydrophobicContact CG1-CD2 4.05Å; A101-L165 HydrophobicContact CB-CD1 3.86Å; A101-L165 HydrophobicContact CB-CD2 4.28Å; Q102-L165 HydrophobicContact CB-CB 4.28Å; Q102-L165 HydrophobicContact CB-CD1 4.2Å; L105-L165 HydrophobicContact CD1-CD1 3.67Å; L152-L165 HydrophobicContact CD1-CD1 4.35Å; L152-L165 HydrophobicContact CD1-CD2 4.2Å; L152-L165 HydrophobicContact CD1-CG 4.27Å; L152-L165 HydrophobicContact CD2-CG 4.4Å; L156-L165 HydrophobicContact CD2-CD2 3.76Å; T162-L165 WeakPolarHBondContact O-CB 3.26Å; T162-L165 PolarHBondContact O-N 3.47Å; T162-L165 VanDerWaalsContact O-N 3.1Å; L165-E168 PolarHBondContact O-N 3.05Å; L165-A169 PolarHBondContact O-N 3.19Å
166	H	96.3	Very high	94.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.2	-49	172.4	-78.2	-80.9	0	0	0	111.2	L152 L156 T162 Y163 L164 E168 A169 H170 L303	L152-H166 PolarHBondContact O-CE1 2.97Å; L156-H166 PolarHBondContact O-CE1 3.49Å; L156-H166 PolarHBondContact O-NE2 2.79Å; T162-H166 PolarHBondContact O-CD2 3.34Å; T162-H166 VanDerWaalsContact O-CD2 3.24Å; T162-H166 PolarHBondContact O-N 3.09Å; Y163-H166 WeakPolarHBondContact O-CB 3.47Å; Y163-H166 PolarHBondContact O-N 3.21Å; L164-H166 VanDerWaalsContact C-N 3.32Å; L164-H166 PolarHBondContact O-N 2.92Å; H166-E168 VanDerWaalsContact C-N 3.3Å; H166-E168 PolarHBondContact O-N 3.21Å; H166-A169 PolarHBondContact O-N 3.37Å; H166-H170 PolarHBondContact O-N 3.33Å; H166-H170 VanDerWaalsContact O-N 3.08Å; H166-H170 PolarHBondContact O-ND1 3.29Å; H166-L303 HydrophobicContact CB-CD1 3.93Å
167	C	93.7	Very high	94.3	Very high	4 Å²	4	17.6 Å²	17.6	3%	0.027	9%	0.094	C	C	.	.	H	α-helix	trans	-57.1	-44.8	179.9	-65.7	0	0	0	0	111.8	Y163 L164 A169 H170 L171 L302	Y163-C167 PolarHBondContact O-N 3.22Å; Y163-C167 VanDerWaalsContact O-N 3.1Å; Y163-C167 PolarHBondContact O-SG 3.48Å; L164-C167 WeakPolarHBondContact O-CB 3.4Å; L164-C167 PolarHBondContact O-N 2.93Å; C167-A169 PolarHBondContact O-N 2.93Å; C167-H170 PolarHBondContact O-N 3.33Å; C167-L171 VanDerWaalsContact O-CG 3.31Å; C167-L171 WeakPolarHBondContact O-CG 3.43Å; C167-L171 PolarHBondContact O-N 3.01Å; C167-L302 HydrophobicContact CB-CD2 4.19Å; C167-L302 HydrophobicContact CB-CG 4.47Å
168	E	92	Very high	94.2	Very high	6 Å²	6	14.5 Å²	14.5	3%	0.028	7%	0.074	C	C	.	.	H	α-helix	trans	-66.3	-38.5	179.9	-170.6	54.8	-139.5	0	0	112.2	L105 L106 R109 L164 L165 H166 H170 L171 L172 W236	L105-E168 HydrophobicContact CB-CB 4.38Å; L105-E168 HydrophobicContact CB-CG 3.5Å; L105-E168 VanDerWaalsContact CB-CG 3.5Å; L106-E168 VanDerWaalsContact CA-OE1 3.28Å; L106-E168 WeakPolarHBondContact CA-OE1 3.45Å; L106-E168 HydrophobicContact CB-CG 4.29Å; R109-E168 WeakPolarHBondContact CB-OE1 3.35Å; R109-E168 WeakPolarHBondContact CD-OE1 3.18Å; R109-E168 IonicContact CZ-OE1 3.75Å; R109-E168 IonicContact CZ-OE2 3.39Å; R109-E168 IonicContact NE-OE1 3.78Å; R109-E168 PolarHBondContact NE-OE1 3.34Å; R109-E168 IonicContact NE-OE2 3.97Å; R109-E168 PolarHBondContact NE-OE2 2.86Å; R109-E168 IonicContact NH2-OE1 2.67Å; R109-E168 IonicContact NH2-OE2 3.3Å; R109-E168 PolarHBondContact NH2-OE2 3.11Å; L164-E168 WeakPolarHBondContact O-CB 3.42Å; L164-E168 PolarHBondContact O-N 3.01Å; L165-E168 PolarHBondContact O-N 3.05Å; H166-E168 VanDerWaalsContact C-N 3.3Å; H166-E168 PolarHBondContact O-N 3.21Å; E168-H170 VanDerWaalsContact C-N 3.33Å; E168-H170 PolarHBondContact O-N 3.47Å; E168-L171 PolarHBondContact O-N 3.31Å; E168-L172 WeakPolarHBondContact O-CB 3.19Å; E168-L172 PolarHBondContact O-N 2.78Å; E168-W236 VanDerWaalsContact OE2-CH2 3.28Å; E168-W236 WeakPolarHBondContact OE2-CH2 3.3Å
169	A	98	Very high	94.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60	-41.7	172.8	0	0	0	0	0	112.3	L105 L149 L152 I153 L165 H166 C167 C173	L105-A169 HydrophobicContact CD1-CB 4.14Å; L149-A169 HydrophobicContact CD2-CB 4.1Å; L152-A169 HydrophobicContact CD2-CB 3.95Å; I153-A169 HydrophobicContact CD1-CB 4.29Å; I153-A169 HydrophobicContact CG1-CB 4.09Å; L165-A169 PolarHBondContact O-N 3.19Å; H166-A169 PolarHBondContact O-N 3.37Å; C167-A169 PolarHBondContact O-N 2.93Å; A169-C173 PolarHBondContact O-N 3.02Å; A169-C173 VanDerWaalsContact O-N 3.16Å; A169-C173 PolarHBondContact O-SG 3.27Å
170	H	97.7	Very high	94.1	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-65.7	-47.5	175.9	-70.6	75.8	0	0	0	111.5	H166 C167 E168 L172 C173 I174 L212 V306 S307	H166-H170 PolarHBondContact O-N 3.33Å; H166-H170 VanDerWaalsContact O-N 3.08Å; H166-H170 PolarHBondContact O-ND1 3.29Å; C167-H170 PolarHBondContact O-N 3.33Å; E168-H170 VanDerWaalsContact C-N 3.33Å; E168-H170 PolarHBondContact O-N 3.47Å; H170-L172 VanDerWaalsContact C-N 3.32Å; H170-L172 PolarHBondContact O-N 3.45Å; H170-C173 WeakPolarHBondContact O-CB 3.27Å; H170-C173 PolarHBondContact O-N 2.82Å; H170-I174 WeakPolarHBondContact O-CG1 3.49Å; H170-I174 PolarHBondContact O-N 2.96Å; H170-L212 WeakPolarHBondContact NE2-CD2 3.23Å; H170-V306 HydrophobicContact CB-CB 4.02Å; H170-V306 HydrophobicContact CB-CG2 3.66Å; H170-S307 PolarHBondContact NE2-OG 3.41Å
171	L	95.4	Very high	94.3	Very high	9 Å²	9	7.7 Å²	7.7	5%	0.047	4%	0.037	C	C	.	.	H	α-helix	trans	-63	-39	-179.3	-69.4	169.9	0	0	0	111.7	C167 E168 I174 V175 W236 V306 I741	C167-L171 VanDerWaalsContact O-CG 3.31Å; C167-L171 WeakPolarHBondContact O-CG 3.43Å; C167-L171 PolarHBondContact O-N 3.01Å; E168-L171 PolarHBondContact O-N 3.31Å; L171-I174 PolarHBondContact O-N 3.44Å; L171-V175 WeakPolarHBondContact O-CG2 3.48Å; L171-V175 PolarHBondContact O-N 3.47Å; L171-W236 HydrophobicContact CD1-CZ3 4.1Å; L171-V306 HydrophobicContact CD2-CG1 3.84Å; L171-V306 HydrophobicContact CG-CG1 4.29Å; L171-I741 HydrophobicContact CD2-CD1 3.88Å; L171-I741 HydrophobicContact CD2-CG1 4.16Å
172	L	97	Very high	94.5	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-62.1	-44.3	174.5	179	62.9	0	0	0	111.4	L105 L108 R109 V112 L149 E168 H170 I174 V175 F176	L105-L172 HydrophobicContact CD2-CD2 3.66Å; L108-L172 HydrophobicContact CD2-CD1 4.44Å; L108-L172 HydrophobicContact CD2-CD2 3.74Å; L108-L172 HydrophobicContact CG-CD1 4.11Å; L108-L172 HydrophobicContact CG-CD2 4.24Å; R109-L172 HydrophobicContact CB-CB 4.39Å; R109-L172 HydrophobicContact CB-CD1 3.83Å; R109-L172 HydrophobicContact CG-CD1 4.36Å; V112-L172 HydrophobicContact CG2-CD1 4.4Å; L149-L172 HydrophobicContact CD1-CD2 3.99Å; L149-L172 HydrophobicContact CD1-CG 4.46Å; L149-L172 HydrophobicContact CD2-CD2 4.29Å; E168-L172 WeakPolarHBondContact O-CB 3.19Å; E168-L172 PolarHBondContact O-N 2.78Å; H170-L172 VanDerWaalsContact C-N 3.32Å; H170-L172 PolarHBondContact O-N 3.45Å; L172-I174 VanDerWaalsContact C-N 3.34Å; L172-I174 PolarHBondContact O-N 2.85Å; L172-V175 PolarHBondContact O-N 3.38Å; L172-F176 HydrophobicContact CD1-CD2 3.8Å; L172-F176 HydrophobicContact CD1-CE2 3.56Å; L172-F176 HydrophobicContact CD2-CE2 4.28Å; L172-F176 HydrophobicContact CG-CD2 3.89Å; L172-F176 HydrophobicContact CG-CE2 3.83Å; L172-F176 WeakPolarHBondContact O-CD2 3.48Å; L172-F176 PolarHBondContact O-N 3.16Å
173	C	98.3	Very high	94.3	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-58.6	-46.3	174.6	-67.1	0	0	0	0	111.3	F146 A169 H170 V175 F176 L177 L310	F146-C173 HydrophobicContact CE1-CB 4.37Å; A169-C173 PolarHBondContact O-N 3.02Å; A169-C173 VanDerWaalsContact O-N 3.16Å; A169-C173 PolarHBondContact O-SG 3.27Å; H170-C173 WeakPolarHBondContact O-CB 3.27Å; H170-C173 PolarHBondContact O-N 2.82Å; C173-V175 VanDerWaalsContact C-N 3.35Å; C173-V175 PolarHBondContact O-N 2.92Å; C173-F176 PolarHBondContact O-N 3.42Å; C173-L177 VanDerWaalsContact O-CG 3.29Å; C173-L177 WeakPolarHBondContact O-CG 3.46Å; C173-L177 PolarHBondContact O-N 2.82Å; C173-L177 VanDerWaalsContact O-N 3.07Å; C173-L310 HydrophobicContact CB-CD1 3.93Å; C173-L310 HydrophobicContact CB-CD2 4.06Å
174	I	97.2	Very high	94.1	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-58.7	-46.7	177.3	-68.6	170.8	0	0	0	110.6	H170 L171 L172 F176 L177 S178 L309 L310 I313 W732 V735 I741	H170-I174 WeakPolarHBondContact O-CG1 3.49Å; H170-I174 PolarHBondContact O-N 2.96Å; L171-I174 PolarHBondContact O-N 3.44Å; L172-I174 VanDerWaalsContact C-N 3.34Å; L172-I174 PolarHBondContact O-N 2.85Å; I174-F176 PolarHBondContact O-N 3.47Å; I174-L177 PolarHBondContact O-N 2.76Å; I174-S178 VanDerWaalsContact O-CB 3.28Å; I174-S178 WeakPolarHBondContact O-CB 3.37Å; I174-S178 PolarHBondContact O-N 2.66Å; I174-L309 HydrophobicContact CD1-CB 4.13Å; I174-L310 HydrophobicContact CD1-CB 4.49Å; I174-L310 HydrophobicContact CG1-CB 4.3Å; I174-L310 HydrophobicContact CG1-CD1 4.26Å; I174-I313 HydrophobicContact CB-CD1 4.38Å; I174-I313 HydrophobicContact CG1-CD1 3.91Å; I174-I313 HydrophobicContact CG2-CD1 4.02Å; I174-W732 HydrophobicContact CG2-CZ3 4.42Å; I174-V735 HydrophobicContact CG2-CG1 3.75Å; I174-I741 HydrophobicContact CB-CD1 4.48Å; I174-I741 HydrophobicContact CG2-CD1 3.97Å
175	V	95.6	Very high	94	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.5	-48.6	178.6	167.3	0	0	0	0	111	R109 V112 K113 M116 L171 L172 C173 L177 S178 I741	R109-V175 HydrophobicContact CG-CB 4.14Å; R109-V175 HydrophobicContact CG-CG2 3.64Å; V112-V175 HydrophobicContact CB-CG1 4.27Å; V112-V175 HydrophobicContact CG1-CG1 3.86Å; K113-V175 HydrophobicContact CB-CG1 3.75Å; M116-V175 HydrophobicContact CE-CG1 4.39Å; L171-V175 WeakPolarHBondContact O-CG2 3.48Å; L171-V175 PolarHBondContact O-N 3.47Å; L172-V175 PolarHBondContact O-N 3.38Å; C173-V175 VanDerWaalsContact C-N 3.35Å; C173-V175 PolarHBondContact O-N 2.92Å; V175-L177 VanDerWaalsContact C-N 3.27Å; V175-L177 PolarHBondContact O-N 3.42Å; V175-S178 PolarHBondContact O-N 3.06Å; V175-S178 VanDerWaalsContact O-N 3.14Å; V175-S178 PolarHBondContact O-OG 2.95Å; V175-I741 HydrophobicContact CG2-CD1 3.82Å; V175-I741 HydrophobicContact CG2-CG2 4.4Å
176	F	96	Very high	93.5	Very high	4 Å²	4	20 Å²	20	2%	0.018	10%	0.104	C	C	.	.	H	α-helix	trans	-59.5	-36.6	177.7	-89.4	-68.1	0	0	0	113.4	V112 F124 F128 I142 L145 F146 L172 C173 I174 V192	V112-F176 HydrophobicContact CB-CE1 4.42Å; V112-F176 HydrophobicContact CB-CZ 4.32Å; V112-F176 HydrophobicContact CG1-CD1 3.63Å; V112-F176 HydrophobicContact CG1-CD2 4.28Å; V112-F176 HydrophobicContact CG1-CE1 3.56Å; V112-F176 HydrophobicContact CG1-CE2 4.22Å; V112-F176 HydrophobicContact CG1-CG 3.99Å; V112-F176 HydrophobicContact CG1-CZ 3.87Å; V112-F176 HydrophobicContact CG2-CE1 3.87Å; V112-F176 HydrophobicContact CG2-CE2 3.95Å; V112-F176 HydrophobicContact CG2-CZ 3.44Å; V112-F176 VanDerWaalsContact CG2-CZ 3.44Å; F124-F176 HydrophobicContact CZ-CD1 4.1Å; F124-F176 AromaticContact CZ-CE1 3.98Å; F124-F176 HydrophobicContact CZ-CE1 3.98Å; F128-F176 HydrophobicContact CE1-CE1 4.22Å; F128-F176 HydrophobicContact CE1-CZ 4.21Å; F128-F176 HydrophobicContact CZ-CE1 4.13Å; F128-F176 HydrophobicContact CZ-CZ 4.49Å; I142-F176 HydrophobicContact CD1-CE1 4.09Å; I142-F176 HydrophobicContact CG1-CE1 4.34Å; L145-F176 HydrophobicContact CD2-CE2 3.85Å; L145-F176 HydrophobicContact CD2-CZ 4.12Å; F146-F176 HydrophobicContact CE2-CB 4.14Å; F146-F176 HydrophobicContact CE2-CD2 4.28Å; F146-F176 HydrophobicContact CE2-CG 4.1Å; F146-F176 HydrophobicContact CZ-CB 3.55Å; F146-F176 HydrophobicContact CZ-CD2 4.13Å; F146-F176 AromaticContact CZ-CG 3.94Å; F146-F176 HydrophobicContact CZ-CG 3.94Å; L172-F176 HydrophobicContact CD1-CD2 3.8Å; L172-F176 HydrophobicContact CD1-CE2 3.56Å; L172-F176 HydrophobicContact CD2-CE2 4.28Å; L172-F176 HydrophobicContact CG-CD2 3.89Å; L172-F176 HydrophobicContact CG-CE2 3.83Å; L172-F176 WeakPolarHBondContact O-CD2 3.48Å; L172-F176 PolarHBondContact O-N 3.16Å; C173-F176 PolarHBondContact O-N 3.42Å; I174-F176 PolarHBondContact O-N 3.47Å; F176-V192 HydrophobicContact CB-CG1 4.12Å; F176-V192 HydrophobicContact CD1-CG1 4.38Å
177	L	95.6	Very high	93	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-79.6	-18.7	179.8	-64	171.4	0	0	0	112.9	C173 I174 V175 R179 Q180 Y193 V196 L310 I313 L314 W732	C173-L177 VanDerWaalsContact O-CG 3.29Å; C173-L177 WeakPolarHBondContact O-CG 3.46Å; C173-L177 PolarHBondContact O-N 2.82Å; C173-L177 VanDerWaalsContact O-N 3.07Å; I174-L177 PolarHBondContact O-N 2.76Å; V175-L177 VanDerWaalsContact C-N 3.27Å; V175-L177 PolarHBondContact O-N 3.42Å; L177-R179 PolarHBondContact O-N 2.93Å; L177-R179 VanDerWaalsContact O-N 3.16Å; L177-Q180 PolarHBondContact O-N 3.41Å; L177-Y193 HydrophobicContact CB-CD2 4.11Å; L177-Y193 HydrophobicContact CB-CE2 4.4Å; L177-Y193 HydrophobicContact CD2-CD2 3.64Å; L177-Y193 HydrophobicContact CD2-CE2 4.23Å; L177-Y193 HydrophobicContact CD2-CG 3.98Å; L177-Y193 HydrophobicContact CG-CD2 4.41Å; L177-V196 HydrophobicContact CD2-CB 4.33Å; L177-V196 HydrophobicContact CD2-CG1 4.49Å; L177-V196 HydrophobicContact CD2-CG2 4.33Å; L177-L310 HydrophobicContact CD1-CD1 3.93Å; L177-I313 HydrophobicContact CB-CG2 4.09Å; L177-I313 HydrophobicContact CD1-CG2 3.8Å; L177-L314 HydrophobicContact CD1-CD2 4.02Å; L177-W732 HydrophobicContact CB-CH2 4.1Å; L177-W732 HydrophobicContact CB-CZ2 4.42Å; L177-W732 WeakPolarHBondContact O-CZ2 3.41Å
178	S	94.9	Very high	92.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-72.6	-5.9	-172.4	72.5	0	0	0	0	115.4	M116 I174 V175 Q180 M181 F743	M116-S178 WeakPolarHBondContact CE-OG 3.16Å; M116-S178 PolarHBondContact SD-OG 2.89Å; I174-S178 VanDerWaalsContact O-CB 3.28Å; I174-S178 WeakPolarHBondContact O-CB 3.37Å; I174-S178 PolarHBondContact O-N 2.66Å; V175-S178 PolarHBondContact O-N 3.06Å; V175-S178 VanDerWaalsContact O-N 3.14Å; V175-S178 PolarHBondContact O-OG 2.95Å; S178-Q180 PolarHBondContact O-N 3.33Å; S178-M181 WeakPolarHBondContact O-CB 3.36Å; S178-M181 PolarHBondContact O-N 2.75Å; S178-F743 WeakPolarHBondContact OG-CE1 3.48Å
179	R	92.6	Very high	92.3	Very high	45 Å²	45	26.1 Å²	26.1	17%	0.17	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-55	-25.4	170.4	-171.4	64	173.9	174.9	-2.7	112	M116 C119 L177 M181 Y182 P190	M116-R179 HydrophobicContact CG-CB 4.14Å; M116-R179 HydrophobicContact CG-CG 4.49Å; M116-R179 PolarHBondContact O-NH1 2.92Å; M116-R179 HydrophobicContact SD-CB 4Å; M116-R179 PolarHBondContact SD-N 3.13Å; M116-R179 VanDerWaalsContact SD-N 3.36Å; C119-R179 PolarHBondContact O-NH1 3.35Å; C119-R179 PolarHBondContact O-NH2 3.45Å; L177-R179 PolarHBondContact O-N 2.93Å; L177-R179 VanDerWaalsContact O-N 3.16Å; R179-M181 PolarHBondContact O-N 2.82Å; R179-Y182 PolarHBondContact O-N 3.41Å; R179-P190 HydrophobicContact CB-CB 4.04Å; R179-P190 HydrophobicContact CB-CG 4.05Å; R179-P190 HydrophobicContact CG-CB 4.14Å; R179-P190 HydrophobicContact CG-CG 4.24Å
180	Q	92.2	Very high	91.9	Very high	10 Å²	10	26.2 Å²	26.2	5%	0.047	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-56.8	-31.2	174.9	-172	172.5	31.3	0	0	112.6	L177 S178 Y182 K183 P190 W732	L177-Q180 PolarHBondContact O-N 3.41Å; S178-Q180 PolarHBondContact O-N 3.33Å; Q180-Y182 PolarHBondContact O-N 2.67Å; Q180-K183 PolarHBondContact O-N 2.84Å; Q180-P190 HydrophobicContact CB-CG 4.02Å; Q180-W732 HydrophobicContact CB-CZ2 4.25Å
181	M	92.6	Very high	91.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-69.4	-20.7	178	-58.4	-173.9	-60.5	0	0	113.7	S178 R179 K183 W732 R736 F743 L748 L749 L750 F751	S178-M181 WeakPolarHBondContact O-CB 3.36Å; S178-M181 PolarHBondContact O-N 2.75Å; R179-M181 PolarHBondContact O-N 2.82Å; M181-K183 VanDerWaalsContact C-N 3.34Å; M181-W732 HydrophobicContact CE-CE3 4.34Å; M181-W732 HydrophobicContact CG-CB 3.77Å; M181-W732 HydrophobicContact CG-CD2 3.55Å; M181-W732 HydrophobicContact CG-CE3 3.68Å; M181-W732 HydrophobicContact CG-CG 3.6Å; M181-W732 HydrophobicContact SD-CB 3.94Å; M181-W732 HydrophobicContact SD-CD2 3.97Å; M181-W732 HydrophobicContact SD-CE3 3.53Å; M181-W732 VanDerWaalsContact SD-CE3 3.53Å; M181-W732 HydrophobicContact SD-CG 4.17Å; M181-W732 HydrophobicContact SD-CZ3 4.37Å; M181-R736 HydrophobicContact SD-CG 3.79Å; M181-F743 HydrophobicContact CE-CB 3.95Å; M181-F743 HydrophobicContact CE-CD1 3.42Å; M181-F743 VanDerWaalsContact CE-CD1 3.42Å; M181-F743 HydrophobicContact CE-CD2 3.64Å; M181-F743 HydrophobicContact CE-CE1 3.71Å; M181-F743 HydrophobicContact CE-CE2 3.88Å; M181-F743 HydrophobicContact CE-CG 3.37Å; M181-F743 HydrophobicContact CE-CZ 3.91Å; M181-L748 HydrophobicContact CB-CD2 3.86Å; M181-L748 HydrophobicContact CE-CD2 4.43Å; M181-L748 CarbonylContact O-C 3.54Å; M181-L748 WeakPolarHBondContact O-CA 3.4Å; M181-L749 PolarHBondContact O-N 3.01Å; M181-L750 HydrophobicContact CG-CD2 4.32Å; M181-L750 WeakPolarHBondContact O-CB 3.5Å; M181-L750 PolarHBondContact O-N 3.01Å; M181-L750 VanDerWaalsContact O-N 3.11Å; M181-F751 HydrophobicContact CB-CE2 4.21Å; M181-F751 HydrophobicContact CG-CE2 4.3Å; M181-F751 HydrophobicContact CG-CZ 4.35Å; M181-F751 HydrophobicContact SD-CE2 4.19Å; M181-F751 HydrophobicContact SD-CZ 4.12Å
182	Y	92.2	Very high	91.2	Very high	18 Å²	18	27.7 Å²	27.7	7%	0.071	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-95.3	8.9	-180	-58.3	-91.6	0	0	0	112.2	M116 E117 R179 Q180 S747 L748 L749	M116-Y182 HydrophobicContact CE-CE2 3.88Å; M116-Y182 HydrophobicContact SD-CE2 4.49Å; E117-Y182 HydrophobicContact CG-CE1 4.4Å; E117-Y182 WeakPolarHBondContact CG-OH 3.38Å; E117-Y182 PolarHBondContact OE1-OH 2.7Å; R179-Y182 PolarHBondContact O-N 3.41Å; Q180-Y182 PolarHBondContact O-N 2.67Å; Y182-S747 WeakPolarHBondContact CD1-O 3.37Å; Y182-L748 HydrophobicContact CD1-CD2 4.07Å; Y182-L748 HydrophobicContact CE1-CD2 3.68Å; Y182-L748 HydrophobicContact CE2-CD2 4.16Å; Y182-L748 HydrophobicContact CG-CD2 4.46Å; Y182-L749 WeakPolarHBondContact O-CD1 3.43Å
183	K	89	Confident	90.9	Very high	37 Å²	37	27.7 Å²	27.7	16%	0.161	15%	0.153	C	C	.	.	S	Bend	trans	-119.2	149.8	173.8	-67.3	-164.3	177.4	-170.3	0	109.3	E121 Q180 M181 A187 P188 P190 L750	E121-K183 IonicContact OE1-NZ 2.8Å; E121-K183 WeakPolarHBondContact OE2-CE 3.2Å; E121-K183 IonicContact OE2-NZ 2.57Å; E121-K183 PolarHBondContact OE2-NZ 3.49Å; Q180-K183 PolarHBondContact O-N 2.84Å; M181-K183 VanDerWaalsContact C-N 3.34Å; K183-A187 HydrophobicContact CB-CB 4.09Å; K183-A187 HydrophobicContact CD-CB 4.33Å; K183-P188 WeakPolarHBondContact CD-O 3.39Å; K183-P188 PolarHBondContact NZ-O 3.22Å; K183-P190 HydrophobicContact CD-CG 4.26Å; K183-L750 WeakPolarHBondContact O-CA 3.41Å; K183-L750 PolarHBondContact O-N 3.19Å
184	E	88.1	Confident	90.4	Very high	116 Å²	116	28.3 Å²	28.3	54%	0.542	16%	0.157	S	C	.	.			trans	-64.3	153	166.6	-64.3	-175	173.6	0	0	109.9	S186 A187 L749	E184-S186 PolarHBondContact O-N 3.34Å; E184-S186 PolarHBondContact OE2-OG 3.17Å; E184-A187 VanDerWaalsContact O-CB 3.26Å; E184-A187 WeakPolarHBondContact O-CB 3.46Å; E184-A187 PolarHBondContact O-N 3.28Å; E184-L749 HydrophobicContact CG-CB 4.12Å; E184-L749 HydrophobicContact CG-CD1 4.46Å
185	L	85.1	Confident	89.9	Confident	70 Å²	70	29.1 Å²	29.1	37%	0.366	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.8	179.2	-179	68.1	0	0	0	113	A187 E725 I728 L750	L185-A187 VanDerWaalsContact C-N 3.27Å; L185-A187 PolarHBondContact O-N 2.96Å; L185-E725 HydrophobicContact CD2-CB 3.9Å; L185-E725 HydrophobicContact CD2-CG 3.93Å; L185-I728 HydrophobicContact CD1-CB 4.14Å; L185-I728 HydrophobicContact CD1-CD1 3.85Å; L185-I728 HydrophobicContact CD1-CG2 4.14Å; L185-L750 HydrophobicContact CB-CD1 4.16Å; L185-L750 HydrophobicContact CD1-CD1 4.2Å
186	S	84.3	Confident	89.8	Confident	102 Å²	102	29.2 Å²	29.2	71%	0.713	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-20.6	176.5	55.1	0	0	0	0	113.3	E184	E184-S186 PolarHBondContact O-N 3.34Å; E184-S186 PolarHBondContact OE2-OG 3.17Å
187	A	86.1	Confident	89.5	Confident	37 Å²	37	29 Å²	29	31%	0.306	16%	0.163	S	C	.	.	S	Bend	trans	-73.7	154.2	-175.4	0	0	0	0	0	111.3	K183 E184 L185 L189	K183-A187 HydrophobicContact CB-CB 4.09Å; K183-A187 HydrophobicContact CD-CB 4.33Å; E184-A187 VanDerWaalsContact O-CB 3.26Å; E184-A187 WeakPolarHBondContact O-CB 3.46Å; E184-A187 PolarHBondContact O-N 3.28Å; L185-A187 VanDerWaalsContact C-N 3.27Å; L185-A187 PolarHBondContact O-N 2.96Å; A187-L189 PolarHBondContact O-N 2.72Å
188	P	84.1	Confident	89.2	Confident	74 Å²	74	30.7 Å²	30.7	48%	0.481	17%	0.169	S	C	.	.	P	Polyproline II helix	trans	-56.5	141.6	173.1	-23.7	33.5	0	0	0	111.9	K183	K183-P188 WeakPolarHBondContact CD-O 3.39Å; K183-P188 PolarHBondContact NZ-O 3.22Å
189	L	87.3	Confident	88.8	Confident	27 Å²	27	32.1 Å²	32.1	14%	0.141	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-53.7	143.2	176.5	-72.8	180	0	0	0	111	A187 Y193 V194 W198 Q317 I324	A187-L189 PolarHBondContact O-N 2.72Å; L189-Y193 HydrophobicContact CD1-CD1 4.28Å; L189-V194 HydrophobicContact CB-CG2 3.8Å; L189-W198 HydrophobicContact CD1-CH2 4.1Å; L189-W198 HydrophobicContact CD1-CZ3 3.98Å; L189-Q317 HydrophobicContact CD1-CG 4.17Å; L189-Q317 HydrophobicContact CD2-CG 4.5Å; L189-I324 HydrophobicContact CD1-CD1 3.85Å
190	P	89.8	Confident	88.7	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.013	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-55.9	142.3	174.1	-21.7	30.8	0	0	0	111.6	R179 Q180 K183 V192 Y193 V194	R179-P190 HydrophobicContact CB-CB 4.04Å; R179-P190 HydrophobicContact CB-CG 4.05Å; R179-P190 HydrophobicContact CG-CB 4.14Å; R179-P190 HydrophobicContact CG-CG 4.24Å; Q180-P190 HydrophobicContact CB-CG 4.02Å; K183-P190 HydrophobicContact CD-CG 4.26Å; P190-V192 VanDerWaalsContact C-N 3.28Å; P190-V192 PolarHBondContact O-N 3.46Å; P190-Y193 WeakPolarHBondContact O-CA 3.4Å; P190-Y193 VanDerWaalsContact O-CB 3.22Å; P190-Y193 WeakPolarHBondContact O-CB 3.38Å; P190-Y193 PolarHBondContact O-N 3.16Å; P190-V194 PolarHBondContact O-N 3.03Å; P190-V194 VanDerWaalsContact O-N 3.13Å
191	Q	87.7	Confident	88.8	Confident	32 Å²	32	35.5 Å²	35.5	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-35.9	-171.9	-177.4	55.3	36.4	0	0	113.2	E121 F125 L139 Y193 V194 S195 Y328	E121-Q191 PolarHBondContact OE1-N 2.89Å; F125-Q191 HydrophobicContact CE2-CB 3.73Å; F125-Q191 HydrophobicContact CE2-CG 4.17Å; F125-Q191 HydrophobicContact CZ-CB 3.68Å; F125-Q191 HydrophobicContact CZ-CG 3.94Å; L139-Q191 HydrophobicContact CD1-CG 4.22Å; L139-Q191 HydrophobicContact CD2-CG 4Å; Q191-Y193 VanDerWaalsContact C-N 3.29Å; Q191-Y193 PolarHBondContact O-N 3.2Å; Q191-V194 PolarHBondContact O-N 3.17Å; Q191-S195 WeakPolarHBondContact O-CB 3.36Å; Q191-S195 PolarHBondContact O-N 3.02Å; Q191-Y328 PolarHBondContact NE2-OH 3.24Å
192	V	90.6	Very high	88.8	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-59.8	-42.7	173.8	179.2	0	0	0	0	110.8	F124 F125 I142 F146 F176 P190 S195 V196	F124-V192 HydrophobicContact CE1-CG2 4.31Å; F125-V192 HydrophobicContact CE1-CG2 3.88Å; F125-V192 HydrophobicContact CZ-CG2 3.69Å; I142-V192 HydrophobicContact CG2-CG1 4.38Å; F146-V192 HydrophobicContact CE2-CG1 3.54Å; F146-V192 HydrophobicContact CZ-CG1 3.77Å; F176-V192 HydrophobicContact CB-CG1 4.12Å; F176-V192 HydrophobicContact CD1-CG1 4.38Å; P190-V192 VanDerWaalsContact C-N 3.28Å; P190-V192 PolarHBondContact O-N 3.46Å; V192-S195 PolarHBondContact O-N 2.83Å; V192-V196 HydrophobicContact CG1-CG2 4.32Å; V192-V196 VanDerWaalsContact O-CG2 3.25Å; V192-V196 WeakPolarHBondContact O-CG2 3.24Å; V192-V196 PolarHBondContact O-N 3.33Å
193	Y	90.2	Very high	88.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-45.7	179.8	-159.4	-68.6	0	0	0	110.8	L177 L189 P190 Q191 S195 V196 V197 I313 Q317	L177-Y193 HydrophobicContact CB-CD2 4.11Å; L177-Y193 HydrophobicContact CB-CE2 4.4Å; L177-Y193 HydrophobicContact CD2-CD2 3.64Å; L177-Y193 HydrophobicContact CD2-CE2 4.23Å; L177-Y193 HydrophobicContact CD2-CG 3.98Å; L177-Y193 HydrophobicContact CG-CD2 4.41Å; L189-Y193 HydrophobicContact CD1-CD1 4.28Å; P190-Y193 WeakPolarHBondContact O-CA 3.4Å; P190-Y193 VanDerWaalsContact O-CB 3.22Å; P190-Y193 WeakPolarHBondContact O-CB 3.38Å; P190-Y193 PolarHBondContact O-N 3.16Å; Q191-Y193 VanDerWaalsContact C-N 3.29Å; Q191-Y193 PolarHBondContact O-N 3.2Å; Y193-S195 PolarHBondContact O-N 3.15Å; Y193-V196 PolarHBondContact O-N 3.23Å; Y193-V197 HydrophobicContact CD1-CG2 3.78Å; Y193-V197 HydrophobicContact CE1-CG2 3.54Å; Y193-V197 WeakPolarHBondContact O-CG2 3.27Å; Y193-V197 PolarHBondContact O-N 3.34Å; Y193-I313 HydrophobicContact CE2-CG2 3.8Å; Y193-I313 PolarHBondContact OH-O 3Å; Y193-Q317 HydrophobicContact CE1-CG 3.57Å; Y193-Q317 WeakPolarHBondContact OH-CG 3.47Å
194	V	87.7	Confident	89.2	Confident	13 Å²	13	40.6 Å²	40.6	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-46.1	176.8	178.2	0	0	0	0	111.2	L189 P190 Q191 V196 V197 W198 I324	L189-V194 HydrophobicContact CB-CG2 3.8Å; P190-V194 PolarHBondContact O-N 3.03Å; P190-V194 VanDerWaalsContact O-N 3.13Å; Q191-V194 PolarHBondContact O-N 3.17Å; V194-V196 PolarHBondContact O-N 2.73Å; V194-V197 PolarHBondContact O-N 2.92Å; V194-W198 HydrophobicContact CG1-CE3 4.22Å; V194-W198 PolarHBondContact O-N 3Å; V194-I324 HydrophobicContact CG1-CG2 4.23Å; V194-I324 HydrophobicContact CG2-CD1 4.41Å; V194-I324 HydrophobicContact CG2-CG2 4.16Å
195	S	87.4	Confident	89.6	Confident	18 Å²	18	35.1 Å²	35.1	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-39.4	179.1	-175.2	0	0	0	0	112.7	E143 Q191 V192 Y193 G199	E143-S195 WeakPolarHBondContact CG-OG 3.49Å; Q191-S195 WeakPolarHBondContact O-CB 3.36Å; Q191-S195 PolarHBondContact O-N 3.02Å; V192-S195 PolarHBondContact O-N 2.83Å; Y193-S195 PolarHBondContact O-N 3.15Å; S195-G199 WeakPolarHBondContact O-CA 3.32Å; S195-G199 PolarHBondContact O-N 3.3Å
196	V	92	Very high	90.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-68.5	-44.2	176.6	171.4	0	0	0	0	111.3	F146 F150 L177 V192 Y193 V194 C201 L314 Y344	F146-V196 HydrophobicContact CB-CG2 4.36Å; F146-V196 HydrophobicContact CD1-CG1 4.38Å; F146-V196 HydrophobicContact CD1-CG2 3.47Å; F146-V196 VanDerWaalsContact CD1-CG2 3.47Å; F146-V196 HydrophobicContact CD2-CG2 3.73Å; F146-V196 HydrophobicContact CE1-CG1 4.47Å; F146-V196 HydrophobicContact CE1-CG2 3.44Å; F146-V196 VanDerWaalsContact CE1-CG2 3.44Å; F146-V196 HydrophobicContact CE2-CG2 3.71Å; F146-V196 HydrophobicContact CG-CG2 3.6Å; F146-V196 HydrophobicContact CZ-CG2 3.55Å; F150-V196 HydrophobicContact CE2-CG1 3.99Å; F150-V196 HydrophobicContact CZ-CG1 3.74Å; L177-V196 HydrophobicContact CD2-CB 4.33Å; L177-V196 HydrophobicContact CD2-CG1 4.49Å; L177-V196 HydrophobicContact CD2-CG2 4.33Å; V192-V196 HydrophobicContact CG1-CG2 4.32Å; V192-V196 VanDerWaalsContact O-CG2 3.25Å; V192-V196 WeakPolarHBondContact O-CG2 3.24Å; V192-V196 PolarHBondContact O-N 3.33Å; Y193-V196 PolarHBondContact O-N 3.23Å; V194-V196 PolarHBondContact O-N 2.73Å; V196-C201 VanDerWaalsContact O-CB 3.29Å; V196-C201 WeakPolarHBondContact O-CB 3.48Å; V196-L314 HydrophobicContact CG1-CD2 3.98Å; V196-Y344 PolarHBondContact O-OH 3.23Å
197	V	90.9	Very high	90.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-77.5	-41.2	-172.9	177.4	0	0	0	0	112.8	Y193 V194 N342 P343 Y344	Y193-V197 HydrophobicContact CD1-CG2 3.78Å; Y193-V197 HydrophobicContact CE1-CG2 3.54Å; Y193-V197 WeakPolarHBondContact O-CG2 3.27Å; Y193-V197 PolarHBondContact O-N 3.34Å; V194-V197 PolarHBondContact O-N 2.92Å; V197-N342 HydrophobicContact CG1-CB 4.32Å; V197-P343 WeakPolarHBondContact O-CD 3.47Å; V197-P343 VanDerWaalsContact O-CG 3.23Å; V197-P343 WeakPolarHBondContact O-CG 3.32Å; V197-Y344 HydrophobicContact CG1-CD2 4.42Å; V197-Y344 HydrophobicContact CG2-CE2 4.5Å
198	W	88.3	Confident	91.3	Very high	35 Å²	35	30 Å²	30	13%	0.133	18%	0.183	C	C	.	.	H	α-helix	trans	-119	1.3	-173	-64.5	-79.6	0	0	0	114.4	L189 V194 I321 I324 G340	L189-W198 HydrophobicContact CD1-CH2 4.1Å; L189-W198 HydrophobicContact CD1-CZ3 3.98Å; V194-W198 HydrophobicContact CG1-CE3 4.22Å; V194-W198 PolarHBondContact O-N 3Å; W198-I321 HydrophobicContact CB-CD1 4.06Å; W198-I321 HydrophobicContact CD2-CD1 4.2Å; W198-I321 HydrophobicContact CD2-CG1 3.92Å; W198-I321 HydrophobicContact CG-CD1 3.68Å; W198-I321 HydrophobicContact CG-CG1 3.96Å; W198-I321 HydrophobicContact CZ2-CG1 4.41Å; W198-I324 HydrophobicContact CH2-CD1 4Å; W198-I324 HydrophobicContact CZ3-CD1 3.88Å; W198-G340 PolarHBondContact NE1-O 3.5Å
199	G	87.8	Confident	92	Very high	29 Å²	29	26.5 Å²	26.5	30%	0.299	16%	0.16	S	C	.	.	S	Bend	trans	-96.1	-144.3	176.6	0	0	0	0	0	113.5	S195 C201 A202	S195-G199 WeakPolarHBondContact O-CA 3.32Å; S195-G199 PolarHBondContact O-N 3.3Å; G199-C201 PolarHBondContact O-N 3.15Å; G199-A202 WeakPolarHBondContact O-CB 3.35Å; G199-A202 PolarHBondContact O-N 3.37Å
200	K	89.9	Confident	92.5	Very high	123 Å²	123	29 Å²	29	54%	0.535	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.7	-173.3	-67.8	174.9	-178.1	154.6	0	114.5	E143 P147	E143-K200 IonicContact OE2-NZ 3.87Å; E143-K200 PolarHBondContact OE2-NZ 3.16Å; P147-K200 HydrophobicContact CG-CB 4.17Å
201	C	94	Very high	92.9	Very high	4 Å²	4	31.6 Å²	31.6	3%	0.027	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-16.2	178.2	-73.9	0	0	0	0	114.1	F146 P147 F150 V196 G199 P203 L204 Y344	F146-C201 VanDerWaalsContact CB-SG 3.54Å; P147-C201 VanDerWaalsContact CD-SG 3.56Å; F150-C201 HydrophobicContact CD2-CB 3.85Å; F150-C201 HydrophobicContact CE2-CB 3.68Å; V196-C201 VanDerWaalsContact O-CB 3.29Å; V196-C201 WeakPolarHBondContact O-CB 3.48Å; G199-C201 PolarHBondContact O-N 3.15Å; C201-P203 VanDerWaalsContact C-CD 3.47Å; C201-P203 VanDerWaalsContact C-N 3.35Å; C201-L204 WeakPolarHBondContact O-CB 3.34Å; C201-L204 PolarHBondContact O-N 3.07Å; C201-Y344 WeakPolarHBondContact CB-OH 3.32Å; C201-Y344 PolarHBondContact O-OH 3.16Å
202	A	92.2	Very high	93.4	Very high	24 Å²	24	30 Å²	30	20%	0.198	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-53.6	-42.3	-178.6	0	0	0	0	0	113.7	G199 L204 A205 P343	G199-A202 WeakPolarHBondContact O-CB 3.35Å; G199-A202 PolarHBondContact O-N 3.37Å; A202-L204 PolarHBondContact O-N 3.3Å; A202-A205 VanDerWaalsContact O-CB 3.28Å; A202-A205 WeakPolarHBondContact O-CB 3.29Å; A202-A205 PolarHBondContact O-N 3.13Å; A202-A205 VanDerWaalsContact O-N 3.15Å; A202-P343 HydrophobicContact CB-CG 3.91Å
203	P	94.1	Very high	93.8	Very high	106 Å²	106	29.7 Å²	29.7	69%	0.688	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-66.2	-17.3	176.7	-21.6	34.9	0	0	0	114.6	C201 A205	C201-P203 VanDerWaalsContact C-CD 3.47Å; C201-P203 VanDerWaalsContact C-N 3.35Å; P203-A205 VanDerWaalsContact C-N 3.32Å
204	L	96.3	Very high	94.1	Very high	32 Å²	32	29.9 Å²	29.9	17%	0.168	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-84.7	-7	178	-56.1	176.3	0	0	0	112.4	P147 F150 C201 A202 A207 L208	P147-L204 HydrophobicContact CB-CD1 4.24Å; F150-L204 HydrophobicContact CB-CD1 3.85Å; F150-L204 HydrophobicContact CD2-CB 4.48Å; F150-L204 HydrophobicContact CD2-CD1 4.29Å; C201-L204 WeakPolarHBondContact O-CB 3.34Å; C201-L204 PolarHBondContact O-N 3.07Å; A202-L204 PolarHBondContact O-N 3.3Å; L204-A207 PolarHBondContact O-N 3.34Å; L204-L208 WeakPolarHBondContact O-CB 3.38Å; L204-L208 PolarHBondContact O-N 3.28Å
205	A	95.8	Very high	94.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-54.4	-44.4	-176.5	0	0	0	0	0	114.1	A202 P203 A207 L208 V209 P343 Y344	A202-A205 VanDerWaalsContact O-CB 3.28Å; A202-A205 WeakPolarHBondContact O-CB 3.29Å; A202-A205 PolarHBondContact O-N 3.13Å; A202-A205 VanDerWaalsContact O-N 3.15Å; P203-A205 VanDerWaalsContact C-N 3.32Å; A205-A207 PolarHBondContact O-N 3.19Å; A205-L208 PolarHBondContact O-N 3.31Å; A205-V209 WeakPolarHBondContact O-CB 3.47Å; A205-V209 VanDerWaalsContact O-CG2 3.3Å; A205-V209 WeakPolarHBondContact O-CG2 3.27Å; A205-V209 PolarHBondContact O-N 3.15Å; A205-P343 HydrophobicContact CB-CB 3.9Å; A205-P343 HydrophobicContact CB-CG 4.3Å; A205-Y344 HydrophobicContact CB-CD1 3.62Å; A205-Y344 HydrophobicContact CB-CD2 4.38Å; A205-Y344 HydrophobicContact CB-CE1 3.63Å; A205-Y344 HydrophobicContact CB-CE2 4.36Å; A205-Y344 HydrophobicContact CB-CG 4Å
206	P	96.6	Very high	95.1	Very high	57 Å²	57	28.7 Å²	28.7	37%	0.37	16%	0.161	S	C	.	.	H	α-helix	trans	-53.4	-52.8	174.8	-29.2	38.3	0	0	0	113.8	Y210 T347 P398	P206-Y210 WeakPolarHBondContact O-CB 3.31Å; P206-Y210 PolarHBondContact O-N 3.2Å; P206-Y210 VanDerWaalsContact O-N 3.15Å; P206-T347 HydrophobicContact CB-CG2 4.47Å; P206-P398 HydrophobicContact CB-CG 4.25Å
207	A	97.1	Very high	95.3	Very high	46 Å²	46	29.3 Å²	29.3	38%	0.38	17%	0.165	S	C	.	.	H	α-helix	trans	-68.5	-39.6	-178	0	0	0	0	0	112	T154 L204 A205 R211	T154-A207 HydrophobicContact CG2-CB 4.05Å; L204-A207 PolarHBondContact O-N 3.34Å; A205-A207 PolarHBondContact O-N 3.19Å; A207-R211 WeakPolarHBondContact O-CB 3.41Å; A207-R211 PolarHBondContact O-N 3.2Å
208	L	98.4	Very high	95.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.5	-48.5	-179.2	-171.7	69.1	0	0	0	111.6	F150 I153 T154 L204 A205 Y210 R211 L212 L314 Y344	F150-L208 HydrophobicContact CB-CD1 4.34Å; F150-L208 HydrophobicContact CD1-CD1 4.13Å; F150-L208 HydrophobicContact CD1-CD2 3.96Å; F150-L208 HydrophobicContact CD2-CD2 3.71Å; F150-L208 HydrophobicContact CE1-CD2 3.83Å; F150-L208 HydrophobicContact CE2-CD2 3.58Å; F150-L208 HydrophobicContact CG-CD1 4.16Å; F150-L208 HydrophobicContact CG-CD2 3.9Å; F150-L208 HydrophobicContact CZ-CD2 3.64Å; I153-L208 HydrophobicContact CB-CD1 4.33Å; I153-L208 HydrophobicContact CG2-CD1 3.89Å; T154-L208 HydrophobicContact CG2-CB 4.41Å; T154-L208 HydrophobicContact CG2-CD1 4.21Å; L204-L208 WeakPolarHBondContact O-CB 3.38Å; L204-L208 PolarHBondContact O-N 3.28Å; A205-L208 PolarHBondContact O-N 3.31Å; L208-Y210 VanDerWaalsContact C-N 3.33Å; L208-Y210 PolarHBondContact O-N 3.33Å; L208-R211 PolarHBondContact O-N 3.07Å; L208-L212 HydrophobicContact CD1-CD1 4.32Å; L208-L212 HydrophobicContact CD1-CG 4.23Å; L208-L212 HydrophobicContact CD2-CD1 4.28Å; L208-L212 HydrophobicContact CG-CD1 3.85Å; L208-L212 HydrophobicContact CG-CG 4.15Å; L208-L212 WeakPolarHBondContact O-CB 3.36Å; L208-L212 VanDerWaalsContact O-CG 3.24Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 3.38Å; L208-L314 HydrophobicContact CD2-CD1 3.68Å; L208-Y344 HydrophobicContact CB-CE1 4.37Å; L208-Y344 HydrophobicContact CD2-CD1 4.2Å; L208-Y344 HydrophobicContact CD2-CE1 3.6Å
209	V	98.2	Very high	95.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-44.3	178.9	170.1	0	0	0	0	110.7	A205 L212 L213 L311 Y344 T347 L348 L351	A205-V209 WeakPolarHBondContact O-CB 3.47Å; A205-V209 VanDerWaalsContact O-CG2 3.3Å; A205-V209 WeakPolarHBondContact O-CG2 3.27Å; A205-V209 PolarHBondContact O-N 3.15Å; V209-L212 PolarHBondContact O-N 2.99Å; V209-L213 VanDerWaalsContact O-CB 3.3Å; V209-L213 WeakPolarHBondContact O-CB 3.03Å; V209-L213 PolarHBondContact O-N 3.03Å; V209-L311 HydrophobicContact CB-CD1 4.42Å; V209-L311 HydrophobicContact CG1-CD1 4.15Å; V209-L311 HydrophobicContact CG2-CD1 4.02Å; V209-Y344 HydrophobicContact CG2-CD1 4.08Å; V209-T347 HydrophobicContact CB-CG2 3.64Å; V209-T347 HydrophobicContact CG1-CG2 3.86Å; V209-T347 HydrophobicContact CG2-CG2 3.97Å; V209-L348 HydrophobicContact CG1-CB 4.12Å; V209-L348 HydrophobicContact CG1-CD1 4.11Å; V209-L351 HydrophobicContact CG1-CD1 4.4Å
210	Y	97.8	Very high	96.1	Very high	79 Å²	79	36.1 Å²	36.1	31%	0.31	19%	0.187	S	C	.	.	H	α-helix	trans	-53.7	-56	173.1	171.3	-99.1	0	0	0	110.6	P206 L208 L212 L213 S214 P398 Q399 I400	P206-Y210 WeakPolarHBondContact O-CB 3.31Å; P206-Y210 PolarHBondContact O-N 3.2Å; P206-Y210 VanDerWaalsContact O-N 3.15Å; L208-Y210 VanDerWaalsContact C-N 3.33Å; L208-Y210 PolarHBondContact O-N 3.33Å; Y210-L212 PolarHBondContact O-N 3.04Å; Y210-L213 PolarHBondContact O-N 3.02Å; Y210-S214 WeakPolarHBondContact O-CB 3.32Å; Y210-S214 PolarHBondContact O-N 3.03Å; Y210-S214 PolarHBondContact O-OG 3.22Å; Y210-P398 HydrophobicContact CD2-CB 4.44Å; Y210-Q399 WeakPolarHBondContact CD2-O 3.47Å; Y210-Q399 WeakPolarHBondContact CE2-O 3.43Å; Y210-I400 HydrophobicContact CD2-CB 4.1Å; Y210-I400 HydrophobicContact CD2-CD1 4.37Å; Y210-I400 HydrophobicContact CD2-CG1 4.45Å; Y210-I400 HydrophobicContact CE2-CB 4.11Å; Y210-I400 HydrophobicContact CE2-CG1 4.27Å
211	R	98.2	Very high	96	Very high	56 Å²	56	34 Å²	34	21%	0.211	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-45.1	-177.7	176.5	62.3	69.5	-165.9	2.7	113.2	I153 T154 A207 L208 L213 S214 N215	I153-R211 HydrophobicContact CG2-CG 3.95Å; I153-R211 WeakPolarHBondContact O-CG 3.47Å; T154-R211 HydrophobicContact CG2-CB 4.1Å; T154-R211 PolarHBondContact O-NE 3.47Å; T154-R211 PolarHBondContact O-NH2 3.46Å; A207-R211 WeakPolarHBondContact O-CB 3.41Å; A207-R211 PolarHBondContact O-N 3.2Å; L208-R211 PolarHBondContact O-N 3.07Å; R211-L213 VanDerWaalsContact C-N 3.3Å; R211-L213 PolarHBondContact O-N 2.9Å; R211-S214 PolarHBondContact O-N 2.97Å; R211-N215 VanDerWaalsContact O-CG 3.23Å; R211-N215 PolarHBondContact O-N 2.95Å; R211-N215 PolarHBondContact O-OD1 2.79Å
212	L	98.7	Very high	95.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-40.4	-179.8	-67.8	176.4	0	0	0	111.3	I153 H170 L208 V209 Y210 N215 F216 S307 L310 L311 L314	I153-L212 HydrophobicContact CG2-CD2 4.4Å; H170-L212 WeakPolarHBondContact NE2-CD2 3.23Å; L208-L212 HydrophobicContact CD1-CD1 4.32Å; L208-L212 HydrophobicContact CD1-CG 4.23Å; L208-L212 HydrophobicContact CD2-CD1 4.28Å; L208-L212 HydrophobicContact CG-CD1 3.85Å; L208-L212 HydrophobicContact CG-CG 4.15Å; L208-L212 WeakPolarHBondContact O-CB 3.36Å; L208-L212 VanDerWaalsContact O-CG 3.24Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 3.38Å; V209-L212 PolarHBondContact O-N 2.99Å; Y210-L212 PolarHBondContact O-N 3.04Å; L212-N215 PolarHBondContact O-N 3.39Å; L212-F216 PolarHBondContact O-N 3.46Å; L212-F216 VanDerWaalsContact O-N 3.16Å; L212-S307 WeakPolarHBondContact O-CB 3.35Å; L212-L310 HydrophobicContact CD1-CD2 4.36Å; L212-L310 HydrophobicContact CD1-CG 4.22Å; L212-L310 HydrophobicContact CD2-CD2 4.13Å; L212-L311 HydrophobicContact CB-CB 4.21Å; L212-L311 HydrophobicContact CD1-CB 4.02Å; L212-L311 HydrophobicContact CD1-CD1 4.39Å; L212-L314 HydrophobicContact CD1-CD1 4.24Å
213	L	98	Very high	94.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-75.3	-32.6	177.6	-168.3	59.7	0	0	0	112.1	V209 Y210 R211 F216 S217 L311 L348 L351 I400 I405 L421 L425	V209-L213 VanDerWaalsContact O-CB 3.3Å; V209-L213 WeakPolarHBondContact O-CB 3.03Å; V209-L213 PolarHBondContact O-N 3.03Å; Y210-L213 PolarHBondContact O-N 3.02Å; R211-L213 VanDerWaalsContact C-N 3.3Å; R211-L213 PolarHBondContact O-N 2.9Å; L213-F216 HydrophobicContact CD1-CB 4.49Å; L213-F216 HydrophobicContact CD1-CD1 4.11Å; L213-F216 WeakPolarHBondContact O-CB 3.22Å; L213-F216 PolarHBondContact O-N 2.7Å; L213-S217 WeakPolarHBondContact O-CB 3.36Å; L213-S217 PolarHBondContact O-N 3.33Å; L213-S217 PolarHBondContact O-OG 3.45Å; L213-L311 HydrophobicContact CB-CD2 4.31Å; L213-L311 HydrophobicContact CD1-CD2 4.31Å; L213-L348 HydrophobicContact CD2-CD1 4.26Å; L213-L351 HydrophobicContact CD2-CD1 3.37Å; L213-I400 HydrophobicContact CB-CD1 3.73Å; L213-I400 HydrophobicContact CD2-CD1 3.97Å; L213-I400 HydrophobicContact CD2-CG2 4.32Å; L213-I400 HydrophobicContact CG-CD1 3.69Å; L213-I405 HydrophobicContact CD1-CD1 4.21Å; L213-I405 HydrophobicContact CD1-CG1 4.4Å; L213-I405 HydrophobicContact CD2-CD1 3.64Å; L213-I405 HydrophobicContact CG-CD1 3.76Å; L213-I405 HydrophobicContact CG-CG1 4.23Å; L213-L421 HydrophobicContact CD1-CD1 4.45Å; L213-L421 HydrophobicContact CD1-CD2 3.83Å; L213-L421 HydrophobicContact CD1-CG 4.4Å; L213-L425 HydrophobicContact CD1-CD1 4.27Å; L213-L425 HydrophobicContact CD2-CD2 4.4Å
214	S	97.7	Very high	93.8	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-46.5	170	-62.5	0	0	0	0	110.6	Y210 R211 F216 S217 E218	Y210-S214 WeakPolarHBondContact O-CB 3.32Å; Y210-S214 PolarHBondContact O-N 3.03Å; Y210-S214 PolarHBondContact O-OG 3.22Å; R211-S214 PolarHBondContact O-N 2.97Å; S214-F216 PolarHBondContact O-N 3.3Å; S214-S217 WeakPolarHBondContact CA-OG 3.5Å; S214-S217 PolarHBondContact O-N 2.9Å; S214-S217 VanDerWaalsContact O-N 3.08Å; S214-S217 PolarHBondContact O-OG 3.36Å; S214-E218 WeakPolarHBondContact O-CB 3.49Å; S214-E218 VanDerWaalsContact O-CG 3.27Å; S214-E218 WeakPolarHBondContact O-CG 3.47Å; S214-E218 PolarHBondContact O-N 3.49Å
215	N	98.1	Very high	92	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-58.2	-38.1	175.9	-70.2	-9.2	0	0	0	112.3	I158 R211 L212 N219 L303 S304 S307	I158-N215 WeakPolarHBondContact CD1-OD1 3.5Å; R211-N215 VanDerWaalsContact O-CG 3.23Å; R211-N215 PolarHBondContact O-N 2.95Å; R211-N215 PolarHBondContact O-OD1 2.79Å; L212-N215 PolarHBondContact O-N 3.39Å; N215-N219 PolarHBondContact O-N 3.24Å; N215-L303 HydrophobicContact CB-CG 4.41Å; N215-S304 WeakPolarHBondContact O-CB 3.44Å; N215-S307 VanDerWaalsContact CB-OG 3.25Å; N215-S307 WeakPolarHBondContact CB-OG 3.42Å; N215-S307 PolarHBondContact ND2-OG 2.71Å
216	F	97.6	Very high	90.1	Very high	3 Å²	3	41 Å²	41	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-59.4	170	173.3	-104.2	0	0	0	110.3	L212 L213 S214 E218 N219 S304 S308 I405 T408 A409 L421	L212-F216 PolarHBondContact O-N 3.46Å; L212-F216 VanDerWaalsContact O-N 3.16Å; L213-F216 HydrophobicContact CD1-CB 4.49Å; L213-F216 HydrophobicContact CD1-CD1 4.11Å; L213-F216 WeakPolarHBondContact O-CB 3.22Å; L213-F216 PolarHBondContact O-N 2.7Å; S214-F216 PolarHBondContact O-N 3.3Å; F216-E218 VanDerWaalsContact C-N 3.29Å; F216-E218 PolarHBondContact O-N 2.8Å; F216-N219 PolarHBondContact O-N 2.71Å; F216-S304 WeakPolarHBondContact CA-OG 3.25Å; F216-S308 VanDerWaalsContact CD2-OG 3.27Å; F216-S308 WeakPolarHBondContact CD2-OG 3.31Å; F216-I405 HydrophobicContact CD1-CG2 4.48Å; F216-I405 HydrophobicContact CE1-CG2 4.13Å; F216-T408 HydrophobicContact CD1-CG2 4.46Å; F216-T408 HydrophobicContact CD2-CG2 4.15Å; F216-T408 HydrophobicContact CE1-CG2 4.15Å; F216-T408 HydrophobicContact CE2-CG2 3.84Å; F216-T408 HydrophobicContact CG-CG2 4.47Å; F216-T408 HydrophobicContact CZ-CG2 3.85Å; F216-T408 WeakPolarHBondContact O-CG2 3.19Å; F216-A409 HydrophobicContact CE1-CB 4.41Å; F216-A409 HydrophobicContact CZ-CB 4.17Å; F216-L421 HydrophobicContact CD1-CD2 3.99Å; F216-L421 HydrophobicContact CD2-CD2 4.28Å; F216-L421 HydrophobicContact CE1-CD2 4.24Å; F216-L421 HydrophobicContact CG-CD2 4Å; F216-L421 HydrophobicContact CZ-CD2 4.47Å
217	S	96.5	Very high	87.5	Confident	14 Å²	14	42.8 Å²	42.8	10%	0.098	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-34	-174.7	72.5	0	0	0	0	114.7	L213 S214 T408	L213-S217 WeakPolarHBondContact O-CB 3.36Å; L213-S217 PolarHBondContact O-N 3.33Å; L213-S217 PolarHBondContact O-OG 3.45Å; S214-S217 WeakPolarHBondContact CA-OG 3.5Å; S214-S217 PolarHBondContact O-N 2.9Å; S214-S217 VanDerWaalsContact O-N 3.08Å; S214-S217 PolarHBondContact O-OG 3.36Å; S217-T408 PolarHBondContact O-OG1 2.94Å
218	E	96.2	Very high	84.7	Confident	76 Å²	76	43.4 Å²	43.4	36%	0.355	23%	0.233	S	C	.	.	H	α-helix	trans	-79.1	-24.7	178.8	-68.8	174.2	-165.2	0	0	112	S214 F216 R220	S214-E218 WeakPolarHBondContact O-CB 3.49Å; S214-E218 VanDerWaalsContact O-CG 3.27Å; S214-E218 WeakPolarHBondContact O-CG 3.47Å; S214-E218 PolarHBondContact O-N 3.49Å; F216-E218 VanDerWaalsContact C-N 3.29Å; F216-E218 PolarHBondContact O-N 2.8Å; E218-R220 VanDerWaalsContact C-N 3.26Å; E218-R220 HydrophobicContact CB-CG 4.11Å; E218-R220 PolarHBondContact O-N 3.49Å; E218-R220 VanDerWaalsContact O-N 3.1Å; E218-R220 IonicContact OE1-NH2 2.69Å; E218-R220 IonicContact OE2-CZ 3.83Å; E218-R220 IonicContact OE2-NE 2.92Å; E218-R220 PolarHBondContact OE2-NE 3.49Å; E218-R220 IonicContact OE2-NH2 2.86Å; E218-R220 PolarHBondContact OE2-NH2 3.24Å
219	N	95.1	Very high	81.8	Confident	21 Å²	21	46.4 Å²	46.4	11%	0.112	25%	0.248	C	C	.	.			trans	36.8	53.2	-178.1	-164.4	28.5	0	0	0	113.5	N215 F216 Q299 C300 H301 S304 T408	N215-N219 PolarHBondContact O-N 3.24Å; F216-N219 PolarHBondContact O-N 2.71Å; N219-Q299 PolarHBondContact ND2-O 3.22Å; N219-C300 WeakPolarHBondContact OD1-CA 3.31Å; N219-H301 PolarHBondContact O-CD2 2.8Å; N219-H301 VanDerWaalsContact O-CD2 3.23Å; N219-H301 PolarHBondContact OD1-N 3.13Å; N219-S304 VanDerWaalsContact OD1-CB 3.27Å; N219-S304 WeakPolarHBondContact OD1-CB 3.49Å; N219-S304 PolarHBondContact OD1-OG 3.04Å; N219-T408 HydrophobicContact CB-CG2 3.94Å
220	R	92.2	Very high	78.7	Confident	110 Å²	110	51.5 Å²	51.5	42%	0.415	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-64.2	129.5	-173.2	-65.1	-173.3	-172.9	-119.3	-5.2	111.6	Y163 E218 H301	Y163-R220 HydrophobicContact CE2-CB 4.32Å; Y163-R220 PolarHBondContact OH-O 3.36Å; E218-R220 VanDerWaalsContact C-N 3.26Å; E218-R220 HydrophobicContact CB-CG 4.11Å; E218-R220 PolarHBondContact O-N 3.49Å; E218-R220 VanDerWaalsContact O-N 3.1Å; E218-R220 IonicContact OE1-NH2 2.69Å; E218-R220 IonicContact OE2-CZ 3.83Å; E218-R220 IonicContact OE2-NE 2.92Å; E218-R220 PolarHBondContact OE2-NE 3.49Å; E218-R220 IonicContact OE2-NH2 2.86Å; E218-R220 PolarHBondContact OE2-NH2 3.24Å; R220-H301 WeakPolarHBondContact O-CB 3.24Å
221	P	88.1	Confident	75.6	Confident	80 Å²	80	53.7 Å²	53.7	52%	0.519	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-63.5	160.5	174	29.6	-35.2	0	0	0	110.5
222	V	82.1	Confident	72.7	Confident	29 Å²	29	53.4 Å²	53.4	18%	0.176	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-63.6	136.4	169.8	-177	0	0	0	0	108	Y163 L226 H227 L302	Y163-V222 HydrophobicContact CE1-CB 4.5Å; Y163-V222 HydrophobicContact CE1-CG1 4.49Å; Y163-V222 HydrophobicContact CE1-CG2 4.08Å; V222-L226 HydrophobicContact CG1-CB 4.12Å; V222-L226 HydrophobicContact CG1-CD1 4.21Å; V222-H227 PolarHBondContact O-CE1 3.06Å; V222-L302 HydrophobicContact CG2-CB 4.36Å
223	P	80.7	Confident	69.9	Low	9 Å²	9	55 Å²	55	6%	0.058	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-53.1	143.5	176.1	-30.8	34.2	0	0	0	114.4	D160 Y163 L225 L226 H227	D160-P223 HydrophobicContact CB-CB 3.85Å; D160-P223 HydrophobicContact CB-CG 3.99Å; Y163-P223 HydrophobicContact CD2-CG 4.3Å; Y163-P223 HydrophobicContact CG-CG 4.1Å; P223-L225 PolarHBondContact O-N 3.42Å; P223-L226 HydrophobicContact CB-CD1 3.99Å; P223-L226 HydrophobicContact CB-CG 4.2Å; P223-L226 HydrophobicContact CG-CD1 4.01Å; P223-L226 WeakPolarHBondContact O-CA 3.2Å; P223-L226 WeakPolarHBondContact O-CB 3.3Å; P223-L226 PolarHBondContact O-N 3.34Å; P223-L226 VanDerWaalsContact O-N 3.07Å; P223-H227 PolarHBondContact O-N 2.79Å; P223-H227 PolarHBondContact O-ND1 3.17Å
