A0A061IAE1_CRIGR Loading...

Engulfment and cell motility 3

Involved in cytoskeletal rearrangements required for phagocytosis of apoptotic cells and cell motility. Acts in association with DOCK1 and CRK. Was initially proposed to be required in complex with DOCK1 to activate Rac Rho small GTPases. May enhance the guanine nucleotide exchange factor (GEF) activity of DOCK1.

AlphaFold DB , UniProt , Accession A0A061IAE1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 720 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	36.3	Very low	67.6	Low	242 Å²	242	93.2 Å²	93.2	100%	1.192	50%	0.496	S	S	*	.				0	118.3	0	-91	166.9	116.7	0	0	107.2
2	A	35.5	Very low	69.7	Low	92 Å²	92	85.4 Å²	85.4	76%	0.76	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-58.4	137.7	168.5	0	0	0	0	0	107.9
3	P	42.9	Very low	71.6	Confident	100 Å²	100	84.8 Å²	84.8	65%	0.649	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-55.7	141.8	174.5	23.2	-30.6	0	0	0	108.8	R5	P3-R5 PolarHBondContact O-N 2.86Å
4	P	53	Low	72.9	Confident	91 Å²	91	84.1 Å²	84.1	59%	0.591	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-52.7	129.3	173.5	19.9	-29.6	0	0	0	109	N6 V7	P4-N6 PolarHBondContact O-N 3.24Å; P4-V7 HydrophobicContact CB-CG2 4.4Å; P4-V7 HydrophobicContact CG-CB 4.23Å; P4-V7 HydrophobicContact CG-CG2 3.68Å; P4-V7 PolarHBondContact O-N 2.92Å
5	R	59.9	Low	73.5	Confident	227 Å²	227	83.6 Å²	83.6	86%	0.857	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-19.6	-173	-90.1	-179.2	167.8	-179.8	-6.3	114.1	P3	P3-R5 PolarHBondContact O-N 2.86Å
6	N	73.3	Confident	74.2	Confident	78 Å²	78	89.4 Å²	89.4	42%	0.417	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-1	-178.5	-64.6	-4.2	0	0	0	114.2	P4 Q26	P4-N6 PolarHBondContact O-N 3.24Å; N6-Q26 HydrophobicContact CB-CB 4.43Å; N6-Q26 VanDerWaalsContact O-CB 3.24Å; N6-Q26 WeakPolarHBondContact O-CB 3.24Å; N6-Q26 WeakPolarHBondContact O-CG 3.37Å; N6-Q26 PolarHBondContact O-N 3.03Å
7	V	84.7	Confident	75	Confident	29 Å²	29	86 Å²	86	18%	0.176	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	122.1	-178.6	179.3	0	0	0	0	111.3	P4 Q23 L24 D25	P4-V7 HydrophobicContact CB-CG2 4.4Å; P4-V7 HydrophobicContact CG-CB 4.23Å; P4-V7 HydrophobicContact CG-CG2 3.68Å; P4-V7 PolarHBondContact O-N 2.92Å; V7-Q23 HydrophobicContact CG1-CB 3.77Å; V7-L24 CarbonylContact C-O 3.53Å; V7-L24 VanDerWaalsContact CA-O 3.32Å; V7-L24 WeakPolarHBondContact CA-O 3.41Å; V7-D25 HydrophobicContact CG2-CB 4.09Å
8	V	86.8	Confident	75.6	Confident	14 Å²	14	89.4 Å²	89.4	9%	0.085	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.6	176.5	-64.1	0	0	0	0	111	I10 Q23 L24 Q26 I69	V8-I10 HydrophobicContact CG2-CG2 4.05Å; V8-Q23 CarbonylContact O-C 3.54Å; V8-L24 HydrophobicContact CG2-CB 3.94Å; V8-L24 HydrophobicContact CG2-CD2 3.71Å; V8-L24 HydrophobicContact CG2-CG 4.38Å; V8-L24 PolarHBondContact N-O 2.99Å; V8-L24 PolarHBondContact O-N 2.96Å; V8-Q26 HydrophobicContact CG1-CG 4.48Å; V8-Q26 HydrophobicContact CG2-CG 4.28Å; V8-I69 HydrophobicContact CG2-CG2 4.01Å
9	K	88.6	Confident	76.4	Confident	130 Å²	130	87.8 Å²	87.8	57%	0.565	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.9	174.6	-63.8	179.7	-178.4	177.8	0	108.8	I22 Q23 N71 G72	K9-I22 WeakPolarHBondContact CA-O 3.48Å; K9-Q23 HydrophobicContact CG-CG 4.28Å; K9-N71 WeakPolarHBondContact CB-OD1 3.43Å; K9-N71 PolarHBondContact N-OD1 3.2Å; K9-G72 PolarHBondContact O-N 3.46Å
10	I	91.9	Very high	77.2	Confident	5 Å²	5	84.9 Å²	84.9	3%	0.026	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	159.7	-176.8	58.2	163.4	0	0	0	110.9	V8 V12 L21 I22 L24 I69 S73 L75	V8-I10 HydrophobicContact CG2-CG2 4.05Å; I10-V12 HydrophobicContact CD1-CG2 3.8Å; I10-V12 HydrophobicContact CG1-CG2 4.45Å; I10-L21 WeakPolarHBondContact O-CA 3.49Å; I10-I22 HydrophobicContact CD1-CB 4.42Å; I10-I22 HydrophobicContact CG1-CB 4.03Å; I10-I22 WeakPolarHBondContact CG1-O 3.34Å; I10-I22 PolarHBondContact N-O 2.75Å; I10-I22 PolarHBondContact O-N 3.28Å; I10-L24 HydrophobicContact CD1-CB 3.87Å; I10-L24 HydrophobicContact CD1-CD1 3.6Å; I10-L24 HydrophobicContact CD1-CG 4.39Å; I10-L24 HydrophobicContact CG1-CB 4.09Å; I10-I69 HydrophobicContact CG2-CG2 3.54Å; I10-S73 WeakPolarHBondContact CA-O 3.45Å; I10-L75 HydrophobicContact CD1-CD1 3.67Å; I10-L75 HydrophobicContact CD1-CG 4.45Å
11	A	90.9	Very high	77.9	Confident	17 Å²	17	88.1 Å²	88.1	14%	0.14	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.2	167	0	0	0	0	0	109	Q20 L21 S73 I74 L75	A11-Q20 CarbonylContact C-O 3.47Å; A11-Q20 WeakPolarHBondContact CA-O 3.33Å; A11-L21 HydrophobicContact CB-CD2 3.83Å; A11-S73 PolarHBondContact N-O 3.31Å; A11-I74 CarbonylContact O-C 3.42Å; A11-I74 WeakPolarHBondContact O-CA 3.29Å; A11-L75 PolarHBondContact O-N 3.41Å
12	V	93.3	Very high	80.4	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.6	172.9	-170.2	0	0	0	0	108.8	I10 P19 Q20 I22 V37 W41 L51 L75 L77	I10-V12 HydrophobicContact CD1-CG2 3.8Å; I10-V12 HydrophobicContact CG1-CG2 4.45Å; V12-P19 CarbonylContact O-C 3.49Å; V12-P19 VanDerWaalsContact O-CA 3.3Å; V12-P19 WeakPolarHBondContact O-CA 3.47Å; V12-Q20 PolarHBondContact N-O 3.16Å; V12-Q20 PolarHBondContact O-N 2.76Å; V12-I22 HydrophobicContact CB-CD1 4.41Å; V12-I22 HydrophobicContact CG2-CD1 3.77Å; V12-I22 HydrophobicContact CG2-CG1 4.48Å; V12-V37 HydrophobicContact CG1-CG1 4.02Å; V12-V37 HydrophobicContact CG2-CG2 4.41Å; V12-W41 HydrophobicContact CB-CH2 4.32Å; V12-W41 HydrophobicContact CG1-CH2 3.95Å; V12-W41 HydrophobicContact CG1-CZ3 4.15Å; V12-W41 VanDerWaalsContact O-CH2 3.31Å; V12-W41 WeakPolarHBondContact O-CH2 3.32Å; V12-W41 WeakPolarHBondContact O-CZ2 3.27Å; V12-L51 HydrophobicContact CG1-CD2 3.81Å; V12-L51 HydrophobicContact CG2-CD2 4.5Å; V12-L75 CarbonylContact C-O 3.55Å; V12-L75 WeakPolarHBondContact CA-O 3.37Å; V12-L75 HydrophobicContact CG2-CB 4.41Å; V12-L77 HydrophobicContact CG1-CB 4.24Å
13	Q	93.3	Very high	83	Confident	78 Å²	78	80 Å²	80	36%	0.364	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	149.7	180	-60.3	-174.5	-11.3	0	0	110.9	P19 I74 L75 C76 L77	Q13-P19 HydrophobicContact CG-CB 4.08Å; Q13-P19 HydrophobicContact CG-CG 4.05Å; Q13-I74 HydrophobicContact CG-CG2 3.78Å; Q13-I74 VanDerWaalsContact NE2-CG2 3.33Å; Q13-L75 PolarHBondContact N-O 2.84Å; Q13-C76 WeakPolarHBondContact O-CA 3.41Å; Q13-L77 PolarHBondContact O-N 3.03Å
14	K	89.9	Confident	85.1	Confident	75 Å²	75	75.3 Å²	75.3	33%	0.326	39%	0.392	S	S	.	.			trans	-142.5	143.6	169.9	172.4	-176.8	169.5	-67.2	0	108	D16 A17 W41 L43 L77	K14-D16 PolarHBondContact O-N 3.4Å; K14-A17 HydrophobicContact CB-CB 4.17Å; K14-A17 HydrophobicContact CD-CB 4.47Å; K14-A17 HydrophobicContact CG-CB 4.4Å; K14-A17 PolarHBondContact O-N 2.97Å; K14-A17 VanDerWaalsContact O-N 3.17Å; K14-W41 HydrophobicContact CB-CD2 4.32Å; K14-W41 HydrophobicContact CB-CE3 3.93Å; K14-W41 HydrophobicContact CB-CH2 3.43Å; K14-W41 VanDerWaalsContact CB-CH2 3.43Å; K14-W41 HydrophobicContact CB-CZ2 3.86Å; K14-W41 HydrophobicContact CB-CZ3 3.48Å; K14-W41 VanDerWaalsContact CB-CZ3 3.48Å; K14-W41 HydrophobicContact CD-CD2 4.12Å; K14-W41 HydrophobicContact CD-CE3 3.79Å; K14-W41 HydrophobicContact CD-CZ3 4.18Å; K14-W41 HydrophobicContact CG-CE3 4.49Å; K14-W41 HydrophobicContact CG-CZ3 4.42Å; K14-L43 HydrophobicContact CD-CD1 3.94Å; K14-L77 HydrophobicContact CD-CD2 4.49Å
15	A	82.8	Confident	86.8	Confident	76 Å²	76	73.3 Å²	73.3	63%	0.628	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	132.4	175.4	0	0	0	0	0	110.8	A17	A15-A17 PolarHBondContact O-N 3.34Å
16	D	83.6	Confident	87.9	Confident	176 Å²	176	63.5 Å²	63.5	94%	0.941	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	23.6	179	-49.1	-48.4	0	0	0	115.3	K14	K14-D16 PolarHBondContact O-N 3.4Å
17	A	88.1	Confident	88.5	Confident	32 Å²	32	63.1 Å²	63.1	26%	0.264	35%	0.348	S	S	.	.	S	Bend	trans	-129.1	152.5	176.6	0	0	0	0	0	112.2	K14 A15 W41	K14-A17 HydrophobicContact CB-CB 4.17Å; K14-A17 HydrophobicContact CD-CB 4.47Å; K14-A17 HydrophobicContact CG-CB 4.4Å; K14-A17 PolarHBondContact O-N 2.97Å; K14-A17 VanDerWaalsContact O-N 3.17Å; A15-A17 PolarHBondContact O-N 3.34Å; A17-W41 HydrophobicContact CB-CZ2 4.39Å
18	I	86.7	Confident	88.7	Confident	147 Å²	147	65.4 Å²	65.4	75%	0.754	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-67.6	128.8	172.5	-59.4	173.1	0	0	0	108.1	Q20 W41	I18-Q20 PolarHBondContact O-N 3.47Å; I18-W41 PolarHBondContact O-NE1 2.7Å
19	P	90.3	Very high	88.9	Confident	60 Å²	60	68.1 Å²	68.1	39%	0.39	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-56.8	136.7	177.5	-26.1	34.8	0	0	0	112.3	V12 Q13	V12-P19 CarbonylContact O-C 3.49Å; V12-P19 VanDerWaalsContact O-CA 3.3Å; V12-P19 WeakPolarHBondContact O-CA 3.47Å; Q13-P19 HydrophobicContact CG-CB 4.08Å; Q13-P19 HydrophobicContact CG-CG 4.05Å
20	Q	91.9	Very high	89	Confident	28 Å²	28	62.5 Å²	62.5	13%	0.131	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131	174.2	-66.7	-176.6	30.7	0	0	110.1	A11 V12 I18 I22 V37 A40 W41	A11-Q20 CarbonylContact C-O 3.47Å; A11-Q20 WeakPolarHBondContact CA-O 3.33Å; V12-Q20 PolarHBondContact N-O 3.16Å; V12-Q20 PolarHBondContact O-N 2.76Å; I18-Q20 PolarHBondContact O-N 3.47Å; Q20-I22 HydrophobicContact CB-CD1 4.15Å; Q20-I22 HydrophobicContact CB-CG1 4.07Å; Q20-V37 PolarHBondContact NE2-O 3.29Å; Q20-A40 VanDerWaalsContact NE2-CB 3.32Å; Q20-A40 VanDerWaalsContact OE1-CB 3.31Å; Q20-W41 HydrophobicContact CB-CZ2 4.36Å; Q20-W41 HydrophobicContact CG-CD2 4.38Å; Q20-W41 HydrophobicContact CG-CH2 4.41Å; Q20-W41 HydrophobicContact CG-CZ2 3.71Å; Q20-W41 VanDerWaalsContact NE2-CD1 3.33Å
21	L	91.6	Very high	89	Confident	153 Å²	153	65.6 Å²	65.6	80%	0.801	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	114.9	171.9	-62.1	177.9	0	0	0	108.9	I10 A11	I10-L21 WeakPolarHBondContact O-CA 3.49Å; A11-L21 HydrophobicContact CB-CD2 3.83Å
22	I	89.8	Confident	88.9	Confident	23 Å²	23	67.7 Å²	67.7	12%	0.118	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.4	-170.5	-53.6	-179.5	0	0	0	109.4	K9 I10 V12 Q20 L24 V37	K9-I22 WeakPolarHBondContact CA-O 3.48Å; I10-I22 HydrophobicContact CD1-CB 4.42Å; I10-I22 HydrophobicContact CG1-CB 4.03Å; I10-I22 WeakPolarHBondContact CG1-O 3.34Å; I10-I22 PolarHBondContact N-O 2.75Å; I10-I22 PolarHBondContact O-N 3.28Å; V12-I22 HydrophobicContact CB-CD1 4.41Å; V12-I22 HydrophobicContact CG2-CD1 3.77Å; V12-I22 HydrophobicContact CG2-CG1 4.48Å; Q20-I22 HydrophobicContact CB-CD1 4.15Å; Q20-I22 HydrophobicContact CB-CG1 4.07Å; I22-L24 PolarHBondContact O-N 3.2Å; I22-V37 HydrophobicContact CD1-CB 4.37Å; I22-V37 HydrophobicContact CD1-CG2 3.31Å
23	Q	89	Confident	88.8	Confident	140 Å²	140	67.9 Å²	67.9	65%	0.654	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	89.2	165.1	-66	-171.1	6.8	0	0	107.7	V7 V8 K9 D25	V7-Q23 HydrophobicContact CG1-CB 3.77Å; V8-Q23 CarbonylContact O-C 3.54Å; K9-Q23 HydrophobicContact CG-CG 4.28Å; Q23-D25 PolarHBondContact O-N 2.95Å
24	L	87.4	Confident	88.7	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	116.7	-178.1	-178.9	151.9	0	0	0	109.2	V7 V8 I10 I22 Q26 V33 I69	V7-L24 CarbonylContact C-O 3.53Å; V7-L24 VanDerWaalsContact CA-O 3.32Å; V7-L24 WeakPolarHBondContact CA-O 3.41Å; V8-L24 HydrophobicContact CG2-CB 3.94Å; V8-L24 HydrophobicContact CG2-CD2 3.71Å; V8-L24 HydrophobicContact CG2-CG 4.38Å; V8-L24 PolarHBondContact N-O 2.99Å; V8-L24 PolarHBondContact O-N 2.96Å; I10-L24 HydrophobicContact CD1-CB 3.87Å; I10-L24 HydrophobicContact CD1-CD1 3.6Å; I10-L24 HydrophobicContact CD1-CG 4.39Å; I10-L24 HydrophobicContact CG1-CB 4.09Å; I22-L24 PolarHBondContact O-N 3.2Å; L24-Q26 HydrophobicContact CD2-CG 3.93Å; L24-V33 HydrophobicContact CD1-CG1 3.79Å; L24-V33 HydrophobicContact CG-CG1 4.23Å; L24-V33 HydrophobicContact CG-CG2 4.32Å; L24-I69 HydrophobicContact CD1-CD1 4.31Å
25	D	88.4	Confident	88.8	Confident	49 Å²	49	67.1 Å²	67.1	26%	0.262	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.8	169.7	-176.8	-3	0	0	0	109.5	V7 Q23 A27 K28 R66	V7-D25 HydrophobicContact CG2-CB 4.09Å; Q23-D25 PolarHBondContact O-N 2.95Å; D25-A27 PolarHBondContact O-N 3.41Å; D25-A27 WeakPolarHBondContact OD1-CB 3.5Å; D25-A27 PolarHBondContact OD1-N 2.82Å; D25-K28 HydrophobicContact CB-CB 4.37Å; D25-K28 HydrophobicContact CB-CD 4.09Å; D25-K28 HydrophobicContact CB-CG 3.94Å; D25-K28 WeakPolarHBondContact O-CB 3.32Å; D25-K28 PolarHBondContact O-N 3.32Å; D25-R66 PolarHBondContact O-NH2 3.07Å
26	Q	84.4	Confident	89.2	Confident	21 Å²	21	67.6 Å²	67.6	10%	0.098	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-15.9	-180	-69.2	-73.9	23.2	0	0	113.2	N6 V8 L24 R66 M67	N6-Q26 HydrophobicContact CB-CB 4.43Å; N6-Q26 VanDerWaalsContact O-CB 3.24Å; N6-Q26 WeakPolarHBondContact O-CB 3.24Å; N6-Q26 WeakPolarHBondContact O-CG 3.37Å; N6-Q26 PolarHBondContact O-N 3.03Å; V8-Q26 HydrophobicContact CG1-CG 4.48Å; V8-Q26 HydrophobicContact CG2-CG 4.28Å; L24-Q26 HydrophobicContact CD2-CG 3.93Å; Q26-R66 VanDerWaalsContact C-NH2 3.28Å; Q26-R66 VanDerWaalsContact CA-NH2 3.31Å; Q26-R66 PolarHBondContact NE2-O 3.28Å; Q26-R66 PolarHBondContact O-NE 2.88Å; Q26-R66 PolarHBondContact O-NH2 3.3Å; Q26-R66 PolarHBondContact OE1-O 3.04Å; Q26-M67 HydrophobicContact CB-SD 4.29Å
27	A	85.4	Confident	89.6	Confident	70 Å²	70	59.2 Å²	59.2	58%	0.579	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-19.8	172.8	0	0	0	0	0	113.2	D25	D25-A27 PolarHBondContact O-N 3.41Å; D25-A27 WeakPolarHBondContact OD1-CB 3.5Å; D25-A27 PolarHBondContact OD1-N 2.82Å
28	K	88.8	Confident	89.8	Confident	77 Å²	77	57.7 Å²	57.7	34%	0.335	32%	0.317	S	S	.	.	S	Bend	trans	-77.4	136	177.6	-75.5	-175.6	177	-174.1	0	110.5	D25 L30 V33 E36 R66	D25-K28 HydrophobicContact CB-CB 4.37Å; D25-K28 HydrophobicContact CB-CD 4.09Å; D25-K28 HydrophobicContact CB-CG 3.94Å; D25-K28 WeakPolarHBondContact O-CB 3.32Å; D25-K28 PolarHBondContact O-N 3.32Å; K28-L30 PolarHBondContact O-N 2.78Å; K28-V33 HydrophobicContact CB-CG2 4.32Å; K28-E36 IonicContact NZ-OE1 2.86Å; K28-E36 PolarHBondContact NZ-OE1 2.81Å; K28-E36 IonicContact NZ-OE2 3.74Å; K28-R66 PolarHBondContact O-NH1 2.78Å; K28-R66 PolarHBondContact O-NH2 3.44Å
29	P	91.1	Very high	90	Very high	71 Å²	71	55 Å²	55	46%	0.461	30%	0.304	S	S	.	.			trans	-53.3	140.1	173.7	-25.8	34.6	0	0	0	112.5	A31 T32 V33	P29-A31 PolarHBondContact O-N 3.47Å; P29-T32 WeakPolarHBondContact O-CB 3.14Å; P29-T32 PolarHBondContact O-N 2.94Å; P29-V33 PolarHBondContact O-N 3.41Å
30	L	90.6	Very high	90	Very high	12 Å²	12	55.2 Å²	55.2	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-57.8	-33.9	179.7	-77.2	173.3	0	0	0	111.9	K28 T32 V33 L34 I61 T62 E63 R66	K28-L30 PolarHBondContact O-N 2.78Å; L30-T32 PolarHBondContact O-N 2.95Å; L30-V33 PolarHBondContact O-N 3.43Å; L30-V33 VanDerWaalsContact O-N 3.16Å; L30-L34 WeakPolarHBondContact O-CB 3.2Å; L30-L34 PolarHBondContact O-N 3.22Å; L30-I61 HydrophobicContact CD1-CG2 3.89Å; L30-I61 HydrophobicContact CD2-CG2 4.12Å; L30-T62 WeakPolarHBondContact CD1-O 3.45Å; L30-E63 WeakPolarHBondContact CB-OE1 3.39Å; L30-E63 HydrophobicContact CD1-CG 4.34Å; L30-E63 PolarHBondContact N-OE1 3.05Å; L30-R66 HydrophobicContact CD1-CB 4.2Å; L30-R66 HydrophobicContact CD2-CB 4.33Å; L30-R66 HydrophobicContact CG-CB 4.46Å
31	A	90.6	Very high	90	Very high	70 Å²	70	55.9 Å²	55.9	58%	0.579	31%	0.312	S	S	*	.	H	α-helix	trans	-58.6	-36.9	175.3	0	0	0	0	0	112.5	P29 K35	P29-A31 PolarHBondContact O-N 3.47Å; A31-K35 WeakPolarHBondContact O-CB 3.45Å; A31-K35 PolarHBondContact O-N 2.74Å
32	T	90.8	Very high	90	Very high	62 Å²	62	55.6 Å²	55.6	38%	0.38	31%	0.311	S	S	.	.	H	α-helix	trans	-70	-42.9	176	-51.1	0	0	0	0	110.9	P29 L30 K35 E36	P29-T32 WeakPolarHBondContact O-CB 3.14Å; P29-T32 PolarHBondContact O-N 2.94Å; L30-T32 PolarHBondContact O-N 2.95Å; T32-K35 WeakPolarHBondContact O-CB 3.47Å; T32-K35 PolarHBondContact O-N 3.29Å; T32-E36 WeakPolarHBondContact O-CG 3.35Å; T32-E36 PolarHBondContact O-N 3.31Å
33	V	89.8	Confident	90	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-44.9	177.1	179.5	0	0	0	0	111	L24 K28 P29 L30 K35 E36 V37	L24-V33 HydrophobicContact CD1-CG1 3.79Å; L24-V33 HydrophobicContact CG-CG1 4.23Å; L24-V33 HydrophobicContact CG-CG2 4.32Å; K28-V33 HydrophobicContact CB-CG2 4.32Å; P29-V33 PolarHBondContact O-N 3.41Å; L30-V33 PolarHBondContact O-N 3.43Å; L30-V33 VanDerWaalsContact O-N 3.16Å; V33-K35 VanDerWaalsContact C-N 3.31Å; V33-K35 PolarHBondContact O-N 3.22Å; V33-E36 PolarHBondContact O-N 3.44Å; V33-V37 HydrophobicContact CG1-CG2 4.42Å; V33-V37 WeakPolarHBondContact O-CG2 3.41Å; V33-V37 PolarHBondContact O-N 3.11Å
34	L	92.3	Very high	89.8	Confident	23 Å²	23	53.1 Å²	53.1	12%	0.12	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-41.8	175.8	-86.3	164.6	0	0	0	111.8	L30 V37 C38 L51 L77	L30-L34 WeakPolarHBondContact O-CB 3.2Å; L30-L34 PolarHBondContact O-N 3.22Å; L34-V37 PolarHBondContact O-N 2.77Å; L34-C38 WeakPolarHBondContact O-CB 3.37Å; L34-C38 PolarHBondContact O-N 3.37Å; L34-C38 PolarHBondContact O-SG 3.3Å; L34-L51 HydrophobicContact CD2-CD2 4.11Å; L34-L51 HydrophobicContact CD2-CG 3.85Å; L34-L51 HydrophobicContact CG-CG 4.37Å; L34-L77 HydrophobicContact CD2-CD1 3.62Å
35	K	92.1	Very high	89.9	Confident	114 Å²	114	58.8 Å²	58.8	50%	0.496	33%	0.333	S	S	.	.	H	α-helix	trans	-60.2	-47.1	174.8	-171.6	177.2	179.2	179.1	0	111.8	A31 T32 V33 V37 C38 D39	A31-K35 WeakPolarHBondContact O-CB 3.45Å; A31-K35 PolarHBondContact O-N 2.74Å; T32-K35 WeakPolarHBondContact O-CB 3.47Å; T32-K35 PolarHBondContact O-N 3.29Å; V33-K35 VanDerWaalsContact C-N 3.31Å; V33-K35 PolarHBondContact O-N 3.22Å; K35-V37 VanDerWaalsContact C-N 3.33Å; K35-V37 PolarHBondContact O-N 2.81Å; K35-C38 PolarHBondContact O-N 2.91Å; K35-D39 WeakPolarHBondContact O-CB 3.42Å; K35-D39 PolarHBondContact O-N 3.4Å
36	E	90.8	Very high	89.9	Confident	86 Å²	86	57.8 Å²	57.8	40%	0.402	33%	0.33	S	S	.	.	H	α-helix	trans	-58.5	-43.1	176	-68.6	174.7	-170.2	0	0	111.7	K28 T32 V33 A40	K28-E36 IonicContact NZ-OE1 2.86Å; K28-E36 PolarHBondContact NZ-OE1 2.81Å; K28-E36 IonicContact NZ-OE2 3.74Å; T32-E36 WeakPolarHBondContact O-CG 3.35Å; T32-E36 PolarHBondContact O-N 3.31Å; V33-E36 PolarHBondContact O-N 3.44Å; E36-A40 PolarHBondContact O-N 3.27Å
37	V	91.3	Very high	90.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-63.2	-47.9	176.8	174.8	0	0	0	0	111.6	V12 Q20 I22 V33 L34 K35 A40 W41 L77	V12-V37 HydrophobicContact CG1-CG1 4.02Å; V12-V37 HydrophobicContact CG2-CG2 4.41Å; Q20-V37 PolarHBondContact NE2-O 3.29Å; I22-V37 HydrophobicContact CD1-CB 4.37Å; I22-V37 HydrophobicContact CD1-CG2 3.31Å; V33-V37 HydrophobicContact CG1-CG2 4.42Å; V33-V37 WeakPolarHBondContact O-CG2 3.41Å; V33-V37 PolarHBondContact O-N 3.11Å; L34-V37 PolarHBondContact O-N 2.77Å; K35-V37 VanDerWaalsContact C-N 3.33Å; K35-V37 PolarHBondContact O-N 2.81Å; V37-A40 PolarHBondContact O-N 3.26Å; V37-W41 HydrophobicContact CG1-CE3 3.99Å; V37-W41 HydrophobicContact CG1-CZ3 3.71Å; V37-W41 PolarHBondContact O-N 2.86Å; V37-L77 HydrophobicContact CG1-CD1 4.16Å; V37-L77 HydrophobicContact CG1-CD2 4.32Å
38	C	92.1	Very high	90.5	Very high	0 Å²	0	61 Å²	61	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-43.5	-178.5	-73.9	0	0	0	0	111.5	L34 K35 A40 W41 N42 L43	L34-C38 WeakPolarHBondContact O-CB 3.37Å; L34-C38 PolarHBondContact O-N 3.37Å; L34-C38 PolarHBondContact O-SG 3.3Å; K35-C38 PolarHBondContact O-N 2.91Å; C38-A40 VanDerWaalsContact C-N 3.29Å; C38-A40 PolarHBondContact O-N 2.89Å; C38-W41 CarbonylContact O-C 3.56Å; C38-W41 PolarHBondContact O-N 2.93Å; C38-W41 VanDerWaalsContact O-N 3.11Å; C38-N42 PolarHBondContact O-N 2.88Å; C38-L43 HydrophobicContact CB-CB 4.1Å; C38-L43 PolarHBondContact O-N 3.05Å
39	D	91.9	Very high	90.7	Very high	92 Å²	92	60 Å²	60	49%	0.492	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-41.8	177.9	-72.2	-16.5	0	0	0	110.8	K35 W41 N42	K35-D39 WeakPolarHBondContact O-CB 3.42Å; K35-D39 PolarHBondContact O-N 3.4Å; D39-W41 VanDerWaalsContact C-N 3.28Å; D39-W41 PolarHBondContact O-N 2.7Å; D39-N42 PolarHBondContact O-N 3.09Å
40	A	89.7	Confident	90.9	Very high	63 Å²	63	57 Å²	57	52%	0.521	31%	0.313	S	S	.	.	H	α-helix	trans	-66.9	-23.9	178.6	0	0	0	0	0	114.3	Q20 E36 V37 C38	Q20-A40 VanDerWaalsContact NE2-CB 3.32Å; Q20-A40 VanDerWaalsContact OE1-CB 3.31Å; E36-A40 PolarHBondContact O-N 3.27Å; V37-A40 PolarHBondContact O-N 3.26Å; C38-A40 VanDerWaalsContact C-N 3.29Å; C38-A40 PolarHBondContact O-N 2.89Å
41	W	92.3	Very high	91	Very high	42 Å²	42	56.6 Å²	56.6	16%	0.159	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	9.7	171.1	-75.6	-33	0	0	0	113.6	V12 K14 A17 I18 Q20 V37 C38 D39 L43 L77	V12-W41 HydrophobicContact CB-CH2 4.32Å; V12-W41 HydrophobicContact CG1-CH2 3.95Å; V12-W41 HydrophobicContact CG1-CZ3 4.15Å; V12-W41 VanDerWaalsContact O-CH2 3.31Å; V12-W41 WeakPolarHBondContact O-CH2 3.32Å; V12-W41 WeakPolarHBondContact O-CZ2 3.27Å; K14-W41 HydrophobicContact CB-CD2 4.32Å; K14-W41 HydrophobicContact CB-CE3 3.93Å; K14-W41 HydrophobicContact CB-CH2 3.43Å; K14-W41 VanDerWaalsContact CB-CH2 3.43Å; K14-W41 HydrophobicContact CB-CZ2 3.86Å; K14-W41 HydrophobicContact CB-CZ3 3.48Å; K14-W41 VanDerWaalsContact CB-CZ3 3.48Å; K14-W41 HydrophobicContact CD-CD2 4.12Å; K14-W41 HydrophobicContact CD-CE3 3.79Å; K14-W41 HydrophobicContact CD-CZ3 4.18Å; K14-W41 HydrophobicContact CG-CE3 4.49Å; K14-W41 HydrophobicContact CG-CZ3 4.42Å; A17-W41 HydrophobicContact CB-CZ2 4.39Å; I18-W41 PolarHBondContact O-NE1 2.7Å; Q20-W41 HydrophobicContact CB-CZ2 4.36Å; Q20-W41 HydrophobicContact CG-CD2 4.38Å; Q20-W41 HydrophobicContact CG-CH2 4.41Å; Q20-W41 HydrophobicContact CG-CZ2 3.71Å; Q20-W41 VanDerWaalsContact NE2-CD1 3.33Å; V37-W41 HydrophobicContact CG1-CE3 3.99Å; V37-W41 HydrophobicContact CG1-CZ3 3.71Å; V37-W41 PolarHBondContact O-N 2.86Å; C38-W41 CarbonylContact O-C 3.56Å; C38-W41 PolarHBondContact O-N 2.93Å; C38-W41 VanDerWaalsContact O-N 3.11Å; D39-W41 VanDerWaalsContact C-N 3.28Å; D39-W41 PolarHBondContact O-N 2.7Å; W41-L43 HydrophobicContact CB-CD1 4.07Å; W41-L43 HydrophobicContact CB-CG 3.91Å; W41-L43 HydrophobicContact CE3-CD1 4.22Å; W41-L43 PolarHBondContact O-N 2.59Å; W41-L77 HydrophobicContact CE3-CD2 3.74Å; W41-L77 HydrophobicContact CZ3-CB 3.79Å; W41-L77 HydrophobicContact CZ3-CD2 3.68Å; W41-L77 HydrophobicContact CZ3-CG 4.33Å
42	N	91.2	Very high	91	Very high	147 Å²	147	53.8 Å²	53.8	79%	0.786	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	37.4	-174.9	-59.1	-62.2	0	0	0	113.2	C38 D39	C38-N42 PolarHBondContact O-N 2.88Å; D39-N42 PolarHBondContact O-N 3.09Å
43	L	89.4	Confident	90.9	Very high	29 Å²	29	51.7 Å²	51.7	15%	0.152	27%	0.271	C	S	.	.			trans	-88	121.7	177.9	-62.7	175.6	0	0	0	109.9	K14 C38 W41 Y49 L77	K14-L43 HydrophobicContact CD-CD1 3.94Å; C38-L43 HydrophobicContact CB-CB 4.1Å; C38-L43 PolarHBondContact O-N 3.05Å; W41-L43 HydrophobicContact CB-CD1 4.07Å; W41-L43 HydrophobicContact CB-CG 3.91Å; W41-L43 HydrophobicContact CE3-CD1 4.22Å; W41-L43 PolarHBondContact O-N 2.59Å; L43-Y49 HydrophobicContact CB-CE2 4.09Å; L43-Y49 HydrophobicContact CD1-CE1 4.22Å; L43-Y49 HydrophobicContact CD1-CE2 4.47Å; L43-L77 HydrophobicContact CD1-CD2 3.51Å
44	P	86.3	Confident	90.5	Very high	83 Å²	83	53.1 Å²	53.1	54%	0.539	28%	0.283	S	S	.	.	S	Bend	trans	-71.5	155	174.5	32.2	-34.8	0	0	0	110.1
45	H	88.4	Confident	89.5	Confident	120 Å²	120	56 Å²	56	56%	0.556	30%	0.299	S	S	*	.			trans	60.1	72.2	173.9	-56.7	-68.6	0	0	0	114	E47 S48 Y49	H45-E47 WeakPolarHBondContact CA-OE1 3.25Å; H45-E47 WeakPolarHBondContact CA-OE2 3.44Å; H45-E47 HydrophobicContact CB-CG 4.5Å; H45-E47 VanDerWaalsContact CB-OE1 3.27Å; H45-E47 WeakPolarHBondContact CB-OE1 3.45Å; H45-E47 IonicContact CG-OE1 2.88Å; H45-E47 IonicContact ND1-OE1 3.69Å; H45-E47 PolarHBondContact ND1-OE1 3.36Å; H45-E47 PolarHBondContact O-N 3.01Å; H45-E47 VanDerWaalsContact O-N 3.09Å; H45-S48 WeakPolarHBondContact O-CB 3.49Å; H45-S48 PolarHBondContact O-N 3.18Å; H45-Y49 WeakPolarHBondContact O-CD2 3.18Å
46	S	88.9	Confident	88.2	Confident	28 Å²	28	53.4 Å²	53.4	20%	0.196	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-55.4	-27.8	178.5	52.5	0	0	0	0	113.7	S48 Y49	S46-S48 PolarHBondContact O-N 2.8Å; S46-Y49 PolarHBondContact O-N 3.1Å
47	E	89.8	Confident	86.8	Confident	123 Å²	123	53.9 Å²	53.9	58%	0.575	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-62.5	-19.8	174.2	64.5	-82.7	-170.3	0	0	113.7	H45 Y49	H45-E47 WeakPolarHBondContact CA-OE1 3.25Å; H45-E47 WeakPolarHBondContact CA-OE2 3.44Å; H45-E47 HydrophobicContact CB-CG 4.5Å; H45-E47 VanDerWaalsContact CB-OE1 3.27Å; H45-E47 WeakPolarHBondContact CB-OE1 3.45Å; H45-E47 IonicContact CG-OE1 2.88Å; H45-E47 IonicContact ND1-OE1 3.69Å; H45-E47 PolarHBondContact ND1-OE1 3.36Å; H45-E47 PolarHBondContact O-N 3.01Å; H45-E47 VanDerWaalsContact O-N 3.09Å; E47-Y49 PolarHBondContact O-N 3.04Å
48	S	92.3	Very high	86.1	Confident	35 Å²	35	59.8 Å²	59.8	25%	0.245	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-82.5	-0.9	179.3	-60.3	0	0	0	0	113.9	H45 S46 A80 L83	H45-S48 WeakPolarHBondContact O-CB 3.49Å; H45-S48 PolarHBondContact O-N 3.18Å; S46-S48 PolarHBondContact O-N 2.8Å; S48-A80 PolarHBondContact O-N 2.91Å; S48-L83 VanDerWaalsContact CA-CD1 3.43Å; S48-L83 VanDerWaalsContact CB-CD1 3.45Å
49	Y	93.5	Very high	85.8	Confident	57 Å²	57	64.2 Å²	64.2	22%	0.224	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	155.5	-175.1	-57.4	-86.5	0	0	0	111.8	L43 H45 S46 E47 L77 S78	L43-Y49 HydrophobicContact CB-CE2 4.09Å; L43-Y49 HydrophobicContact CD1-CE1 4.22Å; L43-Y49 HydrophobicContact CD1-CE2 4.47Å; H45-Y49 WeakPolarHBondContact O-CD2 3.18Å; S46-Y49 PolarHBondContact O-N 3.1Å; E47-Y49 PolarHBondContact O-N 3.04Å; Y49-L77 HydrophobicContact CD1-CD2 3.98Å; Y49-L77 HydrophobicContact CD1-CG 4.04Å; Y49-L77 HydrophobicContact CG-CD1 4.39Å; Y49-L77 HydrophobicContact CG-CD2 4.23Å; Y49-L77 HydrophobicContact CG-CG 4.3Å; Y49-S78 CarbonylContact C-O 3.59Å; Y49-S78 VanDerWaalsContact CA-O 3.25Å; Y49-S78 WeakPolarHBondContact CA-O 3.36Å
50	A	94.1	Very high	85.8	Confident	9 Å²	9	60 Å²	60	7%	0.074	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162.6	171.1	0	0	0	0	0	110.4	Y60 S78	A50-Y60 HydrophobicContact CB-CD1 3.94Å; A50-Y60 HydrophobicContact CB-CE1 3.84Å; A50-S78 PolarHBondContact N-O 3.07Å; A50-S78 PolarHBondContact O-N 3.35Å
51	L	93	Very high	85.8	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.9	174.4	-61.2	174.3	0	0	0	109.4	V12 L34 I61 L75 L77	V12-L51 HydrophobicContact CG1-CD2 3.81Å; V12-L51 HydrophobicContact CG2-CD2 4.5Å; L34-L51 HydrophobicContact CD2-CD2 4.11Å; L34-L51 HydrophobicContact CD2-CG 3.85Å; L34-L51 HydrophobicContact CG-CG 4.37Å; L51-I61 HydrophobicContact CB-CB 4.16Å; L51-I61 HydrophobicContact CB-CD1 3.81Å; L51-I61 HydrophobicContact CB-CG1 4.43Å; L51-I61 WeakPolarHBondContact O-CB 3.4Å; L51-I61 PolarHBondContact O-N 2.81Å; L51-L75 HydrophobicContact CB-CD1 4.45Å; L51-L75 HydrophobicContact CD1-CD1 4.01Å; L51-L77 HydrophobicContact CD2-CD1 3.99Å
52	K	91.7	Very high	85.8	Confident	10 Å²	10	57.2 Å²	57.2	4%	0.043	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	155.2	167.6	-68.4	179.5	-177.4	178.3	0	109.2	K58 R59 Y60 L75 C76 S78 E84	K52-K58 WeakPolarHBondContact CD-O 3.45Å; K52-R59 VanDerWaalsContact CA-O 3.29Å; K52-R59 WeakPolarHBondContact CA-O 3.37Å; K52-Y60 HydrophobicContact CD-CD1 4.46Å; K52-Y60 HydrophobicContact CD-CE1 4.26Å; K52-Y60 HydrophobicContact CD-CE2 4.49Å; K52-Y60 WeakPolarHBondContact CE-OH 3.48Å; K52-Y60 HydrophobicContact CG-CD1 3.83Å; K52-Y60 HydrophobicContact CG-CE1 4.02Å; K52-Y60 HydrophobicContact CG-CG 4.18Å; K52-Y60 PolarHBondContact NZ-OH 3.36Å; K52-L75 CarbonylContact O-C 3.53Å; K52-L75 VanDerWaalsContact O-CA 3.26Å; K52-L75 WeakPolarHBondContact O-CA 3.17Å; K52-C76 PolarHBondContact N-O 2.78Å; K52-C76 PolarHBondContact O-N 2.9Å; K52-S78 WeakPolarHBondContact CD-OG 3.3Å; K52-E84 IonicContact NZ-OE1 3.14Å; K52-E84 PolarHBondContact NZ-OE1 3.13Å; K52-E84 IonicContact NZ-OE2 2.76Å; K52-E84 PolarHBondContact NZ-OE2 3.29Å
53	F	87.8	Confident	85.7	Confident	19 Å²	19	54.7 Å²	54.7	8%	0.083	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	139.1	165.1	-71.2	-81.5	0	0	0	110	K58 R59 I61 E68 I69 L75	F53-K58 VanDerWaalsContact O-CA 3.31Å; F53-K58 WeakPolarHBondContact O-CA 3.49Å; F53-R59 HydrophobicContact CD2-CB 4.44Å; F53-R59 PolarHBondContact N-O 3.06Å; F53-R59 VanDerWaalsContact N-O 3.11Å; F53-I61 HydrophobicContact CD2-CD1 4.32Å; F53-I61 HydrophobicContact CD2-CG1 3.98Å; F53-I61 HydrophobicContact CE2-CD1 4.14Å; F53-I61 HydrophobicContact CE2-CG1 3.68Å; F53-I61 HydrophobicContact CZ-CD1 4.25Å; F53-I61 HydrophobicContact CZ-CG1 4.19Å; F53-E68 HydrophobicContact CZ-CB 4.02Å; F53-I69 HydrophobicContact CE1-CG1 4.3Å; F53-I69 HydrophobicContact CZ-CG1 4.05Å; F53-L75 HydrophobicContact CD1-CD2 3.83Å; F53-L75 HydrophobicContact CE1-CD2 4.07Å; F53-L75 HydrophobicContact CG-CD2 4.46Å
54	A	82.5	Confident	85.3	Confident	33 Å²	33	60.9 Å²	60.9	27%	0.273	32%	0.323	S	S	.	.	S	Bend	trans	-79.9	-23	178.2	0	0	0	0	0	112.5	I74	A54-I74 HydrophobicContact CB-CB 3.97Å; A54-I74 HydrophobicContact CB-CG2 3.61Å; A54-I74 WeakPolarHBondContact CB-O 3.31Å; A54-I74 PolarHBondContact N-O 2.81Å
55	D	70.3	Confident	85.2	Confident	84 Å²	84	58 Å²	58	45%	0.449	30%	0.303	S	S	.	.	S	Bend	trans	-101.8	160.7	178.6	52.3	-12.4	0	0	0	112.9
56	G	65.6	Low	85	Confident	59 Å²	59	52.8 Å²	52.8	61%	0.608	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	-143.8	-178.2	0	0	0	0	0	114.2	K58	G56-K58 PolarHBondContact O-N 3.27Å
57	H	61.7	Low	84.7	Confident	95 Å²	95	56.6 Å²	56.6	44%	0.44	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	11.1	-179.2	-67.9	-64.6	0	0	0	114.9	R59 D577	H57-R59 VanDerWaalsContact C-N 3.29Å; H57-R59 HydrophobicContact CB-CG 4.3Å; H57-R59 PolarHBondContact O-N 2.88Å; H57-D577 IonicContact CD2-OD2 2.71Å; H57-D577 PolarHBondContact CD2-OD2 2.96Å; H57-D577 IonicContact NE2-OD2 3.21Å; H57-D577 PolarHBondContact NE2-OD2 3.19Å
58	K	76.4	Confident	84.3	Confident	125 Å²	125	54.4 Å²	54.4	54%	0.543	28%	0.284	S	S	.	.			trans	49.8	46.6	179.9	-58.9	-178	179	177.9	0	113.6	K52 F53 G56	K52-K58 WeakPolarHBondContact CD-O 3.45Å; F53-K58 VanDerWaalsContact O-CA 3.31Å; F53-K58 WeakPolarHBondContact O-CA 3.49Å; G56-K58 PolarHBondContact O-N 3.27Å
59	R	84.9	Confident	83.9	Confident	93 Å²	93	53 Å²	53	35%	0.351	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-62.9	145	-176.9	-70.3	-173.4	-83.3	142.7	-1.3	111.6	K52 F53 H57 E68 D113	K52-R59 VanDerWaalsContact CA-O 3.29Å; K52-R59 WeakPolarHBondContact CA-O 3.37Å; F53-R59 HydrophobicContact CD2-CB 4.44Å; F53-R59 PolarHBondContact N-O 3.06Å; F53-R59 VanDerWaalsContact N-O 3.11Å; H57-R59 VanDerWaalsContact C-N 3.29Å; H57-R59 HydrophobicContact CB-CG 4.3Å; H57-R59 PolarHBondContact O-N 2.88Å; R59-E68 IonicContact CZ-OE2 3.19Å; R59-E68 IonicContact NH1-OE2 3.43Å; R59-E68 PolarHBondContact NH1-OE2 2.94Å; R59-E68 VanDerWaalsContact NH1-OE2 3.12Å; R59-E68 IonicContact NH2-OE2 2.88Å; R59-D113 WeakPolarHBondContact CA-OD2 3.22Å; R59-D113 WeakPolarHBondContact CB-OD2 3.46Å
60	Y	91.4	Very high	83.3	Confident	3 Å²	3	54 Å²	54	1%	0.012	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-68.8	139.3	175	-86.9	-76.6	0	0	0	111.3	A50 K52 N65 I79 P81 E84 D113 F116	A50-Y60 HydrophobicContact CB-CD1 3.94Å; A50-Y60 HydrophobicContact CB-CE1 3.84Å; K52-Y60 HydrophobicContact CD-CD1 4.46Å; K52-Y60 HydrophobicContact CD-CE1 4.26Å; K52-Y60 HydrophobicContact CD-CE2 4.49Å; K52-Y60 WeakPolarHBondContact CE-OH 3.48Å; K52-Y60 HydrophobicContact CG-CD1 3.83Å; K52-Y60 HydrophobicContact CG-CE1 4.02Å; K52-Y60 HydrophobicContact CG-CG 4.18Å; K52-Y60 PolarHBondContact NZ-OH 3.36Å; Y60-N65 PolarHBondContact O-ND2 2.95Å; Y60-I79 PolarHBondContact OH-O 2.96Å; Y60-P81 HydrophobicContact CD1-CB 4.2Å; Y60-P81 HydrophobicContact CD1-CG 4.26Å; Y60-P81 HydrophobicContact CD2-CB 4.19Å; Y60-P81 HydrophobicContact CE1-CB 3.85Å; Y60-P81 HydrophobicContact CE1-CG 4.13Å; Y60-P81 HydrophobicContact CE2-CB 3.85Å; Y60-P81 HydrophobicContact CG-CB 4.33Å; Y60-P81 WeakPolarHBondContact OH-CA 3.25Å; Y60-E84 PolarHBondContact OH-OE2 3.11Å; Y60-D113 PolarHBondContact N-OD2 2.99Å; Y60-F116 HydrophobicContact CD2-CB 3.98Å; Y60-F116 HydrophobicContact CE2-CB 3.82Å; Y60-F116 HydrophobicContact CE2-CD2 4.12Å; Y60-F116 HydrophobicContact CE2-CG 4.35Å
61	I	91.3	Very high	82.7	Confident	13 Å²	13	58.5 Å²	58.5	7%	0.067	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-92.1	126.5	172.9	-63	168.8	0	0	0	108.7	L30 L51 F53 N65 R66 I69 L75	L30-I61 HydrophobicContact CD1-CG2 3.89Å; L30-I61 HydrophobicContact CD2-CG2 4.12Å; L51-I61 HydrophobicContact CB-CB 4.16Å; L51-I61 HydrophobicContact CB-CD1 3.81Å; L51-I61 HydrophobicContact CB-CG1 4.43Å; L51-I61 WeakPolarHBondContact O-CB 3.4Å; L51-I61 PolarHBondContact O-N 2.81Å; F53-I61 HydrophobicContact CD2-CD1 4.32Å; F53-I61 HydrophobicContact CD2-CG1 3.98Å; F53-I61 HydrophobicContact CE2-CD1 4.14Å; F53-I61 HydrophobicContact CE2-CG1 3.68Å; F53-I61 HydrophobicContact CZ-CD1 4.25Å; F53-I61 HydrophobicContact CZ-CG1 4.19Å; I61-N65 WeakPolarHBondContact CA-OD1 3.38Å; I61-R66 HydrophobicContact CG2-CB 4.32Å; I61-I69 HydrophobicContact CD1-CD1 3.96Å; I61-I69 HydrophobicContact CD1-CG1 4.07Å; I61-I69 HydrophobicContact CG2-CD1 3.89Å; I61-L75 HydrophobicContact CD1-CD1 3.7Å; I61-L75 HydrophobicContact CD1-CD2 3.54Å; I61-L75 HydrophobicContact CD1-CG 4.16Å
62	T	91.4	Very high	82.1	Confident	33 Å²	33	61.2 Å²	61.2	20%	0.202	33%	0.331	C	S	.	.			trans	-127	168.4	179.7	67.6	0	0	0	0	109.2	L30 N64 N65 R66 T115	L30-T62 WeakPolarHBondContact CD1-O 3.45Å; T62-N64 PolarHBondContact O-N 3.48Å; T62-N64 VanDerWaalsContact O-N 3.13Å; T62-N64 PolarHBondContact OG1-N 2.86Å; T62-N65 PolarHBondContact N-OD1 3.18Å; T62-N65 PolarHBondContact O-N 3.19Å; T62-N65 PolarHBondContact O-OD1 3.09Å; T62-N65 VanDerWaalsContact O-OD1 3.09Å; T62-N65 PolarHBondContact OG1-N 3.06Å; T62-N65 PolarHBondContact OG1-OD1 2.71Å; T62-R66 WeakPolarHBondContact O-CB 3.4Å; T62-R66 PolarHBondContact O-N 3.45Å; T62-T115 HydrophobicContact CG2-CG2 3.56Å; T62-T115 WeakPolarHBondContact CG2-OG1 3.22Å
63	E	88.7	Confident	81.8	Confident	95 Å²	95	61.7 Å²	61.7	44%	0.444	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.2	174.7	-66	-67.1	175	0	0	112.6	L30 R66	L30-E63 WeakPolarHBondContact CB-OE1 3.39Å; L30-E63 HydrophobicContact CD1-CG 4.34Å; L30-E63 PolarHBondContact N-OE1 3.05Å; E63-R66 WeakPolarHBondContact O-CG 3.1Å; E63-R66 IonicContact OE1-NH1 3.69Å; E63-R66 WeakPolarHBondContact OE2-CD 3.43Å; E63-R66 IonicContact OE2-CZ 3.65Å; E63-R66 IonicContact OE2-NE 3.82Å; E63-R66 IonicContact OE2-NH1 2.74Å; E63-R66 PolarHBondContact OE2-NH1 3.22Å
64	N	81.7	Confident	81.9	Confident	158 Å²	158	64.1 Å²	64.1	85%	0.845	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-28.1	-179.4	-64.4	-24.1	0	0	0	113.5	T62	T62-N64 PolarHBondContact O-N 3.48Å; T62-N64 VanDerWaalsContact O-N 3.13Å; T62-N64 PolarHBondContact OG1-N 2.86Å
65	N	84.4	Confident	82.4	Confident	22 Å²	22	62.5 Å²	62.5	12%	0.118	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	3.5	-176.1	72.2	-2.4	0	0	0	113.9	Y60 I61 T62 M67 E68	Y60-N65 PolarHBondContact O-ND2 2.95Å; I61-N65 WeakPolarHBondContact CA-OD1 3.38Å; T62-N65 PolarHBondContact N-OD1 3.18Å; T62-N65 PolarHBondContact O-N 3.19Å; T62-N65 PolarHBondContact O-OD1 3.09Å; T62-N65 VanDerWaalsContact O-OD1 3.09Å; T62-N65 PolarHBondContact OG1-N 3.06Å; T62-N65 PolarHBondContact OG1-OD1 2.71Å; N65-M67 PolarHBondContact O-N 3.32Å; N65-E68 HydrophobicContact CB-CG 4.39Å; N65-E68 WeakPolarHBondContact CB-OE1 3.26Å; N65-E68 WeakPolarHBondContact O-CB 3.47Å; N65-E68 WeakPolarHBondContact O-CG 3.31Å; N65-E68 PolarHBondContact O-N 3.13Å
66	R	84.8	Confident	83.4	Confident	12 Å²	12	59.7 Å²	59.7	5%	0.045	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-55.1	-25.8	176.6	64.1	-178.1	-67.3	165.6	4.9	114.3	D25 Q26 K28 L30 I61 T62 E63 E68 I69	D25-R66 PolarHBondContact O-NH2 3.07Å; Q26-R66 VanDerWaalsContact C-NH2 3.28Å; Q26-R66 VanDerWaalsContact CA-NH2 3.31Å; Q26-R66 PolarHBondContact NE2-O 3.28Å; Q26-R66 PolarHBondContact O-NE 2.88Å; Q26-R66 PolarHBondContact O-NH2 3.3Å; Q26-R66 PolarHBondContact OE1-O 3.04Å; K28-R66 PolarHBondContact O-NH1 2.78Å; K28-R66 PolarHBondContact O-NH2 3.44Å; L30-R66 HydrophobicContact CD1-CB 4.2Å; L30-R66 HydrophobicContact CD2-CB 4.33Å; L30-R66 HydrophobicContact CG-CB 4.46Å; I61-R66 HydrophobicContact CG2-CB 4.32Å; T62-R66 WeakPolarHBondContact O-CB 3.4Å; T62-R66 PolarHBondContact O-N 3.45Å; E63-R66 WeakPolarHBondContact O-CG 3.1Å; E63-R66 IonicContact OE1-NH1 3.69Å; E63-R66 WeakPolarHBondContact OE2-CD 3.43Å; E63-R66 IonicContact OE2-CZ 3.65Å; E63-R66 IonicContact OE2-NE 3.82Å; E63-R66 IonicContact OE2-NH1 2.74Å; E63-R66 PolarHBondContact OE2-NH1 3.22Å; R66-E68 PolarHBondContact O-N 2.86Å; R66-I69 HydrophobicContact CB-CD1 4.43Å; R66-I69 WeakPolarHBondContact O-CB 3.17Å; R66-I69 WeakPolarHBondContact O-CD1 3.25Å; R66-I69 VanDerWaalsContact O-CG1 3.25Å; R66-I69 WeakPolarHBondContact O-CG1 3.48Å; R66-I69 PolarHBondContact O-N 2.87Å; R66-I69 VanDerWaalsContact O-N 3.11Å
67	M	80.8	Confident	84.7	Confident	108 Å²	108	57.7 Å²	57.7	53%	0.532	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-70.5	-10	176.3	-58.9	-57.6	-76.7	0	0	112.8	Q26 N65 I69 H634	Q26-M67 HydrophobicContact CB-SD 4.29Å; N65-M67 PolarHBondContact O-N 3.32Å; M67-I69 VanDerWaalsContact C-N 3.28Å; M67-H634 PolarHBondContact O-NE2 3.38Å
68	E	81.4	Confident	86.1	Confident	76 Å²	76	54.5 Å²	54.5	36%	0.355	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-75.1	-16.4	170.1	-62.7	179.3	-151.7	0	0	112	F53 R59 N65 R66 K70	F53-E68 HydrophobicContact CZ-CB 4.02Å; R59-E68 IonicContact CZ-OE2 3.19Å; R59-E68 IonicContact NH1-OE2 3.43Å; R59-E68 PolarHBondContact NH1-OE2 2.94Å; R59-E68 VanDerWaalsContact NH1-OE2 3.12Å; R59-E68 IonicContact NH2-OE2 2.88Å; N65-E68 HydrophobicContact CB-CG 4.39Å; N65-E68 WeakPolarHBondContact CB-OE1 3.26Å; N65-E68 WeakPolarHBondContact O-CB 3.47Å; N65-E68 WeakPolarHBondContact O-CG 3.31Å; N65-E68 PolarHBondContact O-N 3.13Å; R66-E68 PolarHBondContact O-N 2.86Å; E68-K70 PolarHBondContact O-N 3.42Å
69	I	83.8	Confident	86.9	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.031	27%	0.274	C	S	.	.			trans	-71.9	121.3	179.9	-55.3	167.6	0	0	0	110.2	V8 I10 L24 F53 I61 R66 M67 L75	V8-I69 HydrophobicContact CG2-CG2 4.01Å; I10-I69 HydrophobicContact CG2-CG2 3.54Å; L24-I69 HydrophobicContact CD1-CD1 4.31Å; F53-I69 HydrophobicContact CE1-CG1 4.3Å; F53-I69 HydrophobicContact CZ-CG1 4.05Å; I61-I69 HydrophobicContact CD1-CD1 3.96Å; I61-I69 HydrophobicContact CD1-CG1 4.07Å; I61-I69 HydrophobicContact CG2-CD1 3.89Å; R66-I69 HydrophobicContact CB-CD1 4.43Å; R66-I69 WeakPolarHBondContact O-CB 3.17Å; R66-I69 WeakPolarHBondContact O-CD1 3.25Å; R66-I69 VanDerWaalsContact O-CG1 3.25Å; R66-I69 WeakPolarHBondContact O-CG1 3.48Å; R66-I69 PolarHBondContact O-N 2.87Å; R66-I69 VanDerWaalsContact O-N 3.11Å; M67-I69 VanDerWaalsContact C-N 3.28Å; I69-L75 HydrophobicContact CD1-CD1 4.24Å; I69-L75 HydrophobicContact CG2-CD1 4.46Å
70	K	82.3	Confident	87.3	Confident	78 Å²	78	47.1 Å²	47.1	34%	0.339	26%	0.259	S	S	.	.			trans	-104.7	162.9	-178.3	-64.8	172.4	-174.7	168.6	0	111.2	E68 G72 S73 E592	E68-K70 PolarHBondContact O-N 3.42Å; K70-G72 PolarHBondContact O-N 3.04Å; K70-S73 PolarHBondContact N-OG 3.07Å; K70-S73 VanDerWaalsContact O-CB 3.25Å; K70-S73 WeakPolarHBondContact O-CB 3.48Å; K70-S73 PolarHBondContact O-N 3.22Å; K70-S73 VanDerWaalsContact O-N 3.07Å; K70-S73 PolarHBondContact O-OG 3.31Å; K70-E592 IonicContact NZ-OE2 3.54Å; K70-E592 PolarHBondContact NZ-OE2 3.23Å
71	N	80.5	Confident	87.4	Confident	104 Å²	104	48 Å²	48	56%	0.556	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	130.8	168.5	-87.2	-73.6	0	0	0	109.7	K9 S73	K9-N71 WeakPolarHBondContact CB-OD1 3.43Å; K9-N71 PolarHBondContact N-OD1 3.2Å; N71-S73 VanDerWaalsContact C-N 3.32Å
72	G	81.6	Confident	87.5	Confident	60 Å²	60	50 Å²	50	62%	0.619	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-2.7	-175.5	0	0	0	0	0	114.3	K9 K70 I74	K9-G72 PolarHBondContact O-N 3.46Å; K70-G72 PolarHBondContact O-N 3.04Å; G72-I74 PolarHBondContact O-N 3.3Å
73	S	85.4	Confident	87.6	Confident	19 Å²	19	50.6 Å²	50.6	13%	0.133	28%	0.278	C	S	.	.			trans	-57.5	135.3	174.6	-71.3	0	0	0	0	110.9	I10 A11 K70 N71	I10-S73 WeakPolarHBondContact CA-O 3.45Å; A11-S73 PolarHBondContact N-O 3.31Å; K70-S73 PolarHBondContact N-OG 3.07Å; K70-S73 VanDerWaalsContact O-CB 3.25Å; K70-S73 WeakPolarHBondContact O-CB 3.48Å; K70-S73 PolarHBondContact O-N 3.22Å; K70-S73 VanDerWaalsContact O-N 3.07Å; K70-S73 PolarHBondContact O-OG 3.31Å; N71-S73 VanDerWaalsContact C-N 3.32Å
74	I	88.6	Confident	87.9	Confident	70 Å²	70	47.6 Å²	47.6	36%	0.359	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	118.1	173.5	-54.4	178.7	0	0	0	106.9	A11 Q13 A54 G72	A11-I74 CarbonylContact O-C 3.42Å; A11-I74 WeakPolarHBondContact O-CA 3.29Å; Q13-I74 HydrophobicContact CG-CG2 3.78Å; Q13-I74 VanDerWaalsContact NE2-CG2 3.33Å; A54-I74 HydrophobicContact CB-CB 3.97Å; A54-I74 HydrophobicContact CB-CG2 3.61Å; A54-I74 WeakPolarHBondContact CB-O 3.31Å; A54-I74 PolarHBondContact N-O 2.81Å; G72-I74 PolarHBondContact O-N 3.3Å
75	L	92.5	Very high	88.5	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	153.8	177.5	-51.5	-173.7	0	0	0	109	I10 A11 V12 Q13 L51 K52 F53 I61 I69	I10-L75 HydrophobicContact CD1-CD1 3.67Å; I10-L75 HydrophobicContact CD1-CG 4.45Å; A11-L75 PolarHBondContact O-N 3.41Å; V12-L75 CarbonylContact C-O 3.55Å; V12-L75 WeakPolarHBondContact CA-O 3.37Å; V12-L75 HydrophobicContact CG2-CB 4.41Å; Q13-L75 PolarHBondContact N-O 2.84Å; L51-L75 HydrophobicContact CB-CD1 4.45Å; L51-L75 HydrophobicContact CD1-CD1 4.01Å; K52-L75 CarbonylContact O-C 3.53Å; K52-L75 VanDerWaalsContact O-CA 3.26Å; K52-L75 WeakPolarHBondContact O-CA 3.17Å; F53-L75 HydrophobicContact CD1-CD2 3.83Å; F53-L75 HydrophobicContact CE1-CD2 4.07Å; F53-L75 HydrophobicContact CG-CD2 4.46Å; I61-L75 HydrophobicContact CD1-CD1 3.7Å; I61-L75 HydrophobicContact CD1-CD2 3.54Å; I61-L75 HydrophobicContact CD1-CG 4.16Å; I69-L75 HydrophobicContact CD1-CD1 4.24Å; I69-L75 HydrophobicContact CG2-CD1 4.46Å
76	C	92	Very high	88.9	Confident	24 Å²	24	44.6 Å²	44.6	16%	0.162	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.9	169.8	56.8	0	0	0	0	110.5	Q13 K52 S78	Q13-C76 WeakPolarHBondContact O-CA 3.41Å; K52-C76 PolarHBondContact N-O 2.78Å; K52-C76 PolarHBondContact O-N 2.9Å; C76-S78 PolarHBondContact O-N 3.09Å
77	L	92.6	Very high	89.3	Confident	17 Å²	17	49.6 Å²	49.6	9%	0.089	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	115.3	169.5	-169.6	74.1	0	0	0	107.9	V12 Q13 K14 L34 V37 W41 L43 Y49 L51	V12-L77 HydrophobicContact CG1-CB 4.24Å; Q13-L77 PolarHBondContact O-N 3.03Å; K14-L77 HydrophobicContact CD-CD2 4.49Å; L34-L77 HydrophobicContact CD2-CD1 3.62Å; V37-L77 HydrophobicContact CG1-CD1 4.16Å; V37-L77 HydrophobicContact CG1-CD2 4.32Å; W41-L77 HydrophobicContact CE3-CD2 3.74Å; W41-L77 HydrophobicContact CZ3-CB 3.79Å; W41-L77 HydrophobicContact CZ3-CD2 3.68Å; W41-L77 HydrophobicContact CZ3-CG 4.33Å; L43-L77 HydrophobicContact CD1-CD2 3.51Å; Y49-L77 HydrophobicContact CD1-CD2 3.98Å; Y49-L77 HydrophobicContact CD1-CG 4.04Å; Y49-L77 HydrophobicContact CG-CD1 4.39Å; Y49-L77 HydrophobicContact CG-CD2 4.23Å; Y49-L77 HydrophobicContact CG-CG 4.3Å; L51-L77 HydrophobicContact CD2-CD1 3.99Å
78	S	91.8	Very high	89.9	Confident	29 Å²	29	45 Å²	45	20%	0.203	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	172.1	178.6	-68.2	0	0	0	0	110.2	Y49 A50 K52 C76	Y49-S78 CarbonylContact C-O 3.59Å; Y49-S78 VanDerWaalsContact CA-O 3.25Å; Y49-S78 WeakPolarHBondContact CA-O 3.36Å; A50-S78 PolarHBondContact N-O 3.07Å; A50-S78 PolarHBondContact O-N 3.35Å; K52-S78 WeakPolarHBondContact CD-OG 3.3Å; C76-S78 PolarHBondContact O-N 3.09Å
79	I	92.2	Very high	90.4	Very high	58 Å²	58	41.6 Å²	41.6	30%	0.297	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	144.7	171.5	-57.8	174.1	0	0	0	108.3	Y60 L83 E84	Y60-I79 PolarHBondContact OH-O 2.96Å; I79-L83 HydrophobicContact CG2-CB 3.64Å; I79-E84 HydrophobicContact CB-CB 4.33Å; I79-E84 HydrophobicContact CG2-CB 4.14Å
80	A	93.9	Very high	90.7	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.033	25%	0.248	C	C	.	.			trans	-58.9	144.4	175.7	0	0	0	0	0	111.1	S48 D82 L83 E84	S48-A80 PolarHBondContact O-N 2.91Å; A80-D82 WeakPolarHBondContact CB-OD1 3.26Å; A80-D82 PolarHBondContact O-N 3.4Å; A80-L83 PolarHBondContact O-N 2.81Å; A80-L83 VanDerWaalsContact O-N 3.07Å; A80-E84 WeakPolarHBondContact O-CB 3.29Å; A80-E84 PolarHBondContact O-N 3.02Å
81	P	93.6	Very high	91	Very high	22 Å²	22	40.4 Å²	40.4	14%	0.143	24%	0.242	C	C	.	.	H	α-helix	trans	-60.2	-34.1	-172.7	23.5	-33.2	0	0	0	112.6	Y60 A85 T115 E119	Y60-P81 HydrophobicContact CD1-CB 4.2Å; Y60-P81 HydrophobicContact CD1-CG 4.26Å; Y60-P81 HydrophobicContact CD2-CB 4.19Å; Y60-P81 HydrophobicContact CE1-CB 3.85Å; Y60-P81 HydrophobicContact CE1-CG 4.13Å; Y60-P81 HydrophobicContact CE2-CB 3.85Å; Y60-P81 HydrophobicContact CG-CB 4.33Å; Y60-P81 WeakPolarHBondContact OH-CA 3.25Å; P81-A85 WeakPolarHBondContact O-CB 3.45Å; P81-A85 PolarHBondContact O-N 3.12Å; P81-T115 HydrophobicContact CB-CG2 4.49Å; P81-T115 HydrophobicContact CG-CG2 4.3Å; P81-E119 HydrophobicContact CB-CG 4.29Å
82	D	93.4	Very high	91.3	Very high	55 Å²	55	36 Å²	36	29%	0.294	22%	0.218	S	C	.	.	H	α-helix	trans	-67.2	-46.9	176.3	73.9	-56.3	0	0	0	110.3	A80 Q86 E119 R123	A80-D82 WeakPolarHBondContact CB-OD1 3.26Å; A80-D82 PolarHBondContact O-N 3.4Å; D82-Q86 WeakPolarHBondContact O-CB 3.37Å; D82-Q86 PolarHBondContact O-N 3.11Å; D82-E119 HydrophobicContact CB-CG 4.42Å; D82-R123 PolarHBondContact O-NH1 3.27Å; D82-R123 PolarHBondContact O-NH2 2.86Å; D82-R123 IonicContact OD2-NH2 2.6Å
83	L	93.9	Very high	91.4	Very high	46 Å²	46	39 Å²	39	24%	0.241	22%	0.216	C	C	.	.	H	α-helix	trans	-68.6	-38.9	176.7	-67.4	-177	0	0	0	112.4	S48 I79 A80 Q86 Q87	S48-L83 VanDerWaalsContact CA-CD1 3.43Å; S48-L83 VanDerWaalsContact CB-CD1 3.45Å; I79-L83 HydrophobicContact CG2-CB 3.64Å; A80-L83 PolarHBondContact O-N 2.81Å; A80-L83 VanDerWaalsContact O-N 3.07Å; L83-Q86 PolarHBondContact O-N 2.82Å; L83-Q87 VanDerWaalsContact O-CG 3.31Å; L83-Q87 WeakPolarHBondContact O-CG 3.35Å; L83-Q87 PolarHBondContact O-N 2.89Å
84	E	93.9	Very high	91.2	Very high	31 Å²	31	40.5 Å²	40.5	15%	0.145	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-44.4	177.9	-166.4	172.5	-131	0	0	110.3	K52 Y60 I79 A80 Q86 Q87 V88 L110 F116	K52-E84 IonicContact NZ-OE1 3.14Å; K52-E84 PolarHBondContact NZ-OE1 3.13Å; K52-E84 IonicContact NZ-OE2 2.76Å; K52-E84 PolarHBondContact NZ-OE2 3.29Å; Y60-E84 PolarHBondContact OH-OE2 3.11Å; I79-E84 HydrophobicContact CB-CB 4.33Å; I79-E84 HydrophobicContact CG2-CB 4.14Å; A80-E84 WeakPolarHBondContact O-CB 3.29Å; A80-E84 PolarHBondContact O-N 3.02Å; E84-Q86 VanDerWaalsContact C-N 3.35Å; E84-Q86 PolarHBondContact O-N 2.8Å; E84-Q87 PolarHBondContact O-N 2.93Å; E84-V88 WeakPolarHBondContact O-CB 3.49Å; E84-V88 VanDerWaalsContact O-CG2 3.31Å; E84-V88 WeakPolarHBondContact O-CG2 3.21Å; E84-V88 PolarHBondContact O-N 3.12Å; E84-L110 VanDerWaalsContact CD-CD1 3.48Å; E84-L110 HydrophobicContact CG-CD1 3.98Å; E84-F116 HydrophobicContact CB-CE2 4.23Å; E84-F116 HydrophobicContact CG-CE2 4.1Å
85	A	94.6	Very high	90.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-41.1	173.4	0	0	0	0	0	111.6	P81 Q87 V88 L89 F116 E119 V120	P81-A85 WeakPolarHBondContact O-CB 3.45Å; P81-A85 PolarHBondContact O-N 3.12Å; A85-Q87 PolarHBondContact O-N 3.34Å; A85-V88 PolarHBondContact O-N 3.35Å; A85-L89 VanDerWaalsContact O-CB 3.22Å; A85-L89 WeakPolarHBondContact O-CB 3.16Å; A85-L89 WeakPolarHBondContact O-CG 3.42Å; A85-L89 PolarHBondContact O-N 2.9Å; A85-F116 HydrophobicContact CB-CD2 4.44Å; A85-F116 HydrophobicContact CB-CE2 3.96Å; A85-F116 HydrophobicContact CB-CZ 4.49Å; A85-E119 HydrophobicContact CB-CB 3.93Å; A85-V120 HydrophobicContact CB-CG2 3.77Å
86	Q	93.8	Very high	90	Very high	118 Å²	118	47.4 Å²	47.4	55%	0.551	27%	0.274	S	S	*	.	H	α-helix	trans	-62	-43.5	175.4	-175.2	179.4	-2.5	0	0	112.3	D82 L83 E84 G90	D82-Q86 WeakPolarHBondContact O-CB 3.37Å; D82-Q86 PolarHBondContact O-N 3.11Å; L83-Q86 PolarHBondContact O-N 2.82Å; E84-Q86 VanDerWaalsContact C-N 3.35Å; E84-Q86 PolarHBondContact O-N 2.8Å; Q86-G90 PolarHBondContact O-N 2.77Å
87	Q	92.6	Very high	89.5	Confident	117 Å²	117	53.2 Å²	53.2	55%	0.547	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-47	178.1	-72.9	175.9	12.5	0	0	111.7	L83 E84 A85 G90 G91	L83-Q87 VanDerWaalsContact O-CG 3.31Å; L83-Q87 WeakPolarHBondContact O-CG 3.35Å; L83-Q87 PolarHBondContact O-N 2.89Å; E84-Q87 PolarHBondContact O-N 2.93Å; A85-Q87 PolarHBondContact O-N 3.34Å; Q87-G90 PolarHBondContact O-N 3.17Å; Q87-G91 PolarHBondContact O-N 3.23Å
88	V	92.6	Very high	89.2	Confident	10 Å²	10	56.7 Å²	56.7	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-48.4	178.6	172.2	0	0	0	0	110.5	E84 A85 G90 G91 L92 L107	E84-V88 WeakPolarHBondContact O-CB 3.49Å; E84-V88 VanDerWaalsContact O-CG2 3.31Å; E84-V88 WeakPolarHBondContact O-CG2 3.21Å; E84-V88 PolarHBondContact O-N 3.12Å; A85-V88 PolarHBondContact O-N 3.35Å; V88-G90 VanDerWaalsContact C-N 3.3Å; V88-G90 PolarHBondContact O-N 3.43Å; V88-G91 WeakPolarHBondContact O-CA 3.27Å; V88-G91 PolarHBondContact O-N 2.85Å; V88-L92 WeakPolarHBondContact O-CG 3.49Å; V88-L92 PolarHBondContact O-N 2.86Å; V88-L107 HydrophobicContact CG1-CB 3.83Å; V88-L107 HydrophobicContact CG1-CD1 3.8Å; V88-L107 HydrophobicContact CG1-CG 4.26Å
89	L	92.3	Very high	88.9	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-31.9	178.6	-69.5	-177.8	0	0	0	113.2	A85 L92 Q93 V120 R123 R128	A85-L89 VanDerWaalsContact O-CB 3.22Å; A85-L89 WeakPolarHBondContact O-CB 3.16Å; A85-L89 WeakPolarHBondContact O-CG 3.42Å; A85-L89 PolarHBondContact O-N 2.9Å; L89-L92 HydrophobicContact CD2-CD1 3.77Å; L89-Q93 PolarHBondContact O-N 2.94Å; L89-V120 HydrophobicContact CD2-CG1 4.2Å; L89-R123 HydrophobicContact CD1-CB 3.6Å; L89-R128 PolarHBondContact O-NH1 3Å; L89-R128 VanDerWaalsContact O-NH1 3.07Å
90	G	90.3	Very high	88.7	Confident	40 Å²	40	54 Å²	54	41%	0.412	30%	0.298	S	S	.	.	H	α-helix	trans	-66.5	-40.4	170.3	0	0	0	0	0	112	Q86 Q87 V88 L92 Q93 S94	Q86-G90 PolarHBondContact O-N 2.77Å; Q87-G90 PolarHBondContact O-N 3.17Å; V88-G90 VanDerWaalsContact C-N 3.3Å; V88-G90 PolarHBondContact O-N 3.43Å; G90-L92 PolarHBondContact O-N 3.33Å; G90-Q93 PolarHBondContact O-N 3.43Å; G90-S94 PolarHBondContact O-N 3.35Å
91	G	88.8	Confident	88.4	Confident	20 Å²	20	56 Å²	56	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-62.8	-37.4	173.2	0	0	0	0	0	113.5	Q87 V88 Q93 S94 C100	Q87-G91 PolarHBondContact O-N 3.23Å; V88-G91 WeakPolarHBondContact O-CA 3.27Å; V88-G91 PolarHBondContact O-N 2.85Å; G91-Q93 PolarHBondContact O-N 2.98Å; G91-S94 WeakPolarHBondContact O-CB 3.2Å; G91-S94 PolarHBondContact O-N 2.87Å; G91-C100 WeakPolarHBondContact O-CA 3.46Å
92	L	86.7	Confident	88.2	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-63	-28.4	174.4	-66.1	-176.7	0	0	0	113.2	V88 L89 G90 S94 C100 A103 L104 L107 L129 I132	V88-L92 WeakPolarHBondContact O-CG 3.49Å; V88-L92 PolarHBondContact O-N 2.86Å; L89-L92 HydrophobicContact CD2-CD1 3.77Å; G90-L92 PolarHBondContact O-N 3.33Å; L92-S94 VanDerWaalsContact C-N 3.34Å; L92-C100 PolarHBondContact O-SG 3.46Å; L92-A103 HydrophobicContact CD2-CB 3.91Å; L92-A103 HydrophobicContact CG-CB 4.3Å; L92-L104 HydrophobicContact CD2-CD2 3.55Å; L92-L104 HydrophobicContact CD2-CG 3.56Å; L92-L107 HydrophobicContact CD1-CD2 4.27Å; L92-L129 HydrophobicContact CD1-CD2 4.08Å; L92-L129 HydrophobicContact CD1-CG 4.47Å; L92-I132 HydrophobicContact CB-CD1 4.13Å; L92-I132 HydrophobicContact CD1-CD1 4.46Å; L92-I132 HydrophobicContact CD2-CD1 4Å; L92-I132 HydrophobicContact CG-CD1 4.42Å
93	Q	83.8	Confident	88.1	Confident	121 Å²	121	59.7 Å²	59.7	57%	0.565	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	3.3	175.9	-71.6	-174.6	-40.9	0	0	113.5	L89 G90 G91 T95 R128	L89-Q93 PolarHBondContact O-N 2.94Å; G90-Q93 PolarHBondContact O-N 3.43Å; G91-Q93 PolarHBondContact O-N 2.98Å; Q93-T95 PolarHBondContact O-N 3Å; Q93-R128 VanDerWaalsContact CD-CZ 3.41Å; Q93-R128 VanDerWaalsContact NE2-NH1 3.13Å
94	S	81.4	Confident	88	Confident	51 Å²	51	57.5 Å²	57.5	36%	0.357	30%	0.302	S	S	.	.			trans	-60.8	136.5	176.2	-171.1	0	0	0	0	110.5	G90 G91 L92 S96	G90-S94 PolarHBondContact O-N 3.35Å; G91-S94 WeakPolarHBondContact O-CB 3.2Å; G91-S94 PolarHBondContact O-N 2.87Å; L92-S94 VanDerWaalsContact C-N 3.34Å; S94-S96 PolarHBondContact O-N 2.98Å; S94-S96 PolarHBondContact OG-N 3.42Å
95	T	73.9	Confident	87.9	Confident	157 Å²	157	61.5 Å²	61.5	96%	0.963	32%	0.319	S	S	*	.	S	Bend	trans	-68.7	-12.8	170.2	52.5	0	0	0	0	112.5	Q93	Q93-T95 PolarHBondContact O-N 3Å
96	S	82.7	Confident	87.7	Confident	58 Å²	58	66 Å²	66	41%	0.406	34%	0.343	S	S	.	.	S	Bend	trans	-90.1	123.1	176.2	177.6	0	0	0	0	111.2	S94 E98 G99 C100	S94-S96 PolarHBondContact O-N 2.98Å; S94-S96 PolarHBondContact OG-N 3.42Å; S96-E98 PolarHBondContact O-N 2.46Å; S96-G99 PolarHBondContact O-N 3.22Å; S96-C100 PolarHBondContact O-N 2.82Å; S96-C100 VanDerWaalsContact O-N 3.08Å
97	R	81	Confident	87.7	Confident	146 Å²	146	60.3 Å²	60.3	55%	0.551	32%	0.317	S	S	*	.	H	α-helix	trans	-53.3	-42.8	175.1	-178.4	175.4	175.9	159.6	3.6	112.5	G99 C100 Y101 D138 M142	R97-G99 VanDerWaalsContact C-N 3.32Å; R97-G99 PolarHBondContact O-N 3.34Å; R97-C100 PolarHBondContact O-N 3.21Å; R97-Y101 WeakPolarHBondContact O-CB 3.42Å; R97-Y101 PolarHBondContact O-N 3.09Å; R97-D138 IonicContact CZ-OD1 3.65Å; R97-D138 VanDerWaalsContact CZ-OD1 3.31Å; R97-D138 IonicContact CZ-OD2 3.95Å; R97-D138 IonicContact NE-OD2 2.9Å; R97-D138 IonicContact NH1-OD1 2.94Å; R97-D138 PolarHBondContact NH1-OD1 3.14Å; R97-D138 IonicContact NH1-OD2 3.68Å; R97-D138 PolarHBondContact NH1-OD2 3.46Å; R97-D138 VanDerWaalsContact NH2-CG 3.29Å; R97-D138 IonicContact NH2-OD1 3.29Å; R97-D138 PolarHBondContact NH2-OD1 3.32Å; R97-D138 IonicContact NH2-OD2 3.44Å; R97-M142 HydrophobicContact CG-SD 4.35Å
98	E	85.1	Confident	87.6	Confident	90 Å²	90	56.2 Å²	56.2	42%	0.421	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-35.9	179.1	178.7	58.7	-156.6	0	0	111.9	S96 R102	S96-E98 PolarHBondContact O-N 2.46Å; E98-R102 WeakPolarHBondContact O-CG 3.35Å; E98-R102 PolarHBondContact O-N 3.32Å; E98-R102 VanDerWaalsContact O-N 3.09Å; E98-R102 IonicContact OE1-CZ 3.78Å; E98-R102 IonicContact OE1-NE 3.12Å; E98-R102 PolarHBondContact OE1-NE 2.64Å; E98-R102 IonicContact OE1-NH2 3.74Å; E98-R102 PolarHBondContact OE1-NH2 2.88Å
99	G	86.4	Confident	87.4	Confident	21 Å²	21	59.7 Å²	59.7	22%	0.216	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-45.1	174.8	0	0	0	0	0	112.1	S96 R97 R102 A103	S96-G99 PolarHBondContact O-N 3.22Å; R97-G99 VanDerWaalsContact C-N 3.32Å; R97-G99 PolarHBondContact O-N 3.34Å; G99-R102 PolarHBondContact O-N 2.91Å; G99-A103 WeakPolarHBondContact O-CB 3.48Å; G99-A103 PolarHBondContact O-N 3.48Å
100	C	87.4	Confident	87.3	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.061	33%	0.328	C	S	.	.	H	α-helix	trans	-67.8	-40.5	178.1	-168.6	0	0	0	0	112.1	G91 L92 S96 R97 R102 A103 L104 M142	G91-C100 WeakPolarHBondContact O-CA 3.46Å; L92-C100 PolarHBondContact O-SG 3.46Å; S96-C100 PolarHBondContact O-N 2.82Å; S96-C100 VanDerWaalsContact O-N 3.08Å; R97-C100 PolarHBondContact O-N 3.21Å; C100-R102 PolarHBondContact O-N 3.31Å; C100-A103 PolarHBondContact O-N 2.9Å; C100-L104 WeakPolarHBondContact O-CG 3.31Å; C100-L104 PolarHBondContact O-N 2.98Å; C100-M142 HydrophobicContact CB-CE 3.53Å; C100-M142 WeakPolarHBondContact SG-CE 3.22Å
101	Y	88.5	Confident	87.3	Confident	46 Å²	46	58.9 Å²	58.9	18%	0.18	31%	0.309	C	S	.	.	H	α-helix	trans	-58.4	-48.5	174.3	174	-96.8	0	0	0	112.3	R97 A103 L104 K105 E141 L145	R97-Y101 WeakPolarHBondContact O-CB 3.42Å; R97-Y101 PolarHBondContact O-N 3.09Å; Y101-A103 VanDerWaalsContact C-N 3.32Å; Y101-A103 PolarHBondContact O-N 3.24Å; Y101-L104 PolarHBondContact O-N 3.29Å; Y101-K105 HydrophobicContact CE1-CD 4.22Å; Y101-K105 WeakPolarHBondContact O-CB 3.49Å; Y101-K105 PolarHBondContact O-N 3.16Å; Y101-E141 HydrophobicContact CE2-CB 4.48Å; Y101-E141 HydrophobicContact CE2-CG 4.1Å; Y101-E141 VanDerWaalsContact OH-CD 3.23Å; Y101-E141 PolarHBondContact OH-OE1 3.42Å; Y101-E141 PolarHBondContact OH-OE2 2.87Å; Y101-L145 HydrophobicContact CD2-CD1 4.03Å; Y101-L145 HydrophobicContact CE2-CD1 3.72Å
102	R	89.5	Confident	87.1	Confident	147 Å²	147	59.4 Å²	59.4	56%	0.555	31%	0.309	S	S	*	.	H	α-helix	trans	-62.2	-39.9	176.6	-69.9	-178.3	-147	163.4	4.2	112.3	E98 G99 C100 K105 N106	E98-R102 WeakPolarHBondContact O-CG 3.35Å; E98-R102 PolarHBondContact O-N 3.32Å; E98-R102 VanDerWaalsContact O-N 3.09Å; E98-R102 IonicContact OE1-CZ 3.78Å; E98-R102 IonicContact OE1-NE 3.12Å; E98-R102 PolarHBondContact OE1-NE 2.64Å; E98-R102 IonicContact OE1-NH2 3.74Å; E98-R102 PolarHBondContact OE1-NH2 2.88Å; G99-R102 PolarHBondContact O-N 2.91Å; C100-R102 PolarHBondContact O-N 3.31Å; R102-K105 PolarHBondContact O-N 3.47Å; R102-N106 VanDerWaalsContact O-CG 3.28Å; R102-N106 PolarHBondContact O-N 3.17Å
103	A	91.8	Very high	87.2	Confident	8 Å²	8	59.4 Å²	59.4	7%	0.066	31%	0.309	C	S	.	.	H	α-helix	trans	-61.9	-45.7	177.2	0	0	0	0	0	111.5	L92 G99 C100 Y101 N106 L107	L92-A103 HydrophobicContact CD2-CB 3.91Å; L92-A103 HydrophobicContact CG-CB 4.3Å; G99-A103 WeakPolarHBondContact O-CB 3.48Å; G99-A103 PolarHBondContact O-N 3.48Å; C100-A103 PolarHBondContact O-N 2.9Å; Y101-A103 VanDerWaalsContact C-N 3.32Å; Y101-A103 PolarHBondContact O-N 3.24Å; A103-N106 PolarHBondContact O-N 2.81Å; A103-L107 WeakPolarHBondContact O-CB 3.48Å; A103-L107 PolarHBondContact O-N 3.41Å
104	L	91.6	Very high	87.4	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.8	-43.3	175.5	-75.5	170.7	0	0	0	112.6	L92 C100 Y101 N106 L107 V108 L129 M142 L145	L92-L104 HydrophobicContact CD2-CD2 3.55Å; L92-L104 HydrophobicContact CD2-CG 3.56Å; C100-L104 WeakPolarHBondContact O-CG 3.31Å; C100-L104 PolarHBondContact O-N 2.98Å; Y101-L104 PolarHBondContact O-N 3.29Å; L104-N106 VanDerWaalsContact C-N 3.26Å; L104-N106 PolarHBondContact O-N 3.46Å; L104-L107 HydrophobicContact CD2-CD2 4.41Å; L104-L107 WeakPolarHBondContact O-CB 3.46Å; L104-L107 PolarHBondContact O-N 3.09Å; L104-L107 VanDerWaalsContact O-N 3.08Å; L104-V108 PolarHBondContact O-N 3.41Å; L104-L129 HydrophobicContact CD2-CD2 3.67Å; L104-M142 HydrophobicContact CD1-CE 4.06Å; L104-M142 HydrophobicContact CD1-CG 3.64Å; L104-L145 HydrophobicContact CB-CB 3.91Å; L104-L145 HydrophobicContact CB-CD1 4.33Å
105	K	91.6	Very high	87.9	Confident	115 Å²	115	56 Å²	56	50%	0.5	29%	0.291	S	S	.	.	H	α-helix	trans	-61	-36.7	177.8	-171.4	172.2	-175.5	165.8	0	112.4	Y101 R102 P109 L145	Y101-K105 HydrophobicContact CE1-CD 4.22Å; Y101-K105 WeakPolarHBondContact O-CB 3.49Å; Y101-K105 PolarHBondContact O-N 3.16Å; R102-K105 PolarHBondContact O-N 3.47Å; K105-P109 VanDerWaalsContact O-CD 3.26Å; K105-P109 WeakPolarHBondContact O-CD 3.48Å; K105-L145 HydrophobicContact CB-CD1 4.28Å
106	N	90.8	Very high	88.8	Confident	94 Å²	94	48.6 Å²	48.6	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-76.1	-30.9	174.5	-68	-9.6	0	0	0	112.2	R102 A103 L104 P109 L110	R102-N106 VanDerWaalsContact O-CG 3.28Å; R102-N106 PolarHBondContact O-N 3.17Å; A103-N106 PolarHBondContact O-N 2.81Å; L104-N106 VanDerWaalsContact C-N 3.26Å; L104-N106 PolarHBondContact O-N 3.46Å; N106-P109 WeakPolarHBondContact O-CD 3.45Å; N106-P109 WeakPolarHBondContact O-CG 3.25Å; N106-L110 WeakPolarHBondContact O-CD1 3.46Å; N106-L110 WeakPolarHBondContact O-CG 3.41Å
107	L	92.8	Very high	89.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.5	-45.6	-177.6	-178.8	64.4	0	0	0	112.8	V88 L92 A103 L104 L110 A111 F116 V120 L129 A149	V88-L107 HydrophobicContact CG1-CB 3.83Å; V88-L107 HydrophobicContact CG1-CD1 3.8Å; V88-L107 HydrophobicContact CG1-CG 4.26Å; L92-L107 HydrophobicContact CD1-CD2 4.27Å; A103-L107 WeakPolarHBondContact O-CB 3.48Å; A103-L107 PolarHBondContact O-N 3.41Å; L104-L107 HydrophobicContact CD2-CD2 4.41Å; L104-L107 WeakPolarHBondContact O-CB 3.46Å; L104-L107 PolarHBondContact O-N 3.09Å; L104-L107 VanDerWaalsContact O-N 3.08Å; L107-L110 CarbonylContact O-C 3.48Å; L107-L110 PolarHBondContact O-N 2.97Å; L107-L110 VanDerWaalsContact O-N 3.13Å; L107-A111 WeakPolarHBondContact O-CB 3.39Å; L107-A111 PolarHBondContact O-N 2.97Å; L107-F116 HydrophobicContact CD1-CE1 3.56Å; L107-F116 HydrophobicContact CD1-CZ 3.82Å; L107-V120 HydrophobicContact CD1-CG2 4.23Å; L107-L129 HydrophobicContact CD2-CD1 4.12Å; L107-L129 HydrophobicContact CD2-CD2 3.88Å; L107-L129 HydrophobicContact CD2-CG 4.44Å; L107-A149 HydrophobicContact CD2-CB 3.59Å; L107-A149 HydrophobicContact CG-CB 3.87Å
108	V	90.2	Very high	89.9	Confident	30 Å²	30	43.6 Å²	43.6	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-52.5	-53.1	-174.6	173.7	0	0	0	0	113.7	L104 L110 A111 L145 M148 A149	L104-V108 PolarHBondContact O-N 3.41Å; V108-L110 VanDerWaalsContact C-N 3.3Å; V108-L110 PolarHBondContact O-N 2.82Å; V108-A111 PolarHBondContact O-N 3.24Å; V108-L145 HydrophobicContact CG2-CB 4.38Å; V108-L145 HydrophobicContact CG2-CD2 3.9Å; V108-M148 HydrophobicContact CG1-CB 4.3Å; V108-M148 HydrophobicContact CG2-CB 4.09Å; V108-A149 HydrophobicContact CG2-CB 4.08Å
109	P	88.2	Confident	90.4	Very high	83 Å²	83	42.2 Å²	42.2	54%	0.539	22%	0.215	S	C	.	.	H	α-helix	trans	-64.9	-34.9	179.7	24.8	-34.1	0	0	0	112.5	K105 N106 S112	K105-P109 VanDerWaalsContact O-CD 3.26Å; K105-P109 WeakPolarHBondContact O-CD 3.48Å; N106-P109 WeakPolarHBondContact O-CD 3.45Å; N106-P109 WeakPolarHBondContact O-CG 3.25Å; P109-S112 PolarHBondContact O-OG 2.86Å
110	L	90.4	Very high	90.8	Very high	29 Å²	29	41.2 Å²	41.2	15%	0.152	21%	0.205	C	C	.	.	H	α-helix	trans	-73.2	-30.9	179.3	-63	173.6	0	0	0	112.5	E84 N106 L107 V108 S112 D113 F116	E84-L110 VanDerWaalsContact CD-CD1 3.48Å; E84-L110 HydrophobicContact CG-CD1 3.98Å; N106-L110 WeakPolarHBondContact O-CD1 3.46Å; N106-L110 WeakPolarHBondContact O-CG 3.41Å; L107-L110 CarbonylContact O-C 3.48Å; L107-L110 PolarHBondContact O-N 2.97Å; L107-L110 VanDerWaalsContact O-N 3.13Å; V108-L110 VanDerWaalsContact C-N 3.3Å; V108-L110 PolarHBondContact O-N 2.82Å; L110-S112 PolarHBondContact O-N 3.42Å; L110-S112 VanDerWaalsContact O-N 3.13Å; L110-D113 WeakPolarHBondContact O-CB 3.22Å; L110-D113 PolarHBondContact O-N 2.82Å; L110-F116 VanDerWaalsContact C-CD1 3.46Å; L110-F116 HydrophobicContact CB-CD1 3.54Å; L110-F116 HydrophobicContact CB-CD2 4.3Å; L110-F116 HydrophobicContact CB-CE1 3.42Å; L110-F116 VanDerWaalsContact CB-CE1 3.42Å; L110-F116 HydrophobicContact CB-CE2 4.2Å; L110-F116 HydrophobicContact CB-CG 3.98Å; L110-F116 HydrophobicContact CB-CZ 3.77Å; L110-F116 HydrophobicContact CD1-CE1 4.38Å; L110-F116 HydrophobicContact CD1-CE2 3.92Å; L110-F116 HydrophobicContact CD1-CZ 3.84Å; L110-F116 HydrophobicContact CG-CZ 4.47Å; L110-F116 WeakPolarHBondContact O-CD1 3.47Å
111	A	89.9	Confident	91.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.4	-178	0	0	0	0	0	113.6	L107 V108 D113 E152 L153 H156	L107-A111 WeakPolarHBondContact O-CB 3.39Å; L107-A111 PolarHBondContact O-N 2.97Å; V108-A111 PolarHBondContact O-N 3.24Å; A111-D113 VanDerWaalsContact C-N 3.29Å; A111-E152 HydrophobicContact CB-CB 3.93Å; A111-L153 HydrophobicContact CB-CD2 4.12Å; A111-L153 HydrophobicContact CB-CG 4.18Å; A111-H156 PolarHBondContact O-NE2 3.31Å
112	S	86	Confident	91.4	Very high	31 Å²	31	43.7 Å²	43.7	22%	0.217	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.4	174.6	70.4	0	0	0	0	113.7	P109 L110 H156	P109-S112 PolarHBondContact O-OG 2.86Å; L110-S112 PolarHBondContact O-N 3.42Å; L110-S112 VanDerWaalsContact O-N 3.13Å; S112-H156 PolarHBondContact O-CE1 3.5Å; S112-H156 VanDerWaalsContact O-CE1 3.27Å; S112-H156 PolarHBondContact O-NE2 3.39Å
113	D	88.6	Confident	91.7	Very high	11 Å²	11	39.9 Å²	39.9	6%	0.059	21%	0.212	C	C	.	.	S	Bend	trans	-87.4	124.6	176.6	-178.2	-83.5	0	0	0	110.6	R59 Y60 L110 A111 T115 F116 A117	R59-D113 WeakPolarHBondContact CA-OD2 3.22Å; R59-D113 WeakPolarHBondContact CB-OD2 3.46Å; Y60-D113 PolarHBondContact N-OD2 2.99Å; L110-D113 WeakPolarHBondContact O-CB 3.22Å; L110-D113 PolarHBondContact O-N 2.82Å; A111-D113 VanDerWaalsContact C-N 3.29Å; D113-T115 VanDerWaalsContact C-N 3.32Å; D113-T115 PolarHBondContact O-N 2.85Å; D113-T115 WeakPolarHBondContact OD1-CA 3.48Å; D113-T115 WeakPolarHBondContact OD1-CB 3.4Å; D113-T115 PolarHBondContact OD1-N 3.15Å; D113-T115 PolarHBondContact OD1-OG1 3.1Å; D113-F116 HydrophobicContact CB-CB 4.25Å; D113-F116 PolarHBondContact O-N 3.28Å; D113-F116 PolarHBondContact OD1-N 3.4Å; D113-A117 VanDerWaalsContact O-CB 3.22Å; D113-A117 WeakPolarHBondContact O-CB 3.39Å; D113-A117 PolarHBondContact O-N 2.84Å
114	M	87.6	Confident	91.7	Very high	71 Å²	71	44.5 Å²	44.5	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-61.4	-38.1	-177.3	179.7	67.2	84.4	0	0	112.8	A117 Q118 H156 V158	M114-A117 PolarHBondContact O-N 2.78Å; M114-Q118 WeakPolarHBondContact O-CB 3.27Å; M114-Q118 VanDerWaalsContact O-CG 3.27Å; M114-Q118 WeakPolarHBondContact O-CG 3.38Å; M114-Q118 PolarHBondContact O-N 2.86Å; M114-Q118 HydrophobicContact SD-CG 4.34Å; M114-H156 HydrophobicContact CE-CB 3.78Å; M114-H156 VanDerWaalsContact CE-ND1 3.31Å; M114-H156 WeakPolarHBondContact CE-ND1 3.4Å; M114-H156 HydrophobicContact SD-CB 3.7Å; M114-H156 PolarHBondContact SD-ND1 2.78Å; M114-H156 VanDerWaalsContact SD-ND1 3.4Å; M114-V158 HydrophobicContact SD-CG2 3.96Å
115	T	91.3	Very high	91.8	Very high	31 Å²	31	44.5 Å²	44.5	19%	0.19	24%	0.236	C	C	.	.	H	α-helix	trans	-66.3	-48.3	-177.2	-46.4	0	0	0	0	109.7	T62 P81 D113 Q118 E119	T62-T115 HydrophobicContact CG2-CG2 3.56Å; T62-T115 WeakPolarHBondContact CG2-OG1 3.22Å; P81-T115 HydrophobicContact CB-CG2 4.49Å; P81-T115 HydrophobicContact CG-CG2 4.3Å; D113-T115 VanDerWaalsContact C-N 3.32Å; D113-T115 PolarHBondContact O-N 2.85Å; D113-T115 WeakPolarHBondContact OD1-CA 3.48Å; D113-T115 WeakPolarHBondContact OD1-CB 3.4Å; D113-T115 PolarHBondContact OD1-N 3.15Å; D113-T115 PolarHBondContact OD1-OG1 3.1Å; T115-Q118 PolarHBondContact O-N 3.18Å; T115-E119 PolarHBondContact O-N 3.31Å
116	F	93.9	Very high	91.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.7	-43.1	176	177.4	-93.5	0	0	0	112	Y60 E84 A85 L107 L110 D113 Q118 E119 V120	Y60-F116 HydrophobicContact CD2-CB 3.98Å; Y60-F116 HydrophobicContact CE2-CB 3.82Å; Y60-F116 HydrophobicContact CE2-CD2 4.12Å; Y60-F116 HydrophobicContact CE2-CG 4.35Å; E84-F116 HydrophobicContact CB-CE2 4.23Å; E84-F116 HydrophobicContact CG-CE2 4.1Å; A85-F116 HydrophobicContact CB-CD2 4.44Å; A85-F116 HydrophobicContact CB-CE2 3.96Å; A85-F116 HydrophobicContact CB-CZ 4.49Å; L107-F116 HydrophobicContact CD1-CE1 3.56Å; L107-F116 HydrophobicContact CD1-CZ 3.82Å; L110-F116 VanDerWaalsContact C-CD1 3.46Å; L110-F116 HydrophobicContact CB-CD1 3.54Å; L110-F116 HydrophobicContact CB-CD2 4.3Å; L110-F116 HydrophobicContact CB-CE1 3.42Å; L110-F116 VanDerWaalsContact CB-CE1 3.42Å; L110-F116 HydrophobicContact CB-CE2 4.2Å; L110-F116 HydrophobicContact CB-CG 3.98Å; L110-F116 HydrophobicContact CB-CZ 3.77Å; L110-F116 HydrophobicContact CD1-CE1 4.38Å; L110-F116 HydrophobicContact CD1-CE2 3.92Å; L110-F116 HydrophobicContact CD1-CZ 3.84Å; L110-F116 HydrophobicContact CG-CZ 4.47Å; L110-F116 WeakPolarHBondContact O-CD1 3.47Å; D113-F116 HydrophobicContact CB-CB 4.25Å; D113-F116 PolarHBondContact O-N 3.28Å; D113-F116 PolarHBondContact OD1-N 3.4Å; F116-Q118 VanDerWaalsContact C-N 3.28Å; F116-Q118 PolarHBondContact O-N 3.18Å; F116-E119 PolarHBondContact O-N 3.44Å; F116-E119 VanDerWaalsContact O-N 3.14Å; F116-V120 HydrophobicContact CD1-CG2 3.97Å; F116-V120 HydrophobicContact CE1-CG2 3.44Å; F116-V120 VanDerWaalsContact CE1-CG2 3.44Å; F116-V120 HydrophobicContact CE2-CG2 4.15Å; F116-V120 HydrophobicContact CZ-CG2 3.54Å; F116-V120 WeakPolarHBondContact O-CG2 3.26Å; F116-V120 PolarHBondContact O-N 3.07Å
117	A	93.3	Very high	91.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.4	-41.2	177.9	0	0	0	0	0	111.9	D113 M114 V120 I121 L153	D113-A117 VanDerWaalsContact O-CB 3.22Å; D113-A117 WeakPolarHBondContact O-CB 3.39Å; D113-A117 PolarHBondContact O-N 2.84Å; M114-A117 PolarHBondContact O-N 2.78Å; A117-V120 PolarHBondContact O-N 2.62Å; A117-I121 WeakPolarHBondContact O-CB 3.38Å; A117-I121 WeakPolarHBondContact O-CD1 3.31Å; A117-I121 WeakPolarHBondContact O-CG1 3.42Å; A117-I121 PolarHBondContact O-N 2.89Å; A117-L153 HydrophobicContact CB-CD2 3.55Å
118	Q	92.9	Very high	91.9	Very high	99 Å²	99	45.3 Å²	45.3	46%	0.463	24%	0.236	S	C	.	.	H	α-helix	trans	-61.5	-43.5	175.6	-76.3	174.7	-2.7	0	0	112.6	M114 T115 F116 V120 I121 S122 V158	M114-Q118 WeakPolarHBondContact O-CB 3.27Å; M114-Q118 VanDerWaalsContact O-CG 3.27Å; M114-Q118 WeakPolarHBondContact O-CG 3.38Å; M114-Q118 PolarHBondContact O-N 2.86Å; M114-Q118 HydrophobicContact SD-CG 4.34Å; T115-Q118 PolarHBondContact O-N 3.18Å; F116-Q118 VanDerWaalsContact C-N 3.28Å; F116-Q118 PolarHBondContact O-N 3.18Å; Q118-V120 VanDerWaalsContact C-N 3.33Å; Q118-V120 PolarHBondContact O-N 3.22Å; Q118-I121 PolarHBondContact O-N 3.06Å; Q118-S122 WeakPolarHBondContact O-CB 3.45Å; Q118-S122 PolarHBondContact O-N 2.67Å; Q118-S122 PolarHBondContact O-OG 3.4Å; Q118-V158 HydrophobicContact CG-CG2 4.21Å
119	E	95.1	Very high	92	Very high	61 Å²	61	43.9 Å²	43.9	29%	0.285	23%	0.227	S	C	.	.	H	α-helix	trans	-66	-32.9	176.7	-73.4	-58.6	143.2	0	0	113.3	P81 D82 A85 T115 F116 S122 R123	P81-E119 HydrophobicContact CB-CG 4.29Å; D82-E119 HydrophobicContact CB-CG 4.42Å; A85-E119 HydrophobicContact CB-CB 3.93Å; T115-E119 PolarHBondContact O-N 3.31Å; F116-E119 PolarHBondContact O-N 3.44Å; F116-E119 VanDerWaalsContact O-N 3.14Å; E119-S122 PolarHBondContact O-OG 3.18Å; E119-S122 VanDerWaalsContact O-OG 3.09Å; E119-R123 WeakPolarHBondContact O-CG 3.39Å; E119-R123 IonicContact OE2-CZ 2.61Å; E119-R123 IonicContact OE2-NH1 3.34Å
120	V	95.7	Very high	92.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-71.5	-44.3	173.7	171.9	0	0	0	0	110.6	A85 L89 L107 F116 A117 Q118 R123 G125 L153	A85-V120 HydrophobicContact CB-CG2 3.77Å; L89-V120 HydrophobicContact CD2-CG1 4.2Å; L107-V120 HydrophobicContact CD1-CG2 4.23Å; F116-V120 HydrophobicContact CD1-CG2 3.97Å; F116-V120 HydrophobicContact CE1-CG2 3.44Å; F116-V120 VanDerWaalsContact CE1-CG2 3.44Å; F116-V120 HydrophobicContact CE2-CG2 4.15Å; F116-V120 HydrophobicContact CZ-CG2 3.54Å; F116-V120 WeakPolarHBondContact O-CG2 3.26Å; F116-V120 PolarHBondContact O-N 3.07Å; A117-V120 PolarHBondContact O-N 2.62Å; Q118-V120 VanDerWaalsContact C-N 3.33Å; Q118-V120 PolarHBondContact O-N 3.22Å; V120-R123 PolarHBondContact O-N 3.43Å; V120-G125 VanDerWaalsContact O-CA 3.26Å; V120-G125 WeakPolarHBondContact O-CA 3.2Å; V120-G125 PolarHBondContact O-N 3.26Å; V120-L153 HydrophobicContact CB-CD2 4.29Å; V120-L153 HydrophobicContact CG1-CD1 3.79Å; V120-L153 HydrophobicContact CG1-CD2 4.23Å
121	I	94.2	Very high	92.2	Very high	26 Å²	26	42.3 Å²	42.3	13%	0.133	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-42	-179.4	-70.3	167.6	0	0	0	111.1	A117 Q118 R123 D124 L126 V158 V159	A117-I121 WeakPolarHBondContact O-CB 3.38Å; A117-I121 WeakPolarHBondContact O-CD1 3.31Å; A117-I121 WeakPolarHBondContact O-CG1 3.42Å; A117-I121 PolarHBondContact O-N 2.89Å; Q118-I121 PolarHBondContact O-N 3.06Å; I121-R123 PolarHBondContact O-N 3.45Å; I121-R123 VanDerWaalsContact O-N 3.16Å; I121-D124 PolarHBondContact O-N 3.04Å; I121-L126 HydrophobicContact CG1-CD1 4.08Å; I121-L126 HydrophobicContact CG1-CG 4.18Å; I121-L126 HydrophobicContact CG2-CD1 4.46Å; I121-V158 HydrophobicContact CD1-CB 3.87Å; I121-V158 HydrophobicContact CD1-CG1 4.15Å; I121-V158 HydrophobicContact CD1-CG2 4.23Å; I121-V158 HydrophobicContact CG2-CG1 4.13Å; I121-V159 HydrophobicContact CG2-CG2 3.57Å
122	S	94.4	Very high	92.1	Very high	81 Å²	81	44 Å²	44	57%	0.566	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.7	179.7	70	0	0	0	0	113.4	Q118 E119	Q118-S122 WeakPolarHBondContact O-CB 3.45Å; Q118-S122 PolarHBondContact O-N 2.67Å; Q118-S122 PolarHBondContact O-OG 3.4Å; E119-S122 PolarHBondContact O-OG 3.18Å; E119-S122 VanDerWaalsContact O-OG 3.09Å
123	R	94.8	Very high	92.3	Very high	67 Å²	67	42.5 Å²	42.5	25%	0.253	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	30.3	-179.2	-64.4	-174.4	180	134.5	-21.2	113.7	D82 L89 E119 V120 I121 G125	D82-R123 PolarHBondContact O-NH1 3.27Å; D82-R123 PolarHBondContact O-NH2 2.86Å; D82-R123 IonicContact OD2-NH2 2.6Å; L89-R123 HydrophobicContact CD1-CB 3.6Å; E119-R123 WeakPolarHBondContact O-CG 3.39Å; E119-R123 IonicContact OE2-CZ 2.61Å; E119-R123 IonicContact OE2-NH1 3.34Å; V120-R123 PolarHBondContact O-N 3.43Å; I121-R123 PolarHBondContact O-N 3.45Å; I121-R123 VanDerWaalsContact O-N 3.16Å; R123-G125 PolarHBondContact O-N 2.98Å; R123-G125 VanDerWaalsContact O-N 3.17Å
124	D	92.7	Very high	92.4	Very high	106 Å²	106	44.7 Å²	44.7	57%	0.567	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	29	179.3	-57.2	-50.3	0	0	0	113.2	I121 L126 Q127 R128	I121-D124 PolarHBondContact O-N 3.04Å; D124-L126 VanDerWaalsContact C-N 3.27Å; D124-L126 PolarHBondContact O-N 3.37Å; D124-Q127 HydrophobicContact CB-CB 4.18Å; D124-Q127 HydrophobicContact CB-CG 4.36Å; D124-Q127 WeakPolarHBondContact O-CB 3.31Å; D124-Q127 PolarHBondContact O-N 3.13Å; D124-Q127 VanDerWaalsContact O-N 3.12Å; D124-R128 WeakPolarHBondContact O-CG 3.22Å; D124-R128 PolarHBondContact O-N 2.8Å; D124-R128 VanDerWaalsContact O-N 3.09Å
125	G	92.9	Very high	92.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-37.7	179.4	0	0	0	0	0	112.8	V120 R123 R128 L129	V120-G125 VanDerWaalsContact O-CA 3.26Å; V120-G125 WeakPolarHBondContact O-CA 3.2Å; V120-G125 PolarHBondContact O-N 3.26Å; R123-G125 PolarHBondContact O-N 2.98Å; R123-G125 VanDerWaalsContact O-N 3.17Å; G125-R128 PolarHBondContact O-N 3.06Å; G125-L129 WeakPolarHBondContact O-CG 3.35Å; G125-L129 PolarHBondContact O-N 2.92Å
126	L	93.3	Very high	91	Very high	23 Å²	23	45.6 Å²	45.6	12%	0.12	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-41.9	174	-70.6	174.4	0	0	0	112	I121 D124 R128 L129 S130 F150 L153 M154 V159	I121-L126 HydrophobicContact CG1-CD1 4.08Å; I121-L126 HydrophobicContact CG1-CG 4.18Å; I121-L126 HydrophobicContact CG2-CD1 4.46Å; D124-L126 VanDerWaalsContact C-N 3.27Å; D124-L126 PolarHBondContact O-N 3.37Å; L126-R128 PolarHBondContact O-N 2.87Å; L126-L129 PolarHBondContact O-N 3.25Å; L126-S130 WeakPolarHBondContact O-CB 3.47Å; L126-S130 PolarHBondContact O-N 2.88Å; L126-S130 PolarHBondContact O-OG 2.95Å; L126-S130 VanDerWaalsContact O-OG 3.07Å; L126-F150 HydrophobicContact CB-CE2 4.28Å; L126-F150 HydrophobicContact CD2-CD2 3.9Å; L126-F150 HydrophobicContact CD2-CE2 3.79Å; L126-F150 HydrophobicContact CD2-CZ 4.31Å; L126-L153 HydrophobicContact CD2-CB 3.84Å; L126-L153 HydrophobicContact CD2-CD1 3.99Å; L126-M154 HydrophobicContact CD1-SD 3.8Å; L126-M154 HydrophobicContact CD2-CG 4.22Å; L126-M154 HydrophobicContact CD2-SD 4.15Å; L126-V159 HydrophobicContact CD1-CB 4.08Å; L126-V159 HydrophobicContact CD1-CG1 4.3Å; L126-V159 HydrophobicContact CD1-CG2 3.79Å
127	Q	92.6	Very high	89.3	Confident	133 Å²	133	52.7 Å²	52.7	62%	0.621	27%	0.273	S	S	*	.	H	α-helix	trans	-62.1	-43.7	176.4	-73	-89	-19.5	0	0	111.3	D124 S130 T131	D124-Q127 HydrophobicContact CB-CB 4.18Å; D124-Q127 HydrophobicContact CB-CG 4.36Å; D124-Q127 WeakPolarHBondContact O-CB 3.31Å; D124-Q127 PolarHBondContact O-N 3.13Å; D124-Q127 VanDerWaalsContact O-N 3.12Å; Q127-S130 WeakPolarHBondContact O-CB 3.16Å; Q127-S130 PolarHBondContact O-N 3.34Å; Q127-T131 PolarHBondContact O-N 3.42Å; Q127-T131 PolarHBondContact O-OG1 2.96Å; Q127-T131 VanDerWaalsContact O-OG1 3.05Å
128	R	91.6	Very high	87.7	Confident	69 Å²	69	56.3 Å²	56.3	26%	0.26	29%	0.292	S	S	.	.	H	α-helix	trans	-62.9	-44.4	177.7	-66	165	-176.9	-116.9	-9.7	111.6	L89 Q93 D124 G125 L126 T131 I132	L89-R128 PolarHBondContact O-NH1 3Å; L89-R128 VanDerWaalsContact O-NH1 3.07Å; Q93-R128 VanDerWaalsContact CD-CZ 3.41Å; Q93-R128 VanDerWaalsContact NE2-NH1 3.13Å; D124-R128 WeakPolarHBondContact O-CG 3.22Å; D124-R128 PolarHBondContact O-N 2.8Å; D124-R128 VanDerWaalsContact O-N 3.09Å; G125-R128 PolarHBondContact O-N 3.06Å; L126-R128 PolarHBondContact O-N 2.87Å; R128-T131 PolarHBondContact O-N 2.9Å; R128-I132 WeakPolarHBondContact O-CG1 3.22Å; R128-I132 PolarHBondContact O-N 3.32Å
129	L	92.9	Very high	86.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-41.9	174	-70.9	171.9	0	0	0	111.6	L92 L104 L107 G125 L126 T131 I132 I133 A149 F150 L153	L92-L129 HydrophobicContact CD1-CD2 4.08Å; L92-L129 HydrophobicContact CD1-CG 4.47Å; L104-L129 HydrophobicContact CD2-CD2 3.67Å; L107-L129 HydrophobicContact CD2-CD1 4.12Å; L107-L129 HydrophobicContact CD2-CD2 3.88Å; L107-L129 HydrophobicContact CD2-CG 4.44Å; G125-L129 WeakPolarHBondContact O-CG 3.35Å; G125-L129 PolarHBondContact O-N 2.92Å; L126-L129 PolarHBondContact O-N 3.25Å; L129-T131 VanDerWaalsContact C-N 3.31Å; L129-T131 PolarHBondContact O-N 3.29Å; L129-I132 PolarHBondContact O-N 3.46Å; L129-I132 VanDerWaalsContact O-N 3.16Å; L129-I133 WeakPolarHBondContact O-CB 3.46Å; L129-I133 WeakPolarHBondContact O-CD1 3.37Å; L129-I133 VanDerWaalsContact O-CG1 3.23Å; L129-I133 WeakPolarHBondContact O-CG1 3.47Å; L129-I133 PolarHBondContact O-N 3.47Å; L129-A149 HydrophobicContact CD1-CB 4.27Å; L129-A149 HydrophobicContact CD2-CB 4.46Å; L129-F150 HydrophobicContact CB-CD2 3.91Å; L129-F150 HydrophobicContact CD1-CB 4.46Å; L129-F150 HydrophobicContact CD1-CD2 4.46Å; L129-L153 HydrophobicContact CD1-CD1 3.55Å
130	S	92.4	Very high	85.5	Confident	16 Å²	16	54.2 Å²	54.2	11%	0.112	29%	0.289	C	S	.	.	H	α-helix	trans	-58.1	-43	173.7	-70.1	0	0	0	0	111.5	L126 Q127 I132 I133 E134 F150	L126-S130 WeakPolarHBondContact O-CB 3.47Å; L126-S130 PolarHBondContact O-N 2.88Å; L126-S130 PolarHBondContact O-OG 2.95Å; L126-S130 VanDerWaalsContact O-OG 3.07Å; Q127-S130 WeakPolarHBondContact O-CB 3.16Å; Q127-S130 PolarHBondContact O-N 3.34Å; S130-I132 PolarHBondContact O-N 2.87Å; S130-I133 CarbonylContact O-C 3.57Å; S130-I133 PolarHBondContact O-N 2.94Å; S130-E134 WeakPolarHBondContact O-CB 3.31Å; S130-E134 VanDerWaalsContact O-CG 3.28Å; S130-E134 WeakPolarHBondContact O-CG 3.47Å; S130-E134 PolarHBondContact O-N 3.38Å; S130-F150 WeakPolarHBondContact OG-CE2 3.43Å
131	T	89.8	Confident	84.9	Confident	64 Å²	64	59.4 Å²	59.4	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-62.7	-41.3	175.4	-57.9	0	0	0	0	112	Q127 R128 L129 E134 N135	Q127-T131 PolarHBondContact O-N 3.42Å; Q127-T131 PolarHBondContact O-OG1 2.96Å; Q127-T131 VanDerWaalsContact O-OG1 3.05Å; R128-T131 PolarHBondContact O-N 2.9Å; L129-T131 VanDerWaalsContact C-N 3.31Å; L129-T131 PolarHBondContact O-N 3.29Å; T131-E134 PolarHBondContact O-N 2.95Å; T131-N135 WeakPolarHBondContact CG2-ND2 3.39Å; T131-N135 WeakPolarHBondContact O-CB 3.26Å; T131-N135 PolarHBondContact O-N 3.38Å; T131-N135 PolarHBondContact O-ND2 3.07Å
132	I	88.6	Confident	84.6	Confident	34 Å²	34	59.8 Å²	59.8	17%	0.174	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-43.6	175.7	-67.6	165.1	0	0	0	110.8	L92 R128 L129 S130 G136	L92-I132 HydrophobicContact CB-CD1 4.13Å; L92-I132 HydrophobicContact CD1-CD1 4.46Å; L92-I132 HydrophobicContact CD2-CD1 4Å; L92-I132 HydrophobicContact CG-CD1 4.42Å; R128-I132 WeakPolarHBondContact O-CG1 3.22Å; R128-I132 PolarHBondContact O-N 3.32Å; L129-I132 PolarHBondContact O-N 3.46Å; L129-I132 VanDerWaalsContact O-N 3.16Å; S130-I132 PolarHBondContact O-N 2.87Å; I132-G136 PolarHBondContact O-N 3.12Å
133	I	90.8	Very high	84.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.4	-37.5	177.9	-65.3	162.4	0	0	0	110.5	L129 S130 L143 L147 F150 F168 V172 Y175	L129-I133 WeakPolarHBondContact O-CB 3.46Å; L129-I133 WeakPolarHBondContact O-CD1 3.37Å; L129-I133 VanDerWaalsContact O-CG1 3.23Å; L129-I133 WeakPolarHBondContact O-CG1 3.47Å; L129-I133 PolarHBondContact O-N 3.47Å; S130-I133 CarbonylContact O-C 3.57Å; S130-I133 PolarHBondContact O-N 2.94Å; I133-L143 HydrophobicContact CB-CD1 4.46Å; I133-L143 HydrophobicContact CG1-CD1 4.3Å; I133-L143 HydrophobicContact CG2-CD1 4.33Å; I133-L147 HydrophobicContact CD1-CD2 4.06Å; I133-L147 HydrophobicContact CG1-CD2 4.33Å; I133-L147 HydrophobicContact CG2-CD2 4.12Å; I133-F150 HydrophobicContact CD1-CB 3.94Å; I133-F150 HydrophobicContact CD1-CD2 4.09Å; I133-F150 HydrophobicContact CD1-CG 4.06Å; I133-F168 HydrophobicContact CB-CE2 3.89Å; I133-F168 HydrophobicContact CD1-CE2 3.8Å; I133-F168 HydrophobicContact CD1-CZ 4.1Å; I133-F168 HydrophobicContact CG1-CE2 4.46Å; I133-F168 HydrophobicContact CG2-CD2 4.36Å; I133-F168 HydrophobicContact CG2-CE2 3.7Å; I133-F168 HydrophobicContact CG2-CZ 4.39Å; I133-V172 HydrophobicContact CG2-CG2 4.25Å; I133-Y175 HydrophobicContact CG2-CE2 3.9Å; I133-Y175 PolarHBondContact O-OH 3.39Å
134	E	89.9	Confident	84.1	Confident	58 Å²	58	53.1 Å²	53.1	27%	0.271	28%	0.279	S	S	.	.	H	α-helix	trans	-70	-40	177.6	-76.4	176.3	171.4	0	0	112.5	S130 T131 G136 F168 K171	S130-E134 WeakPolarHBondContact O-CB 3.31Å; S130-E134 VanDerWaalsContact O-CG 3.28Å; S130-E134 WeakPolarHBondContact O-CG 3.47Å; S130-E134 PolarHBondContact O-N 3.38Å; T131-E134 PolarHBondContact O-N 2.95Å; E134-G136 VanDerWaalsContact C-N 3.3Å; E134-G136 PolarHBondContact O-N 3.34Å; E134-F168 HydrophobicContact CG-CD2 4.28Å; E134-F168 VanDerWaalsContact OE1-CA 3.22Å; E134-F168 WeakPolarHBondContact OE1-CA 3.34Å; E134-F168 WeakPolarHBondContact OE1-CB 3.33Å; E134-F168 PolarHBondContact OE1-N 3.44Å; E134-F168 VanDerWaalsContact OE1-N 3.15Å; E134-K171 HydrophobicContact CG-CB 4.46Å; E134-K171 WeakPolarHBondContact O-CD 3.48Å; E134-K171 WeakPolarHBondContact O-CE 3.49Å; E134-K171 PolarHBondContact O-NZ 3.47Å
135	N	83.4	Confident	84	Confident	107 Å²	107	48.9 Å²	48.9	57%	0.572	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	5.2	-178.3	-65.3	-23	0	0	0	113.9	T131 D137	T131-N135 WeakPolarHBondContact CG2-ND2 3.39Å; T131-N135 WeakPolarHBondContact O-CB 3.26Å; T131-N135 PolarHBondContact O-N 3.38Å; T131-N135 PolarHBondContact O-ND2 3.07Å; N135-D137 VanDerWaalsContact C-N 3.3Å; N135-D137 PolarHBondContact O-N 3.09Å
136	G	66.2	Low	84	Confident	13 Å²	13	48.9 Å²	48.9	13%	0.134	26%	0.256	C	S	.	.			trans	-63.9	84.8	-174.8	0	0	0	0	0	113	I132 E134	I132-G136 PolarHBondContact O-N 3.12Å; E134-G136 VanDerWaalsContact C-N 3.3Å; E134-G136 PolarHBondContact O-N 3.34Å
137	D	58.7	Low	84	Confident	150 Å²	150	47.8 Å²	47.8	80%	0.802	25%	0.25	S	S	*	.			trans	-81.6	-22.9	169	-70.4	-25.9	0	0	0	111.1	N135	N135-D137 VanDerWaalsContact C-N 3.3Å; N135-D137 PolarHBondContact O-N 3.09Å
138	D	59.8	Low	84	Confident	75 Å²	75	44.5 Å²	44.5	40%	0.401	24%	0.236	S	C	.	.	S	Bend	trans	-96.2	88.2	176.2	-80.2	-56.3	0	0	0	111	R97 G140	R97-D138 IonicContact CZ-OD1 3.65Å; R97-D138 VanDerWaalsContact CZ-OD1 3.31Å; R97-D138 IonicContact CZ-OD2 3.95Å; R97-D138 IonicContact NE-OD2 2.9Å; R97-D138 IonicContact NH1-OD1 2.94Å; R97-D138 PolarHBondContact NH1-OD1 3.14Å; R97-D138 IonicContact NH1-OD2 3.68Å; R97-D138 PolarHBondContact NH1-OD2 3.46Å; R97-D138 VanDerWaalsContact NH2-CG 3.29Å; R97-D138 IonicContact NH2-OD1 3.29Å; R97-D138 PolarHBondContact NH2-OD1 3.32Å; R97-D138 IonicContact NH2-OD2 3.44Å; D138-G140 PolarHBondContact O-N 3.07Å
139	L	62.8	Low	84.1	Confident	99 Å²	99	41.2 Å²	41.2	52%	0.518	22%	0.223	S	C	.	.			trans	-62.6	123.9	170.6	-62.8	168.1	0	0	0	109.6	L143 Y175 M178	L139-L143 HydrophobicContact CD2-CD2 4.22Å; L139-Y175 HydrophobicContact CD2-CD1 4.18Å; L139-Y175 HydrophobicContact CD2-CE1 4.02Å; L139-M178 HydrophobicContact CD1-CE 4.3Å; L139-M178 HydrophobicContact CD1-SD 3.72Å; L139-M178 HydrophobicContact CD2-CE 3.84Å; L139-M178 HydrophobicContact CD2-SD 3.3Å; L139-M178 WeakPolarHBondContact CD2-SD 3.16Å; L139-M178 HydrophobicContact CG-SD 4.15Å
140	G	77.5	Confident	84.2	Confident	17 Å²	17	41.2 Å²	41.2	18%	0.175	22%	0.223	C	C	.	.	S	Bend	trans	158.4	-162.8	-178.1	0	0	0	0	0	114.9	D138 M142 L143 A144 D182	D138-G140 PolarHBondContact O-N 3.07Å; G140-M142 VanDerWaalsContact C-N 3.26Å; G140-M142 PolarHBondContact O-N 3.35Å; G140-L143 PolarHBondContact O-N 3.2Å; G140-L143 VanDerWaalsContact O-N 3.13Å; G140-A144 PolarHBondContact O-N 2.89Å; G140-D182 WeakPolarHBondContact CA-OD2 3.46Å; G140-D182 PolarHBondContact N-OD2 3.34Å
141	E	84.4	Confident	84.2	Confident	110 Å²	110	40.5 Å²	40.5	51%	0.514	22%	0.218	S	C	.	.	H	α-helix	trans	-55.3	-35	-177.6	-168.3	-174.9	173.8	0	0	113.7	Y101 L143 A144 L145	Y101-E141 HydrophobicContact CE2-CB 4.48Å; Y101-E141 HydrophobicContact CE2-CG 4.1Å; Y101-E141 VanDerWaalsContact OH-CD 3.23Å; Y101-E141 PolarHBondContact OH-OE1 3.42Å; Y101-E141 PolarHBondContact OH-OE2 2.87Å; E141-L143 PolarHBondContact O-N 3.5Å; E141-A144 WeakPolarHBondContact O-CB 3.44Å; E141-A144 PolarHBondContact O-N 3.35Å; E141-L145 HydrophobicContact CG-CD1 4.35Å; E141-L145 WeakPolarHBondContact O-CG 3.1Å; E141-L145 PolarHBondContact O-N 3.35Å
142	M	86.6	Confident	84.2	Confident	34 Å²	34	39 Å²	39	17%	0.167	21%	0.207	C	C	.	.	H	α-helix	trans	-63.3	-42.6	179.2	-171.3	177.9	176.8	0	0	112.2	R97 C100 L104 G140 L145 G146	R97-M142 HydrophobicContact CG-SD 4.35Å; C100-M142 HydrophobicContact CB-CE 3.53Å; C100-M142 WeakPolarHBondContact SG-CE 3.22Å; L104-M142 HydrophobicContact CD1-CE 4.06Å; L104-M142 HydrophobicContact CD1-CG 3.64Å; G140-M142 VanDerWaalsContact C-N 3.26Å; G140-M142 PolarHBondContact O-N 3.35Å; M142-L145 PolarHBondContact O-N 2.94Å; M142-G146 PolarHBondContact O-N 3.28Å
143	L	89	Confident	84.3	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-39.4	175.2	177.7	60.7	0	0	0	110.9	I133 L139 G140 E141 G146 L147 Y175 V185	I133-L143 HydrophobicContact CB-CD1 4.46Å; I133-L143 HydrophobicContact CG1-CD1 4.3Å; I133-L143 HydrophobicContact CG2-CD1 4.33Å; L139-L143 HydrophobicContact CD2-CD2 4.22Å; G140-L143 PolarHBondContact O-N 3.2Å; G140-L143 VanDerWaalsContact O-N 3.13Å; E141-L143 PolarHBondContact O-N 3.5Å; L143-G146 PolarHBondContact O-N 3.29Å; L143-L147 HydrophobicContact CD1-CD1 4.33Å; L143-L147 HydrophobicContact CD1-CG 4.28Å; L143-L147 HydrophobicContact CG-CD1 4.13Å; L143-L147 WeakPolarHBondContact O-CG 3.42Å; L143-L147 PolarHBondContact O-N 3.26Å; L143-Y175 HydrophobicContact CD1-CE2 3.89Å; L143-Y175 HydrophobicContact CD2-CD1 3.91Å; L143-Y175 HydrophobicContact CD2-CD2 4.22Å; L143-Y175 HydrophobicContact CD2-CE1 3.56Å; L143-Y175 HydrophobicContact CD2-CE2 3.9Å; L143-Y175 HydrophobicContact CD2-CG 4.24Å; L143-Y175 HydrophobicContact CG-CE2 4.48Å; L143-V185 HydrophobicContact CB-CG2 4.36Å; L143-V185 HydrophobicContact CD2-CG1 3.67Å; L143-V185 HydrophobicContact CD2-CG2 4.19Å; L143-V185 HydrophobicContact CG-CG1 4.13Å; L143-V185 HydrophobicContact CG-CG2 4.31Å
144	A	90.2	Very high	84.3	Confident	3 Å²	3	37.5 Å²	37.5	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-60.3	-45.4	175.3	0	0	0	0	0	111.6	G140 E141 G146 L147 M148 V185 L188	G140-A144 PolarHBondContact O-N 2.89Å; E141-A144 WeakPolarHBondContact O-CB 3.44Å; E141-A144 PolarHBondContact O-N 3.35Å; A144-G146 PolarHBondContact O-N 3.42Å; A144-L147 PolarHBondContact O-N 2.88Å; A144-M148 HydrophobicContact CB-CE 4.13Å; A144-M148 WeakPolarHBondContact O-CB 3.48Å; A144-M148 WeakPolarHBondContact O-CE 3.47Å; A144-M148 WeakPolarHBondContact O-CG 3.32Å; A144-M148 PolarHBondContact O-N 3.47Å; A144-V185 HydrophobicContact CB-CG2 4.26Å; A144-L188 HydrophobicContact CB-CD1 3.86Å; A144-L188 WeakPolarHBondContact O-CD1 3.5Å
145	L	91.6	Very high	84	Confident	16 Å²	16	35.5 Å²	35.5	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-41.5	174.2	-67.8	168.4	0	0	0	112.3	Y101 L104 K105 V108 E141 M142 M148 A149	Y101-L145 HydrophobicContact CD2-CD1 4.03Å; Y101-L145 HydrophobicContact CE2-CD1 3.72Å; L104-L145 HydrophobicContact CB-CB 3.91Å; L104-L145 HydrophobicContact CB-CD1 4.33Å; K105-L145 HydrophobicContact CB-CD1 4.28Å; V108-L145 HydrophobicContact CG2-CB 4.38Å; V108-L145 HydrophobicContact CG2-CD2 3.9Å; E141-L145 HydrophobicContact CG-CD1 4.35Å; E141-L145 WeakPolarHBondContact O-CG 3.1Å; E141-L145 PolarHBondContact O-N 3.35Å; M142-L145 PolarHBondContact O-N 2.94Å; L145-M148 HydrophobicContact CD2-CE 3.95Å; L145-M148 HydrophobicContact CG-CE 4.4Å; L145-M148 PolarHBondContact O-N 3.38Å; L145-A149 WeakPolarHBondContact O-CB 3.27Å; L145-A149 PolarHBondContact O-N 2.9Å
146	G	92.5	Very high	84	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.8	-48	174.6	0	0	0	0	0	112.8	M142 L143 A144 F150	M142-G146 PolarHBondContact O-N 3.28Å; L143-G146 PolarHBondContact O-N 3.29Å; A144-G146 PolarHBondContact O-N 3.42Å; G146-F150 VanDerWaalsContact O-CB 3.3Å; G146-F150 WeakPolarHBondContact O-CB 3.3Å; G146-F150 PolarHBondContact O-N 2.83Å
147	L	92.7	Very high	84.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.8	-42.7	177.1	-72.6	168.6	0	0	0	112.1	I133 L143 A144 F150 L151 V185 L188 L192	I133-L147 HydrophobicContact CD1-CD2 4.06Å; I133-L147 HydrophobicContact CG1-CD2 4.33Å; I133-L147 HydrophobicContact CG2-CD2 4.12Å; L143-L147 HydrophobicContact CD1-CD1 4.33Å; L143-L147 HydrophobicContact CD1-CG 4.28Å; L143-L147 HydrophobicContact CG-CD1 4.13Å; L143-L147 WeakPolarHBondContact O-CG 3.42Å; L143-L147 PolarHBondContact O-N 3.26Å; A144-L147 PolarHBondContact O-N 2.88Å; L147-F150 PolarHBondContact O-N 2.95Å; L147-L151 WeakPolarHBondContact O-CB 3.48Å; L147-L151 VanDerWaalsContact O-CG 3.28Å; L147-L151 WeakPolarHBondContact O-CG 3.4Å; L147-L151 PolarHBondContact O-N 2.71Å; L147-V185 HydrophobicContact CD1-CG1 3.89Å; L147-L188 HydrophobicContact CB-CB 4.03Å; L147-L188 HydrophobicContact CB-CD1 4.24Å; L147-L188 HydrophobicContact CD1-CB 4.15Å; L147-L192 HydrophobicContact CD2-CD1 4.02Å
148	M	92.2	Very high	86.1	Confident	65 Å²	65	27.9 Å²	27.9	32%	0.32	15%	0.152	S	C	.	.	H	α-helix	trans	-59.8	-50.5	175.9	-79.1	-175.3	-83.7	0	0	111.5	V108 A144 L145 F150 L151 E152 L188	V108-M148 HydrophobicContact CG1-CB 4.3Å; V108-M148 HydrophobicContact CG2-CB 4.09Å; A144-M148 HydrophobicContact CB-CE 4.13Å; A144-M148 WeakPolarHBondContact O-CB 3.48Å; A144-M148 WeakPolarHBondContact O-CE 3.47Å; A144-M148 WeakPolarHBondContact O-CG 3.32Å; A144-M148 PolarHBondContact O-N 3.47Å; L145-M148 HydrophobicContact CD2-CE 3.95Å; L145-M148 HydrophobicContact CG-CE 4.4Å; L145-M148 PolarHBondContact O-N 3.38Å; M148-F150 VanDerWaalsContact C-N 3.32Å; M148-F150 PolarHBondContact O-N 2.8Å; M148-L151 PolarHBondContact O-N 3.26Å; M148-E152 PolarHBondContact O-N 2.75Å; M148-L188 HydrophobicContact CE-CD1 4.32Å; M148-L188 HydrophobicContact CG-CD1 3.63Å; M148-L188 HydrophobicContact CG-CD2 3.56Å; M148-L188 HydrophobicContact CG-CG 4.25Å; M148-L188 HydrophobicContact SD-CD1 4.41Å
149	A	93.6	Very high	87.4	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.1	-42.9	178.1	0	0	0	0	0	111.6	L107 V108 L129 L145 L151 E152 L153	L107-A149 HydrophobicContact CD2-CB 3.59Å; L107-A149 HydrophobicContact CG-CB 3.87Å; V108-A149 HydrophobicContact CG2-CB 4.08Å; L129-A149 HydrophobicContact CD1-CB 4.27Å; L129-A149 HydrophobicContact CD2-CB 4.46Å; L145-A149 WeakPolarHBondContact O-CB 3.27Å; L145-A149 PolarHBondContact O-N 2.9Å; A149-L151 PolarHBondContact O-N 3.02Å; A149-E152 PolarHBondContact O-N 2.8Å; A149-L153 WeakPolarHBondContact O-CB 3.43Å; A149-L153 WeakPolarHBondContact O-CG 3.43Å; A149-L153 PolarHBondContact O-N 2.86Å; A149-L153 VanDerWaalsContact O-N 3.07Å
150	F	95.1	Very high	88.6	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.2	-44.8	177.5	-168.8	-85.9	0	0	0	112.1	L126 L129 S130 I133 G146 L147 M148 M154 L164 F168 L192	L126-F150 HydrophobicContact CB-CE2 4.28Å; L126-F150 HydrophobicContact CD2-CD2 3.9Å; L126-F150 HydrophobicContact CD2-CE2 3.79Å; L126-F150 HydrophobicContact CD2-CZ 4.31Å; L129-F150 HydrophobicContact CB-CD2 3.91Å; L129-F150 HydrophobicContact CD1-CB 4.46Å; L129-F150 HydrophobicContact CD1-CD2 4.46Å; S130-F150 WeakPolarHBondContact OG-CE2 3.43Å; I133-F150 HydrophobicContact CD1-CB 3.94Å; I133-F150 HydrophobicContact CD1-CD2 4.09Å; I133-F150 HydrophobicContact CD1-CG 4.06Å; G146-F150 VanDerWaalsContact O-CB 3.3Å; G146-F150 WeakPolarHBondContact O-CB 3.3Å; G146-F150 PolarHBondContact O-N 2.83Å; L147-F150 PolarHBondContact O-N 2.95Å; M148-F150 VanDerWaalsContact C-N 3.32Å; M148-F150 PolarHBondContact O-N 2.8Å; F150-M154 HydrophobicContact CD1-CG 3.91Å; F150-M154 HydrophobicContact CE1-CG 3.57Å; F150-M154 HydrophobicContact CE1-SD 4.37Å; F150-M154 HydrophobicContact CZ-CG 4.12Å; F150-M154 HydrophobicContact CZ-SD 4.4Å; F150-M154 WeakPolarHBondContact O-CB 3.36Å; F150-M154 VanDerWaalsContact O-CG 3.31Å; F150-M154 WeakPolarHBondContact O-CG 3.28Å; F150-M154 PolarHBondContact O-N 2.8Å; F150-L164 HydrophobicContact CE1-CD2 4.07Å; F150-L164 HydrophobicContact CZ-CD2 3.54Å; F150-F168 HydrophobicContact CD1-CZ 4.05Å; F150-F168 HydrophobicContact CD2-CZ 4.33Å; F150-F168 AromaticContact CE1-CE1 3.82Å; F150-F168 HydrophobicContact CE1-CE1 3.82Å; F150-F168 AromaticContact CE1-CZ 3.66Å; F150-F168 HydrophobicContact CE1-CZ 3.66Å; F150-F168 HydrophobicContact CE2-CE2 4.33Å; F150-F168 AromaticContact CE2-CZ 3.97Å; F150-F168 HydrophobicContact CE2-CZ 3.97Å; F150-F168 HydrophobicContact CG-CZ 4.37Å; F150-F168 AromaticContact CZ-CE1 3.84Å; F150-F168 HydrophobicContact CZ-CE1 3.84Å; F150-F168 HydrophobicContact CZ-CE2 4.35Å; F150-F168 AromaticContact CZ-CZ 3.62Å; F150-F168 HydrophobicContact CZ-CZ 3.62Å; F150-L192 HydrophobicContact CD1-CD1 3.8Å; F150-L192 HydrophobicContact CE1-CD1 4.21Å
151	L	91.9	Very high	89.1	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-60.7	-52.7	177.1	-79.8	166.4	0	0	0	111.8	L147 M148 A149 L153 M154 E155 W161 L188 R191 L192	L147-L151 WeakPolarHBondContact O-CB 3.48Å; L147-L151 VanDerWaalsContact O-CG 3.28Å; L147-L151 WeakPolarHBondContact O-CG 3.4Å; L147-L151 PolarHBondContact O-N 2.71Å; M148-L151 PolarHBondContact O-N 3.26Å; A149-L151 PolarHBondContact O-N 3.02Å; L151-L153 VanDerWaalsContact C-N 3.31Å; L151-L153 PolarHBondContact O-N 2.8Å; L151-M154 PolarHBondContact O-N 3.47Å; L151-M154 VanDerWaalsContact O-N 3.17Å; L151-E155 WeakPolarHBondContact O-CB 3.42Å; L151-E155 VanDerWaalsContact O-CG 3.32Å; L151-E155 WeakPolarHBondContact O-CG 3.38Å; L151-E155 PolarHBondContact O-N 2.93Å; L151-W161 HydrophobicContact CD2-CH2 4.3Å; L151-L188 HydrophobicContact CD1-CB 4.39Å; L151-L188 HydrophobicContact CD1-CD2 4.1Å; L151-R191 HydrophobicContact CD1-CG 4.03Å; L151-R191 HydrophobicContact CD2-CG 4.07Å; L151-L192 HydrophobicContact CD2-CB 3.8Å; L151-L192 HydrophobicContact CD2-CD1 4.4Å; L151-L192 HydrophobicContact CD2-CG 4.05Å; L151-L192 HydrophobicContact CG-CB 4.39Å; L151-L192 HydrophobicContact CG-CD1 4.46Å
152	E	90.2	Very high	89.3	Confident	32 Å²	32	24.8 Å²	24.8	15%	0.15	13%	0.134	C	C	.	.	H	α-helix	trans	-58.2	-43.3	-180	-70.2	-69.3	147.9	0	0	111.2	A111 M148 A149 M154 E155 H156 K560	A111-E152 HydrophobicContact CB-CB 3.93Å; M148-E152 PolarHBondContact O-N 2.75Å; A149-E152 PolarHBondContact O-N 2.8Å; E152-M154 PolarHBondContact O-N 2.89Å; E152-E155 PolarHBondContact O-N 3.05Å; E152-H156 PolarHBondContact O-CD2 3.28Å; E152-K560 IonicContact OE1-NZ 3.7Å; E152-K560 IonicContact OE2-NZ 4Å; E152-K560 PolarHBondContact OE2-NZ 3.17Å
153	L	92.3	Very high	89.5	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-44.1	176.6	-69.1	173.3	0	0	0	112.7	A111 A117 V120 L126 L129 A149 L151 E155 H156	A111-L153 HydrophobicContact CB-CD2 4.12Å; A111-L153 HydrophobicContact CB-CG 4.18Å; A117-L153 HydrophobicContact CB-CD2 3.55Å; V120-L153 HydrophobicContact CB-CD2 4.29Å; V120-L153 HydrophobicContact CG1-CD1 3.79Å; V120-L153 HydrophobicContact CG1-CD2 4.23Å; L126-L153 HydrophobicContact CD2-CB 3.84Å; L126-L153 HydrophobicContact CD2-CD1 3.99Å; L129-L153 HydrophobicContact CD1-CD1 3.55Å; A149-L153 WeakPolarHBondContact O-CB 3.43Å; A149-L153 WeakPolarHBondContact O-CG 3.43Å; A149-L153 PolarHBondContact O-N 2.86Å; A149-L153 VanDerWaalsContact O-N 3.07Å; L151-L153 VanDerWaalsContact C-N 3.31Å; L151-L153 PolarHBondContact O-N 2.8Å; L153-E155 VanDerWaalsContact C-N 3.34Å; L153-H156 PolarHBondContact O-N 2.81Å
154	M	89.8	Confident	89.6	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-69.5	-31.3	179.1	-71.5	-65.2	-68.6	0	0	112.4	L126 F150 L151 E152 H156 G157 V159 W161 L164	L126-M154 HydrophobicContact CD1-SD 3.8Å; L126-M154 HydrophobicContact CD2-CG 4.22Å; L126-M154 HydrophobicContact CD2-SD 4.15Å; F150-M154 HydrophobicContact CD1-CG 3.91Å; F150-M154 HydrophobicContact CE1-CG 3.57Å; F150-M154 HydrophobicContact CE1-SD 4.37Å; F150-M154 HydrophobicContact CZ-CG 4.12Å; F150-M154 HydrophobicContact CZ-SD 4.4Å; F150-M154 WeakPolarHBondContact O-CB 3.36Å; F150-M154 VanDerWaalsContact O-CG 3.31Å; F150-M154 WeakPolarHBondContact O-CG 3.28Å; F150-M154 PolarHBondContact O-N 2.8Å; L151-M154 PolarHBondContact O-N 3.47Å; L151-M154 VanDerWaalsContact O-N 3.17Å; E152-M154 PolarHBondContact O-N 2.89Å; M154-H156 PolarHBondContact O-N 3.02Å; M154-G157 PolarHBondContact O-N 3.48Å; M154-V159 HydrophobicContact SD-CB 4.25Å; M154-V159 HydrophobicContact SD-CG1 4.42Å; M154-W161 HydrophobicContact CB-CH2 3.48Å; M154-W161 VanDerWaalsContact CB-CH2 3.48Å; M154-W161 HydrophobicContact CB-CZ2 3.68Å; M154-W161 HydrophobicContact CB-CZ3 3.96Å; M154-W161 HydrophobicContact CE-CD2 3.74Å; M154-W161 HydrophobicContact CE-CE3 3.62Å; M154-W161 HydrophobicContact CE-CG 4.19Å; M154-W161 HydrophobicContact CE-CZ3 4.05Å; M154-W161 HydrophobicContact CG-CH2 4.13Å; M154-W161 HydrophobicContact CG-CZ3 4.12Å; M154-L164 HydrophobicContact CE-CD2 4.2Å; M154-L164 HydrophobicContact CE-CG 4.39Å
155	E	83.3	Confident	89.8	Confident	16 Å²	16	30.9 Å²	30.9	8%	0.075	18%	0.175	C	C	.	.	H	α-helix	trans	-67.3	-15.8	178.9	-80.3	-175	179.3	0	0	114.5	L151 E152 L153 G157 R191 R557	L151-E155 WeakPolarHBondContact O-CB 3.42Å; L151-E155 VanDerWaalsContact O-CG 3.32Å; L151-E155 WeakPolarHBondContact O-CG 3.38Å; L151-E155 PolarHBondContact O-N 2.93Å; E152-E155 PolarHBondContact O-N 3.05Å; L153-E155 VanDerWaalsContact C-N 3.34Å; E155-G157 PolarHBondContact O-N 3.3Å; E155-R191 VanDerWaalsContact CD-NH2 3.31Å; E155-R191 IonicContact OE1-CZ 2.91Å; E155-R191 IonicContact OE1-NE 2.83Å; E155-R191 PolarHBondContact OE1-NE 3.43Å; E155-R191 IonicContact OE1-NH2 2.81Å; E155-R191 PolarHBondContact OE1-NH2 3.06Å; E155-R191 IonicContact OE2-NH2 3.91Å; E155-R191 PolarHBondContact OE2-NH2 3.24Å; E155-R557 HydrophobicContact CB-CG 4.45Å; E155-R557 PolarHBondContact O-NE 3.13Å
156	H	83.8	Confident	89.8	Confident	21 Å²	21	34.9 Å²	34.9	10%	0.097	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.9	168.8	-73.4	-76.6	0	0	0	112.9	A111 S112 M114 E152 L153 M154 V158 R557	A111-H156 PolarHBondContact O-NE2 3.31Å; S112-H156 PolarHBondContact O-CE1 3.5Å; S112-H156 VanDerWaalsContact O-CE1 3.27Å; S112-H156 PolarHBondContact O-NE2 3.39Å; M114-H156 HydrophobicContact CE-CB 3.78Å; M114-H156 VanDerWaalsContact CE-ND1 3.31Å; M114-H156 WeakPolarHBondContact CE-ND1 3.4Å; M114-H156 HydrophobicContact SD-CB 3.7Å; M114-H156 PolarHBondContact SD-ND1 2.78Å; M114-H156 VanDerWaalsContact SD-ND1 3.4Å; E152-H156 PolarHBondContact O-CD2 3.28Å; L153-H156 PolarHBondContact O-N 2.81Å; M154-H156 PolarHBondContact O-N 3.02Å; H156-V158 HydrophobicContact CB-CG2 4.05Å; H156-V158 PolarHBondContact O-N 2.73Å; H156-R557 PolarHBondContact ND1-NH2 3Å; H156-R557 VanDerWaalsContact ND1-NH2 3.18Å
157	G	82.1	Confident	89.9	Confident	20 Å²	20	38.7 Å²	38.7	21%	0.206	22%	0.219	C	C	.	.			trans	70.8	11	176.5	0	0	0	0	0	114.9	M154 E155 V159 R555	M154-G157 PolarHBondContact O-N 3.48Å; E155-G157 PolarHBondContact O-N 3.3Å; G157-V159 PolarHBondContact O-N 2.64Å; G157-R555 PolarHBondContact O-NH1 3.32Å
158	V	85.9	Confident	90	Very high	69 Å²	69	38.7 Å²	38.7	42%	0.418	22%	0.219	S	C	.	.	S	Bend	trans	-60.5	-36.1	173.4	-179.9	0	0	0	0	110.5	M114 Q118 I121 H156	M114-V158 HydrophobicContact SD-CG2 3.96Å; Q118-V158 HydrophobicContact CG-CG2 4.21Å; I121-V158 HydrophobicContact CD1-CB 3.87Å; I121-V158 HydrophobicContact CD1-CG1 4.15Å; I121-V158 HydrophobicContact CD1-CG2 4.23Å; I121-V158 HydrophobicContact CG2-CG1 4.13Å; H156-V158 HydrophobicContact CB-CG2 4.05Å; H156-V158 PolarHBondContact O-N 2.73Å
159	V	87.4	Confident	90.2	Very high	30 Å²	30	35.6 Å²	35.6	18%	0.182	20%	0.204	C	C	.	.	S	Bend	trans	-116.1	141.6	178.3	-177.5	0	0	0	0	109.5	I121 L126 M154 G157 T163	I121-V159 HydrophobicContact CG2-CG2 3.57Å; L126-V159 HydrophobicContact CD1-CB 4.08Å; L126-V159 HydrophobicContact CD1-CG1 4.3Å; L126-V159 HydrophobicContact CD1-CG2 3.79Å; M154-V159 HydrophobicContact SD-CB 4.25Å; M154-V159 HydrophobicContact SD-CG1 4.42Å; G157-V159 PolarHBondContact O-N 2.64Å; V159-T163 HydrophobicContact CG1-CG2 4.15Å; V159-T163 WeakPolarHBondContact CG1-OG1 3.31Å
160	S	88	Confident	90.2	Very high	49 Å²	49	41.5 Å²	41.5	34%	0.343	23%	0.226	S	C	.	.			trans	-77.2	143.1	176.2	179.4	0	0	0	0	110.8	E162 T163	S160-E162 PolarHBondContact O-N 3.33Å; S160-E162 VanDerWaalsContact O-N 3.12Å; S160-E162 PolarHBondContact OG-N 3.35Å; S160-T163 PolarHBondContact O-N 3.04Å; S160-T163 VanDerWaalsContact O-N 3.11Å; S160-T163 PolarHBondContact O-OG1 2.82Å
161	W	89.6	Confident	90.1	Very high	32 Å²	32	44 Å²	44	12%	0.121	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-59.7	-21.6	171.9	-64.6	99.4	0	0	0	112.9	L151 M154 T163 L164 L192 V196 L203	L151-W161 HydrophobicContact CD2-CH2 4.3Å; M154-W161 HydrophobicContact CB-CH2 3.48Å; M154-W161 VanDerWaalsContact CB-CH2 3.48Å; M154-W161 HydrophobicContact CB-CZ2 3.68Å; M154-W161 HydrophobicContact CB-CZ3 3.96Å; M154-W161 HydrophobicContact CE-CD2 3.74Å; M154-W161 HydrophobicContact CE-CE3 3.62Å; M154-W161 HydrophobicContact CE-CG 4.19Å; M154-W161 HydrophobicContact CE-CZ3 4.05Å; M154-W161 HydrophobicContact CG-CH2 4.13Å; M154-W161 HydrophobicContact CG-CZ3 4.12Å; W161-T163 PolarHBondContact O-N 2.87Å; W161-L164 HydrophobicContact CE3-CD1 3.76Å; W161-L164 HydrophobicContact CZ3-CD1 4.28Å; W161-L164 WeakPolarHBondContact O-CG 3.28Å; W161-L164 PolarHBondContact O-N 3.39Å; W161-L192 HydrophobicContact CZ3-CG 4.4Å; W161-V196 HydrophobicContact CE3-CG2 3.61Å; W161-V196 HydrophobicContact CZ3-CG2 3.98Å; W161-L203 WeakPolarHBondContact O-CD1 3.31Å
162	E	87.9	Confident	90.2	Very high	126 Å²	126	43.9 Å²	43.9	59%	0.589	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-68.2	-18.7	176.6	-62.4	-173.3	151.2	0	0	114	S160 L164	S160-E162 PolarHBondContact O-N 3.33Å; S160-E162 VanDerWaalsContact O-N 3.12Å; S160-E162 PolarHBondContact OG-N 3.35Å; E162-L164 PolarHBondContact O-N 3.25Å
163	T	89.8	Confident	90.4	Very high	95 Å²	95	42.5 Å²	42.5	58%	0.583	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-79.6	-6.4	179.3	68.7	0	0	0	0	112.7	V159 S160 W161	V159-T163 HydrophobicContact CG1-CG2 4.15Å; V159-T163 WeakPolarHBondContact CG1-OG1 3.31Å; S160-T163 PolarHBondContact O-N 3.04Å; S160-T163 VanDerWaalsContact O-N 3.11Å; S160-T163 PolarHBondContact O-OG1 2.82Å; W161-T163 PolarHBondContact O-N 2.87Å
164	L	92.4	Very high	90.4	Very high	20 Å²	20	44.4 Å²	44.4	11%	0.105	24%	0.243	C	C	.	.	S	Bend	trans	-68.7	137.9	178.4	-61.4	-175.4	0	0	0	110.9	F150 M154 W161 E162 F168 V169 V196 L203	F150-L164 HydrophobicContact CE1-CD2 4.07Å; F150-L164 HydrophobicContact CZ-CD2 3.54Å; M154-L164 HydrophobicContact CE-CD2 4.2Å; M154-L164 HydrophobicContact CE-CG 4.39Å; W161-L164 HydrophobicContact CE3-CD1 3.76Å; W161-L164 HydrophobicContact CZ3-CD1 4.28Å; W161-L164 WeakPolarHBondContact O-CG 3.28Å; W161-L164 PolarHBondContact O-N 3.39Å; E162-L164 PolarHBondContact O-N 3.25Å; L164-F168 HydrophobicContact CB-CD1 4.43Å; L164-F168 HydrophobicContact CD1-CD1 4.28Å; L164-F168 HydrophobicContact CD1-CE1 4.12Å; L164-F168 HydrophobicContact CD2-CD1 4.36Å; L164-F168 HydrophobicContact CD2-CE1 4.33Å; L164-V169 HydrophobicContact CB-CG2 4.31Å; L164-V196 HydrophobicContact CD1-CG2 3.71Å; L164-L203 HydrophobicContact CB-CD1 3.89Å
165	S	93.3	Very high	90.5	Very high	54 Å²	54	44.3 Å²	44.3	38%	0.378	24%	0.243	S	C	.	.			trans	-72.2	145.4	178	83	0	0	0	0	110.3	F168 V169	S165-F168 WeakPolarHBondContact O-CB 3.26Å; S165-F168 PolarHBondContact O-N 3.44Å; S165-F168 VanDerWaalsContact OG-CB 3.24Å; S165-F168 WeakPolarHBondContact OG-CB 3.08Å; S165-F168 PolarHBondContact OG-N 2.8Å; S165-F168 VanDerWaalsContact OG-N 3.11Å; S165-V169 PolarHBondContact O-N 2.65Å
166	M	92.8	Very high	90.8	Very high	101 Å²	101	43.6 Å²	43.6	50%	0.498	24%	0.239	S	C	.	.	H	α-helix	trans	-57.2	-44.1	171.8	-67.4	-174.2	176	0	0	112.3	F168 V169 R170 L203 L206	M166-F168 VanDerWaalsContact C-N 3.3Å; M166-F168 PolarHBondContact O-N 2.84Å; M166-V169 PolarHBondContact O-N 2.65Å; M166-R170 VanDerWaalsContact O-CG 3.31Å; M166-R170 WeakPolarHBondContact O-CG 3.09Å; M166-R170 PolarHBondContact O-N 3.34Å; M166-L203 HydrophobicContact CG-CD2 4.29Å; M166-L206 HydrophobicContact CB-CD2 4.1Å; M166-L206 HydrophobicContact CG-CD2 4.15Å
167	P	93.9	Very high	91	Very high	80 Å²	80	45.1 Å²	45.1	52%	0.519	25%	0.248	S	C	.	.	H	α-helix	trans	-54.1	-42.8	176	-27.4	35.8	0	0	0	114	R170 K171	P167-R170 PolarHBondContact O-N 3.38Å; P167-K171 PolarHBondContact O-N 3.23Å
168	F	94.8	Very high	91.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-50.6	176.6	174.4	-100	0	0	0	111	I133 E134 F150 L164 S165 M166 R170 K171 V172 L192	I133-F168 HydrophobicContact CB-CE2 3.89Å; I133-F168 HydrophobicContact CD1-CE2 3.8Å; I133-F168 HydrophobicContact CD1-CZ 4.1Å; I133-F168 HydrophobicContact CG1-CE2 4.46Å; I133-F168 HydrophobicContact CG2-CD2 4.36Å; I133-F168 HydrophobicContact CG2-CE2 3.7Å; I133-F168 HydrophobicContact CG2-CZ 4.39Å; E134-F168 HydrophobicContact CG-CD2 4.28Å; E134-F168 VanDerWaalsContact OE1-CA 3.22Å; E134-F168 WeakPolarHBondContact OE1-CA 3.34Å; E134-F168 WeakPolarHBondContact OE1-CB 3.33Å; E134-F168 PolarHBondContact OE1-N 3.44Å; E134-F168 VanDerWaalsContact OE1-N 3.15Å; F150-F168 HydrophobicContact CD1-CZ 4.05Å; F150-F168 HydrophobicContact CD2-CZ 4.33Å; F150-F168 AromaticContact CE1-CE1 3.82Å; F150-F168 HydrophobicContact CE1-CE1 3.82Å; F150-F168 AromaticContact CE1-CZ 3.66Å; F150-F168 HydrophobicContact CE1-CZ 3.66Å; F150-F168 HydrophobicContact CE2-CE2 4.33Å; F150-F168 AromaticContact CE2-CZ 3.97Å; F150-F168 HydrophobicContact CE2-CZ 3.97Å; F150-F168 HydrophobicContact CG-CZ 4.37Å; F150-F168 AromaticContact CZ-CE1 3.84Å; F150-F168 HydrophobicContact CZ-CE1 3.84Å; F150-F168 HydrophobicContact CZ-CE2 4.35Å; F150-F168 AromaticContact CZ-CZ 3.62Å; F150-F168 HydrophobicContact CZ-CZ 3.62Å; L164-F168 HydrophobicContact CB-CD1 4.43Å; L164-F168 HydrophobicContact CD1-CD1 4.28Å; L164-F168 HydrophobicContact CD1-CE1 4.12Å; L164-F168 HydrophobicContact CD2-CD1 4.36Å; L164-F168 HydrophobicContact CD2-CE1 4.33Å; S165-F168 WeakPolarHBondContact O-CB 3.26Å; S165-F168 PolarHBondContact O-N 3.44Å; S165-F168 VanDerWaalsContact OG-CB 3.24Å; S165-F168 WeakPolarHBondContact OG-CB 3.08Å; S165-F168 PolarHBondContact OG-N 2.8Å; S165-F168 VanDerWaalsContact OG-N 3.11Å; M166-F168 VanDerWaalsContact C-N 3.3Å; M166-F168 PolarHBondContact O-N 2.84Å; F168-R170 VanDerWaalsContact C-N 3.34Å; F168-R170 PolarHBondContact O-N 3.13Å; F168-K171 WeakPolarHBondContact O-CB 3.42Å; F168-K171 PolarHBondContact O-N 3.47Å; F168-K171 VanDerWaalsContact O-N 3.1Å; F168-V172 HydrophobicContact CD1-CG2 4.47Å; F168-V172 HydrophobicContact CE1-CG2 4.06Å; F168-V172 HydrophobicContact CE2-CG2 4.38Å; F168-V172 HydrophobicContact CZ-CG2 4.01Å; F168-V172 WeakPolarHBondContact O-CG2 3.32Å; F168-V172 PolarHBondContact O-N 3.17Å; F168-L192 HydrophobicContact CE1-CD1 4.3Å; F168-L192 HydrophobicContact CE1-CD2 4.19Å; F168-L192 HydrophobicContact CZ-CD1 4.13Å
169	V	95.6	Very high	90.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-43.3	179.6	178.1	0	0	0	0	111	L164 S165 M166 K171 V172 V173 L193 V196 L203 L206 V207	L164-V169 HydrophobicContact CB-CG2 4.31Å; S165-V169 PolarHBondContact O-N 2.65Å; M166-V169 PolarHBondContact O-N 2.65Å; V169-K171 VanDerWaalsContact C-N 3.28Å; V169-K171 PolarHBondContact O-N 3.3Å; V169-V172 PolarHBondContact O-N 3.04Å; V169-V172 VanDerWaalsContact O-N 3.12Å; V169-V173 WeakPolarHBondContact O-CG2 3.19Å; V169-V173 PolarHBondContact O-N 3.5Å; V169-L193 HydrophobicContact CG1-CD2 4.12Å; V169-V196 HydrophobicContact CG2-CG1 4.42Å; V169-L203 HydrophobicContact CG2-CD1 4.24Å; V169-L203 HydrophobicContact CG2-CD2 4.19Å; V169-L206 HydrophobicContact CB-CD2 4Å; V169-L206 HydrophobicContact CG1-CD2 3.9Å; V169-V207 HydrophobicContact CG1-CG2 3.87Å
170	R	94.8	Very high	89.7	Confident	123 Å²	123	51.9 Å²	51.9	46%	0.464	28%	0.275	S	S	.	.	H	α-helix	trans	-58.4	-39.9	174.7	-66.7	-164.5	167.9	131.4	2.4	112.3	M166 P167 F168 V173 S174 L206 E210	M166-R170 VanDerWaalsContact O-CG 3.31Å; M166-R170 WeakPolarHBondContact O-CG 3.09Å; M166-R170 PolarHBondContact O-N 3.34Å; P167-R170 PolarHBondContact O-N 3.38Å; F168-R170 VanDerWaalsContact C-N 3.34Å; F168-R170 PolarHBondContact O-N 3.13Å; R170-V173 WeakPolarHBondContact O-CB 2.77Å; R170-V173 PolarHBondContact O-N 3.49Å; R170-S174 PolarHBondContact O-N 3.35Å; R170-L206 HydrophobicContact CG-CD2 4.29Å; R170-E210 WeakPolarHBondContact CD-OE1 3.42Å; R170-E210 WeakPolarHBondContact CG-OE1 3.4Å; R170-E210 VanDerWaalsContact CG-OE2 3.25Å; R170-E210 WeakPolarHBondContact CG-OE2 3.22Å; R170-E210 IonicContact CZ-OE1 2.57Å; R170-E210 IonicContact NE-OE1 2.64Å; R170-E210 PolarHBondContact NE-OE1 3.32Å; R170-E210 IonicContact NE-OE2 2.6Å; R170-E210 IonicContact NH2-OE1 3.32Å
171	K	93.4	Very high	88.4	Confident	52 Å²	52	57.7 Å²	57.7	23%	0.226	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-44.9	174.9	-171.2	83.6	-177	-158.5	0	111.2	E134 P167 F168 V169 V173 S174 Y175	E134-K171 HydrophobicContact CG-CB 4.46Å; E134-K171 WeakPolarHBondContact O-CD 3.48Å; E134-K171 WeakPolarHBondContact O-CE 3.49Å; E134-K171 PolarHBondContact O-NZ 3.47Å; P167-K171 PolarHBondContact O-N 3.23Å; F168-K171 WeakPolarHBondContact O-CB 3.42Å; F168-K171 PolarHBondContact O-N 3.47Å; F168-K171 VanDerWaalsContact O-N 3.1Å; V169-K171 VanDerWaalsContact C-N 3.28Å; V169-K171 PolarHBondContact O-N 3.3Å; K171-V173 VanDerWaalsContact C-N 3.29Å; K171-V173 PolarHBondContact O-N 2.8Å; K171-S174 WeakPolarHBondContact O-CA 3.34Å; K171-S174 VanDerWaalsContact O-CB 3.28Å; K171-S174 WeakPolarHBondContact O-CB 3.36Å; K171-S174 PolarHBondContact O-N 3.34Å; K171-S174 PolarHBondContact O-OG 2.92Å; K171-Y175 WeakPolarHBondContact CE-OH 3.47Å; K171-Y175 HydrophobicContact CG-CE2 3.82Å; K171-Y175 PolarHBondContact O-N 3.03Å
172	V	93.9	Very high	87.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-39.2	177.3	-177.5	0	0	0	0	111.4	I133 F168 V169 S174 Y175 V176 A189 L192 L193	I133-V172 HydrophobicContact CG2-CG2 4.25Å; F168-V172 HydrophobicContact CD1-CG2 4.47Å; F168-V172 HydrophobicContact CE1-CG2 4.06Å; F168-V172 HydrophobicContact CE2-CG2 4.38Å; F168-V172 HydrophobicContact CZ-CG2 4.01Å; F168-V172 WeakPolarHBondContact O-CG2 3.32Å; F168-V172 PolarHBondContact O-N 3.17Å; V169-V172 PolarHBondContact O-N 3.04Å; V169-V172 VanDerWaalsContact O-N 3.12Å; V172-S174 VanDerWaalsContact C-N 3.28Å; V172-S174 PolarHBondContact O-N 3.07Å; V172-Y175 WeakPolarHBondContact O-CB 3.14Å; V172-Y175 PolarHBondContact O-N 3.34Å; V172-Y175 VanDerWaalsContact O-N 3.1Å; V172-V176 PolarHBondContact O-N 3.25Å; V172-A189 HydrophobicContact CG1-CB 3.88Å; V172-L192 HydrophobicContact CG1-CB 4.43Å; V172-L192 HydrophobicContact CG1-CD2 4.2Å; V172-L192 HydrophobicContact CG2-CD1 4.43Å; V172-L192 HydrophobicContact CG2-CD2 4.3Å; V172-L193 HydrophobicContact CB-CD2 4.08Å; V172-L193 HydrophobicContact CG1-CD1 4.39Å; V172-L193 HydrophobicContact CG1-CD2 3.84Å; V172-L193 HydrophobicContact CG1-CG 3.83Å
173	V	94.5	Very high	86.4	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-58.3	-40.8	171.5	171.1	0	0	0	0	111.5	V169 R170 K171 Y175 V176 N177 L193 E210 V211	V169-V173 WeakPolarHBondContact O-CG2 3.19Å; V169-V173 PolarHBondContact O-N 3.5Å; R170-V173 WeakPolarHBondContact O-CB 2.77Å; R170-V173 PolarHBondContact O-N 3.49Å; K171-V173 VanDerWaalsContact C-N 3.29Å; K171-V173 PolarHBondContact O-N 2.8Å; V173-Y175 PolarHBondContact O-N 3.18Å; V173-V176 PolarHBondContact O-N 3.05Å; V173-V176 VanDerWaalsContact O-N 3.15Å; V173-N177 WeakPolarHBondContact CG1-ND2 3.4Å; V173-N177 PolarHBondContact O-N 3.08Å; V173-N177 PolarHBondContact O-ND2 2.91Å; V173-L193 HydrophobicContact CG2-CD1 3.87Å; V173-L193 HydrophobicContact CG2-CD2 3.95Å; V173-E210 HydrophobicContact CG1-CB 3.76Å; V173-E210 WeakPolarHBondContact CG1-O 3.39Å; V173-E210 HydrophobicContact CG2-CB 4.44Å; V173-V211 HydrophobicContact CB-CG2 4.39Å; V173-V211 HydrophobicContact CG1-CG2 3.82Å; V173-V211 HydrophobicContact CG2-CG2 3.87Å
174	S	92.2	Very high	86	Confident	40 Å²	40	53.2 Å²	53.2	28%	0.28	29%	0.29	S	S	.	.	H	α-helix	trans	-57.7	-37.7	175.9	85.5	0	0	0	0	112.1	R170 K171 V172 N177 M178	R170-S174 PolarHBondContact O-N 3.35Å; K171-S174 WeakPolarHBondContact O-CA 3.34Å; K171-S174 VanDerWaalsContact O-CB 3.28Å; K171-S174 WeakPolarHBondContact O-CB 3.36Å; K171-S174 PolarHBondContact O-N 3.34Å; K171-S174 PolarHBondContact O-OG 2.92Å; V172-S174 VanDerWaalsContact C-N 3.28Å; V172-S174 PolarHBondContact O-N 3.07Å; S174-N177 CarbonylContact O-C 3.36Å; S174-N177 WeakPolarHBondContact O-CA 3.21Å; S174-N177 PolarHBondContact O-N 3.25Å; S174-N177 VanDerWaalsContact O-N 3.1Å; S174-M178 WeakPolarHBondContact O-CG 3.43Å; S174-M178 PolarHBondContact O-N 3.12Å
175	Y	91.1	Very high	85.9	Confident	1 Å²	1	52.6 Å²	52.6	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-37	177.1	-61.6	-44.4	0	0	0	113.3	I133 L139 L143 K171 V172 V173 N177 M178 V185	I133-Y175 HydrophobicContact CG2-CE2 3.9Å; I133-Y175 PolarHBondContact O-OH 3.39Å; L139-Y175 HydrophobicContact CD2-CD1 4.18Å; L139-Y175 HydrophobicContact CD2-CE1 4.02Å; L143-Y175 HydrophobicContact CD1-CE2 3.89Å; L143-Y175 HydrophobicContact CD2-CD1 3.91Å; L143-Y175 HydrophobicContact CD2-CD2 4.22Å; L143-Y175 HydrophobicContact CD2-CE1 3.56Å; L143-Y175 HydrophobicContact CD2-CE2 3.9Å; L143-Y175 HydrophobicContact CD2-CG 4.24Å; L143-Y175 HydrophobicContact CG-CE2 4.48Å; K171-Y175 WeakPolarHBondContact CE-OH 3.47Å; K171-Y175 HydrophobicContact CG-CE2 3.82Å; K171-Y175 PolarHBondContact O-N 3.03Å; V172-Y175 WeakPolarHBondContact O-CB 3.14Å; V172-Y175 PolarHBondContact O-N 3.34Å; V172-Y175 VanDerWaalsContact O-N 3.1Å; V173-Y175 PolarHBondContact O-N 3.18Å; Y175-N177 VanDerWaalsContact C-N 3.25Å; Y175-N177 PolarHBondContact O-N 3.5Å; Y175-M178 HydrophobicContact CD1-CE 3.73Å; Y175-M178 HydrophobicContact CD1-SD 3.71Å; Y175-M178 HydrophobicContact CE1-CE 3.84Å; Y175-M178 HydrophobicContact CE1-SD 4.28Å; Y175-M178 PolarHBondContact O-N 3.4Å; Y175-V185 HydrophobicContact CG-CG1 4.42Å
176	V	90.7	Very high	85.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-35	171.6	176.3	0	0	0	0	111	V172 V173 A189 L190 L193 V211 R215 H219	V172-V176 PolarHBondContact O-N 3.25Å; V173-V176 PolarHBondContact O-N 3.05Å; V173-V176 VanDerWaalsContact O-N 3.15Å; V176-A189 HydrophobicContact CG2-CB 3.75Å; V176-L190 HydrophobicContact CB-CD2 4.49Å; V176-L190 HydrophobicContact CG1-CD2 3.66Å; V176-L190 HydrophobicContact CG1-CG 4.39Å; V176-L190 HydrophobicContact CG2-CD2 3.95Å; V176-L190 HydrophobicContact CG2-CG 4.08Å; V176-L193 HydrophobicContact CB-CD1 4.41Å; V176-L193 HydrophobicContact CG2-CD1 3.63Å; V176-V211 HydrophobicContact CG1-CG1 4.43Å; V176-R215 HydrophobicContact CG1-CG 4.36Å; V176-R215 PolarHBondContact O-NE 3.42Å; V176-H219 PolarHBondContact O-NE2 3.34Å
177	N	88	Confident	85.6	Confident	54 Å²	54	45.8 Å²	45.8	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-81	-14.8	-178.6	-70.5	-24.3	0	0	0	114.6	V173 S174 Y175 E210 P212 R215	V173-N177 WeakPolarHBondContact CG1-ND2 3.4Å; V173-N177 PolarHBondContact O-N 3.08Å; V173-N177 PolarHBondContact O-ND2 2.91Å; S174-N177 CarbonylContact O-C 3.36Å; S174-N177 WeakPolarHBondContact O-CA 3.21Å; S174-N177 PolarHBondContact O-N 3.25Å; S174-N177 VanDerWaalsContact O-N 3.1Å; Y175-N177 VanDerWaalsContact C-N 3.25Å; Y175-N177 PolarHBondContact O-N 3.5Å; N177-E210 PolarHBondContact ND2-O 3.03Å; N177-P212 VanDerWaalsContact OD1-CD 3.26Å; N177-P212 WeakPolarHBondContact OD1-CD 3.48Å; N177-R215 PolarHBondContact O-NE 3.46Å; N177-R215 WeakPolarHBondContact OD1-CG 3.35Å
178	M	84.5	Confident	85.5	Confident	63 Å²	63	43.1 Å²	43.1	31%	0.31	23%	0.23	S	C	.	.	S	Bend	trans	-65.6	152.5	177.2	-79.1	179.1	-177.7	0	0	112.9	L139 S174 Y175 Q186 R215	L139-M178 HydrophobicContact CD1-CE 4.3Å; L139-M178 HydrophobicContact CD1-SD 3.72Å; L139-M178 HydrophobicContact CD2-CE 3.84Å; L139-M178 HydrophobicContact CD2-SD 3.3Å; L139-M178 WeakPolarHBondContact CD2-SD 3.16Å; L139-M178 HydrophobicContact CG-SD 4.15Å; S174-M178 WeakPolarHBondContact O-CG 3.43Å; S174-M178 PolarHBondContact O-N 3.12Å; Y175-M178 HydrophobicContact CD1-CE 3.73Å; Y175-M178 HydrophobicContact CD1-SD 3.71Å; Y175-M178 HydrophobicContact CE1-CE 3.84Å; Y175-M178 HydrophobicContact CE1-SD 4.28Å; Y175-M178 PolarHBondContact O-N 3.4Å; M178-Q186 PolarHBondContact O-NE2 3.26Å; M178-R215 PolarHBondContact O-NH2 2.89Å
179	N	76.6	Confident	85.5	Confident	117 Å²	117	43.1 Å²	43.1	63%	0.626	23%	0.23	S	C	*	.			trans	-54.2	151	175.8	-71.5	-27.6	0	0	0	112.4	M181	N179-M181 HydrophobicContact CB-CG 4.28Å; N179-M181 PolarHBondContact O-N 3.36Å
180	L	65.9	Low	85.5	Confident	81 Å²	81	43.1 Å²	43.1	42%	0.424	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	48.1	-175.7	-64.7	170	0	0	0	113.3	Q186 V218 H219 V222 L227	L180-Q186 VanDerWaalsContact CD2-OE1 3.3Å; L180-V218 HydrophobicContact CD1-CG1 3.78Å; L180-V218 HydrophobicContact CG-CG1 4.32Å; L180-H219 VanDerWaalsContact CD2-ND1 3.32Å; L180-H219 WeakPolarHBondContact CD2-ND1 3.31Å; L180-V222 HydrophobicContact CD1-CG1 3.58Å; L180-V222 HydrophobicContact CD2-CG1 4.14Å; L180-L227 HydrophobicContact CD2-CD2 4.09Å
181	M	61.5	Low	85.4	Confident	171 Å²	171	39.4 Å²	39.4	84%	0.842	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-26.8	-175.2	-67.1	-171	171.7	0	0	113.2	N179	N179-M181 HydrophobicContact CB-CG 4.28Å; N179-M181 PolarHBondContact O-N 3.36Å
182	D	65.3	Low	85.4	Confident	43 Å²	43	36.9 Å²	36.9	23%	0.23	21%	0.205	C	C	.	.			trans	-120.4	111.7	178	-169.6	-23.9	0	0	0	110.7	G140 S184	G140-D182 WeakPolarHBondContact CA-OD2 3.46Å; G140-D182 PolarHBondContact N-OD2 3.34Å; D182-S184 PolarHBondContact O-N 3.11Å; D182-S184 WeakPolarHBondContact OD1-CB 3.43Å; D182-S184 PolarHBondContact OD1-N 3.07Å; D182-S184 PolarHBondContact OD1-OG 2.79Å
183	A	69.6	Low	85.5	Confident	64 Å²	64	36.9 Å²	36.9	53%	0.529	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-14.7	-177.7	0	0	0	0	0	113.7	P187	A183-P187 VanDerWaalsContact O-CD 3.24Å; A183-P187 WeakPolarHBondContact O-CD 3.31Å; A183-P187 WeakPolarHBondContact O-CG 3.34Å
184	S	82.4	Confident	85.6	Confident	51 Å²	51	37.8 Å²	37.8	36%	0.357	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-36.5	-172.4	68.9	0	0	0	0	113.8	D182 L188	D182-S184 PolarHBondContact O-N 3.11Å; D182-S184 WeakPolarHBondContact OD1-CB 3.43Å; D182-S184 PolarHBondContact OD1-N 3.07Å; D182-S184 PolarHBondContact OD1-OG 2.79Å; S184-L188 WeakPolarHBondContact O-CD1 3.36Å
185	V	88.9	Confident	85.5	Confident	7 Å²	7	36.8 Å²	36.8	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-76.6	-43	-174	174.7	0	0	0	0	112.2	L143 A144 L147 Y175 L188 A189	L143-V185 HydrophobicContact CB-CG2 4.36Å; L143-V185 HydrophobicContact CD2-CG1 3.67Å; L143-V185 HydrophobicContact CD2-CG2 4.19Å; L143-V185 HydrophobicContact CG-CG1 4.13Å; L143-V185 HydrophobicContact CG-CG2 4.31Å; A144-V185 HydrophobicContact CB-CG2 4.26Å; L147-V185 HydrophobicContact CD1-CG1 3.89Å; Y175-V185 HydrophobicContact CG-CG1 4.42Å; V185-L188 PolarHBondContact O-N 3.38Å; V185-A189 PolarHBondContact O-N 2.96Å