224	T	70.3	Confident	67	Low	107 Å²	107	60.2 Å²	60.2	66%	0.656	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-69.6	-29.1	-177.7	52.6	0	0	0	0	113.7	L226 H227	T224-L226 PolarHBondContact O-N 3.43Å; T224-L226 VanDerWaalsContact O-N 3.14Å; T224-H227 WeakPolarHBondContact CA-ND1 3.35Å; T224-H227 WeakPolarHBondContact O-CA 3.39Å; T224-H227 VanDerWaalsContact O-CB 3.26Å; T224-H227 WeakPolarHBondContact O-CB 3.25Å; T224-H227 PolarHBondContact O-N 3.44Å
225	L	58.8	Low	64	Low	141 Å²	141	60.8 Å²	60.8	74%	0.738	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-62.4	-17.1	170.9	-74.7	144.5	0	0	0	112.4	P223	P223-L225 PolarHBondContact O-N 3.42Å
226	L	55.3	Low	61.3	Low	26 Å²	26	64.6 Å²	64.6	14%	0.136	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-99.4	0.4	172.2	-51.7	171.2	0	0	0	112.1	L164 V222 P223 T224 G228 I229	L164-L226 HydrophobicContact CD1-CD1 3.85Å; L164-L226 HydrophobicContact CD1-CD2 4.02Å; L164-L226 HydrophobicContact CD2-CD1 4.37Å; L164-L226 HydrophobicContact CG-CD1 3.83Å; V222-L226 HydrophobicContact CG1-CB 4.12Å; V222-L226 HydrophobicContact CG1-CD1 4.21Å; P223-L226 HydrophobicContact CB-CD1 3.99Å; P223-L226 HydrophobicContact CB-CG 4.2Å; P223-L226 HydrophobicContact CG-CD1 4.01Å; P223-L226 WeakPolarHBondContact O-CA 3.2Å; P223-L226 WeakPolarHBondContact O-CB 3.3Å; P223-L226 PolarHBondContact O-N 3.34Å; P223-L226 VanDerWaalsContact O-N 3.07Å; T224-L226 PolarHBondContact O-N 3.43Å; T224-L226 VanDerWaalsContact O-N 3.14Å; L226-G228 PolarHBondContact O-N 3.33Å; L226-I229 HydrophobicContact CD2-CD1 3.79Å; L226-I229 VanDerWaalsContact O-CB 3.28Å; L226-I229 WeakPolarHBondContact O-CB 3.29Å; L226-I229 PolarHBondContact O-N 3.39Å
227	H	42.7	Very low	58.4	Low	94 Å²	94	72.9 Å²	72.9	44%	0.435	37%	0.368	S	S	.	.	S	Bend	trans	-80.2	117.8	171	-74.1	57.3	0	0	0	108.8	V222 P223 T224 E230	V222-H227 PolarHBondContact O-CE1 3.06Å; P223-H227 PolarHBondContact O-N 2.79Å; P223-H227 PolarHBondContact O-ND1 3.17Å; T224-H227 WeakPolarHBondContact CA-ND1 3.35Å; T224-H227 WeakPolarHBondContact O-CA 3.39Å; T224-H227 VanDerWaalsContact O-CB 3.26Å; T224-H227 WeakPolarHBondContact O-CB 3.25Å; T224-H227 PolarHBondContact O-N 3.44Å; H227-E230 IonicContact CD2-OE1 3.27Å; H227-E230 PolarHBondContact CD2-OE1 3.18Å; H227-E230 VanDerWaalsContact CD2-OE1 3.27Å; H227-E230 IonicContact CG-OE1 3.98Å; H227-E230 IonicContact NE2-OE1 3.75Å
228	G	37.8	Very low	55.3	Low	59 Å²	59	72.8 Å²	72.8	61%	0.608	37%	0.368	S	S	*	.	S	Bend	trans	112.1	-34.8	-163.9	0	0	0	0	0	113	L226 E230	L226-G228 PolarHBondContact O-N 3.33Å; G228-E230 PolarHBondContact O-N 3.23Å; G228-E230 VanDerWaalsContact O-N 3.16Å
229	I	38.5	Very low	52.2	Low	63 Å²	63	71 Å²	71	32%	0.323	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-0.6	150.1	-64.4	173.2	0	0	0	108.5	L226 Q231 Y232 N233	L226-I229 HydrophobicContact CD2-CD1 3.79Å; L226-I229 VanDerWaalsContact O-CB 3.28Å; L226-I229 WeakPolarHBondContact O-CB 3.29Å; L226-I229 PolarHBondContact O-N 3.39Å; I229-Q231 PolarHBondContact O-N 3.21Å; I229-Q231 VanDerWaalsContact O-N 3.15Å; I229-Y232 VanDerWaalsContact CG2-CB 3.46Å; I229-Y232 HydrophobicContact CG2-CD1 3.66Å; I229-Y232 HydrophobicContact CG2-CG 3.84Å; I229-Y232 CarbonylContact O-C 3.54Å; I229-Y232 VanDerWaalsContact O-C 3.29Å; I229-Y232 WeakPolarHBondContact O-CA 3.47Å; I229-Y232 WeakPolarHBondContact O-CB 3.09Å; I229-Y232 PolarHBondContact O-N 3.01Å; I229-N233 VanDerWaalsContact O-CG 3.23Å; I229-N233 PolarHBondContact O-N 3.36Å; I229-N233 PolarHBondContact O-ND2 2.94Å
230	E	33.8	Very low	49.3	Very low	107 Å²	107	71 Å²	71	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-55.4	-26.3	166.8	-73.4	-166.5	164.9	0	0	114.9	H227 G228 N233 L234	H227-E230 IonicContact CD2-OE1 3.27Å; H227-E230 PolarHBondContact CD2-OE1 3.18Å; H227-E230 VanDerWaalsContact CD2-OE1 3.27Å; H227-E230 IonicContact CG-OE1 3.98Å; H227-E230 IonicContact NE2-OE1 3.75Å; G228-E230 PolarHBondContact O-N 3.23Å; G228-E230 VanDerWaalsContact O-N 3.16Å; E230-N233 CarbonylContact O-C 3.56Å; E230-N233 PolarHBondContact O-N 3.32Å; E230-L234 WeakPolarHBondContact O-CA 3.3Å; E230-L234 WeakPolarHBondContact O-CB 3.31Å; E230-L234 PolarHBondContact O-N 3.49Å
231	Q	32.4	Very low	46.3	Very low	125 Å²	125	69.3 Å²	69.3	58%	0.584	37%	0.374	S	S	*	.	H	α-helix	trans	-75.7	-30.5	168.8	-74	-179.4	-9.1	0	0	112.1	I229 I235	I229-Q231 PolarHBondContact O-N 3.21Å; I229-Q231 VanDerWaalsContact O-N 3.15Å; Q231-I235 WeakPolarHBondContact O-CD1 3.44Å; Q231-I235 VanDerWaalsContact O-CG1 3.26Å; Q231-I235 WeakPolarHBondContact O-CG1 3.41Å; Q231-I235 PolarHBondContact O-N 3.23Å
232	Y	36.1	Very low	43.4	Very low	51 Å²	51	70.8 Å²	70.8	20%	0.2	38%	0.376	C	S	.	.	H	α-helix	trans	-71.5	-33.3	168.5	-160.1	-95.7	0	0	0	111	L49 I229 I235 W236	L49-Y232 HydrophobicContact CD1-CD2 4.02Å; L49-Y232 HydrophobicContact CD1-CE1 4.32Å; L49-Y232 HydrophobicContact CD1-CE2 3.34Å; I229-Y232 VanDerWaalsContact CG2-CB 3.46Å; I229-Y232 HydrophobicContact CG2-CD1 3.66Å; I229-Y232 HydrophobicContact CG2-CG 3.84Å; I229-Y232 CarbonylContact O-C 3.54Å; I229-Y232 VanDerWaalsContact O-C 3.29Å; I229-Y232 WeakPolarHBondContact O-CA 3.47Å; I229-Y232 WeakPolarHBondContact O-CB 3.09Å; I229-Y232 PolarHBondContact O-N 3.01Å; Y232-I235 CarbonylContact O-C 3.29Å; Y232-I235 WeakPolarHBondContact O-CB 3.26Å; Y232-I235 PolarHBondContact O-N 3.11Å; Y232-W236 AromaticContact CD1-CD1 3.98Å; Y232-W236 AromaticContact CD1-NE1 3.83Å; Y232-W236 AromaticContact CE1-NE1 3.8Å; Y232-W236 PolarHBondContact O-N 2.86Å
233	N	40.2	Very low	40.8	Very low	32 Å²	32	72.1 Å²	72.1	17%	0.171	39%	0.39	C	S	.	.	H	α-helix	trans	-79.3	-28.5	174.1	-58.2	-29.3	0	0	0	111.5	I229 E230 I235 W236 R237	I229-N233 VanDerWaalsContact O-CG 3.23Å; I229-N233 PolarHBondContact O-N 3.36Å; I229-N233 PolarHBondContact O-ND2 2.94Å; E230-N233 CarbonylContact O-C 3.56Å; E230-N233 PolarHBondContact O-N 3.32Å; N233-I235 VanDerWaalsContact C-N 3.26Å; N233-W236 CarbonylContact O-C 3.59Å; N233-W236 WeakPolarHBondContact O-CB 3.15Å; N233-W236 PolarHBondContact O-N 3.21Å; N233-R237 WeakPolarHBondContact O-CG 3.18Å; N233-R237 PolarHBondContact O-N 3.36Å
234	L	37.5	Very low	38.2	Very low	110 Å²	110	73.8 Å²	73.8	58%	0.576	41%	0.409	S	S	*	.	H	α-helix	trans	-68	-33.8	167.7	-163.1	77.5	0	0	0	108.5	E230 R237 A238	E230-L234 WeakPolarHBondContact O-CA 3.3Å; E230-L234 WeakPolarHBondContact O-CB 3.31Å; E230-L234 PolarHBondContact O-N 3.49Å; L234-R237 CarbonylContact O-C 3.52Å; L234-R237 PolarHBondContact O-N 3.29Å; L234-A238 VanDerWaalsContact O-CA 3.32Å; L234-A238 WeakPolarHBondContact O-CA 3.4Å; L234-A238 WeakPolarHBondContact O-CB 3.37Å; L234-A238 PolarHBondContact O-N 2.98Å
235	I	34.7	Very low	36	Very low	15 Å²	15	73.2 Å²	73.2	8%	0.077	41%	0.41	C	S	.	.	H	α-helix	trans	-72	-35.5	168.8	-67.1	163.9	0	0	0	111.9	S46 L49 I50 Q231 Y232 N233 R237 A238 A239	S46-I235 WeakPolarHBondContact O-CD1 3.22Å; L49-I235 HydrophobicContact CB-CB 4.44Å; L49-I235 HydrophobicContact CB-CG2 3.25Å; I50-I235 HydrophobicContact CD1-CG1 4.15Å; I50-I235 HydrophobicContact CG1-CB 4.27Å; I50-I235 HydrophobicContact CG1-CG1 4.02Å; I50-I235 HydrophobicContact CG1-CG2 3.71Å; Q231-I235 WeakPolarHBondContact O-CD1 3.44Å; Q231-I235 VanDerWaalsContact O-CG1 3.26Å; Q231-I235 WeakPolarHBondContact O-CG1 3.41Å; Q231-I235 PolarHBondContact O-N 3.23Å; Y232-I235 CarbonylContact O-C 3.29Å; Y232-I235 WeakPolarHBondContact O-CB 3.26Å; Y232-I235 PolarHBondContact O-N 3.11Å; N233-I235 VanDerWaalsContact C-N 3.26Å; I235-R237 PolarHBondContact O-N 2.85Å; I235-A238 PolarHBondContact O-N 3.03Å; I235-A239 HydrophobicContact CG2-CB 4.29Å; I235-A239 WeakPolarHBondContact O-CB 3.43Å; I235-A239 PolarHBondContact O-N 3.26Å
236	W	41.3	Very low	34.4	Very low	84 Å²	84	74.1 Å²	74.1	32%	0.318	41%	0.414	S	S	.	.	H	α-helix	trans	-59.7	-33.2	166.2	-80.6	102.3	0	0	0	113.1	L106 E168 L171 Y232 N233	L106-W236 HydrophobicContact CD1-CH2 3.76Å; L106-W236 HydrophobicContact CD1-CZ2 4.13Å; E168-W236 VanDerWaalsContact OE2-CH2 3.28Å; E168-W236 WeakPolarHBondContact OE2-CH2 3.3Å; L171-W236 HydrophobicContact CD1-CZ3 4.1Å; Y232-W236 AromaticContact CD1-CD1 3.98Å; Y232-W236 AromaticContact CD1-NE1 3.83Å; Y232-W236 AromaticContact CE1-NE1 3.8Å; Y232-W236 PolarHBondContact O-N 2.86Å; N233-W236 CarbonylContact O-C 3.59Å; N233-W236 WeakPolarHBondContact O-CB 3.15Å; N233-W236 PolarHBondContact O-N 3.21Å
237	R	36.5	Very low	33	Very low	178 Å²	178	77.9 Å²	77.9	67%	0.672	44%	0.438	S	S	*	.	H	α-helix	trans	-84.1	-34.1	174.2	-69.4	178.5	71.1	149.2	2.8	112.9	N233 L234 I235 S241	N233-R237 WeakPolarHBondContact O-CG 3.18Å; N233-R237 PolarHBondContact O-N 3.36Å; L234-R237 CarbonylContact O-C 3.52Å; L234-R237 PolarHBondContact O-N 3.29Å; I235-R237 PolarHBondContact O-N 2.85Å; R237-S241 WeakPolarHBondContact O-CA 3.3Å; R237-S241 WeakPolarHBondContact O-CB 3.22Å; R237-S241 PolarHBondContact O-N 3.38Å
238	A	31.3	Very low	32	Very low	11 Å²	11	79 Å²	79	9%	0.091	45%	0.452	C	S	.	.	H	α-helix	trans	-94.7	-31.3	-169.2	0	0	0	0	0	113.5	I50 L234 I235 A240 S241 I242	I50-A238 HydrophobicContact CD1-CB 3.77Å; I50-A238 HydrophobicContact CG1-CB 4.47Å; L234-A238 VanDerWaalsContact O-CA 3.32Å; L234-A238 WeakPolarHBondContact O-CA 3.4Å; L234-A238 WeakPolarHBondContact O-CB 3.37Å; L234-A238 PolarHBondContact O-N 2.98Å; I235-A238 PolarHBondContact O-N 3.03Å; A238-A240 PolarHBondContact O-N 2.92Å; A238-S241 PolarHBondContact O-N 3.19Å; A238-I242 HydrophobicContact CB-CD1 3.56Å; A238-I242 HydrophobicContact CB-CG1 3.74Å; A238-I242 WeakPolarHBondContact O-CB 3.11Å; A238-I242 PolarHBondContact O-N 3.25Å
239	A	31	Very low	31.3	Very low	39 Å²	39	83.1 Å²	83.1	32%	0.322	46%	0.458	S	S	.	.	H	α-helix	trans	-59.5	-25.8	170.4	0	0	0	0	0	110.8	I50 I235	I50-A239 HydrophobicContact CG1-CB 4.13Å; I235-A239 HydrophobicContact CG2-CB 4.29Å; I235-A239 WeakPolarHBondContact O-CB 3.43Å; I235-A239 PolarHBondContact O-N 3.26Å
240	A	34.1	Very low	30.6	Very low	20 Å²	20	84.9 Å²	84.9	17%	0.165	47%	0.472	C	S	.	.	H	α-helix	trans	-98.7	-30.8	169.6	0	0	0	0	0	115.2	A238 G740 H742	A238-A240 PolarHBondContact O-N 2.92Å; A240-G740 WeakPolarHBondContact CB-O 3.21Å; A240-H742 HydrophobicContact CB-CB 4.17Å
241	S	29.8	Very low	30.1	Very low	75 Å²	75	85 Å²	85	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-93.2	-24.2	-173.4	-173.9	0	0	0	0	116.1	R237 A238 A243 G244	R237-S241 WeakPolarHBondContact O-CA 3.3Å; R237-S241 WeakPolarHBondContact O-CB 3.22Å; R237-S241 PolarHBondContact O-N 3.38Å; A238-S241 PolarHBondContact O-N 3.19Å; S241-A243 VanDerWaalsContact C-N 3.29Å; S241-A243 PolarHBondContact O-N 2.7Å; S241-G244 PolarHBondContact O-N 3.09Å
242	I	27.4	Very low	29.9	Very low	111 Å²	111	87.2 Å²	87.2	57%	0.569	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-12.3	-173.1	-66.3	-175.4	0	0	0	112.9	I50 A238	I50-I242 HydrophobicContact CD1-CD1 4.44Å; A238-I242 HydrophobicContact CB-CD1 3.56Å; A238-I242 HydrophobicContact CB-CG1 3.74Å; A238-I242 WeakPolarHBondContact O-CB 3.11Å; A238-I242 PolarHBondContact O-N 3.25Å
243	A	26.3	Very low	29.2	Very low	57 Å²	57	86.6 Å²	86.6	47%	0.471	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-15.9	165.6	0	0	0	0	0	113.2	S241	S241-A243 VanDerWaalsContact C-N 3.29Å; S241-A243 PolarHBondContact O-N 2.7Å
244	G	25.9	Very low	28.4	Very low	44 Å²	44	88.5 Å²	88.5	45%	0.454	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-21.7	-175.1	0	0	0	0	0	115.1	S241 L246 V247	S241-G244 PolarHBondContact O-N 3.09Å; G244-L246 PolarHBondContact O-N 3.24Å; G244-L246 VanDerWaalsContact O-N 3.08Å; G244-V247 PolarHBondContact O-N 2.9Å
245	S	24.8	Very low	27.8	Very low	96 Å²	96	92.2 Å²	92.2	67%	0.671	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-3.6	179.2	52.1	0	0	0	0	114.3
246	L	24.3	Very low	27.3	Very low	159 Å²	159	98.6 Å²	98.6	83%	0.832	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	6.1	174.3	-74.3	173.9	0	0	0	115	G244 T248	G244-L246 PolarHBondContact O-N 3.24Å; G244-L246 VanDerWaalsContact O-N 3.08Å; L246-T248 PolarHBondContact O-N 2.81Å
247	V	25.7	Very low	26.4	Very low	106 Å²	106	99 Å²	99	64%	0.642	58%	0.575	S	S	*	*	S	Bend	trans	-89.3	101	168.6	-175.1	0	0	0	0	107.8	G244 I249	G244-V247 PolarHBondContact O-N 2.9Å; V247-I249 PolarHBondContact O-N 3.1Å
248	T	23.4	Very low	25.7	Very low	116 Å²	116	101.9 Å²	101.9	71%	0.712	59%	0.586	S	S	*	*			trans	-16.1	123.2	158.6	-48.8	0	0	0	0	111	L246 V250	L246-T248 PolarHBondContact O-N 2.81Å; T248-V250 PolarHBondContact O-N 3.16Å
249	I	23.3	Very low	25.4	Very low	146 Å²	146	107.1 Å²	107.1	75%	0.749	62%	0.617	S	S	*	*			trans	-45.4	98.3	164.5	-65	165.6	0	0	0	106.3	V247 T251	V247-I249 PolarHBondContact O-N 3.1Å; I249-T251 PolarHBondContact O-N 3.11Å
250	V	23.7	Very low	25.2	Very low	101 Å²	101	108.9 Å²	108.9	61%	0.612	63%	0.631	S	S	*	*			trans	-71.4	89	162.3	177.4	0	0	0	0	101.9	T248 F252	T248-V250 PolarHBondContact O-N 3.16Å; V250-F252 VanDerWaalsContact C-N 3.33Å; V250-F252 WeakPolarHBondContact O-CD2 3.09Å; V250-F252 PolarHBondContact O-N 2.78Å
251	T	23	Very low	24.8	Very low	108 Å²	108	115.3 Å²	115.3	66%	0.663	66%	0.663	S	S	*	*			trans	-49.9	104.5	170.6	-57.8	0	0	0	0	105.7	I249 G253	I249-T251 PolarHBondContact O-N 3.11Å; T251-G253 PolarHBondContact O-N 3.15Å
252	F	27.3	Very low	24.4	Very low	172 Å²	172	114.8 Å²	114.8	75%	0.754	67%	0.67	S	S	*	*			trans	-68.7	67.2	167.8	-81.9	-86.7	0	0	0	107.7	V250	V250-F252 VanDerWaalsContact C-N 3.33Å; V250-F252 WeakPolarHBondContact O-CD2 3.09Å; V250-F252 PolarHBondContact O-N 2.78Å
253	G	21.7	Very low	24.2	Very low	38 Å²	38	114.9 Å²	114.9	39%	0.392	68%	0.68	S	S	.	*			trans	-108.6	18.9	174.5	0	0	0	0	0	111.9	T251 Y255 F256	T251-G253 PolarHBondContact O-N 3.15Å; G253-Y255 VanDerWaalsContact C-N 3.35Å; G253-Y255 PolarHBondContact O-N 3.44Å; G253-F256 PolarHBondContact O-N 2.91Å
254	G	22.4	Very low	24.1	Very low	73 Å²	73	118.5 Å²	118.5	75%	0.753	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-11.9	-171	0	0	0	0	0	116.3
255	Y	25.4	Very low	23.8	Very low	187 Å²	187	126.1 Å²	126.1	73%	0.733	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-0.2	175.1	-95	-83.1	0	0	0	115	G253 A753	G253-Y255 VanDerWaalsContact C-N 3.35Å; G253-Y255 PolarHBondContact O-N 3.44Å; Y255-A753 HydrophobicContact CE2-CB 4.34Å
256	F	25	Very low	23.9	Very low	150 Å²	150	127 Å²	127	66%	0.658	72%	0.723	S	S	*	*	S	Bend	trans	-127.2	11.2	-178.2	-73.5	-72.2	0	0	0	116	G253	G253-F256 PolarHBondContact O-N 2.91Å
257	S	21.3	Very low	23.7	Very low	91 Å²	91	126.7 Å²	126.7	64%	0.636	72%	0.723	S	S	*	*			trans	-125.9	67.7	168.5	-140.3	0	0	0	0	111.3	T259	S257-T259 VanDerWaalsContact C-N 3.28Å; S257-T259 PolarHBondContact O-N 2.75Å
258	R	22.2	Very low	23.7	Very low	239 Å²	239	129.4 Å²	129.4	90%	0.902	73%	0.732	S	S	*	*			trans	-76.3	91.8	148.8	-108.5	179.3	75.8	-173.6	3.1	105.9	A260	R258-A260 VanDerWaalsContact C-N 3.33Å; R258-A260 PolarHBondContact O-N 2.95Å; R258-A260 VanDerWaalsContact O-N 3.09Å
259	T	25.2	Very low	23.6	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	74%	0.737	S	S	*	*			trans	-66.5	103	153.8	42.1	0	0	0	0	106.6	S257 N261	S257-T259 VanDerWaalsContact C-N 3.28Å; S257-T259 PolarHBondContact O-N 2.75Å; T259-N261 PolarHBondContact O-N 3.32Å
260	A	25.9	Very low	23.7	Very low	75 Å²	75	132.5 Å²	132.5	62%	0.62	74%	0.74	S	S	*	*			trans	-57.8	113.2	155.8	0	0	0	0	0	107	R258	R258-A260 VanDerWaalsContact C-N 3.33Å; R258-A260 PolarHBondContact O-N 2.95Å; R258-A260 VanDerWaalsContact O-N 3.09Å
261	N	25.9	Very low	23.5	Very low	155 Å²	155	133.6 Å²	133.6	83%	0.829	75%	0.752	S	S	*	*			trans	-169.2	95.7	142.1	-92.5	-12.8	0	0	0	108.9	T259	T259-N261 PolarHBondContact O-N 3.32Å
262	G	21.5	Very low	23.7	Very low	64 Å²	64	133.4 Å²	133.4	66%	0.66	75%	0.753	S	S	*	*			trans	-78.6	152.2	150.3	0	0	0	0	0	109.8
263	S	23.2	Very low	23.4	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	76%	0.757	S	S	*	*			trans	71.2	130.4	174.8	80.5	0	0	0	0	114.2
264	T	24.6	Very low	23.5	Very low	133 Å²	133	138.7 Å²	138.7	82%	0.816	78%	0.779	S	S	*	*			cis	-154.8	152.8	36.1	39.5	0	0	0	0	111.9
265	K	20.9	Very low	23.6	Very low	204 Å²	204	138.9 Å²	138.9	89%	0.887	77%	0.773	S	S	*	*			trans	-52.8	138.4	166.6	-64.3	171	173.2	178.4	0	112.7
266	S	25.7	Very low	23.5	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	78%	0.776	S	S	*	*				178.3	132.9	128.1	53.3	0	0	0	0	111.1
267	D	20.5	Very low	23.3	Very low	152 Å²	152	135.2 Å²	135.2	81%	0.813	78%	0.782	S	S	*	*			trans	-48.7	143.6	170.3	-58.3	-65.6	0	0	0	113.7
268	I	25.6	Very low	23.3	Very low	164 Å²	164	137 Å²	137	84%	0.841	78%	0.78	S	S	*	*				168.7	131.8	121.5	-82.5	155.9	0	0	0	109.6	N270	I268-N270 PolarHBondContact O-N 2.96Å
269	Q	21.7	Very low	23.4	Very low	174 Å²	174	131.2 Å²	131.2	81%	0.813	77%	0.773	S	S	*	*			trans	-47.8	122.1	168.8	-66.1	165.2	-37.5	0	0	112.4
270	N	24.9	Very low	23.3	Very low	153 Å²	153	131.1 Å²	131.1	82%	0.818	77%	0.772	S	S	*	*			trans	175.4	118.7	130.9	-89.5	-24.3	0	0	0	109.3	I268 P272	I268-N270 PolarHBondContact O-N 2.96Å; N270-P272 WeakPolarHBondContact O-CD 3.05Å
271	S	20.1	Very low	23.2	Very low	123 Å²	123	135.4 Å²	135.4	86%	0.86	78%	0.777	S	S	*	*			trans	-49.3	137.5	158.3	-72.7	0	0	0	0	109.5
272	P	25.8	Very low	23.1	Very low	105 Å²	105	135.1 Å²	135.1	68%	0.682	78%	0.775	S	S	*	*				-134.7	132.7	107.1	33.2	-20.9	0	0	0	111.9	N270 V274	N270-P272 WeakPolarHBondContact O-CD 3.05Å; P272-V274 PolarHBondContact O-N 3.43Å
273	H	22.9	Very low	23.4	Very low	181 Å²	181	138.2 Å²	138.2	84%	0.838	78%	0.781	S	S	*	*			trans	25.6	84.6	145.7	-61.8	-78.4	0	0	0	116.1	A275	H273-A275 PolarHBondContact O-N 3.48Å
274	V	23.6	Very low	23.4	Very low	140 Å²	140	137.6 Å²	137.6	85%	0.848	78%	0.777	S	S	*	*			trans	-65.8	98.6	152	177.1	0	0	0	0	105.5	P272 V276	P272-V274 PolarHBondContact O-N 3.43Å; V274-V276 PolarHBondContact O-N 3.24Å
275	A	22.6	Very low	23.6	Very low	77 Å²	77	137.3 Å²	137.3	64%	0.636	78%	0.777	S	S	*	*			trans	-50.9	111	169.2	0	0	0	0	0	107.5	H273 V277	H273-A275 PolarHBondContact O-N 3.48Å; A275-V277 VanDerWaalsContact C-N 3.34Å; A275-V277 PolarHBondContact O-N 3.29Å
276	V	23.7	Very low	23.7	Very low	132 Å²	132	134.5 Å²	134.5	80%	0.8	77%	0.772	S	S	*	*			trans	-57.1	107.3	161.6	176.2	0	0	0	0	104.8	V274 E278	V274-V276 PolarHBondContact O-N 3.24Å; V276-E278 PolarHBondContact O-N 3.14Å
277	V	21.7	Very low	23.7	Very low	128 Å²	128	135.4 Å²	135.4	78%	0.776	77%	0.767	S	S	*	*			trans	-64.3	94.7	173.2	176.7	0	0	0	0	106	A275	A275-V277 VanDerWaalsContact C-N 3.34Å; A275-V277 PolarHBondContact O-N 3.29Å
278	E	20.5	Very low	23.9	Very low	129 Å²	129	136.6 Å²	136.6	60%	0.603	77%	0.772	S	S	*	*			trans	-53.4	135.5	163.3	-75.9	-169.9	167.7	0	0	107.8	V276 V280 K281	V276-E278 PolarHBondContact O-N 3.14Å; E278-V280 PolarHBondContact O-N 3.13Å; E278-K281 IonicContact OE2-NZ 3.12Å; E278-K281 PolarHBondContact OE2-NZ 3.1Å
279	P	24.9	Very low	23.8	Very low	117 Å²	117	134.9 Å²	134.9	76%	0.76	77%	0.77	S	S	*	*			trans	-58.7	131.6	178.4	24.9	-33	0	0	0	109.7	K281	P279-K281 PolarHBondContact O-N 3.29Å; P279-K281 VanDerWaalsContact O-N 3.12Å
280	V	23.9	Very low	23.9	Very low	120 Å²	120	131.8 Å²	131.8	73%	0.727	77%	0.768	S	S	*	*			trans	-42.6	113.6	-178.4	176.3	0	0	0	0	111.5	E278 N282	E278-V280 PolarHBondContact O-N 3.13Å; V280-N282 HydrophobicContact CG1-CB 4.24Å; V280-N282 PolarHBondContact O-N 3.26Å
281	K	24.3	Very low	23.8	Very low	165 Å²	165	133.9 Å²	133.9	72%	0.717	77%	0.773	S	S	*	*	S	Bend	trans	-67.6	19.5	-179.6	-83.5	173.6	173.5	142.4	0	115.9	E278 P279	E278-K281 IonicContact OE2-NZ 3.12Å; E278-K281 PolarHBondContact OE2-NZ 3.1Å; P279-K281 PolarHBondContact O-N 3.29Å; P279-K281 VanDerWaalsContact O-N 3.12Å
282	N	23.5	Very low	24	Very low	148 Å²	148	132 Å²	132	79%	0.791	76%	0.759	S	S	*	*			trans	-115	32.2	-177.6	-77.2	-4.3	0	0	0	114.3	V280	V280-N282 HydrophobicContact CG1-CB 4.24Å; V280-N282 PolarHBondContact O-N 3.26Å
283	V	27.5	Very low	23.9	Very low	129 Å²	129	133.3 Å²	133.3	78%	0.782	77%	0.766	S	S	*	*	S	Bend	trans	-103.3	115.1	155	-175.6	0	0	0	0	106.5
284	S	22.5	Very low	24.2	Very low	101 Å²	101	130.1 Å²	130.1	71%	0.706	75%	0.753	S	S	*	*			trans	-41.3	124.5	-178.8	-51.1	0	0	0	0	112	D286	S284-D286 VanDerWaalsContact C-N 3.28Å; S284-D286 PolarHBondContact O-N 3.05Å
285	P	29.3	Very low	24.5	Very low	126 Å²	126	130.8 Å²	130.8	82%	0.818	75%	0.745	S	S	*	*			trans	-86.1	70.7	-176.1	36.2	-32.9	0	0	0	109.6
286	D	23	Very low	25.3	Very low	146 Å²	146	131.4 Å²	131.4	78%	0.781	74%	0.744	S	S	*	*			trans	-131.7	65.4	172	-85.3	-29.4	0	0	0	108.9	S284	S284-D286 VanDerWaalsContact C-N 3.28Å; S284-D286 PolarHBondContact O-N 3.05Å
287	L	26.3	Very low	26.4	Very low	134 Å²	134	131 Å²	131	70%	0.702	74%	0.738	S	S	*	*			trans	-166.2	32.8	168.4	-104.9	145.2	0	0	0	114
288	L	22.8	Very low	28.4	Very low	176 Å²	176	129.9 Å²	129.9	92%	0.921	72%	0.724	S	S	*	*			trans	-116.6	59.2	164.2	-76.3	171.1	0	0	0	109.9
289	T	23.6	Very low	31.3	Very low	129 Å²	129	126.8 Å²	126.8	79%	0.791	71%	0.71	S	S	*	*			trans	-136.9	138.3	161.9	54.8	0	0	0	0	109.8
290	S	24.1	Very low	34.1	Very low	109 Å²	109	121.8 Å²	121.8	76%	0.762	68%	0.677	S	S	*	*			trans	72.6	77.1	-170.7	75	0	0	0	0	115.8	S292	S290-S292 PolarHBondContact O-N 2.8Å
291	E	23.7	Very low	37.3	Very low	197 Å²	197	118.4 Å²	118.4	92%	0.921	65%	0.653	S	S	*	*				-48.5	92.2	129.9	-72.9	179	161.7	0	0	107	T293	E291-T293 PolarHBondContact O-N 2.94Å
292	S	24.4	Very low	40.3	Very low	82 Å²	82	113.7 Å²	113.7	57%	0.573	64%	0.636	S	S	*	*			trans	-57.5	110	162.2	53.8	0	0	0	0	105.1	S290 I294	S290-S292 PolarHBondContact O-N 2.8Å; S292-I294 VanDerWaalsContact C-N 3.28Å; S292-I294 PolarHBondContact O-N 3.38Å
293	T	23.8	Very low	43.7	Very low	134 Å²	134	106.8 Å²	106.8	82%	0.822	60%	0.599	S	S	*	*			trans	-41.8	101.6	160	-4.1	0	0	0	0	106	E291 K295	E291-T293 PolarHBondContact O-N 2.94Å; T293-K295 PolarHBondContact O-N 2.7Å
294	I	29.1	Very low	46.9	Very low	113 Å²	113	100.6 Å²	100.6	58%	0.579	56%	0.561	S	S	*	*			trans	-56.2	112	178.8	-64.4	170.4	0	0	0	103.9	S292 S296	S292-I294 VanDerWaalsContact C-N 3.28Å; S292-I294 PolarHBondContact O-N 3.38Å; I294-S296 PolarHBondContact O-N 3.39Å; I294-S296 VanDerWaalsContact O-N 3.09Å
295	K	30	Very low	50.3	Low	155 Å²	155	96.5 Å²	96.5	67%	0.674	53%	0.532	S	S	*	.			trans	-53.4	124.8	178.8	-72.5	178.6	177.9	177.4	0	106.2	T293 N297 E298	T293-K295 PolarHBondContact O-N 2.7Å; K295-N297 PolarHBondContact O-N 2.94Å; K295-E298 PolarHBondContact O-N 3.07Å; K295-E298 VanDerWaalsContact O-N 3.09Å
296	S	39.4	Very low	53.5	Low	89 Å²	89	90.5 Å²	90.5	62%	0.622	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-16.5	-179.7	50.3	0	0	0	0	114.2	I294	I294-S296 PolarHBondContact O-N 3.39Å; I294-S296 VanDerWaalsContact O-N 3.09Å
297	N	46.1	Very low	57.1	Low	123 Å²	123	83.6 Å²	83.6	66%	0.658	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.4	-178.6	-67.6	7.2	0	0	0	115	K295	K295-N297 PolarHBondContact O-N 2.94Å
298	E	64.4	Low	60.5	Low	105 Å²	105	77.2 Å²	77.2	49%	0.491	42%	0.422	S	S	.	.	S	Bend	trans	-97.8	27.2	-177.9	-64.8	-179.2	-178.3	0	0	113.1	K295 S411	K295-E298 PolarHBondContact O-N 3.07Å; K295-E298 VanDerWaalsContact O-N 3.09Å; E298-S411 CarbonylContact C-O 3.54Å; E298-S411 VanDerWaalsContact O-O 3.11Å
299	Q	79.9	Confident	64	Low	65 Å²	65	68.8 Å²	68.8	30%	0.304	38%	0.378	S	S	.	.	S	Bend	trans	-135	150.1	-176.7	-68.7	-173.6	-0.7	0	0	111	N219 H301	N219-Q299 PolarHBondContact ND2-O 3.22Å; Q299-H301 PolarHBondContact O-N 2.84Å
300	C	85	Confident	67.6	Low	11 Å²	11	62.7 Å²	62.7	7%	0.074	34%	0.34	C	S	.	.			trans	-61.2	127.9	166.4	-64.7	0	0	0	0	108.7	N219 N305 Q415	N219-C300 WeakPolarHBondContact OD1-CA 3.31Å; C300-N305 HydrophobicContact CB-CB 3.95Å; C300-Q415 PolarHBondContact SG-OE1 3.44Å
301	H	90.2	Very high	71.1	Confident	49 Å²	49	57.5 Å²	57.5	23%	0.227	30%	0.304	C	S	.	.			trans	-69.8	165.6	168.1	-67.9	-65.3	0	0	0	110.8	N219 R220 Q299 L303 S304 N305	N219-H301 PolarHBondContact O-CD2 2.8Å; N219-H301 VanDerWaalsContact O-CD2 3.23Å; N219-H301 PolarHBondContact OD1-N 3.13Å; R220-H301 WeakPolarHBondContact O-CB 3.24Å; Q299-H301 PolarHBondContact O-N 2.84Å; H301-L303 PolarHBondContact O-N 2.97Å; H301-S304 WeakPolarHBondContact O-CB 3.46Å; H301-S304 PolarHBondContact O-N 3.49Å; H301-S304 VanDerWaalsContact O-N 3.11Å; H301-N305 WeakPolarHBondContact O-CB 3.38Å; H301-N305 PolarHBondContact O-N 3.22Å
302	L	88.7	Confident	74.6	Confident	66 Å²	66	48.2 Å²	48.2	35%	0.346	26%	0.261	S	S	.	.	H	α-helix	trans	-51.2	-53.4	-167.1	179.5	61.2	0	0	0	113	Y163 C167 V222 S304 N305 V306	Y163-L302 HydrophobicContact CE1-CB 4.38Å; C167-L302 HydrophobicContact CB-CD2 4.19Å; C167-L302 HydrophobicContact CB-CG 4.47Å; V222-L302 HydrophobicContact CG2-CB 4.36Å; L302-S304 PolarHBondContact O-N 2.84Å; L302-N305 PolarHBondContact O-N 2.78Å; L302-V306 HydrophobicContact CD1-CG1 4.2Å; L302-V306 WeakPolarHBondContact O-CG2 3.07Å; L302-V306 PolarHBondContact O-N 3.31Å
303	L	93.3	Very high	78.1	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-41.5	-178.1	-176.4	58.9	0	0	0	112.3	I158 Y163 H166 N215 H301 V306 S307	I158-L303 HydrophobicContact CD1-CD2 3.94Å; I158-L303 HydrophobicContact CG1-CD2 4.34Å; I158-L303 HydrophobicContact CG2-CD2 3.91Å; Y163-L303 HydrophobicContact CD2-CD2 4.31Å; Y163-L303 HydrophobicContact CE1-CB 4.29Å; Y163-L303 HydrophobicContact CE2-CB 3.86Å; Y163-L303 HydrophobicContact CE2-CD2 4.12Å; Y163-L303 PolarHBondContact OH-N 3.01Å; H166-L303 HydrophobicContact CB-CD1 3.93Å; N215-L303 HydrophobicContact CB-CG 4.41Å; H301-L303 PolarHBondContact O-N 2.97Å; L303-V306 HydrophobicContact CD1-CG2 4.36Å; L303-V306 WeakPolarHBondContact O-CG2 3.31Å; L303-S307 WeakPolarHBondContact O-CB 3.43Å; L303-S307 PolarHBondContact O-N 3.41Å; L303-S307 PolarHBondContact O-OG 3.35Å
304	S	95.5	Very high	81.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-45.4	175.7	168.3	0	0	0	0	111.4	N215 F216 N219 H301 L302 S307 S308	N215-S304 WeakPolarHBondContact O-CB 3.44Å; F216-S304 WeakPolarHBondContact CA-OG 3.25Å; N219-S304 VanDerWaalsContact OD1-CB 3.27Å; N219-S304 WeakPolarHBondContact OD1-CB 3.49Å; N219-S304 PolarHBondContact OD1-OG 3.04Å; H301-S304 WeakPolarHBondContact O-CB 3.46Å; H301-S304 PolarHBondContact O-N 3.49Å; H301-S304 VanDerWaalsContact O-N 3.11Å; L302-S304 PolarHBondContact O-N 2.84Å; S304-S307 PolarHBondContact O-N 3.29Å; S304-S308 WeakPolarHBondContact O-CB 3.39Å; S304-S308 PolarHBondContact O-N 3.35Å; S304-S308 PolarHBondContact O-OG 2.94Å
305	N	94.6	Very high	84.6	Confident	15 Å²	15	32.7 Å²	32.7	8%	0.08	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-53	179	177.4	58.1	0	0	0	111.7	C300 H301 L302 S307 S308 L309 Q738	C300-N305 HydrophobicContact CB-CB 3.95Å; H301-N305 WeakPolarHBondContact O-CB 3.38Å; H301-N305 PolarHBondContact O-N 3.22Å; L302-N305 PolarHBondContact O-N 2.78Å; N305-S307 VanDerWaalsContact C-N 3.26Å; N305-S307 PolarHBondContact O-N 2.9Å; N305-S308 WeakPolarHBondContact O-CB 3.34Å; N305-S308 PolarHBondContact O-N 3.08Å; N305-S308 VanDerWaalsContact O-N 3.17Å; N305-L309 VanDerWaalsContact O-CG 3.31Å; N305-L309 WeakPolarHBondContact O-CG 3.39Å; N305-L309 PolarHBondContact O-N 3.22Å; N305-Q738 PolarHBondContact ND2-O 3.05Å
306	V	95.3	Very high	87.3	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.6	-29.5	179.9	-59.4	0	0	0	0	112.5	H170 L171 L302 L303 L310	H170-V306 HydrophobicContact CB-CB 4.02Å; H170-V306 HydrophobicContact CB-CG2 3.66Å; L171-V306 HydrophobicContact CD2-CG1 3.84Å; L171-V306 HydrophobicContact CG-CG1 4.29Å; L302-V306 HydrophobicContact CD1-CG1 4.2Å; L302-V306 WeakPolarHBondContact O-CG2 3.07Å; L302-V306 PolarHBondContact O-N 3.31Å; L303-V306 HydrophobicContact CD1-CG2 4.36Å; L303-V306 WeakPolarHBondContact O-CG2 3.31Å; V306-L310 WeakPolarHBondContact O-CB 3.27Å; V306-L310 PolarHBondContact O-N 3.07Å
307	S	98.3	Very high	89.4	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.2	-44.5	172.6	-59.9	0	0	0	0	111.5	H170 L212 N215 L303 S304 N305 L310 L311	H170-S307 PolarHBondContact NE2-OG 3.41Å; L212-S307 WeakPolarHBondContact O-CB 3.35Å; N215-S307 VanDerWaalsContact CB-OG 3.25Å; N215-S307 WeakPolarHBondContact CB-OG 3.42Å; N215-S307 PolarHBondContact ND2-OG 2.71Å; L303-S307 WeakPolarHBondContact O-CB 3.43Å; L303-S307 PolarHBondContact O-N 3.41Å; L303-S307 PolarHBondContact O-OG 3.35Å; S304-S307 PolarHBondContact O-N 3.29Å; N305-S307 VanDerWaalsContact C-N 3.26Å; N305-S307 PolarHBondContact O-N 2.9Å; S307-L310 PolarHBondContact O-N 2.96Å; S307-L311 VanDerWaalsContact O-CB 3.31Å; S307-L311 WeakPolarHBondContact O-CB 3.44Å; S307-L311 PolarHBondContact O-N 2.97Å
308	S	97.8	Very high	90.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.3	-45.1	176.9	-57.2	0	0	0	0	111.3	F216 S304 N305 L311 L312	F216-S308 VanDerWaalsContact CD2-OG 3.27Å; F216-S308 WeakPolarHBondContact CD2-OG 3.31Å; S304-S308 WeakPolarHBondContact O-CB 3.39Å; S304-S308 PolarHBondContact O-N 3.35Å; S304-S308 PolarHBondContact O-OG 2.94Å; N305-S308 WeakPolarHBondContact O-CB 3.34Å; N305-S308 PolarHBondContact O-N 3.08Å; N305-S308 VanDerWaalsContact O-N 3.17Å; S308-L311 PolarHBondContact O-N 2.95Å; S308-L312 WeakPolarHBondContact O-CB 3.45Å; S308-L312 VanDerWaalsContact O-CG 3.23Å; S308-L312 WeakPolarHBondContact O-CG 3.47Å; S308-L312 PolarHBondContact O-N 3.17Å
309	L	97.7	Very high	90.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62	-46.1	177.2	-66.3	178.7	0	0	0	112.2	I174 N305 L312 I313 V734 V735 Q738	I174-L309 HydrophobicContact CD1-CB 4.13Å; N305-L309 VanDerWaalsContact O-CG 3.31Å; N305-L309 WeakPolarHBondContact O-CG 3.39Å; N305-L309 PolarHBondContact O-N 3.22Å; L309-L312 PolarHBondContact O-N 2.99Å; L309-I313 WeakPolarHBondContact O-CD1 3.3Å; L309-I313 VanDerWaalsContact O-CG1 3.28Å; L309-I313 WeakPolarHBondContact O-CG1 3.32Å; L309-I313 PolarHBondContact O-N 2.85Å; L309-V734 HydrophobicContact CD2-CG1 3.86Å; L309-V735 HydrophobicContact CB-CG2 4.3Å; L309-V735 HydrophobicContact CD2-CG2 4.03Å; L309-Q738 HydrophobicContact CD1-CB 4.08Å; L309-Q738 HydrophobicContact CD2-CB 4.27Å
310	L	98.3	Very high	88.6	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.4	-41.7	177.9	-178.6	58.2	0	0	0	111.4	C173 I174 L177 L212 V306 S307 I313 L314	C173-L310 HydrophobicContact CB-CD1 3.93Å; C173-L310 HydrophobicContact CB-CD2 4.06Å; I174-L310 HydrophobicContact CD1-CB 4.49Å; I174-L310 HydrophobicContact CG1-CB 4.3Å; I174-L310 HydrophobicContact CG1-CD1 4.26Å; L177-L310 HydrophobicContact CD1-CD1 3.93Å; L212-L310 HydrophobicContact CD1-CD2 4.36Å; L212-L310 HydrophobicContact CD1-CG 4.22Å; L212-L310 HydrophobicContact CD2-CD2 4.13Å; V306-L310 WeakPolarHBondContact O-CB 3.27Å; V306-L310 PolarHBondContact O-N 3.07Å; S307-L310 PolarHBondContact O-N 2.96Å; L310-I313 PolarHBondContact O-N 3.41Å; L310-L314 HydrophobicContact CD1-CD1 4.07Å; L310-L314 HydrophobicContact CD1-CG 4.13Å; L310-L314 HydrophobicContact CG-CD1 3.96Å; L310-L314 HydrophobicContact CG-CG 4.45Å; L310-L314 WeakPolarHBondContact O-CB 3.44Å; L310-L314 VanDerWaalsContact O-CG 3.27Å; L310-L314 WeakPolarHBondContact O-CG 3.26Å; L310-L314 PolarHBondContact O-N 3.12Å
311	L	98.3	Very high	86.8	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176.5	-179.7	58.2	0	0	0	111.7	V209 L212 L213 S307 S308 L314 T315 L348 L421	V209-L311 HydrophobicContact CB-CD1 4.42Å; V209-L311 HydrophobicContact CG1-CD1 4.15Å; V209-L311 HydrophobicContact CG2-CD1 4.02Å; L212-L311 HydrophobicContact CB-CB 4.21Å; L212-L311 HydrophobicContact CD1-CB 4.02Å; L212-L311 HydrophobicContact CD1-CD1 4.39Å; L213-L311 HydrophobicContact CB-CD2 4.31Å; L213-L311 HydrophobicContact CD1-CD2 4.31Å; S307-L311 VanDerWaalsContact O-CB 3.31Å; S307-L311 WeakPolarHBondContact O-CB 3.44Å; S307-L311 PolarHBondContact O-N 2.97Å; S308-L311 PolarHBondContact O-N 2.95Å; L311-L314 PolarHBondContact O-N 3.04Å; L311-T315 HydrophobicContact CD1-CG2 4Å; L311-T315 WeakPolarHBondContact O-CB 3.44Å; L311-T315 WeakPolarHBondContact O-CG2 3.18Å; L311-T315 PolarHBondContact O-N 2.86Å; L311-T315 VanDerWaalsContact O-N 3.09Å; L311-T315 PolarHBondContact O-OG1 2.6Å; L311-L348 HydrophobicContact CD2-CD1 4.22Å; L311-L421 HydrophobicContact CD2-CD1 3.75Å; L311-L421 HydrophobicContact CD2-CD2 4.45Å; L311-L421 HydrophobicContact CG-CD1 4.4Å
312	L	97.3	Very high	84.7	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-60.7	-49	174.9	-72.3	169.2	0	0	0	110.9	S308 L309 L314 T315 T316 L420 L424 V731	S308-L312 WeakPolarHBondContact O-CB 3.45Å; S308-L312 VanDerWaalsContact O-CG 3.23Å; S308-L312 WeakPolarHBondContact O-CG 3.47Å; S308-L312 PolarHBondContact O-N 3.17Å; L309-L312 PolarHBondContact O-N 2.99Å; L312-L314 VanDerWaalsContact C-N 3.34Å; L312-L314 PolarHBondContact O-N 2.97Å; L312-T315 PolarHBondContact O-N 2.85Å; L312-T315 VanDerWaalsContact O-N 3.15Å; L312-T315 PolarHBondContact O-OG1 3.03Å; L312-T316 WeakPolarHBondContact O-CG2 3.44Å; L312-T316 PolarHBondContact O-N 3.07Å; L312-L420 HydrophobicContact CD1-CD2 4.07Å; L312-L420 HydrophobicContact CD2-CB 4.38Å; L312-L420 HydrophobicContact CD2-CD2 3.86Å; L312-L420 HydrophobicContact CD2-CG 3.78Å; L312-L424 HydrophobicContact CD2-CD1 3.78Å; L312-V731 HydrophobicContact CB-CG1 3.96Å; L312-V731 HydrophobicContact CB-CG2 4.41Å
313	I	96.6	Very high	82.6	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-53.2	-54.2	175.8	-70.3	160	0	0	0	109.5	I174 L177 Y193 L309 L310 T315 T316 V731 W732 V735	I174-I313 HydrophobicContact CB-CD1 4.38Å; I174-I313 HydrophobicContact CG1-CD1 3.91Å; I174-I313 HydrophobicContact CG2-CD1 4.02Å; L177-I313 HydrophobicContact CB-CG2 4.09Å; L177-I313 HydrophobicContact CD1-CG2 3.8Å; Y193-I313 HydrophobicContact CE2-CG2 3.8Å; Y193-I313 PolarHBondContact OH-O 3Å; L309-I313 WeakPolarHBondContact O-CD1 3.3Å; L309-I313 VanDerWaalsContact O-CG1 3.28Å; L309-I313 WeakPolarHBondContact O-CG1 3.32Å; L309-I313 PolarHBondContact O-N 2.85Å; L310-I313 PolarHBondContact O-N 3.41Å; I313-T315 PolarHBondContact O-N 3.2Å; I313-T315 VanDerWaalsContact O-N 3.15Å; I313-T316 PolarHBondContact O-N 3.15Å; I313-T316 PolarHBondContact O-OG1 3.07Å; I313-V731 HydrophobicContact CG1-CG1 4.24Å; I313-W732 HydrophobicContact CD1-CE3 4.49Å; I313-W732 HydrophobicContact CD1-CH2 3.6Å; I313-W732 HydrophobicContact CD1-CZ2 4.3Å; I313-W732 HydrophobicContact CD1-CZ3 3.73Å; I313-W732 HydrophobicContact CG1-CH2 3.86Å; I313-W732 HydrophobicContact CG1-CZ2 4.06Å; I313-W732 HydrophobicContact CG1-CZ3 4.16Å; I313-W732 HydrophobicContact CG2-CH2 3.97Å; I313-W732 HydrophobicContact CG2-CZ2 3.78Å; I313-V735 HydrophobicContact CD1-CG1 4.34Å; I313-V735 HydrophobicContact CD1-CG2 3.74Å; I313-V735 HydrophobicContact CG1-CG2 3.89Å
314	L	96	Very high	80.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-19.5	-175.8	-69.2	171.2	0	0	0	114.3	L177 V196 L208 L212 L310 L311 L312 N342 Y344	L177-L314 HydrophobicContact CD1-CD2 4.02Å; V196-L314 HydrophobicContact CG1-CD2 3.98Å; L208-L314 HydrophobicContact CD2-CD1 3.68Å; L212-L314 HydrophobicContact CD1-CD1 4.24Å; L310-L314 HydrophobicContact CD1-CD1 4.07Å; L310-L314 HydrophobicContact CD1-CG 4.13Å; L310-L314 HydrophobicContact CG-CD1 3.96Å; L310-L314 HydrophobicContact CG-CG 4.45Å; L310-L314 WeakPolarHBondContact O-CB 3.44Å; L310-L314 VanDerWaalsContact O-CG 3.27Å; L310-L314 WeakPolarHBondContact O-CG 3.26Å; L310-L314 PolarHBondContact O-N 3.12Å; L311-L314 PolarHBondContact O-N 3.04Å; L312-L314 VanDerWaalsContact C-N 3.34Å; L312-L314 PolarHBondContact O-N 2.97Å; L314-N342 PolarHBondContact O-ND2 2.63Å; L314-N342 PolarHBondContact O-OD1 2.86Å; L314-Y344 HydrophobicContact CB-CD1 4.4Å; L314-Y344 HydrophobicContact CB-CD2 4.47Å; L314-Y344 HydrophobicContact CB-CG 4.07Å; L314-Y344 HydrophobicContact CD1-CD1 4.1Å; L314-Y344 HydrophobicContact CD1-CE1 4.26Å
315	T	93.7	Very high	77.8	Confident	4 Å²	4	30.6 Å²	30.6	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-107.8	-10	-175.8	55.8	0	0	0	0	114.4	L311 L312 I313 Q317 L348	L311-T315 HydrophobicContact CD1-CG2 4Å; L311-T315 WeakPolarHBondContact O-CB 3.44Å; L311-T315 WeakPolarHBondContact O-CG2 3.18Å; L311-T315 PolarHBondContact O-N 2.86Å; L311-T315 VanDerWaalsContact O-N 3.09Å; L311-T315 PolarHBondContact O-OG1 2.6Å; L312-T315 PolarHBondContact O-N 2.85Å; L312-T315 VanDerWaalsContact O-N 3.15Å; L312-T315 PolarHBondContact O-OG1 3.03Å; I313-T315 PolarHBondContact O-N 3.2Å; I313-T315 VanDerWaalsContact O-N 3.15Å; T315-Q317 VanDerWaalsContact C-N 3.34Å; T315-Q317 PolarHBondContact O-N 3.34Å; T315-L348 HydrophobicContact CG2-CB 4.37Å; T315-L348 HydrophobicContact CG2-CD2 3.95Å
316	T	87.9	Confident	75.4	Confident	14 Å²	14	34.8 Å²	34.8	9%	0.086	20%	0.195	C	C	.	.			trans	-63.3	-30.5	-178.8	47.3	0	0	0	0	115.2	L312 I313 A318 V731	L312-T316 WeakPolarHBondContact O-CG2 3.44Å; L312-T316 PolarHBondContact O-N 3.07Å; I313-T316 PolarHBondContact O-N 3.15Å; I313-T316 PolarHBondContact O-OG1 3.07Å; T316-A318 PolarHBondContact O-N 3.01Å; T316-V731 HydrophobicContact CG2-CB 3.66Å; T316-V731 HydrophobicContact CG2-CG1 3.81Å; T316-V731 HydrophobicContact CG2-CG2 3.42Å; T316-V731 VanDerWaalsContact CG2-CG2 3.42Å
317	Q	82.5	Confident	72.8	Confident	19 Å²	19	39.2 Å²	39.2	9%	0.089	22%	0.223	C	C	.	.			trans	-78.5	108.5	179.8	-58	-55.5	-49	0	0	109.8	L189 Y193 T315 N342	L189-Q317 HydrophobicContact CD1-CG 4.17Å; L189-Q317 HydrophobicContact CD2-CG 4.5Å; Y193-Q317 HydrophobicContact CE1-CG 3.57Å; Y193-Q317 WeakPolarHBondContact OH-CG 3.47Å; T315-Q317 VanDerWaalsContact C-N 3.34Å; T315-Q317 PolarHBondContact O-N 3.34Å; Q317-N342 PolarHBondContact O-ND2 3.27Å
318	A	66.6	Low	70.1	Confident	32 Å²	32	42.9 Å²	42.9	26%	0.264	24%	0.237	S	C	.	.			trans	-78.7	-32.6	174.9	0	0	0	0	0	112.8	T316 R345 D724	T316-A318 PolarHBondContact O-N 3.01Å; A318-R345 VanDerWaalsContact CA-NH1 3.29Å; A318-R345 VanDerWaalsContact CB-CZ 3.49Å; A318-D724 VanDerWaalsContact CB-OD1 3.3Å; A318-D724 WeakPolarHBondContact CB-OD1 3.33Å; A318-D724 WeakPolarHBondContact CB-OD2 3.26Å; A318-D724 PolarHBondContact N-OD2 3.37Å
319	G	59	Low	67.4	Low	38 Å²	38	47.4 Å²	47.4	39%	0.392	27%	0.268	S	S	.	.			trans	-66	151	-167	0	0	0	0	0	116.1
320	S	48.3	Very low	64.7	Low	45 Å²	45	56.1 Å²	56.1	32%	0.315	31%	0.309	S	S	.	.			trans	-77.5	155.8	168.3	-166.9	0	0	0	0	111	E322 L339 G340	S320-E322 PolarHBondContact O-N 2.78Å; S320-L339 PolarHBondContact OG-O 3.28Å; S320-G340 WeakPolarHBondContact CA-O 3.47Å; S320-G340 WeakPolarHBondContact OG-CA 3.37Å
321	I	47	Very low	61.7	Low	33 Å²	33	61.2 Å²	61.2	17%	0.169	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-9.1	176.5	-55.9	168.3	0	0	0	111.9	W198 K323 I324 I325	W198-I321 HydrophobicContact CB-CD1 4.06Å; W198-I321 HydrophobicContact CD2-CD1 4.2Å; W198-I321 HydrophobicContact CD2-CG1 3.92Å; W198-I321 HydrophobicContact CG-CD1 3.68Å; W198-I321 HydrophobicContact CG-CG1 3.96Å; W198-I321 HydrophobicContact CZ2-CG1 4.41Å; I321-K323 VanDerWaalsContact C-N 3.26Å; I321-K323 PolarHBondContact O-N 3.41Å; I321-K323 VanDerWaalsContact O-N 3.1Å; I321-I324 HydrophobicContact CB-CB 4.49Å; I321-I324 HydrophobicContact CG2-CB 3.84Å; I321-I324 HydrophobicContact CG2-CG2 4.2Å; I321-I324 CarbonylContact O-C 3.31Å; I321-I324 VanDerWaalsContact O-CA 3.22Å; I321-I324 WeakPolarHBondContact O-CA 3.2Å; I321-I324 VanDerWaalsContact O-CB 3.3Å; I321-I324 WeakPolarHBondContact O-CB 3.46Å; I321-I324 PolarHBondContact O-N 2.68Å; I321-I325 HydrophobicContact CB-CG1 4.18Å; I321-I325 HydrophobicContact CG2-CD1 4.23Å; I321-I325 HydrophobicContact CG2-CG1 3.44Å; I321-I325 VanDerWaalsContact CG2-CG1 3.44Å; I321-I325 WeakPolarHBondContact O-CG1 3.29Å; I321-I325 PolarHBondContact O-N 2.85Å
322	E	45.3	Very low	58.8	Low	159 Å²	159	68.3 Å²	68.3	74%	0.743	37%	0.374	S	S	*	.	H	α-helix	trans	-53.9	-34.1	-179.7	-71.8	-177.8	175	0	0	114.8	S320 I324	S320-E322 PolarHBondContact O-N 2.78Å; E322-I324 VanDerWaalsContact C-N 3.25Å; E322-I324 PolarHBondContact O-N 3.1Å
323	K	46.3	Very low	56.2	Low	192 Å²	192	74 Å²	74	84%	0.835	40%	0.404	S	S	*	.	H	α-helix	trans	-73.3	-14.1	170.3	-92.9	-174.3	177.7	179.3	0	114.2	I321 S326	I321-K323 VanDerWaalsContact C-N 3.26Å; I321-K323 PolarHBondContact O-N 3.41Å; I321-K323 VanDerWaalsContact O-N 3.1Å; K323-S326 PolarHBondContact O-OG 2.56Å
324	I	46.8	Very low	53.3	Low	20 Å²	20	82.7 Å²	82.7	10%	0.103	44%	0.442	C	S	.	.	H	α-helix	trans	-105.9	-30.1	-172.6	-52.9	173.4	0	0	0	111.4	L189 V194 W198 I321 E322 S326 T327 Y328	L189-I324 HydrophobicContact CD1-CD1 3.85Å; V194-I324 HydrophobicContact CG1-CG2 4.23Å; V194-I324 HydrophobicContact CG2-CD1 4.41Å; V194-I324 HydrophobicContact CG2-CG2 4.16Å; W198-I324 HydrophobicContact CH2-CD1 4Å; W198-I324 HydrophobicContact CZ3-CD1 3.88Å; I321-I324 HydrophobicContact CB-CB 4.49Å; I321-I324 HydrophobicContact CG2-CB 3.84Å; I321-I324 HydrophobicContact CG2-CG2 4.2Å; I321-I324 CarbonylContact O-C 3.31Å; I321-I324 VanDerWaalsContact O-CA 3.22Å; I321-I324 WeakPolarHBondContact O-CA 3.2Å; I321-I324 VanDerWaalsContact O-CB 3.3Å; I321-I324 WeakPolarHBondContact O-CB 3.46Å; I321-I324 PolarHBondContact O-N 2.68Å; E322-I324 VanDerWaalsContact C-N 3.25Å; E322-I324 PolarHBondContact O-N 3.1Å; I324-S326 PolarHBondContact O-N 2.91Å; I324-T327 PolarHBondContact O-N 2.85Å; I324-Y328 PolarHBondContact O-N 3.44Å
325	I	40.8	Very low	50.5	Low	69 Å²	69	88.9 Å²	88.9	35%	0.354	48%	0.475	S	S	.	.	H	α-helix	trans	-60.9	-31.2	-179.6	-65.3	-177.2	0	0	0	111.4	I321 T327 Y328 S329	I321-I325 HydrophobicContact CB-CG1 4.18Å; I321-I325 HydrophobicContact CG2-CD1 4.23Å; I321-I325 HydrophobicContact CG2-CG1 3.44Å; I321-I325 VanDerWaalsContact CG2-CG1 3.44Å; I321-I325 WeakPolarHBondContact O-CG1 3.29Å; I321-I325 PolarHBondContact O-N 2.85Å; I325-T327 PolarHBondContact O-N 3Å; I325-Y328 PolarHBondContact O-N 3.22Å; I325-Y328 VanDerWaalsContact O-N 3.12Å; I325-S329 PolarHBondContact O-N 3.15Å; I325-S329 PolarHBondContact O-OG 3.12Å
326	S	43.4	Very low	47.6	Very low	103 Å²	103	93 Å²	93	72%	0.72	50%	0.503	S	S	*	.	H	α-helix	trans	-55.8	-22.3	173.1	53.8	0	0	0	0	112.9	K323 I324	K323-S326 PolarHBondContact O-OG 2.56Å; I324-S326 PolarHBondContact O-N 2.91Å
327	T	41.2	Very low	45.4	Very low	93 Å²	93	100.6 Å²	100.6	57%	0.571	54%	0.544	S	S	*	.	H	α-helix	trans	-105.8	-20.1	179	-35.3	0	0	0	0	113.2	I324 I325	I324-T327 PolarHBondContact O-N 2.85Å; I325-T327 PolarHBondContact O-N 3Å
328	Y	41.3	Very low	43.6	Very low	78 Å²	78	104.3 Å²	104.3	31%	0.306	57%	0.571	S	S	.	*	H	α-helix	trans	-118.1	21.3	-167.4	-126.6	-96.9	0	0	0	116.4	Q191 I324 I325 E330	Q191-Y328 PolarHBondContact NE2-OH 3.24Å; I324-Y328 PolarHBondContact O-N 3.44Å; I325-Y328 PolarHBondContact O-N 3.22Å; I325-Y328 VanDerWaalsContact O-N 3.12Å; Y328-E330 PolarHBondContact O-N 3Å
329	S	40.8	Very low	42.8	Very low	94 Å²	94	107.6 Å²	107.6	66%	0.657	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	37	-179	-62.2	0	0	0	0	115.8	I325	I325-S329 PolarHBondContact O-N 3.15Å; I325-S329 PolarHBondContact O-OG 3.12Å
330	E	40.8	Very low	43.1	Very low	183 Å²	183	106 Å²	106	86%	0.855	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127	1.6	172.6	-89.6	-166.7	166.4	0	0	116.8	Y328	Y328-E330 PolarHBondContact O-N 3Å
331	N	36.7	Very low	44.7	Very low	108 Å²	108	112.8 Å²	112.8	58%	0.578	59%	0.587	S	S	*	*	S	Bend	trans	-116.1	120.9	174.6	-78.8	-20.4	0	0	0	113.3	I333	N331-I333 VanDerWaalsContact C-N 3.29Å; N331-I333 PolarHBondContact O-N 3.43Å
332	N	37.1	Very low	46.8	Very low	149 Å²	149	111.4 Å²	111.4	80%	0.797	58%	0.579	S	S	*	*			trans	-52.3	65.8	-179.7	-77.1	-54.3	0	0	0	116	K334	N332-K334 PolarHBondContact O-N 3.42Å
333	I	43.1	Very low	49.1	Very low	121 Å²	121	105 Å²	105	62%	0.621	55%	0.551	S	S	*	*			trans	-93.7	91.4	166.3	-55.3	177.9	0	0	0	107.7	N331	N331-I333 VanDerWaalsContact C-N 3.29Å; N331-I333 PolarHBondContact O-N 3.43Å
334	K	35.4	Very low	51.4	Low	183 Å²	183	95.8 Å²	95.8	80%	0.796	51%	0.512	S	S	*	.			trans	-102.5	19.1	-178.5	-89.1	-170.8	178.3	179.1	0	114.7	N332	N332-K334 PolarHBondContact O-N 3.42Å
335	D	36.3	Very low	53.6	Low	130 Å²	130	97.1 Å²	97.1	70%	0.695	52%	0.515	S	S	*	.			trans	-105.6	104.5	-177.6	-71.3	-27.8	0	0	0	113.9
336	S	32.8	Very low	56.1	Low	89 Å²	89	97.9 Å²	97.9	62%	0.622	52%	0.519	S	S	*	.			trans	36.4	115.2	142.6	62.1	0	0	0	0	121.6	S338	S336-S338 VanDerWaalsContact C-N 3.3Å; S336-S338 PolarHBondContact O-N 3.24Å
337	N	41.4	Very low	58.6	Low	175 Å²	175	93.4 Å²	93.4	94%	0.936	49%	0.488	S	S	*	.	S	Bend	trans	54	-13.5	145.4	-68	-4.7	0	0	0	122.2
338	S	45.8	Very low	61.2	Low	96 Å²	96	89 Å²	89	67%	0.671	46%	0.46	S	S	*	.			trans	-101.7	19.5	170.8	68.7	0	0	0	0	113.2	S336 G340	S336-S338 VanDerWaalsContact C-N 3.3Å; S336-S338 PolarHBondContact O-N 3.24Å; S338-G340 PolarHBondContact O-N 3.38Å
339	L	49.7	Very low	63.8	Low	101 Å²	101	86.8 Å²	86.8	53%	0.529	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	102.4	-167.7	-135.8	76.7	0	0	0	111.7	S320	S320-L339 PolarHBondContact OG-O 3.28Å
340	G	65.1	Low	66.4	Low	5 Å²	5	84.3 Å²	84.3	5%	0.052	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.2	-4.6	159	0	0	0	0	0	118.6	W198 S320 S338	W198-G340 PolarHBondContact NE1-O 3.5Å; S320-G340 WeakPolarHBondContact CA-O 3.47Å; S320-G340 WeakPolarHBondContact OG-CA 3.37Å; S338-G340 PolarHBondContact O-N 3.38Å
341	R	82.4	Confident	69	Low	188 Å²	188	75.6 Å²	75.6	71%	0.709	39%	0.394	S	S	*	.			trans	-69	139.1	173.7	-65.9	-177.8	-179.5	-178.5	0.6	111.2	P343 I346	R341-P343 WeakPolarHBondContact O-CD 3.35Å; R341-I346 HydrophobicContact CB-CD1 3.46Å; R341-I346 VanDerWaalsContact CB-CD1 3.46Å; R341-I346 HydrophobicContact CB-CG1 4.26Å
342	N	90.7	Very high	71.8	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.016	38%	0.379	C	S	.	.			trans	-64	115.3	177.9	178.7	-20.7	0	0	0	111.2	V197 L314 Q317 Y344 R345 I346	V197-N342 HydrophobicContact CG1-CB 4.32Å; L314-N342 PolarHBondContact O-ND2 2.63Å; L314-N342 PolarHBondContact O-OD1 2.86Å; Q317-N342 PolarHBondContact O-ND2 3.27Å; N342-Y344 PolarHBondContact O-N 3.07Å; N342-Y344 WeakPolarHBondContact OD1-CB 3.34Å; N342-Y344 PolarHBondContact OD1-N 3.42Å; N342-R345 HydrophobicContact CB-CB 3.89Å; N342-R345 WeakPolarHBondContact O-CB 3.44Å; N342-R345 PolarHBondContact O-N 2.71Å; N342-R345 PolarHBondContact OD1-N 3.49Å; N342-I346 WeakPolarHBondContact O-CG1 3.48Å; N342-I346 PolarHBondContact O-N 3.33Å