186	Q	90.3	Very high	85.6	Confident	7 Å²	7	36.7 Å²	36.7	3%	0.033	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-43	-172.6	-65.5	177.7	-43.8	0	0	113.7	M178 L180 L188 A189 L190 H219 L227	M178-Q186 PolarHBondContact O-NE2 3.26Å; L180-Q186 VanDerWaalsContact CD2-OE1 3.3Å; Q186-L188 VanDerWaalsContact C-N 3.29Å; Q186-L188 PolarHBondContact O-N 3.49Å; Q186-A189 PolarHBondContact O-N 3.05Å; Q186-L190 WeakPolarHBondContact O-CB 3.35Å; Q186-L190 VanDerWaalsContact O-CG 3.25Å; Q186-L190 WeakPolarHBondContact O-CG 3.19Å; Q186-L190 PolarHBondContact O-N 3.32Å; Q186-H219 PolarHBondContact NE2-CE1 2.79Å; Q186-L227 HydrophobicContact CB-CD1 4Å
187	P	90.6	Very high	85.7	Confident	6 Å²	6	37.4 Å²	37.4	4%	0.039	21%	0.206	C	C	.	.	H	α-helix	trans	-58.7	-39.7	174	-24.5	34.4	0	0	0	113.1	A183 R191 L227 K230	A183-P187 VanDerWaalsContact O-CD 3.24Å; A183-P187 WeakPolarHBondContact O-CD 3.31Å; A183-P187 WeakPolarHBondContact O-CG 3.34Å; P187-R191 WeakPolarHBondContact O-CB 3.34Å; P187-R191 PolarHBondContact O-N 3.33Å; P187-L227 HydrophobicContact CG-CB 4.3Å; P187-L227 HydrophobicContact CG-CD1 4.07Å; P187-K230 HydrophobicContact CB-CG 4.39Å
188	L	92	Very high	85.7	Confident	23 Å²	23	37.4 Å²	37.4	12%	0.12	21%	0.205	C	C	.	.	H	α-helix	trans	-69.2	-42.8	178.4	-64.6	168.9	0	0	0	111.8	A144 L147 M148 L151 S184 V185 Q186 R191 L192	A144-L188 HydrophobicContact CB-CD1 3.86Å; A144-L188 WeakPolarHBondContact O-CD1 3.5Å; L147-L188 HydrophobicContact CB-CB 4.03Å; L147-L188 HydrophobicContact CB-CD1 4.24Å; L147-L188 HydrophobicContact CD1-CB 4.15Å; M148-L188 HydrophobicContact CE-CD1 4.32Å; M148-L188 HydrophobicContact CG-CD1 3.63Å; M148-L188 HydrophobicContact CG-CD2 3.56Å; M148-L188 HydrophobicContact CG-CG 4.25Å; M148-L188 HydrophobicContact SD-CD1 4.41Å; L151-L188 HydrophobicContact CD1-CB 4.39Å; L151-L188 HydrophobicContact CD1-CD2 4.1Å; S184-L188 WeakPolarHBondContact O-CD1 3.36Å; V185-L188 PolarHBondContact O-N 3.38Å; Q186-L188 VanDerWaalsContact C-N 3.29Å; Q186-L188 PolarHBondContact O-N 3.49Å; L188-R191 PolarHBondContact O-N 3.33Å; L188-L192 WeakPolarHBondContact O-CB 3.38Å; L188-L192 PolarHBondContact O-N 2.87Å
189	A	93.9	Very high	85.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-43.6	175.3	0	0	0	0	0	111.4	V172 V176 V185 Q186 L192 L193	V172-A189 HydrophobicContact CG1-CB 3.88Å; V176-A189 HydrophobicContact CG2-CB 3.75Å; V185-A189 PolarHBondContact O-N 2.96Å; Q186-A189 PolarHBondContact O-N 3.05Å; A189-L192 PolarHBondContact O-N 3.05Å; A189-L193 WeakPolarHBondContact O-CG 3.45Å; A189-L193 PolarHBondContact O-N 3.27Å
190	L	94.8	Very high	86.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.7	-46.4	175.2	-72.8	165.7	0	0	0	111.8	V176 Q186 L192 L193 E194 L216 L227 K230 A231 L234	V176-L190 HydrophobicContact CB-CD2 4.49Å; V176-L190 HydrophobicContact CG1-CD2 3.66Å; V176-L190 HydrophobicContact CG1-CG 4.39Å; V176-L190 HydrophobicContact CG2-CD2 3.95Å; V176-L190 HydrophobicContact CG2-CG 4.08Å; Q186-L190 WeakPolarHBondContact O-CB 3.35Å; Q186-L190 VanDerWaalsContact O-CG 3.25Å; Q186-L190 WeakPolarHBondContact O-CG 3.19Å; Q186-L190 PolarHBondContact O-N 3.32Å; L190-L192 VanDerWaalsContact C-N 3.33Å; L190-L192 PolarHBondContact O-N 3.45Å; L190-L193 PolarHBondContact O-N 2.9Å; L190-E194 WeakPolarHBondContact O-CB 3.38Å; L190-E194 PolarHBondContact O-N 2.57Å; L190-L216 HydrophobicContact CD2-CD2 4.08Å; L190-L227 HydrophobicContact CD1-CD1 3.44Å; L190-L227 VanDerWaalsContact CD1-CD1 3.44Å; L190-K230 HydrophobicContact CB-CB 3.99Å; L190-K230 HydrophobicContact CD1-CB 4.38Å; L190-A231 HydrophobicContact CD1-CB 4.1Å; L190-L234 HydrophobicContact CD2-CB 4.31Å; L190-L234 HydrophobicContact CD2-CD2 3.54Å
191	R	93.4	Very high	87.5	Confident	45 Å²	45	31.1 Å²	31.1	17%	0.17	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-42.1	174.8	167	174.8	-179	-180	4	112.6	L151 E155 P187 L188 S195 Q558	L151-R191 HydrophobicContact CD1-CG 4.03Å; L151-R191 HydrophobicContact CD2-CG 4.07Å; E155-R191 VanDerWaalsContact CD-NH2 3.31Å; E155-R191 IonicContact OE1-CZ 2.91Å; E155-R191 IonicContact OE1-NE 2.83Å; E155-R191 PolarHBondContact OE1-NE 3.43Å; E155-R191 IonicContact OE1-NH2 2.81Å; E155-R191 PolarHBondContact OE1-NH2 3.06Å; E155-R191 IonicContact OE2-NH2 3.91Å; E155-R191 PolarHBondContact OE2-NH2 3.24Å; P187-R191 WeakPolarHBondContact O-CB 3.34Å; P187-R191 PolarHBondContact O-N 3.33Å; L188-R191 PolarHBondContact O-N 3.33Å; R191-S195 PolarHBondContact O-N 3.48Å; R191-S195 PolarHBondContact O-OG 3.02Å; R191-Q558 VanDerWaalsContact CZ-OE1 3.25Å
192	L	94.3	Very high	88.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-49.2	177	-166.6	157.4	0	0	0	110.5	L147 F150 L151 W161 F168 V172 L188 A189 L190 E194 S195 V196	L147-L192 HydrophobicContact CD2-CD1 4.02Å; F150-L192 HydrophobicContact CD1-CD1 3.8Å; F150-L192 HydrophobicContact CE1-CD1 4.21Å; L151-L192 HydrophobicContact CD2-CB 3.8Å; L151-L192 HydrophobicContact CD2-CD1 4.4Å; L151-L192 HydrophobicContact CD2-CG 4.05Å; L151-L192 HydrophobicContact CG-CB 4.39Å; L151-L192 HydrophobicContact CG-CD1 4.46Å; W161-L192 HydrophobicContact CZ3-CG 4.4Å; F168-L192 HydrophobicContact CE1-CD1 4.3Å; F168-L192 HydrophobicContact CE1-CD2 4.19Å; F168-L192 HydrophobicContact CZ-CD1 4.13Å; V172-L192 HydrophobicContact CG1-CB 4.43Å; V172-L192 HydrophobicContact CG1-CD2 4.2Å; V172-L192 HydrophobicContact CG2-CD1 4.43Å; V172-L192 HydrophobicContact CG2-CD2 4.3Å; L188-L192 WeakPolarHBondContact O-CB 3.38Å; L188-L192 PolarHBondContact O-N 2.87Å; A189-L192 PolarHBondContact O-N 3.05Å; L190-L192 VanDerWaalsContact C-N 3.33Å; L190-L192 PolarHBondContact O-N 3.45Å; L192-E194 VanDerWaalsContact C-N 3.3Å; L192-E194 PolarHBondContact O-N 2.98Å; L192-S195 WeakPolarHBondContact O-CB 3.13Å; L192-S195 PolarHBondContact O-N 3.47Å; L192-V196 HydrophobicContact CD2-CG2 3.64Å; L192-V196 VanDerWaalsContact O-CG2 3.32Å; L192-V196 WeakPolarHBondContact O-CG2 3.5Å; L192-V196 PolarHBondContact O-N 3.43Å
193	L	96	Very high	90.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.1	-34.1	179.8	-67	-177.9	0	0	0	112.7	V169 V172 V173 V176 A189 L190 V196 T197 V207 V211 L234	V169-L193 HydrophobicContact CG1-CD2 4.12Å; V172-L193 HydrophobicContact CB-CD2 4.08Å; V172-L193 HydrophobicContact CG1-CD1 4.39Å; V172-L193 HydrophobicContact CG1-CD2 3.84Å; V172-L193 HydrophobicContact CG1-CG 3.83Å; V173-L193 HydrophobicContact CG2-CD1 3.87Å; V173-L193 HydrophobicContact CG2-CD2 3.95Å; V176-L193 HydrophobicContact CB-CD1 4.41Å; V176-L193 HydrophobicContact CG2-CD1 3.63Å; A189-L193 WeakPolarHBondContact O-CG 3.45Å; A189-L193 PolarHBondContact O-N 3.27Å; L190-L193 PolarHBondContact O-N 2.9Å; L193-V196 PolarHBondContact O-N 2.84Å; L193-T197 VanDerWaalsContact O-CB 3.25Å; L193-T197 WeakPolarHBondContact O-CB 3.45Å; L193-T197 PolarHBondContact O-N 3.48Å; L193-T197 PolarHBondContact O-OG1 3.02Å; L193-V207 HydrophobicContact CB-CG1 4.11Å; L193-V207 HydrophobicContact CD1-CG1 4.28Å; L193-V207 HydrophobicContact CD2-CG1 4.41Å; L193-V207 HydrophobicContact CD2-CG2 3.89Å; L193-V211 HydrophobicContact CD1-CG2 4.01Å; L193-L234 HydrophobicContact CB-CD1 4.02Å; L193-L234 HydrophobicContact CB-CD2 4.01Å; L193-L234 HydrophobicContact CD1-CD2 4.27Å
194	E	94.8	Very high	91.2	Very high	21 Å²	21	21.9 Å²	21.9	10%	0.098	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-53.1	171.6	-174.6	-152.2	164.3	0	0	109.8	L190 L192 V196 T197 L198 A233 L234 A237 Q558	L190-E194 WeakPolarHBondContact O-CB 3.38Å; L190-E194 PolarHBondContact O-N 2.57Å; L192-E194 VanDerWaalsContact C-N 3.3Å; L192-E194 PolarHBondContact O-N 2.98Å; E194-V196 VanDerWaalsContact C-N 3.32Å; E194-V196 PolarHBondContact O-N 3.39Å; E194-T197 PolarHBondContact O-N 3.29Å; E194-T197 VanDerWaalsContact O-N 3.16Å; E194-L198 HydrophobicContact CG-CD1 3.97Å; E194-L198 WeakPolarHBondContact O-CD1 3.49Å; E194-L198 VanDerWaalsContact O-CG 3.32Å; E194-L198 WeakPolarHBondContact O-CG 3.21Å; E194-L198 PolarHBondContact O-N 3.43Å; E194-A233 HydrophobicContact CG-CB 4.14Å; E194-L234 HydrophobicContact CB-CD1 4.49Å; E194-A237 HydrophobicContact CG-CB 4.09Å; E194-Q558 PolarHBondContact OE2-NE2 3.41Å
195	S	91.3	Very high	91.7	Very high	18 Å²	18	23.6 Å²	23.6	13%	0.126	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-40.4	179	-58.2	0	0	0	0	112.4	R191 L192 G199	R191-S195 PolarHBondContact O-N 3.48Å; R191-S195 PolarHBondContact O-OG 3.02Å; L192-S195 WeakPolarHBondContact O-CB 3.13Å; L192-S195 PolarHBondContact O-N 3.47Å; S195-G199 WeakPolarHBondContact O-CA 3.45Å; S195-G199 PolarHBondContact O-N 3.21Å
196	V	92.9	Very high	92	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.4	-44.3	175.1	169.5	0	0	0	0	111.6	W161 L164 V169 L192 L193 E194 L198 G199 S200 L203 V207	W161-V196 HydrophobicContact CE3-CG2 3.61Å; W161-V196 HydrophobicContact CZ3-CG2 3.98Å; L164-V196 HydrophobicContact CD1-CG2 3.71Å; V169-V196 HydrophobicContact CG2-CG1 4.42Å; L192-V196 HydrophobicContact CD2-CG2 3.64Å; L192-V196 VanDerWaalsContact O-CG2 3.32Å; L192-V196 WeakPolarHBondContact O-CG2 3.5Å; L192-V196 PolarHBondContact O-N 3.43Å; L193-V196 PolarHBondContact O-N 2.84Å; E194-V196 VanDerWaalsContact C-N 3.32Å; E194-V196 PolarHBondContact O-N 3.39Å; V196-L198 VanDerWaalsContact C-N 3.27Å; V196-L198 PolarHBondContact O-N 3.25Å; V196-G199 PolarHBondContact O-N 3.34Å; V196-S200 PolarHBondContact O-N 3.38Å; V196-L203 HydrophobicContact CG1-CB 3.46Å; V196-L203 VanDerWaalsContact CG1-CB 3.46Å; V196-L203 HydrophobicContact CG1-CD1 4.02Å; V196-L203 HydrophobicContact CG1-CG 4.4Å; V196-V207 HydrophobicContact CG1-CG2 4.29Å
197	T	93	Very high	92.2	Very high	14 Å²	14	23.8 Å²	23.8	9%	0.086	15%	0.146	C	C	.	.	H	α-helix	trans	-61.6	-38.9	-178.8	-61.6	0	0	0	0	111.4	L193 E194 A237 L238	L193-T197 VanDerWaalsContact O-CB 3.25Å; L193-T197 WeakPolarHBondContact O-CB 3.45Å; L193-T197 PolarHBondContact O-N 3.48Å; L193-T197 PolarHBondContact O-OG1 3.02Å; E194-T197 PolarHBondContact O-N 3.29Å; E194-T197 VanDerWaalsContact O-N 3.16Å; T197-A237 HydrophobicContact CG2-CB 4.15Å; T197-L238 HydrophobicContact CG2-CD2 3.93Å
198	L	88.8	Confident	92.4	Very high	54 Å²	54	25.4 Å²	25.4	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-82.7	-32.7	179.3	-63	164.1	0	0	0	112.6	E194 V196 A237	E194-L198 HydrophobicContact CG-CD1 3.97Å; E194-L198 WeakPolarHBondContact O-CD1 3.49Å; E194-L198 VanDerWaalsContact O-CG 3.32Å; E194-L198 WeakPolarHBondContact O-CG 3.21Å; E194-L198 PolarHBondContact O-N 3.43Å; V196-L198 VanDerWaalsContact C-N 3.27Å; V196-L198 PolarHBondContact O-N 3.25Å; L198-A237 HydrophobicContact CD1-CB 4.2Å; L198-A237 HydrophobicContact CD2-CB 3.86Å; L198-A237 HydrophobicContact CG-CB 3.89Å
199	G	86	Confident	92.4	Very high	32 Å²	32	28.6 Å²	28.6	33%	0.33	18%	0.177	S	C	.	.	H	α-helix	trans	-85.5	-20.9	-175.5	0	0	0	0	0	114.8	S195 V196	S195-G199 WeakPolarHBondContact O-CA 3.45Å; S195-G199 PolarHBondContact O-N 3.21Å; V196-G199 PolarHBondContact O-N 3.34Å
200	S	89.1	Confident	92.4	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.014	19%	0.189	C	C	.	.			trans	-143.8	113.8	179.6	176.4	0	0	0	0	111.3	V196 A202 L203 G204	V196-S200 PolarHBondContact O-N 3.38Å; S200-A202 VanDerWaalsContact C-N 3.3Å; S200-A202 PolarHBondContact O-N 2.98Å; S200-L203 PolarHBondContact O-N 3.41Å; S200-L203 PolarHBondContact OG-N 3.18Å; S200-G204 PolarHBondContact O-N 3.17Å
201	P	88.3	Confident	92.3	Very high	95 Å²	95	31.4 Å²	31.4	62%	0.617	19%	0.19	S	C	*	.	H	α-helix	trans	-59.7	-38.9	177	-25.6	34.7	0	0	0	113.3	G204 Q205	P201-G204 PolarHBondContact O-N 2.53Å; P201-Q205 WeakPolarHBondContact O-CG 3.44Å; P201-Q205 PolarHBondContact O-N 3.24Å
202	A	90.3	Very high	92.4	Very high	70 Å²	70	32.3 Å²	32.3	58%	0.579	20%	0.202	S	C	*	.	H	α-helix	trans	-66.9	-47.3	-178.7	0	0	0	0	0	111.9	S200 G204 Q205 L206	S200-A202 VanDerWaalsContact C-N 3.3Å; S200-A202 PolarHBondContact O-N 2.98Å; A202-G204 VanDerWaalsContact C-N 3.35Å; A202-Q205 PolarHBondContact O-N 3.23Å; A202-L206 PolarHBondContact O-N 3.46Å
203	L	92.9	Very high	92.4	Very high	8 Å²	8	33.7 Å²	33.7	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-71.6	-32	175.7	-61.4	175.6	0	0	0	111.4	W161 L164 M166 V169 V196 S200 Q205 L206 V207	W161-L203 WeakPolarHBondContact O-CD1 3.31Å; L164-L203 HydrophobicContact CB-CD1 3.89Å; M166-L203 HydrophobicContact CG-CD2 4.29Å; V169-L203 HydrophobicContact CG2-CD1 4.24Å; V169-L203 HydrophobicContact CG2-CD2 4.19Å; V196-L203 HydrophobicContact CG1-CB 3.46Å; V196-L203 VanDerWaalsContact CG1-CB 3.46Å; V196-L203 HydrophobicContact CG1-CD1 4.02Å; V196-L203 HydrophobicContact CG1-CG 4.4Å; S200-L203 PolarHBondContact O-N 3.41Å; S200-L203 PolarHBondContact OG-N 3.18Å; L203-Q205 VanDerWaalsContact C-N 3.3Å; L203-Q205 PolarHBondContact O-N 3.02Å; L203-L206 WeakPolarHBondContact O-CA 3.38Å; L203-L206 VanDerWaalsContact O-CB 3.27Å; L203-L206 WeakPolarHBondContact O-CB 3.5Å; L203-L206 PolarHBondContact O-N 2.96Å; L203-V207 WeakPolarHBondContact O-CG2 3.3Å; L203-V207 PolarHBondContact O-N 3.45Å
204	G	92.1	Very high	92.3	Very high	6 Å²	6	37 Å²	37	6%	0.062	23%	0.227	C	C	.	.	H	α-helix	trans	-59.4	-37.6	172.4	0	0	0	0	0	113.2	S200 P201 A202 L206 V207 K208	S200-G204 PolarHBondContact O-N 3.17Å; P201-G204 PolarHBondContact O-N 2.53Å; A202-G204 VanDerWaalsContact C-N 3.35Å; G204-L206 VanDerWaalsContact C-N 3.34Å; G204-V207 PolarHBondContact O-N 3.14Å; G204-K208 WeakPolarHBondContact O-CB 3.33Å; G204-K208 PolarHBondContact O-N 3.32Å
205	Q	92.4	Very high	92.2	Very high	88 Å²	88	37.7 Å²	37.7	41%	0.411	23%	0.229	S	C	.	.	H	α-helix	trans	-64.3	-38.5	171.5	-66.3	-52.6	-47.4	0	0	112.3	P201 A202 L203 K208 S209	P201-Q205 WeakPolarHBondContact O-CG 3.44Å; P201-Q205 PolarHBondContact O-N 3.24Å; A202-Q205 PolarHBondContact O-N 3.23Å; L203-Q205 VanDerWaalsContact C-N 3.3Å; L203-Q205 PolarHBondContact O-N 3.02Å; Q205-K208 PolarHBondContact O-N 2.67Å; Q205-S209 WeakPolarHBondContact O-CB 3.26Å; Q205-S209 PolarHBondContact O-N 3.15Å; Q205-S209 PolarHBondContact O-OG 2.48Å
206	L	94.5	Very high	92.3	Very high	17 Å²	17	36.8 Å²	36.8	9%	0.089	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-51	174.4	-179.7	69.1	0	0	0	110.8	M166 V169 R170 A202 L203 G204 K208 S209 E210	M166-L206 HydrophobicContact CB-CD2 4.1Å; M166-L206 HydrophobicContact CG-CD2 4.15Å; V169-L206 HydrophobicContact CB-CD2 4Å; V169-L206 HydrophobicContact CG1-CD2 3.9Å; R170-L206 HydrophobicContact CG-CD2 4.29Å; A202-L206 PolarHBondContact O-N 3.46Å; L203-L206 WeakPolarHBondContact O-CA 3.38Å; L203-L206 VanDerWaalsContact O-CB 3.27Å; L203-L206 WeakPolarHBondContact O-CB 3.5Å; L203-L206 PolarHBondContact O-N 2.96Å; G204-L206 VanDerWaalsContact C-N 3.34Å; L206-K208 VanDerWaalsContact C-N 3.32Å; L206-K208 PolarHBondContact O-N 3.45Å; L206-S209 PolarHBondContact O-N 2.89Å; L206-S209 PolarHBondContact O-OG 2.81Å; L206-E210 HydrophobicContact CD1-CG 4.12Å; L206-E210 VanDerWaalsContact CD1-OE1 3.25Å; L206-E210 WeakPolarHBondContact CD1-OE1 3.39Å; L206-E210 PolarHBondContact O-N 3.2Å
207	V	95.7	Very high	92.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.9	-46.4	177.6	-178.2	0	0	0	0	110.8	V169 L193 V196 L203 G204 S209 E210 V211 L234 L238	V169-V207 HydrophobicContact CG1-CG2 3.87Å; L193-V207 HydrophobicContact CB-CG1 4.11Å; L193-V207 HydrophobicContact CD1-CG1 4.28Å; L193-V207 HydrophobicContact CD2-CG1 4.41Å; L193-V207 HydrophobicContact CD2-CG2 3.89Å; V196-V207 HydrophobicContact CG1-CG2 4.29Å; L203-V207 WeakPolarHBondContact O-CG2 3.3Å; L203-V207 PolarHBondContact O-N 3.45Å; G204-V207 PolarHBondContact O-N 3.14Å; V207-S209 VanDerWaalsContact C-N 3.26Å; V207-S209 PolarHBondContact O-N 2.97Å; V207-E210 PolarHBondContact O-N 3.46Å; V207-V211 HydrophobicContact CG1-CG2 3.7Å; V207-V211 WeakPolarHBondContact O-CB 3.4Å; V207-V211 WeakPolarHBondContact O-CG2 3.46Å; V207-V211 PolarHBondContact O-N 3.36Å; V207-L234 HydrophobicContact CG1-CD1 4.15Å; V207-L238 HydrophobicContact CB-CD2 4.46Å; V207-L238 HydrophobicContact CG1-CD2 4.12Å
208	K	93.4	Very high	92.4	Very high	40 Å²	40	39.3 Å²	39.3	17%	0.174	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-36.7	176.9	-167.7	-178.8	74.2	-178.8	0	112.8	G204 Q205 L206 L238 E246 M250	G204-K208 WeakPolarHBondContact O-CB 3.33Å; G204-K208 PolarHBondContact O-N 3.32Å; Q205-K208 PolarHBondContact O-N 2.67Å; L206-K208 VanDerWaalsContact C-N 3.32Å; L206-K208 PolarHBondContact O-N 3.45Å; K208-L238 HydrophobicContact CB-CD2 3.81Å; K208-L238 HydrophobicContact CG-CD2 4.27Å; K208-E246 IonicContact NZ-OE1 3.79Å; K208-E246 PolarHBondContact NZ-OE1 2.94Å; K208-E246 IonicContact NZ-OE2 3.49Å; K208-E246 PolarHBondContact NZ-OE2 3.19Å; K208-M250 HydrophobicContact CD-SD 4.49Å
209	S	91.8	Very high	92.6	Very high	91 Å²	91	36.8 Å²	36.8	64%	0.636	22%	0.224	S	C	*	.	H	α-helix	trans	-78.4	-30.2	-179.3	72	0	0	0	0	113.9	Q205 L206 V207	Q205-S209 WeakPolarHBondContact O-CB 3.26Å; Q205-S209 PolarHBondContact O-N 3.15Å; Q205-S209 PolarHBondContact O-OG 2.48Å; L206-S209 PolarHBondContact O-N 2.89Å; L206-S209 PolarHBondContact O-OG 2.81Å; V207-S209 VanDerWaalsContact C-N 3.26Å; V207-S209 PolarHBondContact O-N 2.97Å
210	E	94	Very high	92.9	Very high	54 Å²	54	35.2 Å²	35.2	25%	0.252	21%	0.208	S	C	.	.	H	α-helix	trans	-105.8	-17.3	-171.5	-63.3	-163.3	-177.2	0	0	114.6	R170 V173 N177 L206 V207 P212	R170-E210 WeakPolarHBondContact CD-OE1 3.42Å; R170-E210 WeakPolarHBondContact CG-OE1 3.4Å; R170-E210 VanDerWaalsContact CG-OE2 3.25Å; R170-E210 WeakPolarHBondContact CG-OE2 3.22Å; R170-E210 IonicContact CZ-OE1 2.57Å; R170-E210 IonicContact NE-OE1 2.64Å; R170-E210 PolarHBondContact NE-OE1 3.32Å; R170-E210 IonicContact NE-OE2 2.6Å; R170-E210 IonicContact NH2-OE1 3.32Å; V173-E210 HydrophobicContact CG1-CB 3.76Å; V173-E210 WeakPolarHBondContact CG1-O 3.39Å; V173-E210 HydrophobicContact CG2-CB 4.44Å; N177-E210 PolarHBondContact ND2-O 3.03Å; L206-E210 HydrophobicContact CD1-CG 4.12Å; L206-E210 VanDerWaalsContact CD1-OE1 3.25Å; L206-E210 WeakPolarHBondContact CD1-OE1 3.39Å; L206-E210 PolarHBondContact O-N 3.2Å; V207-E210 PolarHBondContact O-N 3.46Å; E210-P212 VanDerWaalsContact O-CD 3.27Å; E210-P212 WeakPolarHBondContact O-CD 3.43Å
211	V	94.3	Very high	93	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.03	23%	0.226	C	C	.	.	S	Bend	trans	-91.8	106.6	172.7	-179.1	0	0	0	0	109.1	V173 V176 L193 V207 L216 L234	V173-V211 HydrophobicContact CB-CG2 4.39Å; V173-V211 HydrophobicContact CG1-CG2 3.82Å; V173-V211 HydrophobicContact CG2-CG2 3.87Å; V176-V211 HydrophobicContact CG1-CG1 4.43Å; L193-V211 HydrophobicContact CD1-CG2 4.01Å; V207-V211 HydrophobicContact CG1-CG2 3.7Å; V207-V211 WeakPolarHBondContact O-CB 3.4Å; V207-V211 WeakPolarHBondContact O-CG2 3.46Å; V207-V211 PolarHBondContact O-N 3.36Å; V211-L216 HydrophobicContact CG1-CD1 4.25Å; V211-L216 HydrophobicContact CG1-CD2 3.98Å; V211-L216 HydrophobicContact CG1-CG 3.94Å; V211-L234 HydrophobicContact CG1-CD2 4.48Å
212	P	93.6	Very high	92.9	Very high	63 Å²	63	35.9 Å²	35.9	41%	0.409	20%	0.204	S	C	.	.			trans	-68.7	140.3	179.8	-16.8	32.8	0	0	0	110.9	N177 E210 D214 R215 L216	N177-P212 VanDerWaalsContact OD1-CD 3.26Å; N177-P212 WeakPolarHBondContact OD1-CD 3.48Å; E210-P212 VanDerWaalsContact O-CD 3.27Å; E210-P212 WeakPolarHBondContact O-CD 3.43Å; P212-D214 PolarHBondContact O-N 3.46Å; P212-R215 HydrophobicContact CB-CB 4.41Å; P212-R215 WeakPolarHBondContact O-CA 3.49Å; P212-R215 VanDerWaalsContact O-CB 3.27Å; P212-R215 WeakPolarHBondContact O-CB 3.47Å; P212-R215 PolarHBondContact O-N 3.19Å; P212-L216 PolarHBondContact O-N 2.97Å
213	L	94.8	Very high	92.6	Very high	29 Å²	29	40.1 Å²	40.1	15%	0.152	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-36.8	175.3	-68.8	-178.8	0	0	0	112.4	R215 L216 L217 L235 M250 Y253 L254	L213-R215 PolarHBondContact O-N 3.13Å; L213-L216 HydrophobicContact CD2-CD1 4.34Å; L213-L216 PolarHBondContact O-N 2.67Å; L213-L216 VanDerWaalsContact O-N 3.17Å; L213-L217 WeakPolarHBondContact O-CG 3.22Å; L213-L217 PolarHBondContact O-N 2.89Å; L213-L235 HydrophobicContact CD2-CD1 4.44Å; L213-M250 HydrophobicContact CD1-CB 4.07Å; L213-M250 HydrophobicContact CD1-CG 4.14Å; L213-M250 HydrophobicContact CD2-CE 3.86Å; L213-Y253 HydrophobicContact CB-CD1 3.91Å; L213-Y253 HydrophobicContact CB-CE1 3.93Å; L213-Y253 HydrophobicContact CD1-CD1 3.74Å; L213-Y253 HydrophobicContact CD1-CG 4.23Å; L213-Y253 HydrophobicContact CG-CD1 4.49Å; L213-L254 HydrophobicContact CB-CD2 3.93Å; L213-L254 HydrophobicContact CD1-CD2 4.5Å; L213-L254 HydrophobicContact CD1-CG 4.2Å; L213-L254 HydrophobicContact CD2-CD1 4.3Å; L213-L254 HydrophobicContact CD2-CD2 4.28Å; L213-L254 HydrophobicContact CD2-CG 4.47Å; L213-L254 HydrophobicContact CG-CD2 4.46Å
214	D	93.9	Very high	92.3	Very high	71 Å²	71	42.6 Å²	42.6	38%	0.38	23%	0.227	S	C	.	.	H	α-helix	trans	-58.3	-32.6	173.9	-70.8	-53.5	0	0	0	112.3	P212 L217 V218 Y253 R257	P212-D214 PolarHBondContact O-N 3.46Å; D214-L217 PolarHBondContact O-N 3.25Å; D214-V218 WeakPolarHBondContact O-CG2 3.31Å; D214-V218 PolarHBondContact O-N 3.49Å; D214-V218 VanDerWaalsContact O-N 3.09Å; D214-Y253 PolarHBondContact OD1-OH 2.95Å; D214-Y253 PolarHBondContact OD2-OH 3.22Å; D214-R257 IonicContact OD1-NE 3.26Å; D214-R257 PolarHBondContact OD1-NE 2.95Å; D214-R257 IonicContact OD1-NH2 3.32Å
215	R	92.9	Very high	92.1	Very high	34 Å²	34	46.7 Å²	46.7	13%	0.128	25%	0.245	C	C	.	.	H	α-helix	trans	-69.8	-43	177.8	-168.8	73.4	-165.9	144.2	19.3	111.5	V176 N177 M178 P212 L213 L217 V218 H219	V176-R215 HydrophobicContact CG1-CG 4.36Å; V176-R215 PolarHBondContact O-NE 3.42Å; N177-R215 PolarHBondContact O-NE 3.46Å; N177-R215 WeakPolarHBondContact OD1-CG 3.35Å; M178-R215 PolarHBondContact O-NH2 2.89Å; P212-R215 HydrophobicContact CB-CB 4.41Å; P212-R215 WeakPolarHBondContact O-CA 3.49Å; P212-R215 VanDerWaalsContact O-CB 3.27Å; P212-R215 WeakPolarHBondContact O-CB 3.47Å; P212-R215 PolarHBondContact O-N 3.19Å; L213-R215 PolarHBondContact O-N 3.13Å; R215-L217 VanDerWaalsContact C-N 3.29Å; R215-L217 PolarHBondContact O-N 3.37Å; R215-V218 PolarHBondContact O-N 2.94Å; R215-H219 PolarHBondContact NH2-CE1 3.39Å; R215-H219 PolarHBondContact O-CD2 2.77Å; R215-H219 VanDerWaalsContact O-CD2 3.25Å; R215-H219 PolarHBondContact O-N 3.42Å; R215-H219 VanDerWaalsContact O-N 3.12Å
216	L	94.2	Very high	91.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-38.1	174.9	-64.3	176.3	0	0	0	111.4	L190 V211 P212 L213 V218 H219 L220 L234 L235 L238	L190-L216 HydrophobicContact CD2-CD2 4.08Å; V211-L216 HydrophobicContact CG1-CD1 4.25Å; V211-L216 HydrophobicContact CG1-CD2 3.98Å; V211-L216 HydrophobicContact CG1-CG 3.94Å; P212-L216 PolarHBondContact O-N 2.97Å; L213-L216 HydrophobicContact CD2-CD1 4.34Å; L213-L216 PolarHBondContact O-N 2.67Å; L213-L216 VanDerWaalsContact O-N 3.17Å; L216-V218 PolarHBondContact O-N 3.33Å; L216-H219 PolarHBondContact O-N 3.27Å; L216-L220 WeakPolarHBondContact O-CB 3.34Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.45Å; L216-L220 PolarHBondContact O-N 3Å; L216-L234 HydrophobicContact CD2-CD2 4Å; L216-L234 HydrophobicContact CD2-CG 4.38Å; L216-L235 HydrophobicContact CD1-CB 4.3Å; L216-L235 HydrophobicContact CD1-CD1 4.29Å; L216-L238 HydrophobicContact CD1-CD1 3.86Å
217	L	93.9	Very high	91.7	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.042	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-45.5	174.3	-70.1	175.2	0	0	0	112	L213 D214 R215 H219 L220 Q221 L254 R257 L259	L213-L217 WeakPolarHBondContact O-CG 3.22Å; L213-L217 PolarHBondContact O-N 2.89Å; D214-L217 PolarHBondContact O-N 3.25Å; R215-L217 VanDerWaalsContact C-N 3.29Å; R215-L217 PolarHBondContact O-N 3.37Å; L217-H219 VanDerWaalsContact C-N 3.32Å; L217-H219 PolarHBondContact O-N 3.49Å; L217-L220 PolarHBondContact O-N 2.86Å; L217-Q221 WeakPolarHBondContact O-CB 3.49Å; L217-Q221 VanDerWaalsContact O-CG 3.25Å; L217-Q221 WeakPolarHBondContact O-CG 3.34Å; L217-Q221 PolarHBondContact O-N 2.91Å; L217-Q221 VanDerWaalsContact O-N 3.07Å; L217-L254 HydrophobicContact CD1-CD2 4Å; L217-L254 HydrophobicContact CD2-CD2 3.56Å; L217-L254 HydrophobicContact CG-CD2 3.64Å; L217-R257 HydrophobicContact CD1-CB 3.46Å; L217-R257 VanDerWaalsContact CD1-CB 3.46Å; L217-R257 HydrophobicContact CD1-CG 3.74Å; L217-L259 HydrophobicContact CD2-CB 3.74Å; L217-L259 HydrophobicContact CD2-CD1 3.85Å; L217-L259 HydrophobicContact CD2-CD2 3.91Å; L217-L259 HydrophobicContact CD2-CG 4.01Å
218	V	93.2	Very high	91.5	Very high	59 Å²	59	48.7 Å²	48.7	36%	0.358	25%	0.254	S	S	.	.	H	α-helix	trans	-58.1	-45.5	176	169.1	0	0	0	0	110.8	L180 D214 R215 L216 L220 Q221 V222	L180-V218 HydrophobicContact CD1-CG1 3.78Å; L180-V218 HydrophobicContact CG-CG1 4.32Å; D214-V218 WeakPolarHBondContact O-CG2 3.31Å; D214-V218 PolarHBondContact O-N 3.49Å; D214-V218 VanDerWaalsContact O-N 3.09Å; R215-V218 PolarHBondContact O-N 2.94Å; L216-V218 PolarHBondContact O-N 3.33Å; V218-L220 PolarHBondContact O-N 2.91Å; V218-Q221 PolarHBondContact O-N 2.69Å; V218-V222 WeakPolarHBondContact O-CG1 3.26Å
219	H	92.4	Very high	91.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-34.6	178	-70.3	-49.3	0	0	0	113.7	V176 L180 Q186 R215 L216 L217 Q221 V222 L227 A231	V176-H219 PolarHBondContact O-NE2 3.34Å; L180-H219 VanDerWaalsContact CD2-ND1 3.32Å; L180-H219 WeakPolarHBondContact CD2-ND1 3.31Å; Q186-H219 PolarHBondContact NE2-CE1 2.79Å; R215-H219 PolarHBondContact NH2-CE1 3.39Å; R215-H219 PolarHBondContact O-CD2 2.77Å; R215-H219 VanDerWaalsContact O-CD2 3.25Å; R215-H219 PolarHBondContact O-N 3.42Å; R215-H219 VanDerWaalsContact O-N 3.12Å; L216-H219 PolarHBondContact O-N 3.27Å; L217-H219 VanDerWaalsContact C-N 3.32Å; L217-H219 PolarHBondContact O-N 3.49Å; H219-Q221 VanDerWaalsContact C-N 3.27Å; H219-Q221 PolarHBondContact O-N 3.44Å; H219-V222 WeakPolarHBondContact O-CG2 3.47Å; H219-L227 HydrophobicContact CB-CG 4.48Å; H219-A231 HydrophobicContact CB-CB 3.63Å
220	L	92.3	Very high	91.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-24.5	175.5	-73.4	169.7	0	0	0	112.5	L216 L217 V218 Q228 A231 M232 L235 L259 F262	L216-L220 WeakPolarHBondContact O-CB 3.34Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.45Å; L216-L220 PolarHBondContact O-N 3Å; L217-L220 PolarHBondContact O-N 2.86Å; V218-L220 PolarHBondContact O-N 2.91Å; L220-Q228 WeakPolarHBondContact CD2-O 3.34Å; L220-Q228 WeakPolarHBondContact O-CG 3.32Å; L220-Q228 PolarHBondContact O-NE2 2.9Å; L220-A231 HydrophobicContact CD2-CB 3.97Å; L220-A231 HydrophobicContact CG-CB 4.04Å; L220-M232 HydrophobicContact CD1-CE 4.39Å; L220-M232 HydrophobicContact CD2-CB 3.85Å; L220-M232 HydrophobicContact CD2-CE 3.82Å; L220-M232 HydrophobicContact CD2-SD 4.37Å; L220-L235 HydrophobicContact CD1-CD2 3.96Å; L220-L259 HydrophobicContact CD1-CD1 3.84Å; L220-L259 HydrophobicContact CD1-CD2 4.29Å; L220-F262 WeakPolarHBondContact O-CE1 3.46Å; L220-F262 WeakPolarHBondContact O-CZ 3.34Å
221	Q	91	Very high	91.6	Very high	84 Å²	84	41.2 Å²	41.2	39%	0.393	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-1	-175.1	-70.3	179	-18.7	0	0	114.7	L217 V218 H219 F262	L217-Q221 WeakPolarHBondContact O-CB 3.49Å; L217-Q221 VanDerWaalsContact O-CG 3.25Å; L217-Q221 WeakPolarHBondContact O-CG 3.34Å; L217-Q221 PolarHBondContact O-N 2.91Å; L217-Q221 VanDerWaalsContact O-N 3.07Å; V218-Q221 PolarHBondContact O-N 2.69Å; H219-Q221 VanDerWaalsContact C-N 3.27Å; H219-Q221 PolarHBondContact O-N 3.44Å; Q221-F262 HydrophobicContact CB-CE2 4.05Å; Q221-F262 HydrophobicContact CB-CZ 4.15Å; Q221-F262 HydrophobicContact CG-CD1 4.26Å; Q221-F262 HydrophobicContact CG-CD2 3.77Å; Q221-F262 HydrophobicContact CG-CE1 4.22Å; Q221-F262 HydrophobicContact CG-CE2 3.72Å; Q221-F262 HydrophobicContact CG-CG 4.06Å; Q221-F262 HydrophobicContact CG-CZ 3.98Å
222	V	88.1	Confident	91.7	Very high	26 Å²	26	41 Å²	41	16%	0.158	21%	0.209	C	C	.	.	S	Bend	trans	-75.6	159.9	174.5	-56.3	0	0	0	0	112.1	L180 V218 H219 N224 L227 Q228	L180-V222 HydrophobicContact CD1-CG1 3.58Å; L180-V222 HydrophobicContact CD2-CG1 4.14Å; V218-V222 WeakPolarHBondContact O-CG1 3.26Å; H219-V222 WeakPolarHBondContact O-CG2 3.47Å; V222-N224 VanDerWaalsContact C-N 3.3Å; V222-N224 HydrophobicContact CG2-CB 4.19Å; V222-N224 PolarHBondContact O-N 3.32Å; V222-L227 HydrophobicContact CG1-CD2 4.38Å; V222-L227 HydrophobicContact CG2-CB 4.15Å; V222-L227 HydrophobicContact CG2-CD2 3.78Å; V222-L227 HydrophobicContact CG2-CG 4.01Å; V222-Q228 HydrophobicContact CG2-CG 3.98Å; V222-Q228 WeakPolarHBondContact O-CG 3.49Å; V222-Q228 PolarHBondContact O-NE2 3.32Å
223	M	83.4	Confident	91.7	Very high	160 Å²	160	38 Å²	38	79%	0.788	19%	0.19	S	C	*	.	S	Bend	trans	-78	-12.7	176.7	-63.2	-64.3	128.6	0	0	113.9	Q225	M223-Q225 PolarHBondContact O-N 3.41Å
224	N	87.1	Confident	91.8	Very high	59 Å²	59	36.6 Å²	36.6	32%	0.316	18%	0.183	S	C	.	.			trans	-77.3	105.4	-179.5	-179.2	-31.4	0	0	0	110.4	V222 Q226 L227 Q228	V222-N224 VanDerWaalsContact C-N 3.3Å; V222-N224 HydrophobicContact CG2-CB 4.19Å; V222-N224 PolarHBondContact O-N 3.32Å; N224-Q226 VanDerWaalsContact C-N 3.32Å; N224-Q226 PolarHBondContact O-N 2.98Å; N224-Q226 WeakPolarHBondContact OD1-CB 3.44Å; N224-Q226 PolarHBondContact OD1-N 3.3Å; N224-L227 HydrophobicContact CB-CB 4.06Å; N224-L227 PolarHBondContact O-N 2.94Å; N224-L227 PolarHBondContact OD1-N 2.93Å; N224-Q228 WeakPolarHBondContact O-CG 3.45Å; N224-Q228 PolarHBondContact O-N 2.64Å
225	Q	87.2	Confident	92	Very high	92 Å²	92	33.2 Å²	33.2	43%	0.43	16%	0.164	S	C	.	.	H	α-helix	trans	-60.9	-35.4	-177.5	-67.6	-173.1	-8.9	0	0	114	M223 Q228 T229	M223-Q225 PolarHBondContact O-N 3.41Å; Q225-Q228 PolarHBondContact O-N 2.94Å; Q225-T229 WeakPolarHBondContact O-CB 3.32Å; Q225-T229 PolarHBondContact O-N 2.83Å; Q225-T229 PolarHBondContact O-OG1 3.38Å
226	Q	87.3	Confident	92.1	Very high	122 Å²	122	31.8 Å²	31.8	57%	0.57	16%	0.16	S	C	*	.	H	α-helix	trans	-65.2	-45.7	177.9	-170.9	-175.5	3.6	0	0	110.2	N224 T229 K230	N224-Q226 VanDerWaalsContact C-N 3.32Å; N224-Q226 PolarHBondContact O-N 2.98Å; N224-Q226 WeakPolarHBondContact OD1-CB 3.44Å; N224-Q226 PolarHBondContact OD1-N 3.3Å; Q226-T229 PolarHBondContact O-N 3.37Å; Q226-K230 WeakPolarHBondContact O-CG 3.4Å; Q226-K230 PolarHBondContact O-N 3.43Å
227	L	90.5	Very high	92.1	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-63.4	-43.6	175.8	-179.8	56.2	0	0	0	111.6	L180 Q186 P187 L190 H219 V222 N224 T229 K230 A231	L180-L227 HydrophobicContact CD2-CD2 4.09Å; Q186-L227 HydrophobicContact CB-CD1 4Å; P187-L227 HydrophobicContact CG-CB 4.3Å; P187-L227 HydrophobicContact CG-CD1 4.07Å; L190-L227 HydrophobicContact CD1-CD1 3.44Å; L190-L227 VanDerWaalsContact CD1-CD1 3.44Å; H219-L227 HydrophobicContact CB-CG 4.48Å; V222-L227 HydrophobicContact CG1-CD2 4.38Å; V222-L227 HydrophobicContact CG2-CB 4.15Å; V222-L227 HydrophobicContact CG2-CD2 3.78Å; V222-L227 HydrophobicContact CG2-CG 4.01Å; N224-L227 HydrophobicContact CB-CB 4.06Å; N224-L227 PolarHBondContact O-N 2.94Å; N224-L227 PolarHBondContact OD1-N 2.93Å; L227-T229 VanDerWaalsContact C-N 3.31Å; L227-T229 PolarHBondContact O-N 3.48Å; L227-K230 PolarHBondContact O-N 2.95Å; L227-A231 VanDerWaalsContact O-CB 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.3Å; L227-A231 PolarHBondContact O-N 3.49Å
228	Q	91.8	Very high	92.2	Very high	18 Å²	18	31.7 Å²	31.7	8%	0.084	16%	0.159	C	C	.	.	H	α-helix	trans	-57.7	-44.5	174.9	-70.2	-178.8	-53	0	0	111.6	L220 V222 N224 Q225 A231 M232 M278	L220-Q228 WeakPolarHBondContact CD2-O 3.34Å; L220-Q228 WeakPolarHBondContact O-CG 3.32Å; L220-Q228 PolarHBondContact O-NE2 2.9Å; V222-Q228 HydrophobicContact CG2-CG 3.98Å; V222-Q228 WeakPolarHBondContact O-CG 3.49Å; V222-Q228 PolarHBondContact O-NE2 3.32Å; N224-Q228 WeakPolarHBondContact O-CG 3.45Å; N224-Q228 PolarHBondContact O-N 2.64Å; Q225-Q228 PolarHBondContact O-N 2.94Å; Q228-A231 PolarHBondContact O-N 3.24Å; Q228-M232 WeakPolarHBondContact O-CB 3.23Å; Q228-M232 PolarHBondContact O-N 2.94Å; Q228-M278 HydrophobicContact CB-CE 4.08Å
229	T	92.6	Very high	92.3	Very high	17 Å²	17	28.9 Å²	28.9	10%	0.104	14%	0.142	C	C	.	.	H	α-helix	trans	-65.2	-48.8	-178.6	-53.8	0	0	0	0	110.9	Q225 Q226 L227 A231 M232 A233 E277 M278	Q225-T229 WeakPolarHBondContact O-CB 3.32Å; Q225-T229 PolarHBondContact O-N 2.83Å; Q225-T229 PolarHBondContact O-OG1 3.38Å; Q226-T229 PolarHBondContact O-N 3.37Å; L227-T229 VanDerWaalsContact C-N 3.31Å; L227-T229 PolarHBondContact O-N 3.48Å; T229-A231 VanDerWaalsContact C-N 3.3Å; T229-A231 PolarHBondContact O-N 2.86Å; T229-M232 PolarHBondContact O-N 3.36Å; T229-M232 VanDerWaalsContact O-N 3.13Å; T229-A233 WeakPolarHBondContact O-CB 3.17Å; T229-A233 PolarHBondContact O-N 2.9Å; T229-E277 HydrophobicContact CG2-CB 3.82Å; T229-E277 HydrophobicContact CG2-CG 3.53Å; T229-E277 VanDerWaalsContact CG2-OE2 3.23Å; T229-E277 WeakPolarHBondContact CG2-OE2 3.36Å; T229-M278 HydrophobicContact CG2-CB 4.37Å
230	K	93.3	Very high	92.3	Very high	11 Å²	11	31.8 Å²	31.8	5%	0.048	16%	0.156	C	C	.	.	H	α-helix	trans	-66.8	-29.7	177.6	-56.8	-51.8	172.6	-171.1	0	113	P187 L190 Q226 L227 A233 L234 E277	P187-K230 HydrophobicContact CB-CG 4.39Å; L190-K230 HydrophobicContact CB-CB 3.99Å; L190-K230 HydrophobicContact CD1-CB 4.38Å; Q226-K230 WeakPolarHBondContact O-CG 3.4Å; Q226-K230 PolarHBondContact O-N 3.43Å; L227-K230 PolarHBondContact O-N 2.95Å; K230-A233 WeakPolarHBondContact O-CB 3.26Å; K230-A233 PolarHBondContact O-N 3.49Å; K230-L234 PolarHBondContact O-N 3.22Å; K230-L234 VanDerWaalsContact O-N 3.09Å; K230-E277 IonicContact NZ-OE1 3.74Å; K230-E277 PolarHBondContact NZ-OE1 3.21Å; K230-E277 IonicContact NZ-OE2 2.73Å; K230-E277 PolarHBondContact NZ-OE2 3.45Å
231	A	95.4	Very high	92.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.4	-39.7	171.9	0	0	0	0	0	112.1	L190 H219 L220 L227 Q228 T229 A233 L235	L190-A231 HydrophobicContact CD1-CB 4.1Å; H219-A231 HydrophobicContact CB-CB 3.63Å; L220-A231 HydrophobicContact CD2-CB 3.97Å; L220-A231 HydrophobicContact CG-CB 4.04Å; L227-A231 VanDerWaalsContact O-CB 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.3Å; L227-A231 PolarHBondContact O-N 3.49Å; Q228-A231 PolarHBondContact O-N 3.24Å; T229-A231 VanDerWaalsContact C-N 3.3Å; T229-A231 PolarHBondContact O-N 2.86Å; A231-A233 VanDerWaalsContact C-N 3.35Å; A231-L235 WeakPolarHBondContact O-CB 3.41Å; A231-L235 PolarHBondContact O-N 3Å
232	M	96	Very high	92.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.1	-37.3	173.8	-168.4	65.5	78.4	0	0	111.4	L220 Q228 T229 L235 T236 I263 I267 M278 H281 L282 L285	L220-M232 HydrophobicContact CD1-CE 4.39Å; L220-M232 HydrophobicContact CD2-CB 3.85Å; L220-M232 HydrophobicContact CD2-CE 3.82Å; L220-M232 HydrophobicContact CD2-SD 4.37Å; Q228-M232 WeakPolarHBondContact O-CB 3.23Å; Q228-M232 PolarHBondContact O-N 2.94Å; T229-M232 PolarHBondContact O-N 3.36Å; T229-M232 VanDerWaalsContact O-N 3.13Å; M232-L235 PolarHBondContact O-N 3.32Å; M232-L235 HydrophobicContact SD-CD2 4.01Å; M232-T236 HydrophobicContact CG-CG2 4.41Å; M232-T236 WeakPolarHBondContact O-CG2 3.5Å; M232-T236 PolarHBondContact O-N 2.81Å; M232-T236 PolarHBondContact O-OG1 3.44Å; M232-I263 HydrophobicContact CE-CD1 3.96Å; M232-I263 HydrophobicContact CE-CG1 4.07Å; M232-I267 HydrophobicContact CE-CD1 4.16Å; M232-M278 HydrophobicContact CB-CE 4.24Å; M232-M278 HydrophobicContact CB-SD 4.18Å; M232-M278 HydrophobicContact CE-SD 4.44Å; M232-M278 HydrophobicContact CG-SD 4.13Å; M232-H281 HydrophobicContact CB-CB 4.35Å; M232-H281 HydrophobicContact CG-CB 3.55Å; M232-L282 HydrophobicContact CE-CD2 4.16Å; M232-L285 HydrophobicContact SD-CD2 4.12Å
233	A	94.7	Very high	92.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.1	-53.3	174.8	0	0	0	0	0	111	E194 T229 K230 A231 L235 T236 A237 H281	E194-A233 HydrophobicContact CG-CB 4.14Å; T229-A233 WeakPolarHBondContact O-CB 3.17Å; T229-A233 PolarHBondContact O-N 2.9Å; K230-A233 WeakPolarHBondContact O-CB 3.26Å; K230-A233 PolarHBondContact O-N 3.49Å; A231-A233 VanDerWaalsContact C-N 3.35Å; A233-L235 PolarHBondContact O-N 3.09Å; A233-T236 PolarHBondContact O-N 2.91Å; A233-T236 PolarHBondContact O-OG1 2.81Å; A233-A237 WeakPolarHBondContact O-CB 3.32Å; A233-A237 PolarHBondContact O-N 2.87Å; A233-H281 VanDerWaalsContact CA-NE2 3.33Å; A233-H281 WeakPolarHBondContact CA-NE2 3.48Å; A233-H281 WeakPolarHBondContact CB-NE2 3.34Å; A233-H281 PolarHBondContact N-CD2 3.46Å
234	L	96.8	Very high	92.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.6	-42	176.5	179.5	57.9	0	0	0	112	L190 L193 E194 V207 V211 L216 K230 T236 A237 L238	L190-L234 HydrophobicContact CD2-CB 4.31Å; L190-L234 HydrophobicContact CD2-CD2 3.54Å; L193-L234 HydrophobicContact CB-CD1 4.02Å; L193-L234 HydrophobicContact CB-CD2 4.01Å; L193-L234 HydrophobicContact CD1-CD2 4.27Å; E194-L234 HydrophobicContact CB-CD1 4.49Å; V207-L234 HydrophobicContact CG1-CD1 4.15Å; V211-L234 HydrophobicContact CG1-CD2 4.48Å; L216-L234 HydrophobicContact CD2-CD2 4Å; L216-L234 HydrophobicContact CD2-CG 4.38Å; K230-L234 PolarHBondContact O-N 3.22Å; K230-L234 VanDerWaalsContact O-N 3.09Å; L234-T236 PolarHBondContact O-N 3.34Å; L234-A237 PolarHBondContact O-N 3.28Å; L234-L238 HydrophobicContact CD1-CD1 4.31Å; L234-L238 HydrophobicContact CD1-CG 4.09Å; L234-L238 HydrophobicContact CG-CD1 4.15Å; L234-L238 HydrophobicContact CG-CG 4.4Å; L234-L238 VanDerWaalsContact O-CG 3.27Å; L234-L238 WeakPolarHBondContact O-CG 3.28Å; L234-L238 PolarHBondContact O-N 3.41Å
235	L	97.3	Very high	93.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.9	-50	176.8	173.8	60	0	0	0	111.3	L213 L216 L220 A231 M232 A233 A237 L238 L239 L254 L259	L213-L235 HydrophobicContact CD2-CD1 4.44Å; L216-L235 HydrophobicContact CD1-CB 4.3Å; L216-L235 HydrophobicContact CD1-CD1 4.29Å; L220-L235 HydrophobicContact CD1-CD2 3.96Å; A231-L235 WeakPolarHBondContact O-CB 3.41Å; A231-L235 PolarHBondContact O-N 3Å; M232-L235 PolarHBondContact O-N 3.32Å; M232-L235 HydrophobicContact SD-CD2 4.01Å; A233-L235 PolarHBondContact O-N 3.09Å; L235-A237 PolarHBondContact O-N 3.16Å; L235-L238 PolarHBondContact O-N 3.34Å; L235-L239 HydrophobicContact CD1-CD1 4.07Å; L235-L239 HydrophobicContact CD1-CG 4.2Å; L235-L239 HydrophobicContact CG-CD1 4.13Å; L235-L239 VanDerWaalsContact O-CG 3.26Å; L235-L239 WeakPolarHBondContact O-CG 3.35Å; L235-L239 PolarHBondContact O-N 3.08Å; L235-L254 HydrophobicContact CD1-CD1 3.56Å; L235-L254 HydrophobicContact CD2-CD1 4.24Å; L235-L259 HydrophobicContact CD2-CD2 3.92Å
236	T	95.6	Very high	93.5	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-65.6	-38	179.8	54.8	0	0	0	0	111.9	M232 A233 L234 L238 L239 Q240 H281 V284 L285	M232-T236 HydrophobicContact CG-CG2 4.41Å; M232-T236 WeakPolarHBondContact O-CG2 3.5Å; M232-T236 PolarHBondContact O-N 2.81Å; M232-T236 PolarHBondContact O-OG1 3.44Å; A233-T236 PolarHBondContact O-N 2.91Å; A233-T236 PolarHBondContact O-OG1 2.81Å; L234-T236 PolarHBondContact O-N 3.34Å; T236-L238 PolarHBondContact O-N 3.06Å; T236-L239 PolarHBondContact O-N 3.42Å; T236-Q240 WeakPolarHBondContact O-CG 3.42Å; T236-Q240 PolarHBondContact O-N 3.35Å; T236-H281 HydrophobicContact CG2-CB 4.19Å; T236-V284 HydrophobicContact CG2-CB 4.45Å; T236-V284 HydrophobicContact CG2-CG1 4.23Å; T236-L285 HydrophobicContact CG2-CB 4.32Å
237	A	94.6	Very high	93.9	Very high	2 Å²	2	23.3 Å²	23.3	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-45	173.2	0	0	0	0	0	112.6	E194 T197 L198 A233 L234 L235 L239 Q240 G241	E194-A237 HydrophobicContact CG-CB 4.09Å; T197-A237 HydrophobicContact CG2-CB 4.15Å; L198-A237 HydrophobicContact CD1-CB 4.2Å; L198-A237 HydrophobicContact CD2-CB 3.86Å; L198-A237 HydrophobicContact CG-CB 3.89Å; A233-A237 WeakPolarHBondContact O-CB 3.32Å; A233-A237 PolarHBondContact O-N 2.87Å; L234-A237 PolarHBondContact O-N 3.28Å; L235-A237 PolarHBondContact O-N 3.16Å; A237-L239 VanDerWaalsContact C-N 3.33Å; A237-L239 PolarHBondContact O-N 3.47Å; A237-Q240 PolarHBondContact O-N 3.03Å; A237-G241 PolarHBondContact O-N 3.41Å
238	L	95.6	Very high	94.1	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-62.2	-40.4	176.1	-69.3	172	0	0	0	111.8	T197 V207 K208 L216 L234 L235 T236 G241 A242 M250	T197-L238 HydrophobicContact CG2-CD2 3.93Å; V207-L238 HydrophobicContact CB-CD2 4.46Å; V207-L238 HydrophobicContact CG1-CD2 4.12Å; K208-L238 HydrophobicContact CB-CD2 3.81Å; K208-L238 HydrophobicContact CG-CD2 4.27Å; L216-L238 HydrophobicContact CD1-CD1 3.86Å; L234-L238 HydrophobicContact CD1-CD1 4.31Å; L234-L238 HydrophobicContact CD1-CG 4.09Å; L234-L238 HydrophobicContact CG-CD1 4.15Å; L234-L238 HydrophobicContact CG-CG 4.4Å; L234-L238 VanDerWaalsContact O-CG 3.27Å; L234-L238 WeakPolarHBondContact O-CG 3.28Å; L234-L238 PolarHBondContact O-N 3.41Å; L235-L238 PolarHBondContact O-N 3.34Å; T236-L238 PolarHBondContact O-N 3.06Å; L238-G241 PolarHBondContact O-N 3.22Å; L238-A242 WeakPolarHBondContact O-CB 3.45Å; L238-A242 PolarHBondContact O-N 3.3Å; L238-A242 VanDerWaalsContact O-N 3.11Å; L238-M250 HydrophobicContact CB-CE 4.07Å
239	L	95.3	Very high	94.3	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.8	-34.5	178	-66.5	174.2	0	0	0	112.8	L235 T236 A237 A242 R247 M250 L251 L285 L288	L235-L239 HydrophobicContact CD1-CD1 4.07Å; L235-L239 HydrophobicContact CD1-CG 4.2Å; L235-L239 HydrophobicContact CG-CD1 4.13Å; L235-L239 VanDerWaalsContact O-CG 3.26Å; L235-L239 WeakPolarHBondContact O-CG 3.35Å; L235-L239 PolarHBondContact O-N 3.08Å; T236-L239 PolarHBondContact O-N 3.42Å; A237-L239 VanDerWaalsContact C-N 3.33Å; A237-L239 PolarHBondContact O-N 3.47Å; L239-A242 PolarHBondContact O-N 3.11Å; L239-R247 HydrophobicContact CB-CG 4.48Å; L239-R247 HydrophobicContact CD2-CG 4.12Å; L239-R247 PolarHBondContact O-NE 3.16Å; L239-R247 PolarHBondContact O-NH2 3.12Å; L239-M250 HydrophobicContact CD2-CB 3.84Å; L239-M250 HydrophobicContact CD2-CE 3.8Å; L239-M250 HydrophobicContact CD2-SD 4.02Å; L239-L251 HydrophobicContact CD1-CD2 3.48Å; L239-L251 VanDerWaalsContact CD1-CD2 3.48Å; L239-L251 HydrophobicContact CD2-CD2 3.52Å; L239-L251 HydrophobicContact CG-CD2 4.11Å; L239-L285 HydrophobicContact CD1-CD1 3.7Å; L239-L288 HydrophobicContact CB-CD1 3.71Å
240	Q	92.4	Very high	94.5	Very high	61 Å²	61	34 Å²	34	29%	0.285	20%	0.195	S	C	.	.	H	α-helix	trans	-65.1	-42.6	173.1	-75.4	-179.2	-28.5	0	0	111.4	T236 A237 A242 V284 L288	T236-Q240 WeakPolarHBondContact O-CG 3.42Å; T236-Q240 PolarHBondContact O-N 3.35Å; A237-Q240 PolarHBondContact O-N 3.03Å; Q240-A242 VanDerWaalsContact C-N 3.32Å; Q240-A242 PolarHBondContact O-N 3.29Å; Q240-V284 HydrophobicContact CG-CG1 4.33Å; Q240-L288 HydrophobicContact CG-CD1 3.97Å; Q240-L288 HydrophobicContact CG-CD2 4.2Å
241	G	89.3	Confident	94.6	Very high	48 Å²	48	33.7 Å²	33.7	50%	0.495	19%	0.193	S	C	.	.	H	α-helix	trans	-76.5	-10.7	178.3	0	0	0	0	0	115.4	A237 L238	A237-G241 PolarHBondContact O-N 3.41Å; L238-G241 PolarHBondContact O-N 3.22Å
242	A	92.2	Very high	94.6	Very high	5 Å²	5	37.3 Å²	37.3	4%	0.041	21%	0.213	C	C	.	.	S	Bend	trans	-82.9	146.9	179.6	0	0	0	0	0	112.6	L238 L239 Q240 E246 R247 M250	L238-A242 WeakPolarHBondContact O-CB 3.45Å; L238-A242 PolarHBondContact O-N 3.3Å; L238-A242 VanDerWaalsContact O-N 3.11Å; L239-A242 PolarHBondContact O-N 3.11Å; Q240-A242 VanDerWaalsContact C-N 3.32Å; Q240-A242 PolarHBondContact O-N 3.29Å; A242-E246 HydrophobicContact CB-CB 4.14Å; A242-R247 HydrophobicContact CB-CB 4.22Å; A242-R247 PolarHBondContact O-NH2 3.47Å; A242-M250 HydrophobicContact CB-SD 4.14Å
243	S	92.3	Very high	94.6	Very high	60 Å²	60	40.1 Å²	40.1	42%	0.42	22%	0.223	S	C	.	.			trans	-64.1	160.6	167.7	66.3	0	0	0	0	110.9	A245 E246 R247	S243-A245 VanDerWaalsContact C-N 3.25Å; S243-A245 PolarHBondContact O-N 3.33Å; S243-E246 WeakPolarHBondContact CB-OE2 3.42Å; S243-E246 PolarHBondContact N-OE2 3.45Å; S243-E246 PolarHBondContact O-N 3.15Å; S243-E246 VanDerWaalsContact OG-CD 3.26Å; S243-E246 VanDerWaalsContact OG-CG 3.22Å; S243-E246 WeakPolarHBondContact OG-CG 3.3Å; S243-E246 PolarHBondContact OG-N 3.37Å; S243-E246 PolarHBondContact OG-OE2 3.48Å; S243-R247 VanDerWaalsContact O-CB 3.27Å; S243-R247 WeakPolarHBondContact O-CB 3.32Å; S243-R247 PolarHBondContact O-N 2.76Å
244	T	91.5	Very high	94.7	Very high	62 Å²	62	40.1 Å²	40.1	38%	0.38	22%	0.224	S	C	.	.	H	α-helix	trans	-57.6	-37.1	-178	-49.7	0	0	0	0	113.3	K248 L292 P295	T244-K248 WeakPolarHBondContact O-CB 3.39Å; T244-K248 PolarHBondContact O-N 2.91Å; T244-L292 HydrophobicContact CG2-CD2 3.95Å; T244-P295 HydrophobicContact CG2-CG 3.78Å
245	A	94.3	Very high	94.5	Very high	79 Å²	79	41.8 Å²	41.8	65%	0.653	23%	0.23	S	C	*	.	H	α-helix	trans	-69.8	-46.1	178.9	0	0	0	0	0	112	S243 K248 H249	S243-A245 VanDerWaalsContact C-N 3.25Å; S243-A245 PolarHBondContact O-N 3.33Å; A245-K248 PolarHBondContact O-N 3.46Å; A245-H249 PolarHBondContact O-N 3.22Å; A245-H249 VanDerWaalsContact O-N 3.11Å
246	E	94.7	Very high	94.4	Very high	77 Å²	77	48.9 Å²	48.9	36%	0.36	26%	0.263	S	S	.	.	H	α-helix	trans	-64.3	-44.1	176.5	-68.2	170	126.4	0	0	111.4	K208 A242 S243 K248 H249 M250	K208-E246 IonicContact NZ-OE1 3.79Å; K208-E246 PolarHBondContact NZ-OE1 2.94Å; K208-E246 IonicContact NZ-OE2 3.49Å; K208-E246 PolarHBondContact NZ-OE2 3.19Å; A242-E246 HydrophobicContact CB-CB 4.14Å; S243-E246 WeakPolarHBondContact CB-OE2 3.42Å; S243-E246 PolarHBondContact N-OE2 3.45Å; S243-E246 PolarHBondContact O-N 3.15Å; S243-E246 VanDerWaalsContact OG-CD 3.26Å; S243-E246 VanDerWaalsContact OG-CG 3.22Å; S243-E246 WeakPolarHBondContact OG-CG 3.3Å; S243-E246 PolarHBondContact OG-N 3.37Å; S243-E246 PolarHBondContact OG-OE2 3.48Å; E246-K248 VanDerWaalsContact C-N 3.31Å; E246-K248 PolarHBondContact O-N 2.96Å; E246-H249 WeakPolarHBondContact O-CB 3.48Å; E246-H249 PolarHBondContact O-N 2.95Å; E246-H249 VanDerWaalsContact O-N 3.11Å; E246-M250 WeakPolarHBondContact O-CG 3.45Å; E246-M250 PolarHBondContact O-N 2.9Å
247	R	95.5	Very high	94.3	Very high	35 Å²	35	54.9 Å²	54.9	13%	0.132	29%	0.285	C	S	.	.	H	α-helix	trans	-55.2	-49.7	176.6	-172.6	-174.5	-58.4	137.3	7.8	110.2	L239 A242 S243 H249 M250 L251 L292	L239-R247 HydrophobicContact CB-CG 4.48Å; L239-R247 HydrophobicContact CD2-CG 4.12Å; L239-R247 PolarHBondContact O-NE 3.16Å; L239-R247 PolarHBondContact O-NH2 3.12Å; A242-R247 HydrophobicContact CB-CB 4.22Å; A242-R247 PolarHBondContact O-NH2 3.47Å; S243-R247 VanDerWaalsContact O-CB 3.27Å; S243-R247 WeakPolarHBondContact O-CB 3.32Å; S243-R247 PolarHBondContact O-N 2.76Å; R247-H249 VanDerWaalsContact C-N 3.34Å; R247-H249 PolarHBondContact O-N 3.24Å; R247-M250 PolarHBondContact O-N 3.31Å; R247-L251 HydrophobicContact CG-CG 4.45Å; R247-L251 VanDerWaalsContact O-CG 3.31Å; R247-L251 WeakPolarHBondContact O-CG 3.36Å; R247-L251 PolarHBondContact O-N 3.4Å; R247-L292 HydrophobicContact CB-CD2 4.19Å; R247-L292 HydrophobicContact CG-CD2 4.09Å
248	K	95.4	Very high	94.2	Very high	118 Å²	118	59.2 Å²	59.2	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-55.2	-48.4	176	-178.3	179.1	176.8	-177	0	111.6	T244 A245 E246 M250 L251 D252 L292	T244-K248 WeakPolarHBondContact O-CB 3.39Å; T244-K248 PolarHBondContact O-N 2.91Å; A245-K248 PolarHBondContact O-N 3.46Å; E246-K248 VanDerWaalsContact C-N 3.31Å; E246-K248 PolarHBondContact O-N 2.96Å; K248-M250 PolarHBondContact O-N 3.23Å; K248-L251 PolarHBondContact O-N 3.32Å; K248-D252 WeakPolarHBondContact O-CB 3.44Å; K248-D252 VanDerWaalsContact O-CG 3.26Å; K248-D252 PolarHBondContact O-N 2.87Å; K248-L292 HydrophobicContact CB-CD1 4.09Å; K248-L292 HydrophobicContact CB-CD2 4.18Å; K248-L292 HydrophobicContact CG-CD1 4.33Å
249	H	96.4	Very high	94.1	Very high	132 Å²	132	59.1 Å²	59.1	61%	0.611	31%	0.308	S	S	*	.	H	α-helix	trans	-61.3	-44	178.6	179.9	-86.5	0	0	0	112.7	A245 E246 R247 L251 D252 Y253	A245-H249 PolarHBondContact O-N 3.22Å; A245-H249 VanDerWaalsContact O-N 3.11Å; E246-H249 WeakPolarHBondContact O-CB 3.48Å; E246-H249 PolarHBondContact O-N 2.95Å; E246-H249 VanDerWaalsContact O-N 3.11Å; R247-H249 VanDerWaalsContact C-N 3.34Å; R247-H249 PolarHBondContact O-N 3.24Å; H249-L251 VanDerWaalsContact C-N 3.34Å; H249-D252 PolarHBondContact O-N 3.42Å; H249-Y253 WeakPolarHBondContact O-CB 3.47Å; H249-Y253 PolarHBondContact O-N 2.85Å
250	M	96.8	Very high	94	Very high	17 Å²	17	60.8 Å²	60.8	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-42.4	176.2	-67	171.6	70.9	0	0	111.5	K208 L213 L238 L239 A242 E246 R247 K248 L254	K208-M250 HydrophobicContact CD-SD 4.49Å; L213-M250 HydrophobicContact CD1-CB 4.07Å; L213-M250 HydrophobicContact CD1-CG 4.14Å; L213-M250 HydrophobicContact CD2-CE 3.86Å; L238-M250 HydrophobicContact CB-CE 4.07Å; L239-M250 HydrophobicContact CD2-CB 3.84Å; L239-M250 HydrophobicContact CD2-CE 3.8Å; L239-M250 HydrophobicContact CD2-SD 4.02Å; A242-M250 HydrophobicContact CB-SD 4.14Å; E246-M250 WeakPolarHBondContact O-CG 3.45Å; E246-M250 PolarHBondContact O-N 2.9Å; R247-M250 PolarHBondContact O-N 3.31Å; K248-M250 PolarHBondContact O-N 3.23Å; M250-L254 WeakPolarHBondContact O-CD1 3.5Å; M250-L254 VanDerWaalsContact O-CG 3.31Å; M250-L254 WeakPolarHBondContact O-CG 3.22Å; M250-L254 PolarHBondContact O-N 2.96Å
251	L	95.5	Very high	94	Very high	4 Å²	4	62.5 Å²	62.5	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-53	175.6	-54.4	-164.3	0	0	0	110.5	L239 R247 K248 H249 Y253 L254 W255 T289 L292	L239-L251 HydrophobicContact CD1-CD2 3.48Å; L239-L251 VanDerWaalsContact CD1-CD2 3.48Å; L239-L251 HydrophobicContact CD2-CD2 3.52Å; L239-L251 HydrophobicContact CG-CD2 4.11Å; R247-L251 HydrophobicContact CG-CG 4.45Å; R247-L251 VanDerWaalsContact O-CG 3.31Å; R247-L251 WeakPolarHBondContact O-CG 3.36Å; R247-L251 PolarHBondContact O-N 3.4Å; K248-L251 PolarHBondContact O-N 3.32Å; H249-L251 VanDerWaalsContact C-N 3.34Å; L251-Y253 PolarHBondContact O-N 3.1Å; L251-L254 PolarHBondContact O-N 3.19Å; L251-W255 HydrophobicContact CB-CD2 3.95Å; L251-W255 HydrophobicContact CB-CE3 3.65Å; L251-W255 HydrophobicContact CB-CH2 3.45Å; L251-W255 VanDerWaalsContact CB-CH2 3.45Å; L251-W255 HydrophobicContact CB-CZ2 3.8Å; L251-W255 HydrophobicContact CB-CZ3 3.4Å; L251-W255 VanDerWaalsContact CB-CZ3 3.4Å; L251-W255 HydrophobicContact CD1-CH2 3.64Å; L251-W255 HydrophobicContact CD1-CZ2 3.7Å; L251-W255 HydrophobicContact CD1-CZ3 4.45Å; L251-W255 HydrophobicContact CD2-CE3 4.49Å; L251-W255 HydrophobicContact CD2-CH2 3.03Å; L251-W255 HydrophobicContact CD2-CZ2 3.96Å; L251-W255 HydrophobicContact CD2-CZ3 3.39Å; L251-W255 HydrophobicContact CG-CH2 3.45Å; L251-W255 VanDerWaalsContact CG-CH2 3.45Å; L251-W255 HydrophobicContact CG-CZ2 3.96Å; L251-W255 HydrophobicContact CG-CZ3 3.81Å; L251-W255 WeakPolarHBondContact O-CB 3.23Å; L251-W255 PolarHBondContact O-N 3.44Å; L251-T289 HydrophobicContact CD1-CG2 4.29Å; L251-L292 HydrophobicContact CD1-CD1 3.54Å; L251-L292 HydrophobicContact CD1-CG 4.35Å; L251-L292 HydrophobicContact CG-CD1 4.26Å
252	D	95.2	Very high	94.2	Very high	76 Å²	76	61.5 Å²	61.5	41%	0.406	30%	0.304	S	S	.	.	H	α-helix	trans	-52.2	-40.2	180	-69.3	-19.9	0	0	0	111.4	K248 H249 Q256	K248-D252 WeakPolarHBondContact O-CB 3.44Å; K248-D252 VanDerWaalsContact O-CG 3.26Å; K248-D252 PolarHBondContact O-N 2.87Å; H249-D252 PolarHBondContact O-N 3.42Å; D252-Q256 WeakPolarHBondContact O-CG 3.48Å; D252-Q256 PolarHBondContact O-N 3.47Å; D252-Q256 VanDerWaalsContact O-N 3.13Å
253	Y	96.1	Very high	94.3	Very high	58 Å²	58	61.4 Å²	61.4	23%	0.227	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-54.7	173.6	-174.8	-88.5	0	0	0	114	L213 D214 H249 L251 W255 Q256 R257	L213-Y253 HydrophobicContact CB-CD1 3.91Å; L213-Y253 HydrophobicContact CB-CE1 3.93Å; L213-Y253 HydrophobicContact CD1-CD1 3.74Å; L213-Y253 HydrophobicContact CD1-CG 4.23Å; L213-Y253 HydrophobicContact CG-CD1 4.49Å; D214-Y253 PolarHBondContact OD1-OH 2.95Å; D214-Y253 PolarHBondContact OD2-OH 3.22Å; H249-Y253 WeakPolarHBondContact O-CB 3.47Å; H249-Y253 PolarHBondContact O-N 2.85Å; L251-Y253 PolarHBondContact O-N 3.1Å; Y253-W255 PolarHBondContact O-N 2.95Å; Y253-Q256 PolarHBondContact O-N 2.91Å; Y253-R257 HydrophobicContact CE1-CG 4.17Å; Y253-R257 PolarHBondContact O-N 3.14Å; Y253-R257 PolarHBondContact OH-NH2 2.99Å
254	L	95.3	Very high	94.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-28.9	-176.8	-68.5	160.5	0	0	0	111.5	L213 L217 L235 M250 L251 R257 L259	L213-L254 HydrophobicContact CB-CD2 3.93Å; L213-L254 HydrophobicContact CD1-CD2 4.5Å; L213-L254 HydrophobicContact CD1-CG 4.2Å; L213-L254 HydrophobicContact CD2-CD1 4.3Å; L213-L254 HydrophobicContact CD2-CD2 4.28Å; L213-L254 HydrophobicContact CD2-CG 4.47Å; L213-L254 HydrophobicContact CG-CD2 4.46Å; L217-L254 HydrophobicContact CD1-CD2 4Å; L217-L254 HydrophobicContact CD2-CD2 3.56Å; L217-L254 HydrophobicContact CG-CD2 3.64Å; L235-L254 HydrophobicContact CD1-CD1 3.56Å; L235-L254 HydrophobicContact CD2-CD1 4.24Å; M250-L254 WeakPolarHBondContact O-CD1 3.5Å; M250-L254 VanDerWaalsContact O-CG 3.31Å; M250-L254 WeakPolarHBondContact O-CG 3.22Å; M250-L254 PolarHBondContact O-N 2.96Å; L251-L254 PolarHBondContact O-N 3.19Å; L254-R257 CarbonylContact O-C 3.59Å; L254-R257 PolarHBondContact O-N 2.95Å; L254-L259 HydrophobicContact CB-CB 4.35Å; L254-L259 HydrophobicContact CB-CD2 3.94Å; L254-L259 HydrophobicContact CD1-CD2 4.31Å; L254-L259 HydrophobicContact CD2-CD2 4.2Å; L254-L259 HydrophobicContact CG-CD2 4.38Å; L254-L259 VanDerWaalsContact O-CB 3.22Å; L254-L259 WeakPolarHBondContact O-CB 3.24Å; L254-L259 PolarHBondContact O-N 3.34Å; L254-L259 VanDerWaalsContact O-N 3.17Å
255	W	93.9	Very high	94.4	Very high	35 Å²	35	64 Å²	64	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-77.6	-38.7	-177.6	-79.2	-100	0	0	0	110.6	L251 Y253 R257 N258 L285	L251-W255 HydrophobicContact CB-CD2 3.95Å; L251-W255 HydrophobicContact CB-CE3 3.65Å; L251-W255 HydrophobicContact CB-CH2 3.45Å; L251-W255 VanDerWaalsContact CB-CH2 3.45Å; L251-W255 HydrophobicContact CB-CZ2 3.8Å; L251-W255 HydrophobicContact CB-CZ3 3.4Å; L251-W255 VanDerWaalsContact CB-CZ3 3.4Å; L251-W255 HydrophobicContact CD1-CH2 3.64Å; L251-W255 HydrophobicContact CD1-CZ2 3.7Å; L251-W255 HydrophobicContact CD1-CZ3 4.45Å; L251-W255 HydrophobicContact CD2-CE3 4.49Å; L251-W255 HydrophobicContact CD2-CH2 3.03Å; L251-W255 HydrophobicContact CD2-CZ2 3.96Å; L251-W255 HydrophobicContact CD2-CZ3 3.39Å; L251-W255 HydrophobicContact CG-CH2 3.45Å; L251-W255 VanDerWaalsContact CG-CH2 3.45Å; L251-W255 HydrophobicContact CG-CZ2 3.96Å; L251-W255 HydrophobicContact CG-CZ3 3.81Å; L251-W255 WeakPolarHBondContact O-CB 3.23Å; L251-W255 PolarHBondContact O-N 3.44Å; Y253-W255 PolarHBondContact O-N 2.95Å; W255-R257 PolarHBondContact O-N 2.87Å; W255-N258 PolarHBondContact O-N 3.37Å; W255-L285 HydrophobicContact CH2-CD1 4.04Å
256	Q	94.3	Very high	94.2	Very high	149 Å²	149	63.8 Å²	63.8	70%	0.696	29%	0.288	S	S	*	.	H	α-helix	trans	-59.4	-24.8	169	-72.5	168.1	23.5	0	0	112.7	D252 Y253 N258	D252-Q256 WeakPolarHBondContact O-CG 3.48Å; D252-Q256 PolarHBondContact O-N 3.47Å; D252-Q256 VanDerWaalsContact O-N 3.13Å; Y253-Q256 PolarHBondContact O-N 2.91Å; Q256-N258 VanDerWaalsContact C-N 3.3Å
257	R	95	Very high	94.1	Very high	131 Å²	131	60.6 Å²	60.6	49%	0.494	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	17.4	173.9	-64.5	-70.5	-163.1	-133.6	-1.1	113.9	D214 L217 Y253 L254 W255 L259	D214-R257 IonicContact OD1-NE 3.26Å; D214-R257 PolarHBondContact OD1-NE 2.95Å; D214-R257 IonicContact OD1-NH2 3.32Å; L217-R257 HydrophobicContact CD1-CB 3.46Å; L217-R257 VanDerWaalsContact CD1-CB 3.46Å; L217-R257 HydrophobicContact CD1-CG 3.74Å; Y253-R257 HydrophobicContact CE1-CG 4.17Å; Y253-R257 PolarHBondContact O-N 3.14Å; Y253-R257 PolarHBondContact OH-NH2 2.99Å; L254-R257 CarbonylContact O-C 3.59Å; L254-R257 PolarHBondContact O-N 2.95Å; W255-R257 PolarHBondContact O-N 2.87Å; R257-L259 VanDerWaalsContact C-N 3.26Å; R257-L259 PolarHBondContact O-N 3.47Å
258	N	91.9	Very high	93.9	Very high	93 Å²	93	60.6 Å²	60.6	50%	0.497	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	20.3	177.6	-60.6	-50.9	0	0	0	115.5	W255 Q256 R260 Q261 F262	W255-N258 PolarHBondContact O-N 3.37Å; Q256-N258 VanDerWaalsContact C-N 3.3Å; N258-R260 VanDerWaalsContact C-N 3.29Å; N258-R260 PolarHBondContact O-N 3.45Å; N258-Q261 PolarHBondContact O-N 2.83Å; N258-F262 PolarHBondContact O-N 2.94Å
259	L	93.5	Very high	93.6	Very high	1 Å²	1	59 Å²	59	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-58.3	-42.3	178.1	179.7	58.3	0	0	0	112.1	L217 L220 L235 L254 R257 Q261 F262 I263	L217-L259 HydrophobicContact CD2-CB 3.74Å; L217-L259 HydrophobicContact CD2-CD1 3.85Å; L217-L259 HydrophobicContact CD2-CD2 3.91Å; L217-L259 HydrophobicContact CD2-CG 4.01Å; L220-L259 HydrophobicContact CD1-CD1 3.84Å; L220-L259 HydrophobicContact CD1-CD2 4.29Å; L235-L259 HydrophobicContact CD2-CD2 3.92Å; L254-L259 HydrophobicContact CB-CB 4.35Å; L254-L259 HydrophobicContact CB-CD2 3.94Å; L254-L259 HydrophobicContact CD1-CD2 4.31Å; L254-L259 HydrophobicContact CD2-CD2 4.2Å; L254-L259 HydrophobicContact CG-CD2 4.38Å; L254-L259 VanDerWaalsContact O-CB 3.22Å; L254-L259 WeakPolarHBondContact O-CB 3.24Å; L254-L259 PolarHBondContact O-N 3.34Å; L254-L259 VanDerWaalsContact O-N 3.17Å; R257-L259 VanDerWaalsContact C-N 3.26Å; R257-L259 PolarHBondContact O-N 3.47Å; L259-Q261 PolarHBondContact O-N 3.26Å; L259-F262 WeakPolarHBondContact O-CB 3.22Å; L259-F262 PolarHBondContact O-N 2.94Å; L259-F262 VanDerWaalsContact O-N 3.13Å; L259-I263 HydrophobicContact CD1-CD1 4.09Å; L259-I263 HydrophobicContact CD1-CG1 4.02Å; L259-I263 HydrophobicContact CD2-CD1 4.38Å; L259-I263 HydrophobicContact CG-CD1 3.82Å; L259-I263 HydrophobicContact CG-CG1 4.25Å; L259-I263 WeakPolarHBondContact O-CG1 3.33Å; L259-I263 PolarHBondContact O-N 3.29Å
260	R	93.2	Very high	93.3	Very high	35 Å²	35	55.2 Å²	55.2	13%	0.132	26%	0.258	C	S	.	.	H	α-helix	trans	-54.1	-51.2	177.4	177.3	-171	-81.6	129.4	-2.4	111.5	N258 F262 I263 Y264 F433 Q435 D436	N258-R260 VanDerWaalsContact C-N 3.29Å; N258-R260 PolarHBondContact O-N 3.45Å; R260-F262 VanDerWaalsContact C-N 3.32Å; R260-F262 PolarHBondContact O-N 3.28Å; R260-I263 PolarHBondContact O-N 3.05Å; R260-Y264 PolarHBondContact O-N 2.86Å; R260-F433 WeakPolarHBondContact CG-O 3.39Å; R260-Q435 PolarHBondContact NE-O 2.9Å; R260-D436 WeakPolarHBondContact CD-OD1 3.32Å; R260-D436 IonicContact CZ-OD1 3.87Å; R260-D436 IonicContact NE-OD1 2.69Å; R260-D436 IonicContact NH1-OD1 2.83Å; R260-D436 PolarHBondContact NH1-OD1 2.69Å
261	Q	91.6	Very high	92.6	Very high	96 Å²	96	59.7 Å²	59.7	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-66.6	-34.9	178.7	-65.5	-172	7	0	0	112.3	N258 L259 Y264 K265	N258-Q261 PolarHBondContact O-N 2.83Å; L259-Q261 PolarHBondContact O-N 3.26Å; Q261-Y264 PolarHBondContact O-N 3.31Å; Q261-K265 WeakPolarHBondContact O-CB 3.21Å; Q261-K265 WeakPolarHBondContact O-CG 3.47Å; Q261-K265 PolarHBondContact O-N 3.48Å
262	F	93.3	Very high	92	Very high	27 Å²	27	61.4 Å²	61.4	12%	0.118	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-48.3	175.8	-178	-87.2	0	0	0	111.4	L220 Q221 N258 L259 R260 Y264 K265 N266 I267	L220-F262 WeakPolarHBondContact O-CE1 3.46Å; L220-F262 WeakPolarHBondContact O-CZ 3.34Å; Q221-F262 HydrophobicContact CB-CE2 4.05Å; Q221-F262 HydrophobicContact CB-CZ 4.15Å; Q221-F262 HydrophobicContact CG-CD1 4.26Å; Q221-F262 HydrophobicContact CG-CD2 3.77Å; Q221-F262 HydrophobicContact CG-CE1 4.22Å; Q221-F262 HydrophobicContact CG-CE2 3.72Å; Q221-F262 HydrophobicContact CG-CG 4.06Å; Q221-F262 HydrophobicContact CG-CZ 3.98Å; N258-F262 PolarHBondContact O-N 2.94Å; L259-F262 WeakPolarHBondContact O-CB 3.22Å; L259-F262 PolarHBondContact O-N 2.94Å; L259-F262 VanDerWaalsContact O-N 3.13Å; R260-F262 VanDerWaalsContact C-N 3.32Å; R260-F262 PolarHBondContact O-N 3.28Å; F262-Y264 VanDerWaalsContact C-N 3.3Å; F262-Y264 PolarHBondContact O-N 3.22Å; F262-K265 PolarHBondContact O-N 3.48Å; F262-N266 HydrophobicContact CD1-CB 4.41Å; F262-N266 HydrophobicContact CD2-CB 4.23Å; F262-N266 WeakPolarHBondContact CD2-ND2 3.4Å; F262-N266 HydrophobicContact CE1-CB 3.97Å; F262-N266 HydrophobicContact CE2-CB 3.78Å; F262-N266 VanDerWaalsContact CE2-ND2 3.27Å; F262-N266 WeakPolarHBondContact CE2-ND2 3.31Å; F262-N266 HydrophobicContact CZ-CB 3.61Å; F262-N266 WeakPolarHBondContact O-CB 3.28Å; F262-N266 PolarHBondContact O-N 2.85Å; F262-N266 PolarHBondContact O-ND2 3.11Å; F262-I267 HydrophobicContact CE1-CD1 4.35Å; F262-I267 HydrophobicContact CE1-CG1 4.22Å