343	P	92.5	Very high	74.5	Confident	24 Å²	24	66.5 Å²	66.5	16%	0.156	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-30.1	-174.1	27.7	-35.3	0	0	0	113.4	V197 A202 A205 R341 R345 T347	V197-P343 WeakPolarHBondContact O-CD 3.47Å; V197-P343 VanDerWaalsContact O-CG 3.23Å; V197-P343 WeakPolarHBondContact O-CG 3.32Å; A202-P343 HydrophobicContact CB-CG 3.91Å; A205-P343 HydrophobicContact CB-CB 3.9Å; A205-P343 HydrophobicContact CB-CG 4.3Å; R341-P343 WeakPolarHBondContact O-CD 3.35Å; P343-R345 VanDerWaalsContact C-N 3.35Å; P343-T347 WeakPolarHBondContact O-CB 3.46Å; P343-T347 PolarHBondContact O-N 3.5Å; P343-T347 PolarHBondContact O-OG1 3.23Å
344	Y	95.2	Very high	76.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67	-40.7	175.1	-57.7	-85	0	0	0	110.6	F150 V196 V197 C201 A205 L208 V209 L314 N342 T347 L348	F150-Y344 HydrophobicContact CE2-CE1 4.34Å; F150-Y344 WeakPolarHBondContact CE2-OH 3.36Å; V196-Y344 PolarHBondContact O-OH 3.23Å; V197-Y344 HydrophobicContact CG1-CD2 4.42Å; V197-Y344 HydrophobicContact CG2-CE2 4.5Å; C201-Y344 WeakPolarHBondContact CB-OH 3.32Å; C201-Y344 PolarHBondContact O-OH 3.16Å; A205-Y344 HydrophobicContact CB-CD1 3.62Å; A205-Y344 HydrophobicContact CB-CD2 4.38Å; A205-Y344 HydrophobicContact CB-CE1 3.63Å; A205-Y344 HydrophobicContact CB-CE2 4.36Å; A205-Y344 HydrophobicContact CB-CG 4Å; L208-Y344 HydrophobicContact CB-CE1 4.37Å; L208-Y344 HydrophobicContact CD2-CD1 4.2Å; L208-Y344 HydrophobicContact CD2-CE1 3.6Å; V209-Y344 HydrophobicContact CG2-CD1 4.08Å; L314-Y344 HydrophobicContact CB-CD1 4.4Å; L314-Y344 HydrophobicContact CB-CD2 4.47Å; L314-Y344 HydrophobicContact CB-CG 4.07Å; L314-Y344 HydrophobicContact CD1-CD1 4.1Å; L314-Y344 HydrophobicContact CD1-CE1 4.26Å; N342-Y344 PolarHBondContact O-N 3.07Å; N342-Y344 WeakPolarHBondContact OD1-CB 3.34Å; N342-Y344 PolarHBondContact OD1-N 3.42Å; Y344-T347 PolarHBondContact O-N 3.08Å; Y344-L348 WeakPolarHBondContact O-CB 3.44Å; Y344-L348 PolarHBondContact O-N 3.43Å
345	R	93.2	Very high	78.6	Confident	47 Å²	47	59.4 Å²	59.4	18%	0.177	32%	0.316	C	S	.	.	H	α-helix	trans	-66.4	-46.8	176.4	-169	177.2	-170.3	-135.2	3.4	111.8	A318 N342 P343 T347 L348 F349	A318-R345 VanDerWaalsContact CA-NH1 3.29Å; A318-R345 VanDerWaalsContact CB-CZ 3.49Å; N342-R345 HydrophobicContact CB-CB 3.89Å; N342-R345 WeakPolarHBondContact O-CB 3.44Å; N342-R345 PolarHBondContact O-N 2.71Å; N342-R345 PolarHBondContact OD1-N 3.49Å; P343-R345 VanDerWaalsContact C-N 3.35Å; R345-T347 VanDerWaalsContact C-N 3.27Å; R345-T347 PolarHBondContact O-N 3.27Å; R345-L348 PolarHBondContact O-N 3.36Å; R345-F349 HydrophobicContact CG-CD2 3.79Å; R345-F349 HydrophobicContact CG-CE1 4.33Å; R345-F349 HydrophobicContact CG-CE2 3.23Å; R345-F349 HydrophobicContact CG-CZ 3.53Å; R345-F349 VanDerWaalsContact NE-CE2 3.27Å; R345-F349 WeakPolarHBondContact O-CB 3.24Å; R345-F349 WeakPolarHBondContact O-CD2 3.44Å; R345-F349 WeakPolarHBondContact O-CG 3.48Å; R345-F349 PolarHBondContact O-N 3.04Å
346	I	93	Very high	79.7	Confident	85 Å²	85	56.6 Å²	56.6	44%	0.436	30%	0.304	S	S	.	.	H	α-helix	trans	-56.9	-46	174.8	-69	163.6	0	0	0	110.4	R341 N342 F349 S350	R341-I346 HydrophobicContact CB-CD1 3.46Å; R341-I346 VanDerWaalsContact CB-CD1 3.46Å; R341-I346 HydrophobicContact CB-CG1 4.26Å; N342-I346 WeakPolarHBondContact O-CG1 3.48Å; N342-I346 PolarHBondContact O-N 3.33Å; I346-F349 PolarHBondContact O-N 3.23Å; I346-S350 VanDerWaalsContact O-CB 3.3Å; I346-S350 WeakPolarHBondContact O-CB 3.46Å; I346-S350 PolarHBondContact O-N 3.35Å; I346-S350 PolarHBondContact O-OG 2.88Å
347	T	95.6	Very high	80.7	Confident	10 Å²	10	55.6 Å²	55.6	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-60.3	-53.4	179	-60.5	0	0	0	0	111	P206 V209 P343 Y344 R345 F349 S350 L351 P398	P206-T347 HydrophobicContact CB-CG2 4.47Å; V209-T347 HydrophobicContact CB-CG2 3.64Å; V209-T347 HydrophobicContact CG1-CG2 3.86Å; V209-T347 HydrophobicContact CG2-CG2 3.97Å; P343-T347 WeakPolarHBondContact O-CB 3.46Å; P343-T347 PolarHBondContact O-N 3.5Å; P343-T347 PolarHBondContact O-OG1 3.23Å; Y344-T347 PolarHBondContact O-N 3.08Å; R345-T347 VanDerWaalsContact C-N 3.27Å; R345-T347 PolarHBondContact O-N 3.27Å; T347-F349 PolarHBondContact O-N 3.32Å; T347-S350 PolarHBondContact O-N 3.11Å; T347-S350 PolarHBondContact O-OG 3.45Å; T347-L351 PolarHBondContact O-N 3.12Å; T347-P398 HydrophobicContact CG2-CG 3.66Å
348	L	96.3	Very high	81.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-54.8	-39.7	179.9	-177.1	66.3	0	0	0	112	V209 L213 L311 T315 Y344 R345 S350 L351 L424 L425 N429	V209-L348 HydrophobicContact CG1-CB 4.12Å; V209-L348 HydrophobicContact CG1-CD1 4.11Å; L213-L348 HydrophobicContact CD2-CD1 4.26Å; L311-L348 HydrophobicContact CD2-CD1 4.22Å; T315-L348 HydrophobicContact CG2-CB 4.37Å; T315-L348 HydrophobicContact CG2-CD2 3.95Å; Y344-L348 WeakPolarHBondContact O-CB 3.44Å; Y344-L348 PolarHBondContact O-N 3.43Å; R345-L348 PolarHBondContact O-N 3.36Å; L348-S350 VanDerWaalsContact C-N 3.34Å; L348-L351 HydrophobicContact CD1-CD1 3.92Å; L348-L424 HydrophobicContact CD2-CB 4.44Å; L348-L425 HydrophobicContact CD1-CD2 3.72Å; L348-L425 HydrophobicContact CD1-CG 4.5Å; L348-L425 HydrophobicContact CG-CD2 4.24Å; L348-N429 PolarHBondContact O-ND2 2.92Å
349	F	95.2	Very high	81.5	Confident	32 Å²	32	54.9 Å²	54.9	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-83.8	-9.3	-176.9	-59.1	-12.5	0	0	0	114	R345 I346 T347 L424 R428	R345-F349 HydrophobicContact CG-CD2 3.79Å; R345-F349 HydrophobicContact CG-CE1 4.33Å; R345-F349 HydrophobicContact CG-CE2 3.23Å; R345-F349 HydrophobicContact CG-CZ 3.53Å; R345-F349 VanDerWaalsContact NE-CE2 3.27Å; R345-F349 WeakPolarHBondContact O-CB 3.24Å; R345-F349 WeakPolarHBondContact O-CD2 3.44Å; R345-F349 WeakPolarHBondContact O-CG 3.48Å; R345-F349 PolarHBondContact O-N 3.04Å; I346-F349 PolarHBondContact O-N 3.23Å; T347-F349 PolarHBondContact O-N 3.32Å; F349-L424 HydrophobicContact CE1-CB 4.36Å; F349-L424 HydrophobicContact CZ-CD2 4.5Å; F349-R428 HydrophobicContact CD1-CB 3.53Å; F349-R428 HydrophobicContact CD2-CB 3.77Å; F349-R428 HydrophobicContact CE1-CB 3.48Å; F349-R428 VanDerWaalsContact CE1-CB 3.48Å; F349-R428 HydrophobicContact CE1-CG 4Å; F349-R428 HydrophobicContact CE2-CB 3.66Å; F349-R428 HydrophobicContact CE2-CG 3.92Å; F349-R428 HydrophobicContact CG-CB 3.7Å; F349-R428 HydrophobicContact CZ-CB 3.54Å; F349-R428 HydrophobicContact CZ-CG 3.67Å
350	S	95.3	Very high	81.4	Confident	41 Å²	41	55.6 Å²	55.6	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-106.5	-3.5	177.9	64.9	0	0	0	0	114	I346 T347 L348 S397	I346-S350 VanDerWaalsContact O-CB 3.3Å; I346-S350 WeakPolarHBondContact O-CB 3.46Å; I346-S350 PolarHBondContact O-N 3.35Å; I346-S350 PolarHBondContact O-OG 2.88Å; T347-S350 PolarHBondContact O-N 3.11Å; T347-S350 PolarHBondContact O-OG 3.45Å; L348-S350 VanDerWaalsContact C-N 3.34Å; S350-S397 WeakPolarHBondContact O-CB 3.47Å; S350-S397 PolarHBondContact O-OG 3.37Å
351	L	96.1	Very high	80.5	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.293	C	S	.	.			trans	-50.4	144	179.6	-65.6	167.3	0	0	0	111.8	V209 L213 T347 L348 P398 I400 F402 L425 N429 N431	V209-L351 HydrophobicContact CG1-CD1 4.4Å; L213-L351 HydrophobicContact CD2-CD1 3.37Å; T347-L351 PolarHBondContact O-N 3.12Å; L348-L351 HydrophobicContact CD1-CD1 3.92Å; L351-P398 HydrophobicContact CD2-CB 3.81Å; L351-P398 HydrophobicContact CD2-CG 3.65Å; L351-I400 HydrophobicContact CB-CG2 4.44Å; L351-I400 HydrophobicContact CD1-CG2 4.27Å; L351-I400 HydrophobicContact CD2-CG2 4.35Å; L351-F402 HydrophobicContact CB-CE1 4.24Å; L351-F402 HydrophobicContact CB-CZ 4.37Å; L351-L425 HydrophobicContact CD1-CD2 4.36Å; L351-N429 WeakPolarHBondContact CB-ND2 3.47Å; L351-N429 PolarHBondContact N-ND2 3.43Å; L351-N429 PolarHBondContact O-ND2 2.94Å; L351-N431 WeakPolarHBondContact O-CB 3.25Å; L351-N431 PolarHBondContact O-ND2 3.38Å
352	Q	95.1	Very high	78.5	Confident	56 Å²	56	55.8 Å²	55.8	26%	0.262	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	158.4	174.7	-70.8	180	7.2	0	0	110.5	Q357 S397 P398 Q399 I400	Q352-Q357 VanDerWaalsContact OE1-NE2 3.12Å; Q352-S397 VanDerWaalsContact CG-OG 3.27Å; Q352-S397 WeakPolarHBondContact CG-OG 3.48Å; Q352-S397 PolarHBondContact NE2-OG 2.82Å; Q352-P398 PolarHBondContact N-O 3.49Å; Q352-Q399 HydrophobicContact CB-CG 4.31Å; Q352-Q399 CarbonylContact O-C 3.39Å; Q352-Q399 VanDerWaalsContact O-CA 3.27Å; Q352-Q399 WeakPolarHBondContact O-CA 3.26Å; Q352-I400 PolarHBondContact O-N 2.86Å
353	D	94	Very high	76.2	Confident	10 Å²	10	59.7 Å²	59.7	5%	0.053	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	150.8	170.8	-170.5	41	0	0	0	110.7	V355 F402	D353-V355 VanDerWaalsContact C-N 3.26Å; D353-V355 PolarHBondContact O-N 2.89Å; D353-V355 WeakPolarHBondContact OD2-CB 3.36Å; D353-V355 WeakPolarHBondContact OD2-CG2 3.41Å; D353-V355 PolarHBondContact OD2-N 3.31Å; D353-F402 HydrophobicContact CB-CB 4.46Å; D353-F402 HydrophobicContact CB-CD1 4.44Å; D353-F402 HydrophobicContact CB-CD2 3.5Å; D353-F402 HydrophobicContact CB-CE2 3.76Å; D353-F402 HydrophobicContact CB-CG 3.88Å; D353-F402 HydrophobicContact CB-CZ 4.37Å; D353-F402 WeakPolarHBondContact OD1-CB 3.42Å; D353-F402 PolarHBondContact OD1-N 3.21Å
354	E	88.7	Confident	73.8	Confident	76 Å²	76	64.1 Å²	64.1	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-65	-28.3	177.1	-74.3	173	-165.1	0	0	112.7	Q399 N401	E354-Q399 HydrophobicContact CG-CB 4.17Å; E354-N401 PolarHBondContact OE1-N 3.37Å; E354-N401 VanDerWaalsContact OE1-N 3.17Å
355	V	75.7	Confident	71.1	Confident	80 Å²	80	72 Å²	72	49%	0.485	38%	0.376	S	S	.	.	H	α-helix	trans	-77.6	-30.7	-176.3	-174.8	0	0	0	0	111.9	D353 Q357 K358 N359	D353-V355 VanDerWaalsContact C-N 3.26Å; D353-V355 PolarHBondContact O-N 2.89Å; D353-V355 WeakPolarHBondContact OD2-CB 3.36Å; D353-V355 WeakPolarHBondContact OD2-CG2 3.41Å; D353-V355 PolarHBondContact OD2-N 3.31Å; V355-Q357 VanDerWaalsContact C-N 3.33Å; V355-Q357 PolarHBondContact O-N 2.89Å; V355-K358 PolarHBondContact O-N 3.37Å; V355-N359 PolarHBondContact O-N 3.45Å
356	T	60.7	Low	68.2	Low	71 Å²	71	76.7 Å²	76.7	44%	0.436	40%	0.404	S	S	.	.	H	α-helix	trans	-62.9	-33.3	-171.4	-40.8	0	0	0	0	113.5
357	Q	52.5	Low	65.4	Low	67 Å²	67	77.7 Å²	77.7	31%	0.313	41%	0.414	S	S	.	.	H	α-helix	trans	-85.1	-28.8	177.4	-74	-174.5	20.1	0	0	114.3	Q352 V355 N359 Q360 V361 Q399	Q352-Q357 VanDerWaalsContact OE1-NE2 3.12Å; V355-Q357 VanDerWaalsContact C-N 3.33Å; V355-Q357 PolarHBondContact O-N 2.89Å; Q357-N359 PolarHBondContact O-N 2.88Å; Q357-Q360 PolarHBondContact O-N 2.94Å; Q357-V361 WeakPolarHBondContact O-CG2 3.46Å; Q357-V361 PolarHBondContact O-N 3.22Å; Q357-Q399 VanDerWaalsContact CB-NE2 3.3Å
358	K	53.8	Low	62.2	Low	150 Å²	150	83.2 Å²	83.2	65%	0.652	45%	0.449	S	S	*	.	H	α-helix	trans	-56.8	-43.8	174.2	-77.6	-177.8	178.7	172.4	0	110.5	V355 Q360 V361 D362	V355-K358 PolarHBondContact O-N 3.37Å; K358-Q360 VanDerWaalsContact C-N 3.33Å; K358-Q360 PolarHBondContact O-N 2.95Å; K358-V361 PolarHBondContact O-N 3.03Å; K358-D362 PolarHBondContact O-N 2.91Å; K358-D362 VanDerWaalsContact O-N 3.07Å
359	N	50.1	Low	59.1	Low	107 Å²	107	92.1 Å²	92.1	57%	0.572	49%	0.49	S	S	*	.	H	α-helix	trans	-66.5	-29.6	176.4	-65.5	-14.1	0	0	0	113.6	V355 Q357 S363	V355-N359 PolarHBondContact O-N 3.45Å; Q357-N359 PolarHBondContact O-N 2.88Å; N359-S363 WeakPolarHBondContact O-CB 3.3Å; N359-S363 PolarHBondContact O-N 2.9Å
360	Q	47.4	Very low	55.9	Low	116 Å²	116	97.3 Å²	97.3	54%	0.542	52%	0.524	S	S	.	.	H	α-helix	trans	-76.2	-38.6	175.3	-74.3	-176.6	6.4	0	0	112.6	Q357 K358 S363 I364	Q357-Q360 PolarHBondContact O-N 2.94Å; K358-Q360 VanDerWaalsContact C-N 3.33Å; K358-Q360 PolarHBondContact O-N 2.95Å; Q360-S363 PolarHBondContact O-N 3.03Å; Q360-I364 WeakPolarHBondContact O-CD1 3.45Å; Q360-I364 VanDerWaalsContact O-CG1 3.25Å; Q360-I364 WeakPolarHBondContact O-CG1 3.34Å; Q360-I364 PolarHBondContact O-N 3.24Å; Q360-I364 VanDerWaalsContact O-N 3.08Å
361	V	47.7	Very low	52.4	Low	84 Å²	84	102.9 Å²	102.9	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-67.4	-41.3	177.7	177	0	0	0	0	110.8	Q357 K358 S363 I364 M365	Q357-V361 WeakPolarHBondContact O-CG2 3.46Å; Q357-V361 PolarHBondContact O-N 3.22Å; K358-V361 PolarHBondContact O-N 3.03Å; V361-S363 VanDerWaalsContact C-N 3.3Å; V361-S363 PolarHBondContact O-N 3.18Å; V361-I364 PolarHBondContact O-N 3.03Å; V361-M365 PolarHBondContact O-N 2.91Å
362	D	40.6	Very low	48.9	Very low	113 Å²	113	109 Å²	109	60%	0.604	59%	0.587	S	S	*	*	H	α-helix	trans	-64.1	-36.2	174.8	-70.3	-22.9	0	0	0	111.4	K358 I364	K358-D362 PolarHBondContact O-N 2.91Å; K358-D362 VanDerWaalsContact O-N 3.07Å; D362-I364 PolarHBondContact O-N 3.45Å
363	S	41.8	Very low	45.5	Very low	84 Å²	84	115.6 Å²	115.6	59%	0.587	62%	0.615	S	S	*	*	H	α-helix	trans	-73.3	-23.4	177	-168.4	0	0	0	0	114.4	N359 Q360 V361	N359-S363 WeakPolarHBondContact O-CB 3.3Å; N359-S363 PolarHBondContact O-N 2.9Å; Q360-S363 PolarHBondContact O-N 3.03Å; V361-S363 VanDerWaalsContact C-N 3.3Å; V361-S363 PolarHBondContact O-N 3.18Å
364	I	41	Very low	42.2	Very low	117 Å²	117	121 Å²	121	60%	0.6	65%	0.653	S	S	*	*	H	α-helix	trans	-79.7	-31.2	177.6	-68.1	162.4	0	0	0	110.9	Q360 V361 D362 D366 T367	Q360-I364 WeakPolarHBondContact O-CD1 3.45Å; Q360-I364 VanDerWaalsContact O-CG1 3.25Å; Q360-I364 WeakPolarHBondContact O-CG1 3.34Å; Q360-I364 PolarHBondContact O-N 3.24Å; Q360-I364 VanDerWaalsContact O-N 3.08Å; V361-I364 PolarHBondContact O-N 3.03Å; D362-I364 PolarHBondContact O-N 3.45Å; I364-D366 PolarHBondContact O-N 3.04Å; I364-T367 PolarHBondContact O-N 2.8Å; I364-T367 PolarHBondContact O-OG1 3.17Å
365	M	38.6	Very low	39.1	Very low	166 Å²	166	123.7 Å²	123.7	82%	0.818	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-16.3	177.5	-76.5	-142.5	164.9	0	0	114	V361	V361-M365 PolarHBondContact O-N 2.91Å
366	D	32.4	Very low	36.9	Very low	145 Å²	145	125.7 Å²	125.7	78%	0.775	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	0.5	178.9	-99.7	-12.9	0	0	0	115.3	I364 T368	I364-D366 PolarHBondContact O-N 3.04Å; D366-T368 PolarHBondContact O-N 3.43Å
367	T	35.2	Very low	35	Very low	106 Å²	106	132.3 Å²	132.3	65%	0.65	71%	0.706	S	S	*	*			trans	-100.6	89.2	174.1	25.5	0	0	0	0	112.6	I364 H369	I364-T367 PolarHBondContact O-N 2.8Å; I364-T367 PolarHBondContact O-OG1 3.17Å; T367-H369 PolarHBondContact O-N 2.86Å
368	T	28	Very low	33.7	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	74%	0.737	S	S	*	*			trans	-67.3	102.6	166.9	37	0	0	0	0	110.9	D366	D366-T368 PolarHBondContact O-N 3.43Å
369	H	32.1	Very low	32.2	Very low	187 Å²	187	138 Å²	138	87%	0.866	74%	0.74	S	S	*	*			trans	-135.1	116.7	157.7	-94.4	-75.2	0	0	0	112.6	T367	T367-H369 PolarHBondContact O-N 2.86Å
370	V	28.3	Very low	31.7	Very low	140 Å²	140	138.7 Å²	138.7	85%	0.848	75%	0.751	S	S	*	*			trans	-35.8	134.6	176.7	177.4	0	0	0	0	116
371	M	19.8	Very low	30.5	Very low	159 Å²	159	137.3 Å²	137.3	78%	0.783	77%	0.767	S	S	*	*			trans	-52.2	160.1	169.9	-60.1	-173.7	112.7	0	0	115.1
372	P	24	Very low	29.3	Very low	129 Å²	129	136.4 Å²	136.4	84%	0.838	78%	0.775	S	S	*	*				-122.3	142.1	128.4	31.5	-20.6	0	0	0	113.1
373	K	22.3	Very low	28.5	Very low	194 Å²	194	136 Å²	136	84%	0.843	79%	0.787	S	S	*	*			trans	-74.4	135.5	-175.9	-66.8	166.6	173.1	173.5	0	112.4
374	S	25.6	Very low	27.6	Very low	123 Å²	123	137.9 Å²	137.9	86%	0.86	80%	0.796	S	S	*	*			trans	-160.6	116.9	143.3	53.9	0	0	0	0	111.8
375	T	22.8	Very low	26.8	Very low	132 Å²	132	140.6 Å²	140.6	81%	0.81	81%	0.81	S	S	*	*			trans	-101.5	150.4	162.6	2.5	0	0	0	0	107.3
376	P	30.1	Very low	26.1	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	81%	0.808	S	S	*	*				-148.9	140.4	72.5	35.7	-14.4	0	0	0	115.8
377	R	20.1	Very low	25.7	Very low	210 Å²	210	135.6 Å²	135.6	79%	0.792	80%	0.802	S	S	*	*				68.9	106.5	100.6	-162.7	-176.4	-173.1	-172.7	1.9	117
378	L	26.4	Very low	25.2	Very low	181 Å²	181	138.1 Å²	138.1	95%	0.948	81%	0.806	S	S	*	*			trans	-146.1	130.1	141.4	-88.1	169.2	0	0	0	109.5
379	Q	22.7	Very low	25.1	Very low	156 Å²	156	139.4 Å²	139.4	73%	0.729	81%	0.807	S	S	*	*			trans	-99.6	-176.8	170.7	-86.9	-177.1	-3.9	0	0	108.7
380	P	38.2	Very low	24.8	Very low	122 Å²	122	136.7 Å²	136.7	79%	0.792	80%	0.799	S	S	*	*			cis	-133.1	165.8	-41.6	34.8	-18.1	0	0	0	112.7
381	G	22.5	Very low	24.7	Very low	86 Å²	86	136.7 Å²	136.7	89%	0.887	79%	0.793	S	S	*	*			trans	121	95.5	152.2	0	0	0	0	0	115.8
382	G	23.9	Very low	25.2	Very low	65 Å²	65	133.2 Å²	133.2	67%	0.67	78%	0.78	S	S	*	*			trans	165.9	95.2	169.9	0	0	0	0	0	109.7	T384	G382-T384 PolarHBondContact O-N 2.96Å
383	A	23.4	Very low	25.4	Very low	104 Å²	104	133.4 Å²	133.4	86%	0.86	78%	0.779	S	S	*	*			trans	-57.9	102.4	175.3	0	0	0	0	0	109.8	L385	A383-L385 PolarHBondContact O-N 3.41Å
384	T	23	Very low	25.8	Very low	125 Å²	125	131.5 Å²	131.5	77%	0.767	77%	0.773	S	S	*	*			trans	-79.3	99.1	170.5	50.3	0	0	0	0	107.9	G382 N386	G382-T384 PolarHBondContact O-N 2.96Å; T384-N386 PolarHBondContact O-N 3.4Å
385	L	23.1	Very low	26.7	Very low	173 Å²	173	132 Å²	132	91%	0.906	77%	0.774	S	S	*	*			trans	-66.3	114.8	166.7	-92	154.7	0	0	0	108.6	A383 G387	A383-L385 PolarHBondContact O-N 3.41Å; L385-G387 PolarHBondContact O-N 3.37Å
386	N	23.6	Very low	28.7	Very low	143 Å²	143	129.6 Å²	129.6	77%	0.765	76%	0.762	S	S	*	*			trans	-53.1	113.6	179	-70.9	-37	0	0	0	112.2	T384	T384-N386 PolarHBondContact O-N 3.4Å
387	G	25.1	Very low	30.9	Very low	63 Å²	63	124.8 Å²	124.8	65%	0.649	73%	0.732	S	S	*	*			trans	-155	88.4	159.4	0	0	0	0	0	106.2	L385 L389	L385-G387 PolarHBondContact O-N 3.37Å; G387-L389 VanDerWaalsContact C-N 3.3Å; G387-L389 PolarHBondContact O-N 3.01Å
388	H	24.6	Very low	34.2	Very low	160 Å²	160	115.8 Å²	115.8	74%	0.741	70%	0.7	S	S	*	*			trans	-58.7	89.2	-176.8	-77.6	64.6	0	0	0	110.5	N390	H388-N390 VanDerWaalsContact C-N 3.3Å; H388-N390 PolarHBondContact O-N 3.35Å
389	L	25.5	Very low	37.2	Very low	154 Å²	154	110 Å²	110	81%	0.806	67%	0.669	S	S	*	*			trans	-83.7	88.2	150.4	-73.2	172.3	0	0	0	105.9	G387 I391	G387-L389 VanDerWaalsContact C-N 3.3Å; G387-L389 PolarHBondContact O-N 3.01Å; L389-I391 PolarHBondContact O-N 3.05Å
390	N	25.6	Very low	40.6	Very low	129 Å²	129	102.7 Å²	102.7	69%	0.69	63%	0.634	S	S	*	*			trans	-61.1	92.1	153.2	-88.2	-12.1	0	0	0	106.3	H388 V392	H388-N390 VanDerWaalsContact C-N 3.3Å; H388-N390 PolarHBondContact O-N 3.35Å; N390-V392 HydrophobicContact CB-CG2 3.77Å; N390-V392 PolarHBondContact O-N 3.38Å
391	I	26.9	Very low	43.4	Very low	141 Å²	141	99.9 Å²	99.9	72%	0.723	61%	0.613	S	S	*	*			trans	-67.5	81.3	155.5	-59.3	175.1	0	0	0	104.2	L389 T393	L389-I391 PolarHBondContact O-N 3.05Å; I391-T393 VanDerWaalsContact C-N 3.29Å; I391-T393 PolarHBondContact O-N 2.83Å
392	V	28.8	Very low	46.9	Very low	86 Å²	86	95.9 Å²	95.9	52%	0.521	57%	0.571	S	S	.	*			trans	-65.7	96.6	176.3	-172.9	0	0	0	0	106.6	N390 Q394	N390-V392 HydrophobicContact CB-CG2 3.77Å; N390-V392 PolarHBondContact O-N 3.38Å; V392-Q394 HydrophobicContact CG1-CB 4.49Å; V392-Q394 WeakPolarHBondContact CG1-O 3.25Å; V392-Q394 PolarHBondContact O-N 3.36Å; V392-Q394 VanDerWaalsContact O-N 3.08Å
393	T	29.7	Very low	50.3	Low	132 Å²	132	95.8 Å²	95.8	81%	0.81	56%	0.557	S	S	*	*	S	Bend	trans	-76.1	68.5	159.7	27.6	0	0	0	0	108	I391	I391-T393 VanDerWaalsContact C-N 3.29Å; I391-T393 PolarHBondContact O-N 2.83Å
394	Q	29.8	Very low	53.8	Low	154 Å²	154	92 Å²	92	72%	0.72	53%	0.526	S	S	*	.	S	Bend	trans	-173.1	123.1	152.7	-71.5	-142.7	-3.7	0	0	104.4	V392 S396	V392-Q394 HydrophobicContact CG1-CB 4.49Å; V392-Q394 WeakPolarHBondContact CG1-O 3.25Å; V392-Q394 PolarHBondContact O-N 3.36Å; V392-Q394 VanDerWaalsContact O-N 3.08Å; Q394-S396 PolarHBondContact O-N 3.05Å
395	P	45.4	Very low	57.3	Low	135 Å²	135	86.1 Å²	86.1	88%	0.877	49%	0.49	S	S	*	.			trans	-73.1	81.4	-179.6	30.5	-31.2	0	0	0	108.1	S397	P395-S397 PolarHBondContact O-N 3.29Å; P395-S397 VanDerWaalsContact O-N 3.12Å
396	S	64.9	Low	60.7	Low	81 Å²	81	78 Å²	78	57%	0.566	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-58.7	117.5	162.4	53.9	0	0	0	0	105.9	Q394	Q394-S396 PolarHBondContact O-N 3.05Å
397	S	76.8	Confident	64.1	Low	21 Å²	21	74.2 Å²	74.2	15%	0.147	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-49.5	139.8	174.5	46.5	0	0	0	0	110.2	S350 Q352 P395 Q399	S350-S397 WeakPolarHBondContact O-CB 3.47Å; S350-S397 PolarHBondContact O-OG 3.37Å; Q352-S397 VanDerWaalsContact CG-OG 3.27Å; Q352-S397 WeakPolarHBondContact CG-OG 3.48Å; Q352-S397 PolarHBondContact NE2-OG 2.82Å; P395-S397 PolarHBondContact O-N 3.29Å; P395-S397 VanDerWaalsContact O-N 3.12Å; S397-Q399 PolarHBondContact O-N 3.47Å
398	P	87.3	Confident	67.6	Low	21 Å²	21	71.8 Å²	71.8	14%	0.136	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-58.9	141.5	179.7	2.5	1.3	0	0	0	110.7	P206 Y210 T347 L351 Q352	P206-P398 HydrophobicContact CB-CG 4.25Å; Y210-P398 HydrophobicContact CD2-CB 4.44Å; T347-P398 HydrophobicContact CG2-CG 3.66Å; L351-P398 HydrophobicContact CD2-CB 3.81Å; L351-P398 HydrophobicContact CD2-CG 3.65Å; Q352-P398 PolarHBondContact N-O 3.49Å
399	Q	91	Very high	71	Confident	60 Å²	60	64.2 Å²	64.2	28%	0.28	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	139.3	174.6	-61.6	-174.4	-52.4	0	0	109.5	Y210 Q352 E354 Q357 S397	Y210-Q399 WeakPolarHBondContact CD2-O 3.47Å; Y210-Q399 WeakPolarHBondContact CE2-O 3.43Å; Q352-Q399 HydrophobicContact CB-CG 4.31Å; Q352-Q399 CarbonylContact O-C 3.39Å; Q352-Q399 VanDerWaalsContact O-CA 3.27Å; Q352-Q399 WeakPolarHBondContact O-CA 3.26Å; E354-Q399 HydrophobicContact CG-CB 4.17Å; Q357-Q399 VanDerWaalsContact CB-NE2 3.3Å; S397-Q399 PolarHBondContact O-N 3.47Å
400	I	94.5	Very high	74.2	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	146.5	177.4	-172.8	164.5	0	0	0	110.2	Y210 L213 L351 Q352 F402 I405	Y210-I400 HydrophobicContact CD2-CB 4.1Å; Y210-I400 HydrophobicContact CD2-CD1 4.37Å; Y210-I400 HydrophobicContact CD2-CG1 4.45Å; Y210-I400 HydrophobicContact CE2-CB 4.11Å; Y210-I400 HydrophobicContact CE2-CG1 4.27Å; L213-I400 HydrophobicContact CB-CD1 3.73Å; L213-I400 HydrophobicContact CD2-CD1 3.97Å; L213-I400 HydrophobicContact CD2-CG2 4.32Å; L213-I400 HydrophobicContact CG-CD1 3.69Å; L351-I400 HydrophobicContact CB-CG2 4.44Å; L351-I400 HydrophobicContact CD1-CG2 4.27Å; L351-I400 HydrophobicContact CD2-CG2 4.35Å; Q352-I400 PolarHBondContact O-N 2.86Å; I400-F402 HydrophobicContact CG2-CD1 3.84Å; I400-F402 HydrophobicContact CG2-CE1 3.63Å; I400-F402 VanDerWaalsContact O-CD1 3.25Å; I400-F402 WeakPolarHBondContact O-CD1 3.42Å; I400-F402 PolarHBondContact O-N 2.92Å; I400-I405 HydrophobicContact CD1-CD1 4.18Å; I400-I405 HydrophobicContact CG1-CD1 4.23Å; I400-I405 HydrophobicContact CG2-CD1 3.98Å
401	N	95	Very high	77.5	Confident	63 Å²	63	54 Å²	54	34%	0.337	32%	0.318	S	S	.	.			trans	-62.7	101.6	177.4	-173.3	-34.2	0	0	0	112.3	E354 T403 A404 I405	E354-N401 PolarHBondContact OE1-N 3.37Å; E354-N401 VanDerWaalsContact OE1-N 3.17Å; N401-T403 VanDerWaalsContact C-N 3.33Å; N401-T403 PolarHBondContact O-N 3.07Å; N401-T403 WeakPolarHBondContact OD1-CA 3.1Å; N401-T403 WeakPolarHBondContact OD1-CB 3.33Å; N401-T403 PolarHBondContact OD1-N 3.33Å; N401-A404 HydrophobicContact CB-CB 4.12Å; N401-A404 PolarHBondContact O-N 3.46Å; N401-A404 PolarHBondContact OD1-N 3.44Å; N401-I405 PolarHBondContact O-N 3.21Å
402	F	96.9	Very high	80.7	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.009	28%	0.283	C	S	.	.	H	α-helix	trans	-69.1	-30	-180	-71.3	-6	0	0	0	113	L351 D353 I400 A404 I405 C406 N431 F432 F435	L351-F402 HydrophobicContact CB-CE1 4.24Å; L351-F402 HydrophobicContact CB-CZ 4.37Å; D353-F402 HydrophobicContact CB-CB 4.46Å; D353-F402 HydrophobicContact CB-CD1 4.44Å; D353-F402 HydrophobicContact CB-CD2 3.5Å; D353-F402 HydrophobicContact CB-CE2 3.76Å; D353-F402 HydrophobicContact CB-CG 3.88Å; D353-F402 HydrophobicContact CB-CZ 4.37Å; D353-F402 WeakPolarHBondContact OD1-CB 3.42Å; D353-F402 PolarHBondContact OD1-N 3.21Å; I400-F402 HydrophobicContact CG2-CD1 3.84Å; I400-F402 HydrophobicContact CG2-CE1 3.63Å; I400-F402 VanDerWaalsContact O-CD1 3.25Å; I400-F402 WeakPolarHBondContact O-CD1 3.42Å; I400-F402 PolarHBondContact O-N 2.92Å; F402-A404 PolarHBondContact O-N 3.46Å; F402-I405 HydrophobicContact CD1-CD1 4.09Å; F402-I405 PolarHBondContact O-N 3.25Å; F402-C406 PolarHBondContact O-N 3.42Å; F402-N431 HydrophobicContact CE2-CB 4.08Å; F402-N431 HydrophobicContact CZ-CB 4.32Å; F402-F432 HydrophobicContact CB-CD2 4.09Å; F402-F432 HydrophobicContact CB-CE2 4.1Å; F402-F432 AromaticContact CD1-CD2 3.8Å; F402-F432 HydrophobicContact CD1-CD2 3.8Å; F402-F432 HydrophobicContact CD1-CE2 4.35Å; F402-F432 HydrophobicContact CD2-CB 4.4Å; F402-F432 AromaticContact CD2-CD2 3.85Å; F402-F432 HydrophobicContact CD2-CD2 3.85Å; F402-F432 HydrophobicContact CE1-CD2 4.09Å; F402-F432 HydrophobicContact CE2-CB 4Å; F402-F432 HydrophobicContact CE2-CD2 4.17Å; F402-F432 AromaticContact CG-CD2 3.66Å; F402-F432 HydrophobicContact CG-CD2 3.66Å; F402-F432 HydrophobicContact CG-CE2 4.15Å; F402-F432 HydrophobicContact CZ-CB 4.15Å; F402-F432 HydrophobicContact CZ-CD2 4.27Å; F402-F435 HydrophobicContact CB-CD1 3.45Å; F402-F435 VanDerWaalsContact CB-CD1 3.45Å; F402-F435 HydrophobicContact CB-CD2 4.08Å; F402-F435 HydrophobicContact CB-CE1 3.4Å; F402-F435 VanDerWaalsContact CB-CE1 3.4Å; F402-F435 HydrophobicContact CB-CE2 4.02Å; F402-F435 HydrophobicContact CB-CG 3.82Å; F402-F435 HydrophobicContact CB-CZ 3.71Å; F402-F435 HydrophobicContact CD2-CB 3.65Å; F402-F435 AromaticContact CD2-CD1 3.89Å; F402-F435 HydrophobicContact CD2-CD1 3.89Å; F402-F435 HydrophobicContact CD2-CD2 4.26Å; F402-F435 AromaticContact CD2-CG 3.67Å; F402-F435 HydrophobicContact CD2-CG 3.67Å; F402-F435 HydrophobicContact CE2-CB 4.31Å; F402-F435 HydrophobicContact CG-CD1 4.15Å; F402-F435 HydrophobicContact CG-CG 4.27Å
403	T	95.8	Very high	83.7	Confident	62 Å²	62	43.3 Å²	43.3	38%	0.38	26%	0.259	S	S	.	.	H	α-helix	trans	-61.1	-45.7	175.2	-51.3	0	0	0	0	111.3	N401 I405 C406 D407	N401-T403 VanDerWaalsContact C-N 3.33Å; N401-T403 PolarHBondContact O-N 3.07Å; N401-T403 WeakPolarHBondContact OD1-CA 3.1Å; N401-T403 WeakPolarHBondContact OD1-CB 3.33Å; N401-T403 PolarHBondContact OD1-N 3.33Å; T403-I405 VanDerWaalsContact C-N 3.29Å; T403-I405 PolarHBondContact O-N 3.09Å; T403-C406 PolarHBondContact O-N 3.33Å; T403-D407 VanDerWaalsContact O-CG 3.29Å; T403-D407 PolarHBondContact O-N 3.1Å
404	A	95.8	Very high	86.6	Confident	26 Å²	26	39.9 Å²	39.9	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-35.9	178.9	0	0	0	0	0	112.3	N401 F402 D407 T408	N401-A404 HydrophobicContact CB-CB 4.12Å; N401-A404 PolarHBondContact O-N 3.46Å; N401-A404 PolarHBondContact OD1-N 3.44Å; F402-A404 PolarHBondContact O-N 3.46Å; A404-D407 PolarHBondContact O-N 2.93Å; A404-T408 PolarHBondContact O-N 3.35Å; A404-T408 PolarHBondContact O-OG1 3.19Å
405	I	96.6	Very high	89.4	Confident	1 Å²	1	34 Å²	34	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-48.4	173.1	-64.4	168.7	0	0	0	110.5	L213 F216 I400 N401 F402 T403 D407 T408 A409 L425 F432	L213-I405 HydrophobicContact CD1-CD1 4.21Å; L213-I405 HydrophobicContact CD1-CG1 4.4Å; L213-I405 HydrophobicContact CD2-CD1 3.64Å; L213-I405 HydrophobicContact CG-CD1 3.76Å; L213-I405 HydrophobicContact CG-CG1 4.23Å; F216-I405 HydrophobicContact CD1-CG2 4.48Å; F216-I405 HydrophobicContact CE1-CG2 4.13Å; I400-I405 HydrophobicContact CD1-CD1 4.18Å; I400-I405 HydrophobicContact CG1-CD1 4.23Å; I400-I405 HydrophobicContact CG2-CD1 3.98Å; N401-I405 PolarHBondContact O-N 3.21Å; F402-I405 HydrophobicContact CD1-CD1 4.09Å; F402-I405 PolarHBondContact O-N 3.25Å; T403-I405 VanDerWaalsContact C-N 3.29Å; T403-I405 PolarHBondContact O-N 3.09Å; I405-D407 VanDerWaalsContact C-N 3.31Å; I405-D407 PolarHBondContact O-N 2.8Å; I405-T408 PolarHBondContact O-N 2.91Å; I405-A409 VanDerWaalsContact O-CB 3.24Å; I405-A409 WeakPolarHBondContact O-CB 3.27Å; I405-A409 PolarHBondContact O-N 2.86Å; I405-L425 HydrophobicContact CG2-CD1 3.82Å; I405-F432 HydrophobicContact CB-CE2 4.11Å; I405-F432 HydrophobicContact CD1-CE2 4.44Å; I405-F432 HydrophobicContact CG2-CE2 3.79Å; I405-F432 HydrophobicContact CG2-CZ 3.95Å
406	C	95.9	Very high	91.5	Very high	2 Å²	2	28 Å²	28	1%	0.014	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-40.9	177.3	-77.2	0	0	0	0	112.3	F402 T403 A409 A410	F402-C406 PolarHBondContact O-N 3.42Å; T403-C406 PolarHBondContact O-N 3.33Å; C406-A409 PolarHBondContact O-N 3.29Å; C406-A410 VanDerWaalsContact O-CB 3.3Å; C406-A410 WeakPolarHBondContact O-CB 3.25Å; C406-A410 PolarHBondContact O-N 2.76Å
407	D	95.2	Very high	92.8	Very high	63 Å²	63	24.2 Å²	24.2	34%	0.337	15%	0.147	S	C	.	.	H	α-helix	trans	-67.4	-44.6	-178.1	-73	11.1	0	0	0	111.7	T403 A404 I405 S411 K444	T403-D407 VanDerWaalsContact O-CG 3.29Å; T403-D407 PolarHBondContact O-N 3.1Å; A404-D407 PolarHBondContact O-N 2.93Å; I405-D407 VanDerWaalsContact C-N 3.31Å; I405-D407 PolarHBondContact O-N 2.8Å; D407-S411 PolarHBondContact O-N 3.22Å; D407-S411 PolarHBondContact O-OG 3.26Å; D407-K444 WeakPolarHBondContact OD1-CD 3.13Å; D407-K444 WeakPolarHBondContact OD1-CE 3.46Å; D407-K444 IonicContact OD1-NZ 3.19Å; D407-K444 PolarHBondContact OD1-NZ 3.37Å; D407-K444 IonicContact OD2-NZ 3.58Å; D407-K444 PolarHBondContact OD2-NZ 3.01Å
408	T	96.6	Very high	93.7	Very high	13 Å²	13	23.2 Å²	23.2	8%	0.08	14%	0.14	C	C	.	.	H	α-helix	trans	-69.4	-40.8	175.1	-67.1	0	0	0	0	111.5	F216 S217 N219 A404 I405 A410 S411 T412	F216-T408 HydrophobicContact CD1-CG2 4.46Å; F216-T408 HydrophobicContact CD2-CG2 4.15Å; F216-T408 HydrophobicContact CE1-CG2 4.15Å; F216-T408 HydrophobicContact CE2-CG2 3.84Å; F216-T408 HydrophobicContact CG-CG2 4.47Å; F216-T408 HydrophobicContact CZ-CG2 3.85Å; F216-T408 WeakPolarHBondContact O-CG2 3.19Å; S217-T408 PolarHBondContact O-OG1 2.94Å; N219-T408 HydrophobicContact CB-CG2 3.94Å; A404-T408 PolarHBondContact O-N 3.35Å; A404-T408 PolarHBondContact O-OG1 3.19Å; I405-T408 PolarHBondContact O-N 2.91Å; T408-A410 PolarHBondContact O-N 3.11Å; T408-S411 PolarHBondContact O-N 3.27Å; T408-S411 PolarHBondContact O-OG 3.33Å; T408-T412 HydrophobicContact CG2-CG2 4.11Å; T408-T412 WeakPolarHBondContact O-CB 3.3Å; T408-T412 WeakPolarHBondContact O-CG2 2.96Å; T408-T412 PolarHBondContact O-N 3.06Å; T408-T412 VanDerWaalsContact O-N 3.1Å; T408-T412 PolarHBondContact O-OG1 3.33Å
409	A	96	Very high	94	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-57.5	-50.9	175.6	0	0	0	0	0	110.4	F216 I405 C406 S411 T412 L413 L422	F216-A409 HydrophobicContact CE1-CB 4.41Å; F216-A409 HydrophobicContact CZ-CB 4.17Å; I405-A409 VanDerWaalsContact O-CB 3.24Å; I405-A409 WeakPolarHBondContact O-CB 3.27Å; I405-A409 PolarHBondContact O-N 2.86Å; C406-A409 PolarHBondContact O-N 3.29Å; A409-S411 VanDerWaalsContact C-N 3.26Å; A409-S411 PolarHBondContact O-N 3.3Å; A409-T412 CarbonylContact O-C 3.27Å; A409-T412 PolarHBondContact O-N 3.34Å; A409-T412 PolarHBondContact O-OG1 3.35Å; A409-L413 VanDerWaalsContact O-CG 3.27Å; A409-L413 WeakPolarHBondContact O-CG 3.45Å; A409-L413 PolarHBondContact O-N 3.05Å; A409-L422 HydrophobicContact CB-CD1 4.33Å; A409-L422 HydrophobicContact CB-CD2 4.27Å
410	A	94.6	Very high	94.2	Very high	18 Å²	18	19.5 Å²	19.5	15%	0.149	12%	0.121	C	C	.	.	H	α-helix	trans	-55.5	-37.6	179.5	0	0	0	0	0	113.5	C406 T408 K444 V445 P448	C406-A410 VanDerWaalsContact O-CB 3.3Å; C406-A410 WeakPolarHBondContact O-CB 3.25Å; C406-A410 PolarHBondContact O-N 2.76Å; T408-A410 PolarHBondContact O-N 3.11Å; A410-K444 HydrophobicContact CB-CB 4.07Å; A410-K444 WeakPolarHBondContact CB-O 3.4Å; A410-V445 HydrophobicContact CB-CG2 4.49Å; A410-P448 HydrophobicContact CB-CG 4.34Å; A410-P448 WeakPolarHBondContact O-CG 3.43Å
411	S	93.5	Very high	94.3	Very high	50 Å²	50	19.4 Å²	19.4	35%	0.35	12%	0.121	S	C	.	.	H	α-helix	trans	-80.4	-16.2	178.5	63.6	0	0	0	0	114.3	E298 D407 T408 A409	E298-S411 CarbonylContact C-O 3.54Å; E298-S411 VanDerWaalsContact O-O 3.11Å; D407-S411 PolarHBondContact O-N 3.22Å; D407-S411 PolarHBondContact O-OG 3.26Å; T408-S411 PolarHBondContact O-N 3.27Å; T408-S411 PolarHBondContact O-OG 3.33Å; A409-S411 VanDerWaalsContact C-N 3.26Å; A409-S411 PolarHBondContact O-N 3.3Å
412	T	94.3	Very high	94.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-121.5	4.3	-171.4	62.4	0	0	0	0	114.7	T408 A409 S414 Q415 S418	T408-T412 HydrophobicContact CG2-CG2 4.11Å; T408-T412 WeakPolarHBondContact O-CB 3.3Å; T408-T412 WeakPolarHBondContact O-CG2 2.96Å; T408-T412 PolarHBondContact O-N 3.06Å; T408-T412 VanDerWaalsContact O-N 3.1Å; T408-T412 PolarHBondContact O-OG1 3.33Å; A409-T412 CarbonylContact O-C 3.27Å; A409-T412 PolarHBondContact O-N 3.34Å; A409-T412 PolarHBondContact O-OG1 3.35Å; T412-S414 PolarHBondContact O-N 3.1Å; T412-Q415 PolarHBondContact O-N 2.81Å; T412-S418 WeakPolarHBondContact O-CB 3.07Å; T412-S418 WeakPolarHBondContact OG1-CB 3.38Å; T412-S418 PolarHBondContact OG1-OG 3.07Å
413	L	92.9	Very high	94.4	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.01	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-18.4	-178.6	-81.8	-176.5	0	0	0	114.9	A409 Q415 P419 L422 V445 P448 L449 I452 L463	A409-L413 VanDerWaalsContact O-CG 3.27Å; A409-L413 WeakPolarHBondContact O-CG 3.45Å; A409-L413 PolarHBondContact O-N 3.05Å; L413-Q415 PolarHBondContact O-N 2.78Å; L413-P419 HydrophobicContact CD2-CB 3.87Å; L413-L422 HydrophobicContact CD2-CD2 3.95Å; L413-V445 HydrophobicContact CD1-CG1 4.1Å; L413-P448 HydrophobicContact CD1-CB 3.92Å; L413-P448 HydrophobicContact CD1-CG 3.85Å; L413-L449 HydrophobicContact CD1-CD2 3.73Å; L413-L449 HydrophobicContact CD1-CG 3.76Å; L413-I452 HydrophobicContact CB-CD1 3.97Å; L413-I452 WeakPolarHBondContact O-CD1 3.47Å; L413-L463 WeakPolarHBondContact O-CD1 3.19Å
414	S	89	Confident	94.3	Very high	60 Å²	60	14.8 Å²	14.8	42%	0.42	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.3	175.1	65.1	0	0	0	0	113.9	T412	T412-S414 PolarHBondContact O-N 3.1Å
415	Q	89.4	Confident	94.4	Very high	30 Å²	30	13.5 Å²	13.5	14%	0.14	8%	0.083	C	C	.	.	S	Bend	trans	-102.2	118.6	178.5	-66.5	-179.7	-39.1	0	0	110.7	C300 T412 L413 S417 S418 P419	C300-Q415 PolarHBondContact SG-OE1 3.44Å; T412-Q415 PolarHBondContact O-N 2.81Å; L413-Q415 PolarHBondContact O-N 2.78Å; Q415-S417 PolarHBondContact O-N 3Å; Q415-S418 WeakPolarHBondContact O-CB 3.49Å; Q415-S418 PolarHBondContact O-N 3.44Å; Q415-P419 WeakPolarHBondContact O-CD 3.28Å
416	D	89	Confident	94.5	Very high	11 Å²	11	13.6 Å²	13.6	6%	0.059	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.9	-34.1	-173.7	-65.2	20.8	0	0	0	117.2	P419 L420 Y730 V734 R737 Q738	D416-P419 WeakPolarHBondContact O-CD 3.32Å; D416-P419 WeakPolarHBondContact O-CG 3.36Å; D416-L420 WeakPolarHBondContact O-CB 3.47Å; D416-L420 PolarHBondContact O-N 3.37Å; D416-Y730 PolarHBondContact OD2-OH 3.3Å; D416-Y730 VanDerWaalsContact OD2-OH 3.13Å; D416-V734 HydrophobicContact CB-CG1 4.03Å; D416-V734 HydrophobicContact CB-CG2 3.77Å; D416-R737 IonicContact OD1-NH1 3.78Å; D416-R737 IonicContact OD2-CZ 3.26Å; D416-R737 IonicContact OD2-NH1 3.69Å; D416-R737 PolarHBondContact OD2-NH1 2.83Å; D416-R737 IonicContact OD2-NH2 3.72Å; D416-R737 PolarHBondContact OD2-NH2 2.83Å; D416-Q738 VanDerWaalsContact N-NE2 3.15Å
417	S	92.8	Very high	94.4	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66	-34.4	177.6	51.4	0	0	0	0	113.5	Q415 L421 Q738	Q415-S417 PolarHBondContact O-N 3Å; S417-L421 WeakPolarHBondContact O-CB 3.3Å; S417-L421 PolarHBondContact O-N 3.28Å; S417-Q738 VanDerWaalsContact CB-OE1 3.26Å; S417-Q738 PolarHBondContact OG-OE1 3.36Å
418	S	95.1	Very high	94.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.5	-55.2	-178.8	-177	0	0	0	0	114	T412 Q415 L420 L421 L422	T412-S418 WeakPolarHBondContact O-CB 3.07Å; T412-S418 WeakPolarHBondContact OG1-CB 3.38Å; T412-S418 PolarHBondContact OG1-OG 3.07Å; Q415-S418 WeakPolarHBondContact O-CB 3.49Å; Q415-S418 PolarHBondContact O-N 3.44Å; S418-L420 PolarHBondContact O-N 3.25Å; S418-L421 PolarHBondContact O-N 3.33Å; S418-L422 WeakPolarHBondContact O-CB 3.47Å; S418-L422 PolarHBondContact O-N 2.91Å
419	P	94.7	Very high	94.3	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-64.2	-30.1	175.8	25.8	-31.4	0	0	0	112	L413 Q415 D416 Y423 L463 M466 L470	L413-P419 HydrophobicContact CD2-CB 3.87Å; Q415-P419 WeakPolarHBondContact O-CD 3.28Å; D416-P419 WeakPolarHBondContact O-CD 3.32Å; D416-P419 WeakPolarHBondContact O-CG 3.36Å; P419-Y423 VanDerWaalsContact O-CB 3.24Å; P419-Y423 WeakPolarHBondContact O-CB 3.41Å; P419-Y423 PolarHBondContact O-N 3.49Å; P419-L463 HydrophobicContact CB-CD1 4.39Å; P419-L463 HydrophobicContact CG-CD1 3.58Å; P419-M466 HydrophobicContact CB-CB 4.27Å; P419-M466 HydrophobicContact CB-CE 4.42Å; P419-M466 HydrophobicContact CB-SD 4.41Å; P419-M466 HydrophobicContact CG-CE 3.82Å; P419-M466 HydrophobicContact CG-SD 4.3Å; P419-L470 HydrophobicContact CB-CD1 4.43Å
420	L	94.8	Very high	94.3	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-68.6	-44.2	176	-175.8	59.7	0	0	0	112	L312 D416 S418 Y423 L424 M466 F727 Y730 V731	L312-L420 HydrophobicContact CD1-CD2 4.07Å; L312-L420 HydrophobicContact CD2-CB 4.38Å; L312-L420 HydrophobicContact CD2-CD2 3.86Å; L312-L420 HydrophobicContact CD2-CG 3.78Å; D416-L420 WeakPolarHBondContact O-CB 3.47Å; D416-L420 PolarHBondContact O-N 3.37Å; S418-L420 PolarHBondContact O-N 3.25Å; L420-Y423 HydrophobicContact CD1-CD1 4.29Å; L420-Y423 WeakPolarHBondContact O-CB 3.21Å; L420-Y423 PolarHBondContact O-N 3.02Å; L420-L424 WeakPolarHBondContact O-CG 3.28Å; L420-L424 PolarHBondContact O-N 3.25Å; L420-M466 HydrophobicContact CB-SD 3.81Å; L420-M466 HydrophobicContact CD1-SD 4.1Å; L420-F727 HydrophobicContact CD1-CD1 3.87Å; L420-F727 HydrophobicContact CD1-CE1 3.59Å; L420-Y730 HydrophobicContact CD2-CD1 4.12Å; L420-Y730 HydrophobicContact CD2-CE1 4.09Å; L420-V731 HydrophobicContact CD2-CG2 3.47Å; L420-V731 VanDerWaalsContact CD2-CG2 3.47Å
421	L	96.8	Very high	94.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-64	-43.4	174.2	179.9	59.1	0	0	0	111.2	L213 F216 L311 S417 S418 Y423 L424 L425	L213-L421 HydrophobicContact CD1-CD1 4.45Å; L213-L421 HydrophobicContact CD1-CD2 3.83Å; L213-L421 HydrophobicContact CD1-CG 4.4Å; F216-L421 HydrophobicContact CD1-CD2 3.99Å; F216-L421 HydrophobicContact CD2-CD2 4.28Å; F216-L421 HydrophobicContact CE1-CD2 4.24Å; F216-L421 HydrophobicContact CG-CD2 4Å; F216-L421 HydrophobicContact CZ-CD2 4.47Å; L311-L421 HydrophobicContact CD2-CD1 3.75Å; L311-L421 HydrophobicContact CD2-CD2 4.45Å; L311-L421 HydrophobicContact CG-CD1 4.4Å; S417-L421 WeakPolarHBondContact O-CB 3.3Å; S417-L421 PolarHBondContact O-N 3.28Å; S418-L421 PolarHBondContact O-N 3.33Å; L421-Y423 VanDerWaalsContact C-N 3.33Å; L421-Y423 PolarHBondContact O-N 3.24Å; L421-L424 PolarHBondContact O-N 3.22Å; L421-L425 HydrophobicContact CG-CD1 4.34Å; L421-L425 WeakPolarHBondContact O-CG 3.27Å; L421-L425 PolarHBondContact O-N 3.41Å
422	L	97.4	Very high	94.6	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-42.7	175.4	-178.2	63.9	0	0	0	111.5	A409 L413 S418 L424 L425 V426 F432 V445 L470	A409-L422 HydrophobicContact CB-CD1 4.33Å; A409-L422 HydrophobicContact CB-CD2 4.27Å; L413-L422 HydrophobicContact CD2-CD2 3.95Å; S418-L422 WeakPolarHBondContact O-CB 3.47Å; S418-L422 PolarHBondContact O-N 2.91Å; L422-L424 PolarHBondContact O-N 3.49Å; L422-L425 PolarHBondContact O-N 2.74Å; L422-V426 HydrophobicContact CD1-CG2 3.83Å; L422-V426 HydrophobicContact CG-CG2 4.1Å; L422-V426 WeakPolarHBondContact O-CB 3.37Å; L422-V426 VanDerWaalsContact O-CG2 3.29Å; L422-V426 WeakPolarHBondContact O-CG2 3.46Å; L422-V426 PolarHBondContact O-N 3.28Å; L422-F432 HydrophobicContact CD1-CE1 3.82Å; L422-F432 HydrophobicContact CD1-CZ 4.05Å; L422-V445 HydrophobicContact CD2-CG1 3.65Å; L422-V445 HydrophobicContact CD2-CG2 4.48Å; L422-L470 HydrophobicContact CD2-CD1 3.92Å; L422-L470 HydrophobicContact CD2-CD2 4.3Å; L422-L470 HydrophobicContact CG-CD1 4.33Å; L422-L470 HydrophobicContact CG-CD2 4.05Å
423	Y	95.9	Very high	94.7	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-56	-50.2	174.3	161.7	-98.8	0	0	0	111.5	P419 L420 L421 L425 V426 H427 I469 I473 Y717 E719 F727	P419-Y423 VanDerWaalsContact O-CB 3.24Å; P419-Y423 WeakPolarHBondContact O-CB 3.41Å; P419-Y423 PolarHBondContact O-N 3.49Å; L420-Y423 HydrophobicContact CD1-CD1 4.29Å; L420-Y423 WeakPolarHBondContact O-CB 3.21Å; L420-Y423 PolarHBondContact O-N 3.02Å; L421-Y423 VanDerWaalsContact C-N 3.33Å; L421-Y423 PolarHBondContact O-N 3.24Å; Y423-L425 VanDerWaalsContact C-N 3.3Å; Y423-L425 PolarHBondContact O-N 2.93Å; Y423-V426 PolarHBondContact O-N 3.12Å; Y423-H427 HydrophobicContact CD2-CB 4.31Å; Y423-H427 HydrophobicContact CE2-CB 3.98Å; Y423-H427 WeakPolarHBondContact O-CB 3.41Å; Y423-H427 PolarHBondContact O-N 2.83Å; Y423-I469 HydrophobicContact CD2-CG2 3.74Å; Y423-I469 HydrophobicContact CE2-CG2 3.61Å; Y423-I473 HydrophobicContact CD2-CD1 4.41Å; Y423-I473 HydrophobicContact CE2-CD1 4.39Å; Y423-Y717 AromaticContact CE2-CE1 3.76Å; Y423-Y717 HydrophobicContact CE2-CE1 3.76Å; Y423-Y717 PolarHBondContact OH-OH 3.43Å; Y423-E719 VanDerWaalsContact OH-CD 3.32Å; Y423-E719 VanDerWaalsContact OH-CG 3.24Å; Y423-E719 WeakPolarHBondContact OH-CG 3.3Å; Y423-E719 PolarHBondContact OH-OE1 3.03Å; Y423-F727 HydrophobicContact CD1-CE1 4.23Å; Y423-F727 HydrophobicContact CD1-CZ 4.27Å; Y423-F727 AromaticContact CE1-CE1 3.86Å; Y423-F727 HydrophobicContact CE1-CE1 3.86Å; Y423-F727 HydrophobicContact CE1-CE2 4.43Å; Y423-F727 AromaticContact CE1-CZ 3.48Å; Y423-F727 HydrophobicContact CE1-CZ 3.48Å; Y423-F727 VanDerWaalsContact CE1-CZ 3.48Å; Y423-F727 AromaticContact CZ-CZ 3.96Å
424	L	95	Very high	94.8	Very high	23 Å²	23	26 Å²	26	12%	0.12	14%	0.14	C	C	.	.	H	α-helix	trans	-59.9	-41.8	179.3	-70.5	176.5	0	0	0	111.8	L312 L348 F349 L420 L421 L422 R428	L312-L424 HydrophobicContact CD2-CD1 3.78Å; L348-L424 HydrophobicContact CD2-CB 4.44Å; F349-L424 HydrophobicContact CE1-CB 4.36Å; F349-L424 HydrophobicContact CZ-CD2 4.5Å; L420-L424 WeakPolarHBondContact O-CG 3.28Å; L420-L424 PolarHBondContact O-N 3.25Å; L421-L424 PolarHBondContact O-N 3.22Å; L422-L424 PolarHBondContact O-N 3.49Å; L424-R428 VanDerWaalsContact O-CB 3.24Å; L424-R428 WeakPolarHBondContact O-CB 3.43Å; L424-R428 PolarHBondContact O-N 2.95Å
425	L	97.4	Very high	95.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-49.9	177.7	-71.9	169.6	0	0	0	112.1	L213 L348 L351 I405 L421 L422 Y423 H427 N429 F432	L213-L425 HydrophobicContact CD1-CD1 4.27Å; L213-L425 HydrophobicContact CD2-CD2 4.4Å; L348-L425 HydrophobicContact CD1-CD2 3.72Å; L348-L425 HydrophobicContact CD1-CG 4.5Å; L348-L425 HydrophobicContact CG-CD2 4.24Å; L351-L425 HydrophobicContact CD1-CD2 4.36Å; I405-L425 HydrophobicContact CG2-CD1 3.82Å; L421-L425 HydrophobicContact CG-CD1 4.34Å; L421-L425 WeakPolarHBondContact O-CG 3.27Å; L421-L425 PolarHBondContact O-N 3.41Å; L422-L425 PolarHBondContact O-N 2.74Å; Y423-L425 VanDerWaalsContact C-N 3.3Å; Y423-L425 PolarHBondContact O-N 2.93Å; L425-H427 PolarHBondContact O-N 3.22Å; L425-N429 HydrophobicContact CD2-CB 4.48Å; L425-N429 WeakPolarHBondContact O-CA 3.41Å; L425-N429 VanDerWaalsContact O-CB 3.26Å; L425-N429 WeakPolarHBondContact O-CB 3.23Å; L425-N429 PolarHBondContact O-N 2.99Å; L425-F432 HydrophobicContact CB-CD1 3.66Å; L425-F432 HydrophobicContact CB-CE1 3.93Å; L425-F432 HydrophobicContact CB-CG 3.98Å; L425-F432 HydrophobicContact CB-CZ 4.48Å; L425-F432 HydrophobicContact CD1-CE2 4.45Å; L425-F432 HydrophobicContact CD1-CZ 4.46Å
426	V	97.1	Very high	95.5	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.012	12%	0.118	C	C	.	.	H	α-helix	trans	-64.1	-42.1	-179.1	170	0	0	0	0	111.5	L422 Y423 F432 H433 I436 L470 I473 F474	L422-V426 HydrophobicContact CD1-CG2 3.83Å; L422-V426 HydrophobicContact CG-CG2 4.1Å; L422-V426 WeakPolarHBondContact O-CB 3.37Å; L422-V426 VanDerWaalsContact O-CG2 3.29Å; L422-V426 WeakPolarHBondContact O-CG2 3.46Å; L422-V426 PolarHBondContact O-N 3.28Å; Y423-V426 PolarHBondContact O-N 3.12Å; V426-F432 HydrophobicContact CG2-CD1 4.07Å; V426-F432 HydrophobicContact CG2-CE1 3.79Å; V426-H433 WeakPolarHBondContact O-CB 2.92Å; V426-H433 PolarHBondContact O-CD2 3.46Å; V426-I436 HydrophobicContact CG2-CD1 4.15Å; V426-L470 HydrophobicContact CB-CD2 4.11Å; V426-L470 HydrophobicContact CG1-CD2 4.33Å; V426-L470 HydrophobicContact CG2-CD2 4.11Å; V426-I473 HydrophobicContact CG1-CB 4.42Å; V426-I473 HydrophobicContact CG1-CD1 4.46Å; V426-I473 HydrophobicContact CG1-CG2 3.74Å; V426-F474 HydrophobicContact CG1-CD1 4.31Å; V426-F474 HydrophobicContact CG1-CE1 3.75Å; V426-F474 HydrophobicContact CG2-CE1 4.11Å; V426-F474 HydrophobicContact CG2-CZ 4.47Å
427	H	94.5	Very high	95.9	Very high	52 Å²	52	23.1 Å²	23.1	24%	0.241	12%	0.119	C	C	.	.	H	α-helix	trans	-81.4	-39.7	-175	-175.2	-124	0	0	0	112.8	Y423 L425 I473 Y717 E719	Y423-H427 HydrophobicContact CD2-CB 4.31Å; Y423-H427 HydrophobicContact CE2-CB 3.98Å; Y423-H427 WeakPolarHBondContact O-CB 3.41Å; Y423-H427 PolarHBondContact O-N 2.83Å; L425-H427 PolarHBondContact O-N 3.22Å; H427-I473 HydrophobicContact CB-CD1 4.06Å; H427-Y717 AromaticContact CD2-CD1 3.82Å; H427-Y717 AromaticContact NE2-CD1 3.78Å; H427-E719 VanDerWaalsContact CE1-CG 3.49Å; H427-E719 WeakPolarHBondContact CE1-CG 3.45Å; H427-E719 IonicContact CE1-OE1 2.98Å; H427-E719 PolarHBondContact CE1-OE1 2.87Å; H427-E719 VanDerWaalsContact CE1-OE1 3.24Å; H427-E719 IonicContact CE1-OE2 2.71Å; H427-E719 PolarHBondContact CE1-OE2 3.36Å; H427-E719 VanDerWaalsContact ND1-CD 3.34Å; H427-E719 IonicContact ND1-OE1 2.61Å; H427-E719 PolarHBondContact ND1-OE1 3.1Å; H427-E719 IonicContact ND1-OE2 2.73Å
428	R	93.4	Very high	96	Very high	92 Å²	92	30.2 Å²	30.2	35%	0.347	15%	0.152	S	C	.	.	H	α-helix	trans	-110	-19.1	-167.7	-52.6	-64.2	-60.4	-161.9	7.2	114.4	F349 L424 E719	F349-R428 HydrophobicContact CD1-CB 3.53Å; F349-R428 HydrophobicContact CD2-CB 3.77Å; F349-R428 HydrophobicContact CE1-CB 3.48Å; F349-R428 VanDerWaalsContact CE1-CB 3.48Å; F349-R428 HydrophobicContact CE1-CG 4Å; F349-R428 HydrophobicContact CE2-CB 3.66Å; F349-R428 HydrophobicContact CE2-CG 3.92Å; F349-R428 HydrophobicContact CG-CB 3.7Å; F349-R428 HydrophobicContact CZ-CB 3.54Å; F349-R428 HydrophobicContact CZ-CG 3.67Å; L424-R428 VanDerWaalsContact O-CB 3.24Å; L424-R428 WeakPolarHBondContact O-CB 3.43Å; L424-R428 PolarHBondContact O-N 2.95Å; R428-E719 IonicContact CZ-OE2 3.17Å; R428-E719 IonicContact NH1-OE2 3.95Å; R428-E719 PolarHBondContact NH1-OE2 2.83Å