263	I	94.4	Very high	91.3	Very high	3 Å²	3	63.3 Å²	63.3	2%	0.015	33%	0.329	C	S	.	.	I	π-helix	trans	-55.2	-49.3	174.9	-68.6	166.7	0	0	0	109.6	M232 L259 R260 K265 I267 I268 L282 L285 F433	M232-I263 HydrophobicContact CE-CD1 3.96Å; M232-I263 HydrophobicContact CE-CG1 4.07Å; L259-I263 HydrophobicContact CD1-CD1 4.09Å; L259-I263 HydrophobicContact CD1-CG1 4.02Å; L259-I263 HydrophobicContact CD2-CD1 4.38Å; L259-I263 HydrophobicContact CG-CD1 3.82Å; L259-I263 HydrophobicContact CG-CG1 4.25Å; L259-I263 WeakPolarHBondContact O-CG1 3.33Å; L259-I263 PolarHBondContact O-N 3.29Å; R260-I263 PolarHBondContact O-N 3.05Å; I263-K265 PolarHBondContact O-N 2.93Å; I263-I267 HydrophobicContact CG1-CD1 4.14Å; I263-I267 WeakPolarHBondContact O-CA 3.33Å; I263-I267 WeakPolarHBondContact O-CB 3.48Å; I263-I267 PolarHBondContact O-N 2.89Å; I263-I267 VanDerWaalsContact O-N 3.1Å; I263-I268 HydrophobicContact CG2-CD1 3.89Å; I263-I268 HydrophobicContact CG2-CG1 4.13Å; I263-I268 PolarHBondContact O-N 3.08Å; I263-L282 HydrophobicContact CG2-CD1 4.43Å; I263-L282 HydrophobicContact CG2-CD2 3.6Å; I263-L285 HydrophobicContact CD1-CD2 3.66Å; I263-F433 HydrophobicContact CB-CD1 4.31Å; I263-F433 HydrophobicContact CD1-CD1 4.28Å; I263-F433 HydrophobicContact CD1-CE1 4.29Å; I263-F433 HydrophobicContact CG2-CB 4.41Å; I263-F433 HydrophobicContact CG2-CD1 3.73Å; I263-F433 HydrophobicContact CG2-CE1 4.17Å; I263-F433 HydrophobicContact CG2-CG 4.04Å
264	Y	93.4	Very high	90.8	Very high	47 Å²	47	64 Å²	64	18%	0.184	34%	0.335	C	S	.	.	I	π-helix	trans	-59	-47.6	-179.1	-176.5	-101.6	0	0	0	113.1	R260 Q261 F262 H269 F433 T484	R260-Y264 PolarHBondContact O-N 2.86Å; Q261-Y264 PolarHBondContact O-N 3.31Å; F262-Y264 VanDerWaalsContact C-N 3.3Å; F262-Y264 PolarHBondContact O-N 3.22Å; Y264-H269 AromaticContact CD2-CE1 3.89Å; Y264-H269 AromaticContact CE2-CE1 3.29Å; Y264-H269 WeakPolarHBondContact CE2-CE1 3.31Å; Y264-H269 AromaticContact CE2-ND1 3.85Å; Y264-H269 AromaticContact CZ-CE1 3.38Å; Y264-H269 AromaticContact CZ-ND1 3.87Å; Y264-H269 PolarHBondContact O-N 3.19Å; Y264-H269 PolarHBondContact O-ND1 3.39Å; Y264-F433 WeakPolarHBondContact CB-O 3.45Å; Y264-F433 HydrophobicContact CD2-CB 4.32Å; Y264-T484 VanDerWaalsContact CE2-O 3.26Å; Y264-T484 WeakPolarHBondContact CE2-O 3.45Å; Y264-T484 PolarHBondContact OH-O 2.9Å
265	K	92.1	Very high	90.2	Very high	130 Å²	130	65.8 Å²	65.8	57%	0.565	35%	0.354	S	S	*	.	I	π-helix	trans	-82.8	-42.3	-174.2	-68.3	-178.5	179.9	175.7	0	113.7	Q261 F262 I263	Q261-K265 WeakPolarHBondContact O-CB 3.21Å; Q261-K265 WeakPolarHBondContact O-CG 3.47Å; Q261-K265 PolarHBondContact O-N 3.48Å; F262-K265 PolarHBondContact O-N 3.48Å; I263-K265 PolarHBondContact O-N 2.93Å
266	N	91.4	Very high	89.6	Confident	74 Å²	74	68.6 Å²	68.6	40%	0.396	37%	0.372	S	S	.	.	I	π-helix	trans	-105.5	-16.6	-166.8	-59.6	-74.1	0	0	0	114.1	F262 S270	F262-N266 HydrophobicContact CD1-CB 4.41Å; F262-N266 HydrophobicContact CD2-CB 4.23Å; F262-N266 WeakPolarHBondContact CD2-ND2 3.4Å; F262-N266 HydrophobicContact CE1-CB 3.97Å; F262-N266 HydrophobicContact CE2-CB 3.78Å; F262-N266 VanDerWaalsContact CE2-ND2 3.27Å; F262-N266 WeakPolarHBondContact CE2-ND2 3.31Å; F262-N266 HydrophobicContact CZ-CB 3.61Å; F262-N266 WeakPolarHBondContact O-CB 3.28Å; F262-N266 PolarHBondContact O-N 2.85Å; F262-N266 PolarHBondContact O-ND2 3.11Å; N266-S270 WeakPolarHBondContact O-CB 3.46Å
267	I	92.1	Very high	89	Confident	11 Å²	11	62.5 Å²	62.5	6%	0.056	34%	0.343	C	S	.	.	I	π-helix	trans	-106	-59.2	176.3	-56	-177.8	0	0	0	109.4	M232 F262 I263 S270 M278 L282	M232-I267 HydrophobicContact CE-CD1 4.16Å; F262-I267 HydrophobicContact CE1-CD1 4.35Å; F262-I267 HydrophobicContact CE1-CG1 4.22Å; I263-I267 HydrophobicContact CG1-CD1 4.14Å; I263-I267 WeakPolarHBondContact O-CA 3.33Å; I263-I267 WeakPolarHBondContact O-CB 3.48Å; I263-I267 PolarHBondContact O-N 2.89Å; I263-I267 VanDerWaalsContact O-N 3.1Å; I267-S270 WeakPolarHBondContact O-CB 3.32Å; I267-S270 PolarHBondContact O-N 3.38Å; I267-M278 HydrophobicContact CD1-CE 4.4Å; I267-M278 HydrophobicContact CD1-SD 4.39Å; I267-M278 HydrophobicContact CG2-CG 3.76Å; I267-M278 HydrophobicContact CG2-SD 4Å; I267-L282 HydrophobicContact CG2-CD1 4.09Å
268	I	91.7	Very high	88.9	Confident	35 Å²	35	56.8 Å²	56.8	18%	0.179	32%	0.322	C	S	.	.	I	π-helix	trans	-69.1	-44.3	-174.9	-63.9	172.4	0	0	0	112	I263 L282 F428 P430 F433	I263-I268 HydrophobicContact CG2-CD1 3.89Å; I263-I268 HydrophobicContact CG2-CG1 4.13Å; I263-I268 PolarHBondContact O-N 3.08Å; I268-L282 HydrophobicContact CD1-CD1 4.41Å; I268-L282 HydrophobicContact CG1-CD1 3.86Å; I268-F428 HydrophobicContact CD1-CE2 3.75Å; I268-F428 HydrophobicContact CD1-CZ 4.41Å; I268-F428 HydrophobicContact CG1-CE2 4Å; I268-F428 HydrophobicContact CG1-CZ 4.16Å; I268-P430 HydrophobicContact CG2-CB 4Å; I268-P430 HydrophobicContact CG2-CG 4.26Å; I268-F433 HydrophobicContact CD1-CB 3.78Å; I268-F433 HydrophobicContact CD1-CD2 3.6Å; I268-F433 HydrophobicContact CD1-CE2 4.41Å; I268-F433 HydrophobicContact CD1-CG 3.81Å
269	H	89.6	Confident	88.7	Confident	85 Å²	85	52.7 Å²	52.7	39%	0.394	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	25.1	179.8	-63.7	85.6	0	0	0	112.5	Y264	Y264-H269 AromaticContact CD2-CE1 3.89Å; Y264-H269 AromaticContact CE2-CE1 3.29Å; Y264-H269 WeakPolarHBondContact CE2-CE1 3.31Å; Y264-H269 AromaticContact CE2-ND1 3.85Å; Y264-H269 AromaticContact CZ-CE1 3.38Å; Y264-H269 AromaticContact CZ-ND1 3.87Å; Y264-H269 PolarHBondContact O-N 3.19Å; Y264-H269 PolarHBondContact O-ND1 3.39Å
270	S	88.5	Confident	88.4	Confident	51 Å²	51	54.1 Å²	54.1	36%	0.357	31%	0.308	S	S	.	.			trans	-62.4	152.1	173.1	-168.7	0	0	0	0	111.3	N266 I267 A272	N266-S270 WeakPolarHBondContact O-CB 3.46Å; I267-S270 WeakPolarHBondContact O-CB 3.32Å; I267-S270 PolarHBondContact O-N 3.38Å; S270-A272 VanDerWaalsContact C-N 3.29Å; S270-A272 PolarHBondContact OG-N 3.38Å
271	A	83.9	Confident	88.4	Confident	112 Å²	112	53 Å²	53	93%	0.926	30%	0.304	S	S	*	.	S	Bend	trans	-71	-27.5	173.6	0	0	0	0	0	112.4
272	A	82.8	Confident	88.6	Confident	39 Å²	39	48.4 Å²	48.4	32%	0.322	28%	0.283	S	S	.	.	S	Bend	trans	-85.4	140.6	176.6	0	0	0	0	0	110.3	S270 M274	S270-A272 VanDerWaalsContact C-N 3.29Å; S270-A272 PolarHBondContact OG-N 3.38Å; A272-M274 PolarHBondContact O-N 2.57Å
273	P	80.2	Confident	88.6	Confident	117 Å²	117	49.2 Å²	49.2	76%	0.76	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-61.9	136.3	176.6	27.3	-33.6	0	0	0	110
274	M	85.4	Confident	88.6	Confident	71 Å²	71	49.1 Å²	49.1	35%	0.35	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-73.5	133.2	176.5	176	177.1	58.1	0	0	110	A272 M278 A279 L282 F428	A272-M274 PolarHBondContact O-N 2.57Å; M274-M278 HydrophobicContact CG-CB 3.92Å; M274-M278 HydrophobicContact CG-CG 3.89Å; M274-M278 HydrophobicContact SD-CG 4.03Å; M274-A279 HydrophobicContact CE-CB 3.7Å; M274-A279 HydrophobicContact CG-CB 4.4Å; M274-A279 HydrophobicContact SD-CB 4.08Å; M274-L282 HydrophobicContact SD-CD1 3.68Å; M274-F428 HydrophobicContact CE-CE1 3.66Å; M274-F428 HydrophobicContact CE-CZ 3.84Å; M274-F428 HydrophobicContact SD-CE1 4.27Å; M274-F428 HydrophobicContact SD-CZ 4.3Å
275	G	82.2	Confident	88.7	Confident	40 Å²	40	46.9 Å²	46.9	41%	0.412	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-75	156.5	173.3	0	0	0	0	0	113.2	E277 M278 A279	G275-E277 VanDerWaalsContact C-N 3.31Å; G275-E277 PolarHBondContact O-N 3.19Å; G275-M278 PolarHBondContact O-N 3.32Å; G275-A279 PolarHBondContact O-N 3.03Å
276	D	80.8	Confident	88.8	Confident	93 Å²	93	41.6 Å²	41.6	50%	0.497	25%	0.254	S	S	.	.	H	α-helix	trans	-55.4	-39.2	-178.8	-79.3	23.2	0	0	0	113.9	A279 H280 Q426	D276-A279 PolarHBondContact O-N 3.18Å; D276-H280 WeakPolarHBondContact O-CB 3.4Å; D276-H280 PolarHBondContact O-N 3.29Å; D276-Q426 VanDerWaalsContact CB-NE2 3.28Å; D276-Q426 PolarHBondContact OD2-NE2 3.23Å
277	E	82.6	Confident	88.9	Confident	22 Å²	22	39.2 Å²	39.2	10%	0.103	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-46.3	178.5	-171.7	-175.9	-171.1	0	0	111.2	T229 K230 G275 H280 H281	T229-E277 HydrophobicContact CG2-CB 3.82Å; T229-E277 HydrophobicContact CG2-CG 3.53Å; T229-E277 VanDerWaalsContact CG2-OE2 3.23Å; T229-E277 WeakPolarHBondContact CG2-OE2 3.36Å; K230-E277 IonicContact NZ-OE1 3.74Å; K230-E277 PolarHBondContact NZ-OE1 3.21Å; K230-E277 IonicContact NZ-OE2 2.73Å; K230-E277 PolarHBondContact NZ-OE2 3.45Å; G275-E277 VanDerWaalsContact C-N 3.31Å; G275-E277 PolarHBondContact O-N 3.19Å; E277-H280 WeakPolarHBondContact O-CB 3.46Å; E277-H280 PolarHBondContact O-N 3.31Å; E277-H281 PolarHBondContact O-CD2 3.15Å; E277-H281 PolarHBondContact O-N 3.43Å; E277-H281 IonicContact OE1-NE2 3.74Å
278	M	91.5	Very high	89	Confident	11 Å²	11	39.4 Å²	39.4	5%	0.054	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-42.8	175.6	179.5	60.9	74.8	0	0	111.4	Q228 T229 M232 I267 M274 G275 H280 H281 L282	Q228-M278 HydrophobicContact CB-CE 4.08Å; T229-M278 HydrophobicContact CG2-CB 4.37Å; M232-M278 HydrophobicContact CB-CE 4.24Å; M232-M278 HydrophobicContact CB-SD 4.18Å; M232-M278 HydrophobicContact CE-SD 4.44Å; M232-M278 HydrophobicContact CG-SD 4.13Å; I267-M278 HydrophobicContact CD1-CE 4.4Å; I267-M278 HydrophobicContact CD1-SD 4.39Å; I267-M278 HydrophobicContact CG2-CG 3.76Å; I267-M278 HydrophobicContact CG2-SD 4Å; M274-M278 HydrophobicContact CG-CB 3.92Å; M274-M278 HydrophobicContact CG-CG 3.89Å; M274-M278 HydrophobicContact SD-CG 4.03Å; G275-M278 PolarHBondContact O-N 3.32Å; M278-H280 VanDerWaalsContact C-N 3.3Å; M278-H280 PolarHBondContact O-N 2.88Å; M278-H281 PolarHBondContact O-N 3.25Å; M278-H281 VanDerWaalsContact O-N 3.16Å; M278-L282 WeakPolarHBondContact O-CG 3.36Å; M278-L282 PolarHBondContact O-N 2.94Å; M278-L282 HydrophobicContact SD-CG 4.43Å
279	A	89.8	Confident	89.2	Confident	7 Å²	7	39.6 Å²	39.6	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-58.6	-43.4	177.1	0	0	0	0	0	111.7	M274 G275 D276 L282 Y283 Q426	M274-A279 HydrophobicContact CE-CB 3.7Å; M274-A279 HydrophobicContact CG-CB 4.4Å; M274-A279 HydrophobicContact SD-CB 4.08Å; G275-A279 PolarHBondContact O-N 3.03Å; D276-A279 PolarHBondContact O-N 3.18Å; A279-L282 PolarHBondContact O-N 3.06Å; A279-Y283 PolarHBondContact O-N 3.43Å; A279-Q426 HydrophobicContact CB-CB 4.03Å; A279-Q426 HydrophobicContact CB-CG 4.41Å
280	H	86.8	Confident	89.4	Confident	30 Å²	30	36 Å²	36	14%	0.139	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-45.4	174.3	175.2	62.5	0	0	0	112	D276 E277 M278 L282 Y283 V284 S422 E423 A425 Q426	D276-H280 WeakPolarHBondContact O-CB 3.4Å; D276-H280 PolarHBondContact O-N 3.29Å; E277-H280 WeakPolarHBondContact O-CB 3.46Å; E277-H280 PolarHBondContact O-N 3.31Å; M278-H280 VanDerWaalsContact C-N 3.3Å; M278-H280 PolarHBondContact O-N 2.88Å; H280-L282 VanDerWaalsContact C-N 3.34Å; H280-L282 PolarHBondContact O-N 3.45Å; H280-Y283 WeakPolarHBondContact O-CB 3.42Å; H280-Y283 PolarHBondContact O-N 2.77Å; H280-V284 WeakPolarHBondContact O-CG2 3.19Å; H280-V284 PolarHBondContact O-N 3.21Å; H280-S422 PolarHBondContact CE1-O 3.04Å; H280-S422 VanDerWaalsContact CE1-O 3.32Å; H280-E423 VanDerWaalsContact CE1-C 3.47Å; H280-E423 PolarHBondContact CE1-O 3.41Å; H280-E423 VanDerWaalsContact CE1-O 3.25Å; H280-A425 PolarHBondContact ND1-O 2.9Å; H280-Q426 HydrophobicContact CB-CG 4.38Å
281	H	92.8	Very high	89.7	Confident	11 Å²	11	34.2 Å²	34.2	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-32.7	178.2	-63.3	-23	0	0	0	113.4	M232 A233 T236 E277 M278 V284 L285	M232-H281 HydrophobicContact CB-CB 4.35Å; M232-H281 HydrophobicContact CG-CB 3.55Å; A233-H281 VanDerWaalsContact CA-NE2 3.33Å; A233-H281 WeakPolarHBondContact CA-NE2 3.48Å; A233-H281 WeakPolarHBondContact CB-NE2 3.34Å; A233-H281 PolarHBondContact N-CD2 3.46Å; T236-H281 HydrophobicContact CG2-CB 4.19Å; E277-H281 PolarHBondContact O-CD2 3.15Å; E277-H281 PolarHBondContact O-N 3.43Å; E277-H281 IonicContact OE1-NE2 3.74Å; M278-H281 PolarHBondContact O-N 3.25Å; M278-H281 VanDerWaalsContact O-N 3.16Å; H281-V284 PolarHBondContact O-N 3.03Å; H281-L285 VanDerWaalsContact O-CB 3.27Å; H281-L285 WeakPolarHBondContact O-CB 3.43Å; H281-L285 PolarHBondContact O-N 2.66Å
282	L	95.4	Very high	90.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.1	-38.1	171.7	-66.8	-174.8	0	0	0	112	M232 I263 I267 I268 M274 M278 A279 H280 L285 Q286 F428 F433	M232-L282 HydrophobicContact CE-CD2 4.16Å; I263-L282 HydrophobicContact CG2-CD1 4.43Å; I263-L282 HydrophobicContact CG2-CD2 3.6Å; I267-L282 HydrophobicContact CG2-CD1 4.09Å; I268-L282 HydrophobicContact CD1-CD1 4.41Å; I268-L282 HydrophobicContact CG1-CD1 3.86Å; M274-L282 HydrophobicContact SD-CD1 3.68Å; M278-L282 WeakPolarHBondContact O-CG 3.36Å; M278-L282 PolarHBondContact O-N 2.94Å; M278-L282 HydrophobicContact SD-CG 4.43Å; A279-L282 PolarHBondContact O-N 3.06Å; H280-L282 VanDerWaalsContact C-N 3.34Å; H280-L282 PolarHBondContact O-N 3.45Å; L282-L285 PolarHBondContact O-N 3.16Å; L282-Q286 WeakPolarHBondContact O-CB 3.41Å; L282-Q286 PolarHBondContact O-N 2.84Å; L282-F428 HydrophobicContact CB-CD1 3.86Å; L282-F428 HydrophobicContact CB-CD2 4.4Å; L282-F428 HydrophobicContact CB-CE1 3.85Å; L282-F428 HydrophobicContact CB-CE2 4.4Å; L282-F428 HydrophobicContact CB-CG 4.15Å; L282-F428 HydrophobicContact CB-CZ 4.14Å; L282-F428 HydrophobicContact CD1-CE1 3.89Å; L282-F428 HydrophobicContact CD1-CE2 4.06Å; L282-F428 HydrophobicContact CD1-CZ 3.53Å; L282-F433 HydrophobicContact CB-CZ 4.48Å; L282-F433 HydrophobicContact CD2-CZ 4.4Å
283	Y	93.8	Very high	90.9	Very high	44 Å²	44	30 Å²	30	17%	0.173	18%	0.177	C	C	.	.	H	α-helix	trans	-59.1	-50.4	169.8	161.1	-99.2	0	0	0	111.7	A279 H280 L285 Q286 A287 C421 S422 A425 D427	A279-Y283 PolarHBondContact O-N 3.43Å; H280-Y283 WeakPolarHBondContact O-CB 3.42Å; H280-Y283 PolarHBondContact O-N 2.77Å; Y283-L285 VanDerWaalsContact C-N 3.32Å; Y283-L285 PolarHBondContact O-N 2.86Å; Y283-Q286 PolarHBondContact O-N 3.29Å; Y283-A287 WeakPolarHBondContact O-CB 3.34Å; Y283-A287 PolarHBondContact O-N 2.93Å; Y283-C421 HydrophobicContact CE1-CB 4.33Å; Y283-S422 PolarHBondContact OH-N 3.22Å; Y283-S422 VanDerWaalsContact OH-N 3.15Å; Y283-A425 HydrophobicContact CD1-CB 3.92Å; Y283-A425 WeakPolarHBondContact CD1-O 3.44Å; Y283-A425 HydrophobicContact CD2-CB 4.34Å; Y283-A425 HydrophobicContact CE1-CB 3.64Å; Y283-A425 HydrophobicContact CE2-CB 4.05Å; Y283-A425 HydrophobicContact CG-CB 4.26Å; Y283-D427 WeakPolarHBondContact CD2-O 3.41Å
284	V	93.4	Very high	91.6	Very high	1 Å²	1	27 Å²	27	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-59.5	-44.4	177.8	173.6	0	0	0	0	110.6	T236 Q240 H280 H281 Q286 A287 L288 C421	T236-V284 HydrophobicContact CG2-CB 4.45Å; T236-V284 HydrophobicContact CG2-CG1 4.23Å; Q240-V284 HydrophobicContact CG-CG1 4.33Å; H280-V284 WeakPolarHBondContact O-CG2 3.19Å; H280-V284 PolarHBondContact O-N 3.21Å; H281-V284 PolarHBondContact O-N 3.03Å; V284-Q286 PolarHBondContact O-N 3.05Å; V284-A287 PolarHBondContact O-N 3.3Å; V284-L288 HydrophobicContact CG1-CD1 3.73Å; V284-L288 HydrophobicContact CG1-CG 4.17Å; V284-L288 WeakPolarHBondContact O-CB 3.35Å; V284-L288 VanDerWaalsContact O-CG 3.22Å; V284-L288 WeakPolarHBondContact O-CG 3.47Å; V284-L288 PolarHBondContact O-N 3.36Å; V284-C421 HydrophobicContact CG2-CB 4.48Å
285	L	95.6	Very high	92.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.6	-41.4	178.8	-172.9	60.2	0	0	0	112.3	M232 T236 L239 W255 I263 H281 L282 Y283 T289 F433	M232-L285 HydrophobicContact SD-CD2 4.12Å; T236-L285 HydrophobicContact CG2-CB 4.32Å; L239-L285 HydrophobicContact CD1-CD1 3.7Å; W255-L285 HydrophobicContact CH2-CD1 4.04Å; I263-L285 HydrophobicContact CD1-CD2 3.66Å; H281-L285 VanDerWaalsContact O-CB 3.27Å; H281-L285 WeakPolarHBondContact O-CB 3.43Å; H281-L285 PolarHBondContact O-N 2.66Å; L282-L285 PolarHBondContact O-N 3.16Å; Y283-L285 VanDerWaalsContact C-N 3.32Å; Y283-L285 PolarHBondContact O-N 2.86Å; L285-T289 WeakPolarHBondContact O-CB 3.45Å; L285-T289 PolarHBondContact O-N 3.2Å; L285-T289 PolarHBondContact O-OG1 3.41Å; L285-F433 HydrophobicContact CD2-CE1 3.89Å; L285-F433 HydrophobicContact CD2-CZ 4.49Å; L285-F433 HydrophobicContact CG-CE1 4.25Å
286	Q	95.1	Very high	92.8	Very high	20 Å²	20	27.8 Å²	27.8	9%	0.093	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-49.5	173.4	-179.5	-179.9	-66.2	0	0	110.8	L282 Y283 V284 L288 T289 L290 S429 F432 F433	L282-Q286 WeakPolarHBondContact O-CB 3.41Å; L282-Q286 PolarHBondContact O-N 2.84Å; Y283-Q286 PolarHBondContact O-N 3.29Å; V284-Q286 PolarHBondContact O-N 3.05Å; Q286-L288 VanDerWaalsContact C-N 3.35Å; Q286-L288 PolarHBondContact O-N 2.88Å; Q286-T289 PolarHBondContact O-N 2.95Å; Q286-L290 HydrophobicContact CG-CD1 3.93Å; Q286-L290 HydrophobicContact CG-CG 4.43Å; Q286-L290 WeakPolarHBondContact O-CG 3.09Å; Q286-L290 PolarHBondContact O-N 3.45Å; Q286-S429 PolarHBondContact OE1-O 2.6Å; Q286-F432 HydrophobicContact CG-CD2 4.43Å; Q286-F433 HydrophobicContact CB-CE2 4.4Å; Q286-F433 HydrophobicContact CB-CZ 4.25Å
287	A	93.9	Very high	93.5	Very high	24 Å²	24	24 Å²	24	20%	0.198	13%	0.126	C	C	.	.	H	α-helix	trans	-60.6	-42.8	-179.4	0	0	0	0	0	111.9	Y283 V284 T289 L290 G291 C421	Y283-A287 WeakPolarHBondContact O-CB 3.34Å; Y283-A287 PolarHBondContact O-N 2.93Å; V284-A287 PolarHBondContact O-N 3.3Å; A287-T289 PolarHBondContact O-N 3.44Å; A287-L290 PolarHBondContact O-N 2.87Å; A287-G291 PolarHBondContact O-N 3.13Å; A287-C421 VanDerWaalsContact CB-SG 3.59Å
288	L	94.1	Very high	94.2	Very high	14 Å²	14	30.1 Å²	30.1	7%	0.073	15%	0.148	C	C	.	.	H	α-helix	trans	-65.2	-37.5	175.8	-70.4	173.2	0	0	0	112.6	L239 Q240 V284 Q286 G291 L292	L239-L288 HydrophobicContact CB-CD1 3.71Å; Q240-L288 HydrophobicContact CG-CD1 3.97Å; Q240-L288 HydrophobicContact CG-CD2 4.2Å; V284-L288 HydrophobicContact CG1-CD1 3.73Å; V284-L288 HydrophobicContact CG1-CG 4.17Å; V284-L288 WeakPolarHBondContact O-CB 3.35Å; V284-L288 VanDerWaalsContact O-CG 3.22Å; V284-L288 WeakPolarHBondContact O-CG 3.47Å; V284-L288 PolarHBondContact O-N 3.36Å; Q286-L288 VanDerWaalsContact C-N 3.35Å; Q286-L288 PolarHBondContact O-N 2.88Å; L288-G291 PolarHBondContact O-N 3.48Å; L288-L292 PolarHBondContact O-N 3.18Å
289	T	94.3	Very high	94.4	Very high	40 Å²	40	32.4 Å²	32.4	25%	0.245	16%	0.163	C	C	.	.	H	α-helix	trans	-68	-45.3	176.9	-57.3	0	0	0	0	110.9	L251 L285 Q286 A287 G291 L292	L251-T289 HydrophobicContact CD1-CG2 4.29Å; L285-T289 WeakPolarHBondContact O-CB 3.45Å; L285-T289 PolarHBondContact O-N 3.2Å; L285-T289 PolarHBondContact O-OG1 3.41Å; Q286-T289 PolarHBondContact O-N 2.95Å; A287-T289 PolarHBondContact O-N 3.44Å; T289-G291 VanDerWaalsContact C-N 3.32Å; T289-L292 WeakPolarHBondContact O-CB 3.43Å; T289-L292 PolarHBondContact O-N 3.39Å
290	L	95.1	Very high	94.7	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.052	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-36.3	174.9	-70.7	172.6	0	0	0	111.6	Q286 A287 L292 L293 L415 V417 F432 F439	Q286-L290 HydrophobicContact CG-CD1 3.93Å; Q286-L290 HydrophobicContact CG-CG 4.43Å; Q286-L290 WeakPolarHBondContact O-CG 3.09Å; Q286-L290 PolarHBondContact O-N 3.45Å; A287-L290 PolarHBondContact O-N 2.87Å; L290-L292 PolarHBondContact O-N 3.22Å; L290-L292 VanDerWaalsContact O-N 3.14Å; L290-L293 HydrophobicContact CD2-CD1 4.28Å; L290-L293 VanDerWaalsContact O-CB 3.23Å; L290-L293 WeakPolarHBondContact O-CB 3.35Å; L290-L293 WeakPolarHBondContact O-CG 3.33Å; L290-L293 PolarHBondContact O-N 3.24Å; L290-L415 HydrophobicContact CD1-CB 4.27Å; L290-V417 HydrophobicContact CB-CG2 4.44Å; L290-F432 HydrophobicContact CD2-CD1 4.39Å; L290-F432 HydrophobicContact CD2-CE1 3.96Å; L290-F432 HydrophobicContact CD2-CZ 4.49Å; L290-F439 HydrophobicContact CD2-CD2 4.32Å
291	G	94.8	Very high	95	Very high	13 Å²	13	33.9 Å²	33.9	13%	0.134	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-21.5	176.2	0	0	0	0	0	113.9	A287 L288 T289 L293 E294	A287-G291 PolarHBondContact O-N 3.13Å; L288-G291 PolarHBondContact O-N 3.48Å; T289-G291 VanDerWaalsContact C-N 3.32Å; G291-L293 PolarHBondContact O-N 3.38Å; G291-E294 WeakPolarHBondContact O-CB 2.89Å; G291-E294 PolarHBondContact O-N 3.43Å; G291-E294 VanDerWaalsContact O-N 3.14Å
292	L	95.2	Very high	94.9	Very high	36 Å²	36	36.6 Å²	36.6	19%	0.188	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.6	171.6	-65.2	-174.2	0	0	0	113.5	T244 R247 K248 L251 L288 T289 L290 P295	T244-L292 HydrophobicContact CG2-CD2 3.95Å; R247-L292 HydrophobicContact CB-CD2 4.19Å; R247-L292 HydrophobicContact CG-CD2 4.09Å; K248-L292 HydrophobicContact CB-CD1 4.09Å; K248-L292 HydrophobicContact CB-CD2 4.18Å; K248-L292 HydrophobicContact CG-CD1 4.33Å; L251-L292 HydrophobicContact CD1-CD1 3.54Å; L251-L292 HydrophobicContact CD1-CG 4.35Å; L251-L292 HydrophobicContact CG-CD1 4.26Å; L288-L292 PolarHBondContact O-N 3.18Å; T289-L292 WeakPolarHBondContact O-CB 3.43Å; T289-L292 PolarHBondContact O-N 3.39Å; L290-L292 PolarHBondContact O-N 3.22Å; L290-L292 VanDerWaalsContact O-N 3.14Å; L292-P295 WeakPolarHBondContact O-CD 3.42Å
293	L	96.3	Very high	94.5	Very high	25 Å²	25	39 Å²	39	13%	0.131	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-21.4	176.7	-53.8	174.1	0	0	0	112.1	L290 G291 R296 M297 L366 V417 F439	L290-L293 HydrophobicContact CD2-CD1 4.28Å; L290-L293 VanDerWaalsContact O-CB 3.23Å; L290-L293 WeakPolarHBondContact O-CB 3.35Å; L290-L293 WeakPolarHBondContact O-CG 3.33Å; L290-L293 PolarHBondContact O-N 3.24Å; G291-L293 PolarHBondContact O-N 3.38Å; L293-R296 PolarHBondContact O-N 2.94Å; L293-R296 VanDerWaalsContact O-N 3.16Å; L293-M297 WeakPolarHBondContact O-CB 3.38Å; L293-M297 PolarHBondContact O-N 2.92Å; L293-L366 HydrophobicContact CB-CD1 4.32Å; L293-L366 HydrophobicContact CB-CD2 4.14Å; L293-L366 HydrophobicContact CD2-CD1 4.14Å; L293-V417 HydrophobicContact CB-CG1 4.06Å; L293-F439 HydrophobicContact CD1-CB 3.78Å; L293-F439 HydrophobicContact CD1-CD1 3.66Å; L293-F439 HydrophobicContact CD1-CD2 3.65Å; L293-F439 HydrophobicContact CD1-CE1 4.1Å; L293-F439 HydrophobicContact CD1-CE2 4.12Å; L293-F439 HydrophobicContact CD1-CG 3.4Å; L293-F439 VanDerWaalsContact CD1-CG 3.4Å; L293-F439 HydrophobicContact CD1-CZ 4.33Å
294	E	95.3	Very high	94.3	Very high	56 Å²	56	46.3 Å²	46.3	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-57.6	-44.4	-175.1	178.5	172.5	-152.2	0	0	113.6	G291 R296 M297 R298	G291-E294 WeakPolarHBondContact O-CB 2.89Å; G291-E294 PolarHBondContact O-N 3.43Å; G291-E294 VanDerWaalsContact O-N 3.14Å; E294-R296 VanDerWaalsContact C-N 3.28Å; E294-R296 PolarHBondContact O-N 3.04Å; E294-M297 HydrophobicContact CB-CE 4.42Å; E294-M297 HydrophobicContact CG-CE 4.04Å; E294-M297 WeakPolarHBondContact O-CB 3.47Å; E294-M297 PolarHBondContact O-N 3.18Å; E294-M297 VanDerWaalsContact O-N 3.09Å; E294-R298 HydrophobicContact CG-CG 3.74Å; E294-R298 WeakPolarHBondContact O-CB 3.32Å; E294-R298 WeakPolarHBondContact O-CG 3.36Å; E294-R298 PolarHBondContact O-N 3.12Å; E294-R298 IonicContact OE1-CZ 2.8Å; E294-R298 IonicContact OE1-NE 3.91Å; E294-R298 PolarHBondContact OE1-NE 3.1Å; E294-R298 VanDerWaalsContact OE1-NE 3.09Å; E294-R298 IonicContact OE1-NH2 3.88Å; E294-R298 PolarHBondContact OE1-NH2 2.95Å
295	P	95.6	Very high	94.3	Very high	54 Å²	54	47.5 Å²	47.5	35%	0.351	24%	0.242	S	C	.	.	H	α-helix	trans	-56.8	-43.2	177.7	-23.3	31.3	0	0	0	112.2	T244 L292 R298 T299	T244-P295 HydrophobicContact CG2-CG 3.78Å; L292-P295 WeakPolarHBondContact O-CD 3.42Å; P295-R298 PolarHBondContact O-N 2.99Å; P295-T299 WeakPolarHBondContact O-CB 3.25Å; P295-T299 PolarHBondContact O-N 3.41Å; P295-T299 PolarHBondContact O-OG1 2.91Å
296	R	96.1	Very high	94.2	Very high	73 Å²	73	53.4 Å²	53.4	28%	0.275	27%	0.269	S	S	.	.	H	α-helix	trans	-69	-37.7	177	-64.4	-64.8	-68.9	173.6	-6.6	111.6	L293 E294 R298 T299 L365 L366 D369	L293-R296 PolarHBondContact O-N 2.94Å; L293-R296 VanDerWaalsContact O-N 3.16Å; E294-R296 VanDerWaalsContact C-N 3.28Å; E294-R296 PolarHBondContact O-N 3.04Å; R296-R298 VanDerWaalsContact C-N 3.28Å; R296-R298 PolarHBondContact O-N 3.36Å; R296-T299 PolarHBondContact O-N 3.35Å; R296-L365 VanDerWaalsContact CZ-CB 3.5Å; R296-L365 PolarHBondContact O-N 2.9Å; R296-L366 HydrophobicContact CB-CB 4.19Å; R296-L366 PolarHBondContact O-N 3.43Å; R296-D369 IonicContact CZ-OD1 3.19Å; R296-D369 IonicContact CZ-OD2 3.23Å; R296-D369 IonicContact NE-OD1 3.09Å; R296-D369 IonicContact NE-OD2 4Å; R296-D369 PolarHBondContact NE-OD2 3.1Å; R296-D369 IonicContact NH2-OD1 3.51Å; R296-D369 PolarHBondContact NH2-OD1 3.02Å; R296-D369 IonicContact NH2-OD2 3.98Å; R296-D369 PolarHBondContact NH2-OD2 3.13Å
297	M	96.6	Very high	94.1	Very high	12 Å²	12	58.3 Å²	58.3	6%	0.059	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-36.3	175.5	-173.2	-177.6	64.8	0	0	112.8	L293 E294 P362 P363 L366 C412 V417	L293-M297 WeakPolarHBondContact O-CB 3.38Å; L293-M297 PolarHBondContact O-N 2.92Å; E294-M297 HydrophobicContact CB-CE 4.42Å; E294-M297 HydrophobicContact CG-CE 4.04Å; E294-M297 WeakPolarHBondContact O-CB 3.47Å; E294-M297 PolarHBondContact O-N 3.18Å; E294-M297 VanDerWaalsContact O-N 3.09Å; M297-P362 HydrophobicContact CG-CB 3.78Å; M297-P362 HydrophobicContact SD-CB 4.16Å; M297-P363 CarbonylContact C-O 3.58Å; M297-P363 VanDerWaalsContact CA-O 3.26Å; M297-P363 WeakPolarHBondContact CA-O 3.25Å; M297-P363 CarbonylContact O-C 3.5Å; M297-L366 HydrophobicContact CB-CB 4.36Å; M297-L366 HydrophobicContact CB-CD2 3.98Å; M297-L366 HydrophobicContact CG-CD2 4.37Å; M297-C412 HydrophobicContact SD-CB 3.71Å; M297-V417 HydrophobicContact CE-CG1 4.36Å; M297-V417 HydrophobicContact SD-CB 4.45Å; M297-V417 HydrophobicContact SD-CG1 4.14Å
298	R	95.9	Very high	94.1	Very high	152 Å²	152	58.3 Å²	58.3	57%	0.574	29%	0.288	S	S	*	.	H	α-helix	trans	-93.1	-9.8	-176.1	-63.6	-85.7	-166.9	166.8	1.8	113.7	E294 P295 R296	E294-R298 HydrophobicContact CG-CG 3.74Å; E294-R298 WeakPolarHBondContact O-CB 3.32Å; E294-R298 WeakPolarHBondContact O-CG 3.36Å; E294-R298 PolarHBondContact O-N 3.12Å; E294-R298 IonicContact OE1-CZ 2.8Å; E294-R298 IonicContact OE1-NE 3.91Å; E294-R298 PolarHBondContact OE1-NE 3.1Å; E294-R298 VanDerWaalsContact OE1-NE 3.09Å; E294-R298 IonicContact OE1-NH2 3.88Å; E294-R298 PolarHBondContact OE1-NH2 2.95Å; P295-R298 PolarHBondContact O-N 2.99Å; R296-R298 VanDerWaalsContact C-N 3.28Å; R296-R298 PolarHBondContact O-N 3.36Å
299	T	96.3	Very high	93.9	Very high	59 Å²	59	63.5 Å²	63.5	36%	0.362	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-92.6	118	-179.1	-57.6	0	0	0	0	109.3	P295 R296 G364 L365	P295-T299 WeakPolarHBondContact O-CB 3.25Å; P295-T299 PolarHBondContact O-N 3.41Å; P295-T299 PolarHBondContact O-OG1 2.91Å; R296-T299 PolarHBondContact O-N 3.35Å; T299-G364 WeakPolarHBondContact O-CA 3.46Å; T299-L365 HydrophobicContact CG2-CD1 3.57Å; T299-L365 HydrophobicContact CG2-CG 4.39Å; T299-L365 WeakPolarHBondContact O-CG 3.4Å; T299-L365 PolarHBondContact O-N 3.39Å
300	P	95.8	Very high	93.9	Very high	58 Å²	58	66.8 Å²	66.8	38%	0.377	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-70.3	160.4	173.4	31.5	-35.6	0	0	0	111	D302 E359 V361	P300-D302 PolarHBondContact O-N 2.67Å; P300-E359 WeakPolarHBondContact CB-O 3.22Å; P300-V361 HydrophobicContact CB-CG1 4.2Å
301	L	93.6	Very high	93.8	Very high	9 Å²	9	67.9 Å²	67.9	5%	0.047	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-70	126.5	172.4	-167.5	146.4	0	0	0	110.9	P303 Q308 L312 A355 L358 L365 L368	L301-P303 WeakPolarHBondContact O-CD 3.41Å; L301-Q308 HydrophobicContact CG-CB 4.44Å; L301-L312 HydrophobicContact CD1-CD1 3.73Å; L301-L312 HydrophobicContact CD1-CD2 4.28Å; L301-L312 HydrophobicContact CD1-CG 4.07Å; L301-L312 HydrophobicContact CD2-CD1 4.24Å; L301-A355 HydrophobicContact CD2-CB 3.59Å; L301-L358 HydrophobicContact CB-CB 3.69Å; L301-L358 HydrophobicContact CD1-CB 4.17Å; L301-L358 HydrophobicContact CD1-CD1 3.56Å; L301-L358 PolarHBondContact N-O 3.29Å; L301-L358 VanDerWaalsContact N-O 3.11Å; L301-L365 HydrophobicContact CB-CD2 3.88Å; L301-L365 HydrophobicContact CD1-CD2 4.13Å; L301-L365 HydrophobicContact CG-CD2 4Å; L301-L368 HydrophobicContact CD1-CD2 3.87Å
302	D	91.7	Very high	93.7	Very high	68 Å²	68	67.8 Å²	67.8	36%	0.364	32%	0.321	S	S	.	.			trans	-89.6	110.3	171.6	175	12.9	0	0	0	109.9	P300 Y304 S305 Q308	P300-D302 PolarHBondContact O-N 2.67Å; D302-Y304 PolarHBondContact O-N 3.44Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.39Å; D302-Y304 WeakPolarHBondContact OD1-CD2 3.38Å; D302-Y304 PolarHBondContact OD1-N 2.72Å; D302-S305 WeakPolarHBondContact O-CB 3.35Å; D302-S305 PolarHBondContact O-N 3.18Å; D302-S305 PolarHBondContact OD2-N 2.82Å; D302-Q308 PolarHBondContact O-OE1 3.02Å
303	P	86.7	Confident	93.5	Very high	52 Å²	52	69 Å²	69	34%	0.338	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.8	-179.9	28.1	-34.7	0	0	0	113.3	L301 R309 A355	L301-P303 WeakPolarHBondContact O-CD 3.41Å; P303-R309 VanDerWaalsContact O-CD 3.22Å; P303-R309 WeakPolarHBondContact O-CD 3.48Å; P303-R309 PolarHBondContact O-NE 2.96Å; P303-A355 HydrophobicContact CB-CB 3.96Å
304	Y	89.6	Confident	93.3	Very high	196 Å²	196	69.5 Å²	69.5	77%	0.769	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-24.2	179.4	-58.3	-74.2	0	0	0	112.2	D302 Q306	D302-Y304 PolarHBondContact O-N 3.44Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.39Å; D302-Y304 WeakPolarHBondContact OD1-CD2 3.38Å; D302-Y304 PolarHBondContact OD1-N 2.72Å; Y304-Q306 PolarHBondContact O-N 3.3Å
305	S	93.1	Very high	93.3	Very high	27 Å²	27	66.8 Å²	66.8	19%	0.189	32%	0.32	C	S	.	.			trans	-59.8	122.6	175.5	178.7	0	0	0	0	111.7	D302 R309	D302-S305 WeakPolarHBondContact O-CB 3.35Å; D302-S305 PolarHBondContact O-N 3.18Å; D302-S305 PolarHBondContact OD2-N 2.82Å; S305-R309 WeakPolarHBondContact O-CG 3.33Å; S305-R309 PolarHBondContact O-N 2.7Å; S305-R309 PolarHBondContact O-NE 2.9Å
306	Q	92.8	Very high	93.1	Very high	123 Å²	123	66.1 Å²	66.1	58%	0.575	31%	0.311	S	S	*	.	H	α-helix	trans	-65.5	-44.5	177.6	179.5	174.2	-13.2	0	0	111.6	Y304 Q308 R309 E310	Y304-Q306 PolarHBondContact O-N 3.3Å; Q306-Q308 PolarHBondContact O-N 3.08Å; Q306-R309 PolarHBondContact O-N 3.38Å; Q306-E310 HydrophobicContact CG-CG 4.43Å; Q306-E310 VanDerWaalsContact CG-OE1 3.3Å; Q306-E310 WeakPolarHBondContact CG-OE1 3.27Å; Q306-E310 PolarHBondContact NE2-OE1 3.27Å; Q306-E310 WeakPolarHBondContact O-CG 3.25Å; Q306-E310 PolarHBondContact O-N 2.92Å
307	E	94.4	Very high	92.8	Very high	124 Å²	124	68.1 Å²	68.1	58%	0.579	32%	0.323	S	S	*	.	H	α-helix	trans	-59	-45.4	-179.5	-173.7	-169.5	163.3	0	0	111.7	R309 E310 Q311	E307-R309 PolarHBondContact O-N 3.33Å; E307-E310 PolarHBondContact O-N 3.12Å; E307-Q311 WeakPolarHBondContact O-CG 3.45Å; E307-Q311 PolarHBondContact O-N 2.61Å; E307-Q311 PolarHBondContact OE1-NE2 2.91Å
308	Q	93.3	Very high	92.5	Very high	24 Å²	24	69.4 Å²	69.4	11%	0.112	34%	0.336	C	S	.	.	H	α-helix	trans	-70.6	-33.6	-178.6	-61.9	177.9	21.7	0	0	112	L301 D302 Q306 Q311 L312 L365	L301-Q308 HydrophobicContact CG-CB 4.44Å; D302-Q308 PolarHBondContact O-OE1 3.02Å; Q306-Q308 PolarHBondContact O-N 3.08Å; Q308-Q311 WeakPolarHBondContact O-CB 3.49Å; Q308-Q311 PolarHBondContact O-N 3.44Å; Q308-L312 PolarHBondContact O-N 3.25Å; Q308-L365 HydrophobicContact CG-CD2 4.47Å
309	R	90.8	Very high	92.1	Very high	123 Å²	123	62.4 Å²	62.4	46%	0.464	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-41.3	170.7	-76.2	-172.4	-70.6	121.9	-3.3	111.9	P303 S305 Q306 E307 Q311 L312 Q313	P303-R309 VanDerWaalsContact O-CD 3.22Å; P303-R309 WeakPolarHBondContact O-CD 3.48Å; P303-R309 PolarHBondContact O-NE 2.96Å; S305-R309 WeakPolarHBondContact O-CG 3.33Å; S305-R309 PolarHBondContact O-N 2.7Å; S305-R309 PolarHBondContact O-NE 2.9Å; Q306-R309 PolarHBondContact O-N 3.38Å; E307-R309 PolarHBondContact O-N 3.33Å; R309-Q311 VanDerWaalsContact C-N 3.34Å; R309-L312 PolarHBondContact O-N 3.38Å; R309-Q313 WeakPolarHBondContact O-CG 3.42Å; R309-Q313 PolarHBondContact O-N 3.04Å
310	E	92.4	Very high	91.6	Very high	109 Å²	109	61 Å²	61	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-39.8	175.7	-74	171.7	-173.9	0	0	111.5	Q306 E307 Q313 A314	Q306-E310 HydrophobicContact CG-CG 4.43Å; Q306-E310 VanDerWaalsContact CG-OE1 3.3Å; Q306-E310 WeakPolarHBondContact CG-OE1 3.27Å; Q306-E310 PolarHBondContact NE2-OE1 3.27Å; Q306-E310 WeakPolarHBondContact O-CG 3.25Å; Q306-E310 PolarHBondContact O-N 2.92Å; E307-E310 PolarHBondContact O-N 3.12Å; E310-Q313 PolarHBondContact O-N 2.84Å; E310-A314 WeakPolarHBondContact O-CB 3.35Å; E310-A314 PolarHBondContact O-N 2.82Å
311	Q	94.4	Very high	90.4	Very high	33 Å²	33	66.5 Å²	66.5	15%	0.154	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-47.7	172.2	-79.1	174.2	-1.7	0	0	112.4	E307 Q308 R309 Q313 A314 L315 L368 L372	E307-Q311 WeakPolarHBondContact O-CG 3.45Å; E307-Q311 PolarHBondContact O-N 2.61Å; E307-Q311 PolarHBondContact OE1-NE2 2.91Å; Q308-Q311 WeakPolarHBondContact O-CB 3.49Å; Q308-Q311 PolarHBondContact O-N 3.44Å; R309-Q311 VanDerWaalsContact C-N 3.34Å; Q311-Q313 VanDerWaalsContact C-N 3.32Å; Q311-Q313 PolarHBondContact O-N 2.67Å; Q311-A314 PolarHBondContact O-N 2.82Å; Q311-L315 PolarHBondContact O-N 3.24Å; Q311-L368 HydrophobicContact CB-CD2 4.08Å; Q311-L372 HydrophobicContact CB-CD1 3.84Å; Q311-L372 HydrophobicContact CG-CD1 3.97Å
312	L	92.3	Very high	88.7	Confident	11 Å²	11	71.7 Å²	71.7	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-39.4	174.6	-75.8	172.2	0	0	0	112.5	L301 Q308 R309 L315 R316 F344 F349 P354 L358 L368	L301-L312 HydrophobicContact CD1-CD1 3.73Å; L301-L312 HydrophobicContact CD1-CD2 4.28Å; L301-L312 HydrophobicContact CD1-CG 4.07Å; L301-L312 HydrophobicContact CD2-CD1 4.24Å; Q308-L312 PolarHBondContact O-N 3.25Å; R309-L312 PolarHBondContact O-N 3.38Å; L312-L315 PolarHBondContact O-N 2.71Å; L312-R316 PolarHBondContact O-N 2.9Å; L312-R316 VanDerWaalsContact O-N 3.16Å; L312-F344 HydrophobicContact CB-CE1 4.37Å; L312-F344 HydrophobicContact CB-CZ 4.16Å; L312-F349 HydrophobicContact CD2-CZ 4.24Å; L312-P354 HydrophobicContact CD1-CB 4.11Å; L312-P354 HydrophobicContact CD2-CB 3.95Å; L312-L358 HydrophobicContact CD2-CD1 4.21Å; L312-L368 HydrophobicContact CD2-CD1 3.82Å; L312-L368 HydrophobicContact CD2-CD2 4.37Å; L312-L368 HydrophobicContact CG-CD1 4.46Å; L312-L368 HydrophobicContact CG-CD2 4.34Å
313	Q	90.9	Very high	86.5	Confident	62 Å²	62	76.4 Å²	76.4	29%	0.29	37%	0.374	S	S	.	.	H	α-helix	trans	-66.7	-40.2	176.1	-70.6	-64.4	-25.8	0	0	112	R309 E310 Q311 L315 R316 Q317 C340	R309-Q313 WeakPolarHBondContact O-CG 3.42Å; R309-Q313 PolarHBondContact O-N 3.04Å; E310-Q313 PolarHBondContact O-N 2.84Å; Q311-Q313 VanDerWaalsContact C-N 3.32Å; Q311-Q313 PolarHBondContact O-N 2.67Å; Q313-L315 VanDerWaalsContact C-N 3.32Å; Q313-L315 PolarHBondContact O-N 3.43Å; Q313-R316 WeakPolarHBondContact O-CB 3.25Å; Q313-R316 PolarHBondContact O-N 3.48Å; Q313-R316 VanDerWaalsContact OE1-CZ 3.27Å; Q313-Q317 WeakPolarHBondContact O-CB 3.39Å; Q313-Q317 VanDerWaalsContact O-CG 3.29Å; Q313-Q317 WeakPolarHBondContact O-CG 3.49Å; Q313-Q317 PolarHBondContact O-N 2.91Å; Q313-C340 PolarHBondContact NE2-SG 3.33Å
314	A	92.8	Very high	84.7	Confident	34 Å²	34	78 Å²	78	28%	0.281	40%	0.401	S	S	.	.	H	α-helix	trans	-62	-41	176.3	0	0	0	0	0	111.5	E310 Q311 R316 Q317 A318 L372	E310-A314 WeakPolarHBondContact O-CB 3.35Å; E310-A314 PolarHBondContact O-N 2.82Å; Q311-A314 PolarHBondContact O-N 2.82Å; A314-R316 VanDerWaalsContact C-N 3.34Å; A314-R316 PolarHBondContact O-N 3.33Å; A314-Q317 PolarHBondContact O-N 3.33Å; A314-A318 WeakPolarHBondContact O-CB 3.4Å; A314-A318 PolarHBondContact O-N 2.98Å; A314-L372 HydrophobicContact CB-CD2 4.41Å
315	L	93.5	Very high	82.5	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-60	-44.4	174.6	-175.9	65.8	0	0	0	111.6	Q311 L312 Q313 A318 L368 M371 L372 Y382	Q311-L315 PolarHBondContact O-N 3.24Å; L312-L315 PolarHBondContact O-N 2.71Å; Q313-L315 VanDerWaalsContact C-N 3.32Å; Q313-L315 PolarHBondContact O-N 3.43Å; L315-A318 PolarHBondContact O-N 2.77Å; L315-L368 HydrophobicContact CD2-CD1 4.23Å; L315-M371 HydrophobicContact CD1-CB 3.87Å; L315-M371 HydrophobicContact CD2-CB 3.89Å; L315-M371 HydrophobicContact CD2-CE 4.25Å; L315-M371 HydrophobicContact CD2-SD 3.97Å; L315-L372 HydrophobicContact CB-CD2 3.93Å; L315-L372 HydrophobicContact CD1-CD2 4.42Å; L315-Y382 HydrophobicContact CD1-CE2 4.05Å; L315-Y382 VanDerWaalsContact CD1-OH 3.28Å; L315-Y382 WeakPolarHBondContact CD1-OH 3.33Å; L315-Y382 PolarHBondContact O-OH 3.27Å
316	R	91.4	Very high	80.1	Confident	39 Å²	39	78 Å²	78	15%	0.147	42%	0.416	C	S	.	.	H	α-helix	trans	-61.9	-50.9	176.2	-176.9	-173.3	69.6	93.3	3.5	112.4	L312 Q313 A314 A318 A319 F320 E343 F344 L347	L312-R316 PolarHBondContact O-N 2.9Å; L312-R316 VanDerWaalsContact O-N 3.16Å; Q313-R316 WeakPolarHBondContact O-CB 3.25Å; Q313-R316 PolarHBondContact O-N 3.48Å; Q313-R316 VanDerWaalsContact OE1-CZ 3.27Å; A314-R316 VanDerWaalsContact C-N 3.34Å; A314-R316 PolarHBondContact O-N 3.33Å; R316-A318 PolarHBondContact O-N 2.62Å; R316-A319 PolarHBondContact O-N 3Å; R316-F320 HydrophobicContact CG-CD2 4.01Å; R316-F320 PolarHBondContact O-N 2.94Å; R316-E343 WeakPolarHBondContact CD-OE2 3.31Å; R316-E343 HydrophobicContact CG-CB 4.03Å; R316-E343 WeakPolarHBondContact CG-OE2 3.48Å; R316-E343 IonicContact CZ-OE2 3.5Å; R316-E343 IonicContact NE-OE2 3.69Å; R316-E343 IonicContact NH1-OE1 3.99Å; R316-E343 IonicContact NH1-OE2 2.61Å; R316-E343 PolarHBondContact NH1-OE2 2.96Å; R316-F344 HydrophobicContact CB-CE1 3.93Å; R316-F344 HydrophobicContact CB-CZ 4.31Å; R316-L347 HydrophobicContact CB-CD1 4.16Å; R316-L347 HydrophobicContact CG-CD1 4.4Å
317	Q	90.3	Very high	77.6	Confident	115 Å²	115	81.7 Å²	81.7	54%	0.537	44%	0.436	S	S	.	.	H	α-helix	trans	-63.4	-30.5	-179.2	-71.3	171.2	2	0	0	112.6	Q313 A314 A319	Q313-Q317 WeakPolarHBondContact O-CB 3.39Å; Q313-Q317 VanDerWaalsContact O-CG 3.29Å; Q313-Q317 WeakPolarHBondContact O-CG 3.49Å; Q313-Q317 PolarHBondContact O-N 2.91Å; A314-Q317 PolarHBondContact O-N 3.33Å; Q317-A319 PolarHBondContact O-N 3.19Å
318	A	90.6	Very high	75.2	Confident	40 Å²	40	78.7 Å²	78.7	33%	0.331	44%	0.438	S	S	.	.	H	α-helix	trans	-68.4	-22.7	175.3	0	0	0	0	0	113.3	A314 L315 R316 Y382	A314-A318 WeakPolarHBondContact O-CB 3.4Å; A314-A318 PolarHBondContact O-N 2.98Å; L315-A318 PolarHBondContact O-N 2.77Å; R316-A318 PolarHBondContact O-N 2.62Å; A318-Y382 HydrophobicContact CB-CD1 4.39Å; A318-Y382 HydrophobicContact CB-CE1 3.77Å
319	A	86.8	Confident	73.2	Confident	5 Å²	5	82.9 Å²	82.9	4%	0.041	47%	0.465	C	S	.	.	H	α-helix	trans	-96.8	-39.7	-179.8	0	0	0	0	0	113	R316 Q317 L347 Y382 V386	R316-A319 PolarHBondContact O-N 3Å; Q317-A319 PolarHBondContact O-N 3.19Å; A319-L347 HydrophobicContact CB-CD2 3.93Å; A319-Y382 HydrophobicContact CB-CE1 3.72Å; A319-V386 HydrophobicContact CB-CB 4.16Å; A319-V386 HydrophobicContact CB-CG1 3.83Å; A319-V386 HydrophobicContact CB-CG2 4.26Å
320	F	86.8	Confident	71.4	Confident	29 Å²	29	80.7 Å²	80.7	13%	0.127	48%	0.481	C	S	.	.	S	Bend	trans	-113.1	104.1	-179.4	-50	-65.3	0	0	0	107.6	R316 E343 K346 L347 V386 L387	R316-F320 HydrophobicContact CG-CD2 4.01Å; R316-F320 PolarHBondContact O-N 2.94Å; F320-E343 HydrophobicContact CD2-CB 3.76Å; F320-E343 HydrophobicContact CD2-CG 3.8Å; F320-E343 HydrophobicContact CE2-CB 3.69Å; F320-E343 HydrophobicContact CE2-CG 4.04Å; F320-E343 WeakPolarHBondContact CE2-O 3.46Å; F320-E343 HydrophobicContact CG-CG 4.25Å; F320-K346 HydrophobicContact CE1-CB 4.34Å; F320-K346 HydrophobicContact CE1-CD 4.48Å; F320-K346 HydrophobicContact CE2-CB 4.44Å; F320-K346 HydrophobicContact CZ-CB 3.67Å; F320-L347 HydrophobicContact CE2-CD1 4.16Å; F320-L347 HydrophobicContact CE2-CD2 4.36Å; F320-L347 HydrophobicContact CE2-CG 3.8Å; F320-L347 HydrophobicContact CZ-CG 4.23Å; F320-V386 HydrophobicContact CE1-CG1 4.09Å; F320-V386 HydrophobicContact CZ-CG1 3.83Å; F320-L387 HydrophobicContact CD1-CD2 4.41Å; F320-L387 HydrophobicContact CE1-CD2 4.46Å
321	E	69.5	Low	69.8	Low	174 Å²	174	77.9 Å²	77.9	81%	0.813	47%	0.469	S	S	*	.			trans	-55.6	138.7	167.9	-69.6	-174.2	165.8	0	0	108	E323	E321-E323 VanDerWaalsContact C-N 3.31Å; E321-E323 PolarHBondContact O-N 3.18Å
322	P	58.6	Low	68.5	Low	118 Å²	118	79.1 Å²	79.1	77%	0.766	48%	0.481	S	S	*	.			trans	-61.2	105.3	164.3	26.3	-28.6	0	0	0	105.5	G324	P322-G324 PolarHBondContact O-N 3.25Å
323	E	45.9	Very low	67.4	Low	166 Å²	166	82.1 Å²	82.1	78%	0.776	51%	0.508	S	S	*	.			trans	-42.9	133.5	165	-74.5	-176.3	168.3	0	0	106.5	E321 E325	E321-E323 VanDerWaalsContact C-N 3.31Å; E321-E323 PolarHBondContact O-N 3.18Å; E323-E325 PolarHBondContact O-N 3.19Å
324	G	47.4	Very low	66.2	Low	87 Å²	87	84.9 Å²	84.9	90%	0.897	53%	0.525	S	S	*	.			trans	-58.4	74.1	-176.5	0	0	0	0	0	112.2	P322 S326	P322-G324 PolarHBondContact O-N 3.25Å; G324-S326 PolarHBondContact O-N 2.79Å
325	E	44.7	Very low	65.3	Low	119 Å²	119	91.5 Å²	91.5	56%	0.556	54%	0.542	S	S	*	.			trans	-79.2	102.3	169.2	-75.6	-166.4	164.3	0	0	105	E323 M327 L331	E323-E325 PolarHBondContact O-N 3.19Å; E325-M327 PolarHBondContact O-N 3.42Å; E325-L331 WeakPolarHBondContact OE2-CD1 3.12Å
326	S	42.6	Very low	64.3	Low	102 Å²	102	98.7 Å²	98.7	71%	0.713	57%	0.569	S	S	*	*			trans	-24.4	125.6	159.1	-162.6	0	0	0	0	110.8	G324 G328	G324-S326 PolarHBondContact O-N 2.79Å; S326-G328 PolarHBondContact O-N 2.9Å
327	M	40.7	Very low	63.5	Low	202 Å²	202	105.5 Å²	105.5	100%	0.995	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	22	178.7	-73.6	-80.4	-71.1	0	0	114.6	E325	E325-M327 PolarHBondContact O-N 3.42Å
328	G	44.1	Very low	63	Low	61 Å²	61	104 Å²	104	63%	0.629	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	-12.9	-169	0	0	0	0	0	117.5	S326	S326-G328 PolarHBondContact O-N 2.9Å
329	T	50.2	Low	62.7	Low	112 Å²	112	104.7 Å²	104.7	69%	0.687	60%	0.595	S	S	*	*			trans	-129.6	92.2	176.1	52.9	0	0	0	0	111.5	L331	T329-L331 PolarHBondContact O-N 3.34Å
330	G	53.3	Low	62.5	Low	76 Å²	76	105.4 Å²	105.4	78%	0.784	60%	0.6	S	S	*	*			trans	-58	108.5	176.7	0	0	0	0	0	112	S332	G330-S332 PolarHBondContact O-N 3.5Å
331	L	59	Low	62.4	Low	50 Å²	50	106.4 Å²	106.4	26%	0.262	61%	0.608	S	S	.	*			trans	-53.5	134.9	166.9	-69.5	169.9	0	0	0	109.3	E325 T329 R335 R336	E325-L331 WeakPolarHBondContact OE2-CD1 3.12Å; T329-L331 PolarHBondContact O-N 3.34Å; L331-R335 HydrophobicContact CB-CB 4.47Å; L331-R335 HydrophobicContact CD2-CB 4.4Å; L331-R336 HydrophobicContact CB-CG 3.71Å; L331-R336 HydrophobicContact CD1-CG 4.29Å; L331-R336 VanDerWaalsContact O-CZ 3.25Å; L331-R336 PolarHBondContact O-NE 3.47Å; L331-R336 PolarHBondContact O-NH2 3.03Å
332	S	67.4	Low	63.2	Low	60 Å²	60	105.1 Å²	105.1	42%	0.42	60%	0.596	S	S	.	*			trans	-58.6	152.4	172.8	65.2	0	0	0	0	110.7	G330 D334 R335 R336	G330-S332 PolarHBondContact O-N 3.5Å; S332-D334 PolarHBondContact O-N 2.93Å; S332-D334 VanDerWaalsContact O-N 3.16Å; S332-R335 PolarHBondContact O-N 3.4Å; S332-R335 WeakPolarHBondContact OG-CG 3.37Å; S332-R335 PolarHBondContact OG-N 3.31Å; S332-R336 PolarHBondContact O-N 3.49Å; S332-R336 VanDerWaalsContact O-N 3.11Å
333	A	68	Low	64.7	Low	74 Å²	74	100.7 Å²	100.7	61%	0.612	57%	0.565	S	S	*	*	H	α-helix	trans	-54.7	-35.7	-179	0	0	0	0	0	112.3	R336 R337	A333-R336 PolarHBondContact O-N 3.09Å; A333-R337 PolarHBondContact O-N 2.83Å
334	D	67	Low	66.8	Low	120 Å²	120	93.4 Å²	93.4	64%	0.642	53%	0.53	S	S	*	.	H	α-helix	trans	-69	-39	177.1	-67.4	-35.8	0	0	0	113.2	S332 R337 S338	S332-D334 PolarHBondContact O-N 2.93Å; S332-D334 VanDerWaalsContact O-N 3.16Å; D334-R337 PolarHBondContact O-N 2.69Å; D334-S338 WeakPolarHBondContact O-CB 3.38Å; D334-S338 PolarHBondContact O-N 2.89Å
335	R	73	Confident	68.8	Low	173 Å²	173	96.4 Å²	96.4	65%	0.653	52%	0.515	S	S	*	.	H	α-helix	trans	-66.1	-39.5	175.5	-76.6	-176	-177.2	-167.7	2	111.7	L331 S332 S338 L339	L331-R335 HydrophobicContact CB-CB 4.47Å; L331-R335 HydrophobicContact CD2-CB 4.4Å; S332-R335 PolarHBondContact O-N 3.4Å; S332-R335 WeakPolarHBondContact OG-CG 3.37Å; S332-R335 PolarHBondContact OG-N 3.31Å; R335-S338 PolarHBondContact O-N 3.26Å; R335-L339 WeakPolarHBondContact O-CB 3.09Å; R335-L339 PolarHBondContact O-N 2.92Å
336	R	72.6	Confident	70.9	Confident	150 Å²	150	95.4 Å²	95.4	57%	0.566	51%	0.509	S	S	*	.	H	α-helix	trans	-64.2	-42	175.1	-68.1	-175	-122	171.9	-2.5	112	L331 S332 A333 L339 C340	L331-R336 HydrophobicContact CB-CG 3.71Å; L331-R336 HydrophobicContact CD1-CG 4.29Å; L331-R336 VanDerWaalsContact O-CZ 3.25Å; L331-R336 PolarHBondContact O-NE 3.47Å; L331-R336 PolarHBondContact O-NH2 3.03Å; S332-R336 PolarHBondContact O-N 3.49Å; S332-R336 VanDerWaalsContact O-N 3.11Å; A333-R336 PolarHBondContact O-N 3.09Å; R336-L339 PolarHBondContact O-N 3.49Å; R336-C340 WeakPolarHBondContact O-CB 3.5Å; R336-C340 PolarHBondContact O-N 3.33Å
337	R	74.8	Confident	73.3	Confident	183 Å²	183	90.6 Å²	90.6	69%	0.691	48%	0.475	S	S	*	.	H	α-helix	trans	-64.6	-42.7	176.5	-171.1	178.6	-79	173.8	-5.8	111.4	A333 D334 C340 V341	A333-R337 PolarHBondContact O-N 2.83Å; D334-R337 PolarHBondContact O-N 2.69Å; R337-C340 PolarHBondContact O-N 2.97Å; R337-V341 WeakPolarHBondContact O-CG2 3.44Å; R337-V341 PolarHBondContact O-N 3.43Å; R337-V341 VanDerWaalsContact O-N 3.12Å
338	S	80.6	Confident	75.7	Confident	84 Å²	84	81.5 Å²	81.5	59%	0.587	43%	0.433	S	S	*	.	H	α-helix	trans	-63.9	-40.8	176.4	-174.1	0	0	0	0	112.9	D334 R335 R342	D334-S338 WeakPolarHBondContact O-CB 3.38Å; D334-S338 PolarHBondContact O-N 2.89Å; R335-S338 PolarHBondContact O-N 3.26Å; S338-R342 PolarHBondContact O-N 3.5Å
339	L	83.4	Confident	78.1	Confident	54 Å²	54	79 Å²	79	28%	0.283	41%	0.405	S	S	.	.	H	α-helix	trans	-61.8	-46	175.9	-178.8	69.9	0	0	0	110.9	R335 R336 V341 R342 E343	R335-L339 WeakPolarHBondContact O-CB 3.09Å; R335-L339 PolarHBondContact O-N 2.92Å; R336-L339 PolarHBondContact O-N 3.49Å; L339-V341 PolarHBondContact O-N 3.09Å; L339-R342 WeakPolarHBondContact O-CB 3.44Å; L339-R342 PolarHBondContact O-N 2.97Å; L339-R342 VanDerWaalsContact O-N 3.16Å; L339-E343 WeakPolarHBondContact CG-OE1 3.49Å; L339-E343 PolarHBondContact O-N 3.23Å
340	C	83	Confident	79.8	Confident	20 Å²	20	77.3 Å²	77.3	14%	0.135	40%	0.397	C	S	.	.	H	α-helix	trans	-59.7	-44.8	-179.9	-172.6	0	0	0	0	112.5	Q313 R336 R337 R342 E343 F344	Q313-C340 PolarHBondContact NE2-SG 3.33Å; R336-C340 WeakPolarHBondContact O-CB 3.5Å; R336-C340 PolarHBondContact O-N 3.33Å; R337-C340 PolarHBondContact O-N 2.97Å; C340-R342 VanDerWaalsContact C-N 3.34Å; C340-R342 PolarHBondContact O-N 3.37Å; C340-E343 PolarHBondContact O-N 3.38Å; C340-F344 WeakPolarHBondContact O-CD2 3.46Å; C340-F344 PolarHBondContact O-N 2.99Å; C340-F344 WeakPolarHBondContact SG-CE2 3.44Å
341	V	84.4	Confident	81.4	Confident	49 Å²	49	76.5 Å²	76.5	30%	0.297	38%	0.375	S	S	.	.	H	α-helix	trans	-61.8	-41.8	175.6	172.1	0	0	0	0	111.5	R337 L339 F344 R345	R337-V341 WeakPolarHBondContact O-CG2 3.44Å; R337-V341 PolarHBondContact O-N 3.43Å; R337-V341 VanDerWaalsContact O-N 3.12Å; L339-V341 PolarHBondContact O-N 3.09Å; V341-F344 PolarHBondContact O-N 3.5Å; V341-R345 PolarHBondContact O-N 3.44Å; V341-R345 VanDerWaalsContact O-N 3.1Å
342	R	86.2	Confident	82.3	Confident	148 Å²	148	76.6 Å²	76.6	56%	0.558	38%	0.38	S	S	*	.	H	α-helix	trans	-64.2	-40.9	178.6	-174.5	176	66.9	-178.5	3.3	111.8	S338 L339 C340 R345 K346	S338-R342 PolarHBondContact O-N 3.5Å; L339-R342 WeakPolarHBondContact O-CB 3.44Å; L339-R342 PolarHBondContact O-N 2.97Å; L339-R342 VanDerWaalsContact O-N 3.16Å; C340-R342 VanDerWaalsContact C-N 3.34Å; C340-R342 PolarHBondContact O-N 3.37Å; R342-R345 WeakPolarHBondContact O-CB 3.45Å; R342-R345 PolarHBondContact O-N 2.88Å; R342-K346 WeakPolarHBondContact O-CG 3.4Å; R342-K346 PolarHBondContact O-N 3.21Å
343	E	89.8	Confident	83.2	Confident	25 Å²	25	77.1 Å²	77.1	12%	0.117	38%	0.378	C	S	.	.	H	α-helix	trans	-70.7	-35.6	178.9	-75.6	175.9	-169	0	0	113	R316 F320 L339 C340 R345 K346 L347	R316-E343 WeakPolarHBondContact CD-OE2 3.31Å; R316-E343 HydrophobicContact CG-CB 4.03Å; R316-E343 WeakPolarHBondContact CG-OE2 3.48Å; R316-E343 IonicContact CZ-OE2 3.5Å; R316-E343 IonicContact NE-OE2 3.69Å; R316-E343 IonicContact NH1-OE1 3.99Å; R316-E343 IonicContact NH1-OE2 2.61Å; R316-E343 PolarHBondContact NH1-OE2 2.96Å; F320-E343 HydrophobicContact CD2-CB 3.76Å; F320-E343 HydrophobicContact CD2-CG 3.8Å; F320-E343 HydrophobicContact CE2-CB 3.69Å; F320-E343 HydrophobicContact CE2-CG 4.04Å; F320-E343 WeakPolarHBondContact CE2-O 3.46Å; F320-E343 HydrophobicContact CG-CG 4.25Å; L339-E343 WeakPolarHBondContact CG-OE1 3.49Å; L339-E343 PolarHBondContact O-N 3.23Å; C340-E343 PolarHBondContact O-N 3.38Å; E343-R345 VanDerWaalsContact C-N 3.32Å; E343-R345 PolarHBondContact O-N 2.82Å; E343-K346 CarbonylContact O-C 3.56Å; E343-K346 WeakPolarHBondContact O-CB 3.18Å; E343-K346 PolarHBondContact O-N 3.49Å; E343-L347 PolarHBondContact O-N 3.11Å
344	F	91.1	Very high	84	Confident	13 Å²	13	73.8 Å²	73.8	6%	0.057	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-36.5	170.5	-75.1	-52.2	0	0	0	112.5	L312 R316 C340 V341 L347 G348 F349 P354	L312-F344 HydrophobicContact CB-CE1 4.37Å; L312-F344 HydrophobicContact CB-CZ 4.16Å; R316-F344 HydrophobicContact CB-CE1 3.93Å; R316-F344 HydrophobicContact CB-CZ 4.31Å; C340-F344 WeakPolarHBondContact O-CD2 3.46Å; C340-F344 PolarHBondContact O-N 2.99Å; C340-F344 WeakPolarHBondContact SG-CE2 3.44Å; V341-F344 PolarHBondContact O-N 3.5Å; F344-L347 HydrophobicContact CD1-CD1 3.84Å; F344-L347 HydrophobicContact CE1-CD1 4.33Å; F344-L347 WeakPolarHBondContact O-CB 3.45Å; F344-L347 PolarHBondContact O-N 3.31Å; F344-G348 PolarHBondContact O-N 3.45Å; F344-F349 HydrophobicContact CB-CD2 4.16Å; F344-F349 HydrophobicContact CD1-CD2 4.02Å; F344-F349 AromaticContact CD1-CE2 3.93Å; F344-F349 HydrophobicContact CD1-CE2 3.93Å; F344-F349 WeakPolarHBondContact O-CD2 3.49Å; F344-F349 PolarHBondContact O-N 2.9Å; F344-P354 HydrophobicContact CB-CG 3.85Å; F344-P354 HydrophobicContact CD1-CG 3.58Å; F344-P354 HydrophobicContact CD2-CG 3.74Å; F344-P354 HydrophobicContact CE1-CG 4.01Å; F344-P354 HydrophobicContact CE2-CG 4.11Å; F344-P354 HydrophobicContact CG-CG 3.46Å; F344-P354 VanDerWaalsContact CG-CG 3.46Å; F344-P354 HydrophobicContact CZ-CG 4.26Å
345	R	88.6	Confident	85	Confident	150 Å²	150	68.3 Å²	68.3	57%	0.566	32%	0.322	S	S	*	.	H	α-helix	trans	-64	-42.1	169.5	-72.5	-175.6	-177.6	-178.2	0	112.1	V341 R342 E343 L347 G348 S352	V341-R345 PolarHBondContact O-N 3.44Å; V341-R345 VanDerWaalsContact O-N 3.1Å; R342-R345 WeakPolarHBondContact O-CB 3.45Å; R342-R345 PolarHBondContact O-N 2.88Å; E343-R345 VanDerWaalsContact C-N 3.32Å; E343-R345 PolarHBondContact O-N 2.82Å; R345-L347 VanDerWaalsContact C-N 3.26Å; R345-L347 PolarHBondContact O-N 3.23Å; R345-G348 WeakPolarHBondContact O-CA 3.45Å; R345-G348 PolarHBondContact O-N 3.05Å; R345-S352 PolarHBondContact NH2-OG 3.46Å
346	K	89.6	Confident	85.9	Confident	98 Å²	98	64.9 Å²	64.9	43%	0.426	31%	0.313	S	S	.	.	H	α-helix	trans	-63	-29.7	175.2	-76.2	-172.6	174	-163.2	0	113.3	F320 R342 E343 G348 S390	F320-K346 HydrophobicContact CE1-CB 4.34Å; F320-K346 HydrophobicContact CE1-CD 4.48Å; F320-K346 HydrophobicContact CE2-CB 4.44Å; F320-K346 HydrophobicContact CZ-CB 3.67Å; R342-K346 WeakPolarHBondContact O-CG 3.4Å; R342-K346 PolarHBondContact O-N 3.21Å; E343-K346 CarbonylContact O-C 3.56Å; E343-K346 WeakPolarHBondContact O-CB 3.18Å; E343-K346 PolarHBondContact O-N 3.49Å; K346-G348 PolarHBondContact O-N 2.94Å; K346-S390 WeakPolarHBondContact O-CB 3.26Å
347	L	92.1	Very high	86.7	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-10.7	169.2	-78.7	161.2	0	0	0	113.1	R316 A319 F320 E343 F344 R345 F349 Y382 V386 F400 A401	R316-L347 HydrophobicContact CB-CD1 4.16Å; R316-L347 HydrophobicContact CG-CD1 4.4Å; A319-L347 HydrophobicContact CB-CD2 3.93Å; F320-L347 HydrophobicContact CE2-CD1 4.16Å; F320-L347 HydrophobicContact CE2-CD2 4.36Å; F320-L347 HydrophobicContact CE2-CG 3.8Å; F320-L347 HydrophobicContact CZ-CG 4.23Å; E343-L347 PolarHBondContact O-N 3.11Å; F344-L347 HydrophobicContact CD1-CD1 3.84Å; F344-L347 HydrophobicContact CE1-CD1 4.33Å; F344-L347 WeakPolarHBondContact O-CB 3.45Å; F344-L347 PolarHBondContact O-N 3.31Å; R345-L347 VanDerWaalsContact C-N 3.26Å; R345-L347 PolarHBondContact O-N 3.23Å; L347-F349 HydrophobicContact CB-CD2 4.13Å; L347-F349 HydrophobicContact CB-CE2 4.31Å; L347-F349 HydrophobicContact CD1-CE2 4.48Å; L347-Y382 WeakPolarHBondContact CD2-OH 3.4Å; L347-V386 HydrophobicContact CD2-CG1 3.82Å; L347-V386 HydrophobicContact CD2-CG2 3.93Å; L347-F400 HydrophobicContact CD2-CD1 4.43Å; L347-F400 WeakPolarHBondContact O-CB 3.28Å; L347-F400 PolarHBondContact O-N 3.01Å; L347-A401 PolarHBondContact O-N 3.2Å
348	G	92.3	Very high	87.5	Confident	11 Å²	11	50 Å²	50	11%	0.113	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	27.1	178.9	0	0	0	0	0	114.3	F344 R345 K346 K402	F344-G348 PolarHBondContact O-N 3.45Å; R345-G348 WeakPolarHBondContact O-CA 3.45Å; R345-G348 PolarHBondContact O-N 3.05Å; K346-G348 PolarHBondContact O-N 2.94Å; G348-K402 WeakPolarHBondContact O-CB 3.45Å; G348-K402 PolarHBondContact O-N 3.32Å
349	F	93.3	Very high	88	Confident	9 Å²	9	52.1 Å²	52.1	4%	0.039	26%	0.259	C	S	.	.			trans	-71.9	141.4	163.2	-74.4	-78.3	0	0	0	109.7	L312 F344 L347 P354 D357 L358 M371 A401	L312-F349 HydrophobicContact CD2-CZ 4.24Å; F344-F349 HydrophobicContact CB-CD2 4.16Å; F344-F349 HydrophobicContact CD1-CD2 4.02Å; F344-F349 AromaticContact CD1-CE2 3.93Å; F344-F349 HydrophobicContact CD1-CE2 3.93Å; F344-F349 WeakPolarHBondContact O-CD2 3.49Å; F344-F349 PolarHBondContact O-N 2.9Å; L347-F349 HydrophobicContact CB-CD2 4.13Å; L347-F349 HydrophobicContact CB-CE2 4.31Å; L347-F349 HydrophobicContact CD1-CE2 4.48Å; F349-P354 HydrophobicContact CD1-CB 3.8Å; F349-P354 HydrophobicContact CD1-CG 4.38Å; F349-P354 HydrophobicContact CD2-CB 4.15Å; F349-P354 HydrophobicContact CD2-CG 3.95Å; F349-P354 HydrophobicContact CE1-CB 3.71Å; F349-P354 HydrophobicContact CE2-CB 4.07Å; F349-P354 HydrophobicContact CE2-CG 4.12Å; F349-P354 HydrophobicContact CG-CB 4.02Å; F349-P354 HydrophobicContact CG-CG 4.09Å; F349-P354 HydrophobicContact CZ-CB 3.86Å; F349-P354 HydrophobicContact CZ-CG 4.41Å; F349-D357 HydrophobicContact CD1-CB 3.98Å; F349-L358 HydrophobicContact CE1-CD1 4.28Å; F349-M371 HydrophobicContact CZ-CE 4.25Å; F349-A401 HydrophobicContact CB-CB 4.45Å; F349-A401 HydrophobicContact CD1-CB 3.62Å; F349-A401 HydrophobicContact CD2-CB 3.69Å; F349-A401 HydrophobicContact CE1-CB 3.63Å; F349-A401 HydrophobicContact CE2-CB 3.7Å; F349-A401 HydrophobicContact CG-CB 3.65Å; F349-A401 HydrophobicContact CZ-CB 3.67Å
350	S	87.6	Confident	88.3	Confident	75 Å²	75	58.6 Å²	58.6	52%	0.524	28%	0.279	S	S	.	.	S	Bend	trans	-74.7	-35	-177.5	-35.8	0	0	0	0	111	D357	S350-D357 WeakPolarHBondContact CB-OD1 3.22Å; S350-D357 PolarHBondContact N-OD1 3.28Å; S350-D357 PolarHBondContact OG-OD1 3.33Å
351	N	85.7	Confident	88.6	Confident	59 Å²	59	60.6 Å²	60.6	32%	0.316	29%	0.291	S	S	.	.	S	Bend	trans	-101.9	156.4	-179.5	-58.2	-75.1	0	0	0	112	N353 Q356 D357	N351-N353 PolarHBondContact O-N 2.65Å; N351-Q356 HydrophobicContact CB-CB 4.08Å; N351-Q356 VanDerWaalsContact CB-OE1 3.31Å; N351-D357 VanDerWaalsContact CB-OD2 3.3Å; N351-D357 WeakPolarHBondContact CB-OD2 3.39Å; N351-D357 PolarHBondContact N-OD2 2.93Å; N351-D357 PolarHBondContact ND2-OD2 3.3Å
352	S	79.1	Confident	89	Confident	52 Å²	52	61 Å²	61	36%	0.364	30%	0.295	S	S	.	.	S	Bend	trans	-61.6	-24.2	171.7	-55.5	0	0	0	0	112.7	R345	R345-S352 PolarHBondContact NH2-OG 3.46Å
353	N	84.4	Confident	89.4	Confident	71 Å²	71	54.1 Å²	54.1	38%	0.38	27%	0.269	S	S	.	.	S	Bend	trans	-112.4	108.7	174.6	-177.8	3.3	0	0	0	109.6	N351 A355 Q356	N351-N353 PolarHBondContact O-N 2.65Å; N353-A355 PolarHBondContact O-N 2.74Å; N353-A355 WeakPolarHBondContact OD1-CB 3.23Å; N353-A355 PolarHBondContact OD1-N 2.98Å; N353-A355 VanDerWaalsContact OD1-N 3.14Å; N353-Q356 HydrophobicContact CB-CG 4.44Å; N353-Q356 PolarHBondContact O-N 2.72Å
354	P	86.7	Confident	89.6	Confident	4 Å²	4	52.9 Å²	52.9	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-53.5	-24.6	178.2	-29.5	36.1	0	0	0	115.1	L312 F344 F349 Q356 D357 L358	L312-P354 HydrophobicContact CD1-CB 4.11Å; L312-P354 HydrophobicContact CD2-CB 3.95Å; F344-P354 HydrophobicContact CB-CG 3.85Å; F344-P354 HydrophobicContact CD1-CG 3.58Å; F344-P354 HydrophobicContact CD2-CG 3.74Å; F344-P354 HydrophobicContact CE1-CG 4.01Å; F344-P354 HydrophobicContact CE2-CG 4.11Å; F344-P354 HydrophobicContact CG-CG 3.46Å; F344-P354 VanDerWaalsContact CG-CG 3.46Å; F344-P354 HydrophobicContact CZ-CG 4.26Å; F349-P354 HydrophobicContact CD1-CB 3.8Å; F349-P354 HydrophobicContact CD1-CG 4.38Å; F349-P354 HydrophobicContact CD2-CB 4.15Å; F349-P354 HydrophobicContact CD2-CG 3.95Å; F349-P354 HydrophobicContact CE1-CB 3.71Å; F349-P354 HydrophobicContact CE2-CB 4.07Å; F349-P354 HydrophobicContact CE2-CG 4.12Å; F349-P354 HydrophobicContact CG-CB 4.02Å; F349-P354 HydrophobicContact CG-CG 4.09Å; F349-P354 HydrophobicContact CZ-CB 3.86Å; F349-P354 HydrophobicContact CZ-CG 4.41Å; P354-Q356 PolarHBondContact O-N 3.37Å; P354-D357 PolarHBondContact O-N 3.45Å; P354-L358 PolarHBondContact O-N 2.92Å
355	A	87.9	Confident	89.8	Confident	6 Å²	6	52.3 Å²	52.3	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-34.2	177.5	0	0	0	0	0	112.5	L301 P303 N353 L358 E359	L301-A355 HydrophobicContact CD2-CB 3.59Å; P303-A355 HydrophobicContact CB-CB 3.96Å; N353-A355 PolarHBondContact O-N 2.74Å; N353-A355 WeakPolarHBondContact OD1-CB 3.23Å; N353-A355 PolarHBondContact OD1-N 2.98Å; N353-A355 VanDerWaalsContact OD1-N 3.14Å; A355-L358 CarbonylContact O-C 3.53Å; A355-L358 PolarHBondContact O-N 3.15Å; A355-E359 WeakPolarHBondContact O-CB 3.34Å; A355-E359 PolarHBondContact O-N 3.26Å
356	Q	90.1	Very high	90.3	Very high	100 Å²	100	45.2 Å²	45.2	47%	0.467	23%	0.234	S	C	.	.	H	α-helix	trans	-68.8	-34.9	179.8	-67.8	177.2	-25.9	0	0	112	N351 N353 P354 L358	N351-Q356 HydrophobicContact CB-CB 4.08Å; N351-Q356 VanDerWaalsContact CB-OE1 3.31Å; N353-Q356 HydrophobicContact CB-CG 4.44Å; N353-Q356 PolarHBondContact O-N 2.72Å; P354-Q356 PolarHBondContact O-N 3.37Å; Q356-L358 VanDerWaalsContact C-N 3.31Å
357	D	89.9	Confident	90.6	Very high	19 Å²	19	40.5 Å²	40.5	10%	0.102	21%	0.214	C	C	.	.	H	α-helix	trans	-70.5	-29.3	175.6	-68.1	-104.3	0	0	0	112.1	F349 S350 N351 P354 I405	F349-D357 HydrophobicContact CD1-CB 3.98Å; S350-D357 WeakPolarHBondContact CB-OD1 3.22Å; S350-D357 PolarHBondContact N-OD1 3.28Å; S350-D357 PolarHBondContact OG-OD1 3.33Å; N351-D357 VanDerWaalsContact CB-OD2 3.3Å; N351-D357 WeakPolarHBondContact CB-OD2 3.39Å; N351-D357 PolarHBondContact N-OD2 2.93Å; N351-D357 PolarHBondContact ND2-OD2 3.3Å; P354-D357 PolarHBondContact O-N 3.45Å; D357-I405 HydrophobicContact CB-CD1 3.84Å
358	L	92.5	Very high	90.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	5.5	-178.1	-65.9	167.4	0	0	0	113.6	L301 L312 F349 P354 A355 Q356 A367 L368 M371 I405	L301-L358 HydrophobicContact CB-CB 3.69Å; L301-L358 HydrophobicContact CD1-CB 4.17Å; L301-L358 HydrophobicContact CD1-CD1 3.56Å; L301-L358 PolarHBondContact N-O 3.29Å; L301-L358 VanDerWaalsContact N-O 3.11Å; L312-L358 HydrophobicContact CD2-CD1 4.21Å; F349-L358 HydrophobicContact CE1-CD1 4.28Å; P354-L358 PolarHBondContact O-N 2.92Å; A355-L358 CarbonylContact O-C 3.53Å; A355-L358 PolarHBondContact O-N 3.15Å; Q356-L358 VanDerWaalsContact C-N 3.31Å; L358-A367 HydrophobicContact CD2-CB 3.97Å; L358-L368 HydrophobicContact CD1-CB 4.27Å; L358-M371 HydrophobicContact CD2-CE 4.47Å; L358-I405 HydrophobicContact CD2-CD1 3.83Å; L358-I405 HydrophobicContact CD2-CG1 3.83Å; L358-I405 HydrophobicContact CG-CD1 4.28Å