429	N	96.3	Very high	95.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.			trans	-100.2	105.3	174.2	-173.3	-46.6	0	0	0	110.4	L348 L351 L425 N431 F432 H433	L348-N429 PolarHBondContact O-ND2 2.92Å; L351-N429 WeakPolarHBondContact CB-ND2 3.47Å; L351-N429 PolarHBondContact N-ND2 3.43Å; L351-N429 PolarHBondContact O-ND2 2.94Å; L425-N429 HydrophobicContact CD2-CB 4.48Å; L425-N429 WeakPolarHBondContact O-CA 3.41Å; L425-N429 VanDerWaalsContact O-CB 3.26Å; L425-N429 WeakPolarHBondContact O-CB 3.23Å; L425-N429 PolarHBondContact O-N 2.99Å; N429-N431 VanDerWaalsContact C-N 3.27Å; N429-N431 PolarHBondContact O-N 3.07Å; N429-N431 WeakPolarHBondContact OD1-CA 3.44Å; N429-N431 WeakPolarHBondContact OD1-CB 3.23Å; N429-N431 PolarHBondContact OD1-N 3.34Å; N429-F432 HydrophobicContact CB-CB 3.96Å; N429-F432 PolarHBondContact O-N 3.26Å; N429-F432 PolarHBondContact OD1-N 3.33Å; N429-H433 WeakPolarHBondContact O-CB 3.36Å; N429-H433 PolarHBondContact O-N 3.18Å
430	T	95.5	Very high	95.8	Very high	100 Å²	100	41.4 Å²	41.4	61%	0.613	20%	0.2	S	C	*	.	H	α-helix	trans	-64.9	-29.5	-177.8	52.4	0	0	0	0	113.5	S434	T430-S434 WeakPolarHBondContact O-CB 3.32Å; T430-S434 PolarHBondContact O-N 3.24Å; T430-S434 PolarHBondContact O-OG 2.86Å
431	N	96.5	Very high	95.7	Very high	62 Å²	62	41.8 Å²	41.8	33%	0.332	21%	0.205	S	C	.	.	H	α-helix	trans	-71.4	-46.3	177.9	-56.8	-35.5	0	0	0	109.9	L351 F402 N429 S434 F435	L351-N431 WeakPolarHBondContact O-CB 3.25Å; L351-N431 PolarHBondContact O-ND2 3.38Å; F402-N431 HydrophobicContact CE2-CB 4.08Å; F402-N431 HydrophobicContact CZ-CB 4.32Å; N429-N431 VanDerWaalsContact C-N 3.27Å; N429-N431 PolarHBondContact O-N 3.07Å; N429-N431 WeakPolarHBondContact OD1-CA 3.44Å; N429-N431 WeakPolarHBondContact OD1-CB 3.23Å; N429-N431 PolarHBondContact OD1-N 3.34Å; N431-S434 PolarHBondContact O-N 3.35Å; N431-F435 WeakPolarHBondContact O-CB 3.34Å; N431-F435 PolarHBondContact O-N 2.93Å
432	F	97.7	Very high	95.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-42.7	176.5	-170.4	-91.9	0	0	0	111.5	F402 I405 L422 L425 V426 N429 S434 F435 I436	F402-F432 HydrophobicContact CB-CD2 4.09Å; F402-F432 HydrophobicContact CB-CE2 4.1Å; F402-F432 AromaticContact CD1-CD2 3.8Å; F402-F432 HydrophobicContact CD1-CD2 3.8Å; F402-F432 HydrophobicContact CD1-CE2 4.35Å; F402-F432 HydrophobicContact CD2-CB 4.4Å; F402-F432 AromaticContact CD2-CD2 3.85Å; F402-F432 HydrophobicContact CD2-CD2 3.85Å; F402-F432 HydrophobicContact CE1-CD2 4.09Å; F402-F432 HydrophobicContact CE2-CB 4Å; F402-F432 HydrophobicContact CE2-CD2 4.17Å; F402-F432 AromaticContact CG-CD2 3.66Å; F402-F432 HydrophobicContact CG-CD2 3.66Å; F402-F432 HydrophobicContact CG-CE2 4.15Å; F402-F432 HydrophobicContact CZ-CB 4.15Å; F402-F432 HydrophobicContact CZ-CD2 4.27Å; I405-F432 HydrophobicContact CB-CE2 4.11Å; I405-F432 HydrophobicContact CD1-CE2 4.44Å; I405-F432 HydrophobicContact CG2-CE2 3.79Å; I405-F432 HydrophobicContact CG2-CZ 3.95Å; L422-F432 HydrophobicContact CD1-CE1 3.82Å; L422-F432 HydrophobicContact CD1-CZ 4.05Å; L425-F432 HydrophobicContact CB-CD1 3.66Å; L425-F432 HydrophobicContact CB-CE1 3.93Å; L425-F432 HydrophobicContact CB-CG 3.98Å; L425-F432 HydrophobicContact CB-CZ 4.48Å; L425-F432 HydrophobicContact CD1-CE2 4.45Å; L425-F432 HydrophobicContact CD1-CZ 4.46Å; V426-F432 HydrophobicContact CG2-CD1 4.07Å; V426-F432 HydrophobicContact CG2-CE1 3.79Å; N429-F432 HydrophobicContact CB-CB 3.96Å; N429-F432 PolarHBondContact O-N 3.26Å; N429-F432 PolarHBondContact OD1-N 3.33Å; F432-S434 PolarHBondContact O-N 3.37Å; F432-F435 PolarHBondContact O-N 2.7Å; F432-I436 HydrophobicContact CE1-CD1 4.18Å; F432-I436 PolarHBondContact O-N 3.47Å
433	H	97.1	Very high	95.3	Very high	53 Å²	53	45 Å²	45	25%	0.245	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-43.4	173.2	-178.4	-82.5	0	0	0	112.3	V426 N429 I436 M437	V426-H433 WeakPolarHBondContact O-CB 2.92Å; V426-H433 PolarHBondContact O-CD2 3.46Å; N429-H433 WeakPolarHBondContact O-CB 3.36Å; N429-H433 PolarHBondContact O-N 3.18Å; H433-I436 WeakPolarHBondContact O-CG2 3.39Å; H433-M437 VanDerWaalsContact O-CG 3.23Å; H433-M437 WeakPolarHBondContact O-CG 3.5Å; H433-M437 PolarHBondContact O-N 3.24Å
434	S	96.1	Very high	95.1	Very high	51 Å²	51	49.6 Å²	49.6	36%	0.357	24%	0.24	S	C	.	.	H	α-helix	trans	-65.1	-44.4	178.3	-59.8	0	0	0	0	111.2	T430 N431 F432 M437 Q438	T430-S434 WeakPolarHBondContact O-CB 3.32Å; T430-S434 PolarHBondContact O-N 3.24Å; T430-S434 PolarHBondContact O-OG 2.86Å; N431-S434 PolarHBondContact O-N 3.35Å; F432-S434 PolarHBondContact O-N 3.37Å; S434-M437 PolarHBondContact O-N 3.08Å; S434-Q438 VanDerWaalsContact O-CB 3.32Å; S434-Q438 WeakPolarHBondContact O-CB 3.5Å; S434-Q438 VanDerWaalsContact O-CG 3.27Å; S434-Q438 WeakPolarHBondContact O-CG 3.49Å; S434-Q438 PolarHBondContact O-N 2.97Å
435	F	96.5	Very high	95.1	Very high	23 Å²	23	48.5 Å²	48.5	10%	0.101	23%	0.234	C	C	.	.	H	α-helix	trans	-58.2	-53.4	175.2	163.9	-94.6	0	0	0	112.4	F402 N431 F432 M437 Q438 E439	F402-F435 HydrophobicContact CB-CD1 3.45Å; F402-F435 VanDerWaalsContact CB-CD1 3.45Å; F402-F435 HydrophobicContact CB-CD2 4.08Å; F402-F435 HydrophobicContact CB-CE1 3.4Å; F402-F435 VanDerWaalsContact CB-CE1 3.4Å; F402-F435 HydrophobicContact CB-CE2 4.02Å; F402-F435 HydrophobicContact CB-CG 3.82Å; F402-F435 HydrophobicContact CB-CZ 3.71Å; F402-F435 HydrophobicContact CD2-CB 3.65Å; F402-F435 AromaticContact CD2-CD1 3.89Å; F402-F435 HydrophobicContact CD2-CD1 3.89Å; F402-F435 HydrophobicContact CD2-CD2 4.26Å; F402-F435 AromaticContact CD2-CG 3.67Å; F402-F435 HydrophobicContact CD2-CG 3.67Å; F402-F435 HydrophobicContact CE2-CB 4.31Å; F402-F435 HydrophobicContact CG-CD1 4.15Å; F402-F435 HydrophobicContact CG-CG 4.27Å; N431-F435 WeakPolarHBondContact O-CB 3.34Å; N431-F435 PolarHBondContact O-N 2.93Å; F432-F435 PolarHBondContact O-N 2.7Å; F435-M437 PolarHBondContact O-N 3.01Å; F435-M437 VanDerWaalsContact O-N 3.14Å; F435-Q438 PolarHBondContact O-N 2.95Å; F435-E439 HydrophobicContact CD2-CB 4.1Å; F435-E439 HydrophobicContact CD2-CG 3.65Å; F435-E439 HydrophobicContact CE2-CB 3.92Å; F435-E439 HydrophobicContact CE2-CG 3.72Å; F435-E439 HydrophobicContact CZ-CB 4.4Å; F435-E439 WeakPolarHBondContact O-CB 3.41Å; F435-E439 PolarHBondContact O-N 3.07Å
436	I	96.4	Very high	95	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-29	-174.6	-161.6	171.1	0	0	0	111.6	V426 F432 H433 R440 G441 Y442 F474	V426-I436 HydrophobicContact CG2-CD1 4.15Å; F432-I436 HydrophobicContact CE1-CD1 4.18Å; F432-I436 PolarHBondContact O-N 3.47Å; H433-I436 WeakPolarHBondContact O-CG2 3.39Å; I436-R440 CarbonylContact O-C 3.13Å; I436-G441 PolarHBondContact O-N 3.03Å; I436-Y442 VanDerWaalsContact O-CD1 3.22Å; I436-Y442 WeakPolarHBondContact O-CD1 3.43Å; I436-Y442 PolarHBondContact O-N 3.04Å; I436-F474 HydrophobicContact CD1-CE1 4.06Å; I436-F474 HydrophobicContact CD1-CZ 3.84Å; I436-F474 HydrophobicContact CG2-CE1 4.49Å
437	M	96.5	Very high	94.8	Very high	18 Å²	18	50 Å²	50	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-80	-47.6	175.7	-67	-62.7	158.4	0	0	113.1	H433 S434 F435 Y442 F474 N477 F480	H433-M437 VanDerWaalsContact O-CG 3.23Å; H433-M437 WeakPolarHBondContact O-CG 3.5Å; H433-M437 PolarHBondContact O-N 3.24Å; S434-M437 PolarHBondContact O-N 3.08Å; F435-M437 PolarHBondContact O-N 3.01Å; F435-M437 VanDerWaalsContact O-N 3.14Å; M437-Y442 HydrophobicContact SD-CD1 4.23Å; M437-F474 HydrophobicContact CE-CB 4.09Å; M437-F474 HydrophobicContact CE-CD1 3.32Å; M437-F474 HydrophobicContact CE-CE1 4.05Å; M437-F474 HydrophobicContact CE-CG 4.01Å; M437-N477 HydrophobicContact CE-CB 4.49Å; M437-N477 HydrophobicContact SD-CB 3.74Å; M437-F480 HydrophobicContact SD-CB 4.39Å
438	Q	94.5	Very high	94.7	Very high	148 Å²	148	49 Å²	49	69%	0.692	24%	0.242	S	C	*	.	H	α-helix	trans	-73.8	-44.5	-174.9	-71.1	174.5	-2.4	0	0	112.1	S434 F435 R440	S434-Q438 VanDerWaalsContact O-CB 3.32Å; S434-Q438 WeakPolarHBondContact O-CB 3.5Å; S434-Q438 VanDerWaalsContact O-CG 3.27Å; S434-Q438 WeakPolarHBondContact O-CG 3.49Å; S434-Q438 PolarHBondContact O-N 2.97Å; F435-Q438 PolarHBondContact O-N 2.95Å; Q438-R440 PolarHBondContact O-N 3.5Å
439	E	93.4	Very high	94.8	Very high	135 Å²	135	44.7 Å²	44.7	63%	0.631	23%	0.225	S	C	*	.	S	Bend	trans	-85.3	7.7	179.2	-60.8	-57.1	142.2	0	0	112.7	F435 G441	F435-E439 HydrophobicContact CD2-CB 4.1Å; F435-E439 HydrophobicContact CD2-CG 3.65Å; F435-E439 HydrophobicContact CE2-CB 3.92Å; F435-E439 HydrophobicContact CE2-CG 3.72Å; F435-E439 HydrophobicContact CZ-CB 4.4Å; F435-E439 WeakPolarHBondContact O-CB 3.41Å; F435-E439 PolarHBondContact O-N 3.07Å; E439-G441 PolarHBondContact O-N 3.45Å; E439-G441 VanDerWaalsContact O-N 3.11Å
440	R	93.4	Very high	94.7	Very high	101 Å²	101	44.7 Å²	44.7	38%	0.381	23%	0.225	S	C	.	.			trans	52.5	32.2	-178	-56	-173.1	161.8	-179.7	-0.6	113.9	I436 Q438 Y442 E443 D483	I436-R440 CarbonylContact O-C 3.13Å; Q438-R440 PolarHBondContact O-N 3.5Å; R440-Y442 HydrophobicContact CB-CE1 4.17Å; R440-Y442 HydrophobicContact CB-CE2 4.38Å; R440-Y442 HydrophobicContact CG-CE1 4.27Å; R440-Y442 PolarHBondContact O-N 3.39Å; R440-E443 HydrophobicContact CB-CG 4.17Å; R440-E443 WeakPolarHBondContact O-CB 3.43Å; R440-E443 PolarHBondContact O-N 3.2Å; R440-D483 IonicContact CZ-OD2 2.71Å; R440-D483 VanDerWaalsContact CZ-OD2 3.26Å; R440-D483 IonicContact NE-OD2 2.82Å; R440-D483 PolarHBondContact NE-OD2 3.39Å; R440-D483 VanDerWaalsContact NE-OD2 3.1Å; R440-D483 IonicContact NH2-OD1 2.65Å; R440-D483 PolarHBondContact NH2-OD1 3.31Å; R440-D483 VanDerWaalsContact NH2-OD1 3.11Å; R440-D483 IonicContact NH2-OD2 2.89Å; R440-D483 PolarHBondContact NH2-OD2 2.82Å
441	G	92.7	Very high	94.5	Very high	10 Å²	10	41.8 Å²	41.8	10%	0.103	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.3	176.8	0	0	0	0	0	113.2	I436 E439 E443 K444	I436-G441 PolarHBondContact O-N 3.03Å; E439-G441 PolarHBondContact O-N 3.45Å; E439-G441 VanDerWaalsContact O-N 3.11Å; G441-E443 PolarHBondContact O-N 3.45Å; G441-K444 PolarHBondContact O-N 2.9Å
442	Y	94.6	Very high	94.4	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-23.1	172.7	59.6	-107.4	0	0	0	113.8	I436 M437 R440 K444 V445 L446 F480 D483	I436-Y442 VanDerWaalsContact O-CD1 3.22Å; I436-Y442 WeakPolarHBondContact O-CD1 3.43Å; I436-Y442 PolarHBondContact O-N 3.04Å; M437-Y442 HydrophobicContact SD-CD1 4.23Å; R440-Y442 HydrophobicContact CB-CE1 4.17Å; R440-Y442 HydrophobicContact CB-CE2 4.38Å; R440-Y442 HydrophobicContact CG-CE1 4.27Å; R440-Y442 PolarHBondContact O-N 3.39Å; Y442-K444 PolarHBondContact O-N 3.15Å; Y442-V445 PolarHBondContact O-N 3.29Å; Y442-L446 WeakPolarHBondContact O-CB 3.35Å; Y442-L446 PolarHBondContact O-N 2.74Å; Y442-F480 AromaticContact CD1-CD2 3.81Å; Y442-F480 HydrophobicContact CD1-CD2 3.81Å; Y442-F480 HydrophobicContact CD1-CE2 4.42Å; Y442-F480 AromaticContact CD2-CD2 3.59Å; Y442-F480 HydrophobicContact CD2-CD2 3.59Å; Y442-F480 AromaticContact CD2-CE2 3.59Å; Y442-F480 HydrophobicContact CD2-CE2 3.59Å; Y442-F480 AromaticContact CE1-CD2 3.89Å; Y442-F480 HydrophobicContact CE1-CD2 3.89Å; Y442-F480 AromaticContact CE2-CD2 3.69Å; Y442-F480 HydrophobicContact CE2-CD2 3.69Å; Y442-F480 HydrophobicContact CE2-CE2 4.03Å; Y442-F480 AromaticContact CG-CD2 3.68Å; Y442-F480 HydrophobicContact CG-CD2 3.68Å; Y442-F480 AromaticContact CG-CE2 3.83Å; Y442-F480 HydrophobicContact CG-CE2 3.83Å; Y442-F480 AromaticContact CZ-CD2 3.84Å; Y442-D483 WeakPolarHBondContact OH-CB 3.42Å; Y442-D483 PolarHBondContact OH-OD2 2.61Å
443	E	91.8	Very high	94.2	Very high	69 Å²	69	39.1 Å²	39.1	32%	0.322	19%	0.192	S	C	.	.	H	α-helix	trans	-63.8	-30.5	-178.6	-71.6	-172.5	165.9	0	0	112.6	R440 G441 P447	R440-E443 HydrophobicContact CB-CG 4.17Å; R440-E443 WeakPolarHBondContact O-CB 3.43Å; R440-E443 PolarHBondContact O-N 3.2Å; G441-E443 PolarHBondContact O-N 3.45Å; E443-P447 WeakPolarHBondContact O-CD 3.4Å; E443-P447 WeakPolarHBondContact O-CG 3.43Å
444	K	91.1	Very high	93.8	Very high	100 Å²	100	37.9 Å²	37.9	44%	0.435	19%	0.185	S	C	.	.	H	α-helix	trans	-79.7	-35.3	174.8	-66.5	-176.4	-177.6	178.3	0	112.3	D407 A410 G441 Y442 P448	D407-K444 WeakPolarHBondContact OD1-CD 3.13Å; D407-K444 WeakPolarHBondContact OD1-CE 3.46Å; D407-K444 IonicContact OD1-NZ 3.19Å; D407-K444 PolarHBondContact OD1-NZ 3.37Å; D407-K444 IonicContact OD2-NZ 3.58Å; D407-K444 PolarHBondContact OD2-NZ 3.01Å; A410-K444 HydrophobicContact CB-CB 4.07Å; A410-K444 WeakPolarHBondContact CB-O 3.4Å; G441-K444 PolarHBondContact O-N 2.9Å; Y442-K444 PolarHBondContact O-N 3.15Å; K444-P448 WeakPolarHBondContact O-CD 3.34Å; K444-P448 WeakPolarHBondContact O-CG 3.1Å
445	V	94.8	Very high	93.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-80.5	-34.7	-175.5	178.5	0	0	0	0	112	A410 L413 L422 Y442 P448 L449 F474	A410-V445 HydrophobicContact CB-CG2 4.49Å; L413-V445 HydrophobicContact CD1-CG1 4.1Å; L422-V445 HydrophobicContact CD2-CG1 3.65Å; L422-V445 HydrophobicContact CD2-CG2 4.48Å; Y442-V445 PolarHBondContact O-N 3.29Å; V445-P448 WeakPolarHBondContact O-CD 3.22Å; V445-P448 VanDerWaalsContact O-CG 3.28Å; V445-P448 WeakPolarHBondContact O-CG 3.45Å; V445-L449 HydrophobicContact CG1-CD1 3.69Å; V445-L449 HydrophobicContact CG1-CG 3.99Å; V445-L449 WeakPolarHBondContact O-CG 3.3Å; V445-L449 PolarHBondContact O-N 3.2Å; V445-L449 VanDerWaalsContact O-N 3.15Å; V445-F474 HydrophobicContact CG1-CE2 4.22Å; V445-F474 HydrophobicContact CG1-CZ 4.38Å
446	L	95	Very high	93.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-50.9	-175.2	-179.2	61.9	0	0	0	113.9	Y442 L449 L450 L471 F480 I484 Y505	Y442-L446 WeakPolarHBondContact O-CB 3.35Å; Y442-L446 PolarHBondContact O-N 2.74Å; L446-L449 WeakPolarHBondContact O-CB 3.35Å; L446-L449 PolarHBondContact O-N 2.94Å; L446-L450 HydrophobicContact CD1-CD1 4.03Å; L446-L450 HydrophobicContact CD1-CD2 4.27Å; L446-L450 HydrophobicContact CD1-CG 3.92Å; L446-L450 HydrophobicContact CG-CD1 3.99Å; L446-L450 HydrophobicContact CG-CG 4.29Å; L446-L450 WeakPolarHBondContact O-CG 3.47Å; L446-L450 PolarHBondContact O-N 3.15Å; L446-L471 HydrophobicContact CD1-CD1 3.65Å; L446-F480 HydrophobicContact CD2-CE2 4.45Å; L446-F480 HydrophobicContact CD2-CZ 4.43Å; L446-I484 HydrophobicContact CD2-CG2 3.98Å; L446-Y505 HydrophobicContact CD2-CD1 3.65Å; L446-Y505 HydrophobicContact CD2-CE1 4.5Å; L446-Y505 HydrophobicContact CD2-CG 3.92Å; L446-Y505 HydrophobicContact CG-CD1 4.08Å
447	P	92.4	Very high	92.6	Very high	33 Å²	33	45.7 Å²	45.7	21%	0.214	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-46.5	179	4.4	-10.5	0	0	0	115.1	E443 L450 N451 Y505	E443-P447 WeakPolarHBondContact O-CD 3.4Å; E443-P447 WeakPolarHBondContact O-CG 3.43Å; P447-L450 PolarHBondContact O-N 3.28Å; P447-N451 PolarHBondContact O-N 2.98Å; P447-Y505 HydrophobicContact CB-CE1 4.24Å; P447-Y505 HydrophobicContact CG-CE1 3.88Å
448	P	93.1	Very high	91.9	Very high	31 Å²	31	48.6 Å²	48.6	20%	0.201	24%	0.238	C	C	.	.	H	α-helix	trans	-68.1	-32.5	175.7	21	-28.4	0	0	0	113.4	A410 L413 K444 V445 N451 I452	A410-P448 HydrophobicContact CB-CG 4.34Å; A410-P448 WeakPolarHBondContact O-CG 3.43Å; L413-P448 HydrophobicContact CD1-CB 3.92Å; L413-P448 HydrophobicContact CD1-CG 3.85Å; K444-P448 WeakPolarHBondContact O-CD 3.34Å; K444-P448 WeakPolarHBondContact O-CG 3.1Å; V445-P448 WeakPolarHBondContact O-CD 3.22Å; V445-P448 VanDerWaalsContact O-CG 3.28Å; V445-P448 WeakPolarHBondContact O-CG 3.45Å; P448-N451 WeakPolarHBondContact O-CB 3.28Å; P448-N451 PolarHBondContact O-N 3.35Å; P448-I452 WeakPolarHBondContact O-CG1 3.3Å; P448-I452 PolarHBondContact O-N 2.9Å
449	L	95.4	Very high	91.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-47.7	169.7	-72.1	177	0	0	0	111.8	L413 V445 L446 N451 I452 L453 A467 L470 F474	L413-L449 HydrophobicContact CD1-CD2 3.73Å; L413-L449 HydrophobicContact CD1-CG 3.76Å; V445-L449 HydrophobicContact CG1-CD1 3.69Å; V445-L449 HydrophobicContact CG1-CG 3.99Å; V445-L449 WeakPolarHBondContact O-CG 3.3Å; V445-L449 PolarHBondContact O-N 3.2Å; V445-L449 VanDerWaalsContact O-N 3.15Å; L446-L449 WeakPolarHBondContact O-CB 3.35Å; L446-L449 PolarHBondContact O-N 2.94Å; L449-N451 VanDerWaalsContact C-N 3.26Å; L449-N451 PolarHBondContact O-N 3.06Å; L449-I452 WeakPolarHBondContact O-CB 3.45Å; L449-I452 PolarHBondContact O-N 3.28Å; L449-L453 WeakPolarHBondContact O-CG 3.4Å; L449-L453 PolarHBondContact O-N 3.3Å; L449-L453 VanDerWaalsContact O-N 3.1Å; L449-A467 HydrophobicContact CD2-CB 3.75Å; L449-L470 HydrophobicContact CD1-CB 4.1Å; L449-L470 HydrophobicContact CD2-CB 4.43Å; L449-L470 HydrophobicContact CD2-CD1 3.93Å; L449-F474 HydrophobicContact CD1-CE2 3.96Å
450	L	94.6	Very high	90.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-33.1	177.7	-66	178.5	0	0	0	112	L446 P447 L453 Y454 L471 W494 L508 T509 V512	L446-L450 HydrophobicContact CD1-CD1 4.03Å; L446-L450 HydrophobicContact CD1-CD2 4.27Å; L446-L450 HydrophobicContact CD1-CG 3.92Å; L446-L450 HydrophobicContact CG-CD1 3.99Å; L446-L450 HydrophobicContact CG-CG 4.29Å; L446-L450 WeakPolarHBondContact O-CG 3.47Å; L446-L450 PolarHBondContact O-N 3.15Å; P447-L450 PolarHBondContact O-N 3.28Å; L450-L453 PolarHBondContact O-N 3.05Å; L450-Y454 VanDerWaalsContact O-CB 3.25Å; L450-Y454 WeakPolarHBondContact O-CB 3.41Å; L450-Y454 PolarHBondContact O-N 3.09Å; L450-L471 HydrophobicContact CD2-CD2 4.45Å; L450-W494 HydrophobicContact CB-CH2 4.2Å; L450-W494 HydrophobicContact CB-CZ2 3.98Å; L450-L508 HydrophobicContact CD1-CB 4.43Å; L450-L508 HydrophobicContact CD1-CD2 3.86Å; L450-L508 HydrophobicContact CD1-CG 3.97Å; L450-T509 HydrophobicContact CD2-CG2 4.2Å; L450-V512 HydrophobicContact CD2-CB 4.38Å; L450-V512 HydrophobicContact CD2-CG1 4.42Å
451	N	91.9	Very high	90.5	Very high	39 Å²	39	39 Å²	39	21%	0.209	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-44.4	173.9	-170.8	26.2	0	0	0	111.8	P447 P448 L449 L453 Y454 K455 W494	P447-N451 PolarHBondContact O-N 2.98Å; P448-N451 WeakPolarHBondContact O-CB 3.28Å; P448-N451 PolarHBondContact O-N 3.35Å; L449-N451 VanDerWaalsContact C-N 3.26Å; L449-N451 PolarHBondContact O-N 3.06Å; N451-L453 VanDerWaalsContact C-N 3.33Å; N451-L453 PolarHBondContact O-N 3.42Å; N451-Y454 PolarHBondContact O-N 3.37Å; N451-K455 WeakPolarHBondContact O-CB 3.32Å; N451-K455 PolarHBondContact O-N 3.28Å; N451-K455 WeakPolarHBondContact OD1-CE 3.38Å; N451-W494 HydrophobicContact CB-CD2 4.06Å; N451-W494 HydrophobicContact CB-CG 4.15Å; N451-W494 HydrophobicContact CB-CZ2 4.13Å; N451-W494 WeakPolarHBondContact OD1-CB 3.48Å
452	I	92.9	Very high	90.3	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-57.8	-47.4	175.5	-71.3	166	0	0	0	110.3	L413 P448 L449 K455 S456 L463 A467	L413-I452 HydrophobicContact CB-CD1 3.97Å; L413-I452 WeakPolarHBondContact O-CD1 3.47Å; P448-I452 WeakPolarHBondContact O-CG1 3.3Å; P448-I452 PolarHBondContact O-N 2.9Å; L449-I452 WeakPolarHBondContact O-CB 3.45Å; L449-I452 PolarHBondContact O-N 3.28Å; I452-K455 CarbonylContact O-C 3.58Å; I452-K455 VanDerWaalsContact O-C 3.27Å; I452-K455 PolarHBondContact O-N 2.69Å; I452-S456 WeakPolarHBondContact O-CA 2.97Å; I452-S456 PolarHBondContact O-N 3.34Å; I452-L463 HydrophobicContact CD1-CD1 4.11Å; I452-L463 HydrophobicContact CD1-CD2 4.42Å; I452-L463 HydrophobicContact CD1-CG 4.27Å; I452-L463 HydrophobicContact CG1-CD2 4.45Å; I452-L463 HydrophobicContact CG2-CD2 4.25Å; I452-L463 HydrophobicContact CG2-CG 3.84Å; I452-A467 HydrophobicContact CB-CB 4.42Å; I452-A467 HydrophobicContact CG2-CB 3.98Å
453	L	93.2	Very high	90.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.6	-36.9	179.6	-62.5	180	0	0	0	112.6	L449 L450 N451 K455 S456 V464 A467 L468 L471 V512 L513 T516	L449-L453 WeakPolarHBondContact O-CG 3.4Å; L449-L453 PolarHBondContact O-N 3.3Å; L449-L453 VanDerWaalsContact O-N 3.1Å; L450-L453 PolarHBondContact O-N 3.05Å; N451-L453 VanDerWaalsContact C-N 3.33Å; N451-L453 PolarHBondContact O-N 3.42Å; L453-K455 VanDerWaalsContact C-N 3.32Å; L453-S456 WeakPolarHBondContact O-CB 3.22Å; L453-S456 PolarHBondContact O-N 3.29Å; L453-V464 HydrophobicContact CD2-CG1 3.92Å; L453-A467 HydrophobicContact CD2-CB 3.91Å; L453-A467 HydrophobicContact CG-CB 4.22Å; L453-L468 HydrophobicContact CD1-CD2 3.8Å; L453-L468 HydrophobicContact CD2-CD2 3.68Å; L453-L468 HydrophobicContact CD2-CG 3.7Å; L453-L468 HydrophobicContact CG-CD2 4.4Å; L453-L471 HydrophobicContact CD1-CD2 4.03Å; L453-V512 HydrophobicContact CB-CG1 3.55Å; L453-L513 HydrophobicContact CD1-CD2 4.04Å; L453-T516 PolarHBondContact O-OG1 2.91Å
454	Y	90.7	Very high	90.1	Very high	28 Å²	28	38.1 Å²	38.1	11%	0.11	20%	0.199	C	C	.	.	H	α-helix	trans	-66.3	-36.1	175.1	178.5	-98.1	0	0	0	112.2	L450 N451 W494	L450-Y454 VanDerWaalsContact O-CB 3.25Å; L450-Y454 WeakPolarHBondContact O-CB 3.41Å; L450-Y454 PolarHBondContact O-N 3.09Å; N451-Y454 PolarHBondContact O-N 3.37Å; Y454-W494 AromaticContact CD1-CE3 3.42Å; Y454-W494 HydrophobicContact CD1-CE3 3.42Å; Y454-W494 VanDerWaalsContact CD1-CE3 3.42Å; Y454-W494 AromaticContact CD1-CZ3 3.6Å; Y454-W494 HydrophobicContact CD1-CZ3 3.6Å; Y454-W494 HydrophobicContact CD2-CE3 4.24Å; Y454-W494 AromaticContact CD2-CZ3 3.59Å; Y454-W494 HydrophobicContact CD2-CZ3 3.59Å; Y454-W494 AromaticContact CE1-CE3 3.93Å; Y454-W494 HydrophobicContact CE1-CE3 3.93Å; Y454-W494 HydrophobicContact CE1-CZ3 4.26Å; Y454-W494 HydrophobicContact CE2-CZ3 4.23Å; Y454-W494 AromaticContact CG-CE3 3.62Å; Y454-W494 HydrophobicContact CG-CE3 3.62Å; Y454-W494 HydrophobicContact CG-CH2 4.21Å; Y454-W494 AromaticContact CG-CZ3 3.23Å; Y454-W494 HydrophobicContact CG-CZ3 3.23Å
455	K	89.4	Confident	90.2	Very high	76 Å²	76	35.9 Å²	35.9	33%	0.33	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	24.5	176.9	-67.4	-168.7	-178.5	-173.9	0	112.7	N451 I452 L453 Q457 S458 H459	N451-K455 WeakPolarHBondContact O-CB 3.32Å; N451-K455 PolarHBondContact O-N 3.28Å; N451-K455 WeakPolarHBondContact OD1-CE 3.38Å; I452-K455 CarbonylContact O-C 3.58Å; I452-K455 VanDerWaalsContact O-C 3.27Å; I452-K455 PolarHBondContact O-N 2.69Å; L453-K455 VanDerWaalsContact C-N 3.32Å; K455-Q457 PolarHBondContact O-N 2.74Å; K455-S458 PolarHBondContact O-N 3.3Å; K455-S458 PolarHBondContact O-OG 3.06Å; K455-H459 PolarHBondContact O-CD2 2.92Å; K455-H459 VanDerWaalsContact O-CD2 3.25Å; K455-H459 PolarHBondContact O-N 2.96Å
456	S	88.2	Confident	90.1	Very high	5 Å²	5	36.5 Å²	36.5	4%	0.035	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-53.6	-33.3	-172.6	64.1	0	0	0	0	113.6	I452 L453 S458 H459 H520	I452-S456 WeakPolarHBondContact O-CA 2.97Å; I452-S456 PolarHBondContact O-N 3.34Å; L453-S456 WeakPolarHBondContact O-CB 3.22Å; L453-S456 PolarHBondContact O-N 3.29Å; S456-S458 VanDerWaalsContact C-N 3.28Å; S456-S458 PolarHBondContact O-N 3.32Å; S456-H459 PolarHBondContact O-N 3.41Å; S456-H520 PolarHBondContact OG-CE1 3.36Å; S456-H520 PolarHBondContact OG-NE2 2.9Å
457	Q	84.6	Confident	90.2	Very high	156 Å²	156	36.5 Å²	36.5	73%	0.729	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-62.9	-27.9	177.1	67.3	179.2	8.5	0	0	114.9	K455	K455-Q457 PolarHBondContact O-N 2.74Å
458	S	81.9	Confident	90.3	Very high	80 Å²	80	35 Å²	35	56%	0.559	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-99.4	-1.5	-178.4	52.7	0	0	0	0	112.7	K455 S456	K455-S458 PolarHBondContact O-N 3.3Å; K455-S458 PolarHBondContact O-OG 3.06Å; S456-S458 VanDerWaalsContact C-N 3.28Å; S456-S458 PolarHBondContact O-N 3.32Å
459	H	83	Confident	90.5	Very high	56 Å²	56	34.7 Å²	34.7	26%	0.259	18%	0.179	S	C	.	.	S	Bend	trans	-110.9	158.3	179.8	-71.1	-56.6	0	0	0	110.7	K455 S456 L463 V464	K455-H459 PolarHBondContact O-CD2 2.92Å; K455-H459 VanDerWaalsContact O-CD2 3.25Å; K455-H459 PolarHBondContact O-N 2.96Å; S456-H459 PolarHBondContact O-N 3.41Å; H459-L463 HydrophobicContact CB-CD2 4.12Å; H459-V464 HydrophobicContact CB-CG2 4.35Å
460	N	83.1	Confident	90.6	Very high	68 Å²	68	34.7 Å²	34.7	36%	0.364	18%	0.179	S	C	.	.			trans	-67	145.5	171.8	-173.7	1.3	0	0	0	110.3	H462 L463 V464	N460-H462 VanDerWaalsContact C-N 3.26Å; N460-H462 PolarHBondContact O-N 2.95Å; N460-L463 WeakPolarHBondContact O-CB 3.33Å; N460-L463 PolarHBondContact O-N 2.97Å; N460-V464 PolarHBondContact O-N 2.77Å
461	S	86.3	Confident	90.7	Very high	58 Å²	58	34.7 Å²	34.7	41%	0.406	18%	0.179	S	C	.	.	H	α-helix	trans	-54.3	-40.5	178.2	56.5	0	0	0	0	112.4	L463 V464 Y465	S461-L463 VanDerWaalsContact C-N 3.32Å; S461-L463 PolarHBondContact O-N 3.47Å; S461-V464 WeakPolarHBondContact O-CB 3.48Å; S461-V464 PolarHBondContact O-N 3.41Å; S461-V464 VanDerWaalsContact O-N 3.11Å; S461-Y465 WeakPolarHBondContact O-CD2 3.34Å; S461-Y465 PolarHBondContact O-N 3Å
462	H	87.9	Confident	91	Very high	55 Å²	55	33.2 Å²	33.2	26%	0.255	17%	0.17	S	C	.	.	H	α-helix	trans	-57.8	-41.3	176.8	-61.7	-58.1	0	0	0	113.5	N460 V464 Y465 M466 F726 Y730	N460-H462 VanDerWaalsContact C-N 3.26Å; N460-H462 PolarHBondContact O-N 2.95Å; H462-V464 VanDerWaalsContact C-N 3.33Å; H462-Y465 PolarHBondContact O-N 3.37Å; H462-M466 WeakPolarHBondContact O-CG 3.35Å; H462-M466 PolarHBondContact O-N 3.15Å; H462-F726 AromaticContact CE1-CE2 3.79Å; H462-F726 AromaticContact CE1-CZ 3.65Å; H462-F726 AromaticContact ND1-CZ 3.48Å; H462-F726 WeakPolarHBondContact ND1-CZ 3.37Å; H462-Y730 HydrophobicContact CB-CD2 4.37Å; H462-Y730 HydrophobicContact CB-CE2 3.48Å; H462-Y730 VanDerWaalsContact CB-CE2 3.48Å; H462-Y730 AromaticContact CD2-CD2 3.95Å; H462-Y730 AromaticContact CD2-CE2 3.57Å; H462-Y730 AromaticContact CG-CD2 3.95Å; H462-Y730 AromaticContact CG-CE2 3.47Å; H462-Y730 VanDerWaalsContact CG-CE2 3.47Å
463	L	90.9	Very high	91.3	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-39.6	177.8	-177.6	60.1	0	0	0	111.2	L413 P419 I452 H459 N460 S461 M466 A467	L413-L463 WeakPolarHBondContact O-CD1 3.19Å; P419-L463 HydrophobicContact CB-CD1 4.39Å; P419-L463 HydrophobicContact CG-CD1 3.58Å; I452-L463 HydrophobicContact CD1-CD1 4.11Å; I452-L463 HydrophobicContact CD1-CD2 4.42Å; I452-L463 HydrophobicContact CD1-CG 4.27Å; I452-L463 HydrophobicContact CG1-CD2 4.45Å; I452-L463 HydrophobicContact CG2-CD2 4.25Å; I452-L463 HydrophobicContact CG2-CG 3.84Å; H459-L463 HydrophobicContact CB-CD2 4.12Å; N460-L463 WeakPolarHBondContact O-CB 3.33Å; N460-L463 PolarHBondContact O-N 2.97Å; S461-L463 VanDerWaalsContact C-N 3.32Å; S461-L463 PolarHBondContact O-N 3.47Å; L463-M466 HydrophobicContact CD1-CE 4.23Å; L463-A467 WeakPolarHBondContact O-CB 3.44Å; L463-A467 PolarHBondContact O-N 3.15Å; L463-A467 VanDerWaalsContact O-N 3.09Å
464	V	92.1	Very high	91.5	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.024	17%	0.17	C	C	.	.	H	α-helix	trans	-62.8	-45	175	178.6	0	0	0	0	110.8	L453 H459 N460 S461 H462 A467 L468 L529	L453-V464 HydrophobicContact CD2-CG1 3.92Å; H459-V464 HydrophobicContact CB-CG2 4.35Å; N460-V464 PolarHBondContact O-N 2.77Å; S461-V464 WeakPolarHBondContact O-CB 3.48Å; S461-V464 PolarHBondContact O-N 3.41Å; S461-V464 VanDerWaalsContact O-N 3.11Å; H462-V464 VanDerWaalsContact C-N 3.33Å; V464-A467 PolarHBondContact O-N 2.92Å; V464-L468 HydrophobicContact CG1-CD1 4.38Å; V464-L468 WeakPolarHBondContact O-CG 3.41Å; V464-L468 PolarHBondContact O-N 2.58Å; V464-L529 HydrophobicContact CG1-CD1 3.83Å
465	Y	92.5	Very high	91.8	Very high	53 Å²	53	32 Å²	32	21%	0.208	17%	0.166	C	C	.	.	H	α-helix	trans	-63.5	-45.8	177.7	-64.9	-55.8	0	0	0	112.8	S461 H462 A467 L468 I469 D526 L529	S461-Y465 WeakPolarHBondContact O-CD2 3.34Å; S461-Y465 PolarHBondContact O-N 3Å; H462-Y465 PolarHBondContact O-N 3.37Å; Y465-A467 PolarHBondContact O-N 3.37Å; Y465-L468 PolarHBondContact O-N 2.92Å; Y465-L468 VanDerWaalsContact O-N 3.12Å; Y465-I469 VanDerWaalsContact O-CG1 3.31Å; Y465-I469 WeakPolarHBondContact O-CG1 3.47Å; Y465-I469 PolarHBondContact O-N 3.35Å; Y465-D526 PolarHBondContact OH-OD1 3.16Å; Y465-D526 PolarHBondContact OH-OD2 3.06Å; Y465-L529 HydrophobicContact CD1-CD1 4.49Å; Y465-L529 HydrophobicContact CE1-CB 3.86Å; Y465-L529 HydrophobicContact CE1-CD1 4.24Å
466	M	93.8	Very high	92.2	Very high	14 Å²	14	31.4 Å²	31.4	7%	0.069	16%	0.164	C	C	.	.	H	α-helix	trans	-59.7	-39.7	177.6	-71	-175.9	-69.5	0	0	111.3	P419 L420 H462 L463 I469 L470 Y730	P419-M466 HydrophobicContact CB-CB 4.27Å; P419-M466 HydrophobicContact CB-CE 4.42Å; P419-M466 HydrophobicContact CB-SD 4.41Å; P419-M466 HydrophobicContact CG-CE 3.82Å; P419-M466 HydrophobicContact CG-SD 4.3Å; L420-M466 HydrophobicContact CB-SD 3.81Å; L420-M466 HydrophobicContact CD1-SD 4.1Å; H462-M466 WeakPolarHBondContact O-CG 3.35Å; H462-M466 PolarHBondContact O-N 3.15Å; L463-M466 HydrophobicContact CD1-CE 4.23Å; M466-I469 PolarHBondContact O-N 3.13Å; M466-L470 WeakPolarHBondContact O-CB 3.24Å; M466-L470 WeakPolarHBondContact O-CG 3.34Å; M466-L470 PolarHBondContact O-N 3.25Å; M466-Y730 HydrophobicContact CE-CE1 4.11Å; M466-Y730 WeakPolarHBondContact CE-OH 3.34Å; M466-Y730 HydrophobicContact SD-CE1 4.09Å
467	A	95.7	Very high	92.6	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-39.3	176.1	0	0	0	0	0	112.7	L449 I452 L453 L463 V464 Y465 L471	L449-A467 HydrophobicContact CD2-CB 3.75Å; I452-A467 HydrophobicContact CB-CB 4.42Å; I452-A467 HydrophobicContact CG2-CB 3.98Å; L453-A467 HydrophobicContact CD2-CB 3.91Å; L453-A467 HydrophobicContact CG-CB 4.22Å; L463-A467 WeakPolarHBondContact O-CB 3.44Å; L463-A467 PolarHBondContact O-N 3.15Å; L463-A467 VanDerWaalsContact O-N 3.09Å; V464-A467 PolarHBondContact O-N 2.92Å; Y465-A467 PolarHBondContact O-N 3.37Å; A467-L471 WeakPolarHBondContact O-CB 3.42Å; A467-L471 PolarHBondContact O-N 2.87Å; A467-L471 VanDerWaalsContact O-N 3.07Å
468	L	96.3	Very high	93.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-42.4	174.5	-71.9	175.7	0	0	0	112.6	L453 V464 Y465 L471 L472 L513 L529 N532 I533	L453-L468 HydrophobicContact CD1-CD2 3.8Å; L453-L468 HydrophobicContact CD2-CD2 3.68Å; L453-L468 HydrophobicContact CD2-CG 3.7Å; L453-L468 HydrophobicContact CG-CD2 4.4Å; V464-L468 HydrophobicContact CG1-CD1 4.38Å; V464-L468 WeakPolarHBondContact O-CG 3.41Å; V464-L468 PolarHBondContact O-N 2.58Å; Y465-L468 PolarHBondContact O-N 2.92Å; Y465-L468 VanDerWaalsContact O-N 3.12Å; L468-L471 PolarHBondContact O-N 2.89Å; L468-L472 WeakPolarHBondContact O-CB 3.4Å; L468-L472 PolarHBondContact O-N 3.44Å; L468-L513 HydrophobicContact CD2-CD2 3.8Å; L468-L529 HydrophobicContact CD1-CD1 3.5Å; L468-L529 HydrophobicContact CD1-CG 4.27Å; L468-N532 HydrophobicContact CB-CB 4.19Å; L468-N532 HydrophobicContact CD1-CB 4.4Å; L468-I533 HydrophobicContact CD1-CD1 4.29Å; L468-I533 HydrophobicContact CD1-CG1 3.83Å; L468-I533 HydrophobicContact CD2-CD1 4.47Å; L468-I533 HydrophobicContact CD2-CG1 3.58Å; L468-I533 HydrophobicContact CG-CG1 4.37Å
469	I	95.5	Very high	93.8	Very high	26 Å²	26	29.9 Å²	29.9	13%	0.133	15%	0.15	C	C	.	.	H	α-helix	trans	-63.7	-46.7	179	-69.4	165.2	0	0	0	110.2	Y423 Y465 M466 L471 L472 I473 Y717	Y423-I469 HydrophobicContact CD2-CG2 3.74Å; Y423-I469 HydrophobicContact CE2-CG2 3.61Å; Y465-I469 VanDerWaalsContact O-CG1 3.31Å; Y465-I469 WeakPolarHBondContact O-CG1 3.47Å; Y465-I469 PolarHBondContact O-N 3.35Å; M466-I469 PolarHBondContact O-N 3.13Å; I469-L471 VanDerWaalsContact C-N 3.31Å; I469-L471 PolarHBondContact O-N 3.01Å; I469-L472 PolarHBondContact O-N 2.8Å; I469-I473 HydrophobicContact CG2-CD1 3.86Å; I469-I473 HydrophobicContact CG2-CG1 4.46Å; I469-I473 VanDerWaalsContact O-CG1 3.3Å; I469-I473 WeakPolarHBondContact O-CG1 3.3Å; I469-I473 PolarHBondContact O-N 3.13Å; I469-Y717 HydrophobicContact CB-CE2 4.27Å; I469-Y717 HydrophobicContact CD1-CE2 4.02Å; I469-Y717 HydrophobicContact CG1-CD2 4.31Å; I469-Y717 HydrophobicContact CG1-CE2 3.77Å; I469-Y717 HydrophobicContact CG2-CD1 4.19Å; I469-Y717 HydrophobicContact CG2-CD2 3.83Å; I469-Y717 HydrophobicContact CG2-CE1 3.92Å; I469-Y717 HydrophobicContact CG2-CE2 3.56Å; I469-Y717 HydrophobicContact CG2-CG 4.14Å
470	L	97.9	Very high	94.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57.7	-45.6	175.1	-77.2	168	0	0	0	111.5	P419 L422 V426 L449 M466 I473 F474	P419-L470 HydrophobicContact CB-CD1 4.43Å; L422-L470 HydrophobicContact CD2-CD1 3.92Å; L422-L470 HydrophobicContact CD2-CD2 4.3Å; L422-L470 HydrophobicContact CG-CD1 4.33Å; L422-L470 HydrophobicContact CG-CD2 4.05Å; V426-L470 HydrophobicContact CB-CD2 4.11Å; V426-L470 HydrophobicContact CG1-CD2 4.33Å; V426-L470 HydrophobicContact CG2-CD2 4.11Å; L449-L470 HydrophobicContact CD1-CB 4.1Å; L449-L470 HydrophobicContact CD2-CB 4.43Å; L449-L470 HydrophobicContact CD2-CD1 3.93Å; M466-L470 WeakPolarHBondContact O-CB 3.24Å; M466-L470 WeakPolarHBondContact O-CG 3.34Å; M466-L470 PolarHBondContact O-N 3.25Å; L470-I473 PolarHBondContact O-N 3.47Å; L470-F474 WeakPolarHBondContact O-CD1 3.41Å; L470-F474 WeakPolarHBondContact O-CD2 3.41Å; L470-F474 WeakPolarHBondContact O-CG 3.27Å; L470-F474 PolarHBondContact O-N 3.41Å
471	L	97.9	Very high	95.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.6	-41.6	177.5	-173.5	62.7	0	0	0	111.9	L446 L450 L453 A467 L468 I469 F474 T475 F480 T509 L513 T536	L446-L471 HydrophobicContact CD1-CD1 3.65Å; L450-L471 HydrophobicContact CD2-CD2 4.45Å; L453-L471 HydrophobicContact CD1-CD2 4.03Å; A467-L471 WeakPolarHBondContact O-CB 3.42Å; A467-L471 PolarHBondContact O-N 2.87Å; A467-L471 VanDerWaalsContact O-N 3.07Å; L468-L471 PolarHBondContact O-N 2.89Å; I469-L471 VanDerWaalsContact C-N 3.31Å; I469-L471 PolarHBondContact O-N 3.01Å; L471-F474 PolarHBondContact O-N 3.41Å; L471-T475 WeakPolarHBondContact O-CG2 3.36Å; L471-T475 PolarHBondContact O-N 3.43Å; L471-F480 HydrophobicContact CD1-CZ 4.42Å; L471-T509 HydrophobicContact CD1-CG2 4.32Å; L471-T509 HydrophobicContact CD2-CG2 3.99Å; L471-L513 HydrophobicContact CD2-CD1 4.22Å; L471-L513 HydrophobicContact CD2-CD2 3.96Å; L471-L513 HydrophobicContact CD2-CG 4.4Å; L471-T536 HydrophobicContact CD2-CG2 3.8Å; L471-T536 HydrophobicContact CG-CG2 3.7Å
472	L	98	Very high	95.5	Very high	7 Å²	7	26.5 Å²	26.5	4%	0.037	12%	0.121	C	C	.	.	H	α-helix	trans	-60.2	-49.1	176.8	177.4	59.2	0	0	0	110.8	L468 I469 F474 T475 E476 N532 A535 Y717	L468-L472 WeakPolarHBondContact O-CB 3.4Å; L468-L472 PolarHBondContact O-N 3.44Å; I469-L472 PolarHBondContact O-N 2.8Å; L472-F474 VanDerWaalsContact C-N 3.26Å; L472-F474 PolarHBondContact O-N 3.35Å; L472-T475 PolarHBondContact O-N 2.64Å; L472-T475 PolarHBondContact O-OG1 3.33Å; L472-E476 PolarHBondContact O-N 3.03Å; L472-N532 VanDerWaalsContact CD2-OD1 3.27Å; L472-N532 WeakPolarHBondContact CD2-OD1 3.45Å; L472-A535 HydrophobicContact CD1-CB 3.7Å; L472-A535 HydrophobicContact CD2-CB 4.41Å; L472-Y717 HydrophobicContact CD2-CD2 4.26Å
473	I	97.8	Very high	95.9	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-56.9	-43	176.2	-65.5	164.2	0	0	0	110.3	Y423 V426 H427 I469 L470 T475 E476 Y717	Y423-I473 HydrophobicContact CD2-CD1 4.41Å; Y423-I473 HydrophobicContact CE2-CD1 4.39Å; V426-I473 HydrophobicContact CG1-CB 4.42Å; V426-I473 HydrophobicContact CG1-CD1 4.46Å; V426-I473 HydrophobicContact CG1-CG2 3.74Å; H427-I473 HydrophobicContact CB-CD1 4.06Å; I469-I473 HydrophobicContact CG2-CD1 3.86Å; I469-I473 HydrophobicContact CG2-CG1 4.46Å; I469-I473 VanDerWaalsContact O-CG1 3.3Å; I469-I473 WeakPolarHBondContact O-CG1 3.3Å; I469-I473 PolarHBondContact O-N 3.13Å; L470-I473 PolarHBondContact O-N 3.47Å; I473-T475 VanDerWaalsContact C-N 3.31Å; I473-T475 PolarHBondContact O-N 3.19Å; I473-E476 WeakPolarHBondContact O-CB 3.29Å; I473-E476 PolarHBondContact O-N 2.9Å; I473-Y717 HydrophobicContact CD1-CD1 3.98Å; I473-Y717 HydrophobicContact CD1-CG 4.4Å; I473-Y717 HydrophobicContact CG1-CD1 4.05Å; I473-Y717 HydrophobicContact CG1-CG 4.06Å
474	F	98.2	Very high	96.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.4	-37.9	177	-62.5	-16.6	0	0	0	112.8	V426 I436 M437 V445 L449 L470 L471 L472 E476 N477 F480	V426-F474 HydrophobicContact CG1-CD1 4.31Å; V426-F474 HydrophobicContact CG1-CE1 3.75Å; V426-F474 HydrophobicContact CG2-CE1 4.11Å; V426-F474 HydrophobicContact CG2-CZ 4.47Å; I436-F474 HydrophobicContact CD1-CE1 4.06Å; I436-F474 HydrophobicContact CD1-CZ 3.84Å; I436-F474 HydrophobicContact CG2-CE1 4.49Å; M437-F474 HydrophobicContact CE-CB 4.09Å; M437-F474 HydrophobicContact CE-CD1 3.32Å; M437-F474 HydrophobicContact CE-CE1 4.05Å; M437-F474 HydrophobicContact CE-CG 4.01Å; V445-F474 HydrophobicContact CG1-CE2 4.22Å; V445-F474 HydrophobicContact CG1-CZ 4.38Å; L449-F474 HydrophobicContact CD1-CE2 3.96Å; L470-F474 WeakPolarHBondContact O-CD1 3.41Å; L470-F474 WeakPolarHBondContact O-CD2 3.41Å; L470-F474 WeakPolarHBondContact O-CG 3.27Å; L470-F474 PolarHBondContact O-N 3.41Å; L471-F474 PolarHBondContact O-N 3.41Å; L472-F474 VanDerWaalsContact C-N 3.26Å; L472-F474 PolarHBondContact O-N 3.35Å; F474-E476 PolarHBondContact O-N 2.87Å; F474-N477 PolarHBondContact O-N 3.06Å; F474-F480 HydrophobicContact CB-CD1 4.13Å; F474-F480 HydrophobicContact CB-CD2 4.29Å; F474-F480 HydrophobicContact CB-CE1 3.88Å; F474-F480 HydrophobicContact CB-CE2 4.05Å; F474-F480 HydrophobicContact CB-CG 4.33Å; F474-F480 HydrophobicContact CB-CZ 3.84Å; F474-F480 HydrophobicContact CD2-CE2 4.49Å; F474-F480 WeakPolarHBondContact O-CD1 3.42Å; F474-F480 WeakPolarHBondContact O-CG 3.24Å
475	T	97.9	Very high	96.3	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.018	11%	0.111	C	C	.	.	H	α-helix	trans	-70.6	-13.9	178	64	0	0	0	0	115	L471 L472 I473 N477 F480 T536 N539 L540	L471-T475 WeakPolarHBondContact O-CG2 3.36Å; L471-T475 PolarHBondContact O-N 3.43Å; L472-T475 PolarHBondContact O-N 2.64Å; L472-T475 PolarHBondContact O-OG1 3.33Å; I473-T475 VanDerWaalsContact C-N 3.31Å; I473-T475 PolarHBondContact O-N 3.19Å; T475-N477 PolarHBondContact O-N 2.97Å; T475-F480 HydrophobicContact CG2-CD1 4.48Å; T475-F480 HydrophobicContact CG2-CE1 3.95Å; T475-T536 HydrophobicContact CG2-CG2 3.61Å; T475-N539 WeakPolarHBondContact OG1-CB 3.48Å; T475-N539 PolarHBondContact OG1-ND2 2.99Å; T475-N539 VanDerWaalsContact OG1-ND2 3.11Å; T475-L540 HydrophobicContact CG2-CD1 4.11Å; T475-L540 HydrophobicContact CG2-CD2 3.79Å; T475-L540 HydrophobicContact CG2-CG 3.71Å
476	E	96.8	Very high	96.2	Very high	64 Å²	64	26.4 Å²	26.4	30%	0.299	13%	0.129	S	C	.	.	H	α-helix	trans	-63.2	-28	170.6	-62	-177.2	-154.4	0	0	111.5	L472 I473 F474 E478 K716 Y717	L472-E476 PolarHBondContact O-N 3.03Å; I473-E476 WeakPolarHBondContact O-CB 3.29Å; I473-E476 PolarHBondContact O-N 2.9Å; F474-E476 PolarHBondContact O-N 2.87Å; E476-E478 PolarHBondContact O-N 3.01Å; E476-K716 WeakPolarHBondContact OE2-CG 3.5Å; E476-Y717 WeakPolarHBondContact OE1-CB 3.48Å; E476-Y717 PolarHBondContact OE1-N 3.26Å
477	N	96.7	Very high	95.8	Very high	49 Å²	49	26.9 Å²	26.9	26%	0.262	13%	0.134	S	C	.	.	S	Bend	trans	-80.9	117.2	177.4	-172.4	-63.3	0	0	0	111.3	M437 F474 T475 Q479 F480 G481	M437-N477 HydrophobicContact CE-CB 4.49Å; M437-N477 HydrophobicContact SD-CB 3.74Å; F474-N477 PolarHBondContact O-N 3.06Å; T475-N477 PolarHBondContact O-N 2.97Å; N477-Q479 VanDerWaalsContact C-N 3.28Å; N477-Q479 PolarHBondContact O-N 3.28Å; N477-Q479 WeakPolarHBondContact OD1-CA 3.34Å; N477-Q479 VanDerWaalsContact OD1-CB 3.27Å; N477-Q479 WeakPolarHBondContact OD1-CB 3.31Å; N477-Q479 PolarHBondContact OD1-N 2.71Å; N477-F480 HydrophobicContact CB-CB 4.02Å; N477-F480 WeakPolarHBondContact O-CB 3.43Å; N477-F480 PolarHBondContact O-N 3.05Å; N477-F480 PolarHBondContact OD1-N 2.73Å; N477-G481 PolarHBondContact O-N 2.85Å
478	E	95.3	Very high	95	Very high	77 Å²	77	32.5 Å²	32.5	36%	0.36	16%	0.164	S	C	.	.	H	α-helix	trans	-66.1	-28.2	-177.7	-54.9	-156.7	160.2	0	0	114	E476 R482 R543 K714	E476-E478 PolarHBondContact O-N 3.01Å; E478-R482 PolarHBondContact O-N 3.22Å; E478-R482 PolarHBondContact O-NH1 3.17Å; E478-R543 VanDerWaalsContact CB-NH2 3.34Å; E478-R543 WeakPolarHBondContact O-CD 3.46Å; E478-R543 PolarHBondContact O-NE 3.22Å; E478-R543 VanDerWaalsContact O-NE 3.07Å; E478-R543 IonicContact OE1-NH2 2.81Å; E478-R543 PolarHBondContact OE1-NH2 3.32Å; E478-R543 IonicContact OE2-CZ 2.71Å; E478-R543 IonicContact OE2-NH2 3.62Å; E478-R543 PolarHBondContact OE2-NH2 3.36Å; E478-K714 IonicContact OE1-NZ 2.97Å; E478-K714 PolarHBondContact OE1-NZ 3.23Å
479	Q	95.8	Very high	94.2	Very high	84 Å²	84	33.3 Å²	33.3	39%	0.393	17%	0.168	S	C	.	.	H	α-helix	trans	-74.7	-42.9	177.7	-173.8	61	33	0	0	111.1	N477 G481 R482 D483	N477-Q479 VanDerWaalsContact C-N 3.28Å; N477-Q479 PolarHBondContact O-N 3.28Å; N477-Q479 WeakPolarHBondContact OD1-CA 3.34Å; N477-Q479 VanDerWaalsContact OD1-CB 3.27Å; N477-Q479 WeakPolarHBondContact OD1-CB 3.31Å; N477-Q479 PolarHBondContact OD1-N 2.71Å; Q479-G481 VanDerWaalsContact C-N 3.27Å; Q479-G481 PolarHBondContact O-N 2.85Å; Q479-R482 PolarHBondContact O-N 2.71Å; Q479-D483 PolarHBondContact NE2-OD1 3.11Å; Q479-D483 PolarHBondContact O-N 3.2Å
480	F	97.2	Very high	92.9	Very high	1 Å²	1	41 Å²	41	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-51.7	-49	171.8	167.7	-95.2	0	0	0	110.9	M437 Y442 L446 L471 F474 T475 N477 R482 D483 I484 L540	M437-F480 HydrophobicContact SD-CB 4.39Å; Y442-F480 AromaticContact CD1-CD2 3.81Å; Y442-F480 HydrophobicContact CD1-CD2 3.81Å; Y442-F480 HydrophobicContact CD1-CE2 4.42Å; Y442-F480 AromaticContact CD2-CD2 3.59Å; Y442-F480 HydrophobicContact CD2-CD2 3.59Å; Y442-F480 AromaticContact CD2-CE2 3.59Å; Y442-F480 HydrophobicContact CD2-CE2 3.59Å; Y442-F480 AromaticContact CE1-CD2 3.89Å; Y442-F480 HydrophobicContact CE1-CD2 3.89Å; Y442-F480 AromaticContact CE2-CD2 3.69Å; Y442-F480 HydrophobicContact CE2-CD2 3.69Å; Y442-F480 HydrophobicContact CE2-CE2 4.03Å; Y442-F480 AromaticContact CG-CD2 3.68Å; Y442-F480 HydrophobicContact CG-CD2 3.68Å; Y442-F480 AromaticContact CG-CE2 3.83Å; Y442-F480 HydrophobicContact CG-CE2 3.83Å; Y442-F480 AromaticContact CZ-CD2 3.84Å; L446-F480 HydrophobicContact CD2-CE2 4.45Å; L446-F480 HydrophobicContact CD2-CZ 4.43Å; L471-F480 HydrophobicContact CD1-CZ 4.42Å; F474-F480 HydrophobicContact CB-CD1 4.13Å; F474-F480 HydrophobicContact CB-CD2 4.29Å; F474-F480 HydrophobicContact CB-CE1 3.88Å; F474-F480 HydrophobicContact CB-CE2 4.05Å; F474-F480 HydrophobicContact CB-CG 4.33Å; F474-F480 HydrophobicContact CB-CZ 3.84Å; F474-F480 HydrophobicContact CD2-CE2 4.49Å; F474-F480 WeakPolarHBondContact O-CD1 3.42Å; F474-F480 WeakPolarHBondContact O-CG 3.24Å; T475-F480 HydrophobicContact CG2-CD1 4.48Å; T475-F480 HydrophobicContact CG2-CE1 3.95Å; N477-F480 HydrophobicContact CB-CB 4.02Å; N477-F480 WeakPolarHBondContact O-CB 3.43Å; N477-F480 PolarHBondContact O-N 3.05Å; N477-F480 PolarHBondContact OD1-N 2.73Å; F480-R482 PolarHBondContact O-N 2.79Å; F480-R482 VanDerWaalsContact O-N 3.16Å; F480-D483 PolarHBondContact O-N 2.89Å; F480-D483 VanDerWaalsContact O-N 3.15Å; F480-I484 HydrophobicContact CD2-CG2 3.92Å; F480-I484 HydrophobicContact CE1-CD1 4.05Å; F480-I484 HydrophobicContact CE1-CG2 4.22Å; F480-I484 HydrophobicContact CE2-CG2 3.52Å; F480-I484 HydrophobicContact CG-CG2 4.43Å; F480-I484 HydrophobicContact CZ-CD1 4.27Å; F480-I484 HydrophobicContact CZ-CG2 3.69Å; F480-I484 WeakPolarHBondContact O-CG2 3.48Å; F480-I484 PolarHBondContact O-N 3.33Å; F480-I484 VanDerWaalsContact O-N 3.13Å; F480-L540 HydrophobicContact CE1-CD2 4.5Å
481	G	96.2	Very high	91.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-24.3	179.2	0	0	0	0	0	114.3	N477 Q479 H485 R543	N477-G481 PolarHBondContact O-N 2.85Å; Q479-G481 VanDerWaalsContact C-N 3.27Å; Q479-G481 PolarHBondContact O-N 2.85Å; G481-H485 PolarHBondContact O-CD2 2.89Å; G481-H485 VanDerWaalsContact O-CD2 3.3Å; G481-R543 WeakPolarHBondContact O-CB 3.2Å
482	R	96.1	Very high	89.6	Confident	108 Å²	108	47 Å²	47	41%	0.408	23%	0.225	S	C	.	.	H	α-helix	trans	-83.2	-47	171.9	-71.2	-175.6	-73.7	-91.7	1.5	111.4	E478 Q479 F480 I484 H485 R543	E478-R482 PolarHBondContact O-N 3.22Å; E478-R482 PolarHBondContact O-NH1 3.17Å; Q479-R482 PolarHBondContact O-N 2.71Å; F480-R482 PolarHBondContact O-N 2.79Å; F480-R482 VanDerWaalsContact O-N 3.16Å; R482-I484 PolarHBondContact O-N 3.47Å; R482-H485 PolarHBondContact O-N 2.85Å; R482-H485 VanDerWaalsContact O-N 3.16Å; R482-R543 HydrophobicContact CG-CB 4.4Å; R482-R543 HydrophobicContact CG-CG 4.22Å
483	D	95.4	Very high	88	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.064	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-43.2	-172	-74.4	-7.2	0	0	0	112	R440 Y442 Q479 F480 H485 T486 S487	R440-D483 IonicContact CZ-OD2 2.71Å; R440-D483 VanDerWaalsContact CZ-OD2 3.26Å; R440-D483 IonicContact NE-OD2 2.82Å; R440-D483 PolarHBondContact NE-OD2 3.39Å; R440-D483 VanDerWaalsContact NE-OD2 3.1Å; R440-D483 IonicContact NH2-OD1 2.65Å; R440-D483 PolarHBondContact NH2-OD1 3.31Å; R440-D483 VanDerWaalsContact NH2-OD1 3.11Å; R440-D483 IonicContact NH2-OD2 2.89Å; R440-D483 PolarHBondContact NH2-OD2 2.82Å; Y442-D483 WeakPolarHBondContact OH-CB 3.42Å; Y442-D483 PolarHBondContact OH-OD2 2.61Å; Q479-D483 PolarHBondContact NE2-OD1 3.11Å; Q479-D483 PolarHBondContact O-N 3.2Å; F480-D483 PolarHBondContact O-N 2.89Å; F480-D483 VanDerWaalsContact O-N 3.15Å; D483-H485 PolarHBondContact O-N 3.41Å; D483-H485 VanDerWaalsContact O-N 3.1Å; D483-T486 PolarHBondContact O-N 3.38Å; D483-T486 PolarHBondContact O-OG1 3.24Å; D483-S487 PolarHBondContact O-N 3.15Å; D483-S487 VanDerWaalsContact O-N 3.15Å; D483-S487 PolarHBondContact O-OG 3.42Å
484	I	95.6	Very high	86.8	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-22.5	-178.7	66.9	173.2	0	0	0	113.6	L446 F480 R482 Y505 G506 L540	L446-I484 HydrophobicContact CD2-CG2 3.98Å; F480-I484 HydrophobicContact CD2-CG2 3.92Å; F480-I484 HydrophobicContact CE1-CD1 4.05Å; F480-I484 HydrophobicContact CE1-CG2 4.22Å; F480-I484 HydrophobicContact CE2-CG2 3.52Å; F480-I484 HydrophobicContact CG-CG2 4.43Å; F480-I484 HydrophobicContact CZ-CD1 4.27Å; F480-I484 HydrophobicContact CZ-CG2 3.69Å; F480-I484 WeakPolarHBondContact O-CG2 3.48Å; F480-I484 PolarHBondContact O-N 3.33Å; F480-I484 VanDerWaalsContact O-N 3.13Å; R482-I484 PolarHBondContact O-N 3.47Å; I484-Y505 CarbonylContact O-C 3.59Å; I484-Y505 WeakPolarHBondContact O-CB 3.39Å; I484-Y505 PolarHBondContact O-N 3.45Å; I484-Y505 VanDerWaalsContact O-N 3.13Å; I484-G506 PolarHBondContact O-N 2.94Å; I484-L540 HydrophobicContact CD1-CD1 4.25Å; I484-L540 HydrophobicContact CD1-CD2 3.63Å