359	E	90.1	Very high	91.2	Very high	129 Å²	129	41.6 Å²	41.6	60%	0.603	22%	0.217	S	C	*	.	S	Bend	trans	-74	-31.2	172.6	-174.6	174.3	-164.3	0	0	111.2	P300 A355 V361	P300-E359 WeakPolarHBondContact CB-O 3.22Å; A355-E359 WeakPolarHBondContact O-CB 3.34Å; A355-E359 PolarHBondContact O-N 3.26Å; E359-V361 PolarHBondContact O-N 3.02Å
360	R	89.3	Confident	91.4	Very high	190 Å²	190	41.2 Å²	41.2	72%	0.717	22%	0.215	S	C	*	.	S	Bend	trans	-74.2	127.6	178.6	-173.9	175.6	174.5	171.1	-2.4	111.1	P362 G364	R360-P362 CarbonylContact O-C 3.5Å; R360-G364 PolarHBondContact O-N 3.39Å
361	V	90.4	Very high	91.9	Very high	62 Å²	62	37.6 Å²	37.6	38%	0.376	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	135.7	175.4	-66.6	0	0	0	0	110.6	P300 E359	P300-V361 HydrophobicContact CB-CG1 4.2Å; E359-V361 PolarHBondContact O-N 3.02Å
362	P	91.9	Very high	92.5	Very high	59 Å²	59	35.2 Å²	35.2	38%	0.383	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	cis	-65	158.9	-11.9	31.5	-36.3	0	0	0	112.1	M297 R360 V409	M297-P362 HydrophobicContact CG-CB 3.78Å; M297-P362 HydrophobicContact SD-CB 4.16Å; R360-P362 CarbonylContact O-C 3.5Å; P362-V409 HydrophobicContact CB-CG2 4.48Å; P362-V409 HydrophobicContact CG-CG1 4.47Å
363	P	94.4	Very high	93.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.013	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	cis	-105	1	7.1	41.1	-34.3	0	0	0	114.3	M297 L365 L366 A367 I405 T408 V409	M297-P363 CarbonylContact C-O 3.58Å; M297-P363 VanDerWaalsContact CA-O 3.26Å; M297-P363 WeakPolarHBondContact CA-O 3.25Å; M297-P363 CarbonylContact O-C 3.5Å; P363-L365 PolarHBondContact O-N 3.45Å; P363-L366 WeakPolarHBondContact O-CB 3.3Å; P363-L366 PolarHBondContact O-N 3.28Å; P363-L366 VanDerWaalsContact O-N 3.16Å; P363-A367 HydrophobicContact CB-CB 4.27Å; P363-A367 HydrophobicContact CG-CB 3.6Å; P363-I405 HydrophobicContact CG-CG2 3.83Å; P363-T408 HydrophobicContact CB-CG2 3.5Å; P363-T408 HydrophobicContact CG-CG2 4.22Å; P363-V409 HydrophobicContact CB-CG2 3.99Å; P363-V409 VanDerWaalsContact CD-CG2 3.43Å; P363-V409 HydrophobicContact CG-CG2 3.83Å
364	G	93.8	Very high	94.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	-134.6	178.6	0	0	0	0	0	114	T299 R360 L366 A367	T299-G364 WeakPolarHBondContact O-CA 3.46Å; R360-G364 PolarHBondContact O-N 3.39Å; G364-L366 PolarHBondContact O-N 3.37Å; G364-A367 PolarHBondContact O-N 3.19Å
365	L	96.6	Very high	94.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.3	-20	-178.2	-70.8	177.4	0	0	0	114.6	R296 T299 L301 Q308 P363 A367 L368 D369	R296-L365 VanDerWaalsContact CZ-CB 3.5Å; R296-L365 PolarHBondContact O-N 2.9Å; T299-L365 HydrophobicContact CG2-CD1 3.57Å; T299-L365 HydrophobicContact CG2-CG 4.39Å; T299-L365 WeakPolarHBondContact O-CG 3.4Å; T299-L365 PolarHBondContact O-N 3.39Å; L301-L365 HydrophobicContact CB-CD2 3.88Å; L301-L365 HydrophobicContact CD1-CD2 4.13Å; L301-L365 HydrophobicContact CG-CD2 4Å; Q308-L365 HydrophobicContact CG-CD2 4.47Å; P363-L365 PolarHBondContact O-N 3.45Å; L365-A367 VanDerWaalsContact C-N 3.25Å; L365-A367 PolarHBondContact O-N 2.77Å; L365-L368 HydrophobicContact CD2-CD2 4.29Å; L365-L368 WeakPolarHBondContact O-CB 3.41Å; L365-L368 PolarHBondContact O-N 2.75Å; L365-L368 VanDerWaalsContact O-N 3.08Å; L365-D369 PolarHBondContact O-N 3.1Å
366	L	97.8	Very high	95	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-62.6	-33.7	176.5	-178.2	61.2	0	0	0	112.1	L293 R296 M297 P363 G364 L368 D369 N370 T408 F439	L293-L366 HydrophobicContact CB-CD1 4.32Å; L293-L366 HydrophobicContact CB-CD2 4.14Å; L293-L366 HydrophobicContact CD2-CD1 4.14Å; R296-L366 HydrophobicContact CB-CB 4.19Å; R296-L366 PolarHBondContact O-N 3.43Å; M297-L366 HydrophobicContact CB-CB 4.36Å; M297-L366 HydrophobicContact CB-CD2 3.98Å; M297-L366 HydrophobicContact CG-CD2 4.37Å; P363-L366 WeakPolarHBondContact O-CB 3.3Å; P363-L366 PolarHBondContact O-N 3.28Å; P363-L366 VanDerWaalsContact O-N 3.16Å; G364-L366 PolarHBondContact O-N 3.37Å; L366-L368 VanDerWaalsContact C-N 3.33Å; L366-D369 PolarHBondContact O-N 3.25Å; L366-N370 WeakPolarHBondContact O-CB 3.35Å; L366-N370 PolarHBondContact O-N 3.36Å; L366-T408 HydrophobicContact CB-CG2 4.34Å; L366-T408 HydrophobicContact CD2-CG2 4.01Å; L366-T408 HydrophobicContact CG-CG2 3.87Å; L366-F439 HydrophobicContact CD1-CE1 4.05Å; L366-F439 HydrophobicContact CD2-CE1 3.91Å; L366-F439 HydrophobicContact CD2-CZ 3.99Å; L366-F439 HydrophobicContact CG-CE1 4.11Å
367	A	97.8	Very high	95.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.6	-37	174.3	0	0	0	0	0	112	L358 P363 G364 L365 N370 M371 I405 T408	L358-A367 HydrophobicContact CD2-CB 3.97Å; P363-A367 HydrophobicContact CB-CB 4.27Å; P363-A367 HydrophobicContact CG-CB 3.6Å; G364-A367 PolarHBondContact O-N 3.19Å; L365-A367 VanDerWaalsContact C-N 3.25Å; L365-A367 PolarHBondContact O-N 2.77Å; A367-N370 PolarHBondContact O-N 2.8Å; A367-M371 WeakPolarHBondContact O-CE 3.48Å; A367-M371 VanDerWaalsContact O-CG 3.31Å; A367-M371 WeakPolarHBondContact O-CG 3.41Å; A367-M371 PolarHBondContact O-N 3Å; A367-I405 HydrophobicContact CB-CB 4.45Å; A367-I405 HydrophobicContact CB-CG1 3.97Å; A367-T408 HydrophobicContact CB-CG2 4.37Å
368	L	97.2	Very high	95.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.4	-42.2	174.5	-178.3	58.5	0	0	0	111.3	L301 Q311 L312 L315 L358 L365 L366 N370 M371 L372	L301-L368 HydrophobicContact CD1-CD2 3.87Å; Q311-L368 HydrophobicContact CB-CD2 4.08Å; L312-L368 HydrophobicContact CD2-CD1 3.82Å; L312-L368 HydrophobicContact CD2-CD2 4.37Å; L312-L368 HydrophobicContact CG-CD1 4.46Å; L312-L368 HydrophobicContact CG-CD2 4.34Å; L315-L368 HydrophobicContact CD2-CD1 4.23Å; L358-L368 HydrophobicContact CD1-CB 4.27Å; L365-L368 HydrophobicContact CD2-CD2 4.29Å; L365-L368 WeakPolarHBondContact O-CB 3.41Å; L365-L368 PolarHBondContact O-N 2.75Å; L365-L368 VanDerWaalsContact O-N 3.08Å; L366-L368 VanDerWaalsContact C-N 3.33Å; L368-N370 VanDerWaalsContact C-N 3.35Å; L368-N370 PolarHBondContact O-N 3.06Å; L368-M371 HydrophobicContact CB-CE 4.48Å; L368-M371 HydrophobicContact CD1-CE 4.26Å; L368-M371 PolarHBondContact O-N 2.97Å; L368-L372 HydrophobicContact CD1-CD1 4.12Å; L368-L372 HydrophobicContact CD1-CG 4.26Å; L368-L372 HydrophobicContact CG-CD1 3.97Å; L368-L372 WeakPolarHBondContact O-CB 3.48Å; L368-L372 WeakPolarHBondContact O-CG 3.33Å; L368-L372 PolarHBondContact O-N 3.01Å
369	D	98.1	Very high	95.6	Very high	35 Å²	35	42 Å²	42	19%	0.187	20%	0.201	C	C	.	.	H	α-helix	trans	-59.5	-45.4	175.6	-64.1	-22	0	0	0	111.3	R296 L365 L366 L372 Y373	R296-D369 IonicContact CZ-OD1 3.19Å; R296-D369 IonicContact CZ-OD2 3.23Å; R296-D369 IonicContact NE-OD1 3.09Å; R296-D369 IonicContact NE-OD2 4Å; R296-D369 PolarHBondContact NE-OD2 3.1Å; R296-D369 IonicContact NH2-OD1 3.51Å; R296-D369 PolarHBondContact NH2-OD1 3.02Å; R296-D369 IonicContact NH2-OD2 3.98Å; R296-D369 PolarHBondContact NH2-OD2 3.13Å; L365-D369 PolarHBondContact O-N 3.1Å; L366-D369 PolarHBondContact O-N 3.25Å; D369-L372 PolarHBondContact O-N 2.97Å; D369-Y373 VanDerWaalsContact O-CB 3.27Å; D369-Y373 WeakPolarHBondContact O-CB 3.35Å; D369-Y373 PolarHBondContact O-N 2.61Å
370	N	98.4	Very high	95.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-46.3	175.4	-81.5	-18.3	0	0	0	113	L366 A367 L368 Y373 F374 T408 H440 F443	L366-N370 WeakPolarHBondContact O-CB 3.35Å; L366-N370 PolarHBondContact O-N 3.36Å; A367-N370 PolarHBondContact O-N 2.8Å; L368-N370 VanDerWaalsContact C-N 3.35Å; L368-N370 PolarHBondContact O-N 3.06Å; N370-Y373 PolarHBondContact O-N 3.49Å; N370-F374 WeakPolarHBondContact O-CB 3.23Å; N370-F374 PolarHBondContact O-N 3.17Å; N370-T408 VanDerWaalsContact ND2-CG2 3.3Å; N370-T408 WeakPolarHBondContact ND2-CG2 3.08Å; N370-T408 PolarHBondContact ND2-OG1 3.24Å; N370-H440 PolarHBondContact OD1-CD2 2.56Å; N370-F443 HydrophobicContact CB-CD1 3.72Å; N370-F443 HydrophobicContact CB-CD2 3.89Å; N370-F443 HydrophobicContact CB-CE1 3.81Å; N370-F443 HydrophobicContact CB-CE2 3.97Å; N370-F443 HydrophobicContact CB-CG 3.78Å; N370-F443 HydrophobicContact CB-CZ 3.94Å; N370-F443 WeakPolarHBondContact O-CE1 3.3Å
371	M	98.4	Very high	96.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-44.7	178.3	-73.3	-175.1	-72.3	0	0	111.6	L315 F349 L358 A367 L368 F374 S375 F400 A401	L315-M371 HydrophobicContact CD1-CB 3.87Å; L315-M371 HydrophobicContact CD2-CB 3.89Å; L315-M371 HydrophobicContact CD2-CE 4.25Å; L315-M371 HydrophobicContact CD2-SD 3.97Å; F349-M371 HydrophobicContact CZ-CE 4.25Å; L358-M371 HydrophobicContact CD2-CE 4.47Å; A367-M371 WeakPolarHBondContact O-CE 3.48Å; A367-M371 VanDerWaalsContact O-CG 3.31Å; A367-M371 WeakPolarHBondContact O-CG 3.41Å; A367-M371 PolarHBondContact O-N 3Å; L368-M371 HydrophobicContact CB-CE 4.48Å; L368-M371 HydrophobicContact CD1-CE 4.26Å; L368-M371 PolarHBondContact O-N 2.97Å; M371-F374 PolarHBondContact O-N 3.46Å; M371-S375 PolarHBondContact O-N 2.84Å; M371-F400 HydrophobicContact CB-CE1 4.22Å; M371-F400 HydrophobicContact CB-CZ 4.26Å; M371-F400 HydrophobicContact CG-CE1 3.81Å; M371-F400 HydrophobicContact CG-CZ 3.9Å; M371-F400 HydrophobicContact SD-CE1 3.86Å; M371-A401 HydrophobicContact SD-CB 4.18Å
372	L	97.9	Very high	96.4	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.042	15%	0.152	C	C	.	.	H	α-helix	trans	-66.9	-37.5	176.5	-73.8	168.3	0	0	0	112.5	Q311 A314 L315 L368 D369 S375 R376	Q311-L372 HydrophobicContact CB-CD1 3.84Å; Q311-L372 HydrophobicContact CG-CD1 3.97Å; A314-L372 HydrophobicContact CB-CD2 4.41Å; L315-L372 HydrophobicContact CB-CD2 3.93Å; L315-L372 HydrophobicContact CD1-CD2 4.42Å; L368-L372 HydrophobicContact CD1-CD1 4.12Å; L368-L372 HydrophobicContact CD1-CG 4.26Å; L368-L372 HydrophobicContact CG-CD1 3.97Å; L368-L372 WeakPolarHBondContact O-CB 3.48Å; L368-L372 WeakPolarHBondContact O-CG 3.33Å; L368-L372 PolarHBondContact O-N 3.01Å; D369-L372 PolarHBondContact O-N 2.97Å; L372-S375 PolarHBondContact O-N 3.31Å; L372-S375 PolarHBondContact O-OG 3Å; L372-S375 VanDerWaalsContact O-OG 3.04Å; L372-R376 WeakPolarHBondContact O-CB 3.41Å; L372-R376 VanDerWaalsContact O-CG 3.26Å; L372-R376 WeakPolarHBondContact O-CG 3.46Å; L372-R376 PolarHBondContact O-N 3.05Å; L372-R376 VanDerWaalsContact O-N 3.1Å
373	Y	98.3	Very high	96.5	Very high	25 Å²	25	27 Å²	27	10%	0.098	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-48.6	174.9	-171.6	-82.2	0	0	0	110	D369 N370 S375 R376 H377 H437 H440 E441	D369-Y373 VanDerWaalsContact O-CB 3.27Å; D369-Y373 WeakPolarHBondContact O-CB 3.35Å; D369-Y373 PolarHBondContact O-N 2.61Å; N370-Y373 PolarHBondContact O-N 3.49Å; Y373-S375 PolarHBondContact O-N 3.46Å; Y373-R376 PolarHBondContact O-N 3.38Å; Y373-H377 HydrophobicContact CD1-CB 4.2Å; Y373-H377 AromaticContact CD1-ND1 3.63Å; Y373-H377 AromaticContact CD2-CE1 3.4Å; Y373-H377 VanDerWaalsContact CD2-CE1 3.4Å; Y373-H377 WeakPolarHBondContact CD2-CE1 3.45Å; Y373-H377 AromaticContact CD2-ND1 3.51Å; Y373-H377 HydrophobicContact CE1-CB 3.86Å; Y373-H377 AromaticContact CE1-CG 3.64Å; Y373-H377 AromaticContact CE1-ND1 3.66Å; Y373-H377 AromaticContact CE2-CE1 3.27Å; Y373-H377 WeakPolarHBondContact CE2-CE1 3.22Å; Y373-H377 AromaticContact CE2-ND1 3.55Å; Y373-H377 AromaticContact CE2-NE2 3.63Å; Y373-H377 AromaticContact CG-CE1 3.94Å; Y373-H377 AromaticContact CG-ND1 3.54Å; Y373-H377 AromaticContact CZ-CD2 3.74Å; Y373-H377 AromaticContact CZ-CE1 3.7Å; Y373-H377 AromaticContact CZ-CG 3.64Å; Y373-H377 AromaticContact CZ-ND1 3.62Å; Y373-H377 AromaticContact CZ-NE2 3.8Å; Y373-H377 WeakPolarHBondContact O-CB 3.12Å; Y373-H377 PolarHBondContact O-N 3.1Å; Y373-H377 PolarHBondContact O-ND1 3.05Å; Y373-H437 HydrophobicContact CE2-CB 3.85Å; Y373-H440 HydrophobicContact CD1-CB 3.49Å; Y373-H440 VanDerWaalsContact CD1-CB 3.49Å; Y373-H440 HydrophobicContact CD2-CB 3.72Å; Y373-H440 AromaticContact CD2-CG 3.95Å; Y373-H440 HydrophobicContact CE1-CB 3.74Å; Y373-H440 HydrophobicContact CE2-CB 3.95Å; Y373-H440 HydrophobicContact CG-CB 3.49Å; Y373-H440 VanDerWaalsContact CG-CB 3.49Å; Y373-H440 AromaticContact CG-CG 4Å; Y373-E441 HydrophobicContact CE1-CG 4.35Å; Y373-E441 VanDerWaalsContact CE1-OE1 3.31Å; Y373-E441 WeakPolarHBondContact CE1-OE1 3.33Å; Y373-E441 PolarHBondContact OH-OE1 3.43Å
374	F	98.3	Very high	96.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.2	-43.2	177.9	-178.5	-127	0	0	0	112.4	N370 M371 R376 A378 A381 Y382 F400 F443 C444 I447 Q448	N370-F374 WeakPolarHBondContact O-CB 3.23Å; N370-F374 PolarHBondContact O-N 3.17Å; M371-F374 PolarHBondContact O-N 3.46Å; F374-R376 VanDerWaalsContact C-N 3.26Å; F374-R376 PolarHBondContact O-N 3.41Å; F374-A378 HydrophobicContact CD2-CB 3.78Å; F374-A378 HydrophobicContact CE2-CB 3.72Å; F374-A378 CarbonylContact O-C 3.37Å; F374-A378 WeakPolarHBondContact O-CA 3.4Å; F374-A378 PolarHBondContact O-N 3.42Å; F374-A381 HydrophobicContact CE2-CB 3.95Å; F374-A381 HydrophobicContact CZ-CB 3.87Å; F374-Y382 AromaticContact CD1-CD2 3.74Å; F374-Y382 HydrophobicContact CD1-CD2 3.74Å; F374-Y382 HydrophobicContact CD1-CG 4.28Å; F374-Y382 AromaticContact CE1-CD2 3.97Å; F374-Y382 HydrophobicContact CE1-CD2 3.97Å; F374-Y382 HydrophobicContact CE1-CG 4.41Å; F374-F400 AromaticContact CD1-CE2 3.74Å; F374-F400 HydrophobicContact CD1-CE2 3.74Å; F374-F400 HydrophobicContact CD1-CZ 4.01Å; F374-F400 AromaticContact CE1-CE2 3.9Å; F374-F400 HydrophobicContact CE1-CE2 3.9Å; F374-F443 HydrophobicContact CB-CD1 4.45Å; F374-F443 HydrophobicContact CB-CE1 4.07Å; F374-C444 HydrophobicContact CD2-CB 3.95Å; F374-C444 HydrophobicContact CE2-CB 4.47Å; F374-I447 HydrophobicContact CD1-CG2 4.16Å; F374-I447 HydrophobicContact CD2-CG2 4.25Å; F374-I447 HydrophobicContact CE1-CG2 3.98Å; F374-I447 HydrophobicContact CE2-CG2 4.09Å; F374-I447 HydrophobicContact CG-CG2 4.29Å; F374-I447 HydrophobicContact CZ-CG2 3.96Å; F374-Q448 HydrophobicContact CE2-CG 4.27Å; F374-Q448 HydrophobicContact CZ-CG 4.17Å
375	S	97.2	Very high	96.4	Very high	9 Å²	9	33.2 Å²	33.2	6%	0.063	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-30.2	178.8	77.8	0	0	0	0	113.1	M371 L372 Y373 P379 Y382	M371-S375 PolarHBondContact O-N 2.84Å; L372-S375 PolarHBondContact O-N 3.31Å; L372-S375 PolarHBondContact O-OG 3Å; L372-S375 VanDerWaalsContact O-OG 3.04Å; Y373-S375 PolarHBondContact O-N 3.46Å; S375-P379 WeakPolarHBondContact O-CA 3.43Å; S375-Y382 VanDerWaalsContact CB-CD1 3.49Å
376	R	96.6	Very high	96.3	Very high	163 Å²	163	33.3 Å²	33.3	62%	0.615	17%	0.169	S	C	*	.	H	α-helix	trans	-88.3	-40.3	-179.2	-69.2	172.6	-177.6	174.1	1.5	113.3	L372 Y373 F374	L372-R376 WeakPolarHBondContact O-CB 3.41Å; L372-R376 VanDerWaalsContact O-CG 3.26Å; L372-R376 WeakPolarHBondContact O-CG 3.46Å; L372-R376 PolarHBondContact O-N 3.05Å; L372-R376 VanDerWaalsContact O-N 3.1Å; Y373-R376 PolarHBondContact O-N 3.38Å; F374-R376 VanDerWaalsContact C-N 3.26Å; F374-R376 PolarHBondContact O-N 3.41Å
377	H	95.8	Very high	95.9	Very high	108 Å²	108	37.3 Å²	37.3	50%	0.5	19%	0.19	S	C	.	.	H	α-helix	trans	-93.5	-22.6	-173.1	-63.1	81.6	0	0	0	113.1	Y373 P379	Y373-H377 HydrophobicContact CD1-CB 4.2Å; Y373-H377 AromaticContact CD1-ND1 3.63Å; Y373-H377 AromaticContact CD2-CE1 3.4Å; Y373-H377 VanDerWaalsContact CD2-CE1 3.4Å; Y373-H377 WeakPolarHBondContact CD2-CE1 3.45Å; Y373-H377 AromaticContact CD2-ND1 3.51Å; Y373-H377 HydrophobicContact CE1-CB 3.86Å; Y373-H377 AromaticContact CE1-CG 3.64Å; Y373-H377 AromaticContact CE1-ND1 3.66Å; Y373-H377 AromaticContact CE2-CE1 3.27Å; Y373-H377 WeakPolarHBondContact CE2-CE1 3.22Å; Y373-H377 AromaticContact CE2-ND1 3.55Å; Y373-H377 AromaticContact CE2-NE2 3.63Å; Y373-H377 AromaticContact CG-CE1 3.94Å; Y373-H377 AromaticContact CG-ND1 3.54Å; Y373-H377 AromaticContact CZ-CD2 3.74Å; Y373-H377 AromaticContact CZ-CE1 3.7Å; Y373-H377 AromaticContact CZ-CG 3.64Å; Y373-H377 AromaticContact CZ-ND1 3.62Å; Y373-H377 AromaticContact CZ-NE2 3.8Å; Y373-H377 WeakPolarHBondContact O-CB 3.12Å; Y373-H377 PolarHBondContact O-N 3.1Å; Y373-H377 PolarHBondContact O-ND1 3.05Å; H377-P379 VanDerWaalsContact C-CD 3.47Å
378	A	95.4	Very high	95.6	Very high	22 Å²	22	41 Å²	41	18%	0.182	21%	0.207	C	C	.	.	S	Bend	trans	-132.4	56.6	174.7	0	0	0	0	0	111.4	F374 S380 A381 Y382	F374-A378 HydrophobicContact CD2-CB 3.78Å; F374-A378 HydrophobicContact CE2-CB 3.72Å; F374-A378 CarbonylContact O-C 3.37Å; F374-A378 WeakPolarHBondContact O-CA 3.4Å; F374-A378 PolarHBondContact O-N 3.42Å; A378-S380 VanDerWaalsContact C-N 3.3Å; A378-S380 PolarHBondContact O-N 3.21Å; A378-A381 HydrophobicContact CB-CB 4.12Å; A378-A381 PolarHBondContact O-N 2.93Å; A378-Y382 PolarHBondContact O-N 2.88Å
379	P	94.8	Very high	95.2	Very high	68 Å²	68	41.2 Å²	41.2	44%	0.442	21%	0.208	S	C	.	.	H	α-helix	trans	-58.2	-40.4	-171.2	23.1	-33.9	0	0	0	112.5	S375 H377 A381 Y382 S383	S375-P379 WeakPolarHBondContact O-CA 3.43Å; H377-P379 VanDerWaalsContact C-CD 3.47Å; P379-A381 PolarHBondContact O-N 3.48Å; P379-Y382 PolarHBondContact O-N 2.98Å; P379-S383 WeakPolarHBondContact O-CB 3.47Å; P379-S383 PolarHBondContact O-N 2.72Å; P379-S383 PolarHBondContact O-OG 3.11Å; P379-S383 VanDerWaalsContact O-OG 3.08Å
380	S	94.3	Very high	94.6	Very high	82 Å²	82	40.5 Å²	40.5	57%	0.573	21%	0.206	S	C	*	.	H	α-helix	trans	-65.6	-36.5	178.1	62.4	0	0	0	0	113	A378 R384	A378-S380 VanDerWaalsContact C-N 3.3Å; A378-S380 PolarHBondContact O-N 3.21Å; S380-R384 WeakPolarHBondContact O-CB 3.27Å; S380-R384 PolarHBondContact O-N 2.5Å; S380-R384 VanDerWaalsContact O-N 3.17Å
381	A	95.5	Very high	93.7	Very high	11 Å²	11	44.9 Å²	44.9	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-73.8	-38.3	175.9	0	0	0	0	0	111.4	F374 A378 P379 F385	F374-A381 HydrophobicContact CE2-CB 3.95Å; F374-A381 HydrophobicContact CZ-CB 3.87Å; A378-A381 HydrophobicContact CB-CB 4.12Å; A378-A381 PolarHBondContact O-N 2.93Å; P379-A381 PolarHBondContact O-N 3.48Å; A381-F385 WeakPolarHBondContact O-CB 3.43Å; A381-F385 PolarHBondContact O-N 2.91Å
382	Y	96.5	Very high	92.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-57.1	175.5	172.2	-111.7	0	0	0	112.2	L315 A318 A319 L347 F374 S375 A378 P379 R384 F385 V386 F400	L315-Y382 HydrophobicContact CD1-CE2 4.05Å; L315-Y382 VanDerWaalsContact CD1-OH 3.28Å; L315-Y382 WeakPolarHBondContact CD1-OH 3.33Å; L315-Y382 PolarHBondContact O-OH 3.27Å; A318-Y382 HydrophobicContact CB-CD1 4.39Å; A318-Y382 HydrophobicContact CB-CE1 3.77Å; A319-Y382 HydrophobicContact CB-CE1 3.72Å; L347-Y382 WeakPolarHBondContact CD2-OH 3.4Å; F374-Y382 AromaticContact CD1-CD2 3.74Å; F374-Y382 HydrophobicContact CD1-CD2 3.74Å; F374-Y382 HydrophobicContact CD1-CG 4.28Å; F374-Y382 AromaticContact CE1-CD2 3.97Å; F374-Y382 HydrophobicContact CE1-CD2 3.97Å; F374-Y382 HydrophobicContact CE1-CG 4.41Å; S375-Y382 VanDerWaalsContact CB-CD1 3.49Å; A378-Y382 PolarHBondContact O-N 2.88Å; P379-Y382 PolarHBondContact O-N 2.98Å; Y382-R384 VanDerWaalsContact C-N 3.28Å; Y382-R384 PolarHBondContact O-N 3.14Å; Y382-F385 WeakPolarHBondContact O-CB 3.27Å; Y382-F385 PolarHBondContact O-N 2.88Å; Y382-F385 VanDerWaalsContact O-N 3.11Å; Y382-V386 HydrophobicContact CD2-CG2 4.06Å; Y382-V386 HydrophobicContact CE2-CG2 3.63Å; Y382-V386 PolarHBondContact O-N 3.45Å; Y382-F400 HydrophobicContact CD2-CE1 4.25Å; Y382-F400 HydrophobicContact CD2-CE2 4.11Å; Y382-F400 AromaticContact CD2-CZ 3.81Å; Y382-F400 HydrophobicContact CD2-CZ 3.81Å; Y382-F400 HydrophobicContact CE2-CD1 4.15Å; Y382-F400 AromaticContact CE2-CE1 3.55Å; Y382-F400 HydrophobicContact CE2-CE1 3.55Å; Y382-F400 HydrophobicContact CE2-CE2 4.21Å; Y382-F400 AromaticContact CE2-CZ 3.57Å; Y382-F400 HydrophobicContact CE2-CZ 3.57Å
383	S	92.7	Very high	91.7	Very high	34 Å²	34	58.2 Å²	58.2	24%	0.238	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-40.7	179.2	-54.7	0	0	0	0	111	P379 V386 L387	P379-S383 WeakPolarHBondContact O-CB 3.47Å; P379-S383 PolarHBondContact O-N 2.72Å; P379-S383 PolarHBondContact O-OG 3.11Å; P379-S383 VanDerWaalsContact O-OG 3.08Å; S383-V386 PolarHBondContact O-N 3.01Å; S383-L387 VanDerWaalsContact O-CB 3.24Å; S383-L387 WeakPolarHBondContact O-CB 3.25Å; S383-L387 WeakPolarHBondContact O-CG 3.44Å; S383-L387 PolarHBondContact O-N 2.87Å
384	R	92.6	Very high	91	Very high	126 Å²	126	60.2 Å²	60.2	48%	0.475	31%	0.308	S	S	.	.	H	α-helix	trans	-58.8	-49.6	174	-174.4	-173.8	-53.7	108.2	3.4	111.6	S380 Y382 V386 E388	S380-R384 WeakPolarHBondContact O-CB 3.27Å; S380-R384 PolarHBondContact O-N 2.5Å; S380-R384 VanDerWaalsContact O-N 3.17Å; Y382-R384 VanDerWaalsContact C-N 3.28Å; Y382-R384 PolarHBondContact O-N 3.14Å; R384-V386 PolarHBondContact O-N 2.97Å; R384-E388 VanDerWaalsContact CD-OE1 3.3Å; R384-E388 WeakPolarHBondContact CD-OE1 3.22Å; R384-E388 VanDerWaalsContact CG-CD 3.42Å; R384-E388 HydrophobicContact CG-CG 4.01Å; R384-E388 WeakPolarHBondContact CG-OE1 3.19Å; R384-E388 WeakPolarHBondContact O-CB 3.42Å; R384-E388 WeakPolarHBondContact O-CG 3.33Å; R384-E388 PolarHBondContact O-N 2.6Å
385	F	94.7	Very high	90.5	Very high	5 Å²	5	68 Å²	68	2%	0.022	34%	0.342	C	S	.	.	H	α-helix	trans	-55.4	-53.7	178	-170.8	-52.3	0	0	0	110.6	A381 Y382 N389 C398 F400 I447 N451	A381-F385 WeakPolarHBondContact O-CB 3.43Å; A381-F385 PolarHBondContact O-N 2.91Å; Y382-F385 WeakPolarHBondContact O-CB 3.27Å; Y382-F385 PolarHBondContact O-N 2.88Å; Y382-F385 VanDerWaalsContact O-N 3.11Å; F385-N389 WeakPolarHBondContact CD1-ND2 3.35Å; F385-N389 WeakPolarHBondContact O-CB 3.4Å; F385-N389 PolarHBondContact O-N 2.61Å; F385-N389 PolarHBondContact O-ND2 2.96Å; F385-C398 HydrophobicContact CE1-CB 4.32Å; F385-C398 HydrophobicContact CZ-CB 4.39Å; F385-F400 HydrophobicContact CD1-CB 3.8Å; F385-F400 AromaticContact CD1-CD2 3.81Å; F385-F400 HydrophobicContact CD1-CD2 3.81Å; F385-F400 HydrophobicContact CD1-CG 4.22Å; F385-F400 HydrophobicContact CD2-CD2 4.22Å; F385-F400 HydrophobicContact CE1-CB 3.57Å; F385-F400 AromaticContact CE1-CD2 3.9Å; F385-F400 HydrophobicContact CE1-CD2 3.9Å; F385-F400 HydrophobicContact CE1-CG 4.24Å; F385-F400 HydrophobicContact CE2-CD2 4.2Å; F385-F400 HydrophobicContact CG-CD2 4.05Å; F385-F400 HydrophobicContact CZ-CB 4.34Å; F385-F400 HydrophobicContact CZ-CD2 4.1Å; F385-I447 HydrophobicContact CD2-CG1 4.39Å; F385-I447 HydrophobicContact CE2-CD1 4.03Å; F385-I447 HydrophobicContact CE2-CG1 3.81Å; F385-I447 WeakPolarHBondContact CE2-O 3.37Å; F385-I447 HydrophobicContact CZ-CD1 4.35Å; F385-N451 HydrophobicContact CD2-CB 3.81Å; F385-N451 HydrophobicContact CE2-CB 3.43Å; F385-N451 VanDerWaalsContact CE2-CB 3.43Å; F385-N451 HydrophobicContact CZ-CB 3.97Å
386	V	93.6	Very high	90.2	Very high	2 Å²	2	70.4 Å²	70.4	1%	0.012	35%	0.352	C	S	.	.	H	α-helix	trans	-67.3	-45.9	-173.1	178.1	0	0	0	0	111.2	A319 F320 L347 Y382 S383 R384 N389 S390 F400	A319-V386 HydrophobicContact CB-CB 4.16Å; A319-V386 HydrophobicContact CB-CG1 3.83Å; A319-V386 HydrophobicContact CB-CG2 4.26Å; F320-V386 HydrophobicContact CE1-CG1 4.09Å; F320-V386 HydrophobicContact CZ-CG1 3.83Å; L347-V386 HydrophobicContact CD2-CG1 3.82Å; L347-V386 HydrophobicContact CD2-CG2 3.93Å; Y382-V386 HydrophobicContact CD2-CG2 4.06Å; Y382-V386 HydrophobicContact CE2-CG2 3.63Å; Y382-V386 PolarHBondContact O-N 3.45Å; S383-V386 PolarHBondContact O-N 3.01Å; R384-V386 PolarHBondContact O-N 2.97Å; V386-N389 PolarHBondContact O-N 3.21Å; V386-S390 WeakPolarHBondContact O-CB 3.39Å; V386-S390 PolarHBondContact O-N 3.28Å; V386-S390 PolarHBondContact O-OG 3.37Å; V386-F400 HydrophobicContact CG2-CB 4.37Å; V386-F400 HydrophobicContact CG2-CD1 4.28Å; V386-F400 HydrophobicContact CG2-CG 4.15Å
387	L	90.8	Very high	90	Very high	86 Å²	86	66.6 Å²	66.6	45%	0.45	34%	0.341	S	S	.	.	H	α-helix	trans	-69.7	-41.5	-177.7	-65.1	174.6	0	0	0	111.9	F320 S383 N389 S391	F320-L387 HydrophobicContact CD1-CD2 4.41Å; F320-L387 HydrophobicContact CE1-CD2 4.46Å; S383-L387 VanDerWaalsContact O-CB 3.24Å; S383-L387 WeakPolarHBondContact O-CB 3.25Å; S383-L387 WeakPolarHBondContact O-CG 3.44Å; S383-L387 PolarHBondContact O-N 2.87Å; L387-N389 PolarHBondContact O-N 3.14Å; L387-S391 WeakPolarHBondContact O-CB 3.38Å; L387-S391 PolarHBondContact O-N 3.45Å; L387-S391 PolarHBondContact O-OG 3.48Å
388	E	90.4	Very high	89.9	Confident	76 Å²	76	61.6 Å²	61.6	36%	0.355	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-27.1	176.7	-75.8	178.8	177	0	0	113.2	R384 R392 K455	R384-E388 VanDerWaalsContact CD-OE1 3.3Å; R384-E388 WeakPolarHBondContact CD-OE1 3.22Å; R384-E388 VanDerWaalsContact CG-CD 3.42Å; R384-E388 HydrophobicContact CG-CG 4.01Å; R384-E388 WeakPolarHBondContact CG-OE1 3.19Å; R384-E388 WeakPolarHBondContact O-CB 3.42Å; R384-E388 WeakPolarHBondContact O-CG 3.33Å; R384-E388 PolarHBondContact O-N 2.6Å; E388-R392 VanDerWaalsContact O-CD 3.27Å; E388-R392 WeakPolarHBondContact O-CD 3.3Å; E388-R392 WeakPolarHBondContact O-CG 3.43Å; E388-K455 IonicContact OE2-NZ 2.84Å; E388-K455 PolarHBondContact OE2-NZ 2.78Å
389	N	88.6	Confident	89.9	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.032	31%	0.313	C	S	.	.	H	α-helix	trans	-97.4	-32.8	-179.3	-73.4	-72.3	0	0	0	112.6	F385 V386 L387 E397 C398 N451	F385-N389 WeakPolarHBondContact CD1-ND2 3.35Å; F385-N389 WeakPolarHBondContact O-CB 3.4Å; F385-N389 PolarHBondContact O-N 2.61Å; F385-N389 PolarHBondContact O-ND2 2.96Å; V386-N389 PolarHBondContact O-N 3.21Å; L387-N389 PolarHBondContact O-N 3.14Å; N389-E397 WeakPolarHBondContact O-CB 3.4Å; N389-C398 WeakPolarHBondContact CB-O 3.49Å; N389-C398 WeakPolarHBondContact OD1-CB 3.45Å; N389-C398 PolarHBondContact OD1-N 3.4Å; N389-N451 PolarHBondContact ND2-OD1 2.96Å
390	S	85.8	Confident	89.9	Confident	20 Å²	20	58 Å²	58	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-82.2	-15.9	-178.9	64.5	0	0	0	0	115.1	K346 V386	K346-S390 WeakPolarHBondContact O-CB 3.26Å; V386-S390 WeakPolarHBondContact O-CB 3.39Å; V386-S390 PolarHBondContact O-N 3.28Å; V386-S390 PolarHBondContact O-OG 3.37Å
391	S	80.6	Confident	90	Very high	91 Å²	91	54.1 Å²	54.1	64%	0.636	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-4.6	175.3	60.3	0	0	0	0	113.2	L387	L387-S391 WeakPolarHBondContact O-CB 3.38Å; L387-S391 PolarHBondContact O-N 3.45Å; L387-S391 PolarHBondContact O-OG 3.48Å
392	R	78.5	Confident	90.1	Very high	84 Å²	84	56.5 Å²	56.5	32%	0.317	27%	0.273	S	S	.	.			trans	-78.8	134.3	177.4	-65.9	-177.4	83.8	-172.9	3.8	109.5	E388 D394 H396	E388-R392 VanDerWaalsContact O-CD 3.27Å; E388-R392 WeakPolarHBondContact O-CD 3.3Å; E388-R392 WeakPolarHBondContact O-CG 3.43Å; R392-D394 IonicContact CZ-OD1 3.41Å; R392-D394 VanDerWaalsContact CZ-OD1 3.29Å; R392-D394 IonicContact CZ-OD2 2.72Å; R392-D394 IonicContact NE-OD1 2.63Å; R392-D394 PolarHBondContact NE-OD1 3.02Å; R392-D394 IonicContact NE-OD2 3.29Å; R392-D394 PolarHBondContact NE-OD2 2.98Å; R392-D394 IonicContact NH1-OD1 3.18Å; R392-D394 IonicContact NH2-OD1 3.97Å; R392-D394 PolarHBondContact NH2-OD1 3.37Å; R392-D394 IonicContact NH2-OD2 3.33Å; R392-D394 PolarHBondContact NH2-OD2 3.15Å; R392-H396 VanDerWaalsContact NH1-CB 3.31Å; R392-H396 PolarHBondContact NH1-O 3.27Å
393	E	75.3	Confident	90.1	Very high	204 Å²	204	56.5 Å²	56.5	95%	0.953	27%	0.273	S	S	*	.			trans	-96.6	-1.4	172.7	-59.4	-174.5	166	0	0	111.7
394	D	82.8	Confident	90.4	Very high	68 Å²	68	54.9 Å²	54.9	36%	0.364	26%	0.262	S	S	.	.	S	Bend	trans	-92	169	178.8	69.6	26.1	0	0	0	112.6	R392 H396	R392-D394 IonicContact CZ-OD1 3.41Å; R392-D394 VanDerWaalsContact CZ-OD1 3.29Å; R392-D394 IonicContact CZ-OD2 2.72Å; R392-D394 IonicContact NE-OD1 2.63Å; R392-D394 PolarHBondContact NE-OD1 3.02Å; R392-D394 IonicContact NE-OD2 3.29Å; R392-D394 PolarHBondContact NE-OD2 2.98Å; R392-D394 IonicContact NH1-OD1 3.18Å; R392-D394 IonicContact NH2-OD1 3.97Å; R392-D394 PolarHBondContact NH2-OD1 3.37Å; R392-D394 IonicContact NH2-OD2 3.33Å; R392-D394 PolarHBondContact NH2-OD2 3.15Å; D394-H396 PolarHBondContact O-N 3.29Å; D394-H396 VanDerWaalsContact O-N 3.11Å; D394-H396 WeakPolarHBondContact OD1-CB 3.25Å; D394-H396 IonicContact OD1-CD2 3.94Å; D394-H396 PolarHBondContact OD1-N 2.96Å; D394-H396 IonicContact OD2-CD2 2.8Å
395	K	88.1	Confident	90.7	Very high	164 Å²	164	49.5 Å²	49.5	71%	0.713	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	5.5	-178.2	-62.2	-175.1	179.3	-176	0	114.1	T460	K395-T460 HydrophobicContact CB-CG2 4.1Å; K395-T460 WeakPolarHBondContact O-CA 3.4Å; K395-T460 WeakPolarHBondContact O-CB 3.34Å
396	H	91.1	Very high	90.8	Very high	59 Å²	59	52.9 Å²	52.9	27%	0.273	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	12.9	-170.6	-62.4	-72.2	0	0	0	113.5	R392 D394 C398 W454 R458 A459	R392-H396 VanDerWaalsContact NH1-CB 3.31Å; R392-H396 PolarHBondContact NH1-O 3.27Å; D394-H396 PolarHBondContact O-N 3.29Å; D394-H396 VanDerWaalsContact O-N 3.11Å; D394-H396 WeakPolarHBondContact OD1-CB 3.25Å; D394-H396 IonicContact OD1-CD2 3.94Å; D394-H396 PolarHBondContact OD1-N 2.96Å; D394-H396 IonicContact OD2-CD2 2.8Å; H396-C398 PolarHBondContact O-N 3.05Å; H396-W454 PolarHBondContact O-NE1 2.98Å; H396-R458 PolarHBondContact CE1-O 3.35Å; H396-R458 PolarHBondContact ND1-O 3.4Å; H396-A459 WeakPolarHBondContact CA-O 3.37Å; H396-A459 PolarHBondContact ND1-O 3Å
397	E	92	Very high	91.1	Very high	83 Å²	83	52.8 Å²	52.8	39%	0.388	26%	0.258	S	S	.	.			trans	-61.1	126.6	171.7	62.2	-174.4	-165.9	0	0	111.5	N389 W454 Q461	N389-E397 WeakPolarHBondContact O-CB 3.4Å; E397-W454 VanDerWaalsContact O-CZ2 3.3Å; E397-W454 WeakPolarHBondContact O-CZ2 3.48Å; E397-Q461 PolarHBondContact O-NE2 2.76Å
398	C	94	Very high	91.4	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.02	24%	0.236	C	C	.	.			trans	-85.8	119.5	171.4	-173.7	0	0	0	0	109.1	F385 N389 H396 F400 L450 W454	F385-C398 HydrophobicContact CE1-CB 4.32Å; F385-C398 HydrophobicContact CZ-CB 4.39Å; N389-C398 WeakPolarHBondContact CB-O 3.49Å; N389-C398 WeakPolarHBondContact OD1-CB 3.45Å; N389-C398 PolarHBondContact OD1-N 3.4Å; H396-C398 PolarHBondContact O-N 3.05Å; C398-F400 PolarHBondContact O-N 3.32Å; C398-F400 VanDerWaalsContact O-N 3.12Å; C398-L450 VanDerWaalsContact SG-CD2 3.58Å; C398-W454 HydrophobicContact CB-CB 4.47Å; C398-W454 HydrophobicContact CB-CD2 3.83Å; C398-W454 HydrophobicContact CB-CE3 4.48Å; C398-W454 HydrophobicContact CB-CG 3.78Å
399	P	94.8	Very high	91.8	Very high	11 Å²	11	46 Å²	46	7%	0.071	23%	0.225	C	C	.	.			trans	-78.1	104	-174.8	31.8	-30.8	0	0	0	109.6	A401 K402 S403 F464	P399-A401 PolarHBondContact O-N 3.31Å; P399-K402 HydrophobicContact CB-CB 4.03Å; P399-K402 HydrophobicContact CG-CB 4.03Å; P399-K402 HydrophobicContact CG-CD 4.13Å; P399-S403 WeakPolarHBondContact O-CB 3.36Å; P399-S403 PolarHBondContact O-N 3.46Å; P399-S403 PolarHBondContact O-OG 2.94Å; P399-F464 HydrophobicContact CG-CD2 4.13Å; P399-F464 HydrophobicContact CG-CE2 4Å
400	F	96.6	Very high	92.3	Very high	3 Å²	3	46 Å²	46	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-56	-50.5	-172.7	168.9	-98	0	0	0	113	L347 M371 F374 Y382 F385 V386 C398 S403 S404 I447	L347-F400 HydrophobicContact CD2-CD1 4.43Å; L347-F400 WeakPolarHBondContact O-CB 3.28Å; L347-F400 PolarHBondContact O-N 3.01Å; M371-F400 HydrophobicContact CB-CE1 4.22Å; M371-F400 HydrophobicContact CB-CZ 4.26Å; M371-F400 HydrophobicContact CG-CE1 3.81Å; M371-F400 HydrophobicContact CG-CZ 3.9Å; M371-F400 HydrophobicContact SD-CE1 3.86Å; F374-F400 AromaticContact CD1-CE2 3.74Å; F374-F400 HydrophobicContact CD1-CE2 3.74Å; F374-F400 HydrophobicContact CD1-CZ 4.01Å; F374-F400 AromaticContact CE1-CE2 3.9Å; F374-F400 HydrophobicContact CE1-CE2 3.9Å; Y382-F400 HydrophobicContact CD2-CE1 4.25Å; Y382-F400 HydrophobicContact CD2-CE2 4.11Å; Y382-F400 AromaticContact CD2-CZ 3.81Å; Y382-F400 HydrophobicContact CD2-CZ 3.81Å; Y382-F400 HydrophobicContact CE2-CD1 4.15Å; Y382-F400 AromaticContact CE2-CE1 3.55Å; Y382-F400 HydrophobicContact CE2-CE1 3.55Å; Y382-F400 HydrophobicContact CE2-CE2 4.21Å; Y382-F400 AromaticContact CE2-CZ 3.57Å; Y382-F400 HydrophobicContact CE2-CZ 3.57Å; F385-F400 HydrophobicContact CD1-CB 3.8Å; F385-F400 AromaticContact CD1-CD2 3.81Å; F385-F400 HydrophobicContact CD1-CD2 3.81Å; F385-F400 HydrophobicContact CD1-CG 4.22Å; F385-F400 HydrophobicContact CD2-CD2 4.22Å; F385-F400 HydrophobicContact CE1-CB 3.57Å; F385-F400 AromaticContact CE1-CD2 3.9Å; F385-F400 HydrophobicContact CE1-CD2 3.9Å; F385-F400 HydrophobicContact CE1-CG 4.24Å; F385-F400 HydrophobicContact CE2-CD2 4.2Å; F385-F400 HydrophobicContact CG-CD2 4.05Å; F385-F400 HydrophobicContact CZ-CB 4.34Å; F385-F400 HydrophobicContact CZ-CD2 4.1Å; V386-F400 HydrophobicContact CG2-CB 4.37Å; V386-F400 HydrophobicContact CG2-CD1 4.28Å; V386-F400 HydrophobicContact CG2-CG 4.15Å; C398-F400 PolarHBondContact O-N 3.32Å; C398-F400 VanDerWaalsContact O-N 3.12Å; F400-S403 PolarHBondContact O-N 2.79Å; F400-S404 WeakPolarHBondContact O-CB 3.45Å; F400-S404 PolarHBondContact O-N 2.95Å; F400-S404 PolarHBondContact O-OG 3.16Å; F400-I447 HydrophobicContact CD2-CG1 4.34Å; F400-I447 HydrophobicContact CE2-CG1 4.07Å
401	A	96.2	Very high	92.8	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-49.4	-176.2	0	0	0	0	0	112.4	L347 F349 M371 P399 S403 S404 I405	L347-A401 PolarHBondContact O-N 3.2Å; F349-A401 HydrophobicContact CB-CB 4.45Å; F349-A401 HydrophobicContact CD1-CB 3.62Å; F349-A401 HydrophobicContact CD2-CB 3.69Å; F349-A401 HydrophobicContact CE1-CB 3.63Å; F349-A401 HydrophobicContact CE2-CB 3.7Å; F349-A401 HydrophobicContact CG-CB 3.65Å; F349-A401 HydrophobicContact CZ-CB 3.67Å; M371-A401 HydrophobicContact SD-CB 4.18Å; P399-A401 PolarHBondContact O-N 3.31Å; A401-S403 VanDerWaalsContact C-N 3.29Å; A401-S403 PolarHBondContact O-N 3.14Å; A401-S404 WeakPolarHBondContact O-CB 3.48Å; A401-S404 PolarHBondContact O-N 3.16Å; A401-S404 VanDerWaalsContact O-N 3.15Å; A401-I405 WeakPolarHBondContact O-CG1 3.19Å; A401-I405 PolarHBondContact O-N 3.43Å
402	K	96	Very high	93.6	Very high	62 Å²	62	41 Å²	41	27%	0.27	19%	0.19	S	C	.	.	H	α-helix	trans	-56	-43.5	174.7	-176.5	-175.3	175	-173.4	0	111.8	G348 P399 Q406 F464	G348-K402 WeakPolarHBondContact O-CB 3.45Å; G348-K402 PolarHBondContact O-N 3.32Å; P399-K402 HydrophobicContact CB-CB 4.03Å; P399-K402 HydrophobicContact CG-CB 4.03Å; P399-K402 HydrophobicContact CG-CD 4.13Å; K402-Q406 WeakPolarHBondContact O-CG 3.24Å; K402-Q406 PolarHBondContact O-N 3.42Å; K402-Q406 VanDerWaalsContact O-N 3.14Å; K402-F464 HydrophobicContact CD-CD2 4.32Å; K402-F464 HydrophobicContact CD-CE2 4.03Å; K402-F464 HydrophobicContact CD-CZ 4.22Å; K402-F464 HydrophobicContact CG-CE2 4.02Å; K402-F464 HydrophobicContact CG-CZ 3.89Å
403	S	97.8	Very high	94.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-42.7	176.9	-55.1	0	0	0	0	111.9	P399 F400 A401 Q406 L407	P399-S403 WeakPolarHBondContact O-CB 3.36Å; P399-S403 PolarHBondContact O-N 3.46Å; P399-S403 PolarHBondContact O-OG 2.94Å; F400-S403 PolarHBondContact O-N 2.79Å; A401-S403 VanDerWaalsContact C-N 3.29Å; A401-S403 PolarHBondContact O-N 3.14Å; S403-Q406 PolarHBondContact O-N 3.27Å; S403-L407 WeakPolarHBondContact O-CB 3.34Å; S403-L407 PolarHBondContact O-N 2.72Å
404	S	98.2	Very high	95.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-41.4	178.8	-62.6	0	0	0	0	112.7	F400 A401 T408	F400-S404 WeakPolarHBondContact O-CB 3.45Å; F400-S404 PolarHBondContact O-N 2.95Å; F400-S404 PolarHBondContact O-OG 3.16Å; A401-S404 WeakPolarHBondContact O-CB 3.48Å; A401-S404 PolarHBondContact O-N 3.16Å; A401-S404 VanDerWaalsContact O-N 3.15Å; S404-T408 WeakPolarHBondContact O-CB 2.94Å; S404-T408 PolarHBondContact O-N 3.43Å; S404-T408 PolarHBondContact O-OG1 2.88Å
405	I	98.1	Very high	96	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.062	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-53.2	176	-66.7	167.4	0	0	0	109.7	D357 L358 P363 A367 A401 L407 T408 V409	D357-I405 HydrophobicContact CB-CD1 3.84Å; L358-I405 HydrophobicContact CD2-CD1 3.83Å; L358-I405 HydrophobicContact CD2-CG1 3.83Å; L358-I405 HydrophobicContact CG-CD1 4.28Å; P363-I405 HydrophobicContact CG-CG2 3.83Å; A367-I405 HydrophobicContact CB-CB 4.45Å; A367-I405 HydrophobicContact CB-CG1 3.97Å; A401-I405 WeakPolarHBondContact O-CG1 3.19Å; A401-I405 PolarHBondContact O-N 3.43Å; I405-L407 PolarHBondContact O-N 3.01Å; I405-T408 PolarHBondContact O-N 2.86Å; I405-V409 PolarHBondContact O-N 3.48Å; I405-V409 VanDerWaalsContact O-N 3.17Å
406	Q	98.1	Very high	96.1	Very high	76 Å²	76	29 Å²	29	36%	0.355	14%	0.14	S	C	.	.	H	α-helix	trans	-66.9	-36.7	-178.1	-67.1	-61.9	-29.5	0	0	112.8	K402 S403 T408 V409 L410 F464 M468	K402-Q406 WeakPolarHBondContact O-CG 3.24Å; K402-Q406 PolarHBondContact O-N 3.42Å; K402-Q406 VanDerWaalsContact O-N 3.14Å; S403-Q406 PolarHBondContact O-N 3.27Å; Q406-T408 VanDerWaalsContact C-N 3.33Å; Q406-T408 PolarHBondContact O-N 2.9Å; Q406-V409 PolarHBondContact O-N 3.18Å; Q406-L410 PolarHBondContact O-N 2.85Å; Q406-F464 HydrophobicContact CB-CE1 4.23Å; Q406-F464 HydrophobicContact CB-CZ 4.13Å; Q406-F464 HydrophobicContact CG-CE1 3.87Å; Q406-F464 HydrophobicContact CG-CZ 3.96Å; Q406-M468 HydrophobicContact CB-CE 3.9Å; Q406-M468 HydrophobicContact CB-SD 4.26Å
407	L	98.6	Very high	96.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.2	-37.4	174.4	178.5	65.4	0	0	0	111.9	S403 I405 L410 L411 F443 A446 I447 L450 V471 L475	S403-L407 WeakPolarHBondContact O-CB 3.34Å; S403-L407 PolarHBondContact O-N 2.72Å; I405-L407 PolarHBondContact O-N 3.01Å; L407-L410 HydrophobicContact CD1-CD2 4.29Å; L407-L410 PolarHBondContact O-N 3.4Å; L407-L411 HydrophobicContact CD1-CG 4.31Å; L407-L411 HydrophobicContact CG-CD1 4.24Å; L407-L411 HydrophobicContact CG-CG 4.44Å; L407-L411 WeakPolarHBondContact O-CG 3.5Å; L407-L411 PolarHBondContact O-N 3.35Å; L407-F443 HydrophobicContact CB-CE2 4.43Å; L407-F443 HydrophobicContact CD2-CD2 3.9Å; L407-F443 HydrophobicContact CD2-CE2 3.83Å; L407-F443 HydrophobicContact CG-CD2 4.24Å; L407-F443 HydrophobicContact CG-CE2 4.28Å; L407-A446 HydrophobicContact CD1-CB 3.9Å; L407-A446 HydrophobicContact CD2-CB 3.84Å; L407-A446 HydrophobicContact CG-CB 4.31Å; L407-I447 HydrophobicContact CD2-CB 3.74Å; L407-I447 HydrophobicContact CD2-CD1 3.98Å; L407-I447 HydrophobicContact CD2-CG1 4.43Å; L407-I447 VanDerWaalsContact CD2-N 3.33Å; L407-L450 HydrophobicContact CB-CD1 4.3Å; L407-V471 HydrophobicContact CD1-CG1 4.31Å; L407-L475 HydrophobicContact CD1-CD1 3.96Å
408	T	98.5	Very high	95.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.5	-43.1	176.3	-58.5	0	0	0	0	110.8	P363 L366 A367 N370 S404 I405 Q406 L410 L411 C412	P363-T408 HydrophobicContact CB-CG2 3.5Å; P363-T408 HydrophobicContact CG-CG2 4.22Å; L366-T408 HydrophobicContact CB-CG2 4.34Å; L366-T408 HydrophobicContact CD2-CG2 4.01Å; L366-T408 HydrophobicContact CG-CG2 3.87Å; A367-T408 HydrophobicContact CB-CG2 4.37Å; N370-T408 VanDerWaalsContact ND2-CG2 3.3Å; N370-T408 WeakPolarHBondContact ND2-CG2 3.08Å; N370-T408 PolarHBondContact ND2-OG1 3.24Å; S404-T408 WeakPolarHBondContact O-CB 2.94Å; S404-T408 PolarHBondContact O-N 3.43Å; S404-T408 PolarHBondContact O-OG1 2.88Å; I405-T408 PolarHBondContact O-N 2.86Å; Q406-T408 VanDerWaalsContact C-N 3.33Å; Q406-T408 PolarHBondContact O-N 2.9Å; T408-L410 VanDerWaalsContact C-N 3.35Å; T408-L410 PolarHBondContact O-N 2.73Å; T408-L411 PolarHBondContact O-N 2.83Å; T408-C412 PolarHBondContact O-N 3.41Å; T408-C412 PolarHBondContact O-SG 3.45Å
409	V	98.1	Very high	95.3	Very high	20 Å²	20	29 Å²	29	12%	0.121	15%	0.146	C	C	.	.	H	α-helix	trans	-57.5	-49.8	173.3	177.9	0	0	0	0	110.6	P362 P363 I405 Q406 L411 C412 E413	P362-V409 HydrophobicContact CB-CG2 4.48Å; P362-V409 HydrophobicContact CG-CG1 4.47Å; P363-V409 HydrophobicContact CB-CG2 3.99Å; P363-V409 VanDerWaalsContact CD-CG2 3.43Å; P363-V409 HydrophobicContact CG-CG2 3.83Å; I405-V409 PolarHBondContact O-N 3.48Å; I405-V409 VanDerWaalsContact O-N 3.17Å; Q406-V409 PolarHBondContact O-N 3.18Å; V409-L411 VanDerWaalsContact C-N 3.33Å; V409-L411 PolarHBondContact O-N 2.92Å; V409-C412 WeakPolarHBondContact O-CB 3.5Å; V409-C412 PolarHBondContact O-N 3.39Å; V409-C412 VanDerWaalsContact O-N 3.15Å; V409-E413 WeakPolarHBondContact O-CG 3.2Å; V409-E413 PolarHBondContact O-N 3.43Å
410	L	98.4	Very high	94.5	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-58.2	-43.3	179.7	173.4	60	0	0	0	112.5	Q406 L407 T408 E413 L414 M468 V471 R472 L475	Q406-L410 PolarHBondContact O-N 2.85Å; L407-L410 HydrophobicContact CD1-CD2 4.29Å; L407-L410 PolarHBondContact O-N 3.4Å; T408-L410 VanDerWaalsContact C-N 3.35Å; T408-L410 PolarHBondContact O-N 2.73Å; L410-E413 PolarHBondContact O-N 3.13Å; L410-L414 HydrophobicContact CD1-CD1 3.89Å; L410-L414 HydrophobicContact CD1-CG 3.98Å; L410-L414 HydrophobicContact CG-CD1 4.04Å; L410-L414 WeakPolarHBondContact O-CG 3.34Å; L410-L414 PolarHBondContact O-N 3.22Å; L410-M468 HydrophobicContact CB-CE 4.39Å; L410-M468 HydrophobicContact CD2-CE 3.95Å; L410-V471 HydrophobicContact CD2-CG1 4.39Å; L410-R472 HydrophobicContact CD1-CB 3.68Å; L410-R472 HydrophobicContact CD1-CG 3.69Å; L410-R472 VanDerWaalsContact CD1-NE 3.31Å; L410-R472 HydrophobicContact CD2-CB 3.91Å; L410-R472 HydrophobicContact CG-CB 4.46Å; L410-L475 HydrophobicContact CD2-CD1 3.98Å; L410-L475 HydrophobicContact CG-CD1 4.49Å
411	L	98.2	Very high	93.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-37.3	177.3	-69.9	175.4	0	0	0	112.1	L407 T408 V409 E413 L415 F439 L442 F443 A446 L475	L407-L411 HydrophobicContact CD1-CG 4.31Å; L407-L411 HydrophobicContact CG-CD1 4.24Å; L407-L411 HydrophobicContact CG-CG 4.44Å; L407-L411 WeakPolarHBondContact O-CG 3.5Å; L407-L411 PolarHBondContact O-N 3.35Å; T408-L411 PolarHBondContact O-N 2.83Å; V409-L411 VanDerWaalsContact C-N 3.33Å; V409-L411 PolarHBondContact O-N 2.92Å; L411-E413 VanDerWaalsContact C-N 3.33Å; L411-L415 VanDerWaalsContact O-CB 3.3Å; L411-L415 WeakPolarHBondContact O-CB 3.4Å; L411-L415 VanDerWaalsContact O-CG 3.29Å; L411-L415 WeakPolarHBondContact O-CG 3.14Å; L411-L415 PolarHBondContact O-N 3.06Å; L411-L415 VanDerWaalsContact O-N 3.14Å; L411-F439 HydrophobicContact CB-CE2 4.03Å; L411-F439 HydrophobicContact CB-CZ 4.18Å; L411-L442 HydrophobicContact CD2-CD2 4.08Å; L411-L442 HydrophobicContact CD2-CG 4.15Å; L411-F443 HydrophobicContact CD1-CB 3.88Å; L411-F443 HydrophobicContact CD1-CD2 4.12Å; L411-A446 HydrophobicContact CD1-CB 4.41Å; L411-A446 HydrophobicContact CD2-CB 4.47Å; L411-L475 HydrophobicContact CD2-CD1 4.08Å
412	C	97.4	Very high	92.6	Very high	8 Å²	8	35.9 Å²	35.9	5%	0.054	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-41.5	174	-70.6	0	0	0	0	111.9	M297 T408 V409 H416 V417	M297-C412 HydrophobicContact SD-CB 3.71Å; T408-C412 PolarHBondContact O-N 3.41Å; T408-C412 PolarHBondContact O-SG 3.45Å; V409-C412 WeakPolarHBondContact O-CB 3.5Å; V409-C412 PolarHBondContact O-N 3.39Å; V409-C412 VanDerWaalsContact O-N 3.15Å; C412-H416 PolarHBondContact O-N 3.3Å; C412-V417 HydrophobicContact CB-CB 4.09Å; C412-V417 HydrophobicContact CB-CG2 4.27Å; C412-V417 PolarHBondContact O-N 3.11Å
413	E	95.7	Very high	91.2	Very high	96 Å²	96	37.5 Å²	37.5	45%	0.449	20%	0.2	S	C	.	.	H	α-helix	trans	-66.9	-48.2	176.6	-69.8	173	-177.4	0	0	112.3	V409 L410 L411 L415 H416 R472	V409-E413 WeakPolarHBondContact O-CG 3.2Å; V409-E413 PolarHBondContact O-N 3.43Å; L410-E413 PolarHBondContact O-N 3.13Å; L411-E413 VanDerWaalsContact C-N 3.33Å; E413-L415 PolarHBondContact O-N 3.02Å; E413-H416 PolarHBondContact O-N 2.89Å; E413-R472 IonicContact OE2-CZ 3.67Å; E413-R472 IonicContact OE2-NH2 3.36Å; E413-R472 PolarHBondContact OE2-NH2 3.21Å
414	L	95.4	Very high	89.7	Confident	46 Å²	46	38.2 Å²	38.2	24%	0.241	21%	0.205	C	C	.	.	H	α-helix	trans	-64.9	-22.2	-179.2	-71	175.5	0	0	0	113.3	L410 L475 A476 L479	L410-L414 HydrophobicContact CD1-CD1 3.89Å; L410-L414 HydrophobicContact CD1-CG 3.98Å; L410-L414 HydrophobicContact CG-CD1 4.04Å; L410-L414 WeakPolarHBondContact O-CG 3.34Å; L410-L414 PolarHBondContact O-N 3.22Å; L414-L475 HydrophobicContact CD1-CB 3.7Å; L414-L475 HydrophobicContact CD1-CD1 4.32Å; L414-A476 HydrophobicContact CD2-CB 3.93Å; L414-L479 HydrophobicContact CB-CD1 4.09Å; L414-L479 HydrophobicContact CD1-CD1 4.21Å
415	L	94.1	Very high	88.6	Confident	14 Å²	14	39.5 Å²	39.5	7%	0.073	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	5.6	-178.5	-61.8	174.9	0	0	0	113.4	L290 L411 E413 V417 F432 F439 L442 L479	L290-L415 HydrophobicContact CD1-CB 4.27Å; L411-L415 VanDerWaalsContact O-CB 3.3Å; L411-L415 WeakPolarHBondContact O-CB 3.4Å; L411-L415 VanDerWaalsContact O-CG 3.29Å; L411-L415 WeakPolarHBondContact O-CG 3.14Å; L411-L415 PolarHBondContact O-N 3.06Å; L411-L415 VanDerWaalsContact O-N 3.14Å; E413-L415 PolarHBondContact O-N 3.02Å; L415-V417 VanDerWaalsContact C-N 3.27Å; L415-V417 HydrophobicContact CB-CG2 4.1Å; L415-V417 PolarHBondContact O-N 2.89Å; L415-F432 HydrophobicContact CD1-CE1 4.29Å; L415-F432 HydrophobicContact CD1-CZ 3.68Å; L415-F432 HydrophobicContact CD2-CE2 3.85Å; L415-F432 HydrophobicContact CD2-CZ 3.62Å; L415-F432 HydrophobicContact CG-CZ 4.29Å; L415-F439 HydrophobicContact CD1-CD2 3.72Å; L415-F439 HydrophobicContact CD1-CE2 3.96Å; L415-L442 HydrophobicContact CD1-CD2 3.86Å; L415-L479 HydrophobicContact CD2-CD1 4.45Å
416	H	91.8	Very high	87.8	Confident	111 Å²	111	41.8 Å²	41.8	51%	0.514	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	41.2	178.2	-58.9	-76.5	0	0	0	113.3	C412 E413 G418 E419	C412-H416 PolarHBondContact O-N 3.3Å; E413-H416 PolarHBondContact O-N 2.89Å; H416-G418 PolarHBondContact O-N 3.34Å; H416-E419 HydrophobicContact CB-CB 4.24Å; H416-E419 HydrophobicContact CB-CG 4.14Å; H416-E419 WeakPolarHBondContact CB-OE2 3.43Å; H416-E419 IonicContact CG-OE2 2.83Å; H416-E419 VanDerWaalsContact ND1-CD 3.33Å; H416-E419 IonicContact ND1-OE1 2.69Å; H416-E419 PolarHBondContact ND1-OE1 3.41Å; H416-E419 IonicContact ND1-OE2 3.23Å; H416-E419 PolarHBondContact ND1-OE2 2.94Å; H416-E419 PolarHBondContact O-N 3.02Å
417	V	93.6	Very high	87.2	Confident	10 Å²	10	42.3 Å²	42.3	6%	0.061	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	120.5	-176.5	176.6	0	0	0	0	110.6	L290 L293 M297 C412 L415 F439	L290-V417 HydrophobicContact CB-CG2 4.44Å; L293-V417 HydrophobicContact CB-CG1 4.06Å; M297-V417 HydrophobicContact CE-CG1 4.36Å; M297-V417 HydrophobicContact SD-CB 4.45Å; M297-V417 HydrophobicContact SD-CG1 4.14Å; C412-V417 HydrophobicContact CB-CB 4.09Å; C412-V417 HydrophobicContact CB-CG2 4.27Å; C412-V417 PolarHBondContact O-N 3.11Å; L415-V417 VanDerWaalsContact C-N 3.27Å; L415-V417 HydrophobicContact CB-CG2 4.1Å; L415-V417 PolarHBondContact O-N 2.89Å; V417-F439 HydrophobicContact CG2-CE2 4.22Å
418	G	82.4	Confident	86.9	Confident	23 Å²	23	43.1 Å²	43.1	24%	0.237	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	5	-179.9	0	0	0	0	0	114.3	H416	H416-G418 PolarHBondContact O-N 3.34Å
419	E	84.1	Confident	86.6	Confident	113 Å²	113	44 Å²	44	53%	0.528	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-77.7	144.4	169.7	-65.4	-173.6	-172.4	0	0	110.9	H416	H416-E419 HydrophobicContact CB-CB 4.24Å; H416-E419 HydrophobicContact CB-CG 4.14Å; H416-E419 WeakPolarHBondContact CB-OE2 3.43Å; H416-E419 IonicContact CG-OE2 2.83Å; H416-E419 VanDerWaalsContact ND1-CD 3.33Å; H416-E419 IonicContact ND1-OE1 2.69Å; H416-E419 PolarHBondContact ND1-OE1 3.41Å; H416-E419 IonicContact ND1-OE2 3.23Å; H416-E419 PolarHBondContact ND1-OE2 2.94Å; H416-E419 PolarHBondContact O-N 3.02Å
420	P	77.8	Confident	86.3	Confident	103 Å²	103	43.9 Å²	43.9	67%	0.669	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-64.1	146.1	176.4	28	-34.2	0	0	0	111	S422	P420-S422 PolarHBondContact O-N 3.44Å
421	C	77.5	Confident	86.1	Confident	39 Å²	39	44 Å²	44	26%	0.264	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-66.6	131.6	176.8	-53.2	0	0	0	0	110.6	Y283 V284 A287	Y283-C421 HydrophobicContact CE1-CB 4.33Å; V284-C421 HydrophobicContact CG2-CB 4.48Å; A287-C421 VanDerWaalsContact CB-SG 3.59Å
422	S	75.6	Confident	85.7	Confident	15 Å²	15	44.8 Å²	44.8	11%	0.105	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-64.2	144.9	166	168.8	0	0	0	0	110.5	H280 Y283 P420 T424 A425	H280-S422 PolarHBondContact CE1-O 3.04Å; H280-S422 VanDerWaalsContact CE1-O 3.32Å; Y283-S422 PolarHBondContact OH-N 3.22Å; Y283-S422 VanDerWaalsContact OH-N 3.15Å; P420-S422 PolarHBondContact O-N 3.44Å; S422-T424 PolarHBondContact O-N 3.4Å; S422-T424 PolarHBondContact OG-N 2.87Å; S422-A425 PolarHBondContact OG-N 3.09Å
423	E	66.8	Low	85.5	Confident	96 Å²	96	45 Å²	45	45%	0.449	24%	0.244	S	C	.	.	S	Bend	trans	-73.3	-15.8	175.4	-61.4	-166.3	156	0	0	113	H280 L623	H280-E423 VanDerWaalsContact CE1-C 3.47Å; H280-E423 PolarHBondContact CE1-O 3.41Å; H280-E423 VanDerWaalsContact CE1-O 3.25Å; E423-L623 HydrophobicContact CB-CD1 4.09Å; E423-L623 HydrophobicContact CG-CD1 4.11Å; E423-L623 VanDerWaalsContact OE2-CD1 3.23Å; E423-L623 WeakPolarHBondContact OE2-CD1 3.4Å
424	T	65.8	Low	85.2	Confident	16 Å²	16	42.1 Å²	42.1	10%	0.098	24%	0.235	C	C	.	.	S	Bend	trans	-126.8	-15.2	-170.7	60.5	0	0	0	0	114.6	S422 R550 L623	S422-T424 PolarHBondContact O-N 3.4Å; S422-T424 PolarHBondContact OG-N 2.87Å; T424-R550 VanDerWaalsContact CB-NH1 3.3Å; T424-L623 HydrophobicContact CG2-CD2 4.27Å
425	A	74.3	Confident	84.7	Confident	27 Å²	27	43.4 Å²	43.4	22%	0.223	24%	0.24	C	C	.	.			trans	-63.8	141.6	-176.6	0	0	0	0	0	112.3	H280 Y283 S422	H280-A425 PolarHBondContact ND1-O 2.9Å; Y283-A425 HydrophobicContact CD1-CB 3.92Å; Y283-A425 WeakPolarHBondContact CD1-O 3.44Å; Y283-A425 HydrophobicContact CD2-CB 4.34Å; Y283-A425 HydrophobicContact CE1-CB 3.64Å; Y283-A425 HydrophobicContact CE2-CB 4.05Å; Y283-A425 HydrophobicContact CG-CB 4.26Å; S422-A425 PolarHBondContact OG-N 3.09Å
426	Q	82.1	Confident	84.4	Confident	59 Å²	59	46.6 Å²	46.6	28%	0.276	26%	0.257	S	S	.	.			trans	-121.4	-0.8	-179	-60.8	169.4	-1	0	0	111.9	D276 A279 H280 F428	D276-Q426 VanDerWaalsContact CB-NE2 3.28Å; D276-Q426 PolarHBondContact OD2-NE2 3.23Å; A279-Q426 HydrophobicContact CB-CB 4.03Å; A279-Q426 HydrophobicContact CB-CG 4.41Å; H280-Q426 HydrophobicContact CB-CG 4.38Å; Q426-F428 PolarHBondContact O-N 3.16Å
427	D	84.6	Confident	84.3	Confident	88 Å²	88	46.8 Å²	46.8	47%	0.471	26%	0.258	S	S	.	.			trans	-86.6	111.2	-172.3	-164	-6.5	0	0	0	112	Y283 K482	Y283-D427 WeakPolarHBondContact CD2-O 3.41Å; D427-K482 WeakPolarHBondContact OD1-CE 3.35Å; D427-K482 IonicContact OD1-NZ 2.7Å; D427-K482 PolarHBondContact OD1-NZ 3.34Å; D427-K482 WeakPolarHBondContact OD2-CE 3.3Å; D427-K482 IonicContact OD2-NZ 3.73Å; D427-K482 PolarHBondContact OD2-NZ 3.29Å
428	F	92.1	Very high	84.2	Confident	17 Å²	17	46.9 Å²	46.9	8%	0.075	26%	0.259	C	S	.	.			trans	-129.1	162.5	173.9	70.2	-87.4	0	0	0	110.9	I268 M274 L282 Q426 P430 F433	I268-F428 HydrophobicContact CD1-CE2 3.75Å; I268-F428 HydrophobicContact CD1-CZ 4.41Å; I268-F428 HydrophobicContact CG1-CE2 4Å; I268-F428 HydrophobicContact CG1-CZ 4.16Å; M274-F428 HydrophobicContact CE-CE1 3.66Å; M274-F428 HydrophobicContact CE-CZ 3.84Å; M274-F428 HydrophobicContact SD-CE1 4.27Å; M274-F428 HydrophobicContact SD-CZ 4.3Å; L282-F428 HydrophobicContact CB-CD1 3.86Å; L282-F428 HydrophobicContact CB-CD2 4.4Å; L282-F428 HydrophobicContact CB-CE1 3.85Å; L282-F428 HydrophobicContact CB-CE2 4.4Å; L282-F428 HydrophobicContact CB-CG 4.15Å; L282-F428 HydrophobicContact CB-CZ 4.14Å; L282-F428 HydrophobicContact CD1-CE1 3.89Å; L282-F428 HydrophobicContact CD1-CE2 4.06Å; L282-F428 HydrophobicContact CD1-CZ 3.53Å; Q426-F428 PolarHBondContact O-N 3.16Å; F428-P430 HydrophobicContact CE2-CG 4.07Å; F428-P430 WeakPolarHBondContact O-CD 3.43Å; F428-F433 HydrophobicContact CD2-CD2 4.25Å; F428-F433 AromaticContact CD2-CE2 3.79Å; F428-F433 HydrophobicContact CD2-CE2 3.79Å; F428-F433 HydrophobicContact CE2-CD2 4.44Å; F428-F433 HydrophobicContact CE2-CE2 4.28Å
429	S	92.5	Very high	84.9	Confident	18 Å²	18	46.2 Å²	46.2	13%	0.126	25%	0.249	C	C	.	.			trans	-103.3	111.2	177.6	-42	0	0	0	0	110.5	Q286 M431 F432	Q286-S429 PolarHBondContact OE1-O 2.6Å; S429-M431 PolarHBondContact O-N 3.14Å; S429-F432 PolarHBondContact O-N 3.21Å; S429-F432 VanDerWaalsContact O-N 3.13Å
430	P	92.5	Very high	85.5	Confident	17 Å²	17	42 Å²	42	11%	0.11	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-31.5	-174.8	-31.9	37.8	0	0	0	115.7	I268 F428 F432 F433	I268-P430 HydrophobicContact CG2-CB 4Å; I268-P430 HydrophobicContact CG2-CG 4.26Å; F428-P430 HydrophobicContact CE2-CG 4.07Å; F428-P430 WeakPolarHBondContact O-CD 3.43Å; P430-F432 PolarHBondContact O-N 3.33Å; P430-F432 VanDerWaalsContact O-N 3.12Å; P430-F433 PolarHBondContact O-N 3.3Å
431	M	92.9	Very high	86.5	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.034	20%	0.204	C	C	.	.	H	α-helix	trans	-58.7	-23.5	179.9	64.9	174.5	-169.7	0	0	114.4	S429 F433 S434 L442 L479 P483 T484 F489	S429-M431 PolarHBondContact O-N 3.14Å; M431-F433 PolarHBondContact O-N 3.41Å; M431-S434 PolarHBondContact O-N 2.86Å; M431-S434 PolarHBondContact O-OG 3.47Å; M431-L442 HydrophobicContact CE-CD1 4.42Å; M431-L442 HydrophobicContact CE-CD2 4.25Å; M431-L479 HydrophobicContact CE-CD2 3.38Å; M431-P483 WeakPolarHBondContact CB-O 3.41Å; M431-P483 HydrophobicContact SD-CG 3.99Å; M431-T484 WeakPolarHBondContact CA-O 3.48Å; M431-F489 HydrophobicContact SD-CB 4.16Å; M431-F489 HydrophobicContact SD-CD2 4.32Å; M431-F489 HydrophobicContact SD-CG 4.34Å
432	F	91.4	Very high	87.4	Confident	18 Å²	18	36.7 Å²	36.7	8%	0.079	19%	0.192	C	C	.	.	H	α-helix	trans	-69.8	-19.1	175.4	-73.8	-79.2	0	0	0	113.1	Q286 L290 L415 S429 P430 S438 L442	Q286-F432 HydrophobicContact CG-CD2 4.43Å; L290-F432 HydrophobicContact CD2-CD1 4.39Å; L290-F432 HydrophobicContact CD2-CE1 3.96Å; L290-F432 HydrophobicContact CD2-CZ 4.49Å; L415-F432 HydrophobicContact CD1-CE1 4.29Å; L415-F432 HydrophobicContact CD1-CZ 3.68Å; L415-F432 HydrophobicContact CD2-CE2 3.85Å; L415-F432 HydrophobicContact CD2-CZ 3.62Å; L415-F432 HydrophobicContact CG-CZ 4.29Å; S429-F432 PolarHBondContact O-N 3.21Å; S429-F432 VanDerWaalsContact O-N 3.13Å; P430-F432 PolarHBondContact O-N 3.33Å; P430-F432 VanDerWaalsContact O-N 3.12Å; F432-S438 PolarHBondContact O-OG 2.91Å; F432-S438 VanDerWaalsContact O-OG 3.14Å; F432-L442 HydrophobicContact CZ-CD2 4.33Å
433	F	93.1	Very high	88.5	Confident	11 Å²	11	36 Å²	36	5%	0.048	19%	0.187	C	C	.	.	H	α-helix	trans	-94.3	-10	174.5	-60.2	-81.8	0	0	0	112.4	R260 I263 Y264 I268 L282 L285 Q286 F428 P430 M431	R260-F433 WeakPolarHBondContact CG-O 3.39Å; I263-F433 HydrophobicContact CB-CD1 4.31Å; I263-F433 HydrophobicContact CD1-CD1 4.28Å; I263-F433 HydrophobicContact CD1-CE1 4.29Å; I263-F433 HydrophobicContact CG2-CB 4.41Å; I263-F433 HydrophobicContact CG2-CD1 3.73Å; I263-F433 HydrophobicContact CG2-CE1 4.17Å; I263-F433 HydrophobicContact CG2-CG 4.04Å; Y264-F433 WeakPolarHBondContact CB-O 3.45Å; Y264-F433 HydrophobicContact CD2-CB 4.32Å; I268-F433 HydrophobicContact CD1-CB 3.78Å; I268-F433 HydrophobicContact CD1-CD2 3.6Å; I268-F433 HydrophobicContact CD1-CE2 4.41Å; I268-F433 HydrophobicContact CD1-CG 3.81Å; L282-F433 HydrophobicContact CB-CZ 4.48Å; L282-F433 HydrophobicContact CD2-CZ 4.4Å; L285-F433 HydrophobicContact CD2-CE1 3.89Å; L285-F433 HydrophobicContact CD2-CZ 4.49Å; L285-F433 HydrophobicContact CG-CE1 4.25Å; Q286-F433 HydrophobicContact CB-CE2 4.4Å; Q286-F433 HydrophobicContact CB-CZ 4.25Å; F428-F433 HydrophobicContact CD2-CD2 4.25Å; F428-F433 AromaticContact CD2-CE2 3.79Å; F428-F433 HydrophobicContact CD2-CE2 3.79Å; F428-F433 HydrophobicContact CE2-CD2 4.44Å; F428-F433 HydrophobicContact CE2-CE2 4.28Å; P430-F433 PolarHBondContact O-N 3.3Å; M431-F433 PolarHBondContact O-N 3.41Å
434	S	89.2	Confident	90	Very high	36 Å²	36	31.6 Å²	31.6	25%	0.252	17%	0.167	S	C	.	.	H	α-helix	trans	-85.7	-22.5	179.9	81.3	0	0	0	0	113.8	M431	M431-S434 PolarHBondContact O-N 2.86Å; M431-S434 PolarHBondContact O-OG 3.47Å
435	Q	85.2	Confident	91.6	Very high	73 Å²	73	31 Å²	31	34%	0.341	16%	0.164	S	C	.	.	S	Bend	trans	-138.2	140.6	-164.9	-174	65.8	25.4	0	0	111.3	R260 S438 E441 L486	R260-Q435 PolarHBondContact NE-O 2.9Å; Q435-S438 PolarHBondContact O-OG 3.44Å; Q435-E441 HydrophobicContact CG-CB 4.32Å; Q435-E441 HydrophobicContact CG-CG 3.9Å; Q435-L486 HydrophobicContact CG-CD2 4.39Å
436	D	86.6	Confident	92.7	Very high	82 Å²	82	29.8 Å²	29.8	44%	0.439	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	148	171.4	-62.8	-6.4	0	0	0	110.8	R260 S438	R260-D436 WeakPolarHBondContact CD-OD1 3.32Å; R260-D436 IonicContact CZ-OD1 3.87Å; R260-D436 IonicContact NE-OD1 2.69Å; R260-D436 IonicContact NH1-OD1 2.83Å; R260-D436 PolarHBondContact NH1-OD1 2.69Å; D436-S438 PolarHBondContact O-N 3.38Å; D436-S438 VanDerWaalsContact O-N 3.09Å
437	H	90.6	Very high	93.5	Very high	114 Å²	114	27 Å²	27	53%	0.528	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	36.2	-177.8	-56.9	-74.2	0	0	0	113.9	Y373 F439 H440 E441	Y373-H437 HydrophobicContact CE2-CB 3.85Å; H437-F439 PolarHBondContact O-N 2.88Å; H437-H440 PolarHBondContact O-N 3.33Å; H437-E441 PolarHBondContact O-N 2.97Å; H437-E441 VanDerWaalsContact O-N 3.15Å
438	S	92.3	Very high	94.1	Very high	13 Å²	13	26.4 Å²	26.4	9%	0.091	14%	0.135	C	C	.	.	H	α-helix	trans	-56.6	-29.3	-165.8	-5.9	0	0	0	0	114.3	F432 Q435 D436 L442	F432-S438 PolarHBondContact O-OG 2.91Å; F432-S438 VanDerWaalsContact O-OG 3.14Å; Q435-S438 PolarHBondContact O-OG 3.44Å; D436-S438 PolarHBondContact O-N 3.38Å; D436-S438 VanDerWaalsContact O-N 3.09Å; S438-L442 VanDerWaalsContact O-CB 3.22Å; S438-L442 WeakPolarHBondContact O-CB 3.33Å; S438-L442 PolarHBondContact O-N 3.07Å
439	F	96.3	Very high	94.4	Very high	8 Å²	8	25.7 Å²	25.7	4%	0.035	13%	0.132	C	C	.	.	H	α-helix	trans	-62.6	-44.6	172.5	-178.6	-92.3	0	0	0	113	L290 L293 L366 L411 L415 V417 H437 L442 F443	L290-F439 HydrophobicContact CD2-CD2 4.32Å; L293-F439 HydrophobicContact CD1-CB 3.78Å; L293-F439 HydrophobicContact CD1-CD1 3.66Å; L293-F439 HydrophobicContact CD1-CD2 3.65Å; L293-F439 HydrophobicContact CD1-CE1 4.1Å; L293-F439 HydrophobicContact CD1-CE2 4.12Å; L293-F439 HydrophobicContact CD1-CG 3.4Å; L293-F439 VanDerWaalsContact CD1-CG 3.4Å; L293-F439 HydrophobicContact CD1-CZ 4.33Å; L366-F439 HydrophobicContact CD1-CE1 4.05Å; L366-F439 HydrophobicContact CD2-CE1 3.91Å; L366-F439 HydrophobicContact CD2-CZ 3.99Å; L366-F439 HydrophobicContact CG-CE1 4.11Å; L411-F439 HydrophobicContact CB-CE2 4.03Å; L411-F439 HydrophobicContact CB-CZ 4.18Å; L415-F439 HydrophobicContact CD1-CD2 3.72Å; L415-F439 HydrophobicContact CD1-CE2 3.96Å; V417-F439 HydrophobicContact CG2-CE2 4.22Å; H437-F439 PolarHBondContact O-N 2.88Å; F439-L442 WeakPolarHBondContact O-CB 3.16Å; F439-L442 PolarHBondContact O-N 3.4Å; F439-F443 PolarHBondContact O-N 3.25Å
440	H	97.6	Very high	94.7	Very high	26 Å²	26	24.9 Å²	24.9	12%	0.12	13%	0.126	C	C	.	.	H	α-helix	trans	-72.6	-36.4	179.9	-58.9	82.5	0	0	0	111	N370 Y373 H437 F443 C444	N370-H440 PolarHBondContact OD1-CD2 2.56Å; Y373-H440 HydrophobicContact CD1-CB 3.49Å; Y373-H440 VanDerWaalsContact CD1-CB 3.49Å; Y373-H440 HydrophobicContact CD2-CB 3.72Å; Y373-H440 AromaticContact CD2-CG 3.95Å; Y373-H440 HydrophobicContact CE1-CB 3.74Å; Y373-H440 HydrophobicContact CE2-CB 3.95Å; Y373-H440 HydrophobicContact CG-CB 3.49Å; Y373-H440 VanDerWaalsContact CG-CB 3.49Å; Y373-H440 AromaticContact CG-CG 4Å; H437-H440 PolarHBondContact O-N 3.33Å; H440-F443 WeakPolarHBondContact O-CB 3.44Å; H440-F443 PolarHBondContact O-N 3.4Å; H440-C444 PolarHBondContact O-N 3.5Å; H440-C444 PolarHBondContact O-SG 3.48Å
441	E	97.3	Very high	94.9	Very high	28 Å²	28	24.7 Å²	24.7	13%	0.131	12%	0.124	C	C	.	.	H	α-helix	trans	-63.7	-41	172.3	-72	-62.3	154.7	0	0	112.4	Y373 Q435 H437 F443 C444 V445 L486	Y373-E441 HydrophobicContact CE1-CG 4.35Å; Y373-E441 VanDerWaalsContact CE1-OE1 3.31Å; Y373-E441 WeakPolarHBondContact CE1-OE1 3.33Å; Y373-E441 PolarHBondContact OH-OE1 3.43Å; Q435-E441 HydrophobicContact CG-CB 4.32Å; Q435-E441 HydrophobicContact CG-CG 3.9Å; H437-E441 PolarHBondContact O-N 2.97Å; H437-E441 VanDerWaalsContact O-N 3.15Å; E441-F443 VanDerWaalsContact C-N 3.33Å; E441-F443 PolarHBondContact O-N 2.85Å; E441-C444 WeakPolarHBondContact O-CB 3.45Å; E441-C444 PolarHBondContact O-N 3.25Å; E441-V445 PolarHBondContact O-N 3.21Å; E441-V445 VanDerWaalsContact O-N 3.13Å; E441-L486 HydrophobicContact CB-CD1 4.45Å; E441-L486 HydrophobicContact CB-CD2 3.67Å; E441-L486 HydrophobicContact CG-CD2 4.36Å
442	L	97.4	Very high	95.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-43	172.2	-179.6	62.7	0	0	0	111.2	L411 L415 M431 F432 S438 F439 C444 V445 A446 F489	L411-L442 HydrophobicContact CD2-CD2 4.08Å; L411-L442 HydrophobicContact CD2-CG 4.15Å; L415-L442 HydrophobicContact CD1-CD2 3.86Å; M431-L442 HydrophobicContact CE-CD1 4.42Å; M431-L442 HydrophobicContact CE-CD2 4.25Å; F432-L442 HydrophobicContact CZ-CD2 4.33Å; S438-L442 VanDerWaalsContact O-CB 3.22Å; S438-L442 WeakPolarHBondContact O-CB 3.33Å; S438-L442 PolarHBondContact O-N 3.07Å; F439-L442 WeakPolarHBondContact O-CB 3.16Å; F439-L442 PolarHBondContact O-N 3.4Å; L442-C444 PolarHBondContact O-N 3.4Å; L442-V445 PolarHBondContact O-N 2.88Å; L442-A446 VanDerWaalsContact O-CB 3.3Å; L442-A446 WeakPolarHBondContact O-CB 3.26Å; L442-A446 PolarHBondContact O-N 2.89Å; L442-F489 HydrophobicContact CD1-CD1 3.83Å; L442-F489 HydrophobicContact CD1-CD2 4.36Å; L442-F489 HydrophobicContact CD1-CE1 3.3Å; L442-F489 HydrophobicContact CD1-CE2 3.91Å; L442-F489 HydrophobicContact CD1-CG 4.34Å; L442-F489 HydrophobicContact CD1-CZ 3.36Å
443	F	98.5	Very high	95.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.7	-45.7	172.9	171.8	-89.8	0	0	0	111.9	N370 F374 L407 L411 F439 H440 E441 V445 A446 I447	N370-F443 HydrophobicContact CB-CD1 3.72Å; N370-F443 HydrophobicContact CB-CD2 3.89Å; N370-F443 HydrophobicContact CB-CE1 3.81Å; N370-F443 HydrophobicContact CB-CE2 3.97Å; N370-F443 HydrophobicContact CB-CG 3.78Å; N370-F443 HydrophobicContact CB-CZ 3.94Å; N370-F443 WeakPolarHBondContact O-CE1 3.3Å; F374-F443 HydrophobicContact CB-CD1 4.45Å; F374-F443 HydrophobicContact CB-CE1 4.07Å; L407-F443 HydrophobicContact CB-CE2 4.43Å; L407-F443 HydrophobicContact CD2-CD2 3.9Å; L407-F443 HydrophobicContact CD2-CE2 3.83Å; L407-F443 HydrophobicContact CG-CD2 4.24Å; L407-F443 HydrophobicContact CG-CE2 4.28Å; L411-F443 HydrophobicContact CD1-CB 3.88Å; L411-F443 HydrophobicContact CD1-CD2 4.12Å; F439-F443 PolarHBondContact O-N 3.25Å; H440-F443 WeakPolarHBondContact O-CB 3.44Å; H440-F443 PolarHBondContact O-N 3.4Å; E441-F443 VanDerWaalsContact C-N 3.33Å; E441-F443 PolarHBondContact O-N 2.85Å; F443-V445 VanDerWaalsContact C-N 3.29Å; F443-V445 PolarHBondContact O-N 3.24Å; F443-A446 PolarHBondContact O-N 3.34Å; F443-A446 VanDerWaalsContact O-N 3.14Å; F443-I447 HydrophobicContact CE1-CB 4.31Å; F443-I447 HydrophobicContact CE1-CG2 4.17Å; F443-I447 HydrophobicContact CZ-CB 4.18Å; F443-I447 HydrophobicContact CZ-CG1 4.31Å; F443-I447 WeakPolarHBondContact O-CG2 3.48Å; F443-I447 PolarHBondContact O-N 3.11Å
444	C	98.3	Very high	95.6	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.027	13%	0.131	C	C	.	.	H	α-helix	trans	-58	-40	177.5	-68	0	0	0	0	112.6	F374 H440 E441 L442 I447 Q448	F374-C444 HydrophobicContact CD2-CB 3.95Å; F374-C444 HydrophobicContact CE2-CB 4.47Å; H440-C444 PolarHBondContact O-N 3.5Å; H440-C444 PolarHBondContact O-SG 3.48Å; E441-C444 WeakPolarHBondContact O-CB 3.45Å; E441-C444 PolarHBondContact O-N 3.25Å; L442-C444 PolarHBondContact O-N 3.4Å; C444-I447 WeakPolarHBondContact O-CG2 3.44Å; C444-Q448 WeakPolarHBondContact O-CG 3.38Å; C444-Q448 PolarHBondContact O-NE2 2.85Å
445	V	98	Very high	95.9	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.03	14%	0.137	C	C	.	.	H	α-helix	trans	-70.3	-44.2	175.4	178.5	0	0	0	0	110.6	E441 L442 F443 Q448 L449 L486 F489 R490 V493	E441-V445 PolarHBondContact O-N 3.21Å; E441-V445 VanDerWaalsContact O-N 3.13Å; L442-V445 PolarHBondContact O-N 2.88Å; F443-V445 VanDerWaalsContact C-N 3.29Å; F443-V445 PolarHBondContact O-N 3.24Å; V445-Q448 PolarHBondContact O-N 3.11Å; V445-L449 PolarHBondContact O-N 2.93Å; V445-L486 HydrophobicContact CG2-CD1 4.22Å; V445-L486 HydrophobicContact CG2-CG 4.42Å; V445-F489 HydrophobicContact CB-CE1 4.24Å; V445-F489 HydrophobicContact CG1-CD1 4.03Å; V445-F489 HydrophobicContact CG1-CE1 3.75Å; V445-R490 HydrophobicContact CG1-CB 4.22Å; V445-R490 HydrophobicContact CG1-CG 4.27Å; V445-V493 HydrophobicContact CG1-CG1 4.02Å
446	A	98.5	Very high	96.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.8	-35.1	-176.2	0	0	0	0	0	113.4	L407 L411 L442 F443 L449 L450 L475	L407-A446 HydrophobicContact CD1-CB 3.9Å; L407-A446 HydrophobicContact CD2-CB 3.84Å; L407-A446 HydrophobicContact CG-CB 4.31Å; L411-A446 HydrophobicContact CD1-CB 4.41Å; L411-A446 HydrophobicContact CD2-CB 4.47Å; L442-A446 VanDerWaalsContact O-CB 3.3Å; L442-A446 WeakPolarHBondContact O-CB 3.26Å; L442-A446 PolarHBondContact O-N 2.89Å; F443-A446 PolarHBondContact O-N 3.34Å; F443-A446 VanDerWaalsContact O-N 3.14Å; A446-L449 WeakPolarHBondContact O-CB 3.35Å; A446-L449 PolarHBondContact O-N 3.28Å; A446-L450 WeakPolarHBondContact O-CB 3.44Å; A446-L450 PolarHBondContact O-N 3.1Å; A446-L475 HydrophobicContact CB-CD1 4.21Å; A446-L475 HydrophobicContact CB-CD2 3.93Å
447	I	98.4	Very high	97	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-70.4	-34.7	177.4	-167.1	56.9	0	0	0	111.4	F374 F385 F400 L407 F443 C444 L450 N451	F374-I447 HydrophobicContact CD1-CG2 4.16Å; F374-I447 HydrophobicContact CD2-CG2 4.25Å; F374-I447 HydrophobicContact CE1-CG2 3.98Å; F374-I447 HydrophobicContact CE2-CG2 4.09Å; F374-I447 HydrophobicContact CG-CG2 4.29Å; F374-I447 HydrophobicContact CZ-CG2 3.96Å; F385-I447 HydrophobicContact CD2-CG1 4.39Å; F385-I447 HydrophobicContact CE2-CD1 4.03Å; F385-I447 HydrophobicContact CE2-CG1 3.81Å; F385-I447 WeakPolarHBondContact CE2-O 3.37Å; F385-I447 HydrophobicContact CZ-CD1 4.35Å; F400-I447 HydrophobicContact CD2-CG1 4.34Å; F400-I447 HydrophobicContact CE2-CG1 4.07Å; L407-I447 HydrophobicContact CD2-CB 3.74Å; L407-I447 HydrophobicContact CD2-CD1 3.98Å; L407-I447 HydrophobicContact CD2-CG1 4.43Å; L407-I447 VanDerWaalsContact CD2-N 3.33Å; F443-I447 HydrophobicContact CE1-CB 4.31Å; F443-I447 HydrophobicContact CE1-CG2 4.17Å; F443-I447 HydrophobicContact CZ-CB 4.18Å; F443-I447 HydrophobicContact CZ-CG1 4.31Å; F443-I447 WeakPolarHBondContact O-CG2 3.48Å; F443-I447 PolarHBondContact O-N 3.11Å; C444-I447 WeakPolarHBondContact O-CG2 3.44Å; I447-L450 HydrophobicContact CD1-CD1 4.42Å; I447-L450 PolarHBondContact O-N 2.86Å; I447-N451 PolarHBondContact O-N 2.79Å; I447-N451 VanDerWaalsContact O-N 3.11Å
448	Q	97.9	Very high	97.2	Very high	76 Å²	76	30.8 Å²	30.8	36%	0.355	14%	0.136	S	C	.	.	H	α-helix	trans	-68.3	-41.9	172.6	-70.9	176.2	81.7	0	0	111.6	F374 C444 V445 L450 N451 K452	F374-Q448 HydrophobicContact CE2-CG 4.27Å; F374-Q448 HydrophobicContact CZ-CG 4.17Å; C444-Q448 WeakPolarHBondContact O-CG 3.38Å; C444-Q448 PolarHBondContact O-NE2 2.85Å; V445-Q448 PolarHBondContact O-N 3.11Å; Q448-L450 VanDerWaalsContact C-N 3.31Å; Q448-L450 PolarHBondContact O-N 3.45Å; Q448-N451 PolarHBondContact O-N 3.45Å; Q448-K452 WeakPolarHBondContact O-CB 3.4Å; Q448-K452 PolarHBondContact O-N 3.35Å
449	L	98.3	Very high	97.4	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-43	172.2	174.3	73.5	0	0	0	111.7	V445 A446 K452 T453 V471 Q474 L475 V493	V445-L449 PolarHBondContact O-N 2.93Å; A446-L449 WeakPolarHBondContact O-CB 3.35Å; A446-L449 PolarHBondContact O-N 3.28Å; L449-K452 WeakPolarHBondContact O-CB 3.23Å; L449-K452 PolarHBondContact O-N 3.34Å; L449-T453 WeakPolarHBondContact O-CB 3.22Å; L449-T453 PolarHBondContact O-N 3.23Å; L449-T453 PolarHBondContact O-OG1 3.06Å; L449-V471 HydrophobicContact CD2-CG1 4.48Å; L449-Q474 HydrophobicContact CD2-CB 4.11Å; L449-L475 HydrophobicContact CD2-CD2 3.89Å; L449-L475 HydrophobicContact CD2-CG 4.25Å; L449-V493 HydrophobicContact CD1-CG2 4.17Å; L449-V493 HydrophobicContact CD2-CG2 3.36Å; L449-V493 HydrophobicContact CG-CG2 4.34Å
450	L	98.5	Very high	97.3	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-60	-48.4	178	-175.7	160.9	0	0	0	110.7	C398 L407 A446 I447 Q448 K452 T453 W454 M468 V471	C398-L450 VanDerWaalsContact SG-CD2 3.58Å; L407-L450 HydrophobicContact CB-CD1 4.3Å; A446-L450 WeakPolarHBondContact O-CB 3.44Å; A446-L450 PolarHBondContact O-N 3.1Å; I447-L450 HydrophobicContact CD1-CD1 4.42Å; I447-L450 PolarHBondContact O-N 2.86Å; Q448-L450 VanDerWaalsContact C-N 3.31Å; Q448-L450 PolarHBondContact O-N 3.45Å; L450-K452 VanDerWaalsContact C-N 3.32Å; L450-K452 PolarHBondContact O-N 3.24Å; L450-T453 PolarHBondContact O-N 2.98Å; L450-W454 WeakPolarHBondContact O-CB 3.27Å; L450-W454 PolarHBondContact O-N 3.22Å; L450-M468 HydrophobicContact CD1-SD 3.57Å; L450-M468 VanDerWaalsContact CD1-SD 3.57Å; L450-V471 HydrophobicContact CB-CG2 4.17Å; L450-V471 HydrophobicContact CG-CG2 4.21Å
451	N	97.2	Very high	97	Very high	14 Å²	14	33.1 Å²	33.1	8%	0.075	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-40.4	176.7	-162.8	25.7	0	0	0	112.3	F385 N389 I447 Q448 K455	F385-N451 HydrophobicContact CD2-CB 3.81Å; F385-N451 HydrophobicContact CE2-CB 3.43Å; F385-N451 VanDerWaalsContact CE2-CB 3.43Å; F385-N451 HydrophobicContact CZ-CB 3.97Å; N389-N451 PolarHBondContact ND2-OD1 2.96Å; I447-N451 PolarHBondContact O-N 2.79Å; I447-N451 VanDerWaalsContact O-N 3.11Å; Q448-N451 PolarHBondContact O-N 3.45Å; N451-K455 VanDerWaalsContact O-CG 3.32Å; N451-K455 WeakPolarHBondContact O-CG 3.37Å; N451-K455 PolarHBondContact O-N 2.74Å; N451-K455 VanDerWaalsContact O-N 3.1Å
452	K	97.2	Very high	96.8	Very high	69 Å²	69	40 Å²	40	30%	0.3	18%	0.179	S	C	.	.	H	α-helix	trans	-60.4	-51	175.8	177.7	-178	171.5	-177	0	110.5	Q448 L449 L450 W454 K455 E456 N494	Q448-K452 WeakPolarHBondContact O-CB 3.4Å; Q448-K452 PolarHBondContact O-N 3.35Å; L449-K452 WeakPolarHBondContact O-CB 3.23Å; L449-K452 PolarHBondContact O-N 3.34Å; L450-K452 VanDerWaalsContact C-N 3.32Å; L450-K452 PolarHBondContact O-N 3.24Å; K452-W454 PolarHBondContact O-N 3.35Å; K452-K455 PolarHBondContact O-N 3.33Å; K452-E456 WeakPolarHBondContact CE-OE1 3.42Å; K452-E456 HydrophobicContact CG-CG 4.48Å; K452-E456 WeakPolarHBondContact O-CG 3.39Å; K452-E456 PolarHBondContact O-N 3.48Å; K452-N494 PolarHBondContact NZ-O 2.92Å
453	T	98	Very high	96.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.6	-40.6	-179.6	-57.2	0	0	0	0	111.6	L449 L450 K455 E456 M457 V467 V470 V471 Q474	L449-T453 WeakPolarHBondContact O-CB 3.22Å; L449-T453 PolarHBondContact O-N 3.23Å; L449-T453 PolarHBondContact O-OG1 3.06Å; L450-T453 PolarHBondContact O-N 2.98Å; T453-K455 VanDerWaalsContact C-N 3.32Å; T453-K455 PolarHBondContact O-N 3.23Å; T453-E456 PolarHBondContact O-N 3.3Å; T453-M457 HydrophobicContact CG2-CG 4.4Å; T453-M457 HydrophobicContact CG2-SD 3.9Å; T453-M457 WeakPolarHBondContact O-CB 3.41Å; T453-M457 VanDerWaalsContact O-CG 3.29Å; T453-M457 WeakPolarHBondContact O-CG 3.48Å; T453-M457 PolarHBondContact O-N 3.45Å; T453-V467 HydrophobicContact CG2-CG1 4.34Å; T453-V470 HydrophobicContact CG2-CB 4.16Å; T453-V470 HydrophobicContact CG2-CG1 3.6Å; T453-V471 HydrophobicContact CG2-CG2 4.17Å; T453-Q474 PolarHBondContact OG1-NE2 3.36Å; T453-Q474 PolarHBondContact OG1-OE1 2.92Å; T453-Q474 VanDerWaalsContact OG1-OE1 3.08Å
454	W	97.4	Very high	96.6	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-54.8	-47.2	173.2	-176.5	-80.6	0	0	0	112	H396 E397 C398 L450 K452 M457 R458 A459 T460 F464 V467	H396-W454 PolarHBondContact O-NE1 2.98Å; E397-W454 VanDerWaalsContact O-CZ2 3.3Å; E397-W454 WeakPolarHBondContact O-CZ2 3.48Å; C398-W454 HydrophobicContact CB-CB 4.47Å; C398-W454 HydrophobicContact CB-CD2 3.83Å; C398-W454 HydrophobicContact CB-CE3 4.48Å; C398-W454 HydrophobicContact CB-CG 3.78Å; L450-W454 WeakPolarHBondContact O-CB 3.27Å; L450-W454 PolarHBondContact O-N 3.22Å; K452-W454 PolarHBondContact O-N 3.35Å; W454-M457 PolarHBondContact O-N 2.96Å; W454-R458 PolarHBondContact O-N 3.15Å; W454-A459 HydrophobicContact CD2-CB 3.78Å; W454-A459 HydrophobicContact CE3-CB 4.12Å; W454-A459 HydrophobicContact CG-CB 4.11Å; W454-A459 HydrophobicContact CZ2-CB 4.24Å; W454-A459 HydrophobicContact CZ3-CB 4.47Å; W454-A459 PolarHBondContact NE1-O 2.87Å; W454-A459 PolarHBondContact O-N 3.47Å; W454-T460 VanDerWaalsContact CH2-O 3.22Å; W454-T460 WeakPolarHBondContact CH2-O 3.5Å; W454-F464 HydrophobicContact CH2-CB 4.38Å; W454-F464 HydrophobicContact CH2-CD2 4.14Å; W454-F464 HydrophobicContact CZ3-CB 4.17Å; W454-F464 AromaticContact CZ3-CD2 3.67Å; W454-F464 HydrophobicContact CZ3-CD2 3.67Å; W454-F464 HydrophobicContact CZ3-CG 4.32Å; W454-V467 HydrophobicContact CB-CG1 4.33Å; W454-V467 HydrophobicContact CD2-CG2 4.5Å; W454-V467 HydrophobicContact CE3-CB 4.13Å; W454-V467 HydrophobicContact CE3-CG1 4.02Å; W454-V467 HydrophobicContact CE3-CG2 3.85Å; W454-V467 HydrophobicContact CZ3-CG2 4.25Å
455	K	95.6	Very high	96.5	Very high	88 Å²	88	48 Å²	48	38%	0.383	22%	0.222	S	C	.	.	H	α-helix	trans	-67.9	-42.7	177.6	-69.4	173.5	-177.1	-176.2	0	112.3	E388 N451 K452 T453 M457 R458	E388-K455 IonicContact OE2-NZ 2.84Å; E388-K455 PolarHBondContact OE2-NZ 2.78Å; N451-K455 VanDerWaalsContact O-CG 3.32Å; N451-K455 WeakPolarHBondContact O-CG 3.37Å; N451-K455 PolarHBondContact O-N 2.74Å; N451-K455 VanDerWaalsContact O-N 3.1Å; K452-K455 PolarHBondContact O-N 3.33Å; T453-K455 VanDerWaalsContact C-N 3.32Å; T453-K455 PolarHBondContact O-N 3.23Å; K455-M457 VanDerWaalsContact C-N 3.27Å; K455-M457 PolarHBondContact O-N 3.04Å; K455-R458 PolarHBondContact O-N 3Å
456	E	96.9	Very high	96.5	Very high	68 Å²	68	53.4 Å²	53.4	32%	0.318	25%	0.245	S	C	.	.	H	α-helix	trans	-60.3	-37.9	176.5	-73.4	176.5	175.9	0	0	112	K452 T453 R458 Y498	K452-E456 WeakPolarHBondContact CE-OE1 3.42Å; K452-E456 HydrophobicContact CG-CG 4.48Å; K452-E456 WeakPolarHBondContact O-CG 3.39Å; K452-E456 PolarHBondContact O-N 3.48Å; T453-E456 PolarHBondContact O-N 3.3Å; E456-R458 VanDerWaalsContact C-N 3.27Å; E456-R458 PolarHBondContact O-N 2.75Å; E456-Y498 VanDerWaalsContact OE2-CB 3.27Å; E456-Y498 WeakPolarHBondContact OE2-CB 3.2Å; E456-Y498 PolarHBondContact OE2-N 3.02Å
457	M	96.9	Very high	96.4	Very high	39 Å²	39	53.5 Å²	53.5	19%	0.192	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.7	175.9	-68.9	179.3	64.7	0	0	113.4	T453 W454 K455 A459 K466 V467 V470 Y498	T453-M457 HydrophobicContact CG2-CG 4.4Å; T453-M457 HydrophobicContact CG2-SD 3.9Å; T453-M457 WeakPolarHBondContact O-CB 3.41Å; T453-M457 VanDerWaalsContact O-CG 3.29Å; T453-M457 WeakPolarHBondContact O-CG 3.48Å; T453-M457 PolarHBondContact O-N 3.45Å; W454-M457 PolarHBondContact O-N 2.96Å; K455-M457 VanDerWaalsContact C-N 3.27Å; K455-M457 PolarHBondContact O-N 3.04Å; M457-A459 HydrophobicContact CB-CB 4.18Å; M457-A459 PolarHBondContact O-N 3.37Å; M457-K466 HydrophobicContact CE-CB 4.28Å; M457-V467 HydrophobicContact CE-CG2 3.87Å; M457-V467 HydrophobicContact SD-CB 4.22Å; M457-V467 HydrophobicContact SD-CG1 4.4Å; M457-V467 HydrophobicContact SD-CG2 3.73Å; M457-V470 HydrophobicContact CE-CG2 4.28Å; M457-V470 HydrophobicContact SD-CB 4.25Å; M457-V470 HydrophobicContact SD-CG2 3.95Å; M457-Y498 HydrophobicContact CE-CE2 4.22Å; M457-Y498 HydrophobicContact CG-CD1 3.71Å; M457-Y498 HydrophobicContact CG-CD2 3.65Å; M457-Y498 HydrophobicContact CG-CE1 3.78Å; M457-Y498 HydrophobicContact CG-CE2 3.71Å; M457-Y498 HydrophobicContact CG-CG 3.64Å; M457-Y498 HydrophobicContact SD-CD2 4Å; M457-Y498 HydrophobicContact SD-CE2 3.98Å
458	R	94.8	Very high	96.4	Very high	203 Å²	203	54.5 Å²	54.5	77%	0.766	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	42.8	-167.6	-57.3	-178.4	179.8	-173	0	111.2	H396 W454 K455 E456	H396-R458 PolarHBondContact CE1-O 3.35Å; H396-R458 PolarHBondContact ND1-O 3.4Å; W454-R458 PolarHBondContact O-N 3.15Å; K455-R458 PolarHBondContact O-N 3Å; E456-R458 VanDerWaalsContact C-N 3.27Å; E456-R458 PolarHBondContact O-N 2.75Å
459	A	95.6	Very high	96.4	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.008	26%	0.259	C	S	.	.			trans	-68.7	155.7	-170	0	0	0	0	0	112.4	H396 W454 M457 D463 V467	H396-A459 WeakPolarHBondContact CA-O 3.37Å; H396-A459 PolarHBondContact ND1-O 3Å; W454-A459 HydrophobicContact CD2-CB 3.78Å; W454-A459 HydrophobicContact CE3-CB 4.12Å; W454-A459 HydrophobicContact CG-CB 4.11Å; W454-A459 HydrophobicContact CZ2-CB 4.24Å; W454-A459 HydrophobicContact CZ3-CB 4.47Å; W454-A459 PolarHBondContact NE1-O 2.87Å; W454-A459 PolarHBondContact O-N 3.47Å; M457-A459 HydrophobicContact CB-CB 4.18Å; M457-A459 PolarHBondContact O-N 3.37Å; A459-D463 HydrophobicContact CB-CB 4.04Å; A459-V467 HydrophobicContact CB-CG2 3.43Å; A459-V467 VanDerWaalsContact CB-CG2 3.43Å
460	T	94.6	Very high	96.4	Very high	27 Å²	27	56.4 Å²	56.4	17%	0.166	26%	0.259	C	S	.	.			trans	-116.1	177	167.4	67.2	0	0	0	0	109.9	K395 W454 E462 D463	K395-T460 HydrophobicContact CB-CG2 4.1Å; K395-T460 WeakPolarHBondContact O-CA 3.4Å; K395-T460 WeakPolarHBondContact O-CB 3.34Å; W454-T460 VanDerWaalsContact CH2-O 3.22Å; W454-T460 WeakPolarHBondContact CH2-O 3.5Å; T460-E462 PolarHBondContact O-N 3.14Å; T460-E462 VanDerWaalsContact O-N 3.12Å; T460-E462 PolarHBondContact OG1-N 3.34Å; T460-D463 PolarHBondContact N-OD2 2.91Å; T460-D463 PolarHBondContact O-N 2.71Å; T460-D463 PolarHBondContact OG1-OD2 2.83Å
461	Q	91.5	Very high	96.4	Very high	67 Å²	67	56.4 Å²	56.4	31%	0.313	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-55	-29.1	175.2	-65.6	-63	-32.5	0	0	113.8	E397 D463 F464	E397-Q461 PolarHBondContact O-NE2 2.76Å; Q461-D463 VanDerWaalsContact C-N 3.3Å; Q461-D463 PolarHBondContact O-N 2.82Å; Q461-F464 VanDerWaalsContact O-CB 3.32Å; Q461-F464 WeakPolarHBondContact O-CB 3.4Å; Q461-F464 PolarHBondContact O-N 2.88Å
462	E	93.8	Very high	96.4	Very high	172 Å²	172	60.8 Å²	60.8	80%	0.804	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-72.3	-23.4	177.8	-63.6	177.7	-168.3	0	0	112.7	T460	T460-E462 PolarHBondContact O-N 3.14Å; T460-E462 VanDerWaalsContact O-N 3.12Å; T460-E462 PolarHBondContact OG1-N 3.34Å
463	D	95.6	Very high	96.4	Very high	40 Å²	40	59.2 Å²	59.2	21%	0.214	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-92.6	2.9	179.2	-61.8	-60.2	0	0	0	113	A459 T460 Q461 D465 K466 V467	A459-D463 HydrophobicContact CB-CB 4.04Å; T460-D463 PolarHBondContact N-OD2 2.91Å; T460-D463 PolarHBondContact O-N 2.71Å; T460-D463 PolarHBondContact OG1-OD2 2.83Å; Q461-D463 VanDerWaalsContact C-N 3.3Å; Q461-D463 PolarHBondContact O-N 2.82Å; D463-D465 VanDerWaalsContact C-N 3.31Å; D463-D465 PolarHBondContact O-N 2.96Å; D463-K466 WeakPolarHBondContact O-CA 3.46Å; D463-K466 WeakPolarHBondContact O-CB 3.28Å; D463-K466 PolarHBondContact O-N 3.04Å; D463-K466 IonicContact OD1-NZ 2.62Å; D463-K466 PolarHBondContact OD1-NZ 2.68Å; D463-V467 WeakPolarHBondContact O-CG2 3.39Å; D463-V467 PolarHBondContact O-N 3.04Å
464	F	96.2	Very high	96.4	Very high	7 Å²	7	59.2 Å²	59.2	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-51.1	-48.1	-173	-177.8	-84	0	0	0	112.8	P399 K402 Q406 W454 Q461 K466 V467 M468	P399-F464 HydrophobicContact CG-CD2 4.13Å; P399-F464 HydrophobicContact CG-CE2 4Å; K402-F464 HydrophobicContact CD-CD2 4.32Å; K402-F464 HydrophobicContact CD-CE2 4.03Å; K402-F464 HydrophobicContact CD-CZ 4.22Å; K402-F464 HydrophobicContact CG-CE2 4.02Å; K402-F464 HydrophobicContact CG-CZ 3.89Å; Q406-F464 HydrophobicContact CB-CE1 4.23Å; Q406-F464 HydrophobicContact CB-CZ 4.13Å; Q406-F464 HydrophobicContact CG-CE1 3.87Å; Q406-F464 HydrophobicContact CG-CZ 3.96Å; W454-F464 HydrophobicContact CH2-CB 4.38Å; W454-F464 HydrophobicContact CH2-CD2 4.14Å; W454-F464 HydrophobicContact CZ3-CB 4.17Å; W454-F464 AromaticContact CZ3-CD2 3.67Å; W454-F464 HydrophobicContact CZ3-CD2 3.67Å; W454-F464 HydrophobicContact CZ3-CG 4.32Å; Q461-F464 VanDerWaalsContact O-CB 3.32Å; Q461-F464 WeakPolarHBondContact O-CB 3.4Å; Q461-F464 PolarHBondContact O-N 2.88Å; F464-K466 VanDerWaalsContact C-N 3.32Å; F464-K466 PolarHBondContact O-N 3.14Å; F464-V467 PolarHBondContact O-N 3.41Å; F464-M468 HydrophobicContact CD1-CG 4.08Å; F464-M468 HydrophobicContact CE1-CG 3.63Å; F464-M468 HydrophobicContact CE1-SD 4.45Å; F464-M468 HydrophobicContact CZ-CG 4.04Å; F464-M468 HydrophobicContact CZ-SD 4.31Å; F464-M468 WeakPolarHBondContact O-CG 3.38Å; F464-M468 PolarHBondContact O-N 3.41Å
465	D	96.3	Very high	96.5	Very high	127 Å²	127	59.1 Å²	59.1	68%	0.679	27%	0.268	S	S	*	.	H	α-helix	trans	-66.4	-34.6	-179.7	-63.9	-36.1	0	0	0	112.3	D463 M468 Q469	D463-D465 VanDerWaalsContact C-N 3.31Å; D463-D465 PolarHBondContact O-N 2.96Å; D465-M468 PolarHBondContact O-N 3.5Å; D465-Q469 PolarHBondContact O-N 3.28Å
466	K	96.6	Very high	96.5	Very high	118 Å²	118	56.7 Å²	56.7	51%	0.513	26%	0.264	S	S	.	.	H	α-helix	trans	-67.5	-42.4	175.8	-58.8	176.4	-165.9	154.3	0	111	M457 D463 F464 Q469 V470	M457-K466 HydrophobicContact CE-CB 4.28Å; D463-K466 WeakPolarHBondContact O-CA 3.46Å; D463-K466 WeakPolarHBondContact O-CB 3.28Å; D463-K466 PolarHBondContact O-N 3.04Å; D463-K466 IonicContact OD1-NZ 2.62Å; D463-K466 PolarHBondContact OD1-NZ 2.68Å; F464-K466 VanDerWaalsContact C-N 3.32Å; F464-K466 PolarHBondContact O-N 3.14Å; K466-Q469 WeakPolarHBondContact O-CB 3.4Å; K466-Q469 PolarHBondContact O-N 3.25Å; K466-V470 WeakPolarHBondContact O-CG2 3.34Å; K466-V470 PolarHBondContact O-N 2.96Å
467	V	98	Very high	96.4	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-47.1	175.3	179.3	0	0	0	0	109.7	T453 W454 M457 A459 D463 F464 Q469 V470 V471	T453-V467 HydrophobicContact CG2-CG1 4.34Å; W454-V467 HydrophobicContact CB-CG1 4.33Å; W454-V467 HydrophobicContact CD2-CG2 4.5Å; W454-V467 HydrophobicContact CE3-CB 4.13Å; W454-V467 HydrophobicContact CE3-CG1 4.02Å; W454-V467 HydrophobicContact CE3-CG2 3.85Å; W454-V467 HydrophobicContact CZ3-CG2 4.25Å; M457-V467 HydrophobicContact CE-CG2 3.87Å; M457-V467 HydrophobicContact SD-CB 4.22Å; M457-V467 HydrophobicContact SD-CG1 4.4Å; M457-V467 HydrophobicContact SD-CG2 3.73Å; A459-V467 HydrophobicContact CB-CG2 3.43Å; A459-V467 VanDerWaalsContact CB-CG2 3.43Å; D463-V467 WeakPolarHBondContact O-CG2 3.39Å; D463-V467 PolarHBondContact O-N 3.04Å; F464-V467 PolarHBondContact O-N 3.41Å; V467-Q469 VanDerWaalsContact C-N 3.26Å; V467-Q469 PolarHBondContact O-N 2.94Å; V467-V470 PolarHBondContact O-N 3.3Å; V467-V470 VanDerWaalsContact O-N 3.14Å; V467-V471 HydrophobicContact CG1-CG2 4.29Å; V467-V471 WeakPolarHBondContact O-CG2 3.24Å; V467-V471 PolarHBondContact O-N 2.94Å
468	M	98.1	Very high	96.5	Very high	21 Å²	21	55.9 Å²	55.9	10%	0.103	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-37	176.5	-73.8	-57.8	-56.8	0	0	112.5	Q406 L410 L450 F464 D465 V471 R472	Q406-M468 HydrophobicContact CB-CE 3.9Å; Q406-M468 HydrophobicContact CB-SD 4.26Å; L410-M468 HydrophobicContact CB-CE 4.39Å; L410-M468 HydrophobicContact CD2-CE 3.95Å; L450-M468 HydrophobicContact CD1-SD 3.57Å; L450-M468 VanDerWaalsContact CD1-SD 3.57Å; F464-M468 HydrophobicContact CD1-CG 4.08Å; F464-M468 HydrophobicContact CE1-CG 3.63Å; F464-M468 HydrophobicContact CE1-SD 4.45Å; F464-M468 HydrophobicContact CZ-CG 4.04Å; F464-M468 HydrophobicContact CZ-SD 4.31Å; F464-M468 WeakPolarHBondContact O-CG 3.38Å; F464-M468 PolarHBondContact O-N 3.41Å; D465-M468 PolarHBondContact O-N 3.5Å; M468-V471 PolarHBondContact O-N 3.5Å; M468-R472 WeakPolarHBondContact O-CB 3.32Å; M468-R472 PolarHBondContact O-N 3.44Å
469	Q	96.8	Very high	96.5	Very high	117 Å²	117	47.2 Å²	47.2	55%	0.547	23%	0.225	S	C	.	.	H	α-helix	trans	-66.6	-42.3	175.5	-171.1	-178.1	10.5	0	0	112.5	D465 K466 V467 R472 E473	D465-Q469 PolarHBondContact O-N 3.28Å; K466-Q469 WeakPolarHBondContact O-CB 3.4Å; K466-Q469 PolarHBondContact O-N 3.25Å; V467-Q469 VanDerWaalsContact C-N 3.26Å; V467-Q469 PolarHBondContact O-N 2.94Å; Q469-R472 PolarHBondContact O-N 3.21Å; Q469-E473 PolarHBondContact O-N 2.95Å
470	V	98	Very high	96.3	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.012	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-44.7	174.2	174.6	0	0	0	0	110.4	T453 M457 K466 V467 R472 E473 Q474 Y498 V501	T453-V470 HydrophobicContact CG2-CB 4.16Å; T453-V470 HydrophobicContact CG2-CG1 3.6Å; M457-V470 HydrophobicContact CE-CG2 4.28Å; M457-V470 HydrophobicContact SD-CB 4.25Å; M457-V470 HydrophobicContact SD-CG2 3.95Å; K466-V470 WeakPolarHBondContact O-CG2 3.34Å; K466-V470 PolarHBondContact O-N 2.96Å; V467-V470 PolarHBondContact O-N 3.3Å; V467-V470 VanDerWaalsContact O-N 3.14Å; V470-R472 PolarHBondContact O-N 3.44Å; V470-E473 WeakPolarHBondContact O-CB 3.31Å; V470-E473 PolarHBondContact O-N 2.84Å; V470-E473 VanDerWaalsContact O-N 3.16Å; V470-Q474 HydrophobicContact CG1-CG 4.44Å; V470-Q474 WeakPolarHBondContact O-CG 3.42Å; V470-Q474 PolarHBondContact O-N 3.42Å; V470-Y498 HydrophobicContact CG1-CD2 4.01Å; V470-Y498 HydrophobicContact CG2-CD2 4.25Å; V470-Y498 HydrophobicContact CG2-CE2 4.18Å; V470-V501 HydrophobicContact CG1-CG1 4.36Å
471	V	98.5	Very high	96.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-42.2	177.3	174.1	0	0	0	0	111.4	L407 L410 L449 L450 T453 V467 M468 E473 Q474 L475	L407-V471 HydrophobicContact CD1-CG1 4.31Å; L410-V471 HydrophobicContact CD2-CG1 4.39Å; L449-V471 HydrophobicContact CD2-CG1 4.48Å; L450-V471 HydrophobicContact CB-CG2 4.17Å; L450-V471 HydrophobicContact CG-CG2 4.21Å; T453-V471 HydrophobicContact CG2-CG2 4.17Å; V467-V471 HydrophobicContact CG1-CG2 4.29Å; V467-V471 WeakPolarHBondContact O-CG2 3.24Å; V467-V471 PolarHBondContact O-N 2.94Å; M468-V471 PolarHBondContact O-N 3.5Å; V471-E473 VanDerWaalsContact C-N 3.31Å; V471-E473 PolarHBondContact O-N 2.84Å; V471-Q474 PolarHBondContact O-N 3Å; V471-L475 HydrophobicContact CG1-CD1 3.82Å; V471-L475 HydrophobicContact CG1-CG 4.22Å; V471-L475 WeakPolarHBondContact O-CB 3.48Å; V471-L475 VanDerWaalsContact O-CG 3.25Å; V471-L475 WeakPolarHBondContact O-CG 3.46Å; V471-L475 PolarHBondContact O-N 3.4Å
472	R	98.4	Very high	96.3	Very high	107 Å²	107	56.3 Å²	56.3	40%	0.404	28%	0.281	S	S	.	.	H	α-helix	trans	-54.9	-47.7	171.8	170.2	179.2	-86.4	130.4	-9.7	111	L410 E413 M468 Q469 V470 L475 A476	L410-R472 HydrophobicContact CD1-CB 3.68Å; L410-R472 HydrophobicContact CD1-CG 3.69Å; L410-R472 VanDerWaalsContact CD1-NE 3.31Å; L410-R472 HydrophobicContact CD2-CB 3.91Å; L410-R472 HydrophobicContact CG-CB 4.46Å; E413-R472 IonicContact OE2-CZ 3.67Å; E413-R472 IonicContact OE2-NH2 3.36Å; E413-R472 PolarHBondContact OE2-NH2 3.21Å; M468-R472 WeakPolarHBondContact O-CB 3.32Å; M468-R472 PolarHBondContact O-N 3.44Å; Q469-R472 PolarHBondContact O-N 3.21Å; V470-R472 PolarHBondContact O-N 3.44Å; R472-L475 PolarHBondContact O-N 2.85Å; R472-A476 WeakPolarHBondContact O-CB 3.5Å; R472-A476 PolarHBondContact O-N 3.44Å
473	E	96.9	Very high	96.3	Very high	35 Å²	35	48.4 Å²	48.4	16%	0.164	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-43.2	179.6	-173.4	175.2	172.8	0	0	112	Q469 V470 V471 L475 R477 R505	Q469-E473 PolarHBondContact O-N 2.95Å; V470-E473 WeakPolarHBondContact O-CB 3.31Å; V470-E473 PolarHBondContact O-N 2.84Å; V470-E473 VanDerWaalsContact O-N 3.16Å; V471-E473 VanDerWaalsContact C-N 3.31Å; V471-E473 PolarHBondContact O-N 2.84Å; E473-L475 PolarHBondContact O-N 3.45Å; E473-R477 HydrophobicContact CG-CG 4.28Å; E473-R477 VanDerWaalsContact O-CB 3.3Å; E473-R477 WeakPolarHBondContact O-CB 3.26Å; E473-R477 VanDerWaalsContact O-CG 3.3Å; E473-R477 WeakPolarHBondContact O-CG 3.39Å; E473-R477 PolarHBondContact O-N 3.14Å; E473-R477 IonicContact OE1-CZ 2.84Å; E473-R477 IonicContact OE1-NE 3.39Å; E473-R477 PolarHBondContact OE1-NE 3.44Å; E473-R477 IonicContact OE1-NH2 2.67Å; E473-R477 PolarHBondContact OE1-NH2 2.82Å; E473-R505 IonicContact OE2-CZ 2.96Å; E473-R505 IonicContact OE2-NE 3.71Å; E473-R505 PolarHBondContact OE2-NE 3.49Å; E473-R505 IonicContact OE2-NH2 3Å; E473-R505 PolarHBondContact OE2-NH2 3.27Å
474	Q	98.4	Very high	96.2	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.1	-47.3	176.8	-71.1	167.8	-41.8	0	0	111.9	L449 T453 V470 V471 T478 V493 L496 V501	L449-Q474 HydrophobicContact CD2-CB 4.11Å; T453-Q474 PolarHBondContact OG1-NE2 3.36Å; T453-Q474 PolarHBondContact OG1-OE1 2.92Å; T453-Q474 VanDerWaalsContact OG1-OE1 3.08Å; V470-Q474 HydrophobicContact CG1-CG 4.44Å; V470-Q474 WeakPolarHBondContact O-CG 3.42Å; V470-Q474 PolarHBondContact O-N 3.42Å; V471-Q474 PolarHBondContact O-N 3Å; Q474-T478 WeakPolarHBondContact O-CB 3.46Å; Q474-T478 PolarHBondContact O-N 3.45Å; Q474-T478 VanDerWaalsContact O-N 3.12Å; Q474-T478 PolarHBondContact O-OG1 3.39Å; Q474-V493 HydrophobicContact CB-CG2 4.34Å; Q474-L496 HydrophobicContact CB-CD2 4.26Å; Q474-L496 HydrophobicContact CG-CD2 4.29Å; Q474-L496 HydrophobicContact CG-CG 4.29Å; Q474-L496 PolarHBondContact NE2-O 3.39Å; Q474-V501 HydrophobicContact CG-CG2 3.76Å
475	L	98.3	Very high	96	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-49.3	179.3	-66.1	174.3	0	0	0	111.2	L407 L410 L411 L414 A446 L449 V471 R472 E473 T478 L479 F489 V493	L407-L475 HydrophobicContact CD1-CD1 3.96Å; L410-L475 HydrophobicContact CD2-CD1 3.98Å; L410-L475 HydrophobicContact CG-CD1 4.49Å; L411-L475 HydrophobicContact CD2-CD1 4.08Å; L414-L475 HydrophobicContact CD1-CB 3.7Å; L414-L475 HydrophobicContact CD1-CD1 4.32Å; A446-L475 HydrophobicContact CB-CD1 4.21Å; A446-L475 HydrophobicContact CB-CD2 3.93Å; L449-L475 HydrophobicContact CD2-CD2 3.89Å; L449-L475 HydrophobicContact CD2-CG 4.25Å; V471-L475 HydrophobicContact CG1-CD1 3.82Å; V471-L475 HydrophobicContact CG1-CG 4.22Å; V471-L475 WeakPolarHBondContact O-CB 3.48Å; V471-L475 VanDerWaalsContact O-CG 3.25Å; V471-L475 WeakPolarHBondContact O-CG 3.46Å; V471-L475 PolarHBondContact O-N 3.4Å; R472-L475 PolarHBondContact O-N 2.85Å; E473-L475 PolarHBondContact O-N 3.45Å; L475-T478 PolarHBondContact O-N 3.16Å; L475-L479 WeakPolarHBondContact O-CB 3.33Å; L475-L479 VanDerWaalsContact O-CG 3.29Å; L475-L479 WeakPolarHBondContact O-CG 3.27Å; L475-L479 PolarHBondContact O-N 3.15Å; L475-F489 HydrophobicContact CD2-CZ 3.7Å; L475-V493 HydrophobicContact CD2-CG2 4.27Å
476	A	97.2	Very high	95.9	Very high	37 Å²	37	45 Å²	45	31%	0.306	23%	0.231	S	C	.	.	H	α-helix	trans	-61	-48.1	-178.9	0	0	0	0	0	112	L414 R472 T478 L479 A480	L414-A476 HydrophobicContact CD2-CB 3.93Å; R472-A476 WeakPolarHBondContact O-CB 3.5Å; R472-A476 PolarHBondContact O-N 3.44Å; A476-T478 VanDerWaalsContact C-N 3.28Å; A476-T478 PolarHBondContact O-N 2.77Å; A476-L479 PolarHBondContact O-N 3.35Å; A476-A480 WeakPolarHBondContact O-CB 3.27Å; A476-A480 PolarHBondContact O-N 3.49Å
477	R	95.1	Very high	95.9	Very high	86 Å²	86	44.6 Å²	44.6	33%	0.325	23%	0.231	S	C	.	.	H	α-helix	trans	-60.8	-38.4	176.7	-72.2	-176.5	-174.7	-106.5	6.4	111.5	E473 L481 L496 E508	E473-R477 HydrophobicContact CG-CG 4.28Å; E473-R477 VanDerWaalsContact O-CB 3.3Å; E473-R477 WeakPolarHBondContact O-CB 3.26Å; E473-R477 VanDerWaalsContact O-CG 3.3Å; E473-R477 WeakPolarHBondContact O-CG 3.39Å; E473-R477 PolarHBondContact O-N 3.14Å; E473-R477 IonicContact OE1-CZ 2.84Å; E473-R477 IonicContact OE1-NE 3.39Å; E473-R477 PolarHBondContact OE1-NE 3.44Å; E473-R477 IonicContact OE1-NH2 2.67Å; E473-R477 PolarHBondContact OE1-NH2 2.82Å; R477-L481 WeakPolarHBondContact O-CG 3.26Å; R477-L496 HydrophobicContact CB-CD2 4.03Å; R477-E508 IonicContact CZ-OE1 3.79Å; R477-E508 IonicContact NH1-OE1 2.82Å; R477-E508 PolarHBondContact NH1-OE1 3.42Å; R477-E508 VanDerWaalsContact NH1-OE1 3.14Å; R477-E508 IonicContact NH2-OE1 2.66Å; R477-E508 PolarHBondContact NH2-OE1 2.75Å; R477-E508 IonicContact NH2-OE2 3.35Å; R477-E508 PolarHBondContact NH2-OE2 3.43Å
478	T	97.1	Very high	95.7	Very high	4 Å²	4	47.5 Å²	47.5	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-72.8	-43	179.6	-54.8	0	0	0	0	112.4	Q474 L475 A476 A480 L481 F489 K492 V493	Q474-T478 WeakPolarHBondContact O-CB 3.46Å; Q474-T478 PolarHBondContact O-N 3.45Å; Q474-T478 VanDerWaalsContact O-N 3.12Å; Q474-T478 PolarHBondContact O-OG1 3.39Å; L475-T478 PolarHBondContact O-N 3.16Å; A476-T478 VanDerWaalsContact C-N 3.28Å; A476-T478 PolarHBondContact O-N 2.77Å; T478-A480 VanDerWaalsContact C-N 3.3Å; T478-A480 PolarHBondContact O-N 3.43Å; T478-L481 WeakPolarHBondContact O-CB 3.49Å; T478-L481 PolarHBondContact O-N 3.17Å; T478-L481 VanDerWaalsContact O-N 3.15Å; T478-F489 HydrophobicContact CG2-CD2 3.58Å; T478-F489 HydrophobicContact CG2-CE2 3.74Å; T478-F489 HydrophobicContact CG2-CG 4.38Å; T478-K492 HydrophobicContact CG2-CB 3.76Å; T478-V493 HydrophobicContact CG2-CB 4.07Å
479	L	95.1	Very high	95.7	Very high	21 Å²	21	46.5 Å²	46.5	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-36.1	177.7	-71.7	171.5	0	0	0	111.8	L414 L415 M431 L475 A476 L481 K482 F489	L414-L479 HydrophobicContact CB-CD1 4.09Å; L414-L479 HydrophobicContact CD1-CD1 4.21Å; L415-L479 HydrophobicContact CD2-CD1 4.45Å; M431-L479 HydrophobicContact CE-CD2 3.38Å; L475-L479 WeakPolarHBondContact O-CB 3.33Å; L475-L479 VanDerWaalsContact O-CG 3.29Å; L475-L479 WeakPolarHBondContact O-CG 3.27Å; L475-L479 PolarHBondContact O-N 3.15Å; A476-L479 PolarHBondContact O-N 3.35Å; L479-L481 PolarHBondContact O-N 3.2Å; L479-L481 VanDerWaalsContact O-N 3.16Å; L479-K482 PolarHBondContact O-N 2.97Å; L479-F489 HydrophobicContact CD2-CD2 4.16Å; L479-F489 HydrophobicContact CD2-CE2 3.83Å; L479-F489 HydrophobicContact CG-CE2 4.07Å
480	A	92.9	Very high	95.7	Very high	77 Å²	77	45.2 Å²	45.2	64%	0.636	23%	0.231	S	C	*	.	H	α-helix	trans	-60.5	-22.4	175.3	0	0	0	0	0	113.5	A476 T478 K482	A476-A480 WeakPolarHBondContact O-CB 3.27Å; A476-A480 PolarHBondContact O-N 3.49Å; T478-A480 VanDerWaalsContact C-N 3.3Å; T478-A480 PolarHBondContact O-N 3.43Å; A480-K482 PolarHBondContact O-N 2.73Å
481	L	93.4	Very high	95.7	Very high	118 Å²	118	48.9 Å²	48.9	62%	0.618	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-4	173.9	-57.2	176.4	0	0	0	113.4	R477 T478 L479	R477-L481 WeakPolarHBondContact O-CG 3.26Å; T478-L481 WeakPolarHBondContact O-CB 3.49Å; T478-L481 PolarHBondContact O-N 3.17Å; T478-L481 VanDerWaalsContact O-N 3.15Å; L479-L481 PolarHBondContact O-N 3.2Å; L479-L481 VanDerWaalsContact O-N 3.16Å
482	K	91.7	Very high	95.6	Very high	92 Å²	92	54 Å²	54	40%	0.4	28%	0.276	S	S	.	.			trans	47.2	59.1	-178.2	-56.9	-172.5	-172.9	-172	0	112.8	D427 L479 A480 T484	D427-K482 WeakPolarHBondContact OD1-CE 3.35Å; D427-K482 IonicContact OD1-NZ 2.7Å; D427-K482 PolarHBondContact OD1-NZ 3.34Å; D427-K482 WeakPolarHBondContact OD2-CE 3.3Å; D427-K482 IonicContact OD2-NZ 3.73Å; D427-K482 PolarHBondContact OD2-NZ 3.29Å; L479-K482 PolarHBondContact O-N 2.97Å; A480-K482 PolarHBondContact O-N 2.73Å; K482-T484 PolarHBondContact O-N 2.95Å
483	P	94.1	Very high	95.5	Very high	6 Å²	6	48.9 Å²	48.9	4%	0.039	26%	0.257	C	S	.	.			trans	-57.8	137.2	179.9	23.9	-31.3	0	0	0	110.5	M431 S485 L488 F489	M431-P483 WeakPolarHBondContact CB-O 3.41Å; M431-P483 HydrophobicContact SD-CG 3.99Å; P483-S485 VanDerWaalsContact C-N 3.33Å; P483-L488 HydrophobicContact CB-CB 4.29Å; P483-L488 HydrophobicContact CB-CD2 4.17Å; P483-L488 HydrophobicContact CB-CG 4.11Å; P483-F489 HydrophobicContact CB-CB 4.05Å; P483-F489 HydrophobicContact CG-CB 3.78Å; P483-F489 HydrophobicContact CG-CD2 3.93Å; P483-F489 HydrophobicContact CG-CG 4.36Å
484	T	92.5	Very high	95.5	Very high	53 Å²	53	50 Å²	50	33%	0.325	26%	0.263	S	S	.	.	S	Bend	trans	-76.2	-21.9	-176.5	52.3	0	0	0	0	113.3	Y264 M431 K482	Y264-T484 VanDerWaalsContact CE2-O 3.26Å; Y264-T484 WeakPolarHBondContact CE2-O 3.45Å; Y264-T484 PolarHBondContact OH-O 2.9Å; M431-T484 WeakPolarHBondContact CA-O 3.48Å; K482-T484 PolarHBondContact O-N 2.95Å
485	S	93.7	Very high	95.4	Very high	30 Å²	30	53.3 Å²	53.3	21%	0.21	29%	0.291	C	S	.	.	S	Bend	trans	-141.9	160.8	179.1	72.1	0	0	0	0	112	P483 E487 L488 F489	P483-S485 VanDerWaalsContact C-N 3.33Å; S485-E487 VanDerWaalsContact C-N 3.25Å; S485-E487 PolarHBondContact O-N 3.3Å; S485-L488 PolarHBondContact O-N 3.13Å; S485-L488 PolarHBondContact OG-N 3.04Å; S485-F489 PolarHBondContact O-N 2.96Å
486	L	93.8	Very high	95.2	Very high	18 Å²	18	54.3 Å²	54.3	9%	0.094	30%	0.297	C	S	.	.	H	α-helix	trans	-61	-34.1	175.3	-174	72.9	0	0	0	112.5	Q435 E441 V445 F489 R490	Q435-L486 HydrophobicContact CG-CD2 4.39Å; E441-L486 HydrophobicContact CB-CD1 4.45Å; E441-L486 HydrophobicContact CB-CD2 3.67Å; E441-L486 HydrophobicContact CG-CD2 4.36Å; V445-L486 HydrophobicContact CG2-CD1 4.22Å; V445-L486 HydrophobicContact CG2-CG 4.42Å; L486-F489 HydrophobicContact CD1-CD1 4.47Å; L486-F489 WeakPolarHBondContact O-CB 3.33Å; L486-F489 PolarHBondContact O-N 3.25Å; L486-R490 WeakPolarHBondContact O-CB 3.44Å; L486-R490 PolarHBondContact O-N 3.3Å
487	E	95	Very high	95.2	Very high	110 Å²	110	54.7 Å²	54.7	51%	0.514	30%	0.295	S	S	.	.	H	α-helix	trans	-70.3	-37.8	178.8	-170.3	55.1	-142.7	0	0	111.8	S485 R490 T491	S485-E487 VanDerWaalsContact C-N 3.25Å; S485-E487 PolarHBondContact O-N 3.3Å; E487-R490 PolarHBondContact O-N 3.27Å; E487-T491 WeakPolarHBondContact O-CB 3.42Å; E487-T491 PolarHBondContact O-N 3Å; E487-T491 PolarHBondContact O-OG1 3.34Å
488	L	95.4	Very high	95.2	Very high	64 Å²	64	53.4 Å²	53.4	34%	0.335	29%	0.291	S	S	.	.	H	α-helix	trans	-65.2	-43.4	172.7	-177	61	0	0	0	110.7	P483 S485 R490 T491 K492	P483-L488 HydrophobicContact CB-CB 4.29Å; P483-L488 HydrophobicContact CB-CD2 4.17Å; P483-L488 HydrophobicContact CB-CG 4.11Å; S485-L488 PolarHBondContact O-N 3.13Å; S485-L488 PolarHBondContact OG-N 3.04Å; L488-R490 PolarHBondContact O-N 3.04Å; L488-T491 PolarHBondContact O-N 2.87Å; L488-K492 HydrophobicContact CD1-CG 4.23Å; L488-K492 HydrophobicContact CG-CG 4.46Å; L488-K492 WeakPolarHBondContact O-CB 3.31Å; L488-K492 VanDerWaalsContact O-CG 3.27Å; L488-K492 WeakPolarHBondContact O-CG 3.43Å; L488-K492 PolarHBondContact O-N 3.33Å
489	F	97	Very high	95.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.1	-50.3	172.3	173.6	-90.3	0	0	0	111.1	M431 L442 V445 L475 T478 L479 P483 S485 L486 T491 K492 V493	M431-F489 HydrophobicContact SD-CB 4.16Å; M431-F489 HydrophobicContact SD-CD2 4.32Å; M431-F489 HydrophobicContact SD-CG 4.34Å; L442-F489 HydrophobicContact CD1-CD1 3.83Å; L442-F489 HydrophobicContact CD1-CD2 4.36Å; L442-F489 HydrophobicContact CD1-CE1 3.3Å; L442-F489 HydrophobicContact CD1-CE2 3.91Å; L442-F489 HydrophobicContact CD1-CG 4.34Å; L442-F489 HydrophobicContact CD1-CZ 3.36Å; V445-F489 HydrophobicContact CB-CE1 4.24Å; V445-F489 HydrophobicContact CG1-CD1 4.03Å; V445-F489 HydrophobicContact CG1-CE1 3.75Å; L475-F489 HydrophobicContact CD2-CZ 3.7Å; T478-F489 HydrophobicContact CG2-CD2 3.58Å; T478-F489 HydrophobicContact CG2-CE2 3.74Å; T478-F489 HydrophobicContact CG2-CG 4.38Å; L479-F489 HydrophobicContact CD2-CD2 4.16Å; L479-F489 HydrophobicContact CD2-CE2 3.83Å; L479-F489 HydrophobicContact CG-CE2 4.07Å; P483-F489 HydrophobicContact CB-CB 4.05Å; P483-F489 HydrophobicContact CG-CB 3.78Å; P483-F489 HydrophobicContact CG-CD2 3.93Å; P483-F489 HydrophobicContact CG-CG 4.36Å; S485-F489 PolarHBondContact O-N 2.96Å; L486-F489 HydrophobicContact CD1-CD1 4.47Å; L486-F489 WeakPolarHBondContact O-CB 3.33Å; L486-F489 PolarHBondContact O-N 3.25Å; F489-T491 VanDerWaalsContact C-N 3.32Å; F489-T491 PolarHBondContact O-N 3.25Å; F489-K492 PolarHBondContact O-N 2.97Å; F489-V493 HydrophobicContact CD1-CG1 4.39Å; F489-V493 HydrophobicContact CE1-CB 4.35Å; F489-V493 HydrophobicContact CE1-CG1 4Å; F489-V493 HydrophobicContact CZ-CB 4.3Å; F489-V493 HydrophobicContact CZ-CG1 4.41Å; F489-V493 HydrophobicContact CZ-CG2 4.34Å; F489-V493 WeakPolarHBondContact O-CB 3.28Å; F489-V493 WeakPolarHBondContact O-CG1 3.24Å; F489-V493 PolarHBondContact O-N 2.84Å
490	R	97.2	Very high	95.1	Very high	89 Å²	89	57 Å²	57	34%	0.336	32%	0.318	S	S	.	.	H	α-helix	trans	-57.1	-44	178.3	179.9	-177.8	-70.7	-167.4	-0.6	111.7	V445 L486 E487 L488 N494	V445-R490 HydrophobicContact CG1-CB 4.22Å; V445-R490 HydrophobicContact CG1-CG 4.27Å; L486-R490 WeakPolarHBondContact O-CB 3.44Å; L486-R490 PolarHBondContact O-N 3.3Å; E487-R490 PolarHBondContact O-N 3.27Å; L488-R490 PolarHBondContact O-N 3.04Å; R490-N494 WeakPolarHBondContact CG-ND2 3.23Å; R490-N494 VanDerWaalsContact O-CB 3.26Å; R490-N494 WeakPolarHBondContact O-CB 3.26Å; R490-N494 PolarHBondContact O-N 3.24Å; R490-N494 VanDerWaalsContact O-N 3.15Å; R490-N494 PolarHBondContact O-ND2 2.95Å
491	T	97.2	Very high	95.1	Very high	80 Å²	80	53.4 Å²	53.4	49%	0.491	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-48.8	178.7	-60.9	0	0	0	0	111.1	E487 L488 F489 A495	E487-T491 WeakPolarHBondContact O-CB 3.42Å; E487-T491 PolarHBondContact O-N 3Å; E487-T491 PolarHBondContact O-OG1 3.34Å; L488-T491 PolarHBondContact O-N 2.87Å; F489-T491 VanDerWaalsContact C-N 3.32Å; F489-T491 PolarHBondContact O-N 3.25Å; T491-A495 PolarHBondContact O-N 3.48Å; T491-A495 VanDerWaalsContact O-N 3.12Å
492	K	97	Very high	95	Very high	107 Å²	107	51 Å²	51	47%	0.465	28%	0.276	S	S	.	.	H	α-helix	trans	-66	-44.9	-177.7	-68.3	-68	-176.7	179.9	0	112.3	T478 L488 F489 N494 A495 L496	T478-K492 HydrophobicContact CG2-CB 3.76Å; L488-K492 HydrophobicContact CD1-CG 4.23Å; L488-K492 HydrophobicContact CG-CG 4.46Å; L488-K492 WeakPolarHBondContact O-CB 3.31Å; L488-K492 VanDerWaalsContact O-CG 3.27Å; L488-K492 WeakPolarHBondContact O-CG 3.43Å; L488-K492 PolarHBondContact O-N 3.33Å; F489-K492 PolarHBondContact O-N 2.97Å; K492-N494 VanDerWaalsContact C-N 3.33Å; K492-N494 PolarHBondContact O-N 3.36Å; K492-A495 PolarHBondContact O-N 2.91Å; K492-L496 PolarHBondContact O-N 3.33Å
493	V	97.4	Very high	95	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68.6	-34.7	-178.5	81.3	0	0	0	0	111.8	V445 L449 Q474 L475 T478 F489 L496	V445-V493 HydrophobicContact CG1-CG1 4.02Å; L449-V493 HydrophobicContact CD1-CG2 4.17Å; L449-V493 HydrophobicContact CD2-CG2 3.36Å; L449-V493 HydrophobicContact CG-CG2 4.34Å; Q474-V493 HydrophobicContact CB-CG2 4.34Å; L475-V493 HydrophobicContact CD2-CG2 4.27Å; T478-V493 HydrophobicContact CG2-CB 4.07Å; F489-V493 HydrophobicContact CD1-CG1 4.39Å; F489-V493 HydrophobicContact CE1-CB 4.35Å; F489-V493 HydrophobicContact CE1-CG1 4Å; F489-V493 HydrophobicContact CZ-CB 4.3Å; F489-V493 HydrophobicContact CZ-CG1 4.41Å; F489-V493 HydrophobicContact CZ-CG2 4.34Å; F489-V493 WeakPolarHBondContact O-CB 3.28Å; F489-V493 WeakPolarHBondContact O-CG1 3.24Å; F489-V493 PolarHBondContact O-N 2.84Å; V493-L496 PolarHBondContact O-N 3.04Å
494	N	95.3	Very high	94.7	Very high	57 Å²	57	53.8 Å²	53.8	31%	0.305	29%	0.285	S	S	.	.	H	α-helix	trans	-74.7	-25.1	177.1	-80.1	-53.9	0	0	0	113.7	K452 R490 K492 L496	K452-N494 PolarHBondContact NZ-O 2.92Å; R490-N494 WeakPolarHBondContact CG-ND2 3.23Å; R490-N494 VanDerWaalsContact O-CB 3.26Å; R490-N494 WeakPolarHBondContact O-CB 3.26Å; R490-N494 PolarHBondContact O-N 3.24Å; R490-N494 VanDerWaalsContact O-N 3.15Å; R490-N494 PolarHBondContact O-ND2 2.95Å; K492-N494 VanDerWaalsContact C-N 3.33Å; K492-N494 PolarHBondContact O-N 3.36Å; N494-L496 VanDerWaalsContact C-N 3.29Å
495	A	96.2	Very high	94.4	Very high	70 Å²	70	54.3 Å²	54.3	58%	0.579	28%	0.281	S	S	*	.	H	α-helix	trans	-71	-27.6	171.9	0	0	0	0	0	112	T491 K492 T497	T491-A495 PolarHBondContact O-N 3.48Å; T491-A495 VanDerWaalsContact O-N 3.12Å; K492-A495 PolarHBondContact O-N 2.91Å; A495-T497 VanDerWaalsContact C-N 3.26Å; A495-T497 PolarHBondContact O-N 3.14Å
496	L	95.8	Very high	93.7	Very high	22 Å²	22	58.5 Å²	58.5	12%	0.115	30%	0.298	C	S	.	.	S	Bend	trans	-83.4	63.8	178.5	-164.4	63.1	0	0	0	111.3	Q474 R477 K492 V493 N494 E500 V501 L504	Q474-L496 HydrophobicContact CB-CD2 4.26Å; Q474-L496 HydrophobicContact CG-CD2 4.29Å; Q474-L496 HydrophobicContact CG-CG 4.29Å; Q474-L496 PolarHBondContact NE2-O 3.39Å; R477-L496 HydrophobicContact CB-CD2 4.03Å; K492-L496 PolarHBondContact O-N 3.33Å; V493-L496 PolarHBondContact O-N 3.04Å; N494-L496 VanDerWaalsContact C-N 3.29Å; L496-E500 HydrophobicContact CD1-CB 4.5Å; L496-E500 HydrophobicContact CD1-CG 3.88Å; L496-V501 HydrophobicContact CD1-CG2 4.33Å; L496-V501 HydrophobicContact CG-CG2 3.98Å; L496-L504 HydrophobicContact CD1-CD1 3.73Å
497	T	96.3	Very high	92.9	Very high	45 Å²	45	60 Å²	60	28%	0.276	31%	0.308	S	S	.	.			trans	-63.2	165.9	179.3	66.2	0	0	0	0	112.3	A495 G499 E500 V501	A495-T497 VanDerWaalsContact C-N 3.26Å; A495-T497 PolarHBondContact O-N 3.14Å; T497-G499 PolarHBondContact O-N 3.08Å; T497-E500 PolarHBondContact O-N 3.27Å; T497-E500 VanDerWaalsContact O-N 3.07Å; T497-E500 PolarHBondContact OG1-N 3.26Å; T497-V501 WeakPolarHBondContact O-CG2 3.44Å; T497-V501 PolarHBondContact O-N 2.99Å
498	Y	96.3	Very high	92.2	Very high	59 Å²	59	58.4 Å²	58.4	23%	0.231	30%	0.3	C	S	.	.	H	α-helix	trans	-54.8	-41.1	173.4	174.1	-122.2	0	0	0	112.2	E456 M457 V470 E500 V501 L502	E456-Y498 VanDerWaalsContact OE2-CB 3.27Å; E456-Y498 WeakPolarHBondContact OE2-CB 3.2Å; E456-Y498 PolarHBondContact OE2-N 3.02Å; M457-Y498 HydrophobicContact CE-CE2 4.22Å; M457-Y498 HydrophobicContact CG-CD1 3.71Å; M457-Y498 HydrophobicContact CG-CD2 3.65Å; M457-Y498 HydrophobicContact CG-CE1 3.78Å; M457-Y498 HydrophobicContact CG-CE2 3.71Å; M457-Y498 HydrophobicContact CG-CG 3.64Å; M457-Y498 HydrophobicContact SD-CD2 4Å; M457-Y498 HydrophobicContact SD-CE2 3.98Å; V470-Y498 HydrophobicContact CG1-CD2 4.01Å; V470-Y498 HydrophobicContact CG2-CD2 4.25Å; V470-Y498 HydrophobicContact CG2-CE2 4.18Å; Y498-E500 VanDerWaalsContact C-N 3.32Å; Y498-E500 PolarHBondContact O-N 2.74Å; Y498-V501 PolarHBondContact O-N 3.24Å; Y498-L502 HydrophobicContact CD1-CD1 4.14Å; Y498-L502 HydrophobicContact CD2-CG 4.17Å; Y498-L502 HydrophobicContact CE1-CD1 3.5Å; Y498-L502 HydrophobicContact CE1-CG 4.11Å; Y498-L502 HydrophobicContact CE2-CD1 4.02Å; Y498-L502 HydrophobicContact CE2-CD2 3.82Å; Y498-L502 HydrophobicContact CE2-CG 3.7Å; Y498-L502 VanDerWaalsContact CZ-CD1 3.45Å; Y498-L502 WeakPolarHBondContact O-CG 3.37Å; Y498-L502 PolarHBondContact O-N 2.89Å
499	G	94.1	Very high	91	Very high	43 Å²	43	62.4 Å²	62.4	44%	0.443	31%	0.311	S	S	.	.	H	α-helix	trans	-61.9	-39.7	176.6	0	0	0	0	0	112.6	T497 L502 R503	T497-G499 PolarHBondContact O-N 3.08Å; G499-L502 PolarHBondContact O-N 3.49Å; G499-R503 WeakPolarHBondContact O-CB 3.32Å; G499-R503 PolarHBondContact O-N 3.47Å
500	E	94.8	Very high	89.5	Confident	58 Å²	58	67.1 Å²	67.1	27%	0.271	34%	0.335	S	S	.	.	H	α-helix	trans	-69.3	-40.6	175.8	-176.1	60.3	-169.9	0	0	111.7	L496 T497 Y498 L502 R503 L504	L496-E500 HydrophobicContact CD1-CB 4.5Å; L496-E500 HydrophobicContact CD1-CG 3.88Å; T497-E500 PolarHBondContact O-N 3.27Å; T497-E500 VanDerWaalsContact O-N 3.07Å; T497-E500 PolarHBondContact OG1-N 3.26Å; Y498-E500 VanDerWaalsContact C-N 3.32Å; Y498-E500 PolarHBondContact O-N 2.74Å; E500-L502 VanDerWaalsContact C-N 3.32Å; E500-L502 PolarHBondContact O-N 3.47Å; E500-R503 WeakPolarHBondContact O-CB 3.39Å; E500-R503 PolarHBondContact O-N 2.73Å; E500-R503 IonicContact OE1-CZ 3.31Å; E500-R503 IonicContact OE1-NE 2.77Å; E500-R503 PolarHBondContact OE1-NE 2.82Å; E500-R503 IonicContact OE1-NH2 3.19Å; E500-R503 PolarHBondContact OE1-NH2 3.26Å; E500-R503 IonicContact OE2-CZ 2.72Å; E500-R503 IonicContact OE2-NE 3.56Å; E500-R503 PolarHBondContact OE2-NE 3.45Å; E500-R503 IonicContact OE2-NH2 3.12Å; E500-L504 HydrophobicContact CG-CD1 4.46Å; E500-L504 VanDerWaalsContact O-CG 3.3Å; E500-L504 WeakPolarHBondContact O-CG 3.47Å; E500-L504 PolarHBondContact O-N 3.47Å
501	V	93.5	Very high	87.9	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-43.6	172.7	174.5	0	0	0	0	110.8	V470 Q474 L496 T497 Y498 L504 R505	V470-V501 HydrophobicContact CG1-CG1 4.36Å; Q474-V501 HydrophobicContact CG-CG2 3.76Å; L496-V501 HydrophobicContact CD1-CG2 4.33Å; L496-V501 HydrophobicContact CG-CG2 3.98Å; T497-V501 WeakPolarHBondContact O-CG2 3.44Å; T497-V501 PolarHBondContact O-N 2.99Å; Y498-V501 PolarHBondContact O-N 3.24Å; V501-L504 PolarHBondContact O-N 2.94Å; V501-R505 HydrophobicContact CG1-CG 4.44Å; V501-R505 WeakPolarHBondContact O-CB 3.49Å; V501-R505 WeakPolarHBondContact O-CG 3.47Å; V501-R505 PolarHBondContact O-N 3.03Å
502	L	90.6	Very high	86.2	Confident	69 Å²	69	68.8 Å²	68.8	36%	0.361	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-41.8	174.5	-74.6	-176.2	0	0	0	112.1	Y498 G499 E500 L504 R505 Q506	Y498-L502 HydrophobicContact CD1-CD1 4.14Å; Y498-L502 HydrophobicContact CD2-CG 4.17Å; Y498-L502 HydrophobicContact CE1-CD1 3.5Å; Y498-L502 HydrophobicContact CE1-CG 4.11Å; Y498-L502 HydrophobicContact CE2-CD1 4.02Å; Y498-L502 HydrophobicContact CE2-CD2 3.82Å; Y498-L502 HydrophobicContact CE2-CG 3.7Å; Y498-L502 VanDerWaalsContact CZ-CD1 3.45Å; Y498-L502 WeakPolarHBondContact O-CG 3.37Å; Y498-L502 PolarHBondContact O-N 2.89Å; G499-L502 PolarHBondContact O-N 3.49Å; E500-L502 VanDerWaalsContact C-N 3.32Å; E500-L502 PolarHBondContact O-N 3.47Å; L502-L504 VanDerWaalsContact C-N 3.34Å; L502-R505 PolarHBondContact O-N 3.03Å; L502-Q506 WeakPolarHBondContact O-CB 3.47Å; L502-Q506 PolarHBondContact O-N 3.09Å
503	R	91.1	Very high	84.5	Confident	118 Å²	118	68.6 Å²	68.6	45%	0.445	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-43.4	176.5	-169	-167.8	71.4	76.8	-0.2	111	G499 E500 Q506 T507	G499-R503 WeakPolarHBondContact O-CB 3.32Å; G499-R503 PolarHBondContact O-N 3.47Å; E500-R503 WeakPolarHBondContact O-CB 3.39Å; E500-R503 PolarHBondContact O-N 2.73Å; E500-R503 IonicContact OE1-CZ 3.31Å; E500-R503 IonicContact OE1-NE 2.77Å; E500-R503 PolarHBondContact OE1-NE 2.82Å; E500-R503 IonicContact OE1-NH2 3.19Å; E500-R503 PolarHBondContact OE1-NH2 3.26Å; E500-R503 IonicContact OE2-CZ 2.72Å; E500-R503 IonicContact OE2-NE 3.56Å; E500-R503 PolarHBondContact OE2-NE 3.45Å; E500-R503 IonicContact OE2-NH2 3.12Å; R503-Q506 PolarHBondContact O-N 3.46Å; R503-T507 WeakPolarHBondContact O-CB 3.3Å; R503-T507 PolarHBondContact O-N 2.99Å; R503-T507 PolarHBondContact O-OG1 3.17Å
504	L	88.3	Confident	82.7	Confident	37 Å²	37	70.6 Å²	70.6	19%	0.194	36%	0.363	C	S	.	.	H	α-helix	trans	-62.4	-50.4	175.3	-70	172.8	0	0	0	110.7	L496 E500 V501 L502 Q506 T507 E508	L496-L504 HydrophobicContact CD1-CD1 3.73Å; E500-L504 HydrophobicContact CG-CD1 4.46Å; E500-L504 VanDerWaalsContact O-CG 3.3Å; E500-L504 WeakPolarHBondContact O-CG 3.47Å; E500-L504 PolarHBondContact O-N 3.47Å; V501-L504 PolarHBondContact O-N 2.94Å; L502-L504 VanDerWaalsContact C-N 3.34Å; L504-Q506 VanDerWaalsContact C-N 3.31Å; L504-Q506 PolarHBondContact O-N 3.43Å; L504-T507 WeakPolarHBondContact O-CB 3.3Å; L504-T507 PolarHBondContact O-N 3.26Å; L504-T507 VanDerWaalsContact O-N 3.17Å; L504-E508 WeakPolarHBondContact O-CB 3.49Å; L504-E508 WeakPolarHBondContact O-CG 3.32Å; L504-E508 PolarHBondContact O-N 3.12Å
505	R	86.1	Confident	81.1	Confident	64 Å²	64	68.9 Å²	68.9	24%	0.242	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-39.7	175.5	-72.9	175.5	-178.8	-179.3	0.3	112.5	E473 V501 L502 E508 R509	E473-R505 IonicContact OE2-CZ 2.96Å; E473-R505 IonicContact OE2-NE 3.71Å; E473-R505 PolarHBondContact OE2-NE 3.49Å; E473-R505 IonicContact OE2-NH2 3Å; E473-R505 PolarHBondContact OE2-NH2 3.27Å; V501-R505 HydrophobicContact CG1-CG 4.44Å; V501-R505 WeakPolarHBondContact O-CB 3.49Å; V501-R505 WeakPolarHBondContact O-CG 3.47Å; V501-R505 PolarHBondContact O-N 3.03Å; L502-R505 PolarHBondContact O-N 3.03Å; R505-E508 PolarHBondContact O-N 3.06Å; R505-R509 VanDerWaalsContact O-CB 3.24Å; R505-R509 WeakPolarHBondContact O-CB 3.42Å; R505-R509 VanDerWaalsContact O-CG 3.23Å; R505-R509 WeakPolarHBondContact O-CG 3.42Å; R505-R509 PolarHBondContact O-N 3.43Å
506	Q	78.8	Confident	79.8	Confident	118 Å²	118	71 Å²	71	55%	0.551	36%	0.355	S	S	*	.	H	α-helix	trans	-69.4	-39.9	177.7	-175.9	179	9.3	0	0	110.9	L502 R503 L504 E508 R509 L510	L502-Q506 WeakPolarHBondContact O-CB 3.47Å; L502-Q506 PolarHBondContact O-N 3.09Å; R503-Q506 PolarHBondContact O-N 3.46Å; L504-Q506 VanDerWaalsContact C-N 3.31Å; L504-Q506 PolarHBondContact O-N 3.43Å; Q506-E508 VanDerWaalsContact C-N 3.35Å; Q506-R509 PolarHBondContact O-N 3.28Å; Q506-L510 HydrophobicContact CG-CD1 3.86Å; Q506-L510 HydrophobicContact CG-CG 4.16Å; Q506-L510 VanDerWaalsContact O-CB 3.28Å; Q506-L510 WeakPolarHBondContact O-CB 3.18Å; Q506-L510 VanDerWaalsContact O-CG 3.31Å; Q506-L510 WeakPolarHBondContact O-CG 3.29Å; Q506-L510 PolarHBondContact O-N 2.99Å
507	T	78.6	Confident	79	Confident	51 Å²	51	71.3 Å²	71.3	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-45.8	174.2	-55.4	0	0	0	0	109.8	R503 L504 R509 H511	R503-T507 WeakPolarHBondContact O-CB 3.3Å; R503-T507 PolarHBondContact O-N 2.99Å; R503-T507 PolarHBondContact O-OG1 3.17Å; L504-T507 WeakPolarHBondContact O-CB 3.3Å; L504-T507 PolarHBondContact O-N 3.26Å; L504-T507 VanDerWaalsContact O-N 3.17Å; T507-R509 PolarHBondContact O-N 3.22Å; T507-H511 VanDerWaalsContact O-CB 3.26Å; T507-H511 WeakPolarHBondContact O-CB 3.43Å; T507-H511 PolarHBondContact O-CD2 3.37Å; T507-H511 PolarHBondContact O-N 3.25Å
508	E	79.4	Confident	78.4	Confident	76 Å²	76	72.6 Å²	72.6	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-60.6	-42.2	174.9	-70.2	164.2	-177.5	0	0	111.5	R477 L504 R505 Q506 Q512	R477-E508 IonicContact CZ-OE1 3.79Å; R477-E508 IonicContact NH1-OE1 2.82Å; R477-E508 PolarHBondContact NH1-OE1 3.42Å; R477-E508 VanDerWaalsContact NH1-OE1 3.14Å; R477-E508 IonicContact NH2-OE1 2.66Å; R477-E508 PolarHBondContact NH2-OE1 2.75Å; R477-E508 IonicContact NH2-OE2 3.35Å; R477-E508 PolarHBondContact NH2-OE2 3.43Å; L504-E508 WeakPolarHBondContact O-CB 3.49Å; L504-E508 WeakPolarHBondContact O-CG 3.32Å; L504-E508 PolarHBondContact O-N 3.12Å; R505-E508 PolarHBondContact O-N 3.06Å; Q506-E508 VanDerWaalsContact C-N 3.35Å; E508-Q512 VanDerWaalsContact O-CG 3.3Å; E508-Q512 WeakPolarHBondContact O-CG 3.1Å; E508-Q512 PolarHBondContact O-N 3.45Å
509	R	71.2	Confident	77.8	Confident	148 Å²	148	71.9 Å²	71.9	56%	0.558	37%	0.373	S	S	*	.	H	α-helix	trans	-72.2	-44.6	177.4	-79.6	-178.4	61	-169.2	-5.3	114.3	R505 Q506 T507 H511 Q512 E513	R505-R509 VanDerWaalsContact O-CB 3.24Å; R505-R509 WeakPolarHBondContact O-CB 3.42Å; R505-R509 VanDerWaalsContact O-CG 3.23Å; R505-R509 WeakPolarHBondContact O-CG 3.42Å; R505-R509 PolarHBondContact O-N 3.43Å; Q506-R509 PolarHBondContact O-N 3.28Å; T507-R509 PolarHBondContact O-N 3.22Å; R509-H511 PolarHBondContact O-N 3.25Å; R509-Q512 CarbonylContact O-C 3.56Å; R509-Q512 WeakPolarHBondContact O-CA 3.49Å; R509-Q512 WeakPolarHBondContact O-CB 3.45Å; R509-Q512 PolarHBondContact O-N 3.42Å; R509-E513 IonicContact CZ-OE1 3.8Å; R509-E513 IonicContact NE-OE1 3.97Å; R509-E513 IonicContact NH2-OE1 3.37Å; R509-E513 PolarHBondContact NH2-OE1 2.81Å; R509-E513 WeakPolarHBondContact O-CB 3.46Å; R509-E513 PolarHBondContact O-N 3.25Å
510	L	64.6	Low	77.3	Confident	98 Å²	98	70.1 Å²	70.1	51%	0.513	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-36.4	176.2	-77	171.3	0	0	0	110.3	Q506 G514	Q506-L510 HydrophobicContact CG-CD1 3.86Å; Q506-L510 HydrophobicContact CG-CG 4.16Å; Q506-L510 VanDerWaalsContact O-CB 3.28Å; Q506-L510 WeakPolarHBondContact O-CB 3.18Å; Q506-L510 VanDerWaalsContact O-CG 3.31Å; Q506-L510 WeakPolarHBondContact O-CG 3.29Å; Q506-L510 PolarHBondContact O-N 2.99Å; L510-G514 PolarHBondContact O-N 3.17Å
511	H	63.3	Low	76.9	Confident	79 Å²	79	70.6 Å²	70.6	37%	0.366	36%	0.357	S	S	.	.	H	α-helix	trans	-59.6	-49.2	166.8	-73.4	-31.7	0	0	0	110.6	T507 R509 T515 K684	T507-H511 VanDerWaalsContact O-CB 3.26Å; T507-H511 WeakPolarHBondContact O-CB 3.43Å; T507-H511 PolarHBondContact O-CD2 3.37Å; T507-H511 PolarHBondContact O-N 3.25Å; R509-H511 PolarHBondContact O-N 3.25Å; H511-T515 WeakPolarHBondContact O-CB 3.1Å; H511-T515 PolarHBondContact O-N 2.88Å; H511-T515 VanDerWaalsContact O-N 3.14Å; H511-T515 PolarHBondContact O-OG1 3.19Å; H511-K684 WeakPolarHBondContact CE1-CE 3.5Å; H511-K684 PolarHBondContact CE1-NZ 3.11Å; H511-K684 WeakPolarHBondContact ND1-CE 3.48Å; H511-K684 PolarHBondContact ND1-NZ 2.62Å; H511-K684 PolarHBondContact NE2-NZ 2.85Å; H511-K684 VanDerWaalsContact NE2-NZ 3.15Å
512	Q	61.8	Low	76.6	Confident	126 Å²	126	76.3 Å²	76.3	59%	0.589	38%	0.384	S	S	*	.	H	α-helix	trans	-62.2	-49.8	176.6	-72.7	170.5	2.1	0	0	114.1	E508 R509 T515 L516	E508-Q512 VanDerWaalsContact O-CG 3.3Å; E508-Q512 WeakPolarHBondContact O-CG 3.1Å; E508-Q512 PolarHBondContact O-N 3.45Å; R509-Q512 CarbonylContact O-C 3.56Å; R509-Q512 WeakPolarHBondContact O-CA 3.49Å; R509-Q512 WeakPolarHBondContact O-CB 3.45Å; R509-Q512 PolarHBondContact O-N 3.42Å; Q512-T515 WeakPolarHBondContact O-CB 3.39Å; Q512-T515 PolarHBondContact O-N 3.44Å; Q512-T515 VanDerWaalsContact O-N 3.11Å; Q512-L516 WeakPolarHBondContact O-CD1 3.39Å; Q512-L516 VanDerWaalsContact O-CG 3.22Å; Q512-L516 WeakPolarHBondContact O-CG 3.45Å; Q512-L516 PolarHBondContact O-N 2.85Å
513	E	60.3	Low	76.5	Confident	103 Å²	103	75.4 Å²	75.4	48%	0.481	38%	0.379	S	S	.	.	H	α-helix	trans	-66	-44.9	-176.6	-72.6	172.4	-166.2	0	0	112	R509 T515 L516	R509-E513 IonicContact CZ-OE1 3.8Å; R509-E513 IonicContact NE-OE1 3.97Å; R509-E513 IonicContact NH2-OE1 3.37Å; R509-E513 PolarHBondContact NH2-OE1 2.81Å; R509-E513 WeakPolarHBondContact O-CB 3.46Å; R509-E513 PolarHBondContact O-N 3.25Å; E513-T515 PolarHBondContact O-N 2.69Å; E513-L516 PolarHBondContact O-N 3.36Å; E513-L516 VanDerWaalsContact O-N 3.12Å
514	G	59.9	Low	76.5	Confident	42 Å²	42	70.4 Å²	70.4	43%	0.433	36%	0.36	S	S	.	.	H	α-helix	trans	-64.1	-24.1	172.7	0	0	0	0	0	112.7	L510 L516 I520	L510-G514 PolarHBondContact O-N 3.17Å; G514-L516 VanDerWaalsContact C-N 3.32Å; G514-I520 WeakPolarHBondContact O-CD1 3.34Å
515	T	62.5	Low	76.7	Confident	21 Å²	21	73.8 Å²	73.8	13%	0.129	38%	0.375	C	S	.	.	H	α-helix	trans	-80	-13.7	177.1	-60.7	0	0	0	0	113.3	H511 Q512 E513 L521	H511-T515 WeakPolarHBondContact O-CB 3.1Å; H511-T515 PolarHBondContact O-N 2.88Å; H511-T515 VanDerWaalsContact O-N 3.14Å; H511-T515 PolarHBondContact O-OG1 3.19Å; Q512-T515 WeakPolarHBondContact O-CB 3.39Å; Q512-T515 PolarHBondContact O-N 3.44Å; Q512-T515 VanDerWaalsContact O-N 3.11Å; E513-T515 PolarHBondContact O-N 2.69Å; T515-L521 WeakPolarHBondContact O-CD2 3.36Å
516	L	69.1	Low	77	Confident	113 Å²	113	78.3 Å²	78.3	59%	0.592	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-1.9	-174	-69.8	167.4	0	0	0	114.4	Q512 E513 G514 L521	Q512-L516 WeakPolarHBondContact O-CD1 3.39Å; Q512-L516 VanDerWaalsContact O-CG 3.22Å; Q512-L516 WeakPolarHBondContact O-CG 3.45Å; Q512-L516 PolarHBondContact O-N 2.85Å; E513-L516 PolarHBondContact O-N 3.36Å; E513-L516 VanDerWaalsContact O-N 3.12Å; G514-L516 VanDerWaalsContact C-N 3.32Å; L516-L521 HydrophobicContact CD2-CD2 4.39Å; L516-L521 VanDerWaalsContact O-CD1 3.31Å; L516-L521 WeakPolarHBondContact O-CD1 3.38Å
517	A	78.4	Confident	77.7	Confident	30 Å²	30	73.3 Å²	73.3	25%	0.248	37%	0.374	C	S	.	.	S	Bend	trans	-62.6	138.6	175.4	0	0	0	0	0	110.5	I520 L521	A517-I520 HydrophobicContact CB-CB 4.34Å; A517-I520 HydrophobicContact CB-CD1 4.14Å; A517-I520 HydrophobicContact CB-CG1 4.34Å; A517-I520 WeakPolarHBondContact O-CA 3.29Å; A517-I520 WeakPolarHBondContact O-CB 3.3Å; A517-I520 PolarHBondContact O-N 3.28Å; A517-L521 PolarHBondContact O-N 2.91Å
518	P	83.3	Confident	78.4	Confident	71 Å²	71	73.7 Å²	73.7	46%	0.461	37%	0.371	S	S	.	.	H	α-helix	trans	-53.2	-44.7	-174.4	-23.5	30.6	0	0	0	114.8	I520 L521 E522	P518-I520 VanDerWaalsContact C-N 3.27Å; P518-I520 PolarHBondContact O-N 3.39Å; P518-L521 PolarHBondContact O-N 2.86Å; P518-E522 WeakPolarHBondContact O-CG 3.36Å; P518-E522 PolarHBondContact O-N 3.16Å
519	P	84.9	Confident	79.1	Confident	44 Å²	44	74.3 Å²	74.3	29%	0.286	38%	0.382	S	S	.	.	H	α-helix	trans	-63.7	-31.6	176.7	-22.1	34.3	0	0	0	113.5	L523 I695 P696	P519-L523 WeakPolarHBondContact O-CB 3.35Å; P519-L523 PolarHBondContact O-N 3.45Å; P519-I695 HydrophobicContact CB-CG2 4.28Å; P519-I695 HydrophobicContact CG-CG2 4.11Å; P519-P696 WeakPolarHBondContact CG-O 3.05Å