485	H	95.4	Very high	85.1	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.023	27%	0.273	C	S	.	.	H	α-helix	trans	-85.4	-14.6	175.6	-75.6	-83.6	0	0	0	113.3	G481 R482 D483 T545	G481-H485 PolarHBondContact O-CD2 2.89Å; G481-H485 VanDerWaalsContact O-CD2 3.3Å; R482-H485 PolarHBondContact O-N 2.85Å; R482-H485 VanDerWaalsContact O-N 3.16Å; D483-H485 PolarHBondContact O-N 3.41Å; D483-H485 VanDerWaalsContact O-N 3.1Å; H485-T545 WeakPolarHBondContact CB-OG1 3.48Å; H485-T545 PolarHBondContact ND1-N 3.5Å; H485-T545 PolarHBondContact ND1-O 3.18Å; H485-T545 VanDerWaalsContact ND1-O 3.07Å
486	T	91	Very high	83.1	Confident	94 Å²	94	60.7 Å²	60.7	58%	0.577	30%	0.301	S	S	*	.	H	α-helix	trans	-95.6	-23.8	178	65	0	0	0	0	113.3	D483 D488	D483-T486 PolarHBondContact O-N 3.38Å; D483-T486 PolarHBondContact O-OG1 3.24Å; T486-D488 PolarHBondContact O-N 3.45Å
487	S	84.9	Confident	81.1	Confident	25 Å²	25	62.4 Å²	62.4	18%	0.175	31%	0.313	C	S	.	.	S	Bend	trans	-85.3	105.9	179.5	-60.9	0	0	0	0	111.2	D483 S504 Y505	D483-S487 PolarHBondContact O-N 3.15Å; D483-S487 VanDerWaalsContact O-N 3.15Å; D483-S487 PolarHBondContact O-OG 3.42Å; S487-S504 WeakPolarHBondContact O-CA 3.42Å; S487-Y505 PolarHBondContact O-N 2.85Å
488	D	80	Confident	79.4	Confident	118 Å²	118	67.2 Å²	67.2	63%	0.631	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.2	177.9	-74.1	-29.5	0	0	0	112.2	T486	T486-D488 PolarHBondContact O-N 3.45Å
489	I	78.6	Confident	77.9	Confident	18 Å²	18	73.6 Å²	73.6	9%	0.092	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	118.2	172.3	-47.1	172.4	0	0	0	108.3	W491 V492 V503 Y505 L508	I489-W491 VanDerWaalsContact C-N 3.32Å; I489-W491 WeakPolarHBondContact CG2-O 3.27Å; I489-V492 HydrophobicContact CG2-CG2 4.15Å; I489-V503 WeakPolarHBondContact CB-O 3.07Å; I489-V503 WeakPolarHBondContact CG1-O 3.25Å; I489-V503 PolarHBondContact N-O 3.49Å; I489-Y505 HydrophobicContact CD1-CD1 3.35Å; I489-Y505 HydrophobicContact CD1-CD2 4.05Å; I489-Y505 HydrophobicContact CD1-CE1 3.43Å; I489-Y505 VanDerWaalsContact CD1-CE1 3.43Å; I489-Y505 HydrophobicContact CD1-CE2 4.13Å; I489-Y505 HydrophobicContact CD1-CG 3.67Å; I489-Y505 HydrophobicContact CG1-CD1 3.95Å; I489-Y505 HydrophobicContact CG1-CD2 3.7Å; I489-Y505 HydrophobicContact CG1-CE1 3.86Å; I489-Y505 HydrophobicContact CG1-CE2 3.62Å; I489-Y505 HydrophobicContact CG1-CG 3.86Å; I489-L508 HydrophobicContact CD1-CB 4.4Å; I489-L508 HydrophobicContact CD1-CD2 3.67Å
490	K	68.2	Low	76.7	Confident	186 Å²	186	70.3 Å²	70.3	81%	0.809	33%	0.333	S	S	*	.	S	Bend	trans	-67.3	-35.2	174.9	-67.3	-174.5	179.6	178.9	0	112.2
491	W	60.2	Low	75.5	Confident	116 Å²	116	73.5 Å²	73.5	44%	0.439	36%	0.355	S	S	.	.			trans	-153	131	-172.1	-176.1	-109.6	0	0	0	114	I489 R499	I489-W491 VanDerWaalsContact C-N 3.32Å; I489-W491 WeakPolarHBondContact CG2-O 3.27Å; W491-R499 HydrophobicContact CH2-CB 4.42Å; W491-R499 HydrophobicContact CH2-CG 3.81Å; W491-R499 HydrophobicContact CZ3-CB 4.11Å; W491-R499 HydrophobicContact CZ3-CG 3.99Å
492	V	67	Low	74.7	Confident	12 Å²	12	79.3 Å²	79.3	7%	0.073	39%	0.386	C	S	.	.			trans	-107.8	107.2	173	-176.8	0	0	0	0	108.9	I489 W494 L508	I489-V492 HydrophobicContact CG2-CG2 4.15Å; V492-W494 VanDerWaalsContact C-N 3.3Å; V492-W494 HydrophobicContact CG1-CD2 3.81Å; V492-W494 HydrophobicContact CG1-CE3 4.06Å; V492-W494 HydrophobicContact CG1-CG 4.39Å; V492-W494 HydrophobicContact CG1-CH2 4.1Å; V492-W494 HydrophobicContact CG1-CZ2 3.86Å; V492-W494 HydrophobicContact CG1-CZ3 4.17Å; V492-W494 PolarHBondContact O-N 2.97Å; V492-L508 HydrophobicContact CG1-CD2 4.45Å; V492-L508 HydrophobicContact CG2-CD1 4.44Å; V492-L508 HydrophobicContact CG2-CD2 3.95Å
493	Q	64.3	Low	74.4	Confident	158 Å²	158	74.3 Å²	74.3	74%	0.738	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.7	-171.9	-66.6	-72.2	-3.4	0	0	114.5
494	W	72.1	Confident	74.3	Confident	45 Å²	45	74 Å²	74	17%	0.17	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	4.5	-168.3	45.9	-104.5	0	0	0	115	L450 N451 Y454 V492 A496 L508 V512	L450-W494 HydrophobicContact CB-CH2 4.2Å; L450-W494 HydrophobicContact CB-CZ2 3.98Å; N451-W494 HydrophobicContact CB-CD2 4.06Å; N451-W494 HydrophobicContact CB-CG 4.15Å; N451-W494 HydrophobicContact CB-CZ2 4.13Å; N451-W494 WeakPolarHBondContact OD1-CB 3.48Å; Y454-W494 AromaticContact CD1-CE3 3.42Å; Y454-W494 HydrophobicContact CD1-CE3 3.42Å; Y454-W494 VanDerWaalsContact CD1-CE3 3.42Å; Y454-W494 AromaticContact CD1-CZ3 3.6Å; Y454-W494 HydrophobicContact CD1-CZ3 3.6Å; Y454-W494 HydrophobicContact CD2-CE3 4.24Å; Y454-W494 AromaticContact CD2-CZ3 3.59Å; Y454-W494 HydrophobicContact CD2-CZ3 3.59Å; Y454-W494 AromaticContact CE1-CE3 3.93Å; Y454-W494 HydrophobicContact CE1-CE3 3.93Å; Y454-W494 HydrophobicContact CE1-CZ3 4.26Å; Y454-W494 HydrophobicContact CE2-CZ3 4.23Å; Y454-W494 AromaticContact CG-CE3 3.62Å; Y454-W494 HydrophobicContact CG-CE3 3.62Å; Y454-W494 HydrophobicContact CG-CH2 4.21Å; Y454-W494 AromaticContact CG-CZ3 3.23Å; Y454-W494 HydrophobicContact CG-CZ3 3.23Å; V492-W494 VanDerWaalsContact C-N 3.3Å; V492-W494 HydrophobicContact CG1-CD2 3.81Å; V492-W494 HydrophobicContact CG1-CE3 4.06Å; V492-W494 HydrophobicContact CG1-CG 4.39Å; V492-W494 HydrophobicContact CG1-CH2 4.1Å; V492-W494 HydrophobicContact CG1-CZ2 3.86Å; V492-W494 HydrophobicContact CG1-CZ3 4.17Å; V492-W494 PolarHBondContact O-N 2.97Å; W494-A496 PolarHBondContact O-N 2.8Å; W494-L508 HydrophobicContact CH2-CD1 4.24Å; W494-L508 HydrophobicContact CH2-CD2 4.36Å; W494-L508 HydrophobicContact CZ2-CD2 4.3Å; W494-V512 HydrophobicContact CH2-CG2 3.95Å; W494-V512 HydrophobicContact CZ3-CG2 4.45Å
495	S	62.6	Low	74.2	Confident	24 Å²	24	75.9 Å²	75.9	17%	0.168	37%	0.373	C	S	.	.			trans	-79.5	88.9	176.1	-177.1	0	0	0	0	110.8	N497 R498	S495-N497 VanDerWaalsContact C-N 3.32Å; S495-N497 PolarHBondContact O-N 3.28Å; S495-R498 WeakPolarHBondContact CB-O 3.28Å; S495-R498 PolarHBondContact OG-O 3.45Å
496	A	55	Low	74.2	Confident	75 Å²	75	75.6 Å²	75.6	62%	0.62	37%	0.372	S	S	*	.	S	Bend	trans	-59.4	-36.1	-177.1	0	0	0	0	0	114.2	W494	W494-A496 PolarHBondContact O-N 2.8Å
497	N	55.1	Low	74.5	Confident	100 Å²	100	71.2 Å²	71.2	54%	0.535	35%	0.345	S	S	.	.	S	Bend	trans	-99.4	-21.9	-164.6	-66.4	-30.2	0	0	0	114.6	S495	S495-N497 VanDerWaalsContact C-N 3.32Å; S495-N497 PolarHBondContact O-N 3.28Å
498	R	61.4	Low	74.9	Confident	149 Å²	149	70.2 Å²	70.2	56%	0.562	34%	0.338	S	S	*	.			trans	-148.2	122.6	177.7	-78.8	-173.5	171.2	178.8	-7.6	110	S495 L500 H550	S495-R498 WeakPolarHBondContact CB-O 3.28Å; S495-R498 PolarHBondContact OG-O 3.45Å; R498-L500 PolarHBondContact O-N 3.44Å; R498-H550 PolarHBondContact NH1-CD2 2.88Å; R498-H550 PolarHBondContact NH1-NE2 3.29Å
499	R	62.9	Low	75.7	Confident	211 Å²	211	64.6 Å²	64.6	80%	0.796	31%	0.308	S	S	*	.			trans	-67.7	86.9	166.3	-65.9	-174	180	-178.3	0.1	108.4	W491 S501	W491-R499 HydrophobicContact CH2-CB 4.42Å; W491-R499 HydrophobicContact CH2-CG 3.81Å; W491-R499 HydrophobicContact CZ3-CB 4.11Å; W491-R499 HydrophobicContact CZ3-CG 3.99Å; R499-S501 PolarHBondContact O-N 2.85Å
500	L	71.4	Confident	76.5	Confident	16 Å²	16	63.8 Å²	63.8	8%	0.084	30%	0.304	C	S	.	.			trans	-72.9	119.1	169.9	-69.4	173.2	0	0	0	107.4	R498 V503 L511 H550	R498-L500 PolarHBondContact O-N 3.44Å; L500-V503 HydrophobicContact CB-CG2 3.86Å; L500-V503 HydrophobicContact CD2-CG2 4.42Å; L500-L511 HydrophobicContact CD1-CD1 3.63Å; L500-H550 HydrophobicContact CD2-CB 4.41Å
501	S	72.2	Confident	77.8	Confident	67 Å²	67	55.4 Å²	55.4	47%	0.469	27%	0.268	S	S	.	.			trans	-119.5	151.4	174.1	56.9	0	0	0	0	108.6	R499 V503	R499-S501 PolarHBondContact O-N 2.85Å; S501-V503 PolarHBondContact O-N 3.28Å
502	N	80.3	Confident	79.4	Confident	123 Å²	123	49.9 Å²	49.9	66%	0.658	25%	0.247	S	C	*	.	S	Bend	trans	55.7	47.5	-178.6	-56.3	-20.8	0	0	0	113
503	V	89.3	Confident	80.8	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.9	177	-178.5	0	0	0	0	108.5	I489 L500 S501 L508 H548	I489-V503 WeakPolarHBondContact CB-O 3.07Å; I489-V503 WeakPolarHBondContact CG1-O 3.25Å; I489-V503 PolarHBondContact N-O 3.49Å; L500-V503 HydrophobicContact CB-CG2 3.86Å; L500-V503 HydrophobicContact CD2-CG2 4.42Å; S501-V503 PolarHBondContact O-N 3.28Å; V503-L508 HydrophobicContact CG1-CB 4.14Å; V503-H548 HydrophobicContact CG1-CB 4.4Å; V503-H548 HydrophobicContact CG2-CB 4.44Å
504	S	93.3	Very high	82.3	Confident	5 Å²	5	41.8 Å²	41.8	4%	0.035	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	155	172.4	61.8	0	0	0	0	111.7	S487 G506 S507 L508	S487-S504 WeakPolarHBondContact O-CA 3.42Å; S504-G506 PolarHBondContact O-N 3.35Å; S504-S507 PolarHBondContact O-N 3.38Å; S504-S507 VanDerWaalsContact O-N 3.07Å; S504-S507 PolarHBondContact OG-N 3.01Å; S504-S507 PolarHBondContact OG-OG 3.42Å; S504-S507 VanDerWaalsContact OG-OG 3.05Å; S504-L508 PolarHBondContact O-N 2.92Å
505	Y	93.6	Very high	83.3	Confident	43 Å²	43	42.2 Å²	42.2	17%	0.169	21%	0.21	C	C	.	.	H	α-helix	trans	-54.6	-37.3	173.7	-80.8	-76.3	0	0	0	112.5	L446 P447 I484 S487 I489 L508 T509	L446-Y505 HydrophobicContact CD2-CD1 3.65Å; L446-Y505 HydrophobicContact CD2-CE1 4.5Å; L446-Y505 HydrophobicContact CD2-CG 3.92Å; L446-Y505 HydrophobicContact CG-CD1 4.08Å; P447-Y505 HydrophobicContact CB-CE1 4.24Å; P447-Y505 HydrophobicContact CG-CE1 3.88Å; I484-Y505 CarbonylContact O-C 3.59Å; I484-Y505 WeakPolarHBondContact O-CB 3.39Å; I484-Y505 PolarHBondContact O-N 3.45Å; I484-Y505 VanDerWaalsContact O-N 3.13Å; S487-Y505 PolarHBondContact O-N 2.85Å; I489-Y505 HydrophobicContact CD1-CD1 3.35Å; I489-Y505 HydrophobicContact CD1-CD2 4.05Å; I489-Y505 HydrophobicContact CD1-CE1 3.43Å; I489-Y505 VanDerWaalsContact CD1-CE1 3.43Å; I489-Y505 HydrophobicContact CD1-CE2 4.13Å; I489-Y505 HydrophobicContact CD1-CG 3.67Å; I489-Y505 HydrophobicContact CG1-CD1 3.95Å; I489-Y505 HydrophobicContact CG1-CD2 3.7Å; I489-Y505 HydrophobicContact CG1-CE1 3.86Å; I489-Y505 HydrophobicContact CG1-CE2 3.62Å; I489-Y505 HydrophobicContact CG1-CG 3.86Å; Y505-L508 PolarHBondContact O-N 2.91Å; Y505-T509 VanDerWaalsContact O-CB 3.31Å; Y505-T509 WeakPolarHBondContact O-CB 3.43Å; Y505-T509 PolarHBondContact O-N 3.44Å; Y505-T509 PolarHBondContact O-OG1 3.45Å
506	G	95.8	Very high	84.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-44	175.8	0	0	0	0	0	112.6	I484 S504 T509 V510	I484-G506 PolarHBondContact O-N 2.94Å; S504-G506 PolarHBondContact O-N 3.35Å; G506-T509 PolarHBondContact O-N 3.23Å; G506-V510 WeakPolarHBondContact O-CG2 3.44Å; G506-V510 PolarHBondContact O-N 2.92Å
507	S	95.3	Very high	86.4	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.007	17%	0.172	C	C	.	.	H	α-helix	trans	-65.4	-40.6	175.5	-65.8	0	0	0	0	112.7	S504 T509 L511 H548	S504-S507 PolarHBondContact O-N 3.38Å; S504-S507 VanDerWaalsContact O-N 3.07Å; S504-S507 PolarHBondContact OG-N 3.01Å; S504-S507 PolarHBondContact OG-OG 3.42Å; S504-S507 VanDerWaalsContact OG-OG 3.05Å; S507-T509 VanDerWaalsContact C-N 3.34Å; S507-L511 VanDerWaalsContact O-CB 3.3Å; S507-L511 WeakPolarHBondContact O-CB 3.46Å; S507-L511 PolarHBondContact O-N 3.03Å; S507-L511 VanDerWaalsContact O-N 3.08Å; S507-H548 PolarHBondContact OG-N 3.45Å
508	L	94.1	Very high	88	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-41.1	175.6	-177.1	63	0	0	0	111.1	L450 I489 V492 W494 V503 S504 Y505 L511 V512	L450-L508 HydrophobicContact CD1-CB 4.43Å; L450-L508 HydrophobicContact CD1-CD2 3.86Å; L450-L508 HydrophobicContact CD1-CG 3.97Å; I489-L508 HydrophobicContact CD1-CB 4.4Å; I489-L508 HydrophobicContact CD1-CD2 3.67Å; V492-L508 HydrophobicContact CG1-CD2 4.45Å; V492-L508 HydrophobicContact CG2-CD1 4.44Å; V492-L508 HydrophobicContact CG2-CD2 3.95Å; W494-L508 HydrophobicContact CH2-CD1 4.24Å; W494-L508 HydrophobicContact CH2-CD2 4.36Å; W494-L508 HydrophobicContact CZ2-CD2 4.3Å; V503-L508 HydrophobicContact CG1-CB 4.14Å; S504-L508 PolarHBondContact O-N 2.92Å; Y505-L508 PolarHBondContact O-N 2.91Å; L508-L511 PolarHBondContact O-N 3.49Å; L508-V512 HydrophobicContact CD1-CG2 4.14Å; L508-V512 HydrophobicContact CG-CG2 4.34Å; L508-V512 WeakPolarHBondContact O-CB 3.29Å; L508-V512 VanDerWaalsContact O-CG2 3.29Å; L508-V512 WeakPolarHBondContact O-CG2 3.39Å; L508-V512 PolarHBondContact O-N 3.1Å
509	T	96.2	Very high	89.1	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-52.4	178.2	-60.1	0	0	0	0	110.9	L450 L471 Y505 G506 S507 L511 V512 L513 L540	L450-T509 HydrophobicContact CD2-CG2 4.2Å; L471-T509 HydrophobicContact CD1-CG2 4.32Å; L471-T509 HydrophobicContact CD2-CG2 3.99Å; Y505-T509 VanDerWaalsContact O-CB 3.31Å; Y505-T509 WeakPolarHBondContact O-CB 3.43Å; Y505-T509 PolarHBondContact O-N 3.44Å; Y505-T509 PolarHBondContact O-OG1 3.45Å; G506-T509 PolarHBondContact O-N 3.23Å; S507-T509 VanDerWaalsContact C-N 3.34Å; T509-L511 VanDerWaalsContact C-N 3.3Å; T509-L511 PolarHBondContact O-N 3.02Å; T509-V512 PolarHBondContact O-N 3.27Å; T509-L513 HydrophobicContact CG2-CD1 3.85Å; T509-L513 HydrophobicContact CG2-CG 4.34Å; T509-L513 WeakPolarHBondContact O-CB 3.45Å; T509-L513 VanDerWaalsContact O-CG 3.25Å; T509-L513 WeakPolarHBondContact O-CG 3.33Å; T509-L513 PolarHBondContact O-N 2.86Å; T509-L540 HydrophobicContact CG2-CD1 3.93Å
510	V	97.2	Very high	90	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-57.2	-45.5	177.2	172.3	0	0	0	0	111.1	G506 L513 C514 L537 I544 L547	G506-V510 WeakPolarHBondContact O-CG2 3.44Å; G506-V510 PolarHBondContact O-N 2.92Å; V510-L513 PolarHBondContact O-N 2.77Å; V510-C514 WeakPolarHBondContact O-CB 3.16Å; V510-C514 PolarHBondContact O-N 2.68Å; V510-C514 PolarHBondContact O-SG 3.45Å; V510-L537 HydrophobicContact CB-CD2 4.29Å; V510-L537 HydrophobicContact CG1-CD2 4.19Å; V510-L537 HydrophobicContact CG2-CD2 4.05Å; V510-I544 HydrophobicContact CG2-CD1 3.93Å; V510-L547 HydrophobicContact CB-CD1 4.12Å; V510-L547 HydrophobicContact CG1-CD1 4.28Å; V510-L547 HydrophobicContact CG1-CD2 4.5Å; V510-L547 HydrophobicContact CG2-CD1 4.17Å
511	L	94.3	Very high	90.5	Very high	10 Å²	10	26.1 Å²	26.1	5%	0.052	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-49.1	179.2	179.8	160.4	0	0	0	112.3	L500 S507 L508 T509 R515 H550 A551	L500-L511 HydrophobicContact CD1-CD1 3.63Å; S507-L511 VanDerWaalsContact O-CB 3.3Å; S507-L511 WeakPolarHBondContact O-CB 3.46Å; S507-L511 PolarHBondContact O-N 3.03Å; S507-L511 VanDerWaalsContact O-N 3.08Å; L508-L511 PolarHBondContact O-N 3.49Å; T509-L511 VanDerWaalsContact C-N 3.3Å; T509-L511 PolarHBondContact O-N 3.02Å; L511-R515 VanDerWaalsContact O-CB 3.26Å; L511-R515 WeakPolarHBondContact O-CB 3.31Å; L511-R515 PolarHBondContact O-N 3.38Å; L511-H550 WeakPolarHBondContact CD1-ND1 3.38Å; L511-A551 HydrophobicContact CB-CB 4.22Å
512	V	94.6	Very high	90.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-46.4	-179.6	169.8	0	0	0	0	110.2	L450 L453 W494 L508 T509 C514 R515 T516	L450-V512 HydrophobicContact CD2-CB 4.38Å; L450-V512 HydrophobicContact CD2-CG1 4.42Å; L453-V512 HydrophobicContact CB-CG1 3.55Å; W494-V512 HydrophobicContact CH2-CG2 3.95Å; W494-V512 HydrophobicContact CZ3-CG2 4.45Å; L508-V512 HydrophobicContact CD1-CG2 4.14Å; L508-V512 HydrophobicContact CG-CG2 4.34Å; L508-V512 WeakPolarHBondContact O-CB 3.29Å; L508-V512 VanDerWaalsContact O-CG2 3.29Å; L508-V512 WeakPolarHBondContact O-CG2 3.39Å; L508-V512 PolarHBondContact O-N 3.1Å; T509-V512 PolarHBondContact O-N 3.27Å; V512-C514 PolarHBondContact O-N 3Å; V512-R515 WeakPolarHBondContact O-CB 3.41Å; V512-R515 PolarHBondContact O-N 3.44Å; V512-T516 PolarHBondContact O-N 2.99Å; V512-T516 PolarHBondContact O-OG1 3.2Å
513	L	96.8	Very high	90.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.8	-46.8	179.2	-71.5	179.2	0	0	0	112.8	L453 L468 L471 T509 V510 R515 T516 I517 I533 T536 L537	L453-L513 HydrophobicContact CD1-CD2 4.04Å; L468-L513 HydrophobicContact CD2-CD2 3.8Å; L471-L513 HydrophobicContact CD2-CD1 4.22Å; L471-L513 HydrophobicContact CD2-CD2 3.96Å; L471-L513 HydrophobicContact CD2-CG 4.4Å; T509-L513 HydrophobicContact CG2-CD1 3.85Å; T509-L513 HydrophobicContact CG2-CG 4.34Å; T509-L513 WeakPolarHBondContact O-CB 3.45Å; T509-L513 VanDerWaalsContact O-CG 3.25Å; T509-L513 WeakPolarHBondContact O-CG 3.33Å; T509-L513 PolarHBondContact O-N 2.86Å; V510-L513 PolarHBondContact O-N 2.77Å; L513-R515 VanDerWaalsContact C-N 3.3Å; L513-R515 PolarHBondContact O-N 2.95Å; L513-T516 PolarHBondContact O-N 3.03Å; L513-I517 PolarHBondContact O-N 3.03Å; L513-I533 HydrophobicContact CB-CG2 3.76Å; L513-I533 HydrophobicContact CD2-CG1 4.22Å; L513-I533 HydrophobicContact CD2-CG2 3.97Å; L513-I533 HydrophobicContact CG-CG2 4.29Å; L513-T536 HydrophobicContact CD1-CG2 3.61Å; L513-L537 HydrophobicContact CB-CD1 4.43Å; L513-L537 HydrophobicContact CB-CD2 4.07Å; L513-L537 HydrophobicContact CB-CG 4.25Å; L513-L537 HydrophobicContact CD1-CD2 3.79Å; L513-L537 HydrophobicContact CD1-CG 3.94Å
514	C	95.5	Very high	89	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.4	-39.6	176.1	-69	0	0	0	0	111.9	V510 V512 I517 Q518 T554 L558	V510-C514 WeakPolarHBondContact O-CB 3.16Å; V510-C514 PolarHBondContact O-N 2.68Å; V510-C514 PolarHBondContact O-SG 3.45Å; V512-C514 PolarHBondContact O-N 3Å; C514-I517 PolarHBondContact O-N 3.41Å; C514-Q518 PolarHBondContact O-N 2.89Å; C514-T554 HydrophobicContact CB-CG2 3.7Å; C514-L558 HydrophobicContact CB-CD2 3.95Å
515	R	91.4	Very high	87.8	Confident	54 Å²	54	33.6 Å²	33.6	20%	0.204	15%	0.152	C	C	.	.	H	α-helix	trans	-64.3	-40.7	175.8	177.1	175.3	173.1	81.3	2.1	111.5	L511 V512 L513 Q518 Y519	L511-R515 VanDerWaalsContact O-CB 3.26Å; L511-R515 WeakPolarHBondContact O-CB 3.31Å; L511-R515 PolarHBondContact O-N 3.38Å; V512-R515 WeakPolarHBondContact O-CB 3.41Å; V512-R515 PolarHBondContact O-N 3.44Å; L513-R515 VanDerWaalsContact C-N 3.3Å; L513-R515 PolarHBondContact O-N 2.95Å; R515-Q518 WeakPolarHBondContact O-CB 3.4Å; R515-Q518 PolarHBondContact O-N 2.91Å; R515-Y519 HydrophobicContact CG-CD2 3.71Å; R515-Y519 HydrophobicContact CG-CE2 3.36Å; R515-Y519 PolarHBondContact NH1-OH 2.89Å; R515-Y519 VanDerWaalsContact NH1-OH 3.1Å; R515-Y519 PolarHBondContact NH2-OH 2.94Å; R515-Y519 WeakPolarHBondContact O-CD2 3.27Å; R515-Y519 PolarHBondContact O-N 2.91Å
516	T	91.9	Very high	87.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.3	-41.6	175.8	-54.2	0	0	0	0	111.6	L453 V512 L513 Q518 Y519 H520 I533	L453-T516 PolarHBondContact O-OG1 2.91Å; V512-T516 PolarHBondContact O-N 2.99Å; V512-T516 PolarHBondContact O-OG1 3.2Å; L513-T516 PolarHBondContact O-N 3.03Å; T516-Q518 PolarHBondContact O-N 2.93Å; T516-Y519 PolarHBondContact O-N 3.4Å; T516-H520 PolarHBondContact O-N 3.37Å; T516-H520 VanDerWaalsContact O-N 3.07Å; T516-I533 HydrophobicContact CG2-CD1 3.8Å
517	I	91.1	Very high	86.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.2	-48	171.9	-64.3	171.9	0	0	0	110.4	L513 C514 Y519 H520 L521 I533 L534 L537 L558	L513-I517 PolarHBondContact O-N 3.03Å; C514-I517 PolarHBondContact O-N 3.41Å; I517-Y519 VanDerWaalsContact C-N 3.25Å; I517-Y519 PolarHBondContact O-N 2.87Å; I517-H520 PolarHBondContact O-N 2.78Å; I517-L521 PolarHBondContact O-N 2.97Å; I517-I533 HydrophobicContact CD1-CB 4.39Å; I517-I533 HydrophobicContact CD1-CG2 3.61Å; I517-I533 HydrophobicContact CG1-CB 4.26Å; I517-I533 HydrophobicContact CG1-CD1 3.93Å; I517-I533 HydrophobicContact CG1-CG2 3.71Å; I517-L534 HydrophobicContact CD1-CD2 4.1Å; I517-L537 HydrophobicContact CD1-CD1 4.46Å; I517-L558 HydrophobicContact CB-CD1 4.33Å; I517-L558 HydrophobicContact CB-CD2 3.96Å; I517-L558 HydrophobicContact CD1-CD2 3.93Å; I517-L558 HydrophobicContact CG2-CD1 3.86Å; I517-L558 HydrophobicContact CG2-CD2 4.01Å
518	Q	89.5	Confident	86.1	Confident	96 Å²	96	44.9 Å²	44.9	45%	0.449	20%	0.2	S	C	.	.	H	α-helix	trans	-58.3	-38.5	-178.6	-177.4	178.4	-5	0	0	112.2	C514 R515 T516 L521 L558 L561	C514-Q518 PolarHBondContact O-N 2.89Å; R515-Q518 WeakPolarHBondContact O-CB 3.4Å; R515-Q518 PolarHBondContact O-N 2.91Å; T516-Q518 PolarHBondContact O-N 2.93Å; Q518-L521 WeakPolarHBondContact O-CB 3.37Å; Q518-L558 HydrophobicContact CB-CD1 4.29Å; Q518-L561 HydrophobicContact CG-CD2 3.86Å
519	Y	84.6	Confident	85.9	Confident	100 Å²	100	44.8 Å²	44.8	39%	0.392	20%	0.2	S	C	.	.	H	α-helix	trans	-72.2	-45.8	178.9	-81.2	-60.5	0	0	0	113.5	R515 T516 I517 L521	R515-Y519 HydrophobicContact CG-CD2 3.71Å; R515-Y519 HydrophobicContact CG-CE2 3.36Å; R515-Y519 PolarHBondContact NH1-OH 2.89Å; R515-Y519 VanDerWaalsContact NH1-OH 3.1Å; R515-Y519 PolarHBondContact NH2-OH 2.94Å; R515-Y519 WeakPolarHBondContact O-CD2 3.27Å; R515-Y519 PolarHBondContact O-N 2.91Å; T516-Y519 PolarHBondContact O-N 3.4Å; I517-Y519 VanDerWaalsContact C-N 3.25Å; I517-Y519 PolarHBondContact O-N 2.87Å; Y519-L521 PolarHBondContact O-N 3.44Å
520	H	82.3	Confident	85.6	Confident	33 Å²	33	45.1 Å²	45.1	15%	0.153	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-85.3	14.6	-179.6	-58.2	154.6	0	0	0	112.5	S456 T516 I517 N522 Q523 L529	S456-H520 PolarHBondContact OG-CE1 3.36Å; S456-H520 PolarHBondContact OG-NE2 2.9Å; T516-H520 PolarHBondContact O-N 3.37Å; T516-H520 VanDerWaalsContact O-N 3.07Å; I517-H520 PolarHBondContact O-N 2.78Å; H520-N522 PolarHBondContact O-N 3.35Å; H520-Q523 CarbonylContact O-C 3.53Å; H520-Q523 VanDerWaalsContact O-C 3.31Å; H520-Q523 WeakPolarHBondContact O-CA 3.35Å; H520-Q523 PolarHBondContact O-N 3.35Å; H520-L529 HydrophobicContact CB-CD2 3.43Å; H520-L529 VanDerWaalsContact CB-CD2 3.43Å; H520-L529 WeakPolarHBondContact ND1-CD2 3.25Å
521	L	80.9	Confident	85.3	Confident	7 Å²	7	48.9 Å²	48.9	4%	0.037	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-62.5	-26.7	178.9	-164.6	70.5	0	0	0	112.9	I517 Q518 Y519 Q523 L524 L561 L562 R565	I517-L521 PolarHBondContact O-N 2.97Å; Q518-L521 WeakPolarHBondContact O-CB 3.37Å; Y519-L521 PolarHBondContact O-N 3.44Å; L521-Q523 PolarHBondContact O-N 2.92Å; L521-L524 HydrophobicContact CD1-CD1 4.21Å; L521-L524 HydrophobicContact CD1-CD2 4.02Å; L521-L524 HydrophobicContact CD1-CG 4.22Å; L521-L524 WeakPolarHBondContact O-CG 3.46Å; L521-L561 HydrophobicContact CD2-CD2 3.85Å; L521-L561 HydrophobicContact CD2-CG 4.13Å; L521-L562 HydrophobicContact CD1-CD2 3.3Å; L521-L562 HydrophobicContact CD2-CD2 4.48Å; L521-R565 PolarHBondContact O-NH1 3Å
522	N	72	Confident	85.3	Confident	104 Å²	104	49.5 Å²	49.5	56%	0.556	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-73	-14	173.5	-67.5	-13.4	0	0	0	112.7	H520 L597	H520-N522 PolarHBondContact O-N 3.35Å; N522-L597 WeakPolarHBondContact OD1-CD2 3.16Å
523	Q	72.6	Confident	85.4	Confident	121 Å²	121	49.5 Å²	49.5	57%	0.565	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-117.4	42.3	-179.3	-63.3	177.8	-5.4	0	0	110.7	H520 L521 K525 D526	H520-Q523 CarbonylContact O-C 3.53Å; H520-Q523 VanDerWaalsContact O-C 3.31Å; H520-Q523 WeakPolarHBondContact O-CA 3.35Å; H520-Q523 PolarHBondContact O-N 3.35Å; L521-Q523 PolarHBondContact O-N 2.92Å; Q523-K525 PolarHBondContact O-N 2.94Å; Q523-D526 WeakPolarHBondContact O-CB 3.33Å; Q523-D526 PolarHBondContact O-N 3.4Å
524	L	65.8	Low	85.4	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.052	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-17.9	175.4	-79.3	168.9	0	0	0	113.6	L521 D526 E609	L521-L524 HydrophobicContact CD1-CD1 4.21Å; L521-L524 HydrophobicContact CD1-CD2 4.02Å; L521-L524 HydrophobicContact CD1-CG 4.22Å; L521-L524 WeakPolarHBondContact O-CG 3.46Å; L524-D526 PolarHBondContact O-N 3.23Å; L524-E609 HydrophobicContact CD1-CG 4.48Å
525	K	68.6	Low	85.5	Confident	121 Å²	121	50.4 Å²	50.4	53%	0.526	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-21.6	171.7	-67.6	-174.8	175.2	-177.4	0	112.9	Q523 K527 E605	Q523-K525 PolarHBondContact O-N 2.94Å; K525-K527 PolarHBondContact O-N 3.31Å; K525-E605 IonicContact NZ-OE1 3.72Å; K525-E605 PolarHBondContact NZ-OE1 3.14Å
526	D	79.7	Confident	85.8	Confident	21 Å²	21	47.8 Å²	47.8	11%	0.112	22%	0.223	C	C	.	.			trans	-77.5	73.6	170.3	-173.5	-2.6	0	0	0	110.8	Y465 Q523 L524 Y528 L529 H530	Y465-D526 PolarHBondContact OH-OD1 3.16Å; Y465-D526 PolarHBondContact OH-OD2 3.06Å; Q523-D526 WeakPolarHBondContact O-CB 3.33Å; Q523-D526 PolarHBondContact O-N 3.4Å; L524-D526 PolarHBondContact O-N 3.23Å; D526-Y528 PolarHBondContact O-N 3.37Å; D526-L529 HydrophobicContact CB-CB 4.3Å; D526-L529 VanDerWaalsContact CG-CB 3.45Å; D526-L529 PolarHBondContact O-N 2.93Å; D526-L529 PolarHBondContact OD1-N 3.4Å; D526-L529 VanDerWaalsContact OD1-N 3.11Å; D526-L529 VanDerWaalsContact OD2-CB 3.31Å; D526-L529 WeakPolarHBondContact OD2-CB 3.33Å; D526-H530 PolarHBondContact O-CD2 3.14Å; D526-H530 VanDerWaalsContact O-CD2 3.23Å; D526-H530 PolarHBondContact O-N 2.83Å
527	K	83.4	Confident	86.1	Confident	121 Å²	121	47.9 Å²	47.9	53%	0.526	22%	0.224	S	C	.	.	H	α-helix	trans	-59.6	-37	-179.2	-58.3	-170.6	-171.4	-168.1	0	111.7	K525 L529 H530 V531 L612	K525-K527 PolarHBondContact O-N 3.31Å; K527-L529 PolarHBondContact O-N 3.3Å; K527-H530 PolarHBondContact O-N 3.49Å; K527-V531 VanDerWaalsContact O-CB 3.31Å; K527-V531 WeakPolarHBondContact O-CB 3.42Å; K527-V531 WeakPolarHBondContact O-CG2 3.47Å; K527-V531 PolarHBondContact O-N 2.87Å; K527-L612 HydrophobicContact CD-CD2 3.9Å; K527-L612 HydrophobicContact CG-CD2 4.11Å
528	Y	85.8	Confident	86.5	Confident	139 Å²	139	47.9 Å²	47.9	55%	0.545	22%	0.224	S	C	.	.	H	α-helix	trans	-60.6	-45.8	-178.4	-74.2	-79	0	0	0	111.6	D526 N532	D526-Y528 PolarHBondContact O-N 3.37Å; Y528-N532 PolarHBondContact O-N 3.05Å; Y528-N532 VanDerWaalsContact O-N 3.17Å; Y528-N532 PolarHBondContact O-ND2 3.36Å
529	L	88.8	Confident	86.9	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-57.6	-53.9	176.4	-180	86.7	0	0	0	111.3	V464 Y465 L468 H520 D526 K527 N532 I533	V464-L529 HydrophobicContact CG1-CD1 3.83Å; Y465-L529 HydrophobicContact CD1-CD1 4.49Å; Y465-L529 HydrophobicContact CE1-CB 3.86Å; Y465-L529 HydrophobicContact CE1-CD1 4.24Å; L468-L529 HydrophobicContact CD1-CD1 3.5Å; L468-L529 HydrophobicContact CD1-CG 4.27Å; H520-L529 HydrophobicContact CB-CD2 3.43Å; H520-L529 VanDerWaalsContact CB-CD2 3.43Å; H520-L529 WeakPolarHBondContact ND1-CD2 3.25Å; D526-L529 HydrophobicContact CB-CB 4.3Å; D526-L529 VanDerWaalsContact CG-CB 3.45Å; D526-L529 PolarHBondContact O-N 2.93Å; D526-L529 PolarHBondContact OD1-N 3.4Å; D526-L529 VanDerWaalsContact OD1-N 3.11Å; D526-L529 VanDerWaalsContact OD2-CB 3.31Å; D526-L529 WeakPolarHBondContact OD2-CB 3.33Å; K527-L529 PolarHBondContact O-N 3.3Å; L529-N532 PolarHBondContact O-N 3.03Å; L529-I533 HydrophobicContact CD1-CD1 4.35Å; L529-I533 HydrophobicContact CD2-CD1 4.42Å; L529-I533 HydrophobicContact CG-CD1 3.96Å; L529-I533 WeakPolarHBondContact O-CG1 3.45Å; L529-I533 PolarHBondContact O-N 3.49Å; L529-I533 VanDerWaalsContact O-N 3.13Å
530	H	89.9	Confident	87.5	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.028	19%	0.185	C	C	.	.	H	α-helix	trans	-68	-39.8	-173.4	-66.5	-58.4	0	0	0	112.5	D526 K527 I533 L534	D526-H530 PolarHBondContact O-CD2 3.14Å; D526-H530 VanDerWaalsContact O-CD2 3.23Å; D526-H530 PolarHBondContact O-N 2.83Å; K527-H530 PolarHBondContact O-N 3.49Å; H530-I533 PolarHBondContact O-N 2.87Å; H530-L534 WeakPolarHBondContact O-CB 3.27Å; H530-L534 VanDerWaalsContact O-CG 3.25Å; H530-L534 WeakPolarHBondContact O-CG 3.34Å; H530-L534 PolarHBondContact O-N 2.66Å
531	V	92.3	Very high	88.3	Confident	81 Å²	81	37.3 Å²	37.3	49%	0.491	18%	0.178	S	C	.	.	H	α-helix	trans	-60.5	-46.3	176.4	169.3	0	0	0	0	110.9	K527 I533 L534 A535	K527-V531 VanDerWaalsContact O-CB 3.31Å; K527-V531 WeakPolarHBondContact O-CB 3.42Å; K527-V531 WeakPolarHBondContact O-CG2 3.47Å; K527-V531 PolarHBondContact O-N 2.87Å; V531-I533 PolarHBondContact O-N 3.21Å; V531-L534 PolarHBondContact O-N 2.95Å; V531-A535 WeakPolarHBondContact O-CB 3.44Å; V531-A535 PolarHBondContact O-N 3.21Å
532	N	93.7	Very high	89	Confident	23 Å²	23	38.4 Å²	38.4	12%	0.123	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-41.3	179	-81	-82.2	0	0	0	112.3	L468 L472 Y528 L529 T536	L468-N532 HydrophobicContact CB-CB 4.19Å; L468-N532 HydrophobicContact CD1-CB 4.4Å; L472-N532 VanDerWaalsContact CD2-OD1 3.27Å; L472-N532 WeakPolarHBondContact CD2-OD1 3.45Å; Y528-N532 PolarHBondContact O-N 3.05Å; Y528-N532 VanDerWaalsContact O-N 3.17Å; Y528-N532 PolarHBondContact O-ND2 3.36Å; L529-N532 PolarHBondContact O-N 3.03Å; N532-T536 WeakPolarHBondContact O-CB 3.29Å; N532-T536 PolarHBondContact O-N 3.36Å; N532-T536 PolarHBondContact O-OG1 3.15Å
533	I	96.4	Very high	90.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.2	-48.2	176.5	-65.6	167.2	0	0	0	110.9	L468 L513 T516 I517 L529 H530 V531 T536 L537	L468-I533 HydrophobicContact CD1-CD1 4.29Å; L468-I533 HydrophobicContact CD1-CG1 3.83Å; L468-I533 HydrophobicContact CD2-CD1 4.47Å; L468-I533 HydrophobicContact CD2-CG1 3.58Å; L468-I533 HydrophobicContact CG-CG1 4.37Å; L513-I533 HydrophobicContact CB-CG2 3.76Å; L513-I533 HydrophobicContact CD2-CG1 4.22Å; L513-I533 HydrophobicContact CD2-CG2 3.97Å; L513-I533 HydrophobicContact CG-CG2 4.29Å; T516-I533 HydrophobicContact CG2-CD1 3.8Å; I517-I533 HydrophobicContact CD1-CB 4.39Å; I517-I533 HydrophobicContact CD1-CG2 3.61Å; I517-I533 HydrophobicContact CG1-CB 4.26Å; I517-I533 HydrophobicContact CG1-CD1 3.93Å; I517-I533 HydrophobicContact CG1-CG2 3.71Å; L529-I533 HydrophobicContact CD1-CD1 4.35Å; L529-I533 HydrophobicContact CD2-CD1 4.42Å; L529-I533 HydrophobicContact CG-CD1 3.96Å; L529-I533 WeakPolarHBondContact O-CG1 3.45Å; L529-I533 PolarHBondContact O-N 3.49Å; L529-I533 VanDerWaalsContact O-N 3.13Å; H530-I533 PolarHBondContact O-N 2.87Å; V531-I533 PolarHBondContact O-N 3.21Å; I533-T536 WeakPolarHBondContact O-CB 3.06Å; I533-T536 PolarHBondContact O-N 3.41Å; I533-L537 HydrophobicContact CG2-CD1 4.14Å; I533-L537 WeakPolarHBondContact O-CG 3.45Å; I533-L537 PolarHBondContact O-N 3.25Å
534	L	97.1	Very high	91.4	Very high	12 Å²	12	29.5 Å²	29.5	6%	0.063	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-41	-178	-71.1	170.6	0	0	0	111.7	I517 H530 V531 T536 L537 A538 V616 M619 L620 I623	I517-L534 HydrophobicContact CD1-CD2 4.1Å; H530-L534 WeakPolarHBondContact O-CB 3.27Å; H530-L534 VanDerWaalsContact O-CG 3.25Å; H530-L534 WeakPolarHBondContact O-CG 3.34Å; H530-L534 PolarHBondContact O-N 2.66Å; V531-L534 PolarHBondContact O-N 2.95Å; L534-T536 VanDerWaalsContact C-N 3.31Å; L534-T536 PolarHBondContact O-N 3.44Å; L534-L537 PolarHBondContact O-N 3.39Å; L534-A538 WeakPolarHBondContact O-CB 3.46Å; L534-A538 PolarHBondContact O-N 3.34Å; L534-V616 HydrophobicContact CD1-CB 4.37Å; L534-V616 HydrophobicContact CD1-CG1 4.2Å; L534-V616 HydrophobicContact CD1-CG2 4.09Å; L534-M619 HydrophobicContact CB-CG 3.81Å; L534-M619 HydrophobicContact CD1-CB 4.15Å; L534-M619 HydrophobicContact CD1-CG 4.04Å; L534-M619 HydrophobicContact CD2-CB 4.4Å; L534-M619 HydrophobicContact CD2-CG 4.05Å; L534-M619 HydrophobicContact CG-CG 4.18Å; L534-L620 HydrophobicContact CD2-CD2 3.79Å; L534-L620 HydrophobicContact CD2-CG 3.95Å; L534-I623 HydrophobicContact CD2-CD1 4.2Å
535	A	97.2	Very high	92.9	Very high	6 Å²	6	30.9 Å²	30.9	5%	0.05	15%	0.148	C	C	.	.	H	α-helix	trans	-58.6	-43.1	173.2	0	0	0	0	0	111.6	L472 V531 A538 N539 F715	L472-A535 HydrophobicContact CD1-CB 3.7Å; L472-A535 HydrophobicContact CD2-CB 4.41Å; V531-A535 WeakPolarHBondContact O-CB 3.44Å; V531-A535 PolarHBondContact O-N 3.21Å; A535-A538 PolarHBondContact O-N 3.03Å; A535-N539 PolarHBondContact O-N 2.69Å; A535-F715 HydrophobicContact CB-CB 3.7Å; A535-F715 HydrophobicContact CB-CD1 4.03Å; A535-F715 HydrophobicContact CB-CD2 4.28Å; A535-F715 HydrophobicContact CB-CG 3.74Å
536	T	98.3	Very high	94.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-48.3	176.2	-57.4	0	0	0	0	111.3	L471 T475 L513 N532 I533 L534 A538 N539 L540	L471-T536 HydrophobicContact CD2-CG2 3.8Å; L471-T536 HydrophobicContact CG-CG2 3.7Å; T475-T536 HydrophobicContact CG2-CG2 3.61Å; L513-T536 HydrophobicContact CD1-CG2 3.61Å; N532-T536 WeakPolarHBondContact O-CB 3.29Å; N532-T536 PolarHBondContact O-N 3.36Å; N532-T536 PolarHBondContact O-OG1 3.15Å; I533-T536 WeakPolarHBondContact O-CB 3.06Å; I533-T536 PolarHBondContact O-N 3.41Å; L534-T536 VanDerWaalsContact C-N 3.31Å; L534-T536 PolarHBondContact O-N 3.44Å; T536-A538 VanDerWaalsContact C-N 3.32Å; T536-A538 PolarHBondContact O-N 2.84Å; T536-N539 PolarHBondContact O-N 2.77Å; T536-L540 WeakPolarHBondContact O-CG 3.17Å; T536-L540 PolarHBondContact O-N 3.23Å
537	L	98.5	Very high	94.9	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-62.6	-39.7	176.6	-72.5	172.6	0	0	0	112.1	V510 L513 I517 I533 L534 L540 S541 L620 I623	V510-L537 HydrophobicContact CB-CD2 4.29Å; V510-L537 HydrophobicContact CG1-CD2 4.19Å; V510-L537 HydrophobicContact CG2-CD2 4.05Å; L513-L537 HydrophobicContact CB-CD1 4.43Å; L513-L537 HydrophobicContact CB-CD2 4.07Å; L513-L537 HydrophobicContact CB-CG 4.25Å; L513-L537 HydrophobicContact CD1-CD2 3.79Å; L513-L537 HydrophobicContact CD1-CG 3.94Å; I517-L537 HydrophobicContact CD1-CD1 4.46Å; I533-L537 HydrophobicContact CG2-CD1 4.14Å; I533-L537 WeakPolarHBondContact O-CG 3.45Å; I533-L537 PolarHBondContact O-N 3.25Å; L534-L537 PolarHBondContact O-N 3.39Å; L537-L540 PolarHBondContact O-N 3.29Å; L537-S541 WeakPolarHBondContact O-CB 3.21Å; L537-S541 PolarHBondContact O-N 2.84Å; L537-L620 HydrophobicContact CD1-CD2 4.39Å; L537-I623 HydrophobicContact CB-CD1 3.71Å; L537-I623 HydrophobicContact CB-CG1 4.48Å
538	A	98.3	Very high	95.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-65	-44.4	179.8	0	0	0	0	0	111.9	L534 A535 T536 L540 S541 P542 I623 L713 F715	L534-A538 WeakPolarHBondContact O-CB 3.46Å; L534-A538 PolarHBondContact O-N 3.34Å; A535-A538 PolarHBondContact O-N 3.03Å; T536-A538 VanDerWaalsContact C-N 3.32Å; T536-A538 PolarHBondContact O-N 2.84Å; A538-L540 VanDerWaalsContact C-N 3.29Å; A538-L540 PolarHBondContact O-N 2.81Å; A538-S541 WeakPolarHBondContact O-CB 3.37Å; A538-S541 PolarHBondContact O-N 3.08Å; A538-S541 PolarHBondContact O-OG 3.3Å; A538-P542 WeakPolarHBondContact O-CD 3.31Å; A538-I623 HydrophobicContact CB-CD1 4.35Å; A538-I623 HydrophobicContact CB-CG1 4.02Å; A538-L713 HydrophobicContact CB-CB 4.01Å; A538-L713 HydrophobicContact CB-CD1 3.98Å; A538-L713 HydrophobicContact CB-CG 4.5Å; A538-F715 HydrophobicContact CB-CD2 3.67Å; A538-F715 HydrophobicContact CB-CE2 3.45Å; A538-F715 VanDerWaalsContact CB-CE2 3.45Å
539	N	98.3	Very high	95.8	Very high	7 Å²	7	25 Å²	25	4%	0.037	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-35.6	174.1	-79.4	-12.3	0	0	0	113.4	T475 A535 T536 R543 F715	T475-N539 WeakPolarHBondContact OG1-CB 3.48Å; T475-N539 PolarHBondContact OG1-ND2 2.99Å; T475-N539 VanDerWaalsContact OG1-ND2 3.11Å; A535-N539 PolarHBondContact O-N 2.69Å; T536-N539 PolarHBondContact O-N 2.77Å; N539-R543 PolarHBondContact O-NH1 2.89Å; N539-R543 VanDerWaalsContact O-NH1 3.09Å; N539-F715 PolarHBondContact ND2-O 2.76Å; N539-F715 PolarHBondContact OD1-N 3.41Å; N539-F715 PolarHBondContact OD1-O 3.33Å
540	L	98.2	Very high	96	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-75.5	-31.9	176.7	-69.4	176.7	0	0	0	112.7	T475 F480 I484 T509 T536 L537 A538 P542 R543 I544	T475-L540 HydrophobicContact CG2-CD1 4.11Å; T475-L540 HydrophobicContact CG2-CD2 3.79Å; T475-L540 HydrophobicContact CG2-CG 3.71Å; F480-L540 HydrophobicContact CE1-CD2 4.5Å; I484-L540 HydrophobicContact CD1-CD1 4.25Å; I484-L540 HydrophobicContact CD1-CD2 3.63Å; T509-L540 HydrophobicContact CG2-CD1 3.93Å; T536-L540 WeakPolarHBondContact O-CG 3.17Å; T536-L540 PolarHBondContact O-N 3.23Å; L537-L540 PolarHBondContact O-N 3.29Å; A538-L540 VanDerWaalsContact C-N 3.29Å; A538-L540 PolarHBondContact O-N 2.81Å; L540-P542 VanDerWaalsContact C-CD 3.47Å; L540-R543 CarbonylContact O-C 3.55Å; L540-R543 WeakPolarHBondContact O-CA 3.47Å; L540-R543 PolarHBondContact O-N 3.01Å; L540-I544 HydrophobicContact CB-CG1 4.36Å; L540-I544 PolarHBondContact O-N 3.1Å; L540-I544 VanDerWaalsContact O-N 3.14Å
541	S	98	Very high	96.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-48.2	-44.9	-169.5	69.7	0	0	0	0	116.4	L537 A538 R543 S626 I627	L537-S541 WeakPolarHBondContact O-CB 3.21Å; L537-S541 PolarHBondContact O-N 2.84Å; A538-S541 WeakPolarHBondContact O-CB 3.37Å; A538-S541 PolarHBondContact O-N 3.08Å; A538-S541 PolarHBondContact O-OG 3.3Å; S541-R543 PolarHBondContact O-N 3.27Å; S541-R543 VanDerWaalsContact O-N 3.14Å; S541-S626 WeakPolarHBondContact CB-OG 3.28Å; S541-S626 WeakPolarHBondContact OG-CB 3.27Å; S541-S626 PolarHBondContact OG-OG 2.96Å; S541-I627 WeakPolarHBondContact O-CG1 3.37Å
542	P	97	Very high	96.5	Very high	30 Å²	30	22.7 Å²	22.7	20%	0.195	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-74.7	-0.8	179.6	32.8	-38.3	0	0	0	114	A538 L540 H630 T631	A538-P542 WeakPolarHBondContact O-CD 3.31Å; L540-P542 VanDerWaalsContact C-CD 3.47Å; P542-H630 HydrophobicContact CB-CB 4.09Å; P542-T631 WeakPolarHBondContact O-CG2 3.49Å
543	R	97.2	Very high	96.5	Very high	36 Å²	36	24.9 Å²	24.9	14%	0.136	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-123.4	-5	-176.2	-62.5	172.6	-176.4	80.2	17.6	113.4	E478 G481 R482 N539 L540 S541 T545	E478-R543 VanDerWaalsContact CB-NH2 3.34Å; E478-R543 WeakPolarHBondContact O-CD 3.46Å; E478-R543 PolarHBondContact O-NE 3.22Å; E478-R543 VanDerWaalsContact O-NE 3.07Å; E478-R543 IonicContact OE1-NH2 2.81Å; E478-R543 PolarHBondContact OE1-NH2 3.32Å; E478-R543 IonicContact OE2-CZ 2.71Å; E478-R543 IonicContact OE2-NH2 3.62Å; E478-R543 PolarHBondContact OE2-NH2 3.36Å; G481-R543 WeakPolarHBondContact O-CB 3.2Å; R482-R543 HydrophobicContact CG-CB 4.4Å; R482-R543 HydrophobicContact CG-CG 4.22Å; N539-R543 PolarHBondContact O-NH1 2.89Å; N539-R543 VanDerWaalsContact O-NH1 3.09Å; L540-R543 CarbonylContact O-C 3.55Å; L540-R543 WeakPolarHBondContact O-CA 3.47Å; L540-R543 PolarHBondContact O-N 3.01Å; S541-R543 PolarHBondContact O-N 3.27Å; S541-R543 VanDerWaalsContact O-N 3.14Å; R543-T545 PolarHBondContact O-N 2.89Å; R543-T545 VanDerWaalsContact O-N 3.16Å
544	I	97.6	Very high	96.5	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.133	C	C	.	.			trans	-60.5	120.9	176.7	-71.8	173.6	0	0	0	108.7	V510 L540 L547 I627 T631 N635	V510-I544 HydrophobicContact CG2-CD1 3.93Å; L540-I544 HydrophobicContact CB-CG1 4.36Å; L540-I544 PolarHBondContact O-N 3.1Å; L540-I544 VanDerWaalsContact O-N 3.14Å; I544-L547 HydrophobicContact CG2-CB 3.8Å; I544-L547 HydrophobicContact CG2-CD1 4.15Å; I544-L547 HydrophobicContact CG2-CD2 4.18Å; I544-L547 HydrophobicContact CG2-CG 4.26Å; I544-I627 HydrophobicContact CB-CG1 4.38Å; I544-I627 HydrophobicContact CD1-CD1 3.76Å; I544-I627 HydrophobicContact CD1-CG1 4.09Å; I544-T631 WeakPolarHBondContact O-CB 2.87Å; I544-T631 PolarHBondContact O-OG1 3.22Å; I544-N635 PolarHBondContact O-ND2 3.02Å
545	T	96.9	Very high	96.5	Very high	38 Å²	38	25.4 Å²	25.4	23%	0.233	13%	0.13	C	C	.	.			trans	-131.5	149.7	172.3	64.5	0	0	0	0	109.7	H485 R543 L547 T631	H485-T545 WeakPolarHBondContact CB-OG1 3.48Å; H485-T545 PolarHBondContact ND1-N 3.5Å; H485-T545 PolarHBondContact ND1-O 3.18Å; H485-T545 VanDerWaalsContact ND1-O 3.07Å; R543-T545 PolarHBondContact O-N 2.89Å; R543-T545 VanDerWaalsContact O-N 3.16Å; T545-L547 PolarHBondContact O-N 3.37Å; T545-L547 VanDerWaalsContact O-N 3.15Å; T545-T631 HydrophobicContact CG2-CG2 4.46Å
546	K	95.3	Very high	96.5	Very high	168 Å²	168	25.2 Å²	25.2	73%	0.73	13%	0.128	S	C	*	.	S	Bend	trans	48.3	43.9	178.1	-59	179.6	-179.2	176.7	0	112.4	H548 S634 N635	K546-H548 PolarHBondContact O-N 3.16Å; K546-S634 WeakPolarHBondContact CA-O 3.29Å; K546-S634 PolarHBondContact N-O 3.09Å; K546-N635 PolarHBondContact N-OD1 2.98Å
547	L	95.8	Very high	96.4	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.138	C	C	.	.			trans	-60	123.6	-179.7	-171.2	63.4	0	0	0	109.6	V510 I544 T545 A551 C552 N635	V510-L547 HydrophobicContact CB-CD1 4.12Å; V510-L547 HydrophobicContact CG1-CD1 4.28Å; V510-L547 HydrophobicContact CG1-CD2 4.5Å; V510-L547 HydrophobicContact CG2-CD1 4.17Å; I544-L547 HydrophobicContact CG2-CB 3.8Å; I544-L547 HydrophobicContact CG2-CD1 4.15Å; I544-L547 HydrophobicContact CG2-CD2 4.18Å; I544-L547 HydrophobicContact CG2-CG 4.26Å; T545-L547 PolarHBondContact O-N 3.37Å; T545-L547 VanDerWaalsContact O-N 3.15Å; L547-A551 HydrophobicContact CD1-CB 3.72Å; L547-A551 HydrophobicContact CG-CB 3.93Å; L547-C552 PolarHBondContact O-SG 2.99Å; L547-N635 WeakPolarHBondContact CB-OD1 3.29Å; L547-N635 PolarHBondContact N-OD1 3.2Å
548	H	94.2	Very high	96.3	Very high	48 Å²	48	26.1 Å²	26.1	22%	0.222	14%	0.138	C	C	.	.			trans	-57.1	140.2	-176.2	-175.6	-90.4	0	0	0	111	V503 S507 K546 H550 A551 C552	V503-H548 HydrophobicContact CG1-CB 4.4Å; V503-H548 HydrophobicContact CG2-CB 4.44Å; S507-H548 PolarHBondContact OG-N 3.45Å; K546-H548 PolarHBondContact O-N 3.16Å; H548-H550 VanDerWaalsContact ND1-CB 3.31Å; H548-H550 WeakPolarHBondContact ND1-CB 3.38Å; H548-H550 PolarHBondContact ND1-N 3.09Å; H548-H550 PolarHBondContact O-N 2.86Å; H548-A551 HydrophobicContact CB-CB 4.48Å; H548-A551 WeakPolarHBondContact O-CA 3.49Å; H548-A551 WeakPolarHBondContact O-CB 3.41Å; H548-A551 PolarHBondContact O-N 3.37Å; H548-C552 PolarHBondContact O-N 3.32Å
549	P	93.9	Very high	96.3	Very high	61 Å²	61	26.1 Å²	26.1	40%	0.396	14%	0.138	S	C	.	.	H	α-helix	trans	-52.8	-36.9	-175	-26	29.9	0	0	0	114	C552 D553 D637	P549-C552 WeakPolarHBondContact O-CB 3.31Å; P549-C552 PolarHBondContact O-N 2.66Å; P549-D553 PolarHBondContact O-N 2.97Å; P549-D637 HydrophobicContact CB-CB 4.48Å; P549-D637 HydrophobicContact CG-CB 4.38Å
550	H	92.1	Very high	96.1	Very high	42 Å²	42	28.1 Å²	28.1	19%	0.194	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-37.2	175.1	-172.3	-104.5	0	0	0	113.6	R498 L500 L511 H548 D553 T554	R498-H550 PolarHBondContact NH1-CD2 2.88Å; R498-H550 PolarHBondContact NH1-NE2 3.29Å; L500-H550 HydrophobicContact CD2-CB 4.41Å; L511-H550 WeakPolarHBondContact CD1-ND1 3.38Å; H548-H550 VanDerWaalsContact ND1-CB 3.31Å; H548-H550 WeakPolarHBondContact ND1-CB 3.38Å; H548-H550 PolarHBondContact ND1-N 3.09Å; H548-H550 PolarHBondContact O-N 2.86Å; H550-D553 PolarHBondContact O-N 2.94Å; H550-T554 WeakPolarHBondContact O-CB 3.38Å; H550-T554 PolarHBondContact O-N 3.25Å; H550-T554 PolarHBondContact O-OG1 3.28Å
551	A	94.7	Very high	95.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.9	-38.7	176.3	0	0	0	0	0	110.6	L511 L547 H548 T554 L555	L511-A551 HydrophobicContact CB-CB 4.22Å; L547-A551 HydrophobicContact CD1-CB 3.72Å; L547-A551 HydrophobicContact CG-CB 3.93Å; H548-A551 HydrophobicContact CB-CB 4.48Å; H548-A551 WeakPolarHBondContact O-CA 3.49Å; H548-A551 WeakPolarHBondContact O-CB 3.41Å; H548-A551 PolarHBondContact O-N 3.37Å; A551-T554 PolarHBondContact O-N 3.17Å; A551-L555 WeakPolarHBondContact O-CB 3.28Å; A551-L555 PolarHBondContact O-N 2.92Å
552	C	97.3	Very high	95.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58	-50	170.6	-61.7	0	0	0	0	111.7	L547 H548 P549 T554 L555 V556 S641	L547-C552 PolarHBondContact O-SG 2.99Å; H548-C552 PolarHBondContact O-N 3.32Å; P549-C552 WeakPolarHBondContact O-CB 3.31Å; P549-C552 PolarHBondContact O-N 2.66Å; C552-T554 VanDerWaalsContact C-N 3.31Å; C552-T554 PolarHBondContact O-N 2.96Å; C552-L555 PolarHBondContact O-N 3.32Å; C552-V556 WeakPolarHBondContact O-CG2 3.1Å; C552-V556 PolarHBondContact O-N 3.42Å; C552-S641 WeakPolarHBondContact CB-OG 3.41Å
553	D	95.2	Very high	95.7	Very high	70 Å²	70	30 Å²	30	37%	0.374	16%	0.155	S	C	.	.	H	α-helix	trans	-63.9	-36.6	179.3	-174	52.2	0	0	0	112.6	P549 H550 G557 K645	P549-D553 PolarHBondContact O-N 2.97Å; H550-D553 PolarHBondContact O-N 2.94Å; D553-G557 VanDerWaalsContact O-CA 3.26Å; D553-G557 WeakPolarHBondContact O-CA 2.87Å; D553-G557 PolarHBondContact O-N 3.03Å; D553-K645 PolarHBondContact O-NZ 2.67Å; D553-K645 WeakPolarHBondContact OD1-CE 3.25Å; D553-K645 IonicContact OD1-NZ 3.13Å; D553-K645 PolarHBondContact OD1-NZ 3.2Å
554	T	95	Very high	95.5	Very high	21 Å²	21	33.7 Å²	33.7	13%	0.129	17%	0.172	C	C	.	.	H	α-helix	trans	-66.5	-45.4	175.5	-56.2	0	0	0	0	111.2	C514 H550 A551 C552 G557 L558	C514-T554 HydrophobicContact CB-CG2 3.7Å; H550-T554 WeakPolarHBondContact O-CB 3.38Å; H550-T554 PolarHBondContact O-N 3.25Å; H550-T554 PolarHBondContact O-OG1 3.28Å; A551-T554 PolarHBondContact O-N 3.17Å; C552-T554 VanDerWaalsContact C-N 3.31Å; C552-T554 PolarHBondContact O-N 2.96Å; T554-G557 PolarHBondContact O-N 3.28Å; T554-L558 WeakPolarHBondContact O-CB 3.21Å; T554-L558 PolarHBondContact O-N 3.12Å
555	L	97.8	Very high	95.2	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-52.6	178.2	175.2	61.7	0	0	0	111.6	A551 C552 G557 L558 L559 L620 I624 I627 L638	A551-L555 WeakPolarHBondContact O-CB 3.28Å; A551-L555 PolarHBondContact O-N 2.92Å; C552-L555 PolarHBondContact O-N 3.32Å; L555-G557 VanDerWaalsContact C-N 3.31Å; L555-G557 PolarHBondContact O-N 3.3Å; L555-L558 PolarHBondContact O-N 2.88Å; L555-L559 PolarHBondContact O-N 3.09Å; L555-L559 VanDerWaalsContact O-N 3.16Å; L555-L620 HydrophobicContact CD1-CD2 4.07Å; L555-I624 HydrophobicContact CD2-CG1 4.21Å; L555-I627 HydrophobicContact CD2-CD1 4.3Å; L555-L638 HydrophobicContact CD2-CD1 4.35Å
556	V	98.1	Very high	95	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-71	-31.1	180	-171.8	0	0	0	0	110.9	C552 L559 Q560 L638 L642 K645 F649	C552-V556 WeakPolarHBondContact O-CG2 3.1Å; C552-V556 PolarHBondContact O-N 3.42Å; V556-L559 PolarHBondContact O-N 3.26Å; V556-Q560 PolarHBondContact O-N 3.2Å; V556-L638 HydrophobicContact CG2-CD1 3.96Å; V556-L642 HydrophobicContact CG1-CD2 4.07Å; V556-L642 HydrophobicContact CG2-CD2 3.79Å; V556-L642 HydrophobicContact CG2-CG 4.12Å; V556-K645 HydrophobicContact CB-CD 4.18Å; V556-K645 HydrophobicContact CG1-CB 3.86Å; V556-K645 HydrophobicContact CG1-CD 3.7Å; V556-K645 HydrophobicContact CG1-CG 4.25Å; V556-F649 HydrophobicContact CG1-CZ 4.25Å
557	G	96.2	Very high	94.9	Very high	20 Å²	20	27.1 Å²	27.1	21%	0.206	14%	0.142	C	C	.	.	H	α-helix	trans	-66.6	-41	174.7	0	0	0	0	0	113.2	D553 T554 L555 L559 Q560 L561	D553-G557 VanDerWaalsContact O-CA 3.26Å; D553-G557 WeakPolarHBondContact O-CA 2.87Å; D553-G557 PolarHBondContact O-N 3.03Å; T554-G557 PolarHBondContact O-N 3.28Å; L555-G557 VanDerWaalsContact C-N 3.31Å; L555-G557 PolarHBondContact O-N 3.3Å; G557-L559 VanDerWaalsContact C-N 3.35Å; G557-Q560 PolarHBondContact O-N 3.47Å; G557-L561 WeakPolarHBondContact O-CB 3.5Å; G557-L561 PolarHBondContact O-N 2.97Å