520	I	83.5	Confident	80.3	Confident	7 Å²	7	73.1 Å²	73.1	4%	0.036	38%	0.383	C	S	.	.	H	α-helix	trans	-75.4	-38.8	177.9	-67.8	175.5	0	0	0	110.5	G514 A517 P518 L523 R524 T683 L687 I695	G514-I520 WeakPolarHBondContact O-CD1 3.34Å; A517-I520 HydrophobicContact CB-CB 4.34Å; A517-I520 HydrophobicContact CB-CD1 4.14Å; A517-I520 HydrophobicContact CB-CG1 4.34Å; A517-I520 WeakPolarHBondContact O-CA 3.29Å; A517-I520 WeakPolarHBondContact O-CB 3.3Å; A517-I520 PolarHBondContact O-N 3.28Å; P518-I520 VanDerWaalsContact C-N 3.27Å; P518-I520 PolarHBondContact O-N 3.39Å; I520-L523 PolarHBondContact O-N 3.49Å; I520-R524 HydrophobicContact CG2-CG 4.43Å; I520-R524 WeakPolarHBondContact O-CB 3.3Å; I520-R524 VanDerWaalsContact O-CG 3.26Å; I520-R524 WeakPolarHBondContact O-CG 3.47Å; I520-R524 PolarHBondContact O-N 3.27Å; I520-T683 HydrophobicContact CG2-CG2 3.61Å; I520-L687 HydrophobicContact CD1-CD1 3.65Å; I520-L687 HydrophobicContact CD1-CD2 4.42Å; I520-L687 HydrophobicContact CG1-CD1 4.22Å; I520-L687 HydrophobicContact CG1-CD2 4.47Å; I520-I695 HydrophobicContact CD1-CD1 3.55Å; I520-I695 HydrophobicContact CG1-CD1 4.22Å
521	L	86	Confident	81.7	Confident	67 Å²	67	68.9 Å²	68.9	35%	0.351	36%	0.36	S	S	.	.	H	α-helix	trans	-62.2	-44.4	172.6	-69.8	176.6	0	0	0	111.3	T515 L516 A517 P518 L523 R524 E525	T515-L521 WeakPolarHBondContact O-CD2 3.36Å; L516-L521 HydrophobicContact CD2-CD2 4.39Å; L516-L521 VanDerWaalsContact O-CD1 3.31Å; L516-L521 WeakPolarHBondContact O-CD1 3.38Å; A517-L521 PolarHBondContact O-N 2.91Å; P518-L521 PolarHBondContact O-N 2.86Å; L521-L523 VanDerWaalsContact C-N 3.34Å; L521-L523 PolarHBondContact O-N 3.27Å; L521-R524 PolarHBondContact O-N 3.33Å; L521-E525 WeakPolarHBondContact O-CG 3.44Å; L521-E525 PolarHBondContact O-N 3.47Å
522	E	87.8	Confident	83.2	Confident	121 Å²	121	68.1 Å²	68.1	57%	0.565	36%	0.359	S	S	*	.	H	α-helix	trans	-59.5	-43.3	174.2	-74	-178.3	-159.2	0	0	112.2	P518 E525 K526	P518-E522 WeakPolarHBondContact O-CG 3.36Å; P518-E522 PolarHBondContact O-N 3.16Å; E522-E525 PolarHBondContact O-N 2.93Å; E522-K526 WeakPolarHBondContact O-CG 3.03Å; E522-K526 PolarHBondContact O-N 3.12Å; E522-K526 VanDerWaalsContact O-N 3.12Å
523	L	88.5	Confident	84.9	Confident	50 Å²	50	63.9 Å²	63.9	26%	0.262	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-45.8	174.4	177.8	61.8	0	0	0	111	P519 I520 L521 E525 K526 L527 R686	P519-L523 WeakPolarHBondContact O-CB 3.35Å; P519-L523 PolarHBondContact O-N 3.45Å; I520-L523 PolarHBondContact O-N 3.49Å; L521-L523 VanDerWaalsContact C-N 3.34Å; L521-L523 PolarHBondContact O-N 3.27Å; L523-E525 PolarHBondContact O-N 2.73Å; L523-K526 PolarHBondContact O-N 3.38Å; L523-K526 VanDerWaalsContact O-N 3.16Å; L523-L527 HydrophobicContact CD1-CD1 4.05Å; L523-L527 HydrophobicContact CD1-CG 4.15Å; L523-L527 HydrophobicContact CG-CD1 3.87Å; L523-L527 HydrophobicContact CG-CG 4.38Å; L523-L527 VanDerWaalsContact O-CG 3.31Å; L523-L527 WeakPolarHBondContact O-CG 3.42Å; L523-L527 PolarHBondContact O-N 2.9Å; L523-R686 HydrophobicContact CD2-CB 4.06Å; L523-R686 HydrophobicContact CD2-CG 4.42Å
524	R	90.2	Very high	86.6	Confident	12 Å²	12	63 Å²	63	5%	0.045	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-43.4	178.5	-73.8	174.3	74.8	102.9	-6.5	112	I520 L521 K526 L527 K528 E676 L679 T683	I520-R524 HydrophobicContact CG2-CG 4.43Å; I520-R524 WeakPolarHBondContact O-CB 3.3Å; I520-R524 VanDerWaalsContact O-CG 3.26Å; I520-R524 WeakPolarHBondContact O-CG 3.47Å; I520-R524 PolarHBondContact O-N 3.27Å; L521-R524 PolarHBondContact O-N 3.33Å; R524-K526 VanDerWaalsContact C-N 3.29Å; R524-K526 PolarHBondContact O-N 2.9Å; R524-L527 PolarHBondContact O-N 2.96Å; R524-K528 WeakPolarHBondContact O-CG 3.35Å; R524-K528 PolarHBondContact O-N 3.12Å; R524-E676 IonicContact CZ-OE1 3.46Å; R524-E676 IonicContact NH2-OE1 2.81Å; R524-E676 PolarHBondContact NH2-OE1 2.9Å; R524-E676 IonicContact NH2-OE2 3.22Å; R524-E676 PolarHBondContact NH2-OE2 3.08Å; R524-L679 HydrophobicContact CB-CD2 4.09Å; R524-L679 HydrophobicContact CG-CD2 4.27Å; R524-L679 WeakPolarHBondContact O-CD2 3.45Å; R524-T683 WeakPolarHBondContact CG-OG1 3.17Å
525	E	92.4	Very high	88.3	Confident	108 Å²	108	61.3 Å²	61.3	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-60.6	-38	174.8	-67.6	-49.5	136.3	0	0	112.3	L521 E522 L523 K528 P529	L521-E525 WeakPolarHBondContact O-CG 3.44Å; L521-E525 PolarHBondContact O-N 3.47Å; E522-E525 PolarHBondContact O-N 2.93Å; L523-E525 PolarHBondContact O-N 2.73Å; E525-K528 WeakPolarHBondContact OE1-CE 3.09Å; E525-K528 IonicContact OE1-NZ 2.91Å; E525-K528 PolarHBondContact OE1-NZ 3.44Å; E525-K528 WeakPolarHBondContact OE2-CD 3.43Å; E525-K528 WeakPolarHBondContact OE2-CE 3.47Å; E525-K528 IonicContact OE2-NZ 3.53Å; E525-K528 PolarHBondContact OE2-NZ 2.93Å; E525-P529 WeakPolarHBondContact O-CD 3.28Å
526	K	92.8	Very high	89.9	Confident	160 Å²	160	65.8 Å²	65.8	70%	0.696	34%	0.342	S	S	*	.	H	α-helix	trans	-69.1	-34.9	176.2	-71.6	175.8	-175.8	172	0	113	E522 L523 R524 P529	E522-K526 WeakPolarHBondContact O-CG 3.03Å; E522-K526 PolarHBondContact O-N 3.12Å; E522-K526 VanDerWaalsContact O-N 3.12Å; L523-K526 PolarHBondContact O-N 3.38Å; L523-K526 VanDerWaalsContact O-N 3.16Å; R524-K526 VanDerWaalsContact C-N 3.29Å; R524-K526 PolarHBondContact O-N 2.9Å; K526-P529 WeakPolarHBondContact O-CD 3.31Å
527	L	92.9	Very high	91.2	Very high	13 Å²	13	66.1 Å²	66.1	7%	0.068	34%	0.341	C	S	.	.	H	α-helix	trans	-78.4	-28.4	179.6	-68	172.2	0	0	0	113.2	L523 R524 E530 L531 L679 E682	L523-L527 HydrophobicContact CD1-CD1 4.05Å; L523-L527 HydrophobicContact CD1-CG 4.15Å; L523-L527 HydrophobicContact CG-CD1 3.87Å; L523-L527 HydrophobicContact CG-CG 4.38Å; L523-L527 VanDerWaalsContact O-CG 3.31Å; L523-L527 WeakPolarHBondContact O-CG 3.42Å; L523-L527 PolarHBondContact O-N 2.9Å; R524-L527 PolarHBondContact O-N 2.96Å; L527-E530 PolarHBondContact O-N 2.66Å; L527-L531 HydrophobicContact CB-CD1 4.23Å; L527-L531 WeakPolarHBondContact O-CG 3.42Å; L527-L531 PolarHBondContact O-N 3.48Å; L527-L531 VanDerWaalsContact O-N 3.1Å; L527-L679 HydrophobicContact CB-CD2 4.07Å; L527-E682 HydrophobicContact CD1-CB 4.32Å; L527-E682 HydrophobicContact CD1-CG 3.73Å; L527-E682 HydrophobicContact CD2-CG 4.04Å; L527-E682 HydrophobicContact CG-CG 4.45Å
528	K	93.6	Very high	92	Very high	59 Å²	59	68.1 Å²	68.1	26%	0.257	35%	0.345	S	S	.	.	H	α-helix	trans	-48.2	-48.8	-175.9	-88.7	177.9	-169	178.5	0	114.8	R524 E525 E530 L531 L532 L679	R524-K528 WeakPolarHBondContact O-CG 3.35Å; R524-K528 PolarHBondContact O-N 3.12Å; E525-K528 WeakPolarHBondContact OE1-CE 3.09Å; E525-K528 IonicContact OE1-NZ 2.91Å; E525-K528 PolarHBondContact OE1-NZ 3.44Å; E525-K528 WeakPolarHBondContact OE2-CD 3.43Å; E525-K528 WeakPolarHBondContact OE2-CE 3.47Å; E525-K528 IonicContact OE2-NZ 3.53Å; E525-K528 PolarHBondContact OE2-NZ 2.93Å; K528-E530 PolarHBondContact O-N 3.15Å; K528-L531 PolarHBondContact O-N 3.02Å; K528-L532 VanDerWaalsContact O-CB 3.3Å; K528-L532 WeakPolarHBondContact O-CB 3.32Å; K528-L532 WeakPolarHBondContact O-CG 3.45Å; K528-L532 PolarHBondContact O-N 3.34Å; K528-L679 HydrophobicContact CG-CD1 3.9Å; K528-L679 HydrophobicContact CG-CD2 4.02Å
529	P	94.9	Very high	92.7	Very high	89 Å²	89	64.8 Å²	64.8	58%	0.578	32%	0.323	S	S	*	.	H	α-helix	trans	-63.2	-40	-176.9	-22.8	34.5	0	0	0	113	E525 K526 G533	E525-P529 WeakPolarHBondContact O-CD 3.28Å; K526-P529 WeakPolarHBondContact O-CD 3.31Å; P529-G533 PolarHBondContact O-N 2.96Å
530	E	95.1	Very high	93.2	Very high	123 Å²	123	63.7 Å²	63.7	58%	0.575	32%	0.315	S	S	*	.	H	α-helix	trans	-65.8	-48.2	178.3	-177.1	-178.9	174.2	0	0	110.8	L527 K528 L532 G533 L534	L527-E530 PolarHBondContact O-N 2.66Å; K528-E530 PolarHBondContact O-N 3.15Å; E530-L532 PolarHBondContact O-N 2.87Å; E530-G533 CarbonylContact O-C 3.56Å; E530-G533 WeakPolarHBondContact O-CA 3.4Å; E530-G533 PolarHBondContact O-N 3.26Å; E530-L534 PolarHBondContact O-N 3.4Å
531	L	95.4	Very high	93.7	Very high	9 Å²	9	67.8 Å²	67.8	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-66.9	-36.7	179.7	-61.7	-179.8	0	0	0	112.4	L527 K528 G533 L534 I535 L675 L678 L679 E682	L527-L531 HydrophobicContact CB-CD1 4.23Å; L527-L531 WeakPolarHBondContact O-CG 3.42Å; L527-L531 PolarHBondContact O-N 3.48Å; L527-L531 VanDerWaalsContact O-N 3.1Å; K528-L531 PolarHBondContact O-N 3.02Å; L531-G533 VanDerWaalsContact C-N 3.27Å; L531-G533 PolarHBondContact O-N 3.48Å; L531-L534 HydrophobicContact CD2-CD1 3.95Å; L531-L534 WeakPolarHBondContact O-CB 3.38Å; L531-L534 PolarHBondContact O-N 2.88Å; L531-I535 WeakPolarHBondContact O-CG1 3.41Å; L531-I535 PolarHBondContact O-N 2.76Å; L531-L675 HydrophobicContact CB-CD1 3.98Å; L531-L678 HydrophobicContact CD1-CB 4.06Å; L531-L678 HydrophobicContact CD2-CB 4.27Å; L531-L679 HydrophobicContact CD1-CB 4.31Å; L531-L679 HydrophobicContact CD1-CD2 3.58Å; L531-L679 HydrophobicContact CD1-CG 3.77Å; L531-E682 HydrophobicContact CD1-CB 4.4Å
532	L	94.8	Very high	94.1	Very high	63 Å²	63	68 Å²	68	33%	0.33	33%	0.332	S	S	.	.	H	α-helix	trans	-63.3	-35.1	169.8	-80.3	172.1	0	0	0	111.7	K528 E530 I535 R536 M666 T671 L675	K528-L532 VanDerWaalsContact O-CB 3.3Å; K528-L532 WeakPolarHBondContact O-CB 3.32Å; K528-L532 WeakPolarHBondContact O-CG 3.45Å; K528-L532 PolarHBondContact O-N 3.34Å; E530-L532 PolarHBondContact O-N 2.87Å; L532-I535 PolarHBondContact O-N 3.5Å; L532-R536 VanDerWaalsContact O-CB 3.26Å; L532-R536 WeakPolarHBondContact O-CB 3.22Å; L532-R536 PolarHBondContact O-N 3.25Å; L532-M666 HydrophobicContact CD2-CE 4.31Å; L532-T671 HydrophobicContact CD2-CG2 4.25Å; L532-L675 HydrophobicContact CD1-CD2 4.49Å; L532-L675 HydrophobicContact CD2-CD1 4.27Å; L532-L675 HydrophobicContact CD2-CD2 3.98Å; L532-L675 HydrophobicContact CG-CD1 4.02Å; L532-L675 HydrophobicContact CG-CD2 4.15Å
533	G	95.7	Very high	94.5	Very high	37 Å²	37	62.2 Å²	62.2	38%	0.381	31%	0.306	S	S	.	.	H	α-helix	trans	-60.5	-42.7	171.2	0	0	0	0	0	112.6	P529 E530 L531 R536 Q537	P529-G533 PolarHBondContact O-N 2.96Å; E530-G533 CarbonylContact O-C 3.56Å; E530-G533 WeakPolarHBondContact O-CA 3.4Å; E530-G533 PolarHBondContact O-N 3.26Å; L531-G533 VanDerWaalsContact C-N 3.27Å; L531-G533 PolarHBondContact O-N 3.48Å; G533-R536 WeakPolarHBondContact O-CB 3.46Å; G533-R536 PolarHBondContact O-N 3.41Å; G533-Q537 PolarHBondContact O-N 2.88Å
534	L	96.4	Very high	94.7	Very high	85 Å²	85	61.1 Å²	61.1	45%	0.445	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-46.2	174.7	-69	172	0	0	0	112.1	E530 L531 R536 Q537 Q538	E530-L534 PolarHBondContact O-N 3.4Å; L531-L534 HydrophobicContact CD2-CD1 3.95Å; L531-L534 WeakPolarHBondContact O-CB 3.38Å; L531-L534 PolarHBondContact O-N 2.88Å; L534-R536 VanDerWaalsContact C-N 3.29Å; L534-R536 PolarHBondContact O-N 3.02Å; L534-Q537 PolarHBondContact O-N 3.3Å; L534-Q538 PolarHBondContact O-N 2.86Å
535	I	96.4	Very high	94.8	Very high	5 Å²	5	66 Å²	66	3%	0.026	33%	0.325	C	S	.	.	H	α-helix	trans	-59.6	-45.1	175.5	-65.7	167.6	0	0	0	109.5	L531 L532 Q537 Q538 R539 M666 T671 D674 L675 L678	L531-I535 WeakPolarHBondContact O-CG1 3.41Å; L531-I535 PolarHBondContact O-N 2.76Å; L532-I535 PolarHBondContact O-N 3.5Å; I535-Q537 VanDerWaalsContact C-N 3.33Å; I535-Q537 PolarHBondContact O-N 2.92Å; I535-Q538 WeakPolarHBondContact O-CB 3.34Å; I535-Q538 PolarHBondContact O-N 3.23Å; I535-Q538 VanDerWaalsContact O-N 3.14Å; I535-R539 HydrophobicContact CG2-CG 4.24Å; I535-R539 WeakPolarHBondContact O-CG 3.37Å; I535-R539 PolarHBondContact O-N 3.12Å; I535-M666 HydrophobicContact CB-CE 4.22Å; I535-M666 HydrophobicContact CG2-CE 3.84Å; I535-M666 HydrophobicContact CG2-SD 4.27Å; I535-T671 HydrophobicContact CG2-CG2 4.38Å; I535-D674 HydrophobicContact CD1-CB 3.95Å; I535-D674 HydrophobicContact CG1-CB 4.28Å; I535-L675 HydrophobicContact CD1-CB 3.76Å; I535-L675 HydrophobicContact CD1-CD1 4.29Å; I535-L678 HydrophobicContact CD1-CD1 4.1Å; I535-L678 HydrophobicContact CG1-CD1 3.76Å
536	R	96.8	Very high	94.6	Very high	116 Å²	116	61.5 Å²	61.5	44%	0.438	31%	0.307	S	S	.	.	H	α-helix	trans	-56.3	-47.6	177.2	-172.2	-173.1	-179	-178.2	1.2	111.4	L532 G533 L534 Q538 R539 L540 A660 M666	L532-R536 VanDerWaalsContact O-CB 3.26Å; L532-R536 WeakPolarHBondContact O-CB 3.22Å; L532-R536 PolarHBondContact O-N 3.25Å; G533-R536 WeakPolarHBondContact O-CB 3.46Å; G533-R536 PolarHBondContact O-N 3.41Å; L534-R536 VanDerWaalsContact C-N 3.29Å; L534-R536 PolarHBondContact O-N 3.02Å; R536-Q538 VanDerWaalsContact C-N 3.33Å; R536-Q538 PolarHBondContact O-N 3.33Å; R536-R539 PolarHBondContact O-N 3.18Å; R536-L540 HydrophobicContact CG-CD1 4.46Å; R536-L540 WeakPolarHBondContact O-CG 3.4Å; R536-L540 PolarHBondContact O-N 2.96Å; R536-A660 HydrophobicContact CG-CB 3.71Å; R536-A660 PolarHBondContact NE-O 3.45Å; R536-A660 PolarHBondContact NH2-O 3.44Å; R536-M666 HydrophobicContact CB-CE 4.03Å; R536-M666 HydrophobicContact CB-SD 4.47Å
537	Q	95.7	Very high	94.5	Very high	119 Å²	119	55.4 Å²	55.4	56%	0.556	28%	0.282	S	S	*	.	H	α-helix	trans	-61.2	-43.5	177.6	-173.8	178.1	6.1	0	0	111.4	G533 L534 I535 R539 L540 L541	G533-Q537 PolarHBondContact O-N 2.88Å; L534-Q537 PolarHBondContact O-N 3.3Å; I535-Q537 VanDerWaalsContact C-N 3.33Å; I535-Q537 PolarHBondContact O-N 2.92Å; Q537-R539 PolarHBondContact O-N 2.8Å; Q537-L540 PolarHBondContact O-N 3.47Å; Q537-L541 HydrophobicContact CG-CD1 4.42Å; Q537-L541 WeakPolarHBondContact O-CG 3.3Å; Q537-L541 PolarHBondContact O-N 3.1Å
538	Q	95.9	Very high	94.2	Very high	72 Å²	72	57.9 Å²	57.9	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176.5	-173.6	-82.5	-13.3	0	0	111.9	L534 I535 R536 L541 R542	L534-Q538 PolarHBondContact O-N 2.86Å; I535-Q538 WeakPolarHBondContact O-CB 3.34Å; I535-Q538 PolarHBondContact O-N 3.23Å; I535-Q538 VanDerWaalsContact O-N 3.14Å; R536-Q538 VanDerWaalsContact C-N 3.33Å; R536-Q538 PolarHBondContact O-N 3.33Å; Q538-L541 PolarHBondContact O-N 2.98Å; Q538-R542 VanDerWaalsContact NE2-CG 3.3Å; Q538-R542 WeakPolarHBondContact O-CG 3.21Å; Q538-R542 PolarHBondContact O-N 3.14Å
539	R	96.3	Very high	93.8	Very high	1 Å²	1	55.1 Å²	55.1	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-41.4	177.5	-64.2	-60.9	-172.5	-95.5	-3.3	112	I535 R536 Q537 R542 L543 D656 M666 T671 D674	I535-R539 HydrophobicContact CG2-CG 4.24Å; I535-R539 WeakPolarHBondContact O-CG 3.37Å; I535-R539 PolarHBondContact O-N 3.12Å; R536-R539 PolarHBondContact O-N 3.18Å; Q537-R539 PolarHBondContact O-N 2.8Å; R539-R542 WeakPolarHBondContact O-CB 3.33Å; R539-R542 PolarHBondContact O-N 3.26Å; R539-L543 PolarHBondContact O-N 3.45Å; R539-D656 HydrophobicContact CG-CB 4.23Å; R539-D656 IonicContact NE-OD2 3.37Å; R539-D656 IonicContact NH2-OD2 2.8Å; R539-M666 HydrophobicContact CB-SD 4.5Å; R539-M666 HydrophobicContact CG-SD 3.88Å; R539-T671 PolarHBondContact NH2-OG1 3.47Å; R539-D674 IonicContact CZ-OD2 2.68Å; R539-D674 VanDerWaalsContact CZ-OD2 3.23Å; R539-D674 IonicContact NH1-OD2 3.26Å; R539-D674 PolarHBondContact NH1-OD2 2.98Å; R539-D674 IonicContact NH2-OD2 3.42Å; R539-D674 PolarHBondContact NH2-OD2 3.16Å
540	L	95.7	Very high	93	Very high	22 Å²	22	53.3 Å²	53.3	12%	0.115	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-42.9	174.7	-69	172.5	0	0	0	111.5	R536 Q537 R542 L543 C544 L566 L661	R536-L540 HydrophobicContact CG-CD1 4.46Å; R536-L540 WeakPolarHBondContact O-CG 3.4Å; R536-L540 PolarHBondContact O-N 2.96Å; Q537-L540 PolarHBondContact O-N 3.47Å; L540-R542 VanDerWaalsContact C-N 3.31Å; L540-R542 PolarHBondContact O-N 2.99Å; L540-L543 WeakPolarHBondContact O-CB 3.49Å; L540-L543 PolarHBondContact O-N 3.31Å; L540-C544 PolarHBondContact O-N 3.11Å; L540-C544 PolarHBondContact O-SG 2.85Å; L540-L566 HydrophobicContact CD2-CD2 4.32Å; L540-L661 HydrophobicContact CD2-CB 4.11Å; L540-L661 HydrophobicContact CD2-CD1 4.02Å
541	L	95.3	Very high	92	Very high	92 Å²	92	51 Å²	51	48%	0.482	25%	0.252	S	S	.	.	H	α-helix	trans	-60.3	-40.1	174.1	-71	171.8	0	0	0	111.9	Q537 Q538 L543 C544 E545	Q537-L541 HydrophobicContact CG-CD1 4.42Å; Q537-L541 WeakPolarHBondContact O-CG 3.3Å; Q537-L541 PolarHBondContact O-N 3.1Å; Q538-L541 PolarHBondContact O-N 2.98Å; L541-L543 VanDerWaalsContact C-N 3.35Å; L541-L543 PolarHBondContact O-N 3.09Å; L541-C544 CarbonylContact O-C 3.56Å; L541-C544 WeakPolarHBondContact O-CB 3.45Å; L541-C544 PolarHBondContact O-N 3.15Å; L541-C544 VanDerWaalsContact O-N 3.11Å; L541-E545 WeakPolarHBondContact O-CG 3.44Å; L541-E545 PolarHBondContact O-N 2.7Å
542	R	93.5	Very high	90.7	Very high	71 Å²	71	53.2 Å²	53.2	27%	0.268	26%	0.264	S	S	.	.	H	α-helix	trans	-63.3	-38	174.9	-72.6	-61.9	-60.1	172.5	-2.1	113.1	Q538 R539 L540 C544 E545 G546	Q538-R542 VanDerWaalsContact NE2-CG 3.3Å; Q538-R542 WeakPolarHBondContact O-CG 3.21Å; Q538-R542 PolarHBondContact O-N 3.14Å; R539-R542 WeakPolarHBondContact O-CB 3.33Å; R539-R542 PolarHBondContact O-N 3.26Å; L540-R542 VanDerWaalsContact C-N 3.31Å; L540-R542 PolarHBondContact O-N 2.99Å; R542-C544 VanDerWaalsContact C-N 3.32Å; R542-E545 WeakPolarHBondContact CD-OE2 3.38Å; R542-E545 IonicContact CZ-OE2 2.74Å; R542-E545 IonicContact NE-OE2 2.73Å; R542-E545 IonicContact NH1-OE2 3.64Å; R542-E545 PolarHBondContact NH1-OE2 3.04Å; R542-G546 PolarHBondContact O-N 3.48Å
543	L	95.4	Very high	88.8	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-39.2	171.6	-66	-174.5	0	0	0	111.3	R539 L540 L541 G546 C565 L566 W654 L658 L661	R539-L543 PolarHBondContact O-N 3.45Å; L540-L543 WeakPolarHBondContact O-CB 3.49Å; L540-L543 PolarHBondContact O-N 3.31Å; L541-L543 VanDerWaalsContact C-N 3.35Å; L541-L543 PolarHBondContact O-N 3.09Å; L543-G546 PolarHBondContact O-N 3.46Å; L543-C565 CarbonylContact O-C 3.13Å; L543-C565 WeakPolarHBondContact O-CA 3.47Å; L543-L566 HydrophobicContact CB-CB 3.72Å; L543-L566 HydrophobicContact CB-CD2 3.98Å; L543-L566 HydrophobicContact CD1-CD2 4.13Å; L543-L566 PolarHBondContact O-N 3.44Å; L543-W654 HydrophobicContact CD2-CD2 3.59Å; L543-W654 HydrophobicContact CD2-CE3 3.35Å; L543-W654 HydrophobicContact CD2-CG 4.24Å; L543-W654 HydrophobicContact CD2-CH2 4.09Å; L543-W654 HydrophobicContact CD2-CZ2 4.3Å; L543-W654 HydrophobicContact CD2-CZ3 3.64Å; L543-L658 HydrophobicContact CD1-CD2 4.19Å; L543-L658 HydrophobicContact CD1-CG 4.37Å; L543-L658 HydrophobicContact CD2-CG 4.42Å; L543-L661 HydrophobicContact CD1-CD2 4.39Å
544	C	93.6	Very high	86.3	Confident	27 Å²	27	54.4 Å²	54.4	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-67	-38.1	177.7	-67.6	0	0	0	0	113.3	L540 L541 R542 G546 L566 H570	L540-C544 PolarHBondContact O-N 3.11Å; L540-C544 PolarHBondContact O-SG 2.85Å; L541-C544 CarbonylContact O-C 3.56Å; L541-C544 WeakPolarHBondContact O-CB 3.45Å; L541-C544 PolarHBondContact O-N 3.15Å; L541-C544 VanDerWaalsContact O-N 3.11Å; R542-C544 VanDerWaalsContact C-N 3.32Å; C544-G546 PolarHBondContact O-N 3.41Å; C544-L566 VanDerWaalsContact CA-O 3.31Å; C544-L566 WeakPolarHBondContact CA-O 3.22Å; C544-H570 VanDerWaalsContact SG-CD2 3.53Å
545	E	91.3	Very high	83.9	Confident	115 Å²	115	57.1 Å²	57.1	54%	0.537	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-33.7	171.6	-74.5	174.1	-176.5	0	0	111.7	L541 R542 F563	L541-E545 WeakPolarHBondContact O-CG 3.44Å; L541-E545 PolarHBondContact O-N 2.7Å; R542-E545 WeakPolarHBondContact CD-OE2 3.38Å; R542-E545 IonicContact CZ-OE2 2.74Å; R542-E545 IonicContact NE-OE2 2.73Å; R542-E545 IonicContact NH1-OE2 3.64Å; R542-E545 PolarHBondContact NH1-OE2 3.04Å; E545-F563 WeakPolarHBondContact O-CZ 3.4Å
546	G	90	Very high	81.5	Confident	12 Å²	12	63.9 Å²	63.9	12%	0.124	30%	0.301	C	S	.	.			trans	77.8	173.2	178.2	0	0	0	0	0	114.2	R542 L543 C544 C564	R542-G546 PolarHBondContact O-N 3.48Å; L543-G546 PolarHBondContact O-N 3.46Å; C544-G546 PolarHBondContact O-N 3.41Å; G546-C564 CarbonylContact C-O 3.49Å; G546-C564 WeakPolarHBondContact CA-O 3.36Å
547	M	89.1	Confident	78.9	Confident	32 Å²	32	62.3 Å²	62.3	16%	0.158	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	149.1	-176.2	178.3	158.2	-122.4	0	0	111.5	F549 F563 C564 P646 D650 W654	M547-F549 HydrophobicContact CB-CE2 3.82Å; M547-F549 HydrophobicContact CB-CZ 3.98Å; M547-F549 HydrophobicContact CG-CE1 4.4Å; M547-F549 HydrophobicContact CG-CE2 4.13Å; M547-F549 HydrophobicContact CG-CZ 4.06Å; M547-F549 WeakPolarHBondContact O-CD2 3.25Å; M547-F549 WeakPolarHBondContact O-CE2 3.2Å; M547-F549 HydrophobicContact SD-CE1 4.43Å; M547-F549 HydrophobicContact SD-CZ 4.38Å; M547-F563 WeakPolarHBondContact O-CA 3.34Å; M547-F563 WeakPolarHBondContact O-CD2 3.38Å; M547-C564 PolarHBondContact N-O 2.99Å; M547-C564 PolarHBondContact O-N 3.04Å; M547-P646 HydrophobicContact CE-CG 3.39Å; M547-P646 HydrophobicContact SD-CG 3.78Å; M547-D650 HydrophobicContact CE-CB 3.88Å; M547-D650 HydrophobicContact SD-CB 3.72Å; M547-W654 HydrophobicContact CB-CZ2 3.43Å; M547-W654 VanDerWaalsContact CB-CZ2 3.43Å; M547-W654 PolarHBondContact SD-NE1 2.95Å
548	L	87.1	Confident	76.6	Confident	65 Å²	65	57.9 Å²	57.9	34%	0.34	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	131.6	167.3	-67.9	166.1	0	0	0	110.3	L561 W562 F563 V578	L548-L561 HydrophobicContact CD1-CD1 4.3Å; L548-L561 HydrophobicContact CD2-CB 4.2Å; L548-W562 CarbonylContact C-O 3.54Å; L548-W562 WeakPolarHBondContact CA-O 3.37Å; L548-F563 HydrophobicContact CD2-CB 3.87Å; L548-F563 HydrophobicContact CD2-CD2 3.99Å; L548-F563 HydrophobicContact CD2-CG 4.43Å; L548-F563 HydrophobicContact CG-CD2 4.09Å; L548-V578 HydrophobicContact CD2-CB 4.02Å; L548-V578 HydrophobicContact CD2-CG1 4.24Å; L548-V578 HydrophobicContact CD2-CG2 4.06Å
549	F	85.6	Confident	74.6	Confident	1 Å²	1	56.2 Å²	56.2	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	148.1	176.6	-66.2	-81.7	0	0	0	109.6	M547 L561 W562 C564 F628 F643 W654	M547-F549 HydrophobicContact CB-CE2 3.82Å; M547-F549 HydrophobicContact CB-CZ 3.98Å; M547-F549 HydrophobicContact CG-CE1 4.4Å; M547-F549 HydrophobicContact CG-CE2 4.13Å; M547-F549 HydrophobicContact CG-CZ 4.06Å; M547-F549 WeakPolarHBondContact O-CD2 3.25Å; M547-F549 WeakPolarHBondContact O-CE2 3.2Å; M547-F549 HydrophobicContact SD-CE1 4.43Å; M547-F549 HydrophobicContact SD-CZ 4.38Å; F549-L561 CarbonylContact O-C 3.59Å; F549-L561 VanDerWaalsContact O-CA 3.3Å; F549-L561 WeakPolarHBondContact O-CA 3.42Å; F549-W562 HydrophobicContact CB-CD2 4.31Å; F549-W562 HydrophobicContact CB-CG 4.37Å; F549-W562 HydrophobicContact CB-CZ2 4.12Å; F549-W562 VanDerWaalsContact CB-NE1 3.25Å; F549-W562 HydrophobicContact CD2-CZ2 4.41Å; F549-W562 HydrophobicContact CG-CZ2 4.36Å; F549-W562 PolarHBondContact N-O 3.41Å; F549-W562 PolarHBondContact O-N 3.45Å; F549-C564 HydrophobicContact CD2-CB 4.11Å; F549-C564 HydrophobicContact CE2-CB 3.93Å; F549-F628 HydrophobicContact CE1-CE1 4.16Å; F549-F628 AromaticContact CE1-CZ 3.85Å; F549-F628 HydrophobicContact CE1-CZ 3.85Å; F549-F628 HydrophobicContact CZ-CZ 4.18Å; F549-F643 HydrophobicContact CD1-CB 4.4Å; F549-F643 AromaticContact CD1-CD1 3.88Å; F549-F643 HydrophobicContact CD1-CD1 3.88Å; F549-F643 AromaticContact CD2-CD1 3.96Å; F549-F643 HydrophobicContact CD2-CD1 3.96Å; F549-F643 HydrophobicContact CD2-CE1 4.19Å; F549-F643 HydrophobicContact CE1-CB 4.48Å; F549-F643 AromaticContact CE1-CD1 3.79Å; F549-F643 HydrophobicContact CE1-CD1 3.79Å; F549-F643 AromaticContact CE2-CD1 3.88Å; F549-F643 HydrophobicContact CE2-CD1 3.88Å; F549-F643 AromaticContact CE2-CE1 3.95Å; F549-F643 HydrophobicContact CE2-CE1 3.95Å; F549-F643 AromaticContact CG-CD1 3.95Å; F549-F643 HydrophobicContact CG-CD1 3.95Å; F549-F643 AromaticContact CZ-CD1 3.78Å; F549-F643 HydrophobicContact CZ-CD1 3.78Å; F549-F643 HydrophobicContact CZ-CE1 4.15Å; F549-W654 HydrophobicContact CE1-CD2 4.47Å; F549-W654 HydrophobicContact CE2-CD2 4.3Å; F549-W654 AromaticContact CE2-CE2 3.98Å; F549-W654 HydrophobicContact CE2-CE3 4.32Å; F549-W654 AromaticContact CE2-CH2 3.78Å; F549-W654 HydrophobicContact CE2-CH2 3.78Å; F549-W654 AromaticContact CE2-CZ2 3.75Å; F549-W654 HydrophobicContact CE2-CZ2 3.75Å; F549-W654 HydrophobicContact CE2-CZ3 4.06Å; F549-W654 AromaticContact CZ-CD2 3.53Å; F549-W654 HydrophobicContact CZ-CD2 3.53Å; F549-W654 AromaticContact CZ-CE2 3.48Å; F549-W654 VanDerWaalsContact CZ-CE2 3.48Å; F549-W654 AromaticContact CZ-CE3 3.77Å; F549-W654 HydrophobicContact CZ-CE3 3.77Å; F549-W654 HydrophobicContact CZ-CG 4.05Å; F549-W654 HydrophobicContact CZ-CH2 4Å; F549-W654 AromaticContact CZ-CZ2 3.76Å; F549-W654 HydrophobicContact CZ-CZ2 3.76Å; F549-W654 AromaticContact CZ-CZ3 3.99Å; F549-W654 HydrophobicContact CZ-CZ3 3.99Å; F549-W654 AromaticContact CZ-NE1 3.87Å
550	R	76.9	Confident	73.1	Confident	51 Å²	51	59 Å²	59	19%	0.192	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	137.7	170.7	-72	-178.2	174.2	140	1.7	109.8	T424 I552 D559 L561	T424-R550 VanDerWaalsContact CB-NH1 3.3Å; R550-I552 PolarHBondContact O-N 2.83Å; R550-D559 IonicContact NE-OD1 3.33Å; R550-D559 PolarHBondContact NE-OD1 3.44Å; R550-D559 IonicContact NH2-OD1 3.35Å; R550-L561 HydrophobicContact CG-CD2 3.79Å
551	K	74.4	Confident	72.2	Confident	75 Å²	75	59.7 Å²	59.7	33%	0.326	28%	0.283	S	S	.	.			trans	-65.5	134	170.3	-84.9	-166.4	175	-179.2	0	111.2	S553 K560 W562 D577	K551-S553 PolarHBondContact O-N 2.96Å; K551-K560 HydrophobicContact CB-CB 4.46Å; K551-K560 VanDerWaalsContact CB-O 3.32Å; K551-K560 WeakPolarHBondContact CB-O 3.3Å; K551-K560 HydrophobicContact CD-CB 4.06Å; K551-K560 HydrophobicContact CG-CB 4.43Å; K551-K560 WeakPolarHBondContact CG-O 3.49Å; K551-K560 PolarHBondContact N-O 2.86Å; K551-W562 HydrophobicContact CG-CG 4.4Å; K551-D577 VanDerWaalsContact CE-CG 3.48Å; K551-D577 WeakPolarHBondContact CE-OD1 3.46Å; K551-D577 IonicContact NZ-OD1 3.98Å; K551-D577 PolarHBondContact NZ-OD1 3.34Å; K551-D577 IonicContact NZ-OD2 3Å; K551-D577 PolarHBondContact NZ-OD2 3.4Å
552	I	68.9	Low	71.7	Confident	56 Å²	56	56 Å²	56	29%	0.287	26%	0.263	S	S	.	.			trans	-78.3	109.6	177.1	-58.7	161	0	0	0	107.9	R550 H610 N642 I644	R550-I552 PolarHBondContact O-N 2.83Å; I552-H610 HydrophobicContact CG2-CB 4.15Å; I552-N642 VanDerWaalsContact CD1-C 3.48Å; I552-N642 HydrophobicContact CD1-CB 3.35Å; I552-N642 WeakPolarHBondContact CD1-O 3.45Å; I552-I644 HydrophobicContact CD1-CD1 4.36Å; I552-I644 HydrophobicContact CD1-CG1 4.06Å; I552-I644 HydrophobicContact CG1-CD1 3.63Å; I552-I644 HydrophobicContact CG1-CG1 3.78Å; I552-I644 HydrophobicContact CG2-CD1 4.45Å
553	S	55.7	Low	71.4	Confident	25 Å²	25	53.2 Å²	53.2	18%	0.175	25%	0.253	C	S	.	.			trans	-115	146.7	174.9	-177.7	0	0	0	0	111.1	K551 R555 R557 K614	K551-S553 PolarHBondContact O-N 2.96Å; S553-R555 WeakPolarHBondContact CB-O 3.38Å; S553-R555 PolarHBondContact O-N 3.47Å; S553-R555 PolarHBondContact OG-N 2.81Å; S553-R555 PolarHBondContact OG-O 3.42Å; S553-R557 WeakPolarHBondContact OG-CD 3.34Å; S553-R557 WeakPolarHBondContact OG-CG 3.49Å; S553-K614 PolarHBondContact O-NZ 2.97Å
554	S	41.9	Very low	71.2	Confident	100 Å²	100	53.2 Å²	53.2	70%	0.699	25%	0.253	S	S	*	.	S	Bend	trans	-68.9	-21.1	176.1	64	0	0	0	0	112.8
555	R	46.3	Very low	71.2	Confident	141 Å²	141	52 Å²	52	53%	0.532	25%	0.245	S	C	.	.	S	Bend	trans	-136.9	148.8	177.6	-61.6	-176.2	180	168.9	5.6	108.6	G157 S553 R557	G157-R555 PolarHBondContact O-NH1 3.32Å; S553-R555 WeakPolarHBondContact CB-O 3.38Å; S553-R555 PolarHBondContact O-N 3.47Å; S553-R555 PolarHBondContact OG-N 2.81Å; S553-R555 PolarHBondContact OG-O 3.42Å; R555-R557 VanDerWaalsContact C-N 3.27Å; R555-R557 PolarHBondContact O-N 2.6Å
556	R	45.1	Very low	71.4	Confident	147 Å²	147	46.5 Å²	46.5	56%	0.555	22%	0.219	S	C	*	.			trans	-45.1	87.7	-179.7	-70.1	-176.2	-172.2	-164.6	6.6	110.9
557	R	42.9	Very low	71.5	Confident	84 Å²	84	46.4 Å²	46.4	32%	0.317	22%	0.216	S	C	.	.			trans	-85.7	121.9	162.2	-87.4	-177.9	173.7	-177.9	-10.5	103.2	E155 H156 S553 R555	E155-R557 HydrophobicContact CB-CG 4.45Å; E155-R557 PolarHBondContact O-NE 3.13Å; H156-R557 PolarHBondContact ND1-NH2 3Å; H156-R557 VanDerWaalsContact ND1-NH2 3.18Å; S553-R557 WeakPolarHBondContact OG-CD 3.34Å; S553-R557 WeakPolarHBondContact OG-CG 3.49Å; R555-R557 VanDerWaalsContact C-N 3.27Å; R555-R557 PolarHBondContact O-N 2.6Å
558	Q	48.1	Very low	71.5	Confident	26 Å²	26	49.5 Å²	49.5	12%	0.121	24%	0.239	C	C	.	.			trans	-54.2	157.5	168.3	-74.9	-169.6	-8.9	0	0	110.3	R191 E194 K560	R191-Q558 VanDerWaalsContact CZ-OE1 3.25Å; E194-Q558 PolarHBondContact OE2-NE2 3.41Å; Q558-K560 VanDerWaalsContact C-N 3.26Å; Q558-K560 PolarHBondContact O-N 3.27Å
559	D	53.9	Low	71.8	Confident	37 Å²	37	51.1 Å²	51.1	20%	0.198	25%	0.248	C	C	.	.			trans	-41.3	60.3	-168.9	-60.6	-79.1	0	0	0	117.9	R550 L561	R550-D559 IonicContact NE-OD1 3.33Å; R550-D559 PolarHBondContact NE-OD1 3.44Å; R550-D559 IonicContact NH2-OD1 3.35Å; D559-L561 VanDerWaalsContact C-N 3.28Å; D559-L561 PolarHBondContact O-N 3.07Å
560	K	65.1	Low	72.2	Confident	59 Å²	59	54.2 Å²	54.2	26%	0.257	26%	0.262	S	S	.	.			trans	-69.8	95.6	158.9	-71.9	-171.7	-176.3	175.3	0	106.8	E152 K551 Q558	E152-K560 IonicContact OE1-NZ 3.7Å; E152-K560 IonicContact OE2-NZ 4Å; E152-K560 PolarHBondContact OE2-NZ 3.17Å; K551-K560 HydrophobicContact CB-CB 4.46Å; K551-K560 VanDerWaalsContact CB-O 3.32Å; K551-K560 WeakPolarHBondContact CB-O 3.3Å; K551-K560 HydrophobicContact CD-CB 4.06Å; K551-K560 HydrophobicContact CG-CB 4.43Å; K551-K560 WeakPolarHBondContact CG-O 3.49Å; K551-K560 PolarHBondContact N-O 2.86Å; Q558-K560 VanDerWaalsContact C-N 3.26Å; Q558-K560 PolarHBondContact O-N 3.27Å
561	L	76.3	Confident	73	Confident	36 Å²	36	58.5 Å²	58.5	19%	0.188	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	147.7	172.1	-63.3	173.8	0	0	0	108.8	L548 F549 R550 D559 V578	L548-L561 HydrophobicContact CD1-CD1 4.3Å; L548-L561 HydrophobicContact CD2-CB 4.2Å; F549-L561 CarbonylContact O-C 3.59Å; F549-L561 VanDerWaalsContact O-CA 3.3Å; F549-L561 WeakPolarHBondContact O-CA 3.42Å; R550-L561 HydrophobicContact CG-CD2 3.79Å; D559-L561 VanDerWaalsContact C-N 3.28Å; D559-L561 PolarHBondContact O-N 3.07Å; L561-V578 PolarHBondContact O-N 3.22Å
562	W	83.5	Confident	73.8	Confident	16 Å²	16	56.4 Å²	56.4	6%	0.061	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	141.1	168.7	69.1	-72.2	0	0	0	108	L548 F549 K551 C564 Y575 G576 L641 N642 F643	L548-W562 CarbonylContact C-O 3.54Å; L548-W562 WeakPolarHBondContact CA-O 3.37Å; F549-W562 HydrophobicContact CB-CD2 4.31Å; F549-W562 HydrophobicContact CB-CG 4.37Å; F549-W562 HydrophobicContact CB-CZ2 4.12Å; F549-W562 VanDerWaalsContact CB-NE1 3.25Å; F549-W562 HydrophobicContact CD2-CZ2 4.41Å; F549-W562 HydrophobicContact CG-CZ2 4.36Å; F549-W562 PolarHBondContact N-O 3.41Å; F549-W562 PolarHBondContact O-N 3.45Å; K551-W562 HydrophobicContact CG-CG 4.4Å; W562-C564 HydrophobicContact CE3-CB 4.24Å; W562-C564 HydrophobicContact CH2-CB 4.22Å; W562-C564 HydrophobicContact CZ3-CB 3.74Å; W562-Y575 AromaticContact CE3-CD2 3.89Å; W562-Y575 HydrophobicContact CE3-CD2 3.89Å; W562-Y575 HydrophobicContact CE3-CG 4.16Å; W562-Y575 AromaticContact CZ3-CD2 3.67Å; W562-Y575 HydrophobicContact CZ3-CD2 3.67Å; W562-Y575 AromaticContact CZ3-CG 3.71Å; W562-Y575 HydrophobicContact CZ3-CG 3.71Å; W562-G576 CarbonylContact C-O 3.53Å; W562-G576 WeakPolarHBondContact CA-O 3.33Å; W562-G576 WeakPolarHBondContact CB-O 3.11Å; W562-L641 HydrophobicContact CH2-CD1 3.68Å; W562-L641 HydrophobicContact CH2-CD2 4.12Å; W562-L641 HydrophobicContact CH2-CG 3.85Å; W562-L641 HydrophobicContact CZ3-CD1 3.95Å; W562-L641 HydrophobicContact CZ3-CD2 4.37Å; W562-L641 HydrophobicContact CZ3-CG 4.4Å; W562-N642 WeakPolarHBondContact CZ2-O 3.42Å; W562-F643 AromaticContact CH2-CD1 3.67Å; W562-F643 HydrophobicContact CH2-CD1 3.67Å; W562-F643 AromaticContact CH2-CE1 3.23Å; W562-F643 HydrophobicContact CH2-CE1 3.23Å; W562-F643 HydrophobicContact CH2-CE2 4.3Å; W562-F643 HydrophobicContact CH2-CG 4.38Å; W562-F643 AromaticContact CH2-CZ 3.59Å; W562-F643 HydrophobicContact CH2-CZ 3.59Å; W562-F643 AromaticContact CZ2-CD1 3.53Å; W562-F643 HydrophobicContact CZ2-CD1 3.53Å; W562-F643 AromaticContact CZ2-CE1 3.64Å; W562-F643 HydrophobicContact CZ2-CE1 3.64Å; W562-F643 HydrophobicContact CZ2-CG 4.12Å; W562-F643 HydrophobicContact CZ2-CZ 4.28Å; W562-F643 HydrophobicContact CZ3-CE1 4.2Å
563	F	88.3	Confident	75	Confident	12 Å²	12	53.7 Å²	53.7	5%	0.053	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	139.8	179.4	-174.6	-99.1	0	0	0	109.2	E545 M547 L548 C565 Y575 G576 V578 P584 P585 L590	E545-F563 WeakPolarHBondContact O-CZ 3.4Å; M547-F563 WeakPolarHBondContact O-CA 3.34Å; M547-F563 WeakPolarHBondContact O-CD2 3.38Å; L548-F563 HydrophobicContact CD2-CB 3.87Å; L548-F563 HydrophobicContact CD2-CD2 3.99Å; L548-F563 HydrophobicContact CD2-CG 4.43Å; L548-F563 HydrophobicContact CG-CD2 4.09Å; F563-C565 HydrophobicContact CD1-CB 4.47Å; F563-C565 HydrophobicContact CE1-CB 3.65Å; F563-C565 HydrophobicContact CZ-CB 4.15Å; F563-Y575 CarbonylContact O-C 3.6Å; F563-Y575 WeakPolarHBondContact O-CA 3.4Å; F563-Y575 VanDerWaalsContact O-CB 3.26Å; F563-Y575 WeakPolarHBondContact O-CB 3.39Å; F563-G576 PolarHBondContact N-O 3.36Å; F563-G576 PolarHBondContact O-N 3.37Å; F563-V578 HydrophobicContact CB-CG2 3.59Å; F563-P584 HydrophobicContact CE2-CB 4.42Å; F563-P585 HydrophobicContact CB-CG 3.82Å; F563-P585 HydrophobicContact CD1-CG 3.69Å; F563-P585 HydrophobicContact CE1-CG 4.33Å; F563-P585 HydrophobicContact CG-CG 3.79Å; F563-L590 HydrophobicContact CB-CD2 4.4Å; F563-L590 HydrophobicContact CD1-CD1 3.77Å; F563-L590 HydrophobicContact CD1-CD2 4.18Å; F563-L590 HydrophobicContact CE1-CD1 4.19Å
564	C	92.1	Very high	76.7	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.9	170.5	-175.4	0	0	0	0	109.5	G546 M547 F549 W562 Q574 F643 W654	G546-C564 CarbonylContact C-O 3.49Å; G546-C564 WeakPolarHBondContact CA-O 3.36Å; M547-C564 PolarHBondContact N-O 2.99Å; M547-C564 PolarHBondContact O-N 3.04Å; F549-C564 HydrophobicContact CD2-CB 4.11Å; F549-C564 HydrophobicContact CE2-CB 3.93Å; W562-C564 HydrophobicContact CE3-CB 4.24Å; W562-C564 HydrophobicContact CH2-CB 4.22Å; W562-C564 HydrophobicContact CZ3-CB 3.74Å; C564-Q574 CarbonylContact C-O 3.59Å; C564-Q574 WeakPolarHBondContact CA-O 3.48Å; C564-F643 HydrophobicContact CB-CE1 4.14Å; C564-W654 HydrophobicContact CB-CH2 4.17Å; C564-W654 VanDerWaalsContact O-CH2 3.26Å; C564-W654 WeakPolarHBondContact O-CH2 3.44Å
565	C	93.4	Very high	79	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.014	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	162.3	174.1	64.6	0	0	0	0	111.4	L543 F563 L573 Q574 L587	L543-C565 CarbonylContact O-C 3.13Å; L543-C565 WeakPolarHBondContact O-CA 3.47Å; F563-C565 HydrophobicContact CD1-CB 4.47Å; F563-C565 HydrophobicContact CE1-CB 3.65Å; F563-C565 HydrophobicContact CZ-CB 4.15Å; C565-L573 CarbonylContact O-C 3.59Å; C565-L573 WeakPolarHBondContact O-CA 3.44Å; C565-Q574 PolarHBondContact N-O 3.26Å; C565-Q574 PolarHBondContact O-N 3.24Å; C565-L587 VanDerWaalsContact SG-CD2 3.52Å
566	L	94.6	Very high	80.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	136.7	172.4	-176.8	67.1	0	0	0	109.7	L540 L543 C544 H570 L573 V596 L661	L540-L566 HydrophobicContact CD2-CD2 4.32Å; L543-L566 HydrophobicContact CB-CB 3.72Å; L543-L566 HydrophobicContact CB-CD2 3.98Å; L543-L566 HydrophobicContact CD1-CD2 4.13Å; L543-L566 PolarHBondContact O-N 3.44Å; C544-L566 VanDerWaalsContact CA-O 3.31Å; C544-L566 WeakPolarHBondContact CA-O 3.22Å; L566-H570 HydrophobicContact CD2-CB 4.02Å; L566-L573 HydrophobicContact CB-CD2 4.07Å; L566-L573 HydrophobicContact CD1-CD2 3.9Å; L566-L573 HydrophobicContact CD1-CG 4.19Å; L566-V596 HydrophobicContact CD1-CG2 3.92Å; L566-L661 HydrophobicContact CD1-CD1 4.38Å; L566-L661 HydrophobicContact CD1-CD2 3.81Å; L566-L661 HydrophobicContact CD2-CD1 3.94Å; L566-L661 HydrophobicContact CD2-CD2 4.13Å
567	S	91.8	Very high	82.5	Confident	9 Å²	9	40 Å²	40	6%	0.063	20%	0.198	C	C	.	.			trans	-61.4	147	172.3	45	0	0	0	0	110.9	N569 H570 V572	S567-N569 PolarHBondContact O-N 3.13Å; S567-N569 PolarHBondContact OG-OD1 3.22Å; S567-H570 WeakPolarHBondContact O-CA 3.39Å; S567-H570 PolarHBondContact O-N 3.32Å; S567-V572 WeakPolarHBondContact CB-O 3.22Å; S567-V572 PolarHBondContact N-O 3.42Å; S567-V572 WeakPolarHBondContact OG-CA 3.43Å; S567-V572 PolarHBondContact OG-N 3.27Å; S567-V572 PolarHBondContact OG-O 2.91Å
568	P	90.1	Very high	84	Confident	98 Å²	98	37 Å²	37	64%	0.636	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.4	-177	-27.2	34.7	0	0	0	115.5	H570 L587	P568-H570 VanDerWaalsContact C-N 3.33Å; P568-L587 HydrophobicContact CG-CD1 4.22Å
569	N	92.3	Very high	84.7	Confident	99 Å²	99	43.6 Å²	43.6	53%	0.529	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	0.2	175.7	66.8	11.2	0	0	0	113.5	S567 K571	S567-N569 PolarHBondContact O-N 3.13Å; S567-N569 PolarHBondContact OG-OD1 3.22Å; N569-K571 VanDerWaalsContact C-N 3.28Å; N569-K571 WeakPolarHBondContact O-CG 3.41Å; N569-K571 PolarHBondContact O-N 3.28Å; N569-K571 WeakPolarHBondContact OD1-CB 3.5Å; N569-K571 PolarHBondContact OD1-N 3.36Å
570	H	94.1	Very high	84.7	Confident	65 Å²	65	47.2 Å²	47.2	30%	0.301	24%	0.236	S	C	.	.	S	Bend	trans	60.2	27.4	-178.7	-49.7	153	0	0	0	114.9	C544 L566 S567 P568 L661	C544-H570 VanDerWaalsContact SG-CD2 3.53Å; L566-H570 HydrophobicContact CD2-CB 4.02Å; S567-H570 WeakPolarHBondContact O-CA 3.39Å; S567-H570 PolarHBondContact O-N 3.32Å; P568-H570 VanDerWaalsContact C-N 3.33Å; H570-L661 HydrophobicContact CB-CD1 3.85Å
571	K	93.4	Very high	84.1	Confident	141 Å²	141	48.3 Å²	48.3	61%	0.613	26%	0.264	S	S	*	.	S	Bend	trans	-108.5	-19	-175.8	-65.4	-175.6	179.5	-176.2	0	114.8	N569 V596	N569-K571 VanDerWaalsContact C-N 3.28Å; N569-K571 WeakPolarHBondContact O-CG 3.41Å; N569-K571 PolarHBondContact O-N 3.28Å; N569-K571 WeakPolarHBondContact OD1-CB 3.5Å; N569-K571 PolarHBondContact OD1-N 3.36Å; K571-V596 VanDerWaalsContact C-CG2 3.45Å; K571-V596 WeakPolarHBondContact O-CB 3.45Å; K571-V596 WeakPolarHBondContact O-CG2 3.46Å; K571-V596 PolarHBondContact O-N 2.98Å
572	V	92.9	Very high	83.3	Confident	31 Å²	31	49.2 Å²	49.2	19%	0.188	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	127.4	-173.9	-176	0	0	0	0	109.6	S567 Q574 Q593 L594	S567-V572 WeakPolarHBondContact CB-O 3.22Å; S567-V572 PolarHBondContact N-O 3.42Å; S567-V572 WeakPolarHBondContact OG-CA 3.43Å; S567-V572 PolarHBondContact OG-N 3.27Å; S567-V572 PolarHBondContact OG-O 2.91Å; V572-Q574 HydrophobicContact CG1-CG 4.1Å; V572-Q593 HydrophobicContact CG1-CB 3.79Å; V572-Q593 HydrophobicContact CG1-CG 4.34Å; V572-L594 CarbonylContact C-O 3.51Å; V572-L594 WeakPolarHBondContact CA-O 3.36Å
573	L	93.5	Very high	82.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.8	163.7	-74.4	168.9	0	0	0	108.8	C565 L566 Q593 L594 I599 I630 L658	C565-L573 CarbonylContact O-C 3.59Å; C565-L573 WeakPolarHBondContact O-CA 3.44Å; L566-L573 HydrophobicContact CB-CD2 4.07Å; L566-L573 HydrophobicContact CD1-CD2 3.9Å; L566-L573 HydrophobicContact CD1-CG 4.19Å; L573-Q593 CarbonylContact O-C 3.56Å; L573-Q593 WeakPolarHBondContact O-CA 3.31Å; L573-L594 HydrophobicContact CB-CB 4.28Å; L573-L594 HydrophobicContact CD1-CD2 4.34Å; L573-L594 PolarHBondContact N-O 3.07Å; L573-L594 PolarHBondContact O-N 2.92Å; L573-I599 HydrophobicContact CD1-CD1 3.92Å; L573-I630 HydrophobicContact CD1-CD1 3.56Å; L573-L658 HydrophobicContact CD1-CD2 4.18Å
574	Q	90.8	Very high	80.9	Confident	23 Å²	23	59.4 Å²	59.4	11%	0.107	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.2	179	-60.5	-176.5	-61.5	0	0	109.1	C564 C565 V572 L587 L590 E592 Q593	C564-Q574 CarbonylContact C-O 3.59Å; C564-Q574 WeakPolarHBondContact CA-O 3.48Å; C565-Q574 PolarHBondContact N-O 3.26Å; C565-Q574 PolarHBondContact O-N 3.24Å; V572-Q574 HydrophobicContact CG1-CG 4.1Å; Q574-L587 PolarHBondContact OE1-O 3.49Å; Q574-L590 HydrophobicContact CB-CB 4.27Å; Q574-L590 HydrophobicContact CB-CD1 3.94Å; Q574-E592 WeakPolarHBondContact CA-O 3.21Å; Q574-Q593 HydrophobicContact CG-CG 4.21Å
575	Y	89.6	Confident	79.9	Confident	31 Å²	31	60.8 Å²	60.8	12%	0.122	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	163.3	-176.9	64.3	-86.3	0	0	0	114.1	W562 F563 E592 L594 L641	W562-Y575 AromaticContact CE3-CD2 3.89Å; W562-Y575 HydrophobicContact CE3-CD2 3.89Å; W562-Y575 HydrophobicContact CE3-CG 4.16Å; W562-Y575 AromaticContact CZ3-CD2 3.67Å; W562-Y575 HydrophobicContact CZ3-CD2 3.67Å; W562-Y575 AromaticContact CZ3-CG 3.71Å; W562-Y575 HydrophobicContact CZ3-CG 3.71Å; F563-Y575 CarbonylContact O-C 3.6Å; F563-Y575 WeakPolarHBondContact O-CA 3.4Å; F563-Y575 VanDerWaalsContact O-CB 3.26Å; F563-Y575 WeakPolarHBondContact O-CB 3.39Å; Y575-E592 HydrophobicContact CD1-CB 4.02Å; Y575-E592 HydrophobicContact CD2-CB 3.69Å; Y575-E592 HydrophobicContact CD2-CG 4.25Å; Y575-E592 HydrophobicContact CE1-CB 3.74Å; Y575-E592 HydrophobicContact CE2-CB 3.38Å; Y575-E592 HydrophobicContact CE2-CG 3.75Å; Y575-E592 HydrophobicContact CG-CB 3.99Å; Y575-E592 PolarHBondContact N-O 3.28Å; Y575-E592 WeakPolarHBondContact O-CB 3.3Å; Y575-E592 PolarHBondContact O-N 3.07Å; Y575-L594 HydrophobicContact CE1-CB 4.23Å; Y575-L641 HydrophobicContact CD1-CD2 4.08Å; Y575-L641 HydrophobicContact CD2-CD1 4.28Å; Y575-L641 HydrophobicContact CE1-CD1 4.32Å; Y575-L641 HydrophobicContact CE1-CD2 4Å; Y575-L641 HydrophobicContact CE2-CD1 3.89Å
576	G	83.8	Confident	78.6	Confident	4 Å²	4	65.5 Å²	65.5	4%	0.041	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.2	164	-177.2	0	0	0	0	0	113.6	W562 F563	W562-G576 CarbonylContact C-O 3.53Å; W562-G576 WeakPolarHBondContact CA-O 3.33Å; W562-G576 WeakPolarHBondContact CB-O 3.11Å; F563-G576 PolarHBondContact N-O 3.36Å; F563-G576 PolarHBondContact O-N 3.37Å
577	D	81.8	Confident	77.1	Confident	66 Å²	66	68.5 Å²	68.5	35%	0.353	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	142.2	178.5	-61.6	-19.3	0	0	0	110.8	H57 K551	H57-D577 IonicContact CD2-OD2 2.71Å; H57-D577 PolarHBondContact CD2-OD2 2.96Å; H57-D577 IonicContact NE2-OD2 3.21Å; H57-D577 PolarHBondContact NE2-OD2 3.19Å; K551-D577 VanDerWaalsContact CE-CG 3.48Å; K551-D577 WeakPolarHBondContact CE-OD1 3.46Å; K551-D577 IonicContact NZ-OD1 3.98Å; K551-D577 PolarHBondContact NZ-OD1 3.34Å; K551-D577 IonicContact NZ-OD2 3Å; K551-D577 PolarHBondContact NZ-OD2 3.4Å
578	V	74.3	Confident	75.7	Confident	23 Å²	23	77.1 Å²	77.1	14%	0.139	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.9	-179.7	-176	0	0	0	0	109.8	L548 L561 F563 A582 P585	L548-V578 HydrophobicContact CD2-CB 4.02Å; L548-V578 HydrophobicContact CD2-CG1 4.24Å; L548-V578 HydrophobicContact CD2-CG2 4.06Å; L561-V578 PolarHBondContact O-N 3.22Å; F563-V578 HydrophobicContact CB-CG2 3.59Å; V578-A582 HydrophobicContact CG1-CB 4.02Å; V578-P585 HydrophobicContact CG2-CG 3.89Å
579	E	63.4	Low	74.7	Confident	163 Å²	163	75.7 Å²	75.7	76%	0.762	42%	0.423	S	S	*	.			trans	-74	143.4	173	-65.3	-165.1	170.7	0	0	111.6	G581 A582	E579-G581 PolarHBondContact O-N 2.8Å; E579-A582 WeakPolarHBondContact O-CB 3.18Å; E579-A582 PolarHBondContact O-N 2.83Å
580	E	53.8	Low	74.1	Confident	113 Å²	113	71.4 Å²	71.4	53%	0.528	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	123.6	-176.6	-162.3	175	-167.5	0	0	111.2
581	G	52.8	Low	73.1	Confident	82 Å²	82	71.2 Å²	71.2	85%	0.845	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	1.6	-178.3	0	0	0	0	0	116	E579	E579-G581 PolarHBondContact O-N 2.8Å
582	A	59.2	Low	72.7	Confident	55 Å²	55	66.9 Å²	66.9	46%	0.455	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-75.7	148.1	172.7	0	0	0	0	0	112.3	V578 E579	V578-A582 HydrophobicContact CG1-CB 4.02Å; E579-A582 WeakPolarHBondContact O-CB 3.18Å; E579-A582 PolarHBondContact O-N 2.83Å
583	N	58.4	Low	72.5	Confident	144 Å²	144	70.2 Å²	70.2	77%	0.77	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-61.4	154.4	171.1	-74.5	-33	0	0	0	110.6	P585	N583-P585 VanDerWaalsContact O-N 3.17Å
584	P	62.9	Low	72.3	Confident	98 Å²	98	70.4 Å²	70.4	64%	0.636	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-51.1	124.4	176.3	-23.8	32	0	0	0	110.6	F563	F563-P584 HydrophobicContact CE2-CB 4.42Å
585	P	70.3	Confident	72.4	Confident	30 Å²	30	71.8 Å²	71.8	20%	0.195	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-62.3	146.6	-177.8	23.5	-32.5	0	0	0	111	F563 V578 N583 S589 L590	F563-P585 HydrophobicContact CB-CG 3.82Å; F563-P585 HydrophobicContact CD1-CG 3.69Å; F563-P585 HydrophobicContact CE1-CG 4.33Å; F563-P585 HydrophobicContact CG-CG 3.79Å; V578-P585 HydrophobicContact CG2-CG 3.89Å; N583-P585 VanDerWaalsContact O-N 3.17Å; P585-S589 WeakPolarHBondContact CB-OG 3.44Å; P585-L590 HydrophobicContact CB-CD2 4.08Å; P585-L590 HydrophobicContact CG-CD2 3.7Å; P585-L590 HydrophobicContact CG-CG 4.41Å
586	T	67.4	Low	72.5	Confident	100 Å²	100	71.3 Å²	71.3	61%	0.613	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-70.1	148.7	172.5	54.4	0	0	0	0	109.9	E588 S589	T586-E588 PolarHBondContact O-N 2.82Å; T586-S589 PolarHBondContact N-OG 3.44Å; T586-S589 WeakPolarHBondContact O-CB 3.41Å; T586-S589 PolarHBondContact O-N 3.23Å; T586-S589 PolarHBondContact O-OG 3.26Å
587	L	63	Low	72.9	Confident	64 Å²	64	75.5 Å²	75.5	34%	0.335	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-49.4	-35.1	-179.3	-78.2	145.2	0	0	0	113.3	C565 P568 Q574 S589	C565-L587 VanDerWaalsContact SG-CD2 3.52Å; P568-L587 HydrophobicContact CG-CD1 4.22Å; Q574-L587 PolarHBondContact OE1-O 3.49Å; L587-S589 VanDerWaalsContact C-N 3.31Å; L587-S589 PolarHBondContact O-N 2.66Å
588	E	62.3	Low	73.4	Confident	189 Å²	189	75.3 Å²	75.3	88%	0.883	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-75.4	-16.5	-179	-61.9	-179.1	174.9	0	0	114	T586	T586-E588 PolarHBondContact O-N 2.82Å
589	S	69.1	Low	74.4	Confident	68 Å²	68	75.1 Å²	75.1	48%	0.476	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-90.5	-10.1	-177.4	67.4	0	0	0	0	114.1	P585 T586 L587	P585-S589 WeakPolarHBondContact CB-OG 3.44Å; T586-S589 PolarHBondContact N-OG 3.44Å; T586-S589 WeakPolarHBondContact O-CB 3.41Å; T586-S589 PolarHBondContact O-N 3.23Å; T586-S589 PolarHBondContact O-OG 3.26Å; L587-S589 VanDerWaalsContact C-N 3.31Å; L587-S589 PolarHBondContact O-N 2.66Å
590	L	78.6	Confident	75.7	Confident	9 Å²	9	73.2 Å²	73.2	5%	0.047	43%	0.43	C	S	.	.			trans	-82.7	121.9	-179.2	-65.5	170.7	0	0	0	110.3	F563 Q574 P585	F563-L590 HydrophobicContact CB-CD2 4.4Å; F563-L590 HydrophobicContact CD1-CD1 3.77Å; F563-L590 HydrophobicContact CD1-CD2 4.18Å; F563-L590 HydrophobicContact CE1-CD1 4.19Å; Q574-L590 HydrophobicContact CB-CB 4.27Å; Q574-L590 HydrophobicContact CB-CD1 3.94Å; P585-L590 HydrophobicContact CB-CD2 4.08Å; P585-L590 HydrophobicContact CG-CD2 3.7Å; P585-L590 HydrophobicContact CG-CG 4.41Å
591	P	74.2	Confident	77.5	Confident	61 Å²	61	69.5 Å²	69.5	40%	0.396	42%	0.419	S	S	.	.			trans	-73.5	-32	-172.2	28.1	-34.6	0	0	0	113.2
592	E	84.2	Confident	79.5	Confident	51 Å²	51	67.1 Å²	67.1	24%	0.238	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	142.9	-172.3	-62.9	-67.8	171.8	0	0	112.5	K70 Q574 Y575	K70-E592 IonicContact NZ-OE2 3.54Å; K70-E592 PolarHBondContact NZ-OE2 3.23Å; Q574-E592 WeakPolarHBondContact CA-O 3.21Å; Y575-E592 HydrophobicContact CD1-CB 4.02Å; Y575-E592 HydrophobicContact CD2-CB 3.69Å; Y575-E592 HydrophobicContact CD2-CG 4.25Å; Y575-E592 HydrophobicContact CE1-CB 3.74Å; Y575-E592 HydrophobicContact CE2-CB 3.38Å; Y575-E592 HydrophobicContact CE2-CG 3.75Å; Y575-E592 HydrophobicContact CG-CB 3.99Å; Y575-E592 PolarHBondContact N-O 3.28Å; Y575-E592 WeakPolarHBondContact O-CB 3.3Å; Y575-E592 PolarHBondContact O-N 3.07Å
593	Q	88.8	Confident	81.1	Confident	101 Å²	101	66.5 Å²	66.5	47%	0.472	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.1	-179.4	-56.7	-168.5	5.6	0	0	110.6	V572 L573 Q574	V572-Q593 HydrophobicContact CG1-CB 3.79Å; V572-Q593 HydrophobicContact CG1-CG 4.34Å; L573-Q593 CarbonylContact O-C 3.56Å; L573-Q593 WeakPolarHBondContact O-CA 3.31Å; Q574-Q593 HydrophobicContact CG-CG 4.21Å
594	L	90.1	Very high	82.7	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	109.9	174.5	172	60.2	0	0	0	109.2	V572 L573 Y575 V596 I599 I630 Y632 L641	V572-L594 CarbonylContact C-O 3.51Å; V572-L594 WeakPolarHBondContact CA-O 3.36Å; L573-L594 HydrophobicContact CB-CB 4.28Å; L573-L594 HydrophobicContact CD1-CD2 4.34Å; L573-L594 PolarHBondContact N-O 3.07Å; L573-L594 PolarHBondContact O-N 2.92Å; Y575-L594 HydrophobicContact CE1-CB 4.23Å; L594-V596 PolarHBondContact O-N 2.89Å; L594-I599 HydrophobicContact CD2-CD1 4.49Å; L594-I599 HydrophobicContact CD2-CG1 4.21Å; L594-I599 HydrophobicContact CG-CG1 4.4Å; L594-I630 HydrophobicContact CD2-CG2 4.19Å; L594-Y632 HydrophobicContact CD1-CD1 4.01Å; L594-Y632 HydrophobicContact CD1-CD2 3.42Å; L594-Y632 VanDerWaalsContact CD1-CD2 3.42Å; L594-Y632 HydrophobicContact CD1-CE1 4.42Å; L594-Y632 HydrophobicContact CD1-CE2 3.89Å; L594-Y632 HydrophobicContact CD1-CG 3.48Å; L594-Y632 VanDerWaalsContact CD1-CG 3.48Å; L594-Y632 HydrophobicContact CD2-CD1 3.86Å; L594-Y632 HydrophobicContact CD2-CE1 4.26Å; L594-Y632 HydrophobicContact CD2-CG 4.13Å; L594-Y632 HydrophobicContact CG-CG 4.47Å; L594-L641 HydrophobicContact CD2-CD2 4.27Å
595	P	92.4	Very high	83.8	Confident	52 Å²	52	59.7 Å²	59.7	34%	0.338	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	132.8	172.4	-22.1	34.4	0	0	0	110.9	A597 D598	P595-A597 PolarHBondContact O-N 3.02Å; P595-D598 WeakPolarHBondContact CB-OD2 3.46Å; P595-D598 WeakPolarHBondContact CD-OD2 3.45Å; P595-D598 VanDerWaalsContact CG-OD2 3.29Å; P595-D598 WeakPolarHBondContact CG-OD2 3.32Å; P595-D598 PolarHBondContact O-N 3.17Å; P595-D598 VanDerWaalsContact O-N 3.09Å
596	V	92.8	Very high	84.5	Confident	20 Å²	20	65.8 Å²	65.8	12%	0.121	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-62.8	-28.7	179.1	173.5	0	0	0	0	111.3	L566 K571 L594 D598 I599 L661	L566-V596 HydrophobicContact CD1-CG2 3.92Å; K571-V596 VanDerWaalsContact C-CG2 3.45Å; K571-V596 WeakPolarHBondContact O-CB 3.45Å; K571-V596 WeakPolarHBondContact O-CG2 3.46Å; K571-V596 PolarHBondContact O-N 2.98Å; L594-V596 PolarHBondContact O-N 2.89Å; V596-D598 PolarHBondContact O-N 3.23Å; V596-I599 HydrophobicContact CB-CD1 4.43Å; V596-I599 HydrophobicContact CG1-CD1 4.38Å; V596-I599 HydrophobicContact CG2-CD1 4.46Å; V596-I599 WeakPolarHBondContact O-CB 3.27Å; V596-I599 PolarHBondContact O-N 3.04Å; V596-L661 HydrophobicContact CG1-CD1 4.15Å; V596-L661 HydrophobicContact CG1-CD2 3.92Å; V596-L661 HydrophobicContact CG1-CG 3.75Å; V596-L661 HydrophobicContact CG2-CD2 3.81Å; V596-L661 HydrophobicContact CG2-CG 4.41Å
597	A	91.9	Very high	85.3	Confident	93 Å²	93	64.3 Å²	64.3	77%	0.769	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-65.2	-22.7	177.2	0	0	0	0	0	113.8	P595 I599	P595-A597 PolarHBondContact O-N 3.02Å; A597-I599 VanDerWaalsContact C-N 3.35Å
598	D	92.4	Very high	86.4	Confident	62 Å²	62	61.3 Å²	61.3	33%	0.332	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-88.7	-7.2	-179.7	-59.2	-23.9	0	0	0	111.6	P595 V596 R600 Y632 D633	P595-D598 WeakPolarHBondContact CB-OD2 3.46Å; P595-D598 WeakPolarHBondContact CD-OD2 3.45Å; P595-D598 VanDerWaalsContact CG-OD2 3.29Å; P595-D598 WeakPolarHBondContact CG-OD2 3.32Å; P595-D598 PolarHBondContact O-N 3.17Å; P595-D598 VanDerWaalsContact O-N 3.09Å; V596-D598 PolarHBondContact O-N 3.23Å; D598-R600 PolarHBondContact O-N 2.91Å; D598-Y632 CarbonylContact O-C 3.54Å; D598-Y632 WeakPolarHBondContact O-CA 3.22Å; D598-Y632 VanDerWaalsContact O-CB 3.26Å; D598-Y632 WeakPolarHBondContact O-CB 3.25Å; D598-D633 HydrophobicContact CB-CB 4.33Å; D598-D633 PolarHBondContact O-N 3.46Å
599	I	93.8	Very high	87.4	Confident	19 Å²	19	53.7 Å²	53.7	10%	0.097	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	124.8	179.6	-60.5	174.7	0	0	0	109.7	L573 L594 V596 A597 I630 L662	L573-I599 HydrophobicContact CD1-CD1 3.92Å; L594-I599 HydrophobicContact CD2-CD1 4.49Å; L594-I599 HydrophobicContact CD2-CG1 4.21Å; L594-I599 HydrophobicContact CG-CG1 4.4Å; V596-I599 HydrophobicContact CB-CD1 4.43Å; V596-I599 HydrophobicContact CG1-CD1 4.38Å; V596-I599 HydrophobicContact CG2-CD1 4.46Å; V596-I599 WeakPolarHBondContact O-CB 3.27Å; V596-I599 PolarHBondContact O-N 3.04Å; A597-I599 VanDerWaalsContact C-N 3.35Å; I599-I630 HydrophobicContact CB-CG2 4.18Å; I599-I630 HydrophobicContact CD1-CG2 3.85Å; I599-I630 HydrophobicContact CG1-CG2 3.72Å; I599-I630 HydrophobicContact CG2-CG2 3.49Å; I599-I630 VanDerWaalsContact CG2-CG2 3.49Å; I599-L662 HydrophobicContact CB-CD2 3.85Å; I599-L662 HydrophobicContact CD1-CD2 4.43Å; I599-L662 HydrophobicContact CG2-CD1 3.91Å; I599-L662 HydrophobicContact CG2-CD2 3.59Å; I599-L662 HydrophobicContact CG2-CG 4.36Å
600	R	91.1	Very high	87.7	Confident	123 Å²	123	51.4 Å²	51.4	46%	0.464	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-50.2	176.6	-68.2	-176.4	175.4	177.8	3.8	112.2	D598 S631 D633 E638	D598-R600 PolarHBondContact O-N 2.91Å; R600-S631 PolarHBondContact N-O 3.39Å; R600-D633 IonicContact CZ-OD1 3.77Å; R600-D633 VanDerWaalsContact NE-CG 3.31Å; R600-D633 IonicContact NE-OD1 3.47Å; R600-D633 PolarHBondContact NE-OD1 3.48Å; R600-D633 IonicContact NE-OD2 2.93Å; R600-D633 IonicContact NH2-OD1 3.59Å; R600-D633 PolarHBondContact NH2-OD1 3.34Å; R600-E638 IonicContact NH1-OE2 2.87Å
601	A	92.3	Very high	87.6	Confident	35 Å²	35	51.7 Å²	51.7	29%	0.289	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	157.2	-173.5	0	0	0	0	0	113.4	S631	A601-S631 PolarHBondContact N-O 3.27Å; A601-S631 PolarHBondContact N-OG 3.39Å; A601-S631 PolarHBondContact O-N 2.8Å
602	L	94.6	Very high	87.3	Confident	31 Å²	31	56.4 Å²	56.4	16%	0.162	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119.2	166.2	178.5	66.7	0	0	0	108.7	M604 F628 I630 T655 L658 L662	L602-M604 HydrophobicContact CG-CG 4.46Å; L602-F628 HydrophobicContact CD1-CB 4.38Å; L602-F628 HydrophobicContact CD1-CD2 3.97Å; L602-I630 HydrophobicContact CD1-CG1 4.33Å; L602-T655 HydrophobicContact CD2-CG2 4.34Å; L602-T655 WeakPolarHBondContact CD2-O 3.39Å; L602-L658 HydrophobicContact CD1-CB 4.42Å; L602-L658 HydrophobicContact CD1-CD1 3.91Å; L602-L658 HydrophobicContact CD2-CB 4.07Å; L602-L662 HydrophobicContact CB-CD1 4.38Å
603	L	93	Very high	86	Confident	43 Å²	43	62.1 Å²	62.1	23%	0.225	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	146.2	175.9	-54	178.5	0	0	0	109.6	F628 S629 Y640	L603-F628 CarbonylContact O-C 3.58Å; L603-F628 WeakPolarHBondContact O-CA 3.35Å; L603-F628 WeakPolarHBondContact O-CB 3.17Å; L603-S629 PolarHBondContact N-O 3.27Å; L603-S629 PolarHBondContact O-N 2.81Å; L603-Y640 HydrophobicContact CD1-CD1 4.1Å; L603-Y640 HydrophobicContact CD1-CE1 3.65Å
604	M	91.6	Very high	84.4	Confident	87 Å²	87	61.2 Å²	61.2	43%	0.429	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.8	-177.2	-66.8	179.3	-75.1	0	0	111.6	L602 K606 D607 C608 F628 F651 T655	L602-M604 HydrophobicContact CG-CG 4.46Å; M604-K606 PolarHBondContact O-N 3.31Å; M604-D607 PolarHBondContact O-N 3.31Å; M604-D607 VanDerWaalsContact O-N 3.15Å; M604-C608 VanDerWaalsContact C-SG 3.58Å; M604-F628 HydrophobicContact CG-CB 4.23Å; M604-F651 HydrophobicContact CB-CZ 4.34Å; M604-F651 HydrophobicContact CG-CZ 4.22Å; M604-F651 HydrophobicContact SD-CZ 4.19Å; M604-T655 HydrophobicContact CG-CG2 4.18Å; M604-T655 HydrophobicContact SD-CG2 3.92Å
605	G	86.5	Confident	82.2	Confident	12 Å²	12	63.9 Å²	63.9	12%	0.124	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	49.9	-118.8	178.5	0	0	0	0	0	114.9	D607 C608 Y624 A627	G605-D607 PolarHBondContact O-N 3.3Å; G605-D607 VanDerWaalsContact O-N 3.1Å; G605-C608 VanDerWaalsContact O-CB 3.27Å; G605-C608 WeakPolarHBondContact O-CB 3.3Å; G605-C608 PolarHBondContact O-N 3.45Å; G605-C608 PolarHBondContact O-SG 3.42Å; G605-C608 VanDerWaalsContact O-SG 3.4Å; G605-Y624 WeakPolarHBondContact CA-O 3.27Å; G605-A627 PolarHBondContact N-O 3.02Å
606	K	83.7	Confident	79.6	Confident	158 Å²	158	67.4 Å²	67.4	69%	0.687	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-62.6	-16.6	-176.8	66.7	178.4	-178.5	177.9	0	114.1	M604 C608 R612	M604-K606 PolarHBondContact O-N 3.31Å; K606-C608 VanDerWaalsContact C-N 3.31Å; K606-R612 WeakPolarHBondContact O-CG 3.39Å; K606-R612 PolarHBondContact O-NE 3.1Å
607	D	85.2	Confident	77.4	Confident	69 Å²	69	68.5 Å²	68.5	37%	0.369	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-84.4	-11.6	179	-63.4	-44.2	0	0	0	112.8	M604 G605 R612	M604-D607 PolarHBondContact O-N 3.31Å; M604-D607 VanDerWaalsContact O-N 3.15Å; G605-D607 PolarHBondContact O-N 3.3Å; G605-D607 VanDerWaalsContact O-N 3.1Å; D607-R612 IonicContact OD1-CZ 2.7Å; D607-R612 IonicContact OD1-NH2 2.59Å; D607-R612 PolarHBondContact OD1-NH2 2.83Å
608	C	85.8	Confident	75.2	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	39%	0.39	C	S	.	.	S	Bend	trans	-70.4	132.8	175.9	-59.9	0	0	0	0	111.7	M604 G605 K606 H610 V611 R612 F628	M604-C608 VanDerWaalsContact C-SG 3.58Å; G605-C608 VanDerWaalsContact O-CB 3.27Å; G605-C608 WeakPolarHBondContact O-CB 3.3Å; G605-C608 PolarHBondContact O-N 3.45Å; G605-C608 PolarHBondContact O-SG 3.42Å; G605-C608 VanDerWaalsContact O-SG 3.4Å; K606-C608 VanDerWaalsContact C-N 3.31Å; C608-H610 VanDerWaalsContact C-N 3.33Å; C608-H610 WeakPolarHBondContact CB-CE1 3.46Å; C608-H610 PolarHBondContact O-N 3.11Å; C608-V611 HydrophobicContact CB-CB 4.21Å; C608-V611 HydrophobicContact CB-CG2 4Å; C608-V611 WeakPolarHBondContact O-CB 3.46Å; C608-V611 PolarHBondContact O-N 3.04Å; C608-R612 PolarHBondContact O-N 3.19Å; C608-F628 WeakPolarHBondContact SG-CA 3.44Å
609	P	82.9	Confident	73	Confident	29 Å²	29	79.5 Å²	79.5	19%	0.188	41%	0.412	C	S	.	.	H	α-helix	trans	-57.6	-43.3	-178.6	-25.4	33	0	0	0	113.5	V611 R612 E613 Y640	P609-V611 PolarHBondContact O-N 3.01Å; P609-V611 VanDerWaalsContact O-N 3.13Å; P609-R612 PolarHBondContact O-N 3.41Å; P609-R612 VanDerWaalsContact O-N 3.12Å; P609-E613 PolarHBondContact O-N 2.91Å; P609-Y640 HydrophobicContact CG-CD1 3.49Å; P609-Y640 VanDerWaalsContact CG-CD1 3.49Å; P609-Y640 HydrophobicContact CG-CD2 3.92Å; P609-Y640 HydrophobicContact CG-CE1 3.58Å; P609-Y640 HydrophobicContact CG-CE2 4.05Å; P609-Y640 HydrophobicContact CG-CG 3.65Å
610	H	76.5	Confident	71.2	Confident	21 Å²	21	80.5 Å²	80.5	10%	0.097	42%	0.418	C	S	.	.	H	α-helix	trans	-67.3	-13	-179.9	65.1	-88.2	0	0	0	114.3	I552 C608 S629 N642	I552-H610 HydrophobicContact CG2-CB 4.15Å; C608-H610 VanDerWaalsContact C-N 3.33Å; C608-H610 WeakPolarHBondContact CB-CE1 3.46Å; C608-H610 PolarHBondContact O-N 3.11Å; H610-S629 PolarHBondContact CE1-OG 3.4Å; H610-S629 PolarHBondContact ND1-OG 3Å; H610-N642 HydrophobicContact CB-CB 4.46Å; H610-N642 WeakPolarHBondContact ND1-CB 3.48Å; H610-N642 VanDerWaalsContact ND1-CG 3.27Å; H610-N642 PolarHBondContact ND1-OD1 3.33Å
611	V	76.7	Confident	69.5	Low	14 Å²	14	81.4 Å²	81.4	9%	0.085	43%	0.425	C	S	.	.	H	α-helix	trans	-90.3	-40.1	173.2	164.7	0	0	0	0	110.8	C608 P609 E613 K614 Y624 A627	C608-V611 HydrophobicContact CB-CB 4.21Å; C608-V611 HydrophobicContact CB-CG2 4Å; C608-V611 WeakPolarHBondContact O-CB 3.46Å; C608-V611 PolarHBondContact O-N 3.04Å; P609-V611 PolarHBondContact O-N 3.01Å; P609-V611 VanDerWaalsContact O-N 3.13Å; V611-E613 VanDerWaalsContact C-N 3.34Å; V611-E613 PolarHBondContact O-N 3.46Å; V611-K614 PolarHBondContact O-N 2.85Å; V611-Y624 HydrophobicContact CB-CD1 4.04Å; V611-Y624 HydrophobicContact CB-CE1 4.26Å; V611-Y624 HydrophobicContact CG1-CD1 3.2Å; V611-Y624 HydrophobicContact CG1-CE1 3.42Å; V611-Y624 VanDerWaalsContact CG1-CE1 3.42Å; V611-Y624 HydrophobicContact CG1-CG 4Å; V611-Y624 HydrophobicContact CG2-CD1 3.8Å; V611-Y624 HydrophobicContact CG2-CE1 4.34Å; V611-A627 HydrophobicContact CG2-CB 3.65Å
612	R	66.3	Low	68	Low	160 Å²	160	83.7 Å²	83.7	60%	0.604	43%	0.432	S	S	*	.	H	α-helix	trans	-66.1	-33	-177.8	-68.5	179.5	176	-177.5	0.3	113.1	K606 D607 C608 P609	K606-R612 WeakPolarHBondContact O-CG 3.39Å; K606-R612 PolarHBondContact O-NE 3.1Å; D607-R612 IonicContact OD1-CZ 2.7Å; D607-R612 IonicContact OD1-NH2 2.59Å; D607-R612 PolarHBondContact OD1-NH2 2.83Å; C608-R612 PolarHBondContact O-N 3.19Å; P609-R612 PolarHBondContact O-N 3.41Å; P609-R612 VanDerWaalsContact O-N 3.12Å