558	L	96	Very high	94.7	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-47.9	171.6	172.4	61.8	0	0	0	110.3	C514 I517 Q518 T554 L555 Q560 L561 L562 L620	C514-L558 HydrophobicContact CB-CD2 3.95Å; I517-L558 HydrophobicContact CB-CD1 4.33Å; I517-L558 HydrophobicContact CB-CD2 3.96Å; I517-L558 HydrophobicContact CD1-CD2 3.93Å; I517-L558 HydrophobicContact CG2-CD1 3.86Å; I517-L558 HydrophobicContact CG2-CD2 4.01Å; Q518-L558 HydrophobicContact CB-CD1 4.29Å; T554-L558 WeakPolarHBondContact O-CB 3.21Å; T554-L558 PolarHBondContact O-N 3.12Å; L555-L558 PolarHBondContact O-N 2.88Å; L558-Q560 VanDerWaalsContact C-N 3.34Å; L558-Q560 PolarHBondContact O-N 3.1Å; L558-L561 WeakPolarHBondContact O-CB 3.19Å; L558-L561 PolarHBondContact O-N 3.16Å; L558-L561 VanDerWaalsContact O-N 3.13Å; L558-L562 HydrophobicContact CD1-CD1 4.09Å; L558-L562 HydrophobicContact CD1-CG 4.17Å; L558-L562 HydrophobicContact CG-CD1 4Å; L558-L562 VanDerWaalsContact O-CG 3.28Å; L558-L562 WeakPolarHBondContact O-CG 3.16Å; L558-L562 PolarHBondContact O-N 3.19Å; L558-L620 HydrophobicContact CD2-CD1 4.04Å; L558-L620 HydrophobicContact CG-CD1 4.15Å
559	L	96.9	Very high	94.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-43.7	177.6	-175.3	55.3	0	0	0	112	L555 V556 G557 L561 L562 I563 I617 L620 L621 I624 F649	L555-L559 PolarHBondContact O-N 3.09Å; L555-L559 VanDerWaalsContact O-N 3.16Å; V556-L559 PolarHBondContact O-N 3.26Å; G557-L559 VanDerWaalsContact C-N 3.35Å; L559-L561 VanDerWaalsContact C-N 3.34Å; L559-L561 PolarHBondContact O-N 3.43Å; L559-L562 PolarHBondContact O-N 2.96Å; L559-I563 HydrophobicContact CD1-CD1 4.19Å; L559-I563 HydrophobicContact CD1-CG1 4.36Å; L559-I563 HydrophobicContact CG-CD1 3.99Å; L559-I563 WeakPolarHBondContact O-CG1 3.38Å; L559-I563 PolarHBondContact O-N 2.79Å; L559-I617 HydrophobicContact CD1-CB 4.44Å; L559-I617 HydrophobicContact CD1-CG1 4.45Å; L559-I617 HydrophobicContact CD1-CG2 3.96Å; L559-L620 HydrophobicContact CD1-CB 4.17Å; L559-L620 HydrophobicContact CD1-CD1 4.44Å; L559-L621 HydrophobicContact CD1-CG 4.36Å; L559-L621 HydrophobicContact CD2-CD2 3.7Å; L559-L621 HydrophobicContact CD2-CG 4.22Å; L559-I624 HydrophobicContact CD2-CD1 3.55Å; L559-F649 HydrophobicContact CD2-CE1 3.57Å; L559-F649 HydrophobicContact CD2-CZ 4.16Å; L559-F649 HydrophobicContact CG-CE1 4.02Å
560	Q	96	Very high	94.3	Very high	49 Å²	49	28.3 Å²	28.3	23%	0.229	14%	0.143	C	C	.	.	H	α-helix	trans	-60.3	-41.8	174.1	-178.7	-176.7	52	0	0	112.4	V556 G557 L558 L562 I563 K564 S648	V556-Q560 PolarHBondContact O-N 3.2Å; G557-Q560 PolarHBondContact O-N 3.47Å; L558-Q560 VanDerWaalsContact C-N 3.34Å; L558-Q560 PolarHBondContact O-N 3.1Å; Q560-L562 VanDerWaalsContact C-N 3.35Å; Q560-I563 PolarHBondContact O-N 2.82Å; Q560-K564 HydrophobicContact CG-CD 4.34Å; Q560-K564 WeakPolarHBondContact O-CB 3.42Å; Q560-K564 WeakPolarHBondContact O-CG 3.35Å; Q560-K564 PolarHBondContact O-N 2.57Å; Q560-S648 PolarHBondContact NE2-OG 3.49Å
561	L	93.8	Very high	94.2	Very high	65 Å²	65	29.6 Å²	29.6	34%	0.34	15%	0.152	S	C	.	.	H	α-helix	trans	-61.2	-44.8	177.2	179	67.1	0	0	0	111	Q518 L521 G557 L558 L559 K564 R565	Q518-L561 HydrophobicContact CG-CD2 3.86Å; L521-L561 HydrophobicContact CD2-CD2 3.85Å; L521-L561 HydrophobicContact CD2-CG 4.13Å; G557-L561 WeakPolarHBondContact O-CB 3.5Å; G557-L561 PolarHBondContact O-N 2.97Å; L558-L561 WeakPolarHBondContact O-CB 3.19Å; L558-L561 PolarHBondContact O-N 3.16Å; L558-L561 VanDerWaalsContact O-N 3.13Å; L559-L561 VanDerWaalsContact C-N 3.34Å; L559-L561 PolarHBondContact O-N 3.43Å; L561-K564 PolarHBondContact O-N 3.29Å; L561-R565 PolarHBondContact O-N 3.22Å
562	L	94.1	Very high	93.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.4	-43.8	177.9	-66.2	167.4	0	0	0	111.8	L521 L558 L559 Q560 K564 R565 H566 L613 V616 I617 L620	L521-L562 HydrophobicContact CD1-CD2 3.3Å; L521-L562 HydrophobicContact CD2-CD2 4.48Å; L558-L562 HydrophobicContact CD1-CD1 4.09Å; L558-L562 HydrophobicContact CD1-CG 4.17Å; L558-L562 HydrophobicContact CG-CD1 4Å; L558-L562 VanDerWaalsContact O-CG 3.28Å; L558-L562 WeakPolarHBondContact O-CG 3.16Å; L558-L562 PolarHBondContact O-N 3.19Å; L559-L562 PolarHBondContact O-N 2.96Å; Q560-L562 VanDerWaalsContact C-N 3.35Å; L562-K564 VanDerWaalsContact C-N 3.34Å; L562-K564 PolarHBondContact O-N 2.83Å; L562-R565 WeakPolarHBondContact O-CB 3.49Å; L562-R565 PolarHBondContact O-N 3.32Å; L562-R565 VanDerWaalsContact O-N 3.17Å; L562-H566 WeakPolarHBondContact O-CB 3.34Å; L562-H566 PolarHBondContact O-N 3.45Å; L562-L613 HydrophobicContact CB-CD1 3.92Å; L562-L613 HydrophobicContact CD2-CD1 3.46Å; L562-L613 VanDerWaalsContact CD2-CD1 3.46Å; L562-L613 HydrophobicContact CG-CD1 4.28Å; L562-V616 HydrophobicContact CD1-CG1 3.8Å; L562-V616 HydrophobicContact CD2-CG1 4.43Å; L562-I617 HydrophobicContact CB-CD1 4.03Å; L562-I617 HydrophobicContact CB-CG1 3.63Å; L562-I617 HydrophobicContact CD1-CG1 4.42Å; L562-L620 HydrophobicContact CD1-CD1 3.31Å
563	I	95.4	Very high	93.5	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.015	16%	0.156	C	C	.	.	H	α-helix	trans	-62	-42.6	177	-66.8	168.4	0	0	0	111.1	L559 Q560 R565 H566 N567 I617 S648 F649 L652	L559-I563 HydrophobicContact CD1-CD1 4.19Å; L559-I563 HydrophobicContact CD1-CG1 4.36Å; L559-I563 HydrophobicContact CG-CD1 3.99Å; L559-I563 WeakPolarHBondContact O-CG1 3.38Å; L559-I563 PolarHBondContact O-N 2.79Å; Q560-I563 PolarHBondContact O-N 2.82Å; I563-R565 VanDerWaalsContact C-N 3.32Å; I563-R565 PolarHBondContact O-N 3.07Å; I563-H566 WeakPolarHBondContact O-CB 3.41Å; I563-H566 PolarHBondContact O-N 3.27Å; I563-N567 VanDerWaalsContact O-CG 3.26Å; I563-N567 PolarHBondContact O-N 3.25Å; I563-N567 PolarHBondContact O-ND2 2.63Å; I563-I617 HydrophobicContact CG1-CD1 4.34Å; I563-I617 HydrophobicContact CG1-CG2 4.47Å; I563-S648 WeakPolarHBondContact CG2-O 3.44Å; I563-F649 HydrophobicContact CD1-CD1 3.75Å; I563-F649 HydrophobicContact CD1-CE1 3.98Å; I563-L652 HydrophobicContact CD1-CD1 3.58Å; I563-L652 HydrophobicContact CD1-CG 4.12Å; I563-L652 HydrophobicContact CG1-CD1 3.75Å; I563-L652 HydrophobicContact CG1-CD2 4.24Å; I563-L652 HydrophobicContact CG1-CG 4.14Å; I563-L652 HydrophobicContact CG2-CD2 4.01Å; I563-L652 HydrophobicContact CG2-CG 4.17Å
564	K	94	Very high	93.2	Very high	115 Å²	115	33.5 Å²	33.5	50%	0.5	16%	0.162	S	C	.	.	H	α-helix	trans	-61.8	-40.8	175.4	-75.8	176.1	179.6	176.3	0	111.6	Q560 L561 L562 K568	Q560-K564 HydrophobicContact CG-CD 4.34Å; Q560-K564 WeakPolarHBondContact O-CB 3.42Å; Q560-K564 WeakPolarHBondContact O-CG 3.35Å; Q560-K564 PolarHBondContact O-N 2.57Å; L561-K564 PolarHBondContact O-N 3.29Å; L562-K564 VanDerWaalsContact C-N 3.34Å; L562-K564 PolarHBondContact O-N 2.83Å; K564-K568 VanDerWaalsContact O-CG 3.32Å; K564-K568 WeakPolarHBondContact O-CG 3.46Å; K564-K568 PolarHBondContact O-N 3.16Å
565	R	90.2	Very high	92.7	Very high	16 Å²	16	35.4 Å²	35.4	6%	0.06	17%	0.169	C	C	.	.	H	α-helix	trans	-63.7	-45.2	174.4	-173.9	178.9	-177.8	148.5	-1.1	110.8	L521 L561 L562 I563 N567 K568 T569 E609 L613	L521-R565 PolarHBondContact O-NH1 3Å; L561-R565 PolarHBondContact O-N 3.22Å; L562-R565 WeakPolarHBondContact O-CB 3.49Å; L562-R565 PolarHBondContact O-N 3.32Å; L562-R565 VanDerWaalsContact O-N 3.17Å; I563-R565 VanDerWaalsContact C-N 3.32Å; I563-R565 PolarHBondContact O-N 3.07Å; R565-N567 PolarHBondContact O-N 3.49Å; R565-K568 WeakPolarHBondContact O-CB 3.38Å; R565-K568 PolarHBondContact O-N 3.33Å; R565-T569 PolarHBondContact O-N 2.86Å; R565-T569 PolarHBondContact O-OG1 3.19Å; R565-T569 VanDerWaalsContact O-OG1 3.08Å; R565-E609 IonicContact CZ-OE1 3.1Å; R565-E609 IonicContact NE-OE1 2.86Å; R565-E609 PolarHBondContact NE-OE1 3.09Å; R565-E609 VanDerWaalsContact NH2-CD 3.34Å; R565-E609 IonicContact NH2-OE1 3.11Å; R565-E609 PolarHBondContact NH2-OE1 2.9Å; R565-E609 IonicContact NH2-OE2 3.73Å; R565-L613 HydrophobicContact CB-CD2 3.92Å; R565-L613 HydrophobicContact CG-CD2 3.77Å
566	H	92.8	Very high	91.8	Very high	6 Å²	6	37.4 Å²	37.4	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-57.4	-52.5	180	165.7	-81.8	0	0	0	111.1	L562 I563 K568 T569 V570 L610 L613 E614 I617 F658	L562-H566 WeakPolarHBondContact O-CB 3.34Å; L562-H566 PolarHBondContact O-N 3.45Å; I563-H566 WeakPolarHBondContact O-CB 3.41Å; I563-H566 PolarHBondContact O-N 3.27Å; H566-K568 VanDerWaalsContact C-N 3.28Å; H566-K568 PolarHBondContact O-N 2.91Å; H566-T569 PolarHBondContact O-N 3.46Å; H566-T569 VanDerWaalsContact O-N 3.16Å; H566-V570 WeakPolarHBondContact O-CG2 3.21Å; H566-V570 PolarHBondContact O-N 2.65Å; H566-L610 VanDerWaalsContact CD2-CD1 3.47Å; H566-L610 WeakPolarHBondContact CD2-CD1 3.12Å; H566-L613 HydrophobicContact CB-CD2 3.68Å; H566-L613 HydrophobicContact CB-CG 4.07Å; H566-L613 VanDerWaalsContact N-CD2 3.28Å; H566-E614 IonicContact NE2-OE1 3.61Å; H566-I617 HydrophobicContact CB-CD1 3.76Å; H566-F658 AromaticContact NE2-CE2 3.98Å
567	N	93.6	Very high	91	Very high	47 Å²	47	41.5 Å²	41.5	25%	0.251	21%	0.207	S	C	.	.	H	α-helix	trans	-59.8	-41.4	179.9	-64.4	-15.3	0	0	0	111.5	I563 R565 V570 D571 S651	I563-N567 VanDerWaalsContact O-CG 3.26Å; I563-N567 PolarHBondContact O-N 3.25Å; I563-N567 PolarHBondContact O-ND2 2.63Å; R565-N567 PolarHBondContact O-N 3.49Å; N567-V570 PolarHBondContact O-N 3.21Å; N567-D571 WeakPolarHBondContact O-CB 3.15Å; N567-D571 PolarHBondContact O-N 3.3Å; N567-S651 WeakPolarHBondContact ND2-CB 3.47Å; N567-S651 PolarHBondContact ND2-OG 3.27Å; N567-S651 PolarHBondContact OD1-OG 3.29Å
568	K	90.9	Very high	90.1	Very high	100 Å²	100	45.7 Å²	45.7	44%	0.435	23%	0.225	S	C	.	.	H	α-helix	trans	-62.4	-45.7	175.5	-74.8	179.6	175.3	-166.5	0	112.4	K564 R565 H566 D571 I572	K564-K568 VanDerWaalsContact O-CG 3.32Å; K564-K568 WeakPolarHBondContact O-CG 3.46Å; K564-K568 PolarHBondContact O-N 3.16Å; R565-K568 WeakPolarHBondContact O-CB 3.38Å; R565-K568 PolarHBondContact O-N 3.33Å; H566-K568 VanDerWaalsContact C-N 3.28Å; H566-K568 PolarHBondContact O-N 2.91Å; K568-D571 PolarHBondContact O-N 2.96Å; K568-I572 VanDerWaalsContact O-CG1 3.31Å; K568-I572 WeakPolarHBondContact O-CG1 3.15Å; K568-I572 PolarHBondContact O-N 3.28Å
569	T	89.6	Confident	88.4	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-43.3	178.6	-55.9	0	0	0	0	111.1	R565 H566 D571 I572 L573 M606 L610	R565-T569 PolarHBondContact O-N 2.86Å; R565-T569 PolarHBondContact O-OG1 3.19Å; R565-T569 VanDerWaalsContact O-OG1 3.08Å; H566-T569 PolarHBondContact O-N 3.46Å; H566-T569 VanDerWaalsContact O-N 3.16Å; T569-D571 PolarHBondContact O-N 3.38Å; T569-I572 PolarHBondContact O-N 3.22Å; T569-L573 HydrophobicContact CG2-CD1 4.26Å; T569-L573 PolarHBondContact O-N 3.26Å; T569-M606 HydrophobicContact CG2-CE 4.15Å; T569-L610 HydrophobicContact CG2-CB 4.08Å; T569-L610 HydrophobicContact CG2-CD1 4.42Å
570	V	91.4	Very high	86.5	Confident	34 Å²	34	57.3 Å²	57.3	21%	0.206	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-44.1	174.4	170.4	0	0	0	0	111.6	H566 N567 I572 L573 R574 L610	H566-V570 WeakPolarHBondContact O-CG2 3.21Å; H566-V570 PolarHBondContact O-N 2.65Å; N567-V570 PolarHBondContact O-N 3.21Å; V570-I572 VanDerWaalsContact C-N 3.34Å; V570-I572 PolarHBondContact O-N 3.25Å; V570-L573 PolarHBondContact O-N 3.47Å; V570-R574 WeakPolarHBondContact O-CB 3.13Å; V570-R574 PolarHBondContact O-N 3.3Å; V570-L610 HydrophobicContact CG2-CD1 3.68Å; V570-L610 HydrophobicContact CG2-CD2 3.92Å; V570-L610 HydrophobicContact CG2-CG 4.48Å
571	D	90	Very high	84.5	Confident	70 Å²	70	61.6 Å²	61.6	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-66.7	-35.3	-179.9	-72.4	-24.5	0	0	0	112.2	N567 K568 T569 R574 K575	N567-D571 WeakPolarHBondContact O-CB 3.15Å; N567-D571 PolarHBondContact O-N 3.3Å; K568-D571 PolarHBondContact O-N 2.96Å; T569-D571 PolarHBondContact O-N 3.38Å; D571-R574 IonicContact OD1-CZ 3.85Å; D571-R574 IonicContact OD1-NH1 3.24Å; D571-R574 PolarHBondContact OD1-NH1 3.32Å; D571-K575 WeakPolarHBondContact O-CG 3.37Å; D571-K575 PolarHBondContact O-N 3.08Å
572	I	87.8	Confident	82.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-68.8	-47.2	174.9	-65.4	164.3	0	0	0	110.5	K568 T569 V570 R574 K575 M576 L591 L592 I598 M606	K568-I572 VanDerWaalsContact O-CG1 3.31Å; K568-I572 WeakPolarHBondContact O-CG1 3.15Å; K568-I572 PolarHBondContact O-N 3.28Å; T569-I572 PolarHBondContact O-N 3.22Å; V570-I572 VanDerWaalsContact C-N 3.34Å; V570-I572 PolarHBondContact O-N 3.25Å; I572-R574 VanDerWaalsContact C-N 3.34Å; I572-R574 PolarHBondContact O-N 2.81Å; I572-K575 PolarHBondContact O-N 3.12Å; I572-M576 HydrophobicContact CG2-CE 3.83Å; I572-M576 HydrophobicContact CG2-SD 4.35Å; I572-M576 WeakPolarHBondContact O-CG 3.17Å; I572-M576 PolarHBondContact O-N 2.58Å; I572-L591 HydrophobicContact CD1-CB 4.41Å; I572-L591 HydrophobicContact CG1-CB 4.15Å; I572-L591 HydrophobicContact CG1-CD1 4.36Å; I572-L592 HydrophobicContact CD1-CD2 4.28Å; I572-L592 HydrophobicContact CG2-CD2 4.49Å; I572-I598 HydrophobicContact CD1-CD1 3.28Å; I572-M606 HydrophobicContact CB-CE 3.68Å; I572-M606 HydrophobicContact CG2-CE 3.34Å; I572-M606 HydrophobicContact CG2-SD 4.07Å
573	L	88.7	Confident	80.8	Confident	17 Å²	17	71.7 Å²	71.7	9%	0.089	37%	0.365	C	S	.	.	H	α-helix	trans	-59.8	-43.2	177.8	-78.3	170.6	0	0	0	111.8	T569 V570 K575 M576 S577 E603 M606 V607 L610	T569-L573 HydrophobicContact CG2-CD1 4.26Å; T569-L573 PolarHBondContact O-N 3.26Å; V570-L573 PolarHBondContact O-N 3.47Å; L573-K575 VanDerWaalsContact C-N 3.33Å; L573-K575 PolarHBondContact O-N 3.09Å; L573-M576 PolarHBondContact O-N 3.48Å; L573-S577 PolarHBondContact O-N 3.33Å; L573-S577 PolarHBondContact O-OG 3.31Å; L573-E603 HydrophobicContact CD2-CG 4.01Å; L573-M606 HydrophobicContact CD1-CB 4.44Å; L573-M606 HydrophobicContact CD2-CB 3.74Å; L573-M606 HydrophobicContact CD2-CE 4.25Å; L573-M606 HydrophobicContact CD2-SD 4.41Å; L573-M606 HydrophobicContact CG-CB 4.22Å; L573-M606 HydrophobicContact CG-CE 3.98Å; L573-V607 HydrophobicContact CD1-CG2 4.21Å; L573-V607 HydrophobicContact CD2-CG2 4.07Å; L573-L610 HydrophobicContact CD1-CB 4.4Å; L573-L610 HydrophobicContact CD1-CD2 3.8Å
574	R	88.1	Confident	79	Confident	134 Å²	134	72.4 Å²	72.4	51%	0.506	37%	0.371	S	S	.	.	H	α-helix	trans	-58.2	-45.4	175.9	-171.1	-174.8	-60.7	122.8	5.1	111.6	V570 D571 I572 S577 D578	V570-R574 WeakPolarHBondContact O-CB 3.13Å; V570-R574 PolarHBondContact O-N 3.3Å; D571-R574 IonicContact OD1-CZ 3.85Å; D571-R574 IonicContact OD1-NH1 3.24Å; D571-R574 PolarHBondContact OD1-NH1 3.32Å; I572-R574 VanDerWaalsContact C-N 3.34Å; I572-R574 PolarHBondContact O-N 2.81Å; R574-S577 PolarHBondContact O-N 3.37Å; R574-D578 PolarHBondContact O-N 3.37Å; R574-D578 VanDerWaalsContact O-N 3.14Å
575	K	84.6	Confident	77.6	Confident	60 Å²	60	69.4 Å²	69.4	26%	0.261	37%	0.367	S	S	.	.	H	α-helix	trans	-65.8	-36	178	-72	-176.2	179.6	-156.6	0	112.9	D571 I572 L573 S577 D578 S584 E587 I588 L591	D571-K575 WeakPolarHBondContact O-CG 3.37Å; D571-K575 PolarHBondContact O-N 3.08Å; I572-K575 PolarHBondContact O-N 3.12Å; L573-K575 VanDerWaalsContact C-N 3.33Å; L573-K575 PolarHBondContact O-N 3.09Å; K575-S577 VanDerWaalsContact C-N 3.35Å; K575-D578 PolarHBondContact O-N 2.93Å; K575-S584 PolarHBondContact O-OG 3.12Å; K575-E587 IonicContact NZ-OE2 3.26Å; K575-E587 PolarHBondContact NZ-OE2 2.74Å; K575-I588 HydrophobicContact CB-CD1 4.21Å; K575-I588 HydrophobicContact CB-CG1 3.99Å; K575-L591 HydrophobicContact CD-CD1 3.83Å
576	M	80.4	Confident	76.4	Confident	45 Å²	45	72 Å²	72	22%	0.222	39%	0.393	C	S	.	.	H	α-helix	trans	-65.8	-35.7	173.6	-73.7	-178.9	176.4	0	0	112.3	I572 L573 D578 D579 I588 M606	I572-M576 HydrophobicContact CG2-CE 3.83Å; I572-M576 HydrophobicContact CG2-SD 4.35Å; I572-M576 WeakPolarHBondContact O-CG 3.17Å; I572-M576 PolarHBondContact O-N 2.58Å; L573-M576 PolarHBondContact O-N 3.48Å; M576-D578 VanDerWaalsContact C-N 3.32Å; M576-D579 WeakPolarHBondContact O-CB 3.38Å; M576-I588 HydrophobicContact CE-CG2 4.13Å; M576-I588 HydrophobicContact CG-CD1 4.03Å; M576-M606 HydrophobicContact CE-SD 3.75Å; M576-M606 HydrophobicContact SD-SD 3.92Å
577	S	79.9	Confident	75.2	Confident	86 Å²	86	76.8 Å²	76.8	60%	0.601	42%	0.415	S	S	*	.	H	α-helix	trans	-71.8	-26.2	175.1	-54.3	0	0	0	0	113.3	L573 R574 K575 D579	L573-S577 PolarHBondContact O-N 3.33Å; L573-S577 PolarHBondContact O-OG 3.31Å; R574-S577 PolarHBondContact O-N 3.37Å; K575-S577 VanDerWaalsContact C-N 3.35Å; S577-D579 VanDerWaalsContact C-N 3.31Å; S577-D579 PolarHBondContact O-N 3.27Å
578	D	77.6	Confident	73.8	Confident	109 Å²	109	75.2 Å²	75.2	58%	0.583	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	2.2	-179.7	-71.5	-25.2	0	0	0	113.8	R574 K575 M576 N580	R574-D578 PolarHBondContact O-N 3.37Å; R574-D578 VanDerWaalsContact O-N 3.14Å; K575-D578 PolarHBondContact O-N 2.93Å; M576-D578 VanDerWaalsContact C-N 3.32Å; D578-N580 PolarHBondContact O-N 3.29Å
579	D	60.2	Low	72.8	Confident	78 Å²	78	74.8 Å²	74.8	42%	0.417	41%	0.412	S	S	.	.			trans	-67.7	45	-170.5	-102.4	-1.7	0	0	0	116.4	M576 S577 Q581 S584	M576-D579 WeakPolarHBondContact O-CB 3.38Å; S577-D579 VanDerWaalsContact C-N 3.31Å; S577-D579 PolarHBondContact O-N 3.27Å; D579-Q581 VanDerWaalsContact C-N 3.33Å; D579-S584 WeakPolarHBondContact OD1-CB 3.42Å; D579-S584 PolarHBondContact OD1-OG 3.43Å
580	N	56.5	Low	71.9	Confident	167 Å²	167	81.4 Å²	81.4	89%	0.893	44%	0.441	S	S	*	.	S	Bend	trans	-86.1	2.6	157	-80.6	-34.8	0	0	0	113.1	D578	D578-N580 PolarHBondContact O-N 3.29Å
581	Q	54.1	Low	70.6	Confident	140 Å²	140	82.5 Å²	82.5	65%	0.654	45%	0.445	S	S	*	.	S	Bend	trans	-134.1	124.8	-179.2	-63.8	-172.8	9.9	0	0	113.7	D579 Q583 S584	D579-Q581 VanDerWaalsContact C-N 3.33Å; Q581-Q583 PolarHBondContact O-N 3.44Å; Q581-S584 WeakPolarHBondContact O-CB 3.46Å; Q581-S584 PolarHBondContact O-N 3.15Å; Q581-S584 VanDerWaalsContact O-N 3.09Å
582	S	55.8	Low	69.5	Low	119 Å²	119	81.5 Å²	81.5	83%	0.832	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-14.3	-176.8	49.9	0	0	0	0	116.4	S584	S582-S584 VanDerWaalsContact C-N 3.33Å
583	Q	54.8	Low	68.3	Low	157 Å²	157	85.4 Å²	85.4	73%	0.734	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-21.5	175.4	-72.4	-178.2	-13.7	0	0	113.1	Q581	Q581-Q583 PolarHBondContact O-N 3.44Å
584	S	59.2	Low	66.7	Low	19 Å²	19	90.1 Å²	90.1	13%	0.133	49%	0.492	C	S	.	.	H	α-helix	trans	-69	-40.1	-178.7	165.1	0	0	0	0	113.2	K575 D579 Q581 S582 A586 E587 I588	K575-S584 PolarHBondContact O-OG 3.12Å; D579-S584 WeakPolarHBondContact OD1-CB 3.42Å; D579-S584 PolarHBondContact OD1-OG 3.43Å; Q581-S584 WeakPolarHBondContact O-CB 3.46Å; Q581-S584 PolarHBondContact O-N 3.15Å; Q581-S584 VanDerWaalsContact O-N 3.09Å; S582-S584 VanDerWaalsContact C-N 3.33Å; S584-A586 VanDerWaalsContact C-N 3.31Å; S584-A586 PolarHBondContact O-N 2.94Å; S584-E587 PolarHBondContact O-N 2.8Å; S584-I588 WeakPolarHBondContact O-CG1 3.32Å; S584-I588 PolarHBondContact O-N 3.35Å; S584-I588 WeakPolarHBondContact OG-CD1 3.34Å
585	A	63.6	Low	65.1	Low	51 Å²	51	84.2 Å²	84.2	42%	0.421	47%	0.471	S	S	.	.	H	α-helix	trans	-57.9	-37.7	-175.7	0	0	0	0	0	114.1	T589	A585-T589 WeakPolarHBondContact O-CB 3.43Å; A585-T589 PolarHBondContact O-N 2.96Å; A585-T589 PolarHBondContact O-OG1 3.12Å
586	A	65.5	Low	63.5	Low	72 Å²	72	86.8 Å²	86.8	60%	0.595	50%	0.497	S	S	*	.	H	α-helix	trans	-69.7	-37.1	177.1	0	0	0	0	0	112.2	S584 K590	S584-A586 VanDerWaalsContact C-N 3.31Å; S584-A586 PolarHBondContact O-N 2.94Å; A586-K590 WeakPolarHBondContact O-CB 3.38Å; A586-K590 PolarHBondContact O-N 2.8Å
587	E	66.8	Low	62.2	Low	106 Å²	106	87.5 Å²	87.5	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-70.8	-41.3	175.1	-66.3	-165.6	164.2	0	0	112.4	K575 S584 T589 K590 L591	K575-E587 IonicContact NZ-OE2 3.26Å; K575-E587 PolarHBondContact NZ-OE2 2.74Å; S584-E587 PolarHBondContact O-N 2.8Å; E587-T589 VanDerWaalsContact C-N 3.33Å; E587-K590 PolarHBondContact O-N 3.08Å; E587-L591 WeakPolarHBondContact O-CB 3.41Å; E587-L591 WeakPolarHBondContact O-CG 3.22Å; E587-L591 PolarHBondContact O-N 3.28Å
588	I	64.8	Low	60.9	Low	13 Å²	13	84.1 Å²	84.1	7%	0.067	48%	0.476	C	S	.	.	H	α-helix	trans	-57.7	-48.9	173.3	-68.9	170.7	0	0	0	109.2	K575 M576 S584 K590 L591 L592	K575-I588 HydrophobicContact CB-CD1 4.21Å; K575-I588 HydrophobicContact CB-CG1 3.99Å; M576-I588 HydrophobicContact CE-CG2 4.13Å; M576-I588 HydrophobicContact CG-CD1 4.03Å; S584-I588 WeakPolarHBondContact O-CG1 3.32Å; S584-I588 PolarHBondContact O-N 3.35Å; S584-I588 WeakPolarHBondContact OG-CD1 3.34Å; I588-K590 VanDerWaalsContact C-N 3.3Å; I588-K590 PolarHBondContact O-N 3.28Å; I588-L591 PolarHBondContact O-N 2.94Å; I588-L591 VanDerWaalsContact O-N 3.14Å; I588-L592 HydrophobicContact CG2-CD1 3.68Å; I588-L592 HydrophobicContact CG2-CG 4.25Å; I588-L592 WeakPolarHBondContact O-CB 3.42Å; I588-L592 VanDerWaalsContact O-CG 3.3Å; I588-L592 WeakPolarHBondContact O-CG 3.41Å; I588-L592 PolarHBondContact O-N 2.82Å
589	T	68.5	Low	59.7	Low	92 Å²	92	83.1 Å²	83.1	56%	0.564	48%	0.478	S	S	*	.	H	α-helix	trans	-59.4	-40.2	177.5	-56.9	0	0	0	0	112	A585 E587 S593	A585-T589 WeakPolarHBondContact O-CB 3.43Å; A585-T589 PolarHBondContact O-N 2.96Å; A585-T589 PolarHBondContact O-OG1 3.12Å; E587-T589 VanDerWaalsContact C-N 3.33Å; T589-S593 WeakPolarHBondContact O-CB 3.31Å; T589-S593 PolarHBondContact O-N 3.1Å; T589-S593 PolarHBondContact O-OG 3.29Å
590	K	71.1	Confident	59.4	Low	139 Å²	139	85.5 Å²	85.5	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-69	-35.6	176.3	-172.4	179.5	178.7	-178.2	0	113	A586 E587 I588 S593 N594	A586-K590 WeakPolarHBondContact O-CB 3.38Å; A586-K590 PolarHBondContact O-N 2.8Å; E587-K590 PolarHBondContact O-N 3.08Å; I588-K590 VanDerWaalsContact C-N 3.3Å; I588-K590 PolarHBondContact O-N 3.28Å; K590-S593 WeakPolarHBondContact CA-OG 2.93Å; K590-S593 PolarHBondContact O-OG 3.31Å; K590-N594 WeakPolarHBondContact O-CB 3.49Å; K590-N594 PolarHBondContact O-N 2.99Å; K590-N594 PolarHBondContact O-ND2 3.34Å
591	L	64.8	Low	59.8	Low	57 Å²	57	78.7 Å²	78.7	30%	0.298	47%	0.466	S	S	.	.	H	α-helix	trans	-70.6	-41.7	175.5	-76.9	166.8	0	0	0	111.3	I572 K575 E587 I588 T595	I572-L591 HydrophobicContact CD1-CB 4.41Å; I572-L591 HydrophobicContact CG1-CB 4.15Å; I572-L591 HydrophobicContact CG1-CD1 4.36Å; K575-L591 HydrophobicContact CD-CD1 3.83Å; E587-L591 WeakPolarHBondContact O-CB 3.41Å; E587-L591 WeakPolarHBondContact O-CG 3.22Å; E587-L591 PolarHBondContact O-N 3.28Å; I588-L591 PolarHBondContact O-N 2.94Å; I588-L591 VanDerWaalsContact O-N 3.14Å; L591-T595 VanDerWaalsContact O-CB 3.26Å; L591-T595 WeakPolarHBondContact O-CB 3.17Å; L591-T595 PolarHBondContact O-N 3.44Å; L591-T595 PolarHBondContact O-OG1 2.91Å
592	L	66.6	Low	60.9	Low	49 Å²	49	75.5 Å²	75.5	26%	0.257	46%	0.456	S	S	.	.	H	α-helix	trans	-65.2	-44.2	174.9	-70.2	170.7	0	0	0	111.4	I572 I588 N594 T595 I598	I572-L592 HydrophobicContact CD1-CD2 4.28Å; I572-L592 HydrophobicContact CG2-CD2 4.49Å; I588-L592 HydrophobicContact CG2-CD1 3.68Å; I588-L592 HydrophobicContact CG2-CG 4.25Å; I588-L592 WeakPolarHBondContact O-CB 3.42Å; I588-L592 VanDerWaalsContact O-CG 3.3Å; I588-L592 WeakPolarHBondContact O-CG 3.41Å; I588-L592 PolarHBondContact O-N 2.82Å; L592-N594 PolarHBondContact O-N 2.7Å; L592-T595 CarbonylContact O-C 3.47Å; L592-T595 WeakPolarHBondContact O-CA 3.34Å; L592-T595 PolarHBondContact O-N 2.9Å; L592-I598 HydrophobicContact CD2-CB 3.97Å; L592-I598 HydrophobicContact CD2-CD1 4.23Å; L592-I598 HydrophobicContact CD2-CG2 3.62Å
593	S	62.9	Low	62.1	Low	83 Å²	83	74.9 Å²	74.9	58%	0.58	44%	0.44	S	S	*	.	H	α-helix	trans	-67.6	-35.6	-179.9	65.9	0	0	0	0	113.6	T589 K590 T595	T589-S593 WeakPolarHBondContact O-CB 3.31Å; T589-S593 PolarHBondContact O-N 3.1Å; T589-S593 PolarHBondContact O-OG 3.29Å; K590-S593 WeakPolarHBondContact CA-OG 2.93Å; K590-S593 PolarHBondContact O-OG 3.31Å; S593-T595 PolarHBondContact O-N 3.26Å
594	N	54.4	Low	63.5	Low	116 Å²	116	74.4 Å²	74.4	62%	0.62	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-8.9	171	-72.5	-27.6	0	0	0	113	K590 L592	K590-N594 WeakPolarHBondContact O-CB 3.49Å; K590-N594 PolarHBondContact O-N 2.99Å; K590-N594 PolarHBondContact O-ND2 3.34Å; L592-N594 PolarHBondContact O-N 2.7Å
595	T	55	Low	64.6	Low	10 Å²	10	76.4 Å²	76.4	6%	0.061	45%	0.445	C	S	.	.			trans	-113.8	79.1	177.5	-51.9	0	0	0	0	107.6	L591 L592 S593 L597 I598	L591-T595 VanDerWaalsContact O-CB 3.26Å; L591-T595 WeakPolarHBondContact O-CB 3.17Å; L591-T595 PolarHBondContact O-N 3.44Å; L591-T595 PolarHBondContact O-OG1 2.91Å; L592-T595 CarbonylContact O-C 3.47Å; L592-T595 WeakPolarHBondContact O-CA 3.34Å; L592-T595 PolarHBondContact O-N 2.9Å; S593-T595 PolarHBondContact O-N 3.26Å; T595-L597 HydrophobicContact CG2-CB 3.86Å; T595-L597 HydrophobicContact CG2-CD1 4.42Å; T595-L597 HydrophobicContact CG2-CG 4.32Å; T595-L597 PolarHBondContact O-N 3.09Å; T595-I598 HydrophobicContact CG2-CB 4.33Å; T595-I598 HydrophobicContact CG2-CD1 3.63Å; T595-I598 HydrophobicContact CG2-CG1 3.65Å; T595-I598 PolarHBondContact O-N 3.49Å
596	S	51.7	Low	65.6	Low	115 Å²	115	74 Å²	74	80%	0.804	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	5	169.6	56.1	0	0	0	0	115
597	L	51.5	Low	66.7	Low	60 Å²	60	74.1 Å²	74.1	31%	0.314	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-17.4	-171.1	-48.7	170.9	0	0	0	112.7	N522 T595	N522-L597 WeakPolarHBondContact OD1-CD2 3.16Å; T595-L597 HydrophobicContact CG2-CB 3.86Å; T595-L597 HydrophobicContact CG2-CD1 4.42Å; T595-L597 HydrophobicContact CG2-CG 4.32Å; T595-L597 PolarHBondContact O-N 3.09Å
598	I	52.5	Low	67.7	Low	14 Å²	14	74.9 Å²	74.9	7%	0.072	42%	0.422	C	S	.	.	S	Bend	trans	-104.6	91.6	177	-58.6	166	0	0	0	106.4	I572 L592 T595	I572-I598 HydrophobicContact CD1-CD1 3.28Å; L592-I598 HydrophobicContact CD2-CB 3.97Å; L592-I598 HydrophobicContact CD2-CD1 4.23Å; L592-I598 HydrophobicContact CD2-CG2 3.62Å; T595-I598 HydrophobicContact CG2-CB 4.33Å; T595-I598 HydrophobicContact CG2-CD1 3.63Å; T595-I598 HydrophobicContact CG2-CG1 3.65Å; T595-I598 PolarHBondContact O-N 3.49Å
599	S	54.4	Low	68.6	Low	89 Å²	89	75.6 Å²	75.6	62%	0.622	43%	0.425	S	S	*	.			trans	-53.5	140.6	165.6	50.4	0	0	0	0	108.4	S601	S599-S601 WeakPolarHBondContact O-CA 3.19Å; S599-S601 WeakPolarHBondContact O-CB 3.4Å; S599-S601 PolarHBondContact O-N 3.48Å; S599-S601 PolarHBondContact O-OG 3.28Å
600	S	53.8	Low	69.7	Low	128 Å²	128	72.4 Å²	72.4	90%	0.895	40%	0.404	S	S	*	.	S	Bend	trans	-40.6	93.1	175.8	53.5	0	0	0	0	112.1
601	S	63.7	Low	70.6	Confident	23 Å²	23	68.5 Å²	68.5	16%	0.161	40%	0.398	C	S	.	.			trans	-119.8	145.2	-167.4	54.9	0	0	0	0	109.9	S599 E605 M606	S599-S601 WeakPolarHBondContact O-CA 3.19Å; S599-S601 WeakPolarHBondContact O-CB 3.4Å; S599-S601 PolarHBondContact O-N 3.48Å; S599-S601 PolarHBondContact O-OG 3.28Å; S601-E605 WeakPolarHBondContact CA-OE2 2.84Å; S601-E605 WeakPolarHBondContact CB-OE2 3.45Å; S601-M606 WeakPolarHBondContact OG-CG 3.49Å
602	T	76.7	Confident	71.8	Confident	73 Å²	73	66.8 Å²	66.8	45%	0.448	39%	0.389	S	S	.	.			trans	-63.7	158.4	171.9	59.3	0	0	0	0	110.9	E604 E605 M606	T602-E604 PolarHBondContact O-N 3.16Å; T602-E605 PolarHBondContact N-OE2 3.47Å; T602-E605 PolarHBondContact O-N 2.85Å; T602-E605 VanDerWaalsContact O-N 3.13Å; T602-E605 WeakPolarHBondContact OG1-CG 3.25Å; T602-E605 PolarHBondContact OG1-N 2.88Å; T602-M606 PolarHBondContact O-N 3.09Å; T602-M606 VanDerWaalsContact O-N 3.08Å
603	E	82.5	Confident	73	Confident	107 Å²	107	64.5 Å²	64.5	50%	0.5	38%	0.377	S	S	.	.	H	α-helix	trans	-53	-41	173.4	-174.8	-179.7	174.6	0	0	111.3	L573 E605 M606 V607	L573-E603 HydrophobicContact CD2-CG 4.01Å; E603-E605 PolarHBondContact O-N 2.8Å; E603-M606 WeakPolarHBondContact O-CB 2.92Å; E603-M606 PolarHBondContact O-N 2.71Å; E603-V607 WeakPolarHBondContact O-CG2 3.44Å; E603-V607 PolarHBondContact O-N 3.08Å
604	E	84.4	Confident	74.5	Confident	147 Å²	147	62.3 Å²	62.3	69%	0.687	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-44.3	176.8	-64.8	-177	177.2	0	0	113	T602 M606 V607 Q608	T602-E604 PolarHBondContact O-N 3.16Å; E604-M606 VanDerWaalsContact C-N 3.34Å; E604-V607 PolarHBondContact O-N 3.23Å; E604-Q608 WeakPolarHBondContact O-CG 3.34Å; E604-Q608 PolarHBondContact O-N 3.48Å
605	E	82.2	Confident	76.3	Confident	60 Å²	60	61.4 Å²	61.4	28%	0.28	35%	0.35	S	S	.	.	H	α-helix	trans	-66.3	-37.2	177.2	-76.4	-175	122.7	0	0	112.2	K525 S601 T602 E603 Q608 E609	K525-E605 IonicContact NZ-OE1 3.72Å; K525-E605 PolarHBondContact NZ-OE1 3.14Å; S601-E605 WeakPolarHBondContact CA-OE2 2.84Å; S601-E605 WeakPolarHBondContact CB-OE2 3.45Å; T602-E605 PolarHBondContact N-OE2 3.47Å; T602-E605 PolarHBondContact O-N 2.85Å; T602-E605 VanDerWaalsContact O-N 3.13Å; T602-E605 WeakPolarHBondContact OG1-CG 3.25Å; T602-E605 PolarHBondContact OG1-N 2.88Å; E603-E605 PolarHBondContact O-N 2.8Å; E605-Q608 PolarHBondContact O-N 3.11Å; E605-E609 PolarHBondContact O-N 3.26Å
606	M	84.1	Confident	78.1	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.6	-40	175.3	-75.2	-171.4	66.5	0	0	112.2	T569 I572 L573 M576 S601 T602 E603 E604 Q608 E609 L610	T569-M606 HydrophobicContact CG2-CE 4.15Å; I572-M606 HydrophobicContact CB-CE 3.68Å; I572-M606 HydrophobicContact CG2-CE 3.34Å; I572-M606 HydrophobicContact CG2-SD 4.07Å; L573-M606 HydrophobicContact CD1-CB 4.44Å; L573-M606 HydrophobicContact CD2-CB 3.74Å; L573-M606 HydrophobicContact CD2-CE 4.25Å; L573-M606 HydrophobicContact CD2-SD 4.41Å; L573-M606 HydrophobicContact CG-CB 4.22Å; L573-M606 HydrophobicContact CG-CE 3.98Å; M576-M606 HydrophobicContact CE-SD 3.75Å; M576-M606 HydrophobicContact SD-SD 3.92Å; S601-M606 WeakPolarHBondContact OG-CG 3.49Å; T602-M606 PolarHBondContact O-N 3.09Å; T602-M606 VanDerWaalsContact O-N 3.08Å; E603-M606 WeakPolarHBondContact O-CB 2.92Å; E603-M606 PolarHBondContact O-N 2.71Å; E604-M606 VanDerWaalsContact C-N 3.34Å; M606-Q608 VanDerWaalsContact C-N 3.34Å; M606-E609 PolarHBondContact O-N 3.21Å; M606-L610 WeakPolarHBondContact O-CB 3.4Å; M606-L610 PolarHBondContact O-N 2.78Å
607	V	88.4	Confident	80.2	Confident	76 Å²	76	56 Å²	56	46%	0.461	31%	0.312	S	S	.	.	H	α-helix	trans	-63.2	-41.6	174.6	170.9	0	0	0	0	110.6	L573 E603 E604 L610 A611	L573-V607 HydrophobicContact CD1-CG2 4.21Å; L573-V607 HydrophobicContact CD2-CG2 4.07Å; E603-V607 WeakPolarHBondContact O-CG2 3.44Å; E603-V607 PolarHBondContact O-N 3.08Å; E604-V607 PolarHBondContact O-N 3.23Å; V607-L610 PolarHBondContact O-N 3.23Å; V607-A611 PolarHBondContact O-N 3.35Å
608	Q	87	Confident	82.4	Confident	121 Å²	121	56.8 Å²	56.8	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-64.5	-42	174.6	-70.2	175.6	18.6	0	0	112.3	E604 E605 M606 L610 A611 L612	E604-Q608 WeakPolarHBondContact O-CG 3.34Å; E604-Q608 PolarHBondContact O-N 3.48Å; E605-Q608 PolarHBondContact O-N 3.11Å; M606-Q608 VanDerWaalsContact C-N 3.34Å; Q608-L610 VanDerWaalsContact C-N 3.35Å; Q608-A611 PolarHBondContact O-N 3.06Å; Q608-L612 WeakPolarHBondContact O-CG 3.39Å; Q608-L612 PolarHBondContact O-N 3.33Å; Q608-L612 VanDerWaalsContact O-N 3.1Å
609	E	84.9	Confident	84.4	Confident	29 Å²	29	57.2 Å²	57.2	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-43.9	175.2	-173.9	-173.8	145.7	0	0	111.3	L524 R565 E605 M606 L612 L613	L524-E609 HydrophobicContact CD1-CG 4.48Å; R565-E609 IonicContact CZ-OE1 3.1Å; R565-E609 IonicContact NE-OE1 2.86Å; R565-E609 PolarHBondContact NE-OE1 3.09Å; R565-E609 VanDerWaalsContact NH2-CD 3.34Å; R565-E609 IonicContact NH2-OE1 3.11Å; R565-E609 PolarHBondContact NH2-OE1 2.9Å; R565-E609 IonicContact NH2-OE2 3.73Å; E605-E609 PolarHBondContact O-N 3.26Å; M606-E609 PolarHBondContact O-N 3.21Å; E609-L612 PolarHBondContact O-N 2.95Å; E609-L613 WeakPolarHBondContact O-CB 3.42Å; E609-L613 PolarHBondContact O-N 3.5Å
610	L	90.5	Very high	86.5	Confident	24 Å²	24	53 Å²	53	13%	0.126	28%	0.283	C	S	.	.	H	α-helix	trans	-59.3	-47.8	177.1	179.4	61.4	0	0	0	111	H566 T569 V570 L573 M606 V607 Q608 L612 L613 E614	H566-L610 VanDerWaalsContact CD2-CD1 3.47Å; H566-L610 WeakPolarHBondContact CD2-CD1 3.12Å; T569-L610 HydrophobicContact CG2-CB 4.08Å; T569-L610 HydrophobicContact CG2-CD1 4.42Å; V570-L610 HydrophobicContact CG2-CD1 3.68Å; V570-L610 HydrophobicContact CG2-CD2 3.92Å; V570-L610 HydrophobicContact CG2-CG 4.48Å; L573-L610 HydrophobicContact CD1-CB 4.4Å; L573-L610 HydrophobicContact CD1-CD2 3.8Å; M606-L610 WeakPolarHBondContact O-CB 3.4Å; M606-L610 PolarHBondContact O-N 2.78Å; V607-L610 PolarHBondContact O-N 3.23Å; Q608-L610 VanDerWaalsContact C-N 3.35Å; L610-L612 VanDerWaalsContact C-N 3.34Å; L610-L612 PolarHBondContact O-N 3.42Å; L610-L613 WeakPolarHBondContact O-CB 3.3Å; L610-L613 PolarHBondContact O-N 2.87Å; L610-L613 VanDerWaalsContact O-N 3.15Å; L610-E614 HydrophobicContact CD1-CG 4.43Å; L610-E614 WeakPolarHBondContact O-CG 3.5Å; L610-E614 PolarHBondContact O-N 2.97Å
611	A	90.5	Very high	88.6	Confident	57 Å²	57	46.9 Å²	46.9	47%	0.471	24%	0.24	S	C	.	.	H	α-helix	trans	-59.2	-43	178.3	0	0	0	0	0	112.5	V607 Q608 L613 E614 E615	V607-A611 PolarHBondContact O-N 3.35Å; Q608-A611 PolarHBondContact O-N 3.06Å; A611-L613 VanDerWaalsContact C-N 3.35Å; A611-E614 PolarHBondContact O-N 2.87Å; A611-E615 PolarHBondContact O-N 3.16Å
612	L	89.2	Confident	90.2	Very high	22 Å²	22	47.4 Å²	47.4	12%	0.115	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-40.7	175.7	-69.7	171.7	0	0	0	112	K527 Q608 E609 L610 E614 E615 V616	K527-L612 HydrophobicContact CD-CD2 3.9Å; K527-L612 HydrophobicContact CG-CD2 4.11Å; Q608-L612 WeakPolarHBondContact O-CG 3.39Å; Q608-L612 PolarHBondContact O-N 3.33Å; Q608-L612 VanDerWaalsContact O-N 3.1Å; E609-L612 PolarHBondContact O-N 2.95Å; L610-L612 VanDerWaalsContact C-N 3.34Å; L610-L612 PolarHBondContact O-N 3.42Å; L612-E614 VanDerWaalsContact C-N 3.35Å; L612-E615 PolarHBondContact O-N 3.23Å; L612-V616 VanDerWaalsContact O-CG2 3.31Å; L612-V616 WeakPolarHBondContact O-CG2 3.49Å; L612-V616 PolarHBondContact O-N 3.16Å
613	L	91.8	Very high	91.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.6	-41.4	178.1	-175.4	55.8	0	0	0	111.6	L562 R565 H566 E609 L610 A611 E615 V616 I617	L562-L613 HydrophobicContact CB-CD1 3.92Å; L562-L613 HydrophobicContact CD2-CD1 3.46Å; L562-L613 VanDerWaalsContact CD2-CD1 3.46Å; L562-L613 HydrophobicContact CG-CD1 4.28Å; R565-L613 HydrophobicContact CB-CD2 3.92Å; R565-L613 HydrophobicContact CG-CD2 3.77Å; H566-L613 HydrophobicContact CB-CD2 3.68Å; H566-L613 HydrophobicContact CB-CG 4.07Å; H566-L613 VanDerWaalsContact N-CD2 3.28Å; E609-L613 WeakPolarHBondContact O-CB 3.42Å; E609-L613 PolarHBondContact O-N 3.5Å; L610-L613 WeakPolarHBondContact O-CB 3.3Å; L610-L613 PolarHBondContact O-N 2.87Å; L610-L613 VanDerWaalsContact O-N 3.15Å; A611-L613 VanDerWaalsContact C-N 3.35Å; L613-E615 VanDerWaalsContact C-N 3.35Å; L613-V616 PolarHBondContact O-N 3.19Å; L613-I617 HydrophobicContact CD1-CD1 4.1Å; L613-I617 HydrophobicContact CD1-CG1 4.35Å; L613-I617 HydrophobicContact CG-CD1 3.93Å; L613-I617 WeakPolarHBondContact O-CB 3.24Å; L613-I617 WeakPolarHBondContact O-CD1 3.17Å; L613-I617 WeakPolarHBondContact O-CG1 3.3Å; L613-I617 PolarHBondContact O-N 3.49Å
614	E	94.2	Very high	91.9	Very high	37 Å²	37	38.9 Å²	38.9	17%	0.173	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-42	173.3	-70.1	-174.3	-158.7	0	0	112.2	H566 L610 A611 L612 I617 R618 H655 S657 F658	H566-E614 IonicContact NE2-OE1 3.61Å; L610-E614 HydrophobicContact CD1-CG 4.43Å; L610-E614 WeakPolarHBondContact O-CG 3.5Å; L610-E614 PolarHBondContact O-N 2.97Å; A611-E614 PolarHBondContact O-N 2.87Å; L612-E614 VanDerWaalsContact C-N 3.35Å; E614-I617 PolarHBondContact O-N 3.29Å; E614-R618 VanDerWaalsContact O-CB 3.24Å; E614-R618 WeakPolarHBondContact O-CB 3.24Å; E614-R618 PolarHBondContact O-N 2.64Å; E614-H655 IonicContact OE1-CE1 3.94Å; E614-H655 IonicContact OE1-NE2 3.98Å; E614-H655 IonicContact OE2-CE1 2.99Å; E614-H655 PolarHBondContact OE2-CE1 3.35Å; E614-S657 PolarHBondContact OE2-OG 2.74Å; E614-F658 HydrophobicContact CB-CE1 4.45Å; E614-F658 HydrophobicContact CB-CZ 3.93Å; E614-F658 HydrophobicContact CG-CE2 4.46Å; E614-F658 HydrophobicContact CG-CZ 3.86Å
615	E	93	Very high	92.5	Very high	98 Å²	98	32 Å²	32	46%	0.458	16%	0.163	S	C	.	.	H	α-helix	trans	-61.5	-46.5	177.3	-171.8	179.7	178.1	0	0	111.8	A611 L612 L613 R618 M619	A611-E615 PolarHBondContact O-N 3.16Å; L612-E615 PolarHBondContact O-N 3.23Å; L613-E615 VanDerWaalsContact C-N 3.35Å; E615-R618 PolarHBondContact O-N 3.46Å; E615-M619 WeakPolarHBondContact O-CB 3.5Å; E615-M619 PolarHBondContact O-N 3.12Å
616	V	93.5	Very high	93.2	Very high	10 Å²	10	29.6 Å²	29.6	6%	0.061	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-44.6	177.7	175.4	0	0	0	0	111.1	L534 L562 L612 L613 M619 L620	L534-V616 HydrophobicContact CD1-CB 4.37Å; L534-V616 HydrophobicContact CD1-CG1 4.2Å; L534-V616 HydrophobicContact CD1-CG2 4.09Å; L562-V616 HydrophobicContact CD1-CG1 3.8Å; L562-V616 HydrophobicContact CD2-CG1 4.43Å; L612-V616 VanDerWaalsContact O-CG2 3.31Å; L612-V616 WeakPolarHBondContact O-CG2 3.49Å; L612-V616 PolarHBondContact O-N 3.16Å; L613-V616 PolarHBondContact O-N 3.19Å; V616-M619 PolarHBondContact O-N 2.86Å; V616-L620 HydrophobicContact CG1-CD1 4.3Å; V616-L620 WeakPolarHBondContact O-CG 3.5Å; V616-L620 PolarHBondContact O-N 2.82Å
617	I	96.1	Very high	93.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.9	-48	177	-72.3	168.3	0	0	0	110.4	L559 L562 I563 H566 L613 E614 M619 L620 L621 L652 F658	L559-I617 HydrophobicContact CD1-CB 4.44Å; L559-I617 HydrophobicContact CD1-CG1 4.45Å; L559-I617 HydrophobicContact CD1-CG2 3.96Å; L562-I617 HydrophobicContact CB-CD1 4.03Å; L562-I617 HydrophobicContact CB-CG1 3.63Å; L562-I617 HydrophobicContact CD1-CG1 4.42Å; I563-I617 HydrophobicContact CG1-CD1 4.34Å; I563-I617 HydrophobicContact CG1-CG2 4.47Å; H566-I617 HydrophobicContact CB-CD1 3.76Å; L613-I617 HydrophobicContact CD1-CD1 4.1Å; L613-I617 HydrophobicContact CD1-CG1 4.35Å; L613-I617 HydrophobicContact CG-CD1 3.93Å; L613-I617 WeakPolarHBondContact O-CB 3.24Å; L613-I617 WeakPolarHBondContact O-CD1 3.17Å; L613-I617 WeakPolarHBondContact O-CG1 3.3Å; L613-I617 PolarHBondContact O-N 3.49Å; E614-I617 PolarHBondContact O-N 3.29Å; I617-M619 PolarHBondContact O-N 3.46Å; I617-L620 PolarHBondContact O-N 3.49Å; I617-L621 HydrophobicContact CG2-CD1 3.87Å; I617-L621 HydrophobicContact CG2-CG 4.49Å; I617-L621 WeakPolarHBondContact O-CG 3.31Å; I617-L621 PolarHBondContact O-N 2.92Å; I617-L652 HydrophobicContact CG2-CD1 3.94Å; I617-F658 HydrophobicContact CB-CE1 3.99Å; I617-F658 HydrophobicContact CB-CZ 4.18Å; I617-F658 HydrophobicContact CG2-CD1 4.06Å; I617-F658 HydrophobicContact CG2-CE1 3.56Å; I617-F658 HydrophobicContact CG2-CZ 3.83Å
618	R	96	Very high	94.2	Very high	78 Å²	78	26.1 Å²	26.1	29%	0.294	13%	0.132	S	C	.	.	H	α-helix	trans	-58.8	-47.3	178.8	-177.2	-173.8	61.4	78	3.3	110.8	E614 E615 L620 L621 E622 F658	E614-R618 VanDerWaalsContact O-CB 3.24Å; E614-R618 WeakPolarHBondContact O-CB 3.24Å; E614-R618 PolarHBondContact O-N 2.64Å; E615-R618 PolarHBondContact O-N 3.46Å; R618-L620 PolarHBondContact O-N 3.01Å; R618-L621 WeakPolarHBondContact O-CB 3.5Å; R618-L621 PolarHBondContact O-N 3.37Å; R618-L621 VanDerWaalsContact O-N 3.17Å; R618-E622 WeakPolarHBondContact CG-OE1 3.45Å; R618-E622 IonicContact CZ-OE1 3.88Å; R618-E622 IonicContact NH1-OE1 3.49Å; R618-E622 PolarHBondContact NH1-OE1 2.9Å; R618-E622 IonicContact NH1-OE2 2.8Å; R618-E622 PolarHBondContact NH1-OE2 3.25Å; R618-E622 WeakPolarHBondContact O-CG 3.46Å; R618-E622 PolarHBondContact O-N 3.05Å; R618-F658 HydrophobicContact CB-CD1 4.36Å; R618-F658 HydrophobicContact CB-CE1 4.11Å
619	M	95.7	Very high	94.5	Very high	22 Å²	22	22.9 Å²	22.9	11%	0.108	12%	0.12	C	C	.	.	H	α-helix	trans	-62.2	-41.2	179.2	-174.5	55.9	68.4	0	0	112.2	L534 E615 V616 I617 L621 E622 I623 F715	L534-M619 HydrophobicContact CB-CG 3.81Å; L534-M619 HydrophobicContact CD1-CB 4.15Å; L534-M619 HydrophobicContact CD1-CG 4.04Å; L534-M619 HydrophobicContact CD2-CB 4.4Å; L534-M619 HydrophobicContact CD2-CG 4.05Å; L534-M619 HydrophobicContact CG-CG 4.18Å; E615-M619 WeakPolarHBondContact O-CB 3.5Å; E615-M619 PolarHBondContact O-N 3.12Å; V616-M619 PolarHBondContact O-N 2.86Å; I617-M619 PolarHBondContact O-N 3.46Å; M619-L621 VanDerWaalsContact C-N 3.35Å; M619-L621 PolarHBondContact O-N 3.5Å; M619-E622 PolarHBondContact O-N 3.37Å; M619-I623 HydrophobicContact CG-CD1 4.16Å; M619-I623 WeakPolarHBondContact O-CD1 3.38Å; M619-I623 VanDerWaalsContact O-CG1 3.28Å; M619-I623 WeakPolarHBondContact O-CG1 3.44Å; M619-I623 PolarHBondContact O-N 3.17Å; M619-F715 HydrophobicContact CE-CZ 3.83Å; M619-F715 HydrophobicContact SD-CE2 4.5Å; M619-F715 HydrophobicContact SD-CZ 4.24Å
620	L	97.4	Very high	94.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-37.2	174.4	-73.6	173.9	0	0	0	112.8	L534 L537 L555 L558 L559 L562 V616 I617 R618 E622 I623 I624	L534-L620 HydrophobicContact CD2-CD2 3.79Å; L534-L620 HydrophobicContact CD2-CG 3.95Å; L537-L620 HydrophobicContact CD1-CD2 4.39Å; L555-L620 HydrophobicContact CD1-CD2 4.07Å; L558-L620 HydrophobicContact CD2-CD1 4.04Å; L558-L620 HydrophobicContact CG-CD1 4.15Å; L559-L620 HydrophobicContact CD1-CB 4.17Å; L559-L620 HydrophobicContact CD1-CD1 4.44Å; L562-L620 HydrophobicContact CD1-CD1 3.31Å; V616-L620 HydrophobicContact CG1-CD1 4.3Å; V616-L620 WeakPolarHBondContact O-CG 3.5Å; V616-L620 PolarHBondContact O-N 2.82Å; I617-L620 PolarHBondContact O-N 3.49Å; R618-L620 PolarHBondContact O-N 3.01Å; L620-E622 VanDerWaalsContact C-N 3.35Å; L620-I623 HydrophobicContact CD2-CD1 4.19Å; L620-I623 PolarHBondContact O-N 3.1Å; L620-I624 WeakPolarHBondContact O-CG1 3.3Å; L620-I624 PolarHBondContact O-N 3.17Å
621	L	97.8	Very high	95.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.7	-37.9	173.2	-71.3	167.8	0	0	0	111.5	L559 I617 R618 M619 I624 N625 F649 L652 F658 V661 L662 I665	L559-L621 HydrophobicContact CD1-CG 4.36Å; L559-L621 HydrophobicContact CD2-CD2 3.7Å; L559-L621 HydrophobicContact CD2-CG 4.22Å; I617-L621 HydrophobicContact CG2-CD1 3.87Å; I617-L621 HydrophobicContact CG2-CG 4.49Å; I617-L621 WeakPolarHBondContact O-CG 3.31Å; I617-L621 PolarHBondContact O-N 2.92Å; R618-L621 WeakPolarHBondContact O-CB 3.5Å; R618-L621 PolarHBondContact O-N 3.37Å; R618-L621 VanDerWaalsContact O-N 3.17Å; M619-L621 VanDerWaalsContact C-N 3.35Å; M619-L621 PolarHBondContact O-N 3.5Å; L621-I624 PolarHBondContact O-N 2.93Å; L621-N625 WeakPolarHBondContact O-CB 3.44Å; L621-N625 PolarHBondContact O-N 3.09Å; L621-N625 PolarHBondContact O-ND2 3.25Å; L621-F649 HydrophobicContact CD2-CE1 4.39Å; L621-L652 HydrophobicContact CD1-CD1 4.1Å; L621-F658 HydrophobicContact CD1-CB 4.39Å; L621-F658 HydrophobicContact CD1-CD1 3.98Å; L621-F658 HydrophobicContact CD1-CG 4.4Å; L621-V661 HydrophobicContact CB-CB 4.1Å; L621-V661 HydrophobicContact CB-CG2 3.82Å; L621-V661 HydrophobicContact CD1-CG2 3.77Å; L621-V661 HydrophobicContact CG-CG2 4.42Å; L621-L662 HydrophobicContact CD1-CD2 4.36Å; L621-L662 HydrophobicContact CD1-CG 4.35Å; L621-L662 HydrophobicContact CD2-CD2 3.77Å; L621-I665 HydrophobicContact CD2-CD1 3.6Å
622	E	97.2	Very high	95.4	Very high	34 Å²	34	23.6 Å²	23.6	16%	0.159	11%	0.114	C	C	.	.	H	α-helix	trans	-65.6	-41.9	173.9	-73.3	170.5	-172.8	0	0	111.8	R618 M619 L620 I624 N625 S626 V661 L713	R618-E622 WeakPolarHBondContact CG-OE1 3.45Å; R618-E622 IonicContact CZ-OE1 3.88Å; R618-E622 IonicContact NH1-OE1 3.49Å; R618-E622 PolarHBondContact NH1-OE1 2.9Å; R618-E622 IonicContact NH1-OE2 2.8Å; R618-E622 PolarHBondContact NH1-OE2 3.25Å; R618-E622 WeakPolarHBondContact O-CG 3.46Å; R618-E622 PolarHBondContact O-N 3.05Å; M619-E622 PolarHBondContact O-N 3.37Å; L620-E622 VanDerWaalsContact C-N 3.35Å; E622-I624 PolarHBondContact O-N 2.8Å; E622-N625 WeakPolarHBondContact O-CB 3.39Å; E622-N625 PolarHBondContact O-N 3.49Å; E622-S626 PolarHBondContact O-N 3.06Å; E622-V661 HydrophobicContact CG-CG1 3.75Å; E622-L713 HydrophobicContact CB-CD1 4.19Å; E622-L713 HydrophobicContact CB-CD2 4.41Å
623	I	98	Very high	95.7	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-57.9	-47.6	172.8	-72.9	159.6	0	0	0	110.7	L534 L537 A538 M619 L620 N625 S626 I627 L713	L534-I623 HydrophobicContact CD2-CD1 4.2Å; L537-I623 HydrophobicContact CB-CD1 3.71Å; L537-I623 HydrophobicContact CB-CG1 4.48Å; A538-I623 HydrophobicContact CB-CD1 4.35Å; A538-I623 HydrophobicContact CB-CG1 4.02Å; M619-I623 HydrophobicContact CG-CD1 4.16Å; M619-I623 WeakPolarHBondContact O-CD1 3.38Å; M619-I623 VanDerWaalsContact O-CG1 3.28Å; M619-I623 WeakPolarHBondContact O-CG1 3.44Å; M619-I623 PolarHBondContact O-N 3.17Å; L620-I623 HydrophobicContact CD2-CD1 4.19Å; L620-I623 PolarHBondContact O-N 3.1Å; I623-N625 VanDerWaalsContact C-N 3.34Å; I623-N625 PolarHBondContact O-N 2.98Å; I623-S626 WeakPolarHBondContact O-CB 3.18Å; I623-S626 PolarHBondContact O-N 2.94Å; I623-I627 HydrophobicContact CG2-CD1 4.37Å; I623-I627 WeakPolarHBondContact O-CG1 3.39Å; I623-I627 PolarHBondContact O-N 2.88Å; I623-I627 VanDerWaalsContact O-N 3.09Å; I623-L713 HydrophobicContact CG1-CD1 4.18Å
624	I	97.9	Very high	95.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-43.3	176.6	-70.1	166	0	0	0	110.4	L555 L559 L620 L621 E622 S626 I627 L628 L642 I665	L555-I624 HydrophobicContact CD2-CG1 4.21Å; L559-I624 HydrophobicContact CD2-CD1 3.55Å; L620-I624 WeakPolarHBondContact O-CG1 3.3Å; L620-I624 PolarHBondContact O-N 3.17Å; L621-I624 PolarHBondContact O-N 2.93Å; E622-I624 PolarHBondContact O-N 2.8Å; I624-S626 VanDerWaalsContact C-N 3.3Å; I624-S626 PolarHBondContact O-N 2.87Å; I624-I627 PolarHBondContact O-N 3.41Å; I624-L628 HydrophobicContact CG2-CD1 3.96Å; I624-L628 HydrophobicContact CG2-CG 4.18Å; I624-L628 VanDerWaalsContact O-CG 3.31Å; I624-L628 WeakPolarHBondContact O-CG 3.39Å; I624-L628 PolarHBondContact O-N 3.01Å; I624-L642 HydrophobicContact CD1-CD2 4.33Å; I624-L642 HydrophobicContact CG2-CD1 3.99Å; I624-L642 HydrophobicContact CG2-CD2 4.29Å; I624-I665 HydrophobicContact CB-CD1 4.5Å; I624-I665 HydrophobicContact CG2-CD1 3.97Å; I624-I665 HydrophobicContact CG2-CG1 4.2Å
625	N	96.7	Very high	96.1	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.011	14%	0.142	C	C	.	.	H	α-helix	trans	-58.9	-40.8	175.7	-87.2	-62.9	0	0	0	112.9	L621 E622 I623 L628 T629 V661 N664 F710	L621-N625 WeakPolarHBondContact O-CB 3.44Å; L621-N625 PolarHBondContact O-N 3.09Å; L621-N625 PolarHBondContact O-ND2 3.25Å; E622-N625 WeakPolarHBondContact O-CB 3.39Å; E622-N625 PolarHBondContact O-N 3.49Å; I623-N625 VanDerWaalsContact C-N 3.34Å; I623-N625 PolarHBondContact O-N 2.98Å; N625-L628 PolarHBondContact O-N 3.34Å; N625-T629 VanDerWaalsContact O-CB 3.26Å; N625-T629 WeakPolarHBondContact O-CB 3.37Å; N625-T629 PolarHBondContact O-N 3.25Å; N625-T629 PolarHBondContact O-OG1 3.31Å; N625-V661 PolarHBondContact ND2-O 3.14Å; N625-N664 WeakPolarHBondContact OD1-CB 3.22Å; N625-F710 HydrophobicContact CB-CD2 4.37Å
626	S	96.9	Very high	96.3	Very high	10 Å²	10	23.7 Å²	23.7	7%	0.07	13%	0.127	C	C	.	.	H	α-helix	trans	-60.5	-47.1	175.5	175.2	0	0	0	0	111	S541 E622 I623 I624 L628 T629 H630	S541-S626 WeakPolarHBondContact CB-OG 3.28Å; S541-S626 WeakPolarHBondContact OG-CB 3.27Å; S541-S626 PolarHBondContact OG-OG 2.96Å; E622-S626 PolarHBondContact O-N 3.06Å; I623-S626 WeakPolarHBondContact O-CB 3.18Å; I623-S626 PolarHBondContact O-N 2.94Å; I624-S626 VanDerWaalsContact C-N 3.3Å; I624-S626 PolarHBondContact O-N 2.87Å; S626-L628 PolarHBondContact O-N 2.77Å; S626-T629 PolarHBondContact O-N 3.24Å; S626-T629 VanDerWaalsContact O-N 3.16Å; S626-H630 PolarHBondContact O-CD2 2.7Å; S626-H630 PolarHBondContact O-N 3.01Å
627	I	97	Very high	96.5	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-60.2	-45.9	175	-58.4	164.7	0	0	0	110.7	S541 I544 L555 I623 I624 T629 T631 M632 N635 L638	S541-I627 WeakPolarHBondContact O-CG1 3.37Å; I544-I627 HydrophobicContact CB-CG1 4.38Å; I544-I627 HydrophobicContact CD1-CD1 3.76Å; I544-I627 HydrophobicContact CD1-CG1 4.09Å; L555-I627 HydrophobicContact CD2-CD1 4.3Å; I623-I627 HydrophobicContact CG2-CD1 4.37Å; I623-I627 WeakPolarHBondContact O-CG1 3.39Å; I623-I627 PolarHBondContact O-N 2.88Å; I623-I627 VanDerWaalsContact O-N 3.09Å; I624-I627 PolarHBondContact O-N 3.41Å; I627-T629 VanDerWaalsContact C-N 3.25Å; I627-T629 PolarHBondContact O-N 3.26Å; I627-T631 CarbonylContact O-C 3.57Å; I627-T631 PolarHBondContact O-N 3.32Å; I627-T631 PolarHBondContact O-OG1 2.87Å; I627-M632 PolarHBondContact O-N 2.94Å; I627-N635 HydrophobicContact CG2-CB 4.36Å; I627-L638 HydrophobicContact CB-CD2 3.96Å; I627-L638 HydrophobicContact CD1-CD2 3.97Å; I627-L638 HydrophobicContact CG2-CD2 3.46Å; I627-L638 VanDerWaalsContact CG2-CD2 3.46Å
628	L	95.8	Very high	96.6	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-64.4	-29.5	178.9	-68.2	-179.2	0	0	0	113	I624 N625 S626 M632 I639 L642 I665 V668	I624-L628 HydrophobicContact CG2-CD1 3.96Å; I624-L628 HydrophobicContact CG2-CG 4.18Å; I624-L628 VanDerWaalsContact O-CG 3.31Å; I624-L628 WeakPolarHBondContact O-CG 3.39Å; I624-L628 PolarHBondContact O-N 3.01Å; N625-L628 PolarHBondContact O-N 3.34Å; S626-L628 PolarHBondContact O-N 2.77Å; L628-M632 HydrophobicContact CD2-CG 4.36Å; L628-M632 HydrophobicContact CD2-SD 4.15Å; L628-M632 VanDerWaalsContact O-CB 3.28Å; L628-M632 WeakPolarHBondContact O-CB 3.28Å; L628-M632 WeakPolarHBondContact O-CE 3.25Å; L628-I639 HydrophobicContact CD2-CD1 3.34Å; L628-L642 HydrophobicContact CD1-CD1 4.35Å; L628-L642 HydrophobicContact CD2-CD1 4.3Å; L628-I665 HydrophobicContact CD1-CG1 3.82Å; L628-V668 HydrophobicContact CD1-CG2 4.4Å; L628-V668 HydrophobicContact CD2-CG1 4.41Å
629	T	94.5	Very high	96.7	Very high	52 Å²	52	21.5 Å²	21.5	32%	0.319	12%	0.121	S	C	.	.	H	α-helix	trans	-84.2	-41.2	-178.1	-58.1	0	0	0	0	111.7	N625 S626 I627	N625-T629 VanDerWaalsContact O-CB 3.26Å; N625-T629 WeakPolarHBondContact O-CB 3.37Å; N625-T629 PolarHBondContact O-N 3.25Å; N625-T629 PolarHBondContact O-OG1 3.31Å; S626-T629 PolarHBondContact O-N 3.24Å; S626-T629 VanDerWaalsContact O-N 3.16Å; I627-T629 VanDerWaalsContact C-N 3.25Å; I627-T629 PolarHBondContact O-N 3.26Å
630	H	93.9	Very high	96.8	Very high	95 Å²	95	23.4 Å²	23.4	44%	0.44	13%	0.128	S	C	.	.	H	α-helix	trans	-101.9	-35.5	-170.4	-63.6	-74.6	0	0	0	114	P542 S626 D712	P542-H630 HydrophobicContact CB-CB 4.09Å; S626-H630 PolarHBondContact O-CD2 2.7Å; S626-H630 PolarHBondContact O-N 3.01Å; H630-D712 IonicContact CE1-OD1 3.51Å; H630-D712 IonicContact NE2-OD1 2.82Å
631	T	95.5	Very high	96.8	Very high	16 Å²	16	23.8 Å²	23.8	10%	0.098	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.7	16.1	-168.3	62	0	0	0	0	114.2	P542 I544 T545 I627 V633 S634 N635	P542-T631 WeakPolarHBondContact O-CG2 3.49Å; I544-T631 WeakPolarHBondContact O-CB 2.87Å; I544-T631 PolarHBondContact O-OG1 3.22Å; T545-T631 HydrophobicContact CG2-CG2 4.46Å; I627-T631 CarbonylContact O-C 3.57Å; I627-T631 PolarHBondContact O-N 3.32Å; I627-T631 PolarHBondContact O-OG1 2.87Å; T631-V633 VanDerWaalsContact C-N 3.26Å; T631-V633 PolarHBondContact O-N 3.33Å; T631-V633 VanDerWaalsContact O-N 3.16Å; T631-S634 PolarHBondContact O-N 3.24Å; T631-N635 PolarHBondContact O-ND2 3.29Å; T631-N635 PolarHBondContact OG1-ND2 3.37Å
632	M	95.6	Very high	96.8	Very high	14 Å²	14	23.9 Å²	23.9	7%	0.069	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-48.7	-46.7	-178.7	176.7	164.9	46.3	0	0	112.9	I627 L628 S634 N635 I639 V668 I698 T701 L707	I627-M632 PolarHBondContact O-N 2.94Å; L628-M632 HydrophobicContact CD2-CG 4.36Å; L628-M632 HydrophobicContact CD2-SD 4.15Å; L628-M632 VanDerWaalsContact O-CB 3.28Å; L628-M632 WeakPolarHBondContact O-CB 3.28Å; L628-M632 WeakPolarHBondContact O-CE 3.25Å; M632-S634 PolarHBondContact O-N 3.33Å; M632-S634 VanDerWaalsContact O-N 3.1Å; M632-N635 PolarHBondContact O-N 3.44Å; M632-I639 HydrophobicContact CG-CD1 4.05Å; M632-I639 HydrophobicContact CG-CG1 4.45Å; M632-I639 HydrophobicContact SD-CD1 4.11Å; M632-V668 HydrophobicContact SD-CG1 3.94Å; M632-V668 HydrophobicContact SD-CG2 4.08Å; M632-I698 HydrophobicContact CG-CD1 4.31Å; M632-I698 HydrophobicContact CG-CG1 4.16Å; M632-I698 WeakPolarHBondContact O-CD1 3.32Å; M632-T701 VanDerWaalsContact CE-CB 3.41Å; M632-T701 HydrophobicContact CE-CG2 3.97Å; M632-T701 VanDerWaalsContact CE-OG1 3.23Å; M632-T701 WeakPolarHBondContact CE-OG1 3.32Å; M632-T701 HydrophobicContact SD-CG2 4.13Å; M632-L707 HydrophobicContact CE-CD1 4.35Å
633	V	95.6	Very high	96.8	Very high	81 Å²	81	23.2 Å²	23.2	49%	0.491	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-56.3	-29.7	-178.6	-179.1	0	0	0	0	112.5	T631 I698	T631-V633 VanDerWaalsContact C-N 3.26Å; T631-V633 PolarHBondContact O-N 3.33Å; T631-V633 VanDerWaalsContact O-N 3.16Å; V633-I698 HydrophobicContact CG1-CG2 4.41Å
634	S	96.3	Very high	96.6	Very high	52 Å²	52	31.4 Å²	31.4	36%	0.364	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-91.5	-0.8	180	-54.6	0	0	0	0	114.1	K546 T631 M632 P636	K546-S634 WeakPolarHBondContact CA-O 3.29Å; K546-S634 PolarHBondContact N-O 3.09Å; T631-S634 PolarHBondContact O-N 3.24Å; M632-S634 PolarHBondContact O-N 3.33Å; M632-S634 VanDerWaalsContact O-N 3.1Å; S634-P636 VanDerWaalsContact C-CD 3.49Å
635	N	97.2	Very high	96.5	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.011	17%	0.165	C	C	.	.			trans	-131.8	59.7	-173.8	-62.9	-72.1	0	0	0	112.8	I544 K546 L547 I627 T631 M632 D637 L638	I544-N635 PolarHBondContact O-ND2 3.02Å; K546-N635 PolarHBondContact N-OD1 2.98Å; L547-N635 WeakPolarHBondContact CB-OD1 3.29Å; L547-N635 PolarHBondContact N-OD1 3.2Å; I627-N635 HydrophobicContact CG2-CB 4.36Å; T631-N635 PolarHBondContact O-ND2 3.29Å; T631-N635 PolarHBondContact OG1-ND2 3.37Å; M632-N635 PolarHBondContact O-N 3.44Å; N635-D637 VanDerWaalsContact C-N 3.26Å; N635-D637 PolarHBondContact O-N 3Å; N635-L638 HydrophobicContact CB-CB 4.19Å; N635-L638 PolarHBondContact O-N 2.68Å
636	P	97.5	Very high	96.4	Very high	24 Å²	24	37.6 Å²	37.6	16%	0.156	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-34.2	178.5	26.6	-35.2	0	0	0	112.9	S634 L638 I639 Y640 M691 I694 I695 I698	S634-P636 VanDerWaalsContact C-CD 3.49Å; P636-L638 VanDerWaalsContact C-N 3.27Å; P636-L638 PolarHBondContact O-N 3.01Å; P636-I639 WeakPolarHBondContact O-CB 3.5Å; P636-I639 PolarHBondContact O-N 3.24Å; P636-I639 VanDerWaalsContact O-N 3.13Å; P636-Y640 PolarHBondContact O-N 2.82Å; P636-M691 HydrophobicContact CB-SD 4.08Å; P636-I694 HydrophobicContact CB-CG2 3.97Å; P636-I695 HydrophobicContact CB-CG1 4.02Å; P636-I695 HydrophobicContact CG-CG1 4.31Å; P636-I698 HydrophobicContact CB-CD1 4.05Å
637	D	97.5	Very high	96.3	Very high	41 Å²	41	42.7 Å²	42.7	22%	0.219	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-32.6	177.9	-66.6	-72.1	0	0	0	113.2	P549 N635 Y640 S641 M691	P549-D637 HydrophobicContact CB-CB 4.48Å; P549-D637 HydrophobicContact CG-CB 4.38Å; N635-D637 VanDerWaalsContact C-N 3.26Å; N635-D637 PolarHBondContact O-N 3Å; D637-Y640 PolarHBondContact O-N 3.49Å; D637-S641 PolarHBondContact O-N 3.49Å; D637-S641 PolarHBondContact O-OG 3.4Å; D637-M691 WeakPolarHBondContact OD1-CE 3.23Å
638	L	98.2	Very high	96.1	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-66.3	-41.3	175.1	-179.5	61.3	0	0	0	111.1	L555 V556 I627 N635 P636 Y640 S641 L642	L555-L638 HydrophobicContact CD2-CD1 4.35Å; V556-L638 HydrophobicContact CG2-CD1 3.96Å; I627-L638 HydrophobicContact CB-CD2 3.96Å; I627-L638 HydrophobicContact CD1-CD2 3.97Å; I627-L638 HydrophobicContact CG2-CD2 3.46Å; I627-L638 VanDerWaalsContact CG2-CD2 3.46Å; N635-L638 HydrophobicContact CB-CB 4.19Å; N635-L638 PolarHBondContact O-N 2.68Å; P636-L638 VanDerWaalsContact C-N 3.27Å; P636-L638 PolarHBondContact O-N 3.01Å; L638-Y640 VanDerWaalsContact C-N 3.33Å; L638-Y640 PolarHBondContact O-N 3.4Å; L638-S641 PolarHBondContact O-N 3.1Å; L638-L642 HydrophobicContact CD1-CD1 4.35Å; L638-L642 HydrophobicContact CD1-CG 4.28Å; L638-L642 HydrophobicContact CG-CD1 4.06Å; L638-L642 HydrophobicContact CG-CG 4.45Å; L638-L642 WeakPolarHBondContact O-CB 3.36Å; L638-L642 VanDerWaalsContact O-CG 3.29Å; L638-L642 WeakPolarHBondContact O-CG 3.38Å; L638-L642 PolarHBondContact O-N 3.24Å
639	I	97.9	Very high	96.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-45.4	175.9	-55.7	-51.3	0	0	0	110.3	L628 M632 P636 S641 L642 L643 V668 F672 I694 I698	L628-I639 HydrophobicContact CD2-CD1 3.34Å; M632-I639 HydrophobicContact CG-CD1 4.05Å; M632-I639 HydrophobicContact CG-CG1 4.45Å; M632-I639 HydrophobicContact SD-CD1 4.11Å; P636-I639 WeakPolarHBondContact O-CB 3.5Å; P636-I639 PolarHBondContact O-N 3.24Å; P636-I639 VanDerWaalsContact O-N 3.13Å; I639-S641 PolarHBondContact O-N 3.19Å; I639-L642 PolarHBondContact O-N 3.1Å; I639-L643 HydrophobicContact CG2-CD1 3.97Å; I639-L643 HydrophobicContact CG2-CG 4.46Å; I639-L643 WeakPolarHBondContact O-CB 3.06Å; I639-L643 WeakPolarHBondContact O-CG 3.38Å; I639-L643 PolarHBondContact O-N 2.91Å; I639-V668 HydrophobicContact CD1-CG1 3.84Å; I639-F672 HydrophobicContact CG1-CE2 4.34Å; I639-F672 HydrophobicContact CG2-CB 4.43Å; I639-F672 HydrophobicContact CG2-CD1 4.43Å; I639-F672 HydrophobicContact CG2-CD2 3.48Å; I639-F672 VanDerWaalsContact CG2-CD2 3.48Å; I639-F672 HydrophobicContact CG2-CE2 3.73Å; I639-F672 HydrophobicContact CG2-CG 3.87Å; I639-F672 HydrophobicContact CG2-CZ 4.3Å; I639-I694 HydrophobicContact CB-CG2 4.07Å; I639-I694 HydrophobicContact CG2-CD1 4.25Å; I639-I694 HydrophobicContact CG2-CG1 4.41Å; I639-I694 HydrophobicContact CG2-CG2 4.1Å; I639-I698 HydrophobicContact CG1-CD1 4.23Å
640	Y	98	Very high	96.1	Very high	63 Å²	63	43.8 Å²	43.8	25%	0.247	22%	0.224	C	C	.	.	H	α-helix	trans	-57.7	-49.2	175.6	177.5	-91	0	0	0	111.7	P636 D637 L638 L642 L643 Y644 P687 V690 M691 I694	P636-Y640 PolarHBondContact O-N 2.82Å; D637-Y640 PolarHBondContact O-N 3.49Å; L638-Y640 VanDerWaalsContact C-N 3.33Å; L638-Y640 PolarHBondContact O-N 3.4Å; Y640-L642 PolarHBondContact O-N 3.26Å; Y640-L643 PolarHBondContact O-N 3.48Å; Y640-Y644 WeakPolarHBondContact O-CB 3.5Å; Y640-Y644 PolarHBondContact O-N 3.48Å; Y640-P687 HydrophobicContact CE2-CB 4.41Å; Y640-V690 HydrophobicContact CD2-CG1 4.05Å; Y640-V690 HydrophobicContact CE2-CB 4.4Å; Y640-V690 HydrophobicContact CE2-CG1 4.2Å; Y640-M691 HydrophobicContact CD1-CE 4.42Å; Y640-M691 HydrophobicContact CD2-CE 4.13Å; Y640-M691 HydrophobicContact CG-CE 3.79Å; Y640-I694 HydrophobicContact CD2-CD1 4.28Å
641	S	97.7	Very high	96	Very high	8 Å²	8	41.4 Å²	41.4	6%	0.056	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-39.9	178.3	-66.9	0	0	0	0	113.1	C552 D637 L638 I639 Y644 K645	C552-S641 WeakPolarHBondContact CB-OG 3.41Å; D637-S641 PolarHBondContact O-N 3.49Å; D637-S641 PolarHBondContact O-OG 3.4Å; L638-S641 PolarHBondContact O-N 3.1Å; I639-S641 PolarHBondContact O-N 3.19Å; S641-Y644 PolarHBondContact O-N 2.92Å; S641-K645 PolarHBondContact O-N 3.4Å
642	L	98.2	Very high	95.9	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-67.6	-41.3	177.2	-69.8	167.5	0	0	0	112	V556 I624 L628 L638 I639 Y640 K645 R646 F649 L669	V556-L642 HydrophobicContact CG1-CD2 4.07Å; V556-L642 HydrophobicContact CG2-CD2 3.79Å; V556-L642 HydrophobicContact CG2-CG 4.12Å; I624-L642 HydrophobicContact CD1-CD2 4.33Å; I624-L642 HydrophobicContact CG2-CD1 3.99Å; I624-L642 HydrophobicContact CG2-CD2 4.29Å; L628-L642 HydrophobicContact CD1-CD1 4.35Å; L628-L642 HydrophobicContact CD2-CD1 4.3Å; L638-L642 HydrophobicContact CD1-CD1 4.35Å; L638-L642 HydrophobicContact CD1-CG 4.28Å; L638-L642 HydrophobicContact CG-CD1 4.06Å; L638-L642 HydrophobicContact CG-CG 4.45Å; L638-L642 WeakPolarHBondContact O-CB 3.36Å; L638-L642 VanDerWaalsContact O-CG 3.29Å; L638-L642 WeakPolarHBondContact O-CG 3.38Å; L638-L642 PolarHBondContact O-N 3.24Å; I639-L642 PolarHBondContact O-N 3.1Å; Y640-L642 PolarHBondContact O-N 3.26Å; L642-K645 CarbonylContact O-C 3.34Å; L642-K645 PolarHBondContact O-N 2.98Å; L642-R646 WeakPolarHBondContact O-CA 3.47Å; L642-R646 PolarHBondContact O-N 3.29Å; L642-F649 HydrophobicContact CD2-CE2 4.25Å; L642-F649 HydrophobicContact CD2-CZ 4.01Å; L642-L669 HydrophobicContact CB-CD2 3.7Å
643	L	96.7	Very high	95.8	Very high	21 Å²	21	44.8 Å²	44.8	11%	0.11	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-45.2	174.8	-76.4	165.9	0	0	0	111.3	I639 Y640 K645 R646 L669 F672 I676 I694	I639-L643 HydrophobicContact CG2-CD1 3.97Å; I639-L643 HydrophobicContact CG2-CG 4.46Å; I639-L643 WeakPolarHBondContact O-CB 3.06Å; I639-L643 WeakPolarHBondContact O-CG 3.38Å; I639-L643 PolarHBondContact O-N 2.91Å; Y640-L643 PolarHBondContact O-N 3.48Å; L643-K645 VanDerWaalsContact C-N 3.26Å; L643-K645 PolarHBondContact O-N 3.31Å; L643-R646 WeakPolarHBondContact O-CB 2.96Å; L643-R646 WeakPolarHBondContact O-CG 3.49Å; L643-R646 PolarHBondContact O-N 2.96Å; L643-L669 HydrophobicContact CB-CD2 4.42Å; L643-L669 HydrophobicContact CD2-CB 4.26Å; L643-L669 HydrophobicContact CD2-CD2 3.71Å; L643-L669 HydrophobicContact CG-CD2 3.73Å; L643-F672 HydrophobicContact CD1-CB 3.92Å; L643-F672 HydrophobicContact CD2-CB 4.34Å; L643-I676 HydrophobicContact CD1-CD1 3.71Å; L643-I694 HydrophobicContact CD1-CD1 3.87Å; L643-I694 HydrophobicContact CD1-CG1 4.38Å
644	Y	95	Very high	95.5	Very high	174 Å²	174	45.4 Å²	45.4	68%	0.682	24%	0.236	S	C	*	.	H	α-helix	trans	-62	-33.5	179.8	-173.4	-102.3	0	0	0	112.6	Y640 S641	Y640-Y644 WeakPolarHBondContact O-CB 3.5Å; Y640-Y644 PolarHBondContact O-N 3.48Å; S641-Y644 PolarHBondContact O-N 2.92Å
645	K	95.1	Very high	95.4	Very high	21 Å²	21	45 Å²	45	9%	0.091	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	12.4	-178.9	-61.8	-174.8	-177.1	173.4	0	114.1	D553 V556 S641 L642 L643 D647 S648	D553-K645 PolarHBondContact O-NZ 2.67Å; D553-K645 WeakPolarHBondContact OD1-CE 3.25Å; D553-K645 IonicContact OD1-NZ 3.13Å; D553-K645 PolarHBondContact OD1-NZ 3.2Å; V556-K645 HydrophobicContact CB-CD 4.18Å; V556-K645 HydrophobicContact CG1-CB 3.86Å; V556-K645 HydrophobicContact CG1-CD 3.7Å; V556-K645 HydrophobicContact CG1-CG 4.25Å; S641-K645 PolarHBondContact O-N 3.4Å; L642-K645 CarbonylContact O-C 3.34Å; L642-K645 PolarHBondContact O-N 2.98Å; L643-K645 VanDerWaalsContact C-N 3.26Å; L643-K645 PolarHBondContact O-N 3.31Å; K645-D647 PolarHBondContact O-N 3.36Å; K645-D647 VanDerWaalsContact O-N 3.09Å; K645-S648 WeakPolarHBondContact O-CB 3.28Å; K645-S648 PolarHBondContact O-N 3.39Å; K645-S648 PolarHBondContact O-OG 3.36Å
646	R	95.1	Very high	95.1	Very high	111 Å²	111	49.5 Å²	49.5	42%	0.419	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-53.7	-35.6	-170	72.8	-176.7	-172.4	-178.6	-3.7	114.7	L642 L643 S648 F649 L669 S673	L642-R646 WeakPolarHBondContact O-CA 3.47Å; L642-R646 PolarHBondContact O-N 3.29Å; L643-R646 WeakPolarHBondContact O-CB 2.96Å; L643-R646 WeakPolarHBondContact O-CG 3.49Å; L643-R646 PolarHBondContact O-N 2.96Å; R646-S648 PolarHBondContact O-N 2.79Å; R646-F649 WeakPolarHBondContact O-CD2 3.3Å; R646-F649 PolarHBondContact O-N 3.03Å; R646-L669 HydrophobicContact CB-CD1 3.95Å; R646-S673 PolarHBondContact NH1-OG 3.19Å
647	D	94.5	Very high	94.8	Very high	117 Å²	117	50.8 Å²	50.8	63%	0.626	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-70.4	-20.7	-176	-59.3	-33.8	0	0	0	111.7	K645 F649 A650	K645-D647 PolarHBondContact O-N 3.36Å; K645-D647 VanDerWaalsContact O-N 3.09Å; D647-F649 PolarHBondContact O-N 3.39Å; D647-A650 WeakPolarHBondContact O-CB 3.34Å; D647-A650 PolarHBondContact O-N 3.3Å; D647-A650 VanDerWaalsContact O-N 3.17Å
648	S	93.1	Very high	94.7	Very high	25 Å²	25	48.9 Å²	48.9	18%	0.175	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-63.5	-22.6	176.4	-46.2	0	0	0	0	112.9	Q560 I563 K645 R646	Q560-S648 PolarHBondContact NE2-OG 3.49Å; I563-S648 WeakPolarHBondContact CG2-O 3.44Å; K645-S648 WeakPolarHBondContact O-CB 3.28Å; K645-S648 PolarHBondContact O-N 3.39Å; K645-S648 PolarHBondContact O-OG 3.36Å; R646-S648 PolarHBondContact O-N 2.79Å
649	F	94.8	Very high	94.4	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-85.9	-8.4	-179.8	-55.1	-64.4	0	0	0	113.4	V556 L559 I563 L621 L642 R646 D647 S651 L652 L662	V556-F649 HydrophobicContact CG1-CZ 4.25Å; L559-F649 HydrophobicContact CD2-CE1 3.57Å; L559-F649 HydrophobicContact CD2-CZ 4.16Å; L559-F649 HydrophobicContact CG-CE1 4.02Å; I563-F649 HydrophobicContact CD1-CD1 3.75Å; I563-F649 HydrophobicContact CD1-CE1 3.98Å; L621-F649 HydrophobicContact CD2-CE1 4.39Å; L642-F649 HydrophobicContact CD2-CE2 4.25Å; L642-F649 HydrophobicContact CD2-CZ 4.01Å; R646-F649 WeakPolarHBondContact O-CD2 3.3Å; R646-F649 PolarHBondContact O-N 3.03Å; D647-F649 PolarHBondContact O-N 3.39Å; F649-S651 VanDerWaalsContact C-N 3.3Å; F649-S651 PolarHBondContact O-N 2.87Å; F649-L652 PolarHBondContact O-N 2.84Å; F649-L662 HydrophobicContact CB-CD2 4.11Å; F649-L662 HydrophobicContact CD1-CD2 4.07Å; F649-L662 HydrophobicContact CG-CD2 4.21Å
650	A	93.8	Very high	94.1	Very high	52 Å²	52	57.8 Å²	57.8	43%	0.43	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-58.3	-40	-171.6	0	0	0	0	0	113.2	D647 L652 R653	D647-A650 WeakPolarHBondContact O-CB 3.34Å; D647-A650 PolarHBondContact O-N 3.3Å; D647-A650 VanDerWaalsContact O-N 3.17Å; A650-L652 PolarHBondContact O-N 3.35Å; A650-R653 PolarHBondContact O-N 3.24Å
651	S	92.6	Very high	93.9	Very high	44 Å²	44	55 Å²	55	31%	0.308	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-67.4	-23.2	179.3	63.4	0	0	0	0	113.6	N567 F649	N567-S651 WeakPolarHBondContact ND2-CB 3.47Å; N567-S651 PolarHBondContact ND2-OG 3.27Å; N567-S651 PolarHBondContact OD1-OG 3.29Å; F649-S651 VanDerWaalsContact C-N 3.3Å; F649-S651 PolarHBondContact O-N 2.87Å
652	L	94.6	Very high	93.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-85.4	-18.7	-178	-60.5	-165.8	0	0	0	113	I563 I617 L621 F649 A650 S654 H655 F658 L662	I563-L652 HydrophobicContact CD1-CD1 3.58Å; I563-L652 HydrophobicContact CD1-CG 4.12Å; I563-L652 HydrophobicContact CG1-CD1 3.75Å; I563-L652 HydrophobicContact CG1-CD2 4.24Å; I563-L652 HydrophobicContact CG1-CG 4.14Å; I563-L652 HydrophobicContact CG2-CD2 4.01Å; I563-L652 HydrophobicContact CG2-CG 4.17Å; I617-L652 HydrophobicContact CG2-CD1 3.94Å; L621-L652 HydrophobicContact CD1-CD1 4.1Å; F649-L652 PolarHBondContact O-N 2.84Å; A650-L652 PolarHBondContact O-N 3.35Å; L652-S654 PolarHBondContact O-N 2.63Å; L652-H655 WeakPolarHBondContact O-CB 3.2Å; L652-H655 PolarHBondContact O-N 3.21Å; L652-F658 HydrophobicContact CB-CB 4.13Å; L652-F658 HydrophobicContact CB-CD2 3.88Å; L652-F658 HydrophobicContact CB-CG 4.3Å; L652-F658 HydrophobicContact CD1-CB 4.47Å; L652-F658 HydrophobicContact CD1-CD2 4.03Å; L652-F658 HydrophobicContact CD1-CG 4.16Å; L652-F658 HydrophobicContact CD2-CD2 3.63Å; L652-F658 HydrophobicContact CD2-CE2 3.7Å; L652-F658 HydrophobicContact CG-CD2 4.05Å; L652-L662 HydrophobicContact CB-CD1 3.41Å; L652-L662 VanDerWaalsContact CB-CD1 3.41Å; L652-L662 HydrophobicContact CD1-CD1 4.24Å; L652-L662 HydrophobicContact CG-CD1 4.49Å
653	R	93.4	Very high	93.6	Very high	101 Å²	101	59.2 Å²	59.2	38%	0.381	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28	-175.1	-67	-170.5	179.7	107.6	4.8	113.5	A650 Q659 D666	A650-R653 PolarHBondContact O-N 3.24Å; R653-Q659 WeakPolarHBondContact O-CG 3.39Å; R653-Q659 PolarHBondContact O-NE2 3.19Å; R653-D666 IonicContact CZ-OD1 2.84Å; R653-D666 IonicContact CZ-OD2 2.66Å; R653-D666 IonicContact NE-OD1 2.67Å; R653-D666 PolarHBondContact NE-OD1 3.43Å; R653-D666 IonicContact NE-OD2 2.94Å; R653-D666 PolarHBondContact NE-OD2 2.84Å; R653-D666 IonicContact NH2-OD1 3.73Å; R653-D666 PolarHBondContact NH2-OD1 3.29Å; R653-D666 IonicContact NH2-OD2 3.14Å
654	S	88.7	Confident	93.5	Very high	94 Å²	94	58.2 Å²	58.2	66%	0.657	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.4	175.2	51.7	0	0	0	0	113.1	L652	L652-S654 PolarHBondContact O-N 2.63Å
655	H	93.2	Very high	93.5	Very high	44 Å²	44	50 Å²	50	20%	0.204	27%	0.272	C	S	.	.			trans	-87.3	123	-172.2	-160	-89.6	0	0	0	111.9	E614 L652 S657 F658 Q659	E614-H655 IonicContact OE1-CE1 3.94Å; E614-H655 IonicContact OE1-NE2 3.98Å; E614-H655 IonicContact OE2-CE1 2.99Å; E614-H655 PolarHBondContact OE2-CE1 3.35Å; L652-H655 WeakPolarHBondContact O-CB 3.2Å; L652-H655 PolarHBondContact O-N 3.21Å; H655-S657 VanDerWaalsContact C-N 3.27Å; H655-S657 PolarHBondContact CE1-OG 3.45Å; H655-S657 VanDerWaalsContact CE1-OG 3.27Å; H655-S657 WeakPolarHBondContact ND1-CB 3.32Å; H655-S657 PolarHBondContact ND1-N 3.49Å; H655-S657 PolarHBondContact ND1-OG 3.24Å; H655-S657 PolarHBondContact O-N 2.89Å; H655-F658 HydrophobicContact CB-CD2 3.59Å; H655-F658 HydrophobicContact CB-CE2 4.17Å; H655-F658 HydrophobicContact CB-CG 4.49Å; H655-F658 AromaticContact CG-CD2 3.73Å; H655-F658 AromaticContact CG-CE2 3.84Å; H655-F658 AromaticContact ND1-CD2 3.61Å; H655-F658 AromaticContact ND1-CE2 3.54Å; H655-F658 PolarHBondContact O-N 2.98Å; H655-Q659 WeakPolarHBondContact O-CG 3.44Å; H655-Q659 PolarHBondContact O-N 3.07Å; H655-Q659 VanDerWaalsContact O-N 3.13Å
656	P	91.3	Very high	93.6	Very high	96 Å²	96	50.7 Å²	50.7	62%	0.623	28%	0.277	S	S	*	.	H	α-helix	trans	-55	-37.7	-176.3	-27.5	35.1	0	0	0	114.2	F658	P656-F658 PolarHBondContact O-N 3.46Å
657	S	91.4	Very high	93.6	Very high	52 Å²	52	48 Å²	48	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-64.5	-22.7	179.7	-46.6	0	0	0	0	113.7	E614 H655	E614-S657 PolarHBondContact OE2-OG 2.74Å; H655-S657 VanDerWaalsContact C-N 3.27Å; H655-S657 PolarHBondContact CE1-OG 3.45Å; H655-S657 VanDerWaalsContact CE1-OG 3.27Å; H655-S657 WeakPolarHBondContact ND1-CB 3.32Å; H655-S657 PolarHBondContact ND1-N 3.49Å; H655-S657 PolarHBondContact ND1-OG 3.24Å; H655-S657 PolarHBondContact O-N 2.89Å
658	F	96	Very high	93.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-114	-19.9	-172.1	-52	-51.4	0	0	0	114.4	H566 E614 I617 R618 L621 L652 H655 P656 N660 V661 L662	H566-F658 AromaticContact NE2-CE2 3.98Å; E614-F658 HydrophobicContact CB-CE1 4.45Å; E614-F658 HydrophobicContact CB-CZ 3.93Å; E614-F658 HydrophobicContact CG-CE2 4.46Å; E614-F658 HydrophobicContact CG-CZ 3.86Å; I617-F658 HydrophobicContact CB-CE1 3.99Å; I617-F658 HydrophobicContact CB-CZ 4.18Å; I617-F658 HydrophobicContact CG2-CD1 4.06Å; I617-F658 HydrophobicContact CG2-CE1 3.56Å; I617-F658 HydrophobicContact CG2-CZ 3.83Å; R618-F658 HydrophobicContact CB-CD1 4.36Å; R618-F658 HydrophobicContact CB-CE1 4.11Å; L621-F658 HydrophobicContact CD1-CB 4.39Å; L621-F658 HydrophobicContact CD1-CD1 3.98Å; L621-F658 HydrophobicContact CD1-CG 4.4Å; L652-F658 HydrophobicContact CB-CB 4.13Å; L652-F658 HydrophobicContact CB-CD2 3.88Å; L652-F658 HydrophobicContact CB-CG 4.3Å; L652-F658 HydrophobicContact CD1-CB 4.47Å; L652-F658 HydrophobicContact CD1-CD2 4.03Å; L652-F658 HydrophobicContact CD1-CG 4.16Å; L652-F658 HydrophobicContact CD2-CD2 3.63Å; L652-F658 HydrophobicContact CD2-CE2 3.7Å; L652-F658 HydrophobicContact CG-CD2 4.05Å; H655-F658 HydrophobicContact CB-CD2 3.59Å; H655-F658 HydrophobicContact CB-CE2 4.17Å; H655-F658 HydrophobicContact CB-CG 4.49Å; H655-F658 AromaticContact CG-CD2 3.73Å; H655-F658 AromaticContact CG-CE2 3.84Å; H655-F658 AromaticContact ND1-CD2 3.61Å; H655-F658 AromaticContact ND1-CE2 3.54Å; H655-F658 PolarHBondContact O-N 2.98Å; P656-F658 PolarHBondContact O-N 3.46Å; F658-N660 VanDerWaalsContact C-N 3.31Å; F658-N660 PolarHBondContact O-N 2.8Å; F658-V661 HydrophobicContact CB-CG2 4.4Å; F658-V661 WeakPolarHBondContact O-CG2 3.27Å; F658-V661 PolarHBondContact O-N 3.33Å; F658-V661 VanDerWaalsContact O-N 3.16Å; F658-L662 HydrophobicContact CB-CD1 3.88Å; F658-L662 HydrophobicContact CB-CG 4.42Å; F658-L662 WeakPolarHBondContact O-CB 3.4Å; F658-L662 PolarHBondContact O-N 2.96Å
659	Q	92.5	Very high	93.9	Very high	100 Å²	100	41.6 Å²	41.6	47%	0.467	23%	0.234	S	C	.	.	H	α-helix	trans	-50.2	-48.5	-176.4	-84.8	178.5	-3.3	0	0	113.5	R653 H655 L662 Q663	R653-Q659 WeakPolarHBondContact O-CG 3.39Å; R653-Q659 PolarHBondContact O-NE2 3.19Å; H655-Q659 WeakPolarHBondContact O-CG 3.44Å; H655-Q659 PolarHBondContact O-N 3.07Å; H655-Q659 VanDerWaalsContact O-N 3.13Å; Q659-L662 PolarHBondContact O-N 2.99Å; Q659-Q663 PolarHBondContact O-N 3Å
660	N	90.6	Very high	93.9	Very high	88 Å²	88	44.8 Å²	44.8	47%	0.471	25%	0.253	S	S	.	.	H	α-helix	trans	-62.7	-47	-178.7	-78	-53.1	0	0	0	112	F658 K708 F710	F658-N660 VanDerWaalsContact C-N 3.31Å; F658-N660 PolarHBondContact O-N 2.8Å; N660-K708 PolarHBondContact OD1-NZ 2.83Å; N660-F710 WeakPolarHBondContact O-CZ 3.31Å
661	V	93.3	Very high	94	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.03	24%	0.24	C	C	.	.	H	α-helix	trans	-75	-27.1	-176.8	-65.4	0	0	0	0	112.3	L621 E622 N625 F658 F710	L621-V661 HydrophobicContact CB-CB 4.1Å; L621-V661 HydrophobicContact CB-CG2 3.82Å; L621-V661 HydrophobicContact CD1-CG2 3.77Å; L621-V661 HydrophobicContact CG-CG2 4.42Å; E622-V661 HydrophobicContact CG-CG1 3.75Å; N625-V661 PolarHBondContact ND2-O 3.14Å; F658-V661 HydrophobicContact CB-CG2 4.4Å; F658-V661 WeakPolarHBondContact O-CG2 3.27Å; F658-V661 PolarHBondContact O-N 3.33Å; F658-V661 VanDerWaalsContact O-N 3.16Å; V661-F710 HydrophobicContact CG1-CE1 4Å; V661-F710 HydrophobicContact CG1-CZ 4.31Å
662	L	95.9	Very high	94.2	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-76.7	-25.4	176.2	-77.2	169	0	0	0	113.7	L621 F649 L652 F658 Q659 N664 I665 D666	L621-L662 HydrophobicContact CD1-CD2 4.36Å; L621-L662 HydrophobicContact CD1-CG 4.35Å; L621-L662 HydrophobicContact CD2-CD2 3.77Å; F649-L662 HydrophobicContact CB-CD2 4.11Å; F649-L662 HydrophobicContact CD1-CD2 4.07Å; F649-L662 HydrophobicContact CG-CD2 4.21Å; L652-L662 HydrophobicContact CB-CD1 3.41Å; L652-L662 VanDerWaalsContact CB-CD1 3.41Å; L652-L662 HydrophobicContact CD1-CD1 4.24Å; L652-L662 HydrophobicContact CG-CD1 4.49Å; F658-L662 HydrophobicContact CB-CD1 3.88Å; F658-L662 HydrophobicContact CB-CG 4.42Å; F658-L662 WeakPolarHBondContact O-CB 3.4Å; F658-L662 PolarHBondContact O-N 2.96Å; Q659-L662 PolarHBondContact O-N 2.99Å; L662-N664 PolarHBondContact O-N 3.08Å; L662-I665 HydrophobicContact CD2-CD1 4.33Å; L662-I665 WeakPolarHBondContact O-CB 3.48Å; L662-I665 PolarHBondContact O-N 3.11Å; L662-D666 PolarHBondContact O-N 3.4Å
663	Q	94.5	Very high	94.3	Very high	96 Å²	96	42.9 Å²	42.9	45%	0.449	23%	0.234	S	C	.	.	H	α-helix	trans	-52.2	-49.9	-176	-175.1	-179.9	19.6	0	0	112.9	Q659 D666 I667	Q659-Q663 PolarHBondContact O-N 3Å; Q663-D666 PolarHBondContact O-N 3.19Å; Q663-I667 HydrophobicContact CG-CD1 4.13Å; Q663-I667 VanDerWaalsContact O-CG1 3.26Å; Q663-I667 WeakPolarHBondContact O-CG1 3.36Å; Q663-I667 PolarHBondContact O-N 2.88Å
664	N	94.4	Very high	94.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-41.4	178.7	-85.8	5.4	0	0	0	112.3	N625 L662 I667 V668 L707 K708 F710	N625-N664 WeakPolarHBondContact OD1-CB 3.22Å; L662-N664 PolarHBondContact O-N 3.08Å; N664-I667 PolarHBondContact O-N 2.84Å; N664-V668 WeakPolarHBondContact O-CG2 3.38Å; N664-V668 PolarHBondContact O-N 3.36Å; N664-V668 VanDerWaalsContact O-N 3.08Å; N664-L707 HydrophobicContact CB-CD2 4.13Å; N664-L707 WeakPolarHBondContact OD1-CA 3.39Å; N664-K708 PolarHBondContact ND2-O 3.4Å; N664-K708 WeakPolarHBondContact OD1-CB 3.45Å; N664-K708 PolarHBondContact OD1-N 2.8Å; N664-F710 WeakPolarHBondContact ND2-CE2 3.49Å
665	I	95.9	Very high	94.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.1	-48.6	177.5	-63.9	169.2	0	0	0	109.3	L621 I624 L628 L662 I667 V668 L669	L621-I665 HydrophobicContact CD2-CD1 3.6Å; I624-I665 HydrophobicContact CB-CD1 4.5Å; I624-I665 HydrophobicContact CG2-CD1 3.97Å; I624-I665 HydrophobicContact CG2-CG1 4.2Å; L628-I665 HydrophobicContact CD1-CG1 3.82Å; L662-I665 HydrophobicContact CD2-CD1 4.33Å; L662-I665 WeakPolarHBondContact O-CB 3.48Å; L662-I665 PolarHBondContact O-N 3.11Å; I665-I667 VanDerWaalsContact C-N 3.33Å; I665-I667 PolarHBondContact O-N 3.44Å; I665-V668 PolarHBondContact O-N 3.14Å; I665-L669 HydrophobicContact CG2-CD1 3.79Å; I665-L669 HydrophobicContact CG2-CG 4.14Å; I665-L669 VanDerWaalsContact O-CG 3.27Å; I665-L669 WeakPolarHBondContact O-CG 3.35Å; I665-L669 PolarHBondContact O-N 2.91Å
666	D	96.2	Very high	95	Very high	37 Å²	37	42.6 Å²	42.6	20%	0.198	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-37.7	178.2	-82.4	-30.6	0	0	0	112.3	R653 L662 Q663 T670	R653-D666 IonicContact CZ-OD1 2.84Å; R653-D666 IonicContact CZ-OD2 2.66Å; R653-D666 IonicContact NE-OD1 2.67Å; R653-D666 PolarHBondContact NE-OD1 3.43Å; R653-D666 IonicContact NE-OD2 2.94Å; R653-D666 PolarHBondContact NE-OD2 2.84Å; R653-D666 IonicContact NH2-OD1 3.73Å; R653-D666 PolarHBondContact NH2-OD1 3.29Å; R653-D666 IonicContact NH2-OD2 3.14Å; L662-D666 PolarHBondContact O-N 3.4Å; Q663-D666 PolarHBondContact O-N 3.19Å; D666-T670 WeakPolarHBondContact O-CB 3.32Å; D666-T670 PolarHBondContact O-N 3.41Å; D666-T670 PolarHBondContact O-OG1 2.93Å
667	I	95.7	Very high	95.2	Very high	55 Å²	55	43.5 Å²	43.5	28%	0.282	22%	0.219	S	C	.	.	H	α-helix	trans	-59.2	-49.9	173.7	-71.4	164.4	0	0	0	110.6	Q663 N664 I665 T670 H671 C705 L707	Q663-I667 HydrophobicContact CG-CD1 4.13Å; Q663-I667 VanDerWaalsContact O-CG1 3.26Å; Q663-I667 WeakPolarHBondContact O-CG1 3.36Å; Q663-I667 PolarHBondContact O-N 2.88Å; N664-I667 PolarHBondContact O-N 2.84Å; I665-I667 VanDerWaalsContact C-N 3.33Å; I665-I667 PolarHBondContact O-N 3.44Å; I667-T670 PolarHBondContact O-N 3.1Å; I667-H671 WeakPolarHBondContact O-CB 3.48Å; I667-H671 PolarHBondContact O-N 3.01Å; I667-C705 HydrophobicContact CG2-CB 4.04Å; I667-L707 HydrophobicContact CB-CD2 4.34Å; I667-L707 HydrophobicContact CG2-CD2 4.05Å
668	V	96.3	Very high	95.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-47.1	-179.9	174.6	0	0	0	0	110.9	L628 M632 I639 N664 I665 T670 H671 F672 L707	L628-V668 HydrophobicContact CD1-CG2 4.4Å; L628-V668 HydrophobicContact CD2-CG1 4.41Å; M632-V668 HydrophobicContact SD-CG1 3.94Å; M632-V668 HydrophobicContact SD-CG2 4.08Å; I639-V668 HydrophobicContact CD1-CG1 3.84Å; N664-V668 WeakPolarHBondContact O-CG2 3.38Å; N664-V668 PolarHBondContact O-N 3.36Å; N664-V668 VanDerWaalsContact O-N 3.08Å; I665-V668 PolarHBondContact O-N 3.14Å; V668-T670 VanDerWaalsContact C-N 3.33Å; V668-T670 PolarHBondContact O-N 2.92Å; V668-H671 WeakPolarHBondContact O-CB 3.28Å; V668-H671 PolarHBondContact O-N 3.3Å; V668-F672 HydrophobicContact CG1-CD2 3.83Å; V668-F672 HydrophobicContact CG1-CE2 3.89Å; V668-F672 WeakPolarHBondContact O-CD2 3.26Å; V668-F672 PolarHBondContact O-N 3.48Å; V668-L707 HydrophobicContact CG2-CD1 4.38Å; V668-L707 HydrophobicContact CG2-CD2 3.82Å
669	L	96.6	Very high	95.5	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-38.4	-179.9	-64.8	-176.8	0	0	0	112.3	L642 L643 R646 I665 S673	L642-L669 HydrophobicContact CB-CD2 3.7Å; L643-L669 HydrophobicContact CB-CD2 4.42Å; L643-L669 HydrophobicContact CD2-CB 4.26Å; L643-L669 HydrophobicContact CD2-CD2 3.71Å; L643-L669 HydrophobicContact CG-CD2 3.73Å; R646-L669 HydrophobicContact CB-CD1 3.95Å; I665-L669 HydrophobicContact CG2-CD1 3.79Å; I665-L669 HydrophobicContact CG2-CG 4.14Å; I665-L669 VanDerWaalsContact O-CG 3.27Å; I665-L669 WeakPolarHBondContact O-CG 3.35Å; I665-L669 PolarHBondContact O-N 2.91Å; L669-S673 WeakPolarHBondContact O-CB 3.44Å; L669-S673 PolarHBondContact O-N 3.07Å; L669-S673 PolarHBondContact O-OG 3.06Å
670	T	95.6	Very high	95.6	Very high	68 Å²	68	47.9 Å²	47.9	42%	0.417	25%	0.247	S	C	.	.	H	α-helix	trans	-66.1	-42.3	175.4	-59.6	0	0	0	0	111.2	D666 I667 V668 S673 K674	D666-T670 WeakPolarHBondContact O-CB 3.32Å; D666-T670 PolarHBondContact O-N 3.41Å; D666-T670 PolarHBondContact O-OG1 2.93Å; I667-T670 PolarHBondContact O-N 3.1Å; V668-T670 VanDerWaalsContact C-N 3.33Å; V668-T670 PolarHBondContact O-N 2.92Å; T670-S673 PolarHBondContact O-N 2.92Å; T670-K674 HydrophobicContact CG2-CD 4.35Å; T670-K674 WeakPolarHBondContact O-CG 3.29Å; T670-K674 PolarHBondContact O-N 3.17Å; T670-K674 VanDerWaalsContact O-N 3.1Å
671	H	96.2	Very high	95.8	Very high	30 Å²	30	44.8 Å²	44.8	14%	0.139	24%	0.236	C	C	.	.	H	α-helix	trans	-57.8	-53	177	177	83.6	0	0	0	111.5	I667 V668 K674 K675 S704	I667-H671 WeakPolarHBondContact O-CB 3.48Å; I667-H671 PolarHBondContact O-N 3.01Å; V668-H671 WeakPolarHBondContact O-CB 3.28Å; V668-H671 PolarHBondContact O-N 3.3Å; H671-K674 PolarHBondContact O-N 3.48Å; H671-K675 WeakPolarHBondContact O-CG 3.07Å; H671-K675 PolarHBondContact O-N 2.93Å; H671-S704 WeakPolarHBondContact CE1-CB 3.49Å
672	F	97	Very high	95.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.7	-35.9	-179.4	-76.9	-74.6	0	0	0	113	I639 L643 V668 K674 K675 I676 I694 H697 I698 T701	I639-F672 HydrophobicContact CG1-CE2 4.34Å; I639-F672 HydrophobicContact CG2-CB 4.43Å; I639-F672 HydrophobicContact CG2-CD1 4.43Å; I639-F672 HydrophobicContact CG2-CD2 3.48Å; I639-F672 VanDerWaalsContact CG2-CD2 3.48Å; I639-F672 HydrophobicContact CG2-CE2 3.73Å; I639-F672 HydrophobicContact CG2-CG 3.87Å; I639-F672 HydrophobicContact CG2-CZ 4.3Å; L643-F672 HydrophobicContact CD1-CB 3.92Å; L643-F672 HydrophobicContact CD2-CB 4.34Å; V668-F672 HydrophobicContact CG1-CD2 3.83Å; V668-F672 HydrophobicContact CG1-CE2 3.89Å; V668-F672 WeakPolarHBondContact O-CD2 3.26Å; V668-F672 PolarHBondContact O-N 3.48Å; F672-K674 VanDerWaalsContact C-N 3.31Å; F672-K674 PolarHBondContact O-N 3.41Å; F672-K675 PolarHBondContact O-N 2.81Å; F672-K675 VanDerWaalsContact O-N 3.17Å; F672-I676 HydrophobicContact CB-CD1 4.48Å; F672-I676 WeakPolarHBondContact O-CB 3.28Å; F672-I676 WeakPolarHBondContact O-CD1 3.43Å; F672-I676 VanDerWaalsContact O-CG1 3.24Å; F672-I676 WeakPolarHBondContact O-CG1 3.47Å; F672-I676 PolarHBondContact O-N 2.88Å; F672-I694 HydrophobicContact CD1-CB 4.41Å; F672-I694 HydrophobicContact CD1-CG1 4.06Å; F672-I694 HydrophobicContact CD1-CG2 4.44Å; F672-I694 HydrophobicContact CE1-CB 4.31Å; F672-I694 HydrophobicContact CE1-CG1 4.44Å; F672-I694 HydrophobicContact CE1-CG2 4.04Å; F672-I694 HydrophobicContact CZ-CG2 4.42Å; F672-H697 HydrophobicContact CE1-CB 4.11Å; F672-I698 HydrophobicContact CZ-CB 4.17Å; F672-I698 HydrophobicContact CZ-CG1 4.02Å; F672-T701 HydrophobicContact CE2-CG2 3.81Å; F672-T701 HydrophobicContact CZ-CG2 3.64Å
673	S	96.3	Very high	95.2	Very high	26 Å²	26	57.6 Å²	57.6	18%	0.182	30%	0.304	C	S	.	.	H	α-helix	trans	-57.5	-44.9	174.9	-63.5	0	0	0	0	111.3	R646 L669 T670 K675 I676 E677	R646-S673 PolarHBondContact NH1-OG 3.19Å; L669-S673 WeakPolarHBondContact O-CB 3.44Å; L669-S673 PolarHBondContact O-N 3.07Å; L669-S673 PolarHBondContact O-OG 3.06Å; T670-S673 PolarHBondContact O-N 2.92Å; S673-K675 PolarHBondContact O-N 3.03Å; S673-I676 PolarHBondContact O-N 3.49Å; S673-E677 WeakPolarHBondContact O-CB 3.18Å; S673-E677 PolarHBondContact O-N 3.15Å
674	K	96	Very high	95	Very high	142 Å²	142	55.5 Å²	55.5	62%	0.617	30%	0.299	S	S	*	.	H	α-helix	trans	-63.7	-38.8	176.2	-72.6	178.2	178.9	-179.1	0	113	T670 H671 F672 S678	T670-K674 HydrophobicContact CG2-CD 4.35Å; T670-K674 WeakPolarHBondContact O-CG 3.29Å; T670-K674 PolarHBondContact O-N 3.17Å; T670-K674 VanDerWaalsContact O-N 3.1Å; H671-K674 PolarHBondContact O-N 3.48Å; F672-K674 VanDerWaalsContact C-N 3.31Å; F672-K674 PolarHBondContact O-N 3.41Å; K674-S678 VanDerWaalsContact O-CB 3.31Å; K674-S678 WeakPolarHBondContact O-CB 3.2Å; K674-S678 PolarHBondContact O-N 3.49Å
675	K	96.2	Very high	94.7	Very high	75 Å²	75	61.3 Å²	61.3	33%	0.326	33%	0.334	S	S	.	.	H	α-helix	trans	-68.7	-41.2	177.3	-71.1	-60.5	-170.1	171.5	0	112.4	H671 F672 S673 S678 E679 V693	H671-K675 WeakPolarHBondContact O-CG 3.07Å; H671-K675 PolarHBondContact O-N 2.93Å; F672-K675 PolarHBondContact O-N 2.81Å; F672-K675 VanDerWaalsContact O-N 3.17Å; S673-K675 PolarHBondContact O-N 3.03Å; K675-S678 PolarHBondContact O-N 3.29Å; K675-E679 PolarHBondContact O-N 3.31Å; K675-V693 HydrophobicContact CB-CG1 4.23Å
676	I	96.8	Very high	94.5	Very high	16 Å²	16	67 Å²	67	8%	0.082	36%	0.361	C	S	.	.	H	α-helix	trans	-63.3	-47.6	175.5	-70.9	161.8	0	0	0	110.1	L643 F672 S673 S678 E679 L680 P684 V690 V693	L643-I676 HydrophobicContact CD1-CD1 3.71Å; F672-I676 HydrophobicContact CB-CD1 4.48Å; F672-I676 WeakPolarHBondContact O-CB 3.28Å; F672-I676 WeakPolarHBondContact O-CD1 3.43Å; F672-I676 VanDerWaalsContact O-CG1 3.24Å; F672-I676 WeakPolarHBondContact O-CG1 3.47Å; F672-I676 PolarHBondContact O-N 2.88Å; S673-I676 PolarHBondContact O-N 3.49Å; I676-S678 VanDerWaalsContact C-N 3.31Å; I676-S678 PolarHBondContact O-N 3.27Å; I676-E679 PolarHBondContact O-N 2.94Å; I676-L680 HydrophobicContact CG2-CD1 4.41Å; I676-L680 WeakPolarHBondContact O-CA 3.49Å; I676-L680 WeakPolarHBondContact O-CB 3.26Å; I676-L680 PolarHBondContact O-N 3.33Å; I676-P684 HydrophobicContact CG2-CB 4.28Å; I676-P684 HydrophobicContact CG2-CG 3.71Å; I676-V690 HydrophobicContact CD1-CG1 3.74Å; I676-V690 HydrophobicContact CG1-CG1 4.3Å; I676-V693 HydrophobicContact CG1-CB 4.39Å; I676-V693 HydrophobicContact CG1-CG1 3.99Å
677	E	96.5	Very high	94.4	Very high	115 Å²	115	68.7 Å²	68.7	54%	0.537	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-40.1	177.6	-175.9	174.6	-174.8	0	0	112.3	S673 E679 G681	S673-E677 WeakPolarHBondContact O-CB 3.18Å; S673-E677 PolarHBondContact O-N 3.15Å; E677-E679 PolarHBondContact O-N 3.37Å; E677-G681 WeakPolarHBondContact CA-O 3.47Å; E677-G681 WeakPolarHBondContact O-CA 3.4Å; E677-G681 PolarHBondContact O-N 3.5Å
678	S	95.8	Very high	94.3	Very high	99 Å²	99	72.3 Å²	72.3	69%	0.692	39%	0.39	S	S	*	.	H	α-helix	trans	-67.7	-30.9	179	-178.1	0	0	0	0	114.4	K674 K675 I676	K674-S678 VanDerWaalsContact O-CB 3.31Å; K674-S678 WeakPolarHBondContact O-CB 3.2Å; K674-S678 PolarHBondContact O-N 3.49Å; K675-S678 PolarHBondContact O-N 3.29Å; I676-S678 VanDerWaalsContact C-N 3.31Å; I676-S678 PolarHBondContact O-N 3.27Å
679	E	96.6	Very high	94.3	Very high	82 Å²	82	73.9 Å²	73.9	38%	0.383	40%	0.402	S	S	.	.	H	α-helix	trans	-104.1	-28.5	-176.3	-65.4	-161.1	-179.2	0	0	113.8	K675 I676 E677 V693 K696 H697	K675-E679 PolarHBondContact O-N 3.31Å; I676-E679 PolarHBondContact O-N 2.94Å; E677-E679 PolarHBondContact O-N 3.37Å; E679-V693 HydrophobicContact CB-CG2 4.18Å; E679-K696 IonicContact OE1-NZ 3.5Å; E679-K696 PolarHBondContact OE1-NZ 2.84Å; E679-K696 IonicContact OE2-NZ 3.29Å; E679-K696 PolarHBondContact OE2-NZ 3.38Å; E679-H697 IonicContact OE1-CE1 3.35Å; E679-H697 PolarHBondContact OE1-CE1 3.24Å; E679-H697 IonicContact OE1-NE2 2.82Å
680	L	96.1	Very high	94.3	Very high	64 Å²	64	74.3 Å²	74.3	34%	0.335	41%	0.405	S	S	.	.	H	α-helix	trans	-120	-4.8	-174.6	-55.5	178.6	0	0	0	113.3	I676 P684 A689 V690 V693	I676-L680 HydrophobicContact CG2-CD1 4.41Å; I676-L680 WeakPolarHBondContact O-CA 3.49Å; I676-L680 WeakPolarHBondContact O-CB 3.26Å; I676-L680 PolarHBondContact O-N 3.33Å; L680-P684 HydrophobicContact CB-CB 4Å; L680-P684 HydrophobicContact CD1-CB 4.06Å; L680-A689 HydrophobicContact CD1-CB 3.86Å; L680-A689 HydrophobicContact CD2-CB 3.98Å; L680-V690 HydrophobicContact CD1-CG2 4.07Å; L680-V693 HydrophobicContact CD1-CG2 3.77Å; L680-V693 HydrophobicContact CD2-CG2 4.34Å; L680-V693 HydrophobicContact CG-CG2 3.91Å
681	G	93.6	Very high	94.4	Very high	23 Å²	23	72.4 Å²	72.4	24%	0.237	39%	0.392	C	S	.	.			trans	82.1	178.2	-174.5	0	0	0	0	0	113.9	E677 Q683	E677-G681 WeakPolarHBondContact CA-O 3.47Å; E677-G681 WeakPolarHBondContact O-CA 3.4Å; E677-G681 PolarHBondContact O-N 3.5Å; G681-Q683 VanDerWaalsContact C-N 3.28Å; G681-Q683 PolarHBondContact O-N 2.85Å
682	P	89.5	Confident	94.4	Very high	107 Å²	107	75.4 Å²	75.4	70%	0.695	41%	0.406	S	S	*	.	S	Bend	trans	-69.2	-21	-169.1	26.8	-35.7	0	0	0	114.6
683	Q	88.7	Confident	94.4	Very high	169 Å²	169	75.6 Å²	75.6	79%	0.79	41%	0.407	S	S	*	.	S	Bend	trans	-133.7	79.5	-179.3	-66.8	-172.5	5.4	0	0	110.3	G681 T685	G681-Q683 VanDerWaalsContact C-N 3.28Å; G681-Q683 PolarHBondContact O-N 2.85Å; Q683-T685 PolarHBondContact O-N 2.9Å
684	P	89	Confident	94.5	Very high	51 Å²	51	74.4 Å²	74.4	33%	0.331	40%	0.399	S	S	.	.			trans	-64.5	128.9	177.4	29	-36.7	0	0	0	110.5	I676 L680 V690	I676-P684 HydrophobicContact CG2-CB 4.28Å; I676-P684 HydrophobicContact CG2-CG 3.71Å; L680-P684 HydrophobicContact CB-CB 4Å; L680-P684 HydrophobicContact CD1-CB 4.06Å; P684-V690 HydrophobicContact CB-CG2 3.63Å; P684-V690 HydrophobicContact CG-CG2 3.76Å
685	T	88.3	Confident	94.5	Very high	122 Å²	122	71.6 Å²	71.6	75%	0.748	39%	0.39	S	S	*	.			trans	-93.4	-19.8	-177	54	0	0	0	0	114	Q683	Q683-T685 PolarHBondContact O-N 2.9Å
686	Q	91.9	Very high	94.6	Very high	121 Å²	121	74.1 Å²	74.1	57%	0.565	40%	0.401	S	S	*	.			trans	-110.4	111.3	-173.6	-63.8	-61.8	-26.6	0	0	111.4	H688 A689 V690	Q686-H688 PolarHBondContact O-N 3.37Å; Q686-A689 HydrophobicContact CB-CB 4Å; Q686-A689 WeakPolarHBondContact O-CB 3.45Å; Q686-A689 PolarHBondContact O-N 2.93Å; Q686-V690 PolarHBondContact O-N 2.99Å
687	P	93.1	Very high	94.5	Very high	72 Å²	72	73.9 Å²	73.9	47%	0.468	40%	0.399	S	S	.	.	H	α-helix	trans	-53.4	-37.7	176.5	-30.8	37.5	0	0	0	113.9	Y640 A689 V690 M691	Y640-P687 HydrophobicContact CE2-CB 4.41Å; P687-A689 VanDerWaalsContact C-N 3.35Å; P687-A689 PolarHBondContact O-N 3.35Å; P687-V690 PolarHBondContact O-N 3.44Å; P687-M691 PolarHBondContact O-N 3.41Å
688	H	94.8	Very high	94.5	Very high	131 Å²	131	69 Å²	69	61%	0.606	38%	0.376	S	S	*	.	H	α-helix	trans	-64.3	-39.7	179.2	-162.6	80.8	0	0	0	111.9	Q686 M691 Q692	Q686-H688 PolarHBondContact O-N 3.37Å; H688-M691 PolarHBondContact O-N 3.46Å; H688-Q692 PolarHBondContact NE2-NE2 2.67Å; H688-Q692 VanDerWaalsContact NE2-NE2 3.2Å; H688-Q692 WeakPolarHBondContact O-CG 3.09Å; H688-Q692 PolarHBondContact O-N 2.65Å
689	A	96.3	Very high	94.3	Very high	32 Å²	32	66.7 Å²	66.7	26%	0.264	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-41.7	177	0	0	0	0	0	111.4	L680 Q686 P687 M691 Q692 V693	L680-A689 HydrophobicContact CD1-CB 3.86Å; L680-A689 HydrophobicContact CD2-CB 3.98Å; Q686-A689 HydrophobicContact CB-CB 4Å; Q686-A689 WeakPolarHBondContact O-CB 3.45Å; Q686-A689 PolarHBondContact O-N 2.93Å; P687-A689 VanDerWaalsContact C-N 3.35Å; P687-A689 PolarHBondContact O-N 3.35Å; A689-M691 VanDerWaalsContact C-N 3.33Å; A689-M691 PolarHBondContact O-N 3.48Å; A689-Q692 PolarHBondContact O-N 2.92Å; A689-V693 WeakPolarHBondContact O-CG2 3.01Å; A689-V693 PolarHBondContact O-N 3.16Å; A689-V693 VanDerWaalsContact O-N 3.08Å
690	V	96.8	Very high	94	Very high	16 Å²	16	66.7 Å²	66.7	10%	0.097	37%	0.371	C	S	.	.	H	α-helix	trans	-58.6	-46.2	174.9	176.9	0	0	0	0	110.8	Y640 I676 L680 P684 Q686 P687 Q692 V693 I694	Y640-V690 HydrophobicContact CD2-CG1 4.05Å; Y640-V690 HydrophobicContact CE2-CB 4.4Å; Y640-V690 HydrophobicContact CE2-CG1 4.2Å; I676-V690 HydrophobicContact CD1-CG1 3.74Å; I676-V690 HydrophobicContact CG1-CG1 4.3Å; L680-V690 HydrophobicContact CD1-CG2 4.07Å; P684-V690 HydrophobicContact CB-CG2 3.63Å; P684-V690 HydrophobicContact CG-CG2 3.76Å; Q686-V690 PolarHBondContact O-N 2.99Å; P687-V690 PolarHBondContact O-N 3.44Å; V690-Q692 VanDerWaalsContact C-N 3.34Å; V690-Q692 PolarHBondContact O-N 3.33Å; V690-V693 PolarHBondContact O-N 2.82Å; V690-I694 HydrophobicContact CG1-CD1 4.08Å; V690-I694 WeakPolarHBondContact O-CG1 3.07Å; V690-I694 PolarHBondContact O-N 3.24Å
691	M	96.8	Very high	93.5	Very high	27 Å²	27	63.7 Å²	63.7	13%	0.133	36%	0.356	C	S	.	.	H	α-helix	trans	-60	-42.3	177.1	-175	58.1	73.2	0	0	112.2	P636 D637 Y640 P687 H688 A689 V693 I694 I695	P636-M691 HydrophobicContact CB-SD 4.08Å; D637-M691 WeakPolarHBondContact OD1-CE 3.23Å; Y640-M691 HydrophobicContact CD1-CE 4.42Å; Y640-M691 HydrophobicContact CD2-CE 4.13Å; Y640-M691 HydrophobicContact CG-CE 3.79Å; P687-M691 PolarHBondContact O-N 3.41Å; H688-M691 PolarHBondContact O-N 3.46Å; A689-M691 VanDerWaalsContact C-N 3.33Å; A689-M691 PolarHBondContact O-N 3.48Å; M691-V693 VanDerWaalsContact C-N 3.35Å; M691-V693 PolarHBondContact O-N 2.86Å; M691-I694 PolarHBondContact O-N 3.43Å; M691-I695 HydrophobicContact CG-CD1 3.84Å; M691-I695 HydrophobicContact CG-CG1 4.4Å; M691-I695 WeakPolarHBondContact O-CG1 3.2Å; M691-I695 PolarHBondContact O-N 3Å; M691-I695 HydrophobicContact SD-CD1 4.22Å; M691-I695 HydrophobicContact SD-CG1 4.28Å
692	Q	97	Very high	92.9	Very high	93 Å²	93	71.1 Å²	71.1	44%	0.435	38%	0.384	S	S	.	.	H	α-helix	trans	-61.7	-41	176.9	-67.6	-58.6	-24.3	0	0	112.3	H688 A689 V690 I694 I695 K696	H688-Q692 PolarHBondContact NE2-NE2 2.67Å; H688-Q692 VanDerWaalsContact NE2-NE2 3.2Å; H688-Q692 WeakPolarHBondContact O-CG 3.09Å; H688-Q692 PolarHBondContact O-N 2.65Å; A689-Q692 PolarHBondContact O-N 2.92Å; V690-Q692 VanDerWaalsContact C-N 3.34Å; V690-Q692 PolarHBondContact O-N 3.33Å; Q692-I694 VanDerWaalsContact C-N 3.35Å; Q692-I694 PolarHBondContact O-N 3.15Å; Q692-I695 PolarHBondContact O-N 3.29Å; Q692-K696 WeakPolarHBondContact O-CB 3.26Å; Q692-K696 PolarHBondContact O-N 3.02Å
693	V	97.4	Very high	92.4	Very high	5 Å²	5	77.1 Å²	77.1	3%	0.03	39%	0.393	C	S	.	.	H	α-helix	trans	-63.4	-41.2	175.2	176	0	0	0	0	111.4	K675 I676 E679 L680 A689 V690 M691 K696 H697	K675-V693 HydrophobicContact CB-CG1 4.23Å; I676-V693 HydrophobicContact CG1-CB 4.39Å; I676-V693 HydrophobicContact CG1-CG1 3.99Å; E679-V693 HydrophobicContact CB-CG2 4.18Å; L680-V693 HydrophobicContact CD1-CG2 3.77Å; L680-V693 HydrophobicContact CD2-CG2 4.34Å; L680-V693 HydrophobicContact CG-CG2 3.91Å; A689-V693 WeakPolarHBondContact O-CG2 3.01Å; A689-V693 PolarHBondContact O-N 3.16Å; A689-V693 VanDerWaalsContact O-N 3.08Å; V690-V693 PolarHBondContact O-N 2.82Å; M691-V693 VanDerWaalsContact C-N 3.35Å; M691-V693 PolarHBondContact O-N 2.86Å; V693-K696 PolarHBondContact O-N 3.26Å; V693-H697 PolarHBondContact O-N 3.39Å; V693-H697 VanDerWaalsContact O-N 3.15Å; V693-H697 PolarHBondContact O-ND1 3.47Å
694	I	97.3	Very high	92.2	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-60.6	-55	175.9	-67.2	167.9	0	0	0	109.6	P636 I639 Y640 L643 F672 V690 M691 Q692 K696 H697 I698	P636-I694 HydrophobicContact CB-CG2 3.97Å; I639-I694 HydrophobicContact CB-CG2 4.07Å; I639-I694 HydrophobicContact CG2-CD1 4.25Å; I639-I694 HydrophobicContact CG2-CG1 4.41Å; I639-I694 HydrophobicContact CG2-CG2 4.1Å; Y640-I694 HydrophobicContact CD2-CD1 4.28Å; L643-I694 HydrophobicContact CD1-CD1 3.87Å; L643-I694 HydrophobicContact CD1-CG1 4.38Å; F672-I694 HydrophobicContact CD1-CB 4.41Å; F672-I694 HydrophobicContact CD1-CG1 4.06Å; F672-I694 HydrophobicContact CD1-CG2 4.44Å; F672-I694 HydrophobicContact CE1-CB 4.31Å; F672-I694 HydrophobicContact CE1-CG1 4.44Å; F672-I694 HydrophobicContact CE1-CG2 4.04Å; F672-I694 HydrophobicContact CZ-CG2 4.42Å; V690-I694 HydrophobicContact CG1-CD1 4.08Å; V690-I694 WeakPolarHBondContact O-CG1 3.07Å; V690-I694 PolarHBondContact O-N 3.24Å; M691-I694 PolarHBondContact O-N 3.43Å; Q692-I694 VanDerWaalsContact C-N 3.35Å; Q692-I694 PolarHBondContact O-N 3.15Å; I694-K696 VanDerWaalsContact C-N 3.27Å; I694-K696 PolarHBondContact O-N 2.79Å; I694-H697 PolarHBondContact O-N 2.96Å; I694-H697 VanDerWaalsContact O-N 3.08Å; I694-I698 HydrophobicContact CG2-CD1 4.42Å; I694-I698 WeakPolarHBondContact O-CB 3.09Å; I694-I698 PolarHBondContact O-N 3.31Å
695	I	97.1	Very high	92.1	Very high	84 Å²	84	70.1 Å²	70.1	43%	0.431	36%	0.364	S	S	.	.	H	α-helix	trans	-56	-42.8	179.7	-68.4	169.1	0	0	0	111	P636 M691 Q692 H697	P636-I695 HydrophobicContact CB-CG1 4.02Å; P636-I695 HydrophobicContact CG-CG1 4.31Å; M691-I695 HydrophobicContact CG-CD1 3.84Å; M691-I695 HydrophobicContact CG-CG1 4.4Å; M691-I695 WeakPolarHBondContact O-CG1 3.2Å; M691-I695 PolarHBondContact O-N 3Å; M691-I695 HydrophobicContact SD-CD1 4.22Å; M691-I695 HydrophobicContact SD-CG1 4.28Å; Q692-I695 PolarHBondContact O-N 3.29Å; I695-H697 VanDerWaalsContact C-N 3.32Å; I695-H697 PolarHBondContact O-N 3.32Å
696	K	96.6	Very high	92.1	Very high	127 Å²	127	71.6 Å²	71.6	55%	0.552	37%	0.367	S	S	*	.	H	α-helix	trans	-60.7	-37.4	178.5	-178.7	-177.4	177.5	-168.4	0	113.1	E679 Q692 V693 I694	E679-K696 IonicContact OE1-NZ 3.5Å; E679-K696 PolarHBondContact OE1-NZ 2.84Å; E679-K696 IonicContact OE2-NZ 3.29Å; E679-K696 PolarHBondContact OE2-NZ 3.38Å; Q692-K696 WeakPolarHBondContact O-CB 3.26Å; Q692-K696 PolarHBondContact O-N 3.02Å; V693-K696 PolarHBondContact O-N 3.26Å; I694-K696 VanDerWaalsContact C-N 3.27Å; I694-K696 PolarHBondContact O-N 2.79Å
697	H	95.8	Very high	92	Very high	12 Å²	12	67.2 Å²	67.2	6%	0.056	35%	0.348	C	S	.	.	H	α-helix	trans	-102.6	-13	-173.1	-68.9	91.3	0	0	0	114.9	F672 E679 V693 I694 I695 G699 N700	F672-H697 HydrophobicContact CE1-CB 4.11Å; E679-H697 IonicContact OE1-CE1 3.35Å; E679-H697 PolarHBondContact OE1-CE1 3.24Å; E679-H697 IonicContact OE1-NE2 2.82Å; V693-H697 PolarHBondContact O-N 3.39Å; V693-H697 VanDerWaalsContact O-N 3.15Å; V693-H697 PolarHBondContact O-ND1 3.47Å; I694-H697 PolarHBondContact O-N 2.96Å; I694-H697 VanDerWaalsContact O-N 3.08Å; I695-H697 VanDerWaalsContact C-N 3.32Å; I695-H697 PolarHBondContact O-N 3.32Å; H697-G699 VanDerWaalsContact C-N 3.25Å; H697-G699 PolarHBondContact O-N 3.36Å; H697-N700 WeakPolarHBondContact O-CB 3.37Å; H697-N700 PolarHBondContact O-N 2.92Å
698	I	95.4	Very high	91.8	Very high	11 Å²	11	68.2 Å²	68.2	6%	0.056	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-32.7	-171.4	-155.6	168.6	0	0	0	113.3	M632 V633 P636 I639 F672 I694 N700 T701	M632-I698 HydrophobicContact CG-CD1 4.31Å; M632-I698 HydrophobicContact CG-CG1 4.16Å; M632-I698 WeakPolarHBondContact O-CD1 3.32Å; V633-I698 HydrophobicContact CG1-CG2 4.41Å; P636-I698 HydrophobicContact CB-CD1 4.05Å; I639-I698 HydrophobicContact CG1-CD1 4.23Å; F672-I698 HydrophobicContact CZ-CB 4.17Å; F672-I698 HydrophobicContact CZ-CG1 4.02Å; I694-I698 HydrophobicContact CG2-CD1 4.42Å; I694-I698 WeakPolarHBondContact O-CB 3.09Å; I694-I698 PolarHBondContact O-N 3.31Å; I698-N700 VanDerWaalsContact C-N 3.25Å; I698-N700 PolarHBondContact O-N 2.88Å; I698-T701 WeakPolarHBondContact O-CB 3.4Å; I698-T701 VanDerWaalsContact O-CG2 3.28Å; I698-T701 WeakPolarHBondContact O-CG2 3.35Å; I698-T701 PolarHBondContact O-N 3.12Å; I698-T701 PolarHBondContact O-OG1 3.21Å
699	G	92.3	Very high	91.4	Very high	51 Å²	51	70.9 Å²	70.9	53%	0.526	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-19.8	175.2	0	0	0	0	0	114.7	H697	H697-G699 VanDerWaalsContact C-N 3.25Å; H697-G699 PolarHBondContact O-N 3.36Å
700	N	89.8	Confident	91	Very high	82 Å²	82	72 Å²	72	44%	0.439	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-6.8	-179.3	-64	-32.3	0	0	0	113.2	H697 I698 Q702 R703 S704	H697-N700 WeakPolarHBondContact O-CB 3.37Å; H697-N700 PolarHBondContact O-N 2.92Å; I698-N700 VanDerWaalsContact C-N 3.25Å; I698-N700 PolarHBondContact O-N 2.88Å; N700-Q702 VanDerWaalsContact C-N 3.35Å; N700-Q702 PolarHBondContact O-N 3.31Å; N700-R703 PolarHBondContact O-N 3.48Å; N700-S704 WeakPolarHBondContact O-CB 2.91Å; N700-S704 PolarHBondContact O-N 2.7Å; N700-S704 VanDerWaalsContact O-N 3.11Å; N700-S704 PolarHBondContact O-OG 2.86Å
701	T	86.6	Confident	90.7	Very high	2 Å²	2	76.6 Å²	76.6	1%	0.012	38%	0.384	C	S	.	.	H	α-helix	trans	-63.2	-36.8	-174.6	53.6	0	0	0	0	112.8	M632 F672 I698 R703 S704 C705	M632-T701 VanDerWaalsContact CE-CB 3.41Å; M632-T701 HydrophobicContact CE-CG2 3.97Å; M632-T701 VanDerWaalsContact CE-OG1 3.23Å; M632-T701 WeakPolarHBondContact CE-OG1 3.32Å; M632-T701 HydrophobicContact SD-CG2 4.13Å; F672-T701 HydrophobicContact CE2-CG2 3.81Å; F672-T701 HydrophobicContact CZ-CG2 3.64Å; I698-T701 WeakPolarHBondContact O-CB 3.4Å; I698-T701 VanDerWaalsContact O-CG2 3.28Å; I698-T701 WeakPolarHBondContact O-CG2 3.35Å; I698-T701 PolarHBondContact O-N 3.12Å; I698-T701 PolarHBondContact O-OG1 3.21Å; T701-R703 PolarHBondContact O-N 2.8Å; T701-R703 VanDerWaalsContact O-N 3.14Å; T701-S704 PolarHBondContact O-N 3.25Å; T701-C705 WeakPolarHBondContact O-CB 3.22Å; T701-C705 PolarHBondContact O-N 3.09Å
702	Q	80.7	Confident	90.4	Very high	179 Å²	179	80.2 Å²	80.2	84%	0.836	40%	0.403	S	S	*	.	H	α-helix	trans	-60.2	-27.9	178.2	-169.8	174.7	4.9	0	0	113.1	N700	N700-Q702 VanDerWaalsContact C-N 3.35Å; N700-Q702 PolarHBondContact O-N 3.31Å
703	R	79.9	Confident	90.2	Very high	232 Å²	232	76.8 Å²	76.8	88%	0.875	39%	0.388	S	S	*	.	H	α-helix	trans	-91.1	-26.8	175.6	-62.5	-178.6	-176.7	179.2	0.8	113	N700 T701	N700-R703 PolarHBondContact O-N 3.48Å; T701-R703 PolarHBondContact O-N 2.8Å; T701-R703 VanDerWaalsContact O-N 3.14Å
704	S	83.1	Confident	90	Very high	65 Å²	65	83 Å²	83	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-101.4	-24.4	-168.8	-50.8	0	0	0	0	113.8	H671 N700 T701	H671-S704 WeakPolarHBondContact CE1-CB 3.49Å; N700-S704 WeakPolarHBondContact O-CB 2.91Å; N700-S704 PolarHBondContact O-N 2.7Å; N700-S704 VanDerWaalsContact O-N 3.11Å; N700-S704 PolarHBondContact O-OG 2.86Å; T701-S704 PolarHBondContact O-N 3.25Å
705	C	87	Confident	90	Very high	9 Å²	9	86.3 Å²	86.3	6%	0.061	43%	0.429	C	S	.	.			trans	-112.5	105.2	-177.9	-60.4	0	0	0	0	108.6	I667 T701 L707	I667-C705 HydrophobicContact CG2-CB 4.04Å; T701-C705 WeakPolarHBondContact O-CB 3.22Å; T701-C705 PolarHBondContact O-N 3.09Å; C705-L707 VanDerWaalsContact C-N 3.31Å; C705-L707 HydrophobicContact CB-CD2 3.98Å; C705-L707 HydrophobicContact CB-CG 4.17Å; C705-L707 PolarHBondContact O-N 2.77Å
706	N	88.1	Confident	89.9	Confident	152 Å²	152	89.6 Å²	89.6	81%	0.813	44%	0.441	S	S	*	.			trans	-82	78.6	174.7	-169.5	19.5	0	0	0	110
707	L	91.1	Very high	89.8	Confident	30 Å²	30	85 Å²	85	16%	0.157	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-73.4	133.3	-177	-56.9	-175.3	0	0	0	111.1	M632 N664 I667 V668 C705 K709	M632-L707 HydrophobicContact CE-CD1 4.35Å; N664-L707 HydrophobicContact CB-CD2 4.13Å; N664-L707 WeakPolarHBondContact OD1-CA 3.39Å; I667-L707 HydrophobicContact CB-CD2 4.34Å; I667-L707 HydrophobicContact CG2-CD2 4.05Å; V668-L707 HydrophobicContact CG2-CD1 4.38Å; V668-L707 HydrophobicContact CG2-CD2 3.82Å; C705-L707 VanDerWaalsContact C-N 3.31Å; C705-L707 HydrophobicContact CB-CD2 3.98Å; C705-L707 HydrophobicContact CB-CG 4.17Å; C705-L707 PolarHBondContact O-N 2.77Å; L707-K709 PolarHBondContact O-N 3.36Å
708	K	88.9	Confident	89.4	Confident	93 Å²	93	89.7 Å²	89.7	40%	0.404	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-62.8	132.3	169.9	-175.4	176.7	179.1	178.1	0	109	N660 N664 F710	N660-K708 PolarHBondContact OD1-NZ 2.83Å; N664-K708 PolarHBondContact ND2-O 3.4Å; N664-K708 WeakPolarHBondContact OD1-CB 3.45Å; N664-K708 PolarHBondContact OD1-N 2.8Å; K708-F710 HydrophobicContact CB-CE2 4.43Å; K708-F710 HydrophobicContact CD-CZ 4.4Å; K708-F710 WeakPolarHBondContact O-CD2 2.85Å
709	K	84.6	Confident	89	Confident	187 Å²	187	91 Å²	91	81%	0.813	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-78.4	128.5	174.9	-65.7	-174	178.5	-176.5	0	110	L707	L707-K709 PolarHBondContact O-N 3.36Å
710	F	89.4	Confident	88.5	Confident	54 Å²	54	94.2 Å²	94.2	24%	0.237	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-100.4	158	169.7	-70.9	-87.7	0	0	0	109.7	N625 N660 V661 N664 K708	N625-F710 HydrophobicContact CB-CD2 4.37Å; N660-F710 WeakPolarHBondContact O-CZ 3.31Å; V661-F710 HydrophobicContact CG1-CE1 4Å; V661-F710 HydrophobicContact CG1-CZ 4.31Å; N664-F710 WeakPolarHBondContact ND2-CE2 3.49Å; K708-F710 HydrophobicContact CB-CE2 4.43Å; K708-F710 HydrophobicContact CD-CZ 4.4Å; K708-F710 WeakPolarHBondContact O-CD2 2.85Å
711	P	90.4	Very high	87.8	Confident	113 Å²	113	99.6 Å²	99.6	73%	0.734	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-55.6	142.9	168.5	-22.6	33.9	0	0	0	111.1	L713	P711-L713 PolarHBondContact O-N 2.72Å
712	D	89.4	Confident	87.5	Confident	103 Å²	103	102.6 Å²	102.6	55%	0.551	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-62.5	130	175.8	-69.7	-19.7	0	0	0	110	H630 K714	H630-D712 IonicContact CE1-OD1 3.51Å; H630-D712 IonicContact NE2-OD1 2.82Å; D712-K714 HydrophobicContact CB-CG 4.44Å; D712-K714 PolarHBondContact O-N 3.14Å
713	L	93	Very high	87.6	Confident	22 Å²	22	95.2 Å²	95.2	12%	0.115	47%	0.468	C	S	.	.			trans	-75.3	106.5	174.2	-63	176.8	0	0	0	109.4	A538 E622 I623 P711 F715	A538-L713 HydrophobicContact CB-CB 4.01Å; A538-L713 HydrophobicContact CB-CD1 3.98Å; A538-L713 HydrophobicContact CB-CG 4.5Å; E622-L713 HydrophobicContact CB-CD1 4.19Å; E622-L713 HydrophobicContact CB-CD2 4.41Å; I623-L713 HydrophobicContact CG1-CD1 4.18Å; P711-L713 PolarHBondContact O-N 2.72Å; L713-F715 HydrophobicContact CB-CE2 4.28Å; L713-F715 HydrophobicContact CD2-CE2 4.33Å
714	K	93.8	Very high	87.7	Confident	134 Å²	134	85.9 Å²	85.9	58%	0.583	44%	0.435	S	S	*	.			trans	-134.2	118.5	174.2	-61.1	-164.5	-175.1	-159	0	110	E478 D712	E478-K714 IonicContact OE1-NZ 2.97Å; E478-K714 PolarHBondContact OE1-NZ 3.23Å; D712-K714 HydrophobicContact CB-CG 4.44Å; D712-K714 PolarHBondContact O-N 3.14Å
715	F	96.6	Very high	87.8	Confident	71 Å²	71	88.9 Å²	88.9	31%	0.311	44%	0.442	S	S	.	.			trans	-118.9	141.9	178.5	-65.7	-90.8	0	0	0	109.4	A535 A538 N539 M619 L713	A535-F715 HydrophobicContact CB-CB 3.7Å; A535-F715 HydrophobicContact CB-CD1 4.03Å; A535-F715 HydrophobicContact CB-CD2 4.28Å; A535-F715 HydrophobicContact CB-CG 3.74Å; A538-F715 HydrophobicContact CB-CD2 3.67Å; A538-F715 HydrophobicContact CB-CE2 3.45Å; A538-F715 VanDerWaalsContact CB-CE2 3.45Å; N539-F715 PolarHBondContact ND2-O 2.76Å; N539-F715 PolarHBondContact OD1-N 3.41Å; N539-F715 PolarHBondContact OD1-O 3.33Å; M619-F715 HydrophobicContact CE-CZ 3.83Å; M619-F715 HydrophobicContact SD-CE2 4.5Å; M619-F715 HydrophobicContact SD-CZ 4.24Å; L713-F715 HydrophobicContact CB-CE2 4.28Å; L713-F715 HydrophobicContact CD2-CE2 4.33Å
716	K	94.7	Very high	87.7	Confident	153 Å²	153	93.7 Å²	93.7	67%	0.665	46%	0.462	S	S	*	.			trans	-124.8	139.5	177	171.1	162.3	-170	-174.1	0	108.6	E476	E476-K716 WeakPolarHBondContact OE2-CG 3.5Å
717	Y	94.3	Very high	87.7	Confident	30 Å²	30	88.3 Å²	88.3	12%	0.118	43%	0.431	C	S	.	.			trans	-67.7	132.8	170.3	178.9	-106.3	0	0	0	110.1	Y423 H427 I469 L472 I473 E476 E719	Y423-Y717 AromaticContact CE2-CE1 3.76Å; Y423-Y717 HydrophobicContact CE2-CE1 3.76Å; Y423-Y717 PolarHBondContact OH-OH 3.43Å; H427-Y717 AromaticContact CD2-CD1 3.82Å; H427-Y717 AromaticContact NE2-CD1 3.78Å; I469-Y717 HydrophobicContact CB-CE2 4.27Å; I469-Y717 HydrophobicContact CD1-CE2 4.02Å; I469-Y717 HydrophobicContact CG1-CD2 4.31Å; I469-Y717 HydrophobicContact CG1-CE2 3.77Å; I469-Y717 HydrophobicContact CG2-CD1 4.19Å; I469-Y717 HydrophobicContact CG2-CD2 3.83Å; I469-Y717 HydrophobicContact CG2-CE1 3.92Å; I469-Y717 HydrophobicContact CG2-CE2 3.56Å; I469-Y717 HydrophobicContact CG2-CG 4.14Å; L472-Y717 HydrophobicContact CD2-CD2 4.26Å; I473-Y717 HydrophobicContact CD1-CD1 3.98Å; I473-Y717 HydrophobicContact CD1-CG 4.4Å; I473-Y717 HydrophobicContact CG1-CD1 4.05Å; I473-Y717 HydrophobicContact CG1-CG 4.06Å; E476-Y717 WeakPolarHBondContact OE1-CB 3.48Å; E476-Y717 PolarHBondContact OE1-N 3.26Å; Y717-E719 HydrophobicContact CE1-CG 3.86Å
718	V	88.8	Confident	87.8	Confident	111 Å²	111	87 Å²	87	67%	0.673	43%	0.425	S	S	*	.			trans	-131.8	123.3	177.7	-178.4	0	0	0	0	106.9
719	E	86.3	Confident	87.9	Confident	37 Å²	37	83.9 Å²	83.9	17%	0.173	41%	0.413	C	S	.	.			trans	-63.6	144.5	170.6	-78.8	173.8	166.4	0	0	109.7	Y423 H427 R428 Y717	Y423-E719 VanDerWaalsContact OH-CD 3.32Å; Y423-E719 VanDerWaalsContact OH-CG 3.24Å; Y423-E719 WeakPolarHBondContact OH-CG 3.3Å; Y423-E719 PolarHBondContact OH-OE1 3.03Å; H427-E719 VanDerWaalsContact CE1-CG 3.49Å; H427-E719 WeakPolarHBondContact CE1-CG 3.45Å; H427-E719 IonicContact CE1-OE1 2.98Å; H427-E719 PolarHBondContact CE1-OE1 2.87Å; H427-E719 VanDerWaalsContact CE1-OE1 3.24Å; H427-E719 IonicContact CE1-OE2 2.71Å; H427-E719 PolarHBondContact CE1-OE2 3.36Å; H427-E719 VanDerWaalsContact ND1-CD 3.34Å; H427-E719 IonicContact ND1-OE1 2.61Å; H427-E719 PolarHBondContact ND1-OE1 3.1Å; H427-E719 IonicContact ND1-OE2 2.73Å; R428-E719 IonicContact CZ-OE2 3.17Å; R428-E719 IonicContact NH1-OE2 3.95Å; R428-E719 PolarHBondContact NH1-OE2 2.83Å; Y717-E719 HydrophobicContact CE1-CG 3.86Å
720	E	81.8	Confident	88.3	Confident	120 Å²	120	75.4 Å²	75.4	56%	0.561	38%	0.377	S	S	*	.			trans	-57.7	159.6	168.2	-67.7	-66.8	159.1	0	0	111.1	S722 P723	E720-S722 VanDerWaalsContact C-N 3.31Å; E720-S722 PolarHBondContact O-N 3.14Å; E720-P723 VanDerWaalsContact O-CD 3.29Å; E720-P723 WeakPolarHBondContact O-CD 3.4Å
721	E	76.4	Confident	88.5	Confident	195 Å²	195	73 Å²	73	91%	0.911	37%	0.366	S	S	*	.	S	Bend	trans	-61.7	-36.9	-176.8	-65.5	-173.3	164.9	0	0	113.3	P723	E721-P723 VanDerWaalsContact C-CD 3.47Å; E721-P723 WeakPolarHBondContact O-CD 3.34Å
722	S	79.8	Confident	88.7	Confident	64 Å²	64	67.6 Å²	67.6	45%	0.448	33%	0.331	S	S	.	.			trans	-121.5	65.2	-178.9	-64.6	0	0	0	0	111.4	E720 D724 E725	E720-S722 VanDerWaalsContact C-N 3.31Å; E720-S722 PolarHBondContact O-N 3.14Å; S722-D724 PolarHBondContact O-N 2.78Å; S722-E725 PolarHBondContact O-N 3.21Å
723	P	82.6	Confident	88.9	Confident	25 Å²	25	64 Å²	64	16%	0.162	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-30.6	-172.7	29.7	-33.1	0	0	0	111.2	E720 E721 E725 F726 F727	E720-P723 VanDerWaalsContact O-CD 3.29Å; E720-P723 WeakPolarHBondContact O-CD 3.4Å; E721-P723 VanDerWaalsContact C-CD 3.47Å; E721-P723 WeakPolarHBondContact O-CD 3.34Å; P723-E725 PolarHBondContact O-N 2.95Å; P723-E725 VanDerWaalsContact O-N 3.15Å; P723-F726 PolarHBondContact O-N 3.4Å; P723-F727 HydrophobicContact CB-CD2 3.7Å; P723-F727 HydrophobicContact CB-CE2 3.72Å; P723-F727 WeakPolarHBondContact O-CD2 3.43Å; P723-F727 PolarHBondContact O-N 2.94Å
724	D	82.6	Confident	88.8	Confident	36 Å²	36	62.9 Å²	62.9	19%	0.193	31%	0.308	C	S	.	.	H	α-helix	trans	-54.5	-32.1	177.9	-72.4	5	0	0	0	113.1	A318 S722 F726 F727 I728	A318-D724 VanDerWaalsContact CB-OD1 3.3Å; A318-D724 WeakPolarHBondContact CB-OD1 3.33Å; A318-D724 WeakPolarHBondContact CB-OD2 3.26Å; A318-D724 PolarHBondContact N-OD2 3.37Å; S722-D724 PolarHBondContact O-N 2.78Å; D724-F726 PolarHBondContact O-N 2.93Å; D724-F727 PolarHBondContact O-N 2.84Å; D724-I728 HydrophobicContact CB-CD1 3.83Å; D724-I728 HydrophobicContact CB-CG1 4.36Å; D724-I728 WeakPolarHBondContact O-CB 3.15Å; D724-I728 VanDerWaalsContact O-CG1 3.3Å; D724-I728 WeakPolarHBondContact O-CG1 3.21Å; D724-I728 PolarHBondContact O-N 3.17Å
725	E	84	Confident	88.8	Confident	127 Å²	127	56.5 Å²	56.5	59%	0.593	28%	0.281	S	S	*	.	H	α-helix	trans	-61.7	-29.2	178.8	-63.3	-178.4	-178.8	0	0	112.7	L185 S722 P723 P729	L185-E725 HydrophobicContact CD2-CB 3.9Å; L185-E725 HydrophobicContact CD2-CG 3.93Å; S722-E725 PolarHBondContact O-N 3.21Å; P723-E725 PolarHBondContact O-N 2.95Å; P723-E725 VanDerWaalsContact O-N 3.15Å; E725-P729 VanDerWaalsContact O-CD 3.31Å; E725-P729 WeakPolarHBondContact O-CD 3.44Å; E725-P729 WeakPolarHBondContact O-CG 3.46Å
726	F	85.2	Confident	88.4	Confident	111 Å²	111	56.9 Å²	56.9	49%	0.487	28%	0.28	S	S	.	.	H	α-helix	trans	-95.3	-46.5	175.2	178	-93.5	0	0	0	112.1	H462 P723 D724 I728 P729 Y730	H462-F726 AromaticContact CE1-CE2 3.79Å; H462-F726 AromaticContact CE1-CZ 3.65Å; H462-F726 AromaticContact ND1-CZ 3.48Å; H462-F726 WeakPolarHBondContact ND1-CZ 3.37Å; P723-F726 PolarHBondContact O-N 3.4Å; D724-F726 PolarHBondContact O-N 2.93Å; F726-I728 PolarHBondContact O-N 3.25Å; F726-P729 WeakPolarHBondContact O-CD 3.18Å; F726-Y730 HydrophobicContact CE1-CG 4.44Å; F726-Y730 VanDerWaalsContact O-CB 3.25Å; F726-Y730 WeakPolarHBondContact O-CB 3.24Å; F726-Y730 PolarHBondContact O-N 3.12Å
727	F	88.9	Confident	88.1	Confident	38 Å²	38	55.4 Å²	55.4	17%	0.167	27%	0.27	C	S	.	.	H	α-helix	trans	-65.6	-38.1	-173.7	-80.5	-74.2	0	0	0	113	L420 Y423 P723 D724 Y730 V731	L420-F727 HydrophobicContact CD1-CD1 3.87Å; L420-F727 HydrophobicContact CD1-CE1 3.59Å; Y423-F727 HydrophobicContact CD1-CE1 4.23Å; Y423-F727 HydrophobicContact CD1-CZ 4.27Å; Y423-F727 AromaticContact CE1-CE1 3.86Å; Y423-F727 HydrophobicContact CE1-CE1 3.86Å; Y423-F727 HydrophobicContact CE1-CE2 4.43Å; Y423-F727 AromaticContact CE1-CZ 3.48Å; Y423-F727 HydrophobicContact CE1-CZ 3.48Å; Y423-F727 VanDerWaalsContact CE1-CZ 3.48Å; Y423-F727 AromaticContact CZ-CZ 3.96Å; P723-F727 HydrophobicContact CB-CD2 3.7Å; P723-F727 HydrophobicContact CB-CE2 3.72Å; P723-F727 WeakPolarHBondContact O-CD2 3.43Å; P723-F727 PolarHBondContact O-N 2.94Å; D724-F727 PolarHBondContact O-N 2.84Å; F727-Y730 PolarHBondContact O-N 3.46Å; F727-V731 WeakPolarHBondContact O-CB 3.39Å; F727-V731 WeakPolarHBondContact O-CG2 3.22Å; F727-V731 PolarHBondContact O-N 2.82Å
728	I	91.5	Very high	87.9	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-55.2	-176.9	-65.1	165.5	0	0	0	110.7	L185 D724 F726 Y730 V731 W732 L750	L185-I728 HydrophobicContact CD1-CB 4.14Å; L185-I728 HydrophobicContact CD1-CD1 3.85Å; L185-I728 HydrophobicContact CD1-CG2 4.14Å; D724-I728 HydrophobicContact CB-CD1 3.83Å; D724-I728 HydrophobicContact CB-CG1 4.36Å; D724-I728 WeakPolarHBondContact O-CB 3.15Å; D724-I728 VanDerWaalsContact O-CG1 3.3Å; D724-I728 WeakPolarHBondContact O-CG1 3.21Å; D724-I728 PolarHBondContact O-N 3.17Å; F726-I728 PolarHBondContact O-N 3.25Å; I728-Y730 VanDerWaalsContact C-N 3.28Å; I728-Y730 PolarHBondContact O-N 2.98Å; I728-V731 PolarHBondContact O-N 3.01Å; I728-W732 VanDerWaalsContact O-CD1 3.31Å; I728-W732 PolarHBondContact O-N 2.54Å; I728-L750 HydrophobicContact CG2-CD1 4.15Å; I728-L750 HydrophobicContact CG2-CD2 4.19Å
729	P	92.3	Very high	87.8	Confident	26 Å²	26	51 Å²	51	17%	0.169	24%	0.244	C	C	.	.	H	α-helix	trans	-58.9	-39.8	173.7	-23.7	34	0	0	0	112.3	E725 F726 W732 S733 L750 F751	E725-P729 VanDerWaalsContact O-CD 3.31Å; E725-P729 WeakPolarHBondContact O-CD 3.44Å; E725-P729 WeakPolarHBondContact O-CG 3.46Å; F726-P729 WeakPolarHBondContact O-CD 3.18Å; P729-W732 PolarHBondContact O-N 3.39Å; P729-S733 WeakPolarHBondContact O-CB 3.44Å; P729-S733 PolarHBondContact O-N 3.15Å; P729-L750 HydrophobicContact CB-CG 4.4Å; P729-L750 HydrophobicContact CG-CD1 4.21Å; P729-L750 HydrophobicContact CG-CG 4.28Å; P729-F751 HydrophobicContact CB-CD1 4.47Å; P729-F751 VanDerWaalsContact O-CE1 3.3Å; P729-F751 WeakPolarHBondContact O-CE1 3.41Å
730	Y	91.9	Very high	87.5	Confident	10 Å²	10	51 Å²	51	4%	0.039	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-48	-179.6	-177.9	-113.1	0	0	0	112.3	D416 L420 H462 M466 F726 F727 I728 W732 S733 V734	D416-Y730 PolarHBondContact OD2-OH 3.3Å; D416-Y730 VanDerWaalsContact OD2-OH 3.13Å; L420-Y730 HydrophobicContact CD2-CD1 4.12Å; L420-Y730 HydrophobicContact CD2-CE1 4.09Å; H462-Y730 HydrophobicContact CB-CD2 4.37Å; H462-Y730 HydrophobicContact CB-CE2 3.48Å; H462-Y730 VanDerWaalsContact CB-CE2 3.48Å; H462-Y730 AromaticContact CD2-CD2 3.95Å; H462-Y730 AromaticContact CD2-CE2 3.57Å; H462-Y730 AromaticContact CG-CD2 3.95Å; H462-Y730 AromaticContact CG-CE2 3.47Å; H462-Y730 VanDerWaalsContact CG-CE2 3.47Å; M466-Y730 HydrophobicContact CE-CE1 4.11Å; M466-Y730 WeakPolarHBondContact CE-OH 3.34Å; M466-Y730 HydrophobicContact SD-CE1 4.09Å; F726-Y730 HydrophobicContact CE1-CG 4.44Å; F726-Y730 VanDerWaalsContact O-CB 3.25Å; F726-Y730 WeakPolarHBondContact O-CB 3.24Å; F726-Y730 PolarHBondContact O-N 3.12Å; F727-Y730 PolarHBondContact O-N 3.46Å; I728-Y730 VanDerWaalsContact C-N 3.28Å; I728-Y730 PolarHBondContact O-N 2.98Å; Y730-W732 VanDerWaalsContact C-N 3.34Å; Y730-W732 PolarHBondContact O-N 3.11Å; Y730-S733 WeakPolarHBondContact O-CA 3.42Å; Y730-S733 VanDerWaalsContact O-CB 3.3Å; Y730-S733 WeakPolarHBondContact O-CB 3.07Å; Y730-S733 PolarHBondContact O-N 3.14Å; Y730-S733 PolarHBondContact O-OG 3.33Å; Y730-V734 HydrophobicContact CD1-CG2 4.35Å; Y730-V734 HydrophobicContact CE1-CG2 3.91Å; Y730-V734 HydrophobicContact CE2-CG2 4.12Å; Y730-V734 WeakPolarHBondContact O-CG2 3.48Å; Y730-V734 PolarHBondContact O-N 3.11Å
731	V	94.3	Very high	87.6	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.012	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-45.7	177.9	166.6	0	0	0	0	111.1	L312 I313 T316 L420 F727 I728 S733 V734 V735	L312-V731 HydrophobicContact CB-CG1 3.96Å; L312-V731 HydrophobicContact CB-CG2 4.41Å; I313-V731 HydrophobicContact CG1-CG1 4.24Å; T316-V731 HydrophobicContact CG2-CB 3.66Å; T316-V731 HydrophobicContact CG2-CG1 3.81Å; T316-V731 HydrophobicContact CG2-CG2 3.42Å; T316-V731 VanDerWaalsContact CG2-CG2 3.42Å; L420-V731 HydrophobicContact CD2-CG2 3.47Å; L420-V731 VanDerWaalsContact CD2-CG2 3.47Å; F727-V731 WeakPolarHBondContact O-CB 3.39Å; F727-V731 WeakPolarHBondContact O-CG2 3.22Å; F727-V731 PolarHBondContact O-N 2.82Å; I728-V731 PolarHBondContact O-N 3.01Å; V731-S733 VanDerWaalsContact C-N 3.26Å; V731-S733 PolarHBondContact O-N 3.32Å; V731-V734 WeakPolarHBondContact O-CB 3.47Å; V731-V734 PolarHBondContact O-N 3.44Å; V731-V735 HydrophobicContact CG1-CG2 4.26Å; V731-V735 VanDerWaalsContact O-CG2 3.28Å; V731-V735 WeakPolarHBondContact O-CG2 3.43Å; V731-V735 PolarHBondContact O-N 3.24Å
732	W	95	Very high	87.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-31.1	176.1	-77	112.2	0	0	0	112.7	I174 L177 Q180 M181 I313 I728 P729 Y730 V734 V735 R736 L750 F751	I174-W732 HydrophobicContact CG2-CZ3 4.42Å; L177-W732 HydrophobicContact CB-CH2 4.1Å; L177-W732 HydrophobicContact CB-CZ2 4.42Å; L177-W732 WeakPolarHBondContact O-CZ2 3.41Å; Q180-W732 HydrophobicContact CB-CZ2 4.25Å; M181-W732 HydrophobicContact CE-CE3 4.34Å; M181-W732 HydrophobicContact CG-CB 3.77Å; M181-W732 HydrophobicContact CG-CD2 3.55Å; M181-W732 HydrophobicContact CG-CE3 3.68Å; M181-W732 HydrophobicContact CG-CG 3.6Å; M181-W732 HydrophobicContact SD-CB 3.94Å; M181-W732 HydrophobicContact SD-CD2 3.97Å; M181-W732 HydrophobicContact SD-CE3 3.53Å; M181-W732 VanDerWaalsContact SD-CE3 3.53Å; M181-W732 HydrophobicContact SD-CG 4.17Å; M181-W732 HydrophobicContact SD-CZ3 4.37Å; I313-W732 HydrophobicContact CD1-CE3 4.49Å; I313-W732 HydrophobicContact CD1-CH2 3.6Å; I313-W732 HydrophobicContact CD1-CZ2 4.3Å; I313-W732 HydrophobicContact CD1-CZ3 3.73Å; I313-W732 HydrophobicContact CG1-CH2 3.86Å; I313-W732 HydrophobicContact CG1-CZ2 4.06Å; I313-W732 HydrophobicContact CG1-CZ3 4.16Å; I313-W732 HydrophobicContact CG2-CH2 3.97Å; I313-W732 HydrophobicContact CG2-CZ2 3.78Å; I728-W732 VanDerWaalsContact O-CD1 3.31Å; I728-W732 PolarHBondContact O-N 2.54Å; P729-W732 PolarHBondContact O-N 3.39Å; Y730-W732 VanDerWaalsContact C-N 3.34Å; Y730-W732 PolarHBondContact O-N 3.11Å; W732-V734 VanDerWaalsContact C-N 3.32Å; W732-V734 PolarHBondContact O-N 2.92Å; W732-V735 HydrophobicContact CE3-CB 4Å; W732-V735 HydrophobicContact CE3-CG1 3.95Å; W732-V735 HydrophobicContact CE3-CG2 4.2Å; W732-V735 HydrophobicContact CZ3-CB 4.41Å; W732-V735 HydrophobicContact CZ3-CG1 3.92Å; W732-V735 HydrophobicContact CZ3-CG2 4.48Å; W732-V735 PolarHBondContact O-N 3.14Å; W732-R736 WeakPolarHBondContact O-CG 3.27Å; W732-R736 PolarHBondContact O-N 3.47Å; W732-L750 HydrophobicContact CB-CD2 3.94Å; W732-L750 HydrophobicContact CG-CD2 3.85Å; W732-F751 HydrophobicContact CB-CE1 4.17Å; W732-F751 HydrophobicContact CB-CZ 3.79Å
733	S	92.6	Very high	88.1	Confident	27 Å²	27	37.4 Å²	37.4	19%	0.189	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-36.3	171.7	90	0	0	0	0	112.4	P729 Y730 V731 R737	P729-S733 WeakPolarHBondContact O-CB 3.44Å; P729-S733 PolarHBondContact O-N 3.15Å; Y730-S733 WeakPolarHBondContact O-CA 3.42Å; Y730-S733 VanDerWaalsContact O-CB 3.3Å; Y730-S733 WeakPolarHBondContact O-CB 3.07Å; Y730-S733 PolarHBondContact O-N 3.14Å; Y730-S733 PolarHBondContact O-OG 3.33Å; V731-S733 VanDerWaalsContact C-N 3.26Å; V731-S733 PolarHBondContact O-N 3.32Å; S733-R737 WeakPolarHBondContact O-CG 3.38Å; S733-R737 PolarHBondContact O-N 3.45Å; S733-R737 PolarHBondContact O-NE 2.67Å; S733-R737 VanDerWaalsContact O-NE 3.14Å
734	V	91.8	Very high	88.1	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-46.7	175.5	176	0	0	0	0	109.3	L309 D416 Y730 V731 W732 R736 R737 Q738	L309-V734 HydrophobicContact CD2-CG1 3.86Å; D416-V734 HydrophobicContact CB-CG1 4.03Å; D416-V734 HydrophobicContact CB-CG2 3.77Å; Y730-V734 HydrophobicContact CD1-CG2 4.35Å; Y730-V734 HydrophobicContact CE1-CG2 3.91Å; Y730-V734 HydrophobicContact CE2-CG2 4.12Å; Y730-V734 WeakPolarHBondContact O-CG2 3.48Å; Y730-V734 PolarHBondContact O-N 3.11Å; V731-V734 WeakPolarHBondContact O-CB 3.47Å; V731-V734 PolarHBondContact O-N 3.44Å; W732-V734 VanDerWaalsContact C-N 3.32Å; W732-V734 PolarHBondContact O-N 2.92Å; V734-R736 VanDerWaalsContact C-N 3.33Å; V734-R736 PolarHBondContact O-N 3.21Å; V734-R737 PolarHBondContact O-N 3.39Å; V734-Q738 HydrophobicContact CG1-CG 4.22Å; V734-Q738 VanDerWaalsContact CG1-OE1 3.25Å; V734-Q738 WeakPolarHBondContact O-CB 3.19Å; V734-Q738 PolarHBondContact O-N 3.35Å
735	V	92.6	Very high	88.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.4	-46.4	176.3	174.5	0	0	0	0	110.8	I174 L309 I313 V731 W732 R737 Q738 S739 F743	I174-V735 HydrophobicContact CG2-CG1 3.75Å; L309-V735 HydrophobicContact CB-CG2 4.3Å; L309-V735 HydrophobicContact CD2-CG2 4.03Å; I313-V735 HydrophobicContact CD1-CG1 4.34Å; I313-V735 HydrophobicContact CD1-CG2 3.74Å; I313-V735 HydrophobicContact CG1-CG2 3.89Å; V731-V735 HydrophobicContact CG1-CG2 4.26Å; V731-V735 VanDerWaalsContact O-CG2 3.28Å; V731-V735 WeakPolarHBondContact O-CG2 3.43Å; V731-V735 PolarHBondContact O-N 3.24Å; W732-V735 HydrophobicContact CE3-CB 4Å; W732-V735 HydrophobicContact CE3-CG1 3.95Å; W732-V735 HydrophobicContact CE3-CG2 4.2Å; W732-V735 HydrophobicContact CZ3-CB 4.41Å; W732-V735 HydrophobicContact CZ3-CG1 3.92Å; W732-V735 HydrophobicContact CZ3-CG2 4.48Å; W732-V735 PolarHBondContact O-N 3.14Å; V735-R737 VanDerWaalsContact C-N 3.27Å; V735-R737 PolarHBondContact O-N 2.91Å; V735-Q738 PolarHBondContact O-N 2.64Å; V735-S739 WeakPolarHBondContact O-CB 3.3Å; V735-S739 PolarHBondContact O-N 3.5Å; V735-S739 PolarHBondContact O-OG 3.37Å; V735-F743 HydrophobicContact CG1-CE2 4.45Å
736	R	89.9	Confident	87.8	Confident	79 Å²	79	42.2 Å²	42.2	30%	0.298	21%	0.21	S	C	.	.	H	α-helix	trans	-58.4	-37.6	176.8	-74.8	-178.8	68.6	-120.7	1.8	112.9	M181 W732 V734 F743 S745 F751	M181-R736 HydrophobicContact SD-CG 3.79Å; W732-R736 WeakPolarHBondContact O-CG 3.27Å; W732-R736 PolarHBondContact O-N 3.47Å; V734-R736 VanDerWaalsContact C-N 3.33Å; V734-R736 PolarHBondContact O-N 3.21Å; R736-F743 HydrophobicContact CG-CD2 3.88Å; R736-F743 HydrophobicContact CG-CE2 4.47Å; R736-S745 PolarHBondContact NH2-OG 2.97Å; R736-F751 HydrophobicContact CG-CZ 4.49Å
737	R	87.6	Confident	87.5	Confident	122 Å²	122	39.1 Å²	39.1	46%	0.46	20%	0.202	S	C	.	.	H	α-helix	trans	-81.7	-33.7	-179	-72.2	180	-69.2	131.6	-5	113.4	D416 S733 V734 V735	D416-R737 IonicContact OD1-NH1 3.78Å; D416-R737 IonicContact OD2-CZ 3.26Å; D416-R737 IonicContact OD2-NH1 3.69Å; D416-R737 PolarHBondContact OD2-NH1 2.83Å; D416-R737 IonicContact OD2-NH2 3.72Å; D416-R737 PolarHBondContact OD2-NH2 2.83Å; S733-R737 WeakPolarHBondContact O-CG 3.38Å; S733-R737 PolarHBondContact O-N 3.45Å; S733-R737 PolarHBondContact O-NE 2.67Å; S733-R737 VanDerWaalsContact O-NE 3.14Å; V734-R737 PolarHBondContact O-N 3.39Å; V735-R737 VanDerWaalsContact C-N 3.27Å; V735-R737 PolarHBondContact O-N 2.91Å
738	Q	89.4	Confident	87.5	Confident	37 Å²	37	38.1 Å²	38.1	17%	0.173	20%	0.198	C	C	.	.	H	α-helix	trans	-109.2	-19.8	-167.5	-64.9	-174.9	-11.7	0	0	114.3	N305 L309 D416 S417 V734 V735 G740	N305-Q738 PolarHBondContact ND2-O 3.05Å; L309-Q738 HydrophobicContact CD1-CB 4.08Å; L309-Q738 HydrophobicContact CD2-CB 4.27Å; D416-Q738 VanDerWaalsContact N-NE2 3.15Å; S417-Q738 VanDerWaalsContact CB-OE1 3.26Å; S417-Q738 PolarHBondContact OG-OE1 3.36Å; V734-Q738 HydrophobicContact CG1-CG 4.22Å; V734-Q738 VanDerWaalsContact CG1-OE1 3.25Å; V734-Q738 WeakPolarHBondContact O-CB 3.19Å; V734-Q738 PolarHBondContact O-N 3.35Å; V735-Q738 PolarHBondContact O-N 2.64Å; Q738-G740 VanDerWaalsContact C-N 3.31Å; Q738-G740 PolarHBondContact O-N 3.37Å
739	S	86.4	Confident	87.5	Confident	10 Å²	10	41.7 Å²	41.7	7%	0.07	22%	0.216	C	C	.	.	S	Bend	trans	-73.8	-22.1	179.8	63.2	0	0	0	0	113.8	V735 I741	V735-S739 WeakPolarHBondContact O-CB 3.3Å; V735-S739 PolarHBondContact O-N 3.5Å; V735-S739 PolarHBondContact O-OG 3.37Å; S739-I741 PolarHBondContact O-N 3.24Å; S739-I741 PolarHBondContact OG-N 3.31Å; S739-I741 VanDerWaalsContact OG-N 3.16Å
740	G	80.4	Confident	87.3	Confident	39 Å²	39	40.9 Å²	40.9	40%	0.402	21%	0.211	S	C	.	.			trans	71.6	14.3	-169.1	0	0	0	0	0	113.7	A240 Q738	A240-G740 WeakPolarHBondContact CB-O 3.21Å; Q738-G740 VanDerWaalsContact C-N 3.31Å; Q738-G740 PolarHBondContact O-N 3.37Å
741	I	84.3	Confident	87.1	Confident	9 Å²	9	42.4 Å²	42.4	5%	0.046	22%	0.218	C	C	.	.			trans	-95.5	123.7	175.1	-58.3	163.9	0	0	0	109.5	K113 L171 I174 V175 S739 F743	K113-I741 HydrophobicContact CD-CG2 4.07Å; L171-I741 HydrophobicContact CD2-CD1 3.88Å; L171-I741 HydrophobicContact CD2-CG1 4.16Å; I174-I741 HydrophobicContact CB-CD1 4.48Å; I174-I741 HydrophobicContact CG2-CD1 3.97Å; V175-I741 HydrophobicContact CG2-CD1 3.82Å; V175-I741 HydrophobicContact CG2-CG2 4.4Å; S739-I741 PolarHBondContact O-N 3.24Å; S739-I741 PolarHBondContact OG-N 3.31Å; S739-I741 VanDerWaalsContact OG-N 3.16Å; I741-F743 HydrophobicContact CB-CD2 4.25Å; I741-F743 HydrophobicContact CB-CE1 4.49Å; I741-F743 HydrophobicContact CB-CE2 3.65Å; I741-F743 HydrophobicContact CB-CZ 3.8Å; I741-F743 HydrophobicContact CD1-CE2 4.49Å; I741-F743 HydrophobicContact CD1-CZ 4.03Å; I741-F743 HydrophobicContact CG2-CD1 4.08Å; I741-F743 HydrophobicContact CG2-CD2 4.04Å; I741-F743 HydrophobicContact CG2-CE1 3.66Å; I741-F743 HydrophobicContact CG2-CE2 3.66Å; I741-F743 HydrophobicContact CG2-CG 4.27Å; I741-F743 HydrophobicContact CG2-CZ 3.46Å; I741-F743 VanDerWaalsContact CG2-CZ 3.46Å; I741-F743 WeakPolarHBondContact O-CD2 3.21Å; I741-F743 PolarHBondContact O-N 3.02Å
742	H	80.8	Confident	86.2	Confident	80 Å²	80	45.8 Å²	45.8	37%	0.37	24%	0.241	S	C	.	.			trans	-84.4	93.5	175	178.7	-81.5	0	0	0	111.6	K113 A240	K113-H742 WeakPolarHBondContact CE-O 3.33Å; K113-H742 PolarHBondContact NZ-O 3.38Å; A240-H742 HydrophobicContact CB-CB 4.17Å
743	F	85.8	Confident	84.4	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.018	27%	0.265	C	S	.	.			trans	-78.7	135.1	173.4	-61.3	-77.5	0	0	0	111.8	M116 E117 S178 M181 V735 R736 I741 S745	M116-F743 HydrophobicContact CE-CD1 4.31Å; M116-F743 HydrophobicContact CE-CE1 4.21Å; E117-F743 WeakPolarHBondContact OE1-CA 3.5Å; S178-F743 WeakPolarHBondContact OG-CE1 3.48Å; M181-F743 HydrophobicContact CE-CB 3.95Å; M181-F743 HydrophobicContact CE-CD1 3.42Å; M181-F743 VanDerWaalsContact CE-CD1 3.42Å; M181-F743 HydrophobicContact CE-CD2 3.64Å; M181-F743 HydrophobicContact CE-CE1 3.71Å; M181-F743 HydrophobicContact CE-CE2 3.88Å; M181-F743 HydrophobicContact CE-CG 3.37Å; M181-F743 HydrophobicContact CE-CZ 3.91Å; V735-F743 HydrophobicContact CG1-CE2 4.45Å; R736-F743 HydrophobicContact CG-CD2 3.88Å; R736-F743 HydrophobicContact CG-CE2 4.47Å; I741-F743 HydrophobicContact CB-CD2 4.25Å; I741-F743 HydrophobicContact CB-CE1 4.49Å; I741-F743 HydrophobicContact CB-CE2 3.65Å; I741-F743 HydrophobicContact CB-CZ 3.8Å; I741-F743 HydrophobicContact CD1-CE2 4.49Å; I741-F743 HydrophobicContact CD1-CZ 4.03Å; I741-F743 HydrophobicContact CG2-CD1 4.08Å; I741-F743 HydrophobicContact CG2-CD2 4.04Å; I741-F743 HydrophobicContact CG2-CE1 3.66Å; I741-F743 HydrophobicContact CG2-CE2 3.66Å; I741-F743 HydrophobicContact CG2-CG 4.27Å; I741-F743 HydrophobicContact CG2-CZ 3.46Å; I741-F743 VanDerWaalsContact CG2-CZ 3.46Å; I741-F743 WeakPolarHBondContact O-CD2 3.21Å; I741-F743 PolarHBondContact O-N 3.02Å; F743-S745 PolarHBondContact O-N 2.83Å; F743-S745 VanDerWaalsContact O-N 3.12Å; F743-S745 PolarHBondContact O-OG 2.9Å
744	K	83.6	Confident	82	Confident	59 Å²	59	51.8 Å²	51.8	26%	0.257	29%	0.292	S	S	.	.			trans	-55.8	115.5	174.7	-172.9	-173.3	-179.1	-162.3	0	110.4	E117 E746 L748	E117-K744 HydrophobicContact CB-CB 4.48Å; E117-K744 HydrophobicContact CG-CB 4.07Å; E117-K744 PolarHBondContact OE1-N 3.35Å; K744-E746 WeakPolarHBondContact CE-OE2 3.48Å; K744-E746 IonicContact NZ-OE2 2.77Å; K744-L748 WeakPolarHBondContact O-CG 3.49Å
745	S	81.8	Confident	79.3	Confident	64 Å²	64	56.2 Å²	56.2	45%	0.448	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-81.2	-26	-169.8	-63.5	0	0	0	0	114.6	R736 F743 S747 L748	R736-S745 PolarHBondContact NH2-OG 2.97Å; F743-S745 PolarHBondContact O-N 2.83Å; F743-S745 VanDerWaalsContact O-N 3.12Å; F743-S745 PolarHBondContact O-OG 2.9Å; S745-S747 PolarHBondContact O-N 3.14Å; S745-S747 VanDerWaalsContact O-N 3.15Å; S745-L748 PolarHBondContact O-N 3.14Å
746	E	77.7	Confident	76.2	Confident	166 Å²	166	65.4 Å²	65.4	78%	0.776	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-65.7	-16.5	-175.5	-62.4	165	-174.5	0	0	114.4	K744	K744-E746 WeakPolarHBondContact CE-OE2 3.48Å; K744-E746 IonicContact NZ-OE2 2.77Å
747	S	80	Confident	73.3	Confident	46 Å²	46	68.4 Å²	68.4	32%	0.322	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-119.1	11.5	-172.6	-51	0	0	0	0	112.8	Y182 S745 L749	Y182-S747 WeakPolarHBondContact CD1-O 3.37Å; S745-S747 PolarHBondContact O-N 3.14Å; S745-S747 VanDerWaalsContact O-N 3.15Å; S747-L749 PolarHBondContact O-N 3.04Å
748	L	88.1	Confident	70.4	Confident	17 Å²	17	70.5 Å²	70.5	9%	0.089	40%	0.402	C	S	.	.			trans	-82.1	108.5	-178.5	-55.1	173.5	0	0	0	109.9	M181 Y182 K744 S745 F751	M181-L748 HydrophobicContact CB-CD2 3.86Å; M181-L748 HydrophobicContact CE-CD2 4.43Å; M181-L748 CarbonylContact O-C 3.54Å; M181-L748 WeakPolarHBondContact O-CA 3.4Å; Y182-L748 HydrophobicContact CD1-CD2 4.07Å; Y182-L748 HydrophobicContact CE1-CD2 3.68Å; Y182-L748 HydrophobicContact CE2-CD2 4.16Å; Y182-L748 HydrophobicContact CG-CD2 4.46Å; K744-L748 WeakPolarHBondContact O-CG 3.49Å; S745-L748 PolarHBondContact O-N 3.14Å; L748-F751 HydrophobicContact CB-CD2 3.76Å; L748-F751 HydrophobicContact CB-CE2 4.15Å; L748-F751 HydrophobicContact CD1-CD2 4Å; L748-F751 HydrophobicContact CD1-CE2 3.87Å; L748-F751 HydrophobicContact CG-CD2 4.44Å; L748-F751 HydrophobicContact CG-CE2 4.43Å
749	L	90.8	Very high	67.4	Low	78 Å²	78	76.1 Å²	76.1	41%	0.408	43%	0.428	S	S	.	.			trans	-89	-24.9	-179.3	-62.1	-179.8	0	0	0	112.8	M181 Y182 E184 S747 F751 S752	M181-L749 PolarHBondContact O-N 3.01Å; Y182-L749 WeakPolarHBondContact O-CD1 3.43Å; E184-L749 HydrophobicContact CG-CB 4.12Å; E184-L749 HydrophobicContact CG-CD1 4.46Å; S747-L749 PolarHBondContact O-N 3.04Å; L749-F751 PolarHBondContact O-N 3.01Å; L749-S752 WeakPolarHBondContact O-CB 3.43Å; L749-S752 PolarHBondContact O-N 3.5Å
750	L	89.5	Confident	64.6	Low	9 Å²	9	82.7 Å²	82.7	5%	0.047	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.3	-176	-176.9	65.3	0	0	0	113.5	M181 K183 L185 I728 P729 W732	M181-L750 HydrophobicContact CG-CD2 4.32Å; M181-L750 WeakPolarHBondContact O-CB 3.5Å; M181-L750 PolarHBondContact O-N 3.01Å; M181-L750 VanDerWaalsContact O-N 3.11Å; K183-L750 WeakPolarHBondContact O-CA 3.41Å; K183-L750 PolarHBondContact O-N 3.19Å; L185-L750 HydrophobicContact CB-CD1 4.16Å; L185-L750 HydrophobicContact CD1-CD1 4.2Å; I728-L750 HydrophobicContact CG2-CD1 4.15Å; I728-L750 HydrophobicContact CG2-CD2 4.19Å; P729-L750 HydrophobicContact CB-CG 4.4Å; P729-L750 HydrophobicContact CG-CD1 4.21Å; P729-L750 HydrophobicContact CG-CG 4.28Å; W732-L750 HydrophobicContact CB-CD2 3.94Å; W732-L750 HydrophobicContact CG-CD2 3.85Å
751	F	86.1	Confident	62.1	Low	43 Å²	43	87.3 Å²	87.3	19%	0.189	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-7.3	-178.1	-52	-77.5	0	0	0	113.4	M181 P729 W732 R736 L748 L749 A753	M181-F751 HydrophobicContact CB-CE2 4.21Å; M181-F751 HydrophobicContact CG-CE2 4.3Å; M181-F751 HydrophobicContact CG-CZ 4.35Å; M181-F751 HydrophobicContact SD-CE2 4.19Å; M181-F751 HydrophobicContact SD-CZ 4.12Å; P729-F751 HydrophobicContact CB-CD1 4.47Å; P729-F751 VanDerWaalsContact O-CE1 3.3Å; P729-F751 WeakPolarHBondContact O-CE1 3.41Å; W732-F751 HydrophobicContact CB-CE1 4.17Å; W732-F751 HydrophobicContact CB-CZ 3.79Å; R736-F751 HydrophobicContact CG-CZ 4.49Å; L748-F751 HydrophobicContact CB-CD2 3.76Å; L748-F751 HydrophobicContact CB-CE2 4.15Å; L748-F751 HydrophobicContact CD1-CD2 4Å; L748-F751 HydrophobicContact CD1-CE2 3.87Å; L748-F751 HydrophobicContact CG-CD2 4.44Å; L748-F751 HydrophobicContact CG-CE2 4.43Å; L749-F751 PolarHBondContact O-N 3.01Å; F751-A753 PolarHBondContact O-N 3.45Å
752	S	77.1	Confident	59.4	Low	73 Å²	73	92 Å²	92	51%	0.51	51%	0.513	S	S	.	.	S	Bend	trans	-65.7	130.5	174.9	-64.3	0	0	0	0	108.4	L749 A754	L749-S752 WeakPolarHBondContact O-CB 3.43Å; L749-S752 PolarHBondContact O-N 3.5Å; S752-A754 PolarHBondContact O-N 3.01Å
753	A	55.3	Low	56.9	Low	60 Å²	60	97.1 Å²	97.1	50%	0.496	54%	0.537	S	S	.	.			trans	-53.6	134.5	164.5	0	0	0	0	0	106.8	Y255 F751 S755	Y255-A753 HydrophobicContact CE2-CB 4.34Å; F751-A753 PolarHBondContact O-N 3.45Å; A753-S755 PolarHBondContact O-N 2.92Å
754	A	44.2	Very low	54	Low	92 Å²	92	103.7 Å²	103.7	76%	0.76	57%	0.572	S	S	*	*			trans	-56	88.4	174.8	0	0	0	0	0	108.5	S752 Q756	S752-A754 PolarHBondContact O-N 3.01Å; A754-Q756 PolarHBondContact O-N 3.12Å; A754-Q756 VanDerWaalsContact O-N 3.07Å
755	S	34.7	Very low	51.5	Low	94 Å²	94	106.4 Å²	106.4	66%	0.657	59%	0.589	S	S	*	*			trans	-64.3	112	167	-66.3	0	0	0	0	103.5	A753 H757	A753-S755 PolarHBondContact O-N 2.92Å; S755-H757 PolarHBondContact O-N 3.15Å
756	Q	27.7	Very low	49.1	Very low	193 Å²	193	109.8 Å²	109.8	90%	0.902	60%	0.603	S	S	*	*			trans	-64.5	73.3	161.9	-70.8	-175.9	-7	0	0	107.9	A754	A754-Q756 PolarHBondContact O-N 3.12Å; A754-Q756 VanDerWaalsContact O-N 3.07Å
757	H	27.9	Very low	46.7	Very low	141 Å²	141	110.5 Å²	110.5	65%	0.653	61%	0.61	S	S	*	*			trans	-124.5	87.1	164.8	-88.3	-68.5	0	0	0	106.1	S755 Q759	S755-H757 PolarHBondContact O-N 3.15Å; H757-Q759 PolarHBondContact O-N 3.31Å
758	I	27.1	Very low	44.1	Very low	167 Å²	167	112.4 Å²	112.4	86%	0.856	62%	0.623	S	S	*	*			trans	-59.1	90.4	152.8	-59.6	169	0	0	0	105.3
759	Q	27.4	Very low	41.2	Very low	154 Å²	154	120.4 Å²	120.4	72%	0.72	66%	0.66	S	S	*	*			trans	-126.8	113.4	161.2	-82.9	-171	-10.4	0	0	107.2	H757 T761	H757-Q759 PolarHBondContact O-N 3.31Å; Q759-T761 PolarHBondContact O-N 2.97Å
760	N	26.7	Very low	38.2	Very low	149 Å²	149	123.7 Å²	123.7	80%	0.797	68%	0.678	S	S	*	*			trans	-41	95.9	172.9	-62.5	-27.7	0	0	0	111.2	T762	N760-T762 VanDerWaalsContact C-N 3.28Å; N760-T762 PolarHBondContact O-N 3.32Å
761	T	28.3	Very low	35.1	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	72%	0.718	S	S	*	*			trans	-82.4	85.3	160.1	35.6	0	0	0	0	107.1	Q759 E763	Q759-T761 PolarHBondContact O-N 2.97Å; T761-E763 PolarHBondContact O-N 3.39Å
762	T	27.4	Very low	32.3	Very low	108 Å²	108	136.2 Å²	136.2	66%	0.663	75%	0.747	S	S	*	*			trans	-53.4	118.5	152.2	35.7	0	0	0	0	107.5	N760 N764	N760-T762 VanDerWaalsContact C-N 3.28Å; N760-T762 PolarHBondContact O-N 3.32Å; T762-N764 PolarHBondContact O-N 3.05Å
763	E	27	Very low	29.7	Very low	188 Å²	188	139.7 Å²	139.7	88%	0.879	76%	0.76	S	S	*	*			trans	-57.5	84.5	167.4	-68.5	178	154.1	0	0	109.2	T761 D765	T761-E763 PolarHBondContact O-N 3.39Å; E763-D765 PolarHBondContact O-N 2.99Å
764	N	26	Very low	28.4	Very low	142 Å²	142	141.8 Å²	141.8	76%	0.759	78%	0.777	S	S	*	*			trans	-91.6	81.7	160.1	-79.4	-21.1	0	0	0	106.5	T762 D766	T762-N764 PolarHBondContact O-N 3.05Å; N764-D766 PolarHBondContact O-N 3.4Å
765	D	32	Very low	27.5	Very low	115 Å²	115	145.8 Å²	145.8	62%	0.615	78%	0.782	S	S	*	*			trans	-66.8	109.6	160.2	-90.4	-11.4	0	0	0	107.7	E763 I767	E763-D765 PolarHBondContact O-N 2.99Å; D765-I767 PolarHBondContact O-N 3.42Å
766	D	29.5	Very low	26.9	Very low	136 Å²	136	148.8 Å²	148.8	73%	0.727	79%	0.791	S	S	*	*			trans	23.8	88.4	147.3	-62	-28.4	0	0	0	117.6	N764	N764-D766 PolarHBondContact O-N 3.4Å
767	I	27.7	Very low	27	Very low	180 Å²	180	146.9 Å²	146.9	92%	0.923	79%	0.787	S	S	*	*			trans	-100.2	71.9	137.5	-53.6	174.7	0	0	0	106.5	D765	D765-I767 PolarHBondContact O-N 3.42Å
768	S	27	Very low	26.9	Very low	86 Å²	86	143.7 Å²	143.7	60%	0.601	79%	0.792	S	S	*	*			trans	-152.2	125.7	162.6	55.1	0	0	0	0	109.7
769	E	27.1	Very low	27	Very low	185 Å²	185	145 Å²	145	86%	0.864	79%	0.794	S	S	*	*	S	Bend	trans	81.3	62.1	179.3	-55.8	-171.2	173.7	0	0	116.7
770	D	26.9	Very low	26.8	Very low	148 Å²	148	142.5 Å²	142.5	79%	0.791	79%	0.794	S	S	*	*			trans	-151.8	63.5	135.8	-93.8	-25.2	0	0	0	107.8
771	N	24.5	Very low	26.9	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	80%	0.798	S	S	*	*			trans	-103.9	69.9	167.6	-97.3	-15.4	0	0	0	108.4
772	D	26.7	Very low	26.8	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	80%	0.796	S	S	*	*			trans	-107	93.4	161	-89.2	-27	0	0	0	108.7
773	N	23.9	Very low	27	Very low	146 Å²	146	149.5 Å²	149.5	78%	0.781	81%	0.807	S	S	*	*			trans	47.2	84.4	151.2	-65.6	-36.3	0	0	0	118.3
774	A	26.7	Very low	26.8	Very low	103 Å²	103	148.9 Å²	148.9	85%	0.851	80%	0.804	S	S	*	*			trans	-116.6	97.7	143.6	0	0	0	0	0	108.5	N776	A774-N776 PolarHBondContact O-N 3.19Å; A774-N776 VanDerWaalsContact O-N 3.14Å
775	M	25	Very low	26.9	Very low	177 Å²	177	148.7 Å²	148.7	87%	0.872	81%	0.807	S	S	*	*			trans	-62.4	112.3	171.3	-89.1	-149.9	167.8	0	0	110
776	N	22.8	Very low	26.4	Very low	157 Å²	157	150.9 Å²	150.9	84%	0.84	82%	0.818	S	S	*	*			trans	-79.9	118.8	154.4	-115.1	-12.7	0	0	0	107.9	A774	A774-N776 PolarHBondContact O-N 3.19Å; A774-N776 VanDerWaalsContact O-N 3.14Å
777	N	30.2	Very low	26.7	Very low	153 Å²	153	154.2 Å²	154.2	82%	0.818	84%	0.843	S	S	*	*			trans	-114.8	119.7	152.1	-94.9	-18.3	0	0	0	106.8
778	G	26.3	Very low	26.7	Very low	73 Å²	73	153 Å²	153	75%	0.753	84%	0.839	S	S	*	*			trans	-73.5	153.7	-175.1	0	0	0	0	0	113.5
779	E	28	Very low	26.6	Very low	195 Å²	195	156.5 Å²	156.5	91%	0.911	85%	0.852	S	S	*	*			trans	-116.8	126.7	150	-80	-172.1	157.2	0	0	108.7
780	S	24.4	Very low	26.6	Very low	102 Å²	102	154.9 Å²	154.9	71%	0.713	85%	0.851	S	S	*	*			trans	-59	137.3	174.7	42.1	0	0	0	0	111.5
781	N	28.4	Very low	26.6	Very low	167 Å²	167	155.3 Å²	155.3	89%	0.893	85%	0.854	S	S	*	*			trans	-153.2	111.5	141.2	-99.1	-39.1	0	0	0	111.4
782	H	26.3	Very low	26.7	Very low	166 Å²	166	154.8 Å²	154.8	77%	0.769	85%	0.853	S	S	*	*			trans	-49.2	137.4	162.6	-78.3	-87.2	0	0	0	111.5
783	K	30.4	Very low	26.7	Very low	205 Å²	205	155 Å²	155	89%	0.891	86%	0.856	S	S	*	*				-165.2	100.6	129.4	-104.4	162.4	-173.1	-177.2	0	109.9
784	Q	23.2	Very low	26.9	Very low	176 Å²	176	155.6 Å²	155.6	82%	0.822	86%	0.862	S	S	*	*			trans	-58	129.4	154.8	-74.3	169.2	-35.6	0	0	108.8
785	V	27.7	Very low	27	Very low	137 Å²	137	159.7 Å²	159.7	83%	0.83	86%	0.862	S	S	*	*			trans	-143.4	109.4	138.1	179	0	0	0	0	106.9
786	L	22	Very low	27.1	Very low	161 Å²	161	158.3 Å²	158.3	84%	0.843	86%	0.861	S	S	*	*			trans	-69.2	120.5	157.6	-96.2	132.7	0	0	0	108.5
787	V	35.9	Very low	27.5	Very low	207 Å²	207	158.4 Å²	158.4	100%	1.255	86%	0.863	S	S	*	*				-147.8	0	126.2	175.2	0	0	0	0	106.7

Retrieved 787 of 787 residues in 658.1 ms (Link to these results)

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