613	E	58.5	Low	66.6	Low	171 Å²	171	83.4 Å²	83.4	80%	0.799	43%	0.431	S	S	*	.	S	Bend	trans	-73.6	-25.5	-179.1	-69.7	179.4	169.9	0	0	113.8	P609 V611 G615	P609-E613 PolarHBondContact O-N 2.91Å; V611-E613 VanDerWaalsContact C-N 3.34Å; V611-E613 PolarHBondContact O-N 3.46Å; E613-G615 PolarHBondContact O-N 3.28Å
614	K	53.8	Low	65.6	Low	83 Å²	83	84 Å²	84	36%	0.361	43%	0.43	S	S	.	.	S	Bend	trans	-90.1	93.3	173	-71.6	-175.1	-179.6	-178.2	0	108.5	S553 V611 Y624	S553-K614 PolarHBondContact O-NZ 2.97Å; V611-K614 PolarHBondContact O-N 2.85Å; K614-Y624 PolarHBondContact O-OH 3.41Å
615	G	44.9	Very low	65.1	Low	60 Å²	60	84.2 Å²	84.2	62%	0.619	43%	0.43	S	S	*	.			trans	-45.2	158.7	-176.4	0	0	0	0	0	115.3	E613 G617	E613-G615 PolarHBondContact O-N 3.28Å; G615-G617 PolarHBondContact O-N 3.27Å
616	S	38.2	Very low	65.2	Low	126 Å²	126	84.5 Å²	84.5	88%	0.881	43%	0.429	S	S	*	.			trans	-54.7	58.8	-173.4	59.8	0	0	0	0	116.6
617	G	45.6	Very low	65.4	Low	43 Å²	43	77 Å²	77	44%	0.443	40%	0.397	S	S	.	.			trans	-81.1	125.7	168.8	0	0	0	0	0	109.7	G615 Q619	G615-G617 PolarHBondContact O-N 3.27Å; G617-Q619 PolarHBondContact O-N 2.91Å
618	K	46	Very low	65.8	Low	213 Å²	213	73.7 Å²	73.7	93%	0.926	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-2.1	-179.5	-74.5	-179.7	175.8	178.3	0	115.2
619	Q	45.7	Very low	66.2	Low	173 Å²	173	73.7 Å²	73.7	81%	0.808	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-8.8	-172	-70.8	-177	-10	0	0	115.1	G617	G617-Q619 PolarHBondContact O-N 2.91Å
620	N	55.5	Low	66.8	Low	40 Å²	40	72.4 Å²	72.4	21%	0.214	37%	0.371	C	S	.	.			trans	-121.5	30.4	-172.7	-79.9	-14.3	0	0	0	115.3	D622 L623 Y624	N620-D622 VanDerWaalsContact C-N 3.31Å; N620-D622 PolarHBondContact O-N 3.15Å; N620-L623 HydrophobicContact CB-CB 4.47Å; N620-L623 HydrophobicContact CB-CD1 4.5Å; N620-L623 PolarHBondContact O-N 2.87Å; N620-Y624 HydrophobicContact CB-CE1 4.48Å; N620-Y624 HydrophobicContact CB-CE2 4.33Å; N620-Y624 WeakPolarHBondContact O-CD2 3.29Å; N620-Y624 WeakPolarHBondContact O-CE2 3.44Å; N620-Y624 PolarHBondContact O-N 3.26Å
621	K	57.1	Low	67.6	Low	142 Å²	142	71.5 Å²	71.5	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-59	-41.7	-177.6	-166.1	-178.8	171.9	-166.7	0	112.6	Y624 E625	K621-Y624 PolarHBondContact O-N 2.96Å; K621-E625 PolarHBondContact O-N 2.87Å
622	D	59.9	Low	68.3	Low	82 Å²	82	72.4 Å²	72.4	44%	0.439	37%	0.368	S	S	.	.	H	α-helix	trans	-71.3	-33.2	-175.5	-56	-19.7	0	0	0	112.8	N620 Y624 E625 L626	N620-D622 VanDerWaalsContact C-N 3.31Å; N620-D622 PolarHBondContact O-N 3.15Å; D622-Y624 VanDerWaalsContact C-N 3.33Å; D622-Y624 PolarHBondContact O-N 3.36Å; D622-E625 PolarHBondContact O-N 3.12Å; D622-L626 PolarHBondContact O-N 3.35Å
623	L	64.4	Low	69.2	Low	25 Å²	25	67.9 Å²	67.9	13%	0.131	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-37	174.9	-95.4	154.2	0	0	0	111.9	E423 T424 N620 E625 L626 A627 I644	E423-L623 HydrophobicContact CB-CD1 4.09Å; E423-L623 HydrophobicContact CG-CD1 4.11Å; E423-L623 VanDerWaalsContact OE2-CD1 3.23Å; E423-L623 WeakPolarHBondContact OE2-CD1 3.4Å; T424-L623 HydrophobicContact CG2-CD2 4.27Å; N620-L623 HydrophobicContact CB-CB 4.47Å; N620-L623 HydrophobicContact CB-CD1 4.5Å; N620-L623 PolarHBondContact O-N 2.87Å; L623-E625 VanDerWaalsContact C-N 3.3Å; L623-E625 PolarHBondContact O-N 3.11Å; L623-L626 PolarHBondContact O-N 3.41Å; L623-A627 PolarHBondContact O-N 2.87Å; L623-I644 HydrophobicContact CD2-CD1 3.74Å; L623-I644 HydrophobicContact CD2-CG2 3.94Å
624	Y	73.3	Confident	70.2	Confident	55 Å²	55	63 Å²	63	22%	0.216	33%	0.333	C	S	.	.	H	α-helix	trans	-66.4	-33.9	175.3	-54.7	-40.2	0	0	0	112	G605 V611 K614 N620 K621 D622 L626 A627	G605-Y624 WeakPolarHBondContact CA-O 3.27Å; V611-Y624 HydrophobicContact CB-CD1 4.04Å; V611-Y624 HydrophobicContact CB-CE1 4.26Å; V611-Y624 HydrophobicContact CG1-CD1 3.2Å; V611-Y624 HydrophobicContact CG1-CE1 3.42Å; V611-Y624 VanDerWaalsContact CG1-CE1 3.42Å; V611-Y624 HydrophobicContact CG1-CG 4Å; V611-Y624 HydrophobicContact CG2-CD1 3.8Å; V611-Y624 HydrophobicContact CG2-CE1 4.34Å; K614-Y624 PolarHBondContact O-OH 3.41Å; N620-Y624 HydrophobicContact CB-CE1 4.48Å; N620-Y624 HydrophobicContact CB-CE2 4.33Å; N620-Y624 WeakPolarHBondContact O-CD2 3.29Å; N620-Y624 WeakPolarHBondContact O-CE2 3.44Å; N620-Y624 PolarHBondContact O-N 3.26Å; K621-Y624 PolarHBondContact O-N 2.96Å; D622-Y624 VanDerWaalsContact C-N 3.33Å; D622-Y624 PolarHBondContact O-N 3.36Å; Y624-L626 PolarHBondContact O-N 3.32Å; Y624-A627 PolarHBondContact O-N 3.5Å
625	E	81.5	Confident	71.1	Confident	92 Å²	92	62.3 Å²	62.3	43%	0.43	35%	0.35	S	S	.	.	H	α-helix	trans	-71	-16.3	179.8	-67.2	-174.2	-171.2	0	0	113.1	K621 D622 L623	K621-E625 PolarHBondContact O-N 2.87Å; D622-E625 PolarHBondContact O-N 3.12Å; L623-E625 VanDerWaalsContact C-N 3.3Å; L623-E625 PolarHBondContact O-N 3.11Å
626	L	87.1	Confident	72.1	Confident	18 Å²	18	67.6 Å²	67.6	9%	0.094	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-1.7	179.5	-58.6	-179.7	0	0	0	113.9	D622 L623 Y624 I644 A645 K648 F651	D622-L626 PolarHBondContact O-N 3.35Å; L623-L626 PolarHBondContact O-N 3.41Å; Y624-L626 PolarHBondContact O-N 3.32Å; L626-I644 HydrophobicContact CB-CG2 4.38Å; L626-A645 HydrophobicContact CB-CB 4.42Å; L626-A645 PolarHBondContact O-N 3.48Å; L626-K648 VanDerWaalsContact CD2-CA 3.44Å; L626-K648 HydrophobicContact CD2-CB 3.94Å; L626-F651 HydrophobicContact CD2-CB 4.09Å; L626-F651 WeakPolarHBondContact O-CD2 3.34Å
627	A	89.2	Confident	73.8	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.008	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	133	-176.8	0	0	0	0	0	111.8	G605 V611 L623 Y624 F643 F651	G605-A627 PolarHBondContact N-O 3.02Å; V611-A627 HydrophobicContact CG2-CB 3.65Å; L623-A627 PolarHBondContact O-N 2.87Å; Y624-A627 PolarHBondContact O-N 3.5Å; A627-F643 WeakPolarHBondContact CA-O 3.3Å; A627-F651 WeakPolarHBondContact O-CE2 3.26Å
628	F	93.6	Very high	75.5	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	155.5	169.5	64.1	-79.5	0	0	0	110.8	F549 L602 L603 M604 C608 F643 A645 F651 W654 T655 L658	F549-F628 HydrophobicContact CE1-CE1 4.16Å; F549-F628 AromaticContact CE1-CZ 3.85Å; F549-F628 HydrophobicContact CE1-CZ 3.85Å; F549-F628 HydrophobicContact CZ-CZ 4.18Å; L602-F628 HydrophobicContact CD1-CB 4.38Å; L602-F628 HydrophobicContact CD1-CD2 3.97Å; L603-F628 CarbonylContact O-C 3.58Å; L603-F628 WeakPolarHBondContact O-CA 3.35Å; L603-F628 WeakPolarHBondContact O-CB 3.17Å; M604-F628 HydrophobicContact CG-CB 4.23Å; C608-F628 WeakPolarHBondContact SG-CA 3.44Å; F628-F643 HydrophobicContact CD1-CB 3.73Å; F628-F643 HydrophobicContact CD2-CB 3.83Å; F628-F643 AromaticContact CD2-CD2 3.76Å; F628-F643 HydrophobicContact CD2-CD2 3.76Å; F628-F643 AromaticContact CD2-CG 3.91Å; F628-F643 HydrophobicContact CD2-CG 3.91Å; F628-F643 HydrophobicContact CE1-CB 3.41Å; F628-F643 VanDerWaalsContact CE1-CB 3.41Å; F628-F643 HydrophobicContact CE1-CG 4.1Å; F628-F643 HydrophobicContact CE2-CB 3.52Å; F628-F643 AromaticContact CE2-CD1 3.79Å; F628-F643 HydrophobicContact CE2-CD1 3.79Å; F628-F643 AromaticContact CE2-CD2 3.48Å; F628-F643 HydrophobicContact CE2-CD2 3.48Å; F628-F643 VanDerWaalsContact CE2-CD2 3.48Å; F628-F643 HydrophobicContact CE2-CE1 4.31Å; F628-F643 HydrophobicContact CE2-CE2 4.06Å; F628-F643 AromaticContact CE2-CG 3.32Å; F628-F643 HydrophobicContact CE2-CG 3.32Å; F628-F643 HydrophobicContact CE2-CZ 4.44Å; F628-F643 HydrophobicContact CG-CB 3.94Å; F628-F643 HydrophobicContact CZ-CB 3.3Å; F628-F643 AromaticContact CZ-CD1 3.66Å; F628-F643 HydrophobicContact CZ-CD1 3.66Å; F628-F643 HydrophobicContact CZ-CD2 4.11Å; F628-F643 HydrophobicContact CZ-CE1 4.45Å; F628-F643 AromaticContact CZ-CG 3.45Å; F628-F643 HydrophobicContact CZ-CG 3.45Å; F628-F643 VanDerWaalsContact CZ-CG 3.45Å; F628-F643 PolarHBondContact N-O 3.36Å; F628-F643 WeakPolarHBondContact O-CA 3.47Å; F628-F643 WeakPolarHBondContact O-CB 3.27Å; F628-F643 PolarHBondContact O-N 3.45Å; F628-F643 VanDerWaalsContact O-O 3.09Å; F628-A645 HydrophobicContact CE1-CB 4.17Å; F628-F651 HydrophobicContact CB-CE2 3.99Å; F628-F651 AromaticContact CD1-CD2 3.78Å; F628-F651 HydrophobicContact CD1-CD2 3.78Å; F628-F651 AromaticContact CD1-CE2 3.97Å; F628-F651 HydrophobicContact CD1-CE2 3.97Å; F628-F651 HydrophobicContact CE1-CD2 4.46Å; F628-F651 HydrophobicContact CG-CE2 4.4Å; F628-W654 HydrophobicContact CE1-CB 4.41Å; F628-W654 HydrophobicContact CE2-CB 4.43Å; F628-W654 HydrophobicContact CZ-CB 3.87Å; F628-W654 HydrophobicContact CZ-CE3 4.37Å; F628-W654 HydrophobicContact CZ-CG 4.36Å; F628-T655 HydrophobicContact CB-CG2 3.89Å; F628-T655 HydrophobicContact CD1-CG2 4.16Å; F628-T655 HydrophobicContact CD2-CG2 4.26Å; F628-T655 HydrophobicContact CG-CG2 3.86Å; F628-L658 HydrophobicContact CD2-CD1 4.05Å; F628-L658 HydrophobicContact CE2-CD1 3.69Å
629	S	93.7	Very high	77.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.6	178.8	-62.7	0	0	0	0	110.8	L603 H610 L641 N642	L603-S629 PolarHBondContact N-O 3.27Å; L603-S629 PolarHBondContact O-N 2.81Å; H610-S629 PolarHBondContact CE1-OG 3.4Å; H610-S629 PolarHBondContact ND1-OG 3Å; S629-L641 CarbonylContact C-O 3.59Å; S629-L641 VanDerWaalsContact CA-O 3.26Å; S629-L641 WeakPolarHBondContact CA-O 3.37Å; S629-N642 WeakPolarHBondContact CB-OD1 3.43Å; S629-N642 PolarHBondContact OG-OD1 2.86Å
630	I	94.9	Very high	79.5	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.5	168.9	-58.3	174	0	0	0	106.8	L573 L594 I599 L602 Y640 L641 F643 L658	L573-I630 HydrophobicContact CD1-CD1 3.56Å; L594-I630 HydrophobicContact CD2-CG2 4.19Å; I599-I630 HydrophobicContact CB-CG2 4.18Å; I599-I630 HydrophobicContact CD1-CG2 3.85Å; I599-I630 HydrophobicContact CG1-CG2 3.72Å; I599-I630 HydrophobicContact CG2-CG2 3.49Å; I599-I630 VanDerWaalsContact CG2-CG2 3.49Å; L602-I630 HydrophobicContact CD1-CG1 4.33Å; I630-Y640 CarbonylContact O-C 3.5Å; I630-Y640 WeakPolarHBondContact O-CA 3.32Å; I630-L641 HydrophobicContact CB-CB 4.32Å; I630-L641 PolarHBondContact N-O 2.83Å; I630-L641 PolarHBondContact O-N 2.89Å; I630-F643 HydrophobicContact CB-CE2 4.45Å; I630-F643 HydrophobicContact CD1-CE2 3.65Å; I630-F643 HydrophobicContact CD1-CZ 3.89Å; I630-F643 HydrophobicContact CG1-CE2 3.79Å; I630-L658 HydrophobicContact CD1-CD1 3.82Å; I630-L658 HydrophobicContact CD1-CD2 3.73Å; I630-L658 HydrophobicContact CD1-CG 4.44Å; I630-L658 HydrophobicContact CG1-CD1 4.04Å
631	S	93.8	Very high	81.1	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	137.8	169.2	84.4	0	0	0	0	110.1	R600 A601 E638 A639 Y640	R600-S631 PolarHBondContact N-O 3.39Å; A601-S631 PolarHBondContact N-O 3.27Å; A601-S631 PolarHBondContact N-OG 3.39Å; A601-S631 PolarHBondContact O-N 2.8Å; S631-E638 WeakPolarHBondContact CB-OE1 3.32Å; S631-E638 PolarHBondContact OG-OE1 3.27Å; S631-A639 VanDerWaalsContact CA-O 3.31Å; S631-A639 WeakPolarHBondContact CA-O 3.4Å; S631-Y640 VanDerWaalsContact CB-CE1 3.48Å
632	Y	91	Very high	82.7	Confident	33 Å²	33	51.4 Å²	51.4	13%	0.129	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	158.6	-175	65.3	-88	0	0	0	112.1	L594 D598 H634 A639 L641	L594-Y632 HydrophobicContact CD1-CD1 4.01Å; L594-Y632 HydrophobicContact CD1-CD2 3.42Å; L594-Y632 VanDerWaalsContact CD1-CD2 3.42Å; L594-Y632 HydrophobicContact CD1-CE1 4.42Å; L594-Y632 HydrophobicContact CD1-CE2 3.89Å; L594-Y632 HydrophobicContact CD1-CG 3.48Å; L594-Y632 VanDerWaalsContact CD1-CG 3.48Å; L594-Y632 HydrophobicContact CD2-CD1 3.86Å; L594-Y632 HydrophobicContact CD2-CE1 4.26Å; L594-Y632 HydrophobicContact CD2-CG 4.13Å; L594-Y632 HydrophobicContact CG-CG 4.47Å; D598-Y632 CarbonylContact O-C 3.54Å; D598-Y632 WeakPolarHBondContact O-CA 3.22Å; D598-Y632 VanDerWaalsContact O-CB 3.26Å; D598-Y632 WeakPolarHBondContact O-CB 3.25Å; Y632-H634 HydrophobicContact CD2-CB 4.42Å; Y632-H634 HydrophobicContact CE2-CB 4.04Å; Y632-H634 PolarHBondContact O-N 3.14Å; Y632-A639 HydrophobicContact CD1-CB 4.4Å; Y632-A639 HydrophobicContact CD2-CB 4.22Å; Y632-A639 HydrophobicContact CE1-CB 3.89Å; Y632-A639 HydrophobicContact CE2-CB 3.69Å; Y632-A639 PolarHBondContact N-O 3.35Å; Y632-A639 PolarHBondContact O-N 2.82Å; Y632-L641 HydrophobicContact CE1-CB 4.12Å
633	D	85.9	Confident	84.1	Confident	65 Å²	65	47.5 Å²	47.5	35%	0.348	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	113.7	174.8	-79	-55.4	0	0	0	111	D598 R600	D598-D633 HydrophobicContact CB-CB 4.33Å; D598-D633 PolarHBondContact O-N 3.46Å; R600-D633 IonicContact CZ-OD1 3.77Å; R600-D633 VanDerWaalsContact NE-CG 3.31Å; R600-D633 IonicContact NE-OD1 3.47Å; R600-D633 PolarHBondContact NE-OD1 3.48Å; R600-D633 IonicContact NE-OD2 2.93Å; R600-D633 IonicContact NH2-OD1 3.59Å; R600-D633 PolarHBondContact NH2-OD1 3.34Å
634	H	78.1	Confident	85.1	Confident	69 Å²	69	47.6 Å²	47.6	32%	0.319	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	72.4	170.8	-166.6	68.7	0	0	0	110.4	M67 Y632 E636 E637 A639	M67-H634 PolarHBondContact O-NE2 3.38Å; Y632-H634 HydrophobicContact CD2-CB 4.42Å; Y632-H634 HydrophobicContact CE2-CB 4.04Å; Y632-H634 PolarHBondContact O-N 3.14Å; H634-E636 PolarHBondContact O-N 3Å; H634-E637 PolarHBondContact N-O 3.23Å; H634-E637 VanDerWaalsContact N-O 3.1Å; H634-A639 HydrophobicContact CB-CB 3.55Å
635	G	74.5	Confident	85.8	Confident	68 Å²	68	45 Å²	45	70%	0.701	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.8	-115	-176.3	0	0	0	0	0	112.2
636	E	65.6	Low	85.6	Confident	171 Å²	171	42.7 Å²	42.7	80%	0.799	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-9.6	177.7	-64.1	-170.8	169.6	0	0	113	H634	H634-E636 PolarHBondContact O-N 3Å
637	E	72.9	Confident	85.2	Confident	152 Å²	152	43.7 Å²	43.7	71%	0.71	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	152.2	-177.4	-64.5	-174.1	169.6	0	0	111.7	H634	H634-E637 PolarHBondContact N-O 3.23Å; H634-E637 VanDerWaalsContact N-O 3.1Å
638	E	81.6	Confident	85	Confident	80 Å²	80	48.4 Å²	48.4	37%	0.374	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	119	171.4	-173.3	170.2	-156.5	0	0	109.2	R600 S631 Y640	R600-E638 IonicContact NH1-OE2 2.87Å; S631-E638 WeakPolarHBondContact CB-OE1 3.32Å; S631-E638 PolarHBondContact OG-OE1 3.27Å; E638-Y640 VanDerWaalsContact CD-OH 3.31Å; E638-Y640 HydrophobicContact CG-CE1 4.33Å; E638-Y640 HydrophobicContact CG-CE2 4.15Å; E638-Y640 PolarHBondContact OE2-OH 3.36Å
639	A	86.6	Confident	84.6	Confident	20 Å²	20	55.8 Å²	55.8	17%	0.165	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	162.8	175.3	0	0	0	0	0	110.9	S631 Y632 H634	S631-A639 VanDerWaalsContact CA-O 3.31Å; S631-A639 WeakPolarHBondContact CA-O 3.4Å; Y632-A639 HydrophobicContact CD1-CB 4.4Å; Y632-A639 HydrophobicContact CD2-CB 4.22Å; Y632-A639 HydrophobicContact CE1-CB 3.89Å; Y632-A639 HydrophobicContact CE2-CB 3.69Å; Y632-A639 PolarHBondContact N-O 3.35Å; Y632-A639 PolarHBondContact O-N 2.82Å; H634-A639 HydrophobicContact CB-CB 3.55Å
640	Y	88.5	Confident	84.4	Confident	83 Å²	83	57 Å²	57	33%	0.325	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	126.6	-176	-59.9	-88.9	0	0	0	111.3	L603 P609 I630 S631 E638	L603-Y640 HydrophobicContact CD1-CD1 4.1Å; L603-Y640 HydrophobicContact CD1-CE1 3.65Å; P609-Y640 HydrophobicContact CG-CD1 3.49Å; P609-Y640 VanDerWaalsContact CG-CD1 3.49Å; P609-Y640 HydrophobicContact CG-CD2 3.92Å; P609-Y640 HydrophobicContact CG-CE1 3.58Å; P609-Y640 HydrophobicContact CG-CE2 4.05Å; P609-Y640 HydrophobicContact CG-CG 3.65Å; I630-Y640 CarbonylContact O-C 3.5Å; I630-Y640 WeakPolarHBondContact O-CA 3.32Å; S631-Y640 VanDerWaalsContact CB-CE1 3.48Å; E638-Y640 VanDerWaalsContact CD-OH 3.31Å; E638-Y640 HydrophobicContact CG-CE1 4.33Å; E638-Y640 HydrophobicContact CG-CE2 4.15Å; E638-Y640 PolarHBondContact OE2-OH 3.36Å
641	L	90.5	Very high	84.3	Confident	15 Å²	15	57.8 Å²	57.8	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	110.3	165	-171.7	61.7	0	0	0	107.9	W562 Y575 L594 S629 I630 Y632 F643	W562-L641 HydrophobicContact CH2-CD1 3.68Å; W562-L641 HydrophobicContact CH2-CD2 4.12Å; W562-L641 HydrophobicContact CH2-CG 3.85Å; W562-L641 HydrophobicContact CZ3-CD1 3.95Å; W562-L641 HydrophobicContact CZ3-CD2 4.37Å; W562-L641 HydrophobicContact CZ3-CG 4.4Å; Y575-L641 HydrophobicContact CD1-CD2 4.08Å; Y575-L641 HydrophobicContact CD2-CD1 4.28Å; Y575-L641 HydrophobicContact CE1-CD1 4.32Å; Y575-L641 HydrophobicContact CE1-CD2 4Å; Y575-L641 HydrophobicContact CE2-CD1 3.89Å; L594-L641 HydrophobicContact CD2-CD2 4.27Å; S629-L641 CarbonylContact C-O 3.59Å; S629-L641 VanDerWaalsContact CA-O 3.26Å; S629-L641 WeakPolarHBondContact CA-O 3.37Å; I630-L641 HydrophobicContact CB-CB 4.32Å; I630-L641 PolarHBondContact N-O 2.83Å; I630-L641 PolarHBondContact O-N 2.89Å; Y632-L641 HydrophobicContact CE1-CB 4.12Å; L641-F643 HydrophobicContact CB-CE2 4.02Å; L641-F643 HydrophobicContact CD2-CE2 3.83Å; L641-F643 HydrophobicContact CD2-CZ 3.52Å; L641-F643 HydrophobicContact CG-CD2 4.5Å; L641-F643 HydrophobicContact CG-CE2 3.57Å; L641-F643 HydrophobicContact CG-CZ 3.68Å; L641-F643 VanDerWaalsContact O-CD2 3.28Å; L641-F643 WeakPolarHBondContact O-CD2 3.33Å; L641-F643 VanDerWaalsContact O-CE2 3.31Å; L641-F643 WeakPolarHBondContact O-CE2 3.48Å
642	N	89.6	Confident	84.3	Confident	47 Å²	47	59.7 Å²	59.7	25%	0.251	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	135.3	-170.1	-64.8	-57.8	0	0	0	111.3	I552 W562 H610 S629	I552-N642 VanDerWaalsContact CD1-C 3.48Å; I552-N642 HydrophobicContact CD1-CB 3.35Å; I552-N642 WeakPolarHBondContact CD1-O 3.45Å; W562-N642 WeakPolarHBondContact CZ2-O 3.42Å; H610-N642 HydrophobicContact CB-CB 4.46Å; H610-N642 WeakPolarHBondContact ND1-CB 3.48Å; H610-N642 VanDerWaalsContact ND1-CG 3.27Å; H610-N642 PolarHBondContact ND1-OD1 3.33Å; S629-N642 WeakPolarHBondContact CB-OD1 3.43Å; S629-N642 PolarHBondContact OG-OD1 2.86Å
643	F	90.4	Very high	84.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	146.5	-176.9	-59.2	-103	0	0	0	111.5	F549 W562 C564 A627 F628 I630 L641 W654	F549-F643 HydrophobicContact CD1-CB 4.4Å; F549-F643 AromaticContact CD1-CD1 3.88Å; F549-F643 HydrophobicContact CD1-CD1 3.88Å; F549-F643 AromaticContact CD2-CD1 3.96Å; F549-F643 HydrophobicContact CD2-CD1 3.96Å; F549-F643 HydrophobicContact CD2-CE1 4.19Å; F549-F643 HydrophobicContact CE1-CB 4.48Å; F549-F643 AromaticContact CE1-CD1 3.79Å; F549-F643 HydrophobicContact CE1-CD1 3.79Å; F549-F643 AromaticContact CE2-CD1 3.88Å; F549-F643 HydrophobicContact CE2-CD1 3.88Å; F549-F643 AromaticContact CE2-CE1 3.95Å; F549-F643 HydrophobicContact CE2-CE1 3.95Å; F549-F643 AromaticContact CG-CD1 3.95Å; F549-F643 HydrophobicContact CG-CD1 3.95Å; F549-F643 AromaticContact CZ-CD1 3.78Å; F549-F643 HydrophobicContact CZ-CD1 3.78Å; F549-F643 HydrophobicContact CZ-CE1 4.15Å; W562-F643 AromaticContact CH2-CD1 3.67Å; W562-F643 HydrophobicContact CH2-CD1 3.67Å; W562-F643 AromaticContact CH2-CE1 3.23Å; W562-F643 HydrophobicContact CH2-CE1 3.23Å; W562-F643 HydrophobicContact CH2-CE2 4.3Å; W562-F643 HydrophobicContact CH2-CG 4.38Å; W562-F643 AromaticContact CH2-CZ 3.59Å; W562-F643 HydrophobicContact CH2-CZ 3.59Å; W562-F643 AromaticContact CZ2-CD1 3.53Å; W562-F643 HydrophobicContact CZ2-CD1 3.53Å; W562-F643 AromaticContact CZ2-CE1 3.64Å; W562-F643 HydrophobicContact CZ2-CE1 3.64Å; W562-F643 HydrophobicContact CZ2-CG 4.12Å; W562-F643 HydrophobicContact CZ2-CZ 4.28Å; W562-F643 HydrophobicContact CZ3-CE1 4.2Å; C564-F643 HydrophobicContact CB-CE1 4.14Å; A627-F643 WeakPolarHBondContact CA-O 3.3Å; F628-F643 HydrophobicContact CD1-CB 3.73Å; F628-F643 HydrophobicContact CD2-CB 3.83Å; F628-F643 AromaticContact CD2-CD2 3.76Å; F628-F643 HydrophobicContact CD2-CD2 3.76Å; F628-F643 AromaticContact CD2-CG 3.91Å; F628-F643 HydrophobicContact CD2-CG 3.91Å; F628-F643 HydrophobicContact CE1-CB 3.41Å; F628-F643 VanDerWaalsContact CE1-CB 3.41Å; F628-F643 HydrophobicContact CE1-CG 4.1Å; F628-F643 HydrophobicContact CE2-CB 3.52Å; F628-F643 AromaticContact CE2-CD1 3.79Å; F628-F643 HydrophobicContact CE2-CD1 3.79Å; F628-F643 AromaticContact CE2-CD2 3.48Å; F628-F643 HydrophobicContact CE2-CD2 3.48Å; F628-F643 VanDerWaalsContact CE2-CD2 3.48Å; F628-F643 HydrophobicContact CE2-CE1 4.31Å; F628-F643 HydrophobicContact CE2-CE2 4.06Å; F628-F643 AromaticContact CE2-CG 3.32Å; F628-F643 HydrophobicContact CE2-CG 3.32Å; F628-F643 HydrophobicContact CE2-CZ 4.44Å; F628-F643 HydrophobicContact CG-CB 3.94Å; F628-F643 HydrophobicContact CZ-CB 3.3Å; F628-F643 AromaticContact CZ-CD1 3.66Å; F628-F643 HydrophobicContact CZ-CD1 3.66Å; F628-F643 HydrophobicContact CZ-CD2 4.11Å; F628-F643 HydrophobicContact CZ-CE1 4.45Å; F628-F643 AromaticContact CZ-CG 3.45Å; F628-F643 HydrophobicContact CZ-CG 3.45Å; F628-F643 VanDerWaalsContact CZ-CG 3.45Å; F628-F643 PolarHBondContact N-O 3.36Å; F628-F643 WeakPolarHBondContact O-CA 3.47Å; F628-F643 WeakPolarHBondContact O-CB 3.27Å; F628-F643 PolarHBondContact O-N 3.45Å; F628-F643 VanDerWaalsContact O-O 3.09Å; I630-F643 HydrophobicContact CB-CE2 4.45Å; I630-F643 HydrophobicContact CD1-CE2 3.65Å; I630-F643 HydrophobicContact CD1-CZ 3.89Å; I630-F643 HydrophobicContact CG1-CE2 3.79Å; L641-F643 HydrophobicContact CB-CE2 4.02Å; L641-F643 HydrophobicContact CD2-CE2 3.83Å; L641-F643 HydrophobicContact CD2-CZ 3.52Å; L641-F643 HydrophobicContact CG-CD2 4.5Å; L641-F643 HydrophobicContact CG-CE2 3.57Å; L641-F643 HydrophobicContact CG-CZ 3.68Å; L641-F643 VanDerWaalsContact O-CD2 3.28Å; L641-F643 WeakPolarHBondContact O-CD2 3.33Å; L641-F643 VanDerWaalsContact O-CE2 3.31Å; L641-F643 WeakPolarHBondContact O-CE2 3.48Å; F643-W654 HydrophobicContact CE1-CZ3 4.47Å
644	I	85.8	Confident	85	Confident	27 Å²	27	55.5 Å²	55.5	14%	0.138	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	115.5	160.9	-64.5	173.5	0	0	0	106.3	I552 L623 L626	I552-I644 HydrophobicContact CD1-CD1 4.36Å; I552-I644 HydrophobicContact CD1-CG1 4.06Å; I552-I644 HydrophobicContact CG1-CD1 3.63Å; I552-I644 HydrophobicContact CG1-CG1 3.78Å; I552-I644 HydrophobicContact CG2-CD1 4.45Å; L623-I644 HydrophobicContact CD2-CD1 3.74Å; L623-I644 HydrophobicContact CD2-CG2 3.94Å; L626-I644 HydrophobicContact CB-CG2 4.38Å
645	A	86.3	Confident	85.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.266	C	S	.	.			trans	-66.4	144.4	177.9	0	0	0	0	0	111	L626 F628 S647 F651	L626-A645 HydrophobicContact CB-CB 4.42Å; L626-A645 PolarHBondContact O-N 3.48Å; F628-A645 HydrophobicContact CE1-CB 4.17Å; A645-S647 VanDerWaalsContact C-N 3.28Å; A645-S647 PolarHBondContact O-N 3.36Å; A645-F651 VanDerWaalsContact CB-CA 3.5Å; A645-F651 HydrophobicContact CB-CB 3.56Å; A645-F651 HydrophobicContact CB-CD2 4.27Å; A645-F651 HydrophobicContact CB-CG 4.44Å
646	P	77.9	Confident	86.9	Confident	44 Å²	44	49.4 Å²	49.4	29%	0.286	23%	0.233	S	C	.	.	S	Bend	trans	-70.5	-26.3	178.1	26.6	-32.2	0	0	0	112.6	M547 D650	M547-P646 HydrophobicContact CE-CG 3.39Å; M547-P646 HydrophobicContact SD-CG 3.78Å; P646-D650 HydrophobicContact CG-CB 4.11Å
647	S	79.6	Confident	88.4	Confident	39 Å²	39	41.2 Å²	41.2	27%	0.273	20%	0.195	S	C	.	.	S	Bend	trans	-143.4	162.1	176.2	83.2	0	0	0	0	111.7	A645 R649 D650 F651	A645-S647 VanDerWaalsContact C-N 3.28Å; A645-S647 PolarHBondContact O-N 3.36Å; S647-R649 VanDerWaalsContact C-N 3.25Å; S647-R649 PolarHBondContact O-N 3.36Å; S647-R649 PolarHBondContact OG-N 2.85Å; S647-D650 WeakPolarHBondContact CB-OD2 3.37Å; S647-D650 PolarHBondContact O-N 3.33Å; S647-D650 VanDerWaalsContact OG-CG 3.23Å; S647-D650 PolarHBondContact OG-N 3.13Å; S647-D650 VanDerWaalsContact OG-N 3.08Å; S647-D650 PolarHBondContact OG-OD2 3.23Å; S647-F651 WeakPolarHBondContact O-CB 3.48Å; S647-F651 PolarHBondContact O-N 2.94Å
648	K	83.6	Confident	89.5	Confident	100 Å²	100	34.1 Å²	34.1	44%	0.435	16%	0.162	S	C	.	.	H	α-helix	trans	-62.1	-33.6	174.6	-170.8	169.5	-179.6	170.7	0	112.6	L626 F651 Y652	L626-K648 VanDerWaalsContact CD2-CA 3.44Å; L626-K648 HydrophobicContact CD2-CB 3.94Å; K648-F651 WeakPolarHBondContact O-CB 3.45Å; K648-Y652 HydrophobicContact CD-CE2 4.32Å; K648-Y652 WeakPolarHBondContact CE-OH 3.29Å; K648-Y652 HydrophobicContact CG-CD2 4.32Å; K648-Y652 HydrophobicContact CG-CE2 3.72Å; K648-Y652 VanDerWaalsContact O-CD2 3.25Å; K648-Y652 WeakPolarHBondContact O-CD2 3.47Å; K648-Y652 PolarHBondContact O-N 3.17Å; K648-Y652 VanDerWaalsContact O-N 3.13Å
649	R	85.9	Confident	90.2	Very high	156 Å²	156	31 Å²	31	59%	0.589	15%	0.149	S	C	*	.	H	α-helix	trans	-64.1	-48.1	173.6	176	-179.9	169	137.3	0.1	110.4	S647 F651 Y652 L653	S647-R649 VanDerWaalsContact C-N 3.25Å; S647-R649 PolarHBondContact O-N 3.36Å; S647-R649 PolarHBondContact OG-N 2.85Å; R649-F651 VanDerWaalsContact C-N 3.32Å; R649-F651 PolarHBondContact O-N 2.94Å; R649-Y652 PolarHBondContact O-N 3.33Å; R649-L653 HydrophobicContact CG-CD1 4.1Å; R649-L653 HydrophobicContact CG-CG 4.4Å; R649-L653 WeakPolarHBondContact O-CG 3.43Å; R649-L653 PolarHBondContact O-N 3.32Å
650	D	90.4	Very high	90.6	Very high	24 Å²	24	30.2 Å²	30.2	13%	0.128	14%	0.143	C	C	.	.	H	α-helix	trans	-67.5	-36.9	-178.6	-61.8	-51.2	0	0	0	111.8	M547 P646 S647 Y652 L653 W654	M547-D650 HydrophobicContact CE-CB 3.88Å; M547-D650 HydrophobicContact SD-CB 3.72Å; P646-D650 HydrophobicContact CG-CB 4.11Å; S647-D650 WeakPolarHBondContact CB-OD2 3.37Å; S647-D650 PolarHBondContact O-N 3.33Å; S647-D650 VanDerWaalsContact OG-CG 3.23Å; S647-D650 PolarHBondContact OG-N 3.13Å; S647-D650 VanDerWaalsContact OG-N 3.08Å; S647-D650 PolarHBondContact OG-OD2 3.23Å; D650-Y652 VanDerWaalsContact C-N 3.32Å; D650-Y652 PolarHBondContact O-N 3.1Å; D650-L653 PolarHBondContact O-N 2.86Å; D650-W654 WeakPolarHBondContact O-CB 3.33Å; D650-W654 PolarHBondContact O-N 2.74Å
651	F	92.6	Very high	90.9	Very high	19 Å²	19	27.6 Å²	27.6	8%	0.083	13%	0.134	C	C	.	.	H	α-helix	trans	-52	-51.8	169.5	177	-99.9	0	0	0	111.2	M604 L626 A627 F628 A645 S647 K648 R649 T655	M604-F651 HydrophobicContact CB-CZ 4.34Å; M604-F651 HydrophobicContact CG-CZ 4.22Å; M604-F651 HydrophobicContact SD-CZ 4.19Å; L626-F651 HydrophobicContact CD2-CB 4.09Å; L626-F651 WeakPolarHBondContact O-CD2 3.34Å; A627-F651 WeakPolarHBondContact O-CE2 3.26Å; F628-F651 HydrophobicContact CB-CE2 3.99Å; F628-F651 AromaticContact CD1-CD2 3.78Å; F628-F651 HydrophobicContact CD1-CD2 3.78Å; F628-F651 AromaticContact CD1-CE2 3.97Å; F628-F651 HydrophobicContact CD1-CE2 3.97Å; F628-F651 HydrophobicContact CE1-CD2 4.46Å; F628-F651 HydrophobicContact CG-CE2 4.4Å; A645-F651 VanDerWaalsContact CB-CA 3.5Å; A645-F651 HydrophobicContact CB-CB 3.56Å; A645-F651 HydrophobicContact CB-CD2 4.27Å; A645-F651 HydrophobicContact CB-CG 4.44Å; S647-F651 WeakPolarHBondContact O-CB 3.48Å; S647-F651 PolarHBondContact O-N 2.94Å; K648-F651 WeakPolarHBondContact O-CB 3.45Å; R649-F651 VanDerWaalsContact C-N 3.32Å; R649-F651 PolarHBondContact O-N 2.94Å; F651-T655 HydrophobicContact CD2-CG2 4.14Å; F651-T655 HydrophobicContact CE1-CG2 4.37Å; F651-T655 HydrophobicContact CE2-CG2 3.84Å; F651-T655 HydrophobicContact CZ-CG2 3.95Å; F651-T655 WeakPolarHBondContact O-CB 3.39Å; F651-T655 VanDerWaalsContact O-CG2 3.31Å; F651-T655 WeakPolarHBondContact O-CG2 3.41Å; F651-T655 PolarHBondContact O-N 3.39Å; F651-T655 PolarHBondContact O-OG1 3.47Å
652	Y	94	Very high	91	Very high	41 Å²	41	29.6 Å²	29.6	16%	0.161	14%	0.144	C	C	.	.	H	α-helix	trans	-64.3	-44.8	178.7	-67.3	-31.4	0	0	0	113.1	K648 R649 D650 W654 T655 D656 E669 Q670	K648-Y652 HydrophobicContact CD-CE2 4.32Å; K648-Y652 WeakPolarHBondContact CE-OH 3.29Å; K648-Y652 HydrophobicContact CG-CD2 4.32Å; K648-Y652 HydrophobicContact CG-CE2 3.72Å; K648-Y652 VanDerWaalsContact O-CD2 3.25Å; K648-Y652 WeakPolarHBondContact O-CD2 3.47Å; K648-Y652 PolarHBondContact O-N 3.17Å; K648-Y652 VanDerWaalsContact O-N 3.13Å; R649-Y652 PolarHBondContact O-N 3.33Å; D650-Y652 VanDerWaalsContact C-N 3.32Å; D650-Y652 PolarHBondContact O-N 3.1Å; Y652-W654 PolarHBondContact O-N 3.48Å; Y652-T655 PolarHBondContact O-OG1 3.47Å; Y652-D656 WeakPolarHBondContact O-CB 3.49Å; Y652-D656 VanDerWaalsContact O-CG 3.23Å; Y652-D656 PolarHBondContact O-N 2.94Å; Y652-E669 HydrophobicContact CE2-CB 3.91Å; Y652-Q670 HydrophobicContact CD2-CB 3.98Å; Y652-Q670 HydrophobicContact CG-CB 4.19Å
653	L	94.1	Very high	91.1	Very high	7 Å²	7	30.2 Å²	30.2	4%	0.037	16%	0.162	C	C	.	.	H	α-helix	trans	-61.8	-43.5	179.3	-67.4	178.7	0	0	0	112	R649 D650 G657 Q670	R649-L653 HydrophobicContact CG-CD1 4.1Å; R649-L653 HydrophobicContact CG-CG 4.4Å; R649-L653 WeakPolarHBondContact O-CG 3.43Å; R649-L653 PolarHBondContact O-N 3.32Å; D650-L653 PolarHBondContact O-N 2.86Å; L653-G657 PolarHBondContact O-N 2.6Å; L653-Q670 HydrophobicContact CD2-CG 4.12Å
654	W	96.1	Very high	91.1	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-71.7	-47.8	-179.7	-88.7	82.8	0	0	0	112.8	L543 M547 F549 C564 F628 F643 D650 Y652 D656 G657 L658	L543-W654 HydrophobicContact CD2-CD2 3.59Å; L543-W654 HydrophobicContact CD2-CE3 3.35Å; L543-W654 HydrophobicContact CD2-CG 4.24Å; L543-W654 HydrophobicContact CD2-CH2 4.09Å; L543-W654 HydrophobicContact CD2-CZ2 4.3Å; L543-W654 HydrophobicContact CD2-CZ3 3.64Å; M547-W654 HydrophobicContact CB-CZ2 3.43Å; M547-W654 VanDerWaalsContact CB-CZ2 3.43Å; M547-W654 PolarHBondContact SD-NE1 2.95Å; F549-W654 HydrophobicContact CE1-CD2 4.47Å; F549-W654 HydrophobicContact CE2-CD2 4.3Å; F549-W654 AromaticContact CE2-CE2 3.98Å; F549-W654 HydrophobicContact CE2-CE3 4.32Å; F549-W654 AromaticContact CE2-CH2 3.78Å; F549-W654 HydrophobicContact CE2-CH2 3.78Å; F549-W654 AromaticContact CE2-CZ2 3.75Å; F549-W654 HydrophobicContact CE2-CZ2 3.75Å; F549-W654 HydrophobicContact CE2-CZ3 4.06Å; F549-W654 AromaticContact CZ-CD2 3.53Å; F549-W654 HydrophobicContact CZ-CD2 3.53Å; F549-W654 AromaticContact CZ-CE2 3.48Å; F549-W654 VanDerWaalsContact CZ-CE2 3.48Å; F549-W654 AromaticContact CZ-CE3 3.77Å; F549-W654 HydrophobicContact CZ-CE3 3.77Å; F549-W654 HydrophobicContact CZ-CG 4.05Å; F549-W654 HydrophobicContact CZ-CH2 4Å; F549-W654 AromaticContact CZ-CZ2 3.76Å; F549-W654 HydrophobicContact CZ-CZ2 3.76Å; F549-W654 AromaticContact CZ-CZ3 3.99Å; F549-W654 HydrophobicContact CZ-CZ3 3.99Å; F549-W654 AromaticContact CZ-NE1 3.87Å; C564-W654 HydrophobicContact CB-CH2 4.17Å; C564-W654 VanDerWaalsContact O-CH2 3.26Å; C564-W654 WeakPolarHBondContact O-CH2 3.44Å; F628-W654 HydrophobicContact CE1-CB 4.41Å; F628-W654 HydrophobicContact CE2-CB 4.43Å; F628-W654 HydrophobicContact CZ-CB 3.87Å; F628-W654 HydrophobicContact CZ-CE3 4.37Å; F628-W654 HydrophobicContact CZ-CG 4.36Å; F643-W654 HydrophobicContact CE1-CZ3 4.47Å; D650-W654 WeakPolarHBondContact O-CB 3.33Å; D650-W654 PolarHBondContact O-N 2.74Å; Y652-W654 PolarHBondContact O-N 3.48Å; W654-D656 VanDerWaalsContact C-N 3.34Å; W654-D656 PolarHBondContact O-N 3.33Å; W654-G657 PolarHBondContact O-N 2.99Å; W654-L658 HydrophobicContact CE3-CD1 4.42Å; W654-L658 WeakPolarHBondContact O-CB 3.46Å; W654-L658 VanDerWaalsContact O-CG 3.28Å; W654-L658 WeakPolarHBondContact O-CG 3.41Å; W654-L658 PolarHBondContact O-N 2.97Å
655	T	96.3	Very high	91.3	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-65.2	-37.7	179.6	52.6	0	0	0	0	112.1	L602 M604 F628 F651 Y652 S659	L602-T655 HydrophobicContact CD2-CG2 4.34Å; L602-T655 WeakPolarHBondContact CD2-O 3.39Å; M604-T655 HydrophobicContact CG-CG2 4.18Å; M604-T655 HydrophobicContact SD-CG2 3.92Å; F628-T655 HydrophobicContact CB-CG2 3.89Å; F628-T655 HydrophobicContact CD1-CG2 4.16Å; F628-T655 HydrophobicContact CD2-CG2 4.26Å; F628-T655 HydrophobicContact CG-CG2 3.86Å; F651-T655 HydrophobicContact CD2-CG2 4.14Å; F651-T655 HydrophobicContact CE1-CG2 4.37Å; F651-T655 HydrophobicContact CE2-CG2 3.84Å; F651-T655 HydrophobicContact CZ-CG2 3.95Å; F651-T655 WeakPolarHBondContact O-CB 3.39Å; F651-T655 VanDerWaalsContact O-CG2 3.31Å; F651-T655 WeakPolarHBondContact O-CG2 3.41Å; F651-T655 PolarHBondContact O-N 3.39Å; F651-T655 PolarHBondContact O-OG1 3.47Å; Y652-T655 PolarHBondContact O-OG1 3.47Å; T655-S659 VanDerWaalsContact O-CB 3.32Å; T655-S659 WeakPolarHBondContact O-CB 3.4Å; T655-S659 PolarHBondContact O-N 3.44Å; T655-S659 PolarHBondContact O-OG 3.34Å
656	D	97.1	Very high	91.7	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-67.2	-43.1	172.1	-75.2	-27.7	0	0	0	112	R539 Y652 W654 L658 S659 A660 M666 G667 S668 T671	R539-D656 HydrophobicContact CG-CB 4.23Å; R539-D656 IonicContact NE-OD2 3.37Å; R539-D656 IonicContact NH2-OD2 2.8Å; Y652-D656 WeakPolarHBondContact O-CB 3.49Å; Y652-D656 VanDerWaalsContact O-CG 3.23Å; Y652-D656 PolarHBondContact O-N 2.94Å; W654-D656 VanDerWaalsContact C-N 3.34Å; W654-D656 PolarHBondContact O-N 3.33Å; D656-L658 VanDerWaalsContact C-N 3.33Å; D656-L658 PolarHBondContact O-N 3.23Å; D656-S659 PolarHBondContact O-N 3.19Å; D656-A660 VanDerWaalsContact O-CB 3.27Å; D656-A660 WeakPolarHBondContact O-CB 3.28Å; D656-A660 PolarHBondContact O-N 2.96Å; D656-M666 HydrophobicContact CB-CB 4.06Å; D656-M666 HydrophobicContact CB-CG 3.95Å; D656-M666 HydrophobicContact CB-SD 4.2Å; D656-M666 WeakPolarHBondContact O-CG 3.13Å; D656-G667 PolarHBondContact OD1-N 3.25Å; D656-S668 VanDerWaalsContact CG-OG 3.28Å; D656-S668 VanDerWaalsContact OD1-CB 3.31Å; D656-S668 WeakPolarHBondContact OD1-CB 3.48Å; D656-S668 PolarHBondContact OD1-N 2.94Å; D656-S668 VanDerWaalsContact OD1-N 3.14Å; D656-S668 PolarHBondContact OD1-OG 3.05Å; D656-S668 VanDerWaalsContact OD2-CB 3.22Å; D656-S668 WeakPolarHBondContact OD2-CB 3.16Å; D656-S668 PolarHBondContact OD2-OG 3.46Å; D656-T671 VanDerWaalsContact CG-OG1 3.23Å; D656-T671 WeakPolarHBondContact OD2-CB 3.41Å; D656-T671 PolarHBondContact OD2-OG1 3.45Å
657	G	96.6	Very high	92.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.9	-44.1	176.6	0	0	0	0	0	112.2	L653 W654 A660 L661	L653-G657 PolarHBondContact O-N 2.6Å; W654-G657 PolarHBondContact O-N 2.99Å; G657-A660 WeakPolarHBondContact O-CB 3.48Å; G657-A660 PolarHBondContact O-N 3.46Å; G657-L661 VanDerWaalsContact O-CB 3.3Å; G657-L661 WeakPolarHBondContact O-CB 3.45Å; G657-L661 PolarHBondContact O-N 3.12Å
658	L	96.6	Very high	92.8	Very high	2 Å²	2	40 Å²	40	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-67.1	-40.7	176.4	-70	168.8	0	0	0	111	L543 L573 L602 F628 I630 W654 D656 A660 L661 L662	L543-L658 HydrophobicContact CD1-CD2 4.19Å; L543-L658 HydrophobicContact CD1-CG 4.37Å; L543-L658 HydrophobicContact CD2-CG 4.42Å; L573-L658 HydrophobicContact CD1-CD2 4.18Å; L602-L658 HydrophobicContact CD1-CB 4.42Å; L602-L658 HydrophobicContact CD1-CD1 3.91Å; L602-L658 HydrophobicContact CD2-CB 4.07Å; F628-L658 HydrophobicContact CD2-CD1 4.05Å; F628-L658 HydrophobicContact CE2-CD1 3.69Å; I630-L658 HydrophobicContact CD1-CD1 3.82Å; I630-L658 HydrophobicContact CD1-CD2 3.73Å; I630-L658 HydrophobicContact CD1-CG 4.44Å; I630-L658 HydrophobicContact CG1-CD1 4.04Å; W654-L658 HydrophobicContact CE3-CD1 4.42Å; W654-L658 WeakPolarHBondContact O-CB 3.46Å; W654-L658 VanDerWaalsContact O-CG 3.28Å; W654-L658 WeakPolarHBondContact O-CG 3.41Å; W654-L658 PolarHBondContact O-N 2.97Å; D656-L658 VanDerWaalsContact C-N 3.33Å; D656-L658 PolarHBondContact O-N 3.23Å; L658-A660 PolarHBondContact O-N 3.16Å; L658-L661 HydrophobicContact CD2-CD2 4.41Å; L658-L661 WeakPolarHBondContact O-CB 3.47Å; L658-L661 PolarHBondContact O-N 3.01Å; L658-L662 WeakPolarHBondContact O-CB 3.31Å; L658-L662 VanDerWaalsContact O-CG 3.25Å; L658-L662 WeakPolarHBondContact O-CG 3.46Å; L658-L662 PolarHBondContact O-N 3.22Å
659	S	95.6	Very high	93.1	Very high	16 Å²	16	39.5 Å²	39.5	11%	0.112	24%	0.236	C	C	.	.	H	α-helix	trans	-60.2	-46.3	173.6	-61.2	0	0	0	0	111.3	T655 D656 L661 L662 G663 S664	T655-S659 VanDerWaalsContact O-CB 3.32Å; T655-S659 WeakPolarHBondContact O-CB 3.4Å; T655-S659 PolarHBondContact O-N 3.44Å; T655-S659 PolarHBondContact O-OG 3.34Å; D656-S659 PolarHBondContact O-N 3.19Å; S659-L661 VanDerWaalsContact C-N 3.32Å; S659-L661 PolarHBondContact O-N 3.47Å; S659-L662 CarbonylContact O-C 3.55Å; S659-L662 PolarHBondContact O-N 3.16Å; S659-G663 PolarHBondContact O-N 3.04Å; S659-G663 VanDerWaalsContact O-N 3.09Å; S659-S664 CarbonylContact C-O 3.54Å; S659-S664 WeakPolarHBondContact O-CA 3.49Å; S659-S664 WeakPolarHBondContact O-CB 3.27Å; S659-S664 PolarHBondContact O-N 2.89Å
660	A	94.9	Very high	93.3	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-36.7	176.1	0	0	0	0	0	113.5	R536 D656 G657 L658 G663 M666	R536-A660 HydrophobicContact CG-CB 3.71Å; R536-A660 PolarHBondContact NE-O 3.45Å; R536-A660 PolarHBondContact NH2-O 3.44Å; D656-A660 VanDerWaalsContact O-CB 3.27Å; D656-A660 WeakPolarHBondContact O-CB 3.28Å; D656-A660 PolarHBondContact O-N 2.96Å; G657-A660 WeakPolarHBondContact O-CB 3.48Å; G657-A660 PolarHBondContact O-N 3.46Å; L658-A660 PolarHBondContact O-N 3.16Å; A660-G663 PolarHBondContact O-N 2.88Å; A660-M666 HydrophobicContact CB-CG 4.06Å; A660-M666 HydrophobicContact CB-SD 3.93Å
661	L	94.9	Very high	93.5	Very high	27 Å²	27	32.9 Å²	32.9	14%	0.141	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-41.3	176.1	-177	64.3	0	0	0	111	L540 L543 L566 H570 V596 G657 L658 S659 G663	L540-L661 HydrophobicContact CD2-CB 4.11Å; L540-L661 HydrophobicContact CD2-CD1 4.02Å; L543-L661 HydrophobicContact CD1-CD2 4.39Å; L566-L661 HydrophobicContact CD1-CD1 4.38Å; L566-L661 HydrophobicContact CD1-CD2 3.81Å; L566-L661 HydrophobicContact CD2-CD1 3.94Å; L566-L661 HydrophobicContact CD2-CD2 4.13Å; H570-L661 HydrophobicContact CB-CD1 3.85Å; V596-L661 HydrophobicContact CG1-CD1 4.15Å; V596-L661 HydrophobicContact CG1-CD2 3.92Å; V596-L661 HydrophobicContact CG1-CG 3.75Å; V596-L661 HydrophobicContact CG2-CD2 3.81Å; V596-L661 HydrophobicContact CG2-CG 4.41Å; G657-L661 VanDerWaalsContact O-CB 3.3Å; G657-L661 WeakPolarHBondContact O-CB 3.45Å; G657-L661 PolarHBondContact O-N 3.12Å; L658-L661 HydrophobicContact CD2-CD2 4.41Å; L658-L661 WeakPolarHBondContact O-CB 3.47Å; L658-L661 PolarHBondContact O-N 3.01Å; S659-L661 VanDerWaalsContact C-N 3.32Å; S659-L661 PolarHBondContact O-N 3.47Å; L661-G663 VanDerWaalsContact C-N 3.26Å; L661-G663 PolarHBondContact O-N 3.24Å
662	L	93.3	Very high	93.4	Very high	57 Å²	57	38.8 Å²	38.8	30%	0.298	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-1.6	177.8	-62.3	173.2	0	0	0	113.9	I599 L602 L658 S659 S664	I599-L662 HydrophobicContact CB-CD2 3.85Å; I599-L662 HydrophobicContact CD1-CD2 4.43Å; I599-L662 HydrophobicContact CG2-CD1 3.91Å; I599-L662 HydrophobicContact CG2-CD2 3.59Å; I599-L662 HydrophobicContact CG2-CG 4.36Å; L602-L662 HydrophobicContact CB-CD1 4.38Å; L658-L662 WeakPolarHBondContact O-CB 3.31Å; L658-L662 VanDerWaalsContact O-CG 3.25Å; L658-L662 WeakPolarHBondContact O-CG 3.46Å; L658-L662 PolarHBondContact O-N 3.22Å; S659-L662 CarbonylContact O-C 3.55Å; S659-L662 PolarHBondContact O-N 3.16Å; L662-S664 VanDerWaalsContact C-N 3.27Å; L662-S664 PolarHBondContact O-N 3.1Å
663	G	90.4	Very high	93.1	Very high	60 Å²	60	40.5 Å²	40.5	62%	0.619	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	11.1	-177.9	0	0	0	0	0	114.6	S659 A660 L661	S659-G663 PolarHBondContact O-N 3.04Å; S659-G663 VanDerWaalsContact O-N 3.09Å; A660-G663 PolarHBondContact O-N 2.88Å; L661-G663 VanDerWaalsContact C-N 3.26Å; L661-G663 PolarHBondContact O-N 3.24Å
664	S	91.6	Very high	93	Very high	72 Å²	72	41.7 Å²	41.7	50%	0.503	25%	0.251	S	S	.	.			trans	-82.7	162.2	173.8	-64.6	0	0	0	0	111.8	S659 L662	S659-S664 CarbonylContact C-O 3.54Å; S659-S664 WeakPolarHBondContact O-CA 3.49Å; S659-S664 WeakPolarHBondContact O-CB 3.27Å; S659-S664 PolarHBondContact O-N 2.89Å; L662-S664 VanDerWaalsContact C-N 3.27Å; L662-S664 PolarHBondContact O-N 3.1Å
665	T	90.5	Very high	92.9	Very high	127 Å²	127	42.8 Å²	42.8	78%	0.779	26%	0.257	S	S	*	.			trans	-72	132.3	176.8	53.8	0	0	0	0	111.7	G667	T665-G667 PolarHBondContact O-N 2.97Å
666	M	94.2	Very high	92.5	Very high	31 Å²	31	46.6 Å²	46.6	15%	0.153	28%	0.275	C	S	.	.			trans	-73.3	108.6	171.2	-62.6	-178.4	-61.8	0	0	109.6	L532 I535 R536 R539 D656 A660 T671	L532-M666 HydrophobicContact CD2-CE 4.31Å; I535-M666 HydrophobicContact CB-CE 4.22Å; I535-M666 HydrophobicContact CG2-CE 3.84Å; I535-M666 HydrophobicContact CG2-SD 4.27Å; R536-M666 HydrophobicContact CB-CE 4.03Å; R536-M666 HydrophobicContact CB-SD 4.47Å; R539-M666 HydrophobicContact CB-SD 4.5Å; R539-M666 HydrophobicContact CG-SD 3.88Å; D656-M666 HydrophobicContact CB-CB 4.06Å; D656-M666 HydrophobicContact CB-CG 3.95Å; D656-M666 HydrophobicContact CB-SD 4.2Å; D656-M666 WeakPolarHBondContact O-CG 3.13Å; A660-M666 HydrophobicContact CB-CG 4.06Å; A660-M666 HydrophobicContact CB-SD 3.93Å; M666-T671 HydrophobicContact CB-CG2 3.83Å; M666-T671 HydrophobicContact CE-CG2 4.32Å
667	G	88.5	Confident	92	Very high	72 Å²	72	52.2 Å²	52.2	74%	0.742	30%	0.301	S	S	*	.			trans	-107.9	2	-169.1	0	0	0	0	0	115.2	D656 T665	D656-G667 PolarHBondContact OD1-N 3.25Å; T665-G667 PolarHBondContact O-N 2.97Å
668	S	92.2	Very high	91.8	Very high	14 Å²	14	55 Å²	55	10%	0.098	32%	0.316	C	S	.	.	S	Bend	trans	-71.4	160.6	-174	87.4	0	0	0	0	113.9	D656 Q670 T671 R672	D656-S668 VanDerWaalsContact CG-OG 3.28Å; D656-S668 VanDerWaalsContact OD1-CB 3.31Å; D656-S668 WeakPolarHBondContact OD1-CB 3.48Å; D656-S668 PolarHBondContact OD1-N 2.94Å; D656-S668 VanDerWaalsContact OD1-N 3.14Å; D656-S668 PolarHBondContact OD1-OG 3.05Å; D656-S668 VanDerWaalsContact OD2-CB 3.22Å; D656-S668 WeakPolarHBondContact OD2-CB 3.16Å; D656-S668 PolarHBondContact OD2-OG 3.46Å; S668-Q670 PolarHBondContact O-N 3.4Å; S668-Q670 PolarHBondContact OG-N 3.26Å; S668-Q670 VanDerWaalsContact OG-N 3.15Å; S668-T671 PolarHBondContact O-N 3.38Å; S668-T671 PolarHBondContact OG-N 3.06Å; S668-R672 PolarHBondContact O-N 3.04Å
669	E	88.8	Confident	91.5	Very high	90 Å²	90	55 Å²	55	42%	0.421	32%	0.316	S	S	.	.	H	α-helix	trans	-59.3	-37.2	170.2	-173.9	177.1	-166	0	0	111.7	Y652 R672 L673	Y652-E669 HydrophobicContact CE2-CB 3.91Å; E669-R672 WeakPolarHBondContact O-CB 3.26Å; E669-R672 PolarHBondContact O-N 3.04Å; E669-R672 IonicContact OE1-NH2 2.64Å; E669-L673 HydrophobicContact CG-CD1 4.16Å; E669-L673 HydrophobicContact CG-CG 4.41Å; E669-L673 WeakPolarHBondContact O-CG 3.36Å; E669-L673 PolarHBondContact O-N 3.27Å
670	Q	91.1	Very high	90.9	Very high	35 Å²	35	55.7 Å²	55.7	16%	0.164	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-42.1	179.1	-170.7	64.2	51.2	0	0	111.9	Y652 L653 S668 R672 L673 D674	Y652-Q670 HydrophobicContact CD2-CB 3.98Å; Y652-Q670 HydrophobicContact CG-CB 4.19Å; L653-Q670 HydrophobicContact CD2-CG 4.12Å; S668-Q670 PolarHBondContact O-N 3.4Å; S668-Q670 PolarHBondContact OG-N 3.26Å; S668-Q670 VanDerWaalsContact OG-N 3.15Å; Q670-R672 VanDerWaalsContact C-N 3.31Å; Q670-R672 PolarHBondContact O-N 2.82Å; Q670-L673 PolarHBondContact O-N 3.23Å; Q670-D674 PolarHBondContact NE2-OD1 3.43Å; Q670-D674 WeakPolarHBondContact O-CB 3.48Å; Q670-D674 PolarHBondContact O-N 3.37Å
671	T	93.7	Very high	90.5	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-63.4	-38.9	175.7	-76.7	0	0	0	0	111.6	L532 I535 R539 D656 M666 S668 L675	L532-T671 HydrophobicContact CD2-CG2 4.25Å; I535-T671 HydrophobicContact CG2-CG2 4.38Å; R539-T671 PolarHBondContact NH2-OG1 3.47Å; D656-T671 VanDerWaalsContact CG-OG1 3.23Å; D656-T671 WeakPolarHBondContact OD2-CB 3.41Å; D656-T671 PolarHBondContact OD2-OG1 3.45Å; M666-T671 HydrophobicContact CB-CG2 3.83Å; M666-T671 HydrophobicContact CE-CG2 4.32Å; S668-T671 PolarHBondContact O-N 3.38Å; S668-T671 PolarHBondContact OG-N 3.06Å; T671-L675 WeakPolarHBondContact O-CB 3.27Å; T671-L675 PolarHBondContact O-N 2.9Å
672	R	91.6	Very high	90.2	Very high	143 Å²	143	61.4 Å²	61.4	54%	0.54	35%	0.345	S	S	.	.	H	α-helix	trans	-62.3	-44.3	174.3	-173.5	-175	65.2	84.1	1.5	111.7	S668 E669 Q670 E676	S668-R672 PolarHBondContact O-N 3.04Å; E669-R672 WeakPolarHBondContact O-CB 3.26Å; E669-R672 PolarHBondContact O-N 3.04Å; E669-R672 IonicContact OE1-NH2 2.64Å; Q670-R672 VanDerWaalsContact C-N 3.31Å; Q670-R672 PolarHBondContact O-N 2.82Å; R672-E676 VanDerWaalsContact O-CB 3.3Å; R672-E676 WeakPolarHBondContact O-CB 3.4Å; R672-E676 PolarHBondContact O-N 2.93Å
673	L	88.1	Confident	89.8	Confident	77 Å²	77	59 Å²	59	40%	0.403	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-46.3	178.3	-70.8	172.9	0	0	0	112	E669 Q670 E676 Q677	E669-L673 HydrophobicContact CG-CD1 4.16Å; E669-L673 HydrophobicContact CG-CG 4.41Å; E669-L673 WeakPolarHBondContact O-CG 3.36Å; E669-L673 PolarHBondContact O-N 3.27Å; Q670-L673 PolarHBondContact O-N 3.23Å; L673-E676 PolarHBondContact O-N 3.12Å; L673-Q677 WeakPolarHBondContact O-CB 3.37Å; L673-Q677 PolarHBondContact O-N 3.33Å
674	D	91.8	Very high	89.4	Confident	32 Å²	32	60.3 Å²	60.3	17%	0.171	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-44.5	177.9	-68.2	-7.8	0	0	0	110.9	I535 R539 Q670 Q677 L678	I535-D674 HydrophobicContact CD1-CB 3.95Å; I535-D674 HydrophobicContact CG1-CB 4.28Å; R539-D674 IonicContact CZ-OD2 2.68Å; R539-D674 VanDerWaalsContact CZ-OD2 3.23Å; R539-D674 IonicContact NH1-OD2 3.26Å; R539-D674 PolarHBondContact NH1-OD2 2.98Å; R539-D674 IonicContact NH2-OD2 3.42Å; R539-D674 PolarHBondContact NH2-OD2 3.16Å; Q670-D674 PolarHBondContact NE2-OD1 3.43Å; Q670-D674 WeakPolarHBondContact O-CB 3.48Å; Q670-D674 PolarHBondContact O-N 3.37Å; D674-Q677 PolarHBondContact O-N 3.41Å; D674-L678 WeakPolarHBondContact O-CB 3.29Å; D674-L678 WeakPolarHBondContact O-CG 3.42Å; D674-L678 PolarHBondContact O-N 2.82Å
675	L	92.8	Very high	89.1	Confident	27 Å²	27	61.6 Å²	61.6	14%	0.141	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-45.3	177.1	179.3	62	0	0	0	111.2	L531 L532 I535 T671 Q677 L678 L679	L531-L675 HydrophobicContact CB-CD1 3.98Å; L532-L675 HydrophobicContact CD1-CD2 4.49Å; L532-L675 HydrophobicContact CD2-CD1 4.27Å; L532-L675 HydrophobicContact CD2-CD2 3.98Å; L532-L675 HydrophobicContact CG-CD1 4.02Å; L532-L675 HydrophobicContact CG-CD2 4.15Å; I535-L675 HydrophobicContact CD1-CB 3.76Å; I535-L675 HydrophobicContact CD1-CD1 4.29Å; T671-L675 WeakPolarHBondContact O-CB 3.27Å; T671-L675 PolarHBondContact O-N 2.9Å; L675-Q677 VanDerWaalsContact C-N 3.33Å; L675-Q677 PolarHBondContact O-N 3.18Å; L675-L678 PolarHBondContact O-N 2.95Å; L675-L679 HydrophobicContact CD1-CD1 3.97Å; L675-L679 HydrophobicContact CD1-CG 4.03Å; L675-L679 HydrophobicContact CD2-CD1 4.42Å; L675-L679 HydrophobicContact CG-CD1 3.76Å; L675-L679 HydrophobicContact CG-CG 4.29Å; L675-L679 VanDerWaalsContact O-CB 3.23Å; L675-L679 WeakPolarHBondContact O-CB 3.46Å; L675-L679 VanDerWaalsContact O-CG 3.22Å; L675-L679 WeakPolarHBondContact O-CG 3.42Å; L675-L679 PolarHBondContact O-N 2.84Å
676	E	88.9	Confident	88.8	Confident	86 Å²	86	61.9 Å²	61.9	40%	0.402	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-40.2	178.7	-174.8	55.8	-145.7	0	0	111.7	R524 R672 L673 T680	R524-E676 IonicContact CZ-OE1 3.46Å; R524-E676 IonicContact NH2-OE1 2.81Å; R524-E676 PolarHBondContact NH2-OE1 2.9Å; R524-E676 IonicContact NH2-OE2 3.22Å; R524-E676 PolarHBondContact NH2-OE2 3.08Å; R672-E676 VanDerWaalsContact O-CB 3.3Å; R672-E676 WeakPolarHBondContact O-CB 3.4Å; R672-E676 PolarHBondContact O-N 2.93Å; L673-E676 PolarHBondContact O-N 3.12Å; E676-T680 VanDerWaalsContact O-CB 3.25Å; E676-T680 WeakPolarHBondContact O-CB 3.47Å; E676-T680 PolarHBondContact O-N 3.39Å; E676-T680 PolarHBondContact O-OG1 2.72Å
677	Q	87	Confident	88.2	Confident	120 Å²	120	62.5 Å²	62.5	56%	0.561	31%	0.313	S	S	*	.	H	α-helix	trans	-64.2	-49.7	175.9	-177.9	177.4	-6	0	0	111.5	L673 D674 L675 T680 M681	L673-Q677 WeakPolarHBondContact O-CB 3.37Å; L673-Q677 PolarHBondContact O-N 3.33Å; D674-Q677 PolarHBondContact O-N 3.41Å; L675-Q677 VanDerWaalsContact C-N 3.33Å; L675-Q677 PolarHBondContact O-N 3.18Å; Q677-T680 PolarHBondContact O-N 3.27Å; Q677-M681 HydrophobicContact CG-SD 4.38Å; Q677-M681 WeakPolarHBondContact O-CG 3.49Å; Q677-M681 PolarHBondContact O-N 2.63Å
678	L	91.4	Very high	87.8	Confident	60 Å²	60	63.7 Å²	63.7	31%	0.314	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-44.4	178.7	-70.8	177.7	0	0	0	111.5	L531 I535 D674 L675 T680 M681 E682	L531-L678 HydrophobicContact CD1-CB 4.06Å; L531-L678 HydrophobicContact CD2-CB 4.27Å; I535-L678 HydrophobicContact CD1-CD1 4.1Å; I535-L678 HydrophobicContact CG1-CD1 3.76Å; D674-L678 WeakPolarHBondContact O-CB 3.29Å; D674-L678 WeakPolarHBondContact O-CG 3.42Å; D674-L678 PolarHBondContact O-N 2.82Å; L675-L678 PolarHBondContact O-N 2.95Å; L678-T680 VanDerWaalsContact C-N 3.27Å; L678-T680 PolarHBondContact O-N 3.27Å; L678-M681 PolarHBondContact O-N 2.89Å; L678-E682 WeakPolarHBondContact O-CB 3.26Å; L678-E682 PolarHBondContact O-N 3.33Å
679	L	89.4	Confident	86.7	Confident	2 Å²	2	71.8 Å²	71.8	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-58.3	-43.9	174.9	-79.4	168.7	0	0	0	110.6	R524 L527 K528 L531 L675 T683	R524-L679 HydrophobicContact CB-CD2 4.09Å; R524-L679 HydrophobicContact CG-CD2 4.27Å; R524-L679 WeakPolarHBondContact O-CD2 3.45Å; L527-L679 HydrophobicContact CB-CD2 4.07Å; K528-L679 HydrophobicContact CG-CD1 3.9Å; K528-L679 HydrophobicContact CG-CD2 4.02Å; L531-L679 HydrophobicContact CD1-CB 4.31Å; L531-L679 HydrophobicContact CD1-CD2 3.58Å; L531-L679 HydrophobicContact CD1-CG 3.77Å; L675-L679 HydrophobicContact CD1-CD1 3.97Å; L675-L679 HydrophobicContact CD1-CG 4.03Å; L675-L679 HydrophobicContact CD2-CD1 4.42Å; L675-L679 HydrophobicContact CG-CD1 3.76Å; L675-L679 HydrophobicContact CG-CG 4.29Å; L675-L679 VanDerWaalsContact O-CB 3.23Å; L675-L679 WeakPolarHBondContact O-CB 3.46Å; L675-L679 VanDerWaalsContact O-CG 3.22Å; L675-L679 WeakPolarHBondContact O-CG 3.42Å; L675-L679 PolarHBondContact O-N 2.84Å; L679-T683 WeakPolarHBondContact O-CB 3.48Å; L679-T683 PolarHBondContact O-N 3.17Å; L679-T683 PolarHBondContact O-OG1 3.45Å
680	T	84.3	Confident	86	Confident	29 Å²	29	71.6 Å²	71.6	18%	0.178	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-44	178.3	-61.9	0	0	0	0	111.7	E676 Q677 L678 K684	E676-T680 VanDerWaalsContact O-CB 3.25Å; E676-T680 WeakPolarHBondContact O-CB 3.47Å; E676-T680 PolarHBondContact O-N 3.39Å; E676-T680 PolarHBondContact O-OG1 2.72Å; Q677-T680 PolarHBondContact O-N 3.27Å; L678-T680 VanDerWaalsContact C-N 3.27Å; L678-T680 PolarHBondContact O-N 3.27Å; T680-K684 HydrophobicContact CG2-CD 4.27Å; T680-K684 WeakPolarHBondContact O-CB 3.38Å; T680-K684 WeakPolarHBondContact O-CG 2.94Å; T680-K684 PolarHBondContact O-N 3.4Å
681	M	85.4	Confident	85	Confident	104 Å²	104	76.4 Å²	76.4	51%	0.512	36%	0.362	S	S	.	.	H	α-helix	trans	-67.1	-50.2	178.3	-72.8	-176.3	63.4	0	0	112.1	Q677 L678 T683 K684 L685	Q677-M681 HydrophobicContact CG-SD 4.38Å; Q677-M681 WeakPolarHBondContact O-CG 3.49Å; Q677-M681 PolarHBondContact O-N 2.63Å; L678-M681 PolarHBondContact O-N 2.89Å; M681-T683 PolarHBondContact O-N 2.74Å; M681-K684 WeakPolarHBondContact O-CB 3.48Å; M681-K684 PolarHBondContact O-N 2.97Å; M681-K684 VanDerWaalsContact O-N 3.17Å; M681-L685 WeakPolarHBondContact O-CG 3.18Å; M681-L685 PolarHBondContact O-N 3.31Å
682	E	89.2	Confident	83.8	Confident	46 Å²	46	83.8 Å²	83.8	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-64.4	-42.1	-179.2	-174.3	60.8	-157.8	0	0	111	L527 L531 L678 K684 L685 R686	L527-E682 HydrophobicContact CD1-CB 4.32Å; L527-E682 HydrophobicContact CD1-CG 3.73Å; L527-E682 HydrophobicContact CD2-CG 4.04Å; L527-E682 HydrophobicContact CG-CG 4.45Å; L531-E682 HydrophobicContact CD1-CB 4.4Å; L678-E682 WeakPolarHBondContact O-CB 3.26Å; L678-E682 PolarHBondContact O-N 3.33Å; E682-K684 VanDerWaalsContact C-N 3.32Å; E682-K684 PolarHBondContact O-N 2.93Å; E682-L685 PolarHBondContact O-N 2.89Å; E682-R686 WeakPolarHBondContact O-CG 3.41Å; E682-R686 PolarHBondContact O-N 3.23Å; E682-R686 IonicContact OE1-CZ 3.41Å; E682-R686 IonicContact OE1-NE 3.61Å; E682-R686 PolarHBondContact OE1-NE 3.32Å; E682-R686 IonicContact OE1-NH2 3.41Å; E682-R686 PolarHBondContact OE1-NH2 2.61Å
683	T	85.9	Confident	83	Confident	6 Å²	6	80.8 Å²	80.8	4%	0.037	40%	0.399	C	S	.	.	H	α-helix	trans	-58.5	-45.8	173.6	-58.8	0	0	0	0	110.6	I520 R524 L679 M681 L685 R686 L687	I520-T683 HydrophobicContact CG2-CG2 3.61Å; R524-T683 WeakPolarHBondContact CG-OG1 3.17Å; L679-T683 WeakPolarHBondContact O-CB 3.48Å; L679-T683 PolarHBondContact O-N 3.17Å; L679-T683 PolarHBondContact O-OG1 3.45Å; M681-T683 PolarHBondContact O-N 2.74Å; T683-L685 PolarHBondContact O-N 2.85Å; T683-R686 PolarHBondContact O-N 2.87Å; T683-L687 HydrophobicContact CG2-CD1 3.81Å; T683-L687 HydrophobicContact CG2-CG 4.38Å; T683-L687 WeakPolarHBondContact O-CB 3.27Å; T683-L687 VanDerWaalsContact O-CG 3.24Å; T683-L687 WeakPolarHBondContact O-CG 3.45Å; T683-L687 PolarHBondContact O-N 3.03Å
684	K	81	Confident	82.3	Confident	88 Å²	88	82.6 Å²	82.6	38%	0.383	42%	0.415	S	S	.	.	H	α-helix	trans	-59.5	-45.5	176.6	-78.1	172.5	179.4	-178.4	0	111.6	H511 T680 M681 E682 R686 L687 L688	H511-K684 WeakPolarHBondContact CE1-CE 3.5Å; H511-K684 PolarHBondContact CE1-NZ 3.11Å; H511-K684 WeakPolarHBondContact ND1-CE 3.48Å; H511-K684 PolarHBondContact ND1-NZ 2.62Å; H511-K684 PolarHBondContact NE2-NZ 2.85Å; H511-K684 VanDerWaalsContact NE2-NZ 3.15Å; T680-K684 HydrophobicContact CG2-CD 4.27Å; T680-K684 WeakPolarHBondContact O-CB 3.38Å; T680-K684 WeakPolarHBondContact O-CG 2.94Å; T680-K684 PolarHBondContact O-N 3.4Å; M681-K684 WeakPolarHBondContact O-CB 3.48Å; M681-K684 PolarHBondContact O-N 2.97Å; M681-K684 VanDerWaalsContact O-N 3.17Å; E682-K684 VanDerWaalsContact C-N 3.32Å; E682-K684 PolarHBondContact O-N 2.93Å; K684-R686 VanDerWaalsContact C-N 3.33Å; K684-R686 PolarHBondContact O-N 2.95Å; K684-L687 CarbonylContact O-C 3.57Å; K684-L687 PolarHBondContact O-N 3.39Å; K684-L687 VanDerWaalsContact O-N 3.1Å; K684-L688 WeakPolarHBondContact O-CG 3.44Å; K684-L688 PolarHBondContact O-N 2.96Å
685	L	84.9	Confident	81.5	Confident	99 Å²	99	84.4 Å²	84.4	52%	0.518	42%	0.424	S	S	.	.	H	α-helix	trans	-58.2	-44.5	178.2	-71.5	172.7	0	0	0	111.8	M681 E682 T683 L687 L688	M681-L685 WeakPolarHBondContact O-CG 3.18Å; M681-L685 PolarHBondContact O-N 3.31Å; E682-L685 PolarHBondContact O-N 2.89Å; T683-L685 PolarHBondContact O-N 2.85Å; L685-L687 VanDerWaalsContact C-N 3.27Å; L685-L687 PolarHBondContact O-N 3.06Å; L685-L688 HydrophobicContact CD2-CD1 3.89Å; L685-L688 WeakPolarHBondContact O-CB 3.45Å; L685-L688 PolarHBondContact O-N 3.43Å
686	R	85.1	Confident	80.7	Confident	133 Å²	133	86.5 Å²	86.5	50%	0.502	44%	0.439	S	S	.	.	H	α-helix	trans	-66.6	-27.6	176.9	-61.5	-60.2	175.4	140.9	3.5	113.5	L523 E682 T683 K684	L523-R686 HydrophobicContact CD2-CB 4.06Å; L523-R686 HydrophobicContact CD2-CG 4.42Å; E682-R686 WeakPolarHBondContact O-CG 3.41Å; E682-R686 PolarHBondContact O-N 3.23Å; E682-R686 IonicContact OE1-CZ 3.41Å; E682-R686 IonicContact OE1-NE 3.61Å; E682-R686 PolarHBondContact OE1-NE 3.32Å; E682-R686 IonicContact OE1-NH2 3.41Å; E682-R686 PolarHBondContact OE1-NH2 2.61Å; T683-R686 PolarHBondContact O-N 2.87Å; K684-R686 VanDerWaalsContact C-N 3.33Å; K684-R686 PolarHBondContact O-N 2.95Å
687	L	80.9	Confident	80	Confident	44 Å²	44	90.5 Å²	90.5	23%	0.23	46%	0.458	C	S	.	.	H	α-helix	trans	-88	-8.9	178.9	-65.8	175.8	0	0	0	113.5	I520 T683 K684 L685 E689 L690 E691 I695	I520-L687 HydrophobicContact CD1-CD1 3.65Å; I520-L687 HydrophobicContact CD1-CD2 4.42Å; I520-L687 HydrophobicContact CG1-CD1 4.22Å; I520-L687 HydrophobicContact CG1-CD2 4.47Å; T683-L687 HydrophobicContact CG2-CD1 3.81Å; T683-L687 HydrophobicContact CG2-CG 4.38Å; T683-L687 WeakPolarHBondContact O-CB 3.27Å; T683-L687 VanDerWaalsContact O-CG 3.24Å; T683-L687 WeakPolarHBondContact O-CG 3.45Å; T683-L687 PolarHBondContact O-N 3.03Å; K684-L687 CarbonylContact O-C 3.57Å; K684-L687 PolarHBondContact O-N 3.39Å; K684-L687 VanDerWaalsContact O-N 3.1Å; L685-L687 VanDerWaalsContact C-N 3.27Å; L685-L687 PolarHBondContact O-N 3.06Å; L687-E689 VanDerWaalsContact C-N 3.28Å; L687-E689 PolarHBondContact O-N 3.33Å; L687-L690 HydrophobicContact CD2-CD1 4.32Å; L687-L690 CarbonylContact O-C 3.58Å; L687-L690 WeakPolarHBondContact O-CA 3.35Å; L687-L690 PolarHBondContact O-N 2.88Å; L687-E691 PolarHBondContact O-N 3.47Å; L687-I695 HydrophobicContact CD2-CD1 3.93Å
688	L	80.2	Confident	79.6	Confident	97 Å²	97	92.4 Å²	92.4	51%	0.508	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-58.6	-39.5	177.6	-74.9	174.8	0	0	0	112.1	K684 L685 L690 E691	K684-L688 WeakPolarHBondContact O-CG 3.44Å; K684-L688 PolarHBondContact O-N 2.96Å; L685-L688 HydrophobicContact CD2-CD1 3.89Å; L685-L688 WeakPolarHBondContact O-CB 3.45Å; L685-L688 PolarHBondContact O-N 3.43Å; L688-L690 PolarHBondContact O-N 3.11Å; L688-E691 WeakPolarHBondContact O-CB 3.46Å; L688-E691 PolarHBondContact O-N 3.41Å
689	E	70.4	Confident	79.1	Confident	185 Å²	185	95 Å²	95	86%	0.864	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-68.9	-15.4	177.7	-62.9	-175.5	172.8	0	0	113	L687	L687-E689 VanDerWaalsContact C-N 3.28Å; L687-E689 PolarHBondContact O-N 3.33Å
690	L	74	Confident	78.9	Confident	85 Å²	85	99.4 Å²	99.4	45%	0.445	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-110.4	17.5	-180	-60.1	175.4	0	0	0	111.6	L687 L688 N692 V693	L687-L690 HydrophobicContact CD2-CD1 4.32Å; L687-L690 CarbonylContact O-C 3.58Å; L687-L690 WeakPolarHBondContact O-CA 3.35Å; L687-L690 PolarHBondContact O-N 2.88Å; L688-L690 PolarHBondContact O-N 3.11Å; L690-N692 PolarHBondContact O-N 3.48Å; L690-V693 HydrophobicContact CB-CB 4.35Å; L690-V693 WeakPolarHBondContact O-CB 3.48Å; L690-V693 PolarHBondContact O-N 2.83Å
691	E	68.6	Low	79.1	Confident	137 Å²	137	103.8 Å²	103.8	64%	0.64	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	123.8	-179.5	-162.1	171.6	-155.2	0	0	110.1	L687 L688 V693	L687-E691 PolarHBondContact O-N 3.47Å; L688-E691 WeakPolarHBondContact O-CB 3.46Å; L688-E691 PolarHBondContact O-N 3.41Å; E691-V693 VanDerWaalsContact C-N 3.28Å; E691-V693 PolarHBondContact O-N 2.81Å
692	N	68.9	Low	79.3	Confident	159 Å²	159	105.3 Å²	105.3	85%	0.85	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.5	8	-171.9	-45.6	-68	0	0	0	116.4	L690	L690-N692 PolarHBondContact O-N 3.48Å
693	V	75.8	Confident	79.3	Confident	80 Å²	80	108 Å²	108	49%	0.485	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-90.3	126.9	169.8	-176.6	0	0	0	0	108.9	L690 E691 I695	L690-V693 HydrophobicContact CB-CB 4.35Å; L690-V693 WeakPolarHBondContact O-CB 3.48Å; L690-V693 PolarHBondContact O-N 2.83Å; E691-V693 VanDerWaalsContact C-N 3.28Å; E691-V693 PolarHBondContact O-N 2.81Å; V693-I695 PolarHBondContact O-N 2.64Å
694	P	72.8	Confident	79.3	Confident	116 Å²	116	113 Å²	113	75%	0.753	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-65.8	122.8	176.6	27.1	-32.6	0	0	0	109.6	P696	P694-P696 WeakPolarHBondContact O-CD 3.3Å
695	I	74.9	Confident	79.5	Confident	70 Å²	70	113.9 Å²	113.9	36%	0.359	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-75.3	116.7	177.6	-57.8	177.8	0	0	0	107.8	P519 I520 L687 V693	P519-I695 HydrophobicContact CB-CG2 4.28Å; P519-I695 HydrophobicContact CG-CG2 4.11Å; I520-I695 HydrophobicContact CD1-CD1 3.55Å; I520-I695 HydrophobicContact CG1-CD1 4.22Å; L687-I695 HydrophobicContact CD2-CD1 3.93Å; V693-I695 PolarHBondContact O-N 2.64Å
696	P	76.1	Confident	79.6	Confident	71 Å²	71	113.1 Å²	113.1	46%	0.461	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-71.8	137.7	-177.9	31.1	-35	0	0	0	110.3	P519 P694 Q698	P519-P696 WeakPolarHBondContact CG-O 3.05Å; P694-P696 WeakPolarHBondContact O-CD 3.3Å; P696-Q698 WeakPolarHBondContact CB-O 3.16Å; P696-Q698 PolarHBondContact O-N 2.95Å
697	E	74	Confident	79.6	Confident	169 Å²	169	113.9 Å²	113.9	79%	0.79	65%	0.649	S	S	*	*	S	Bend	trans	-63.8	-29.5	176.7	-68.1	-171.8	168.6	0	0	112.5
698	Q	78.6	Confident	79.6	Confident	160 Å²	160	115.6 Å²	115.6	75%	0.748	66%	0.659	S	S	*	*	S	Bend	trans	-119.8	133.3	174.8	-66.3	-176.5	1.5	0	0	109.9	P696	P696-Q698 WeakPolarHBondContact CB-O 3.16Å; P696-Q698 PolarHBondContact O-N 2.95Å
699	P	80.4	Confident	79.8	Confident	114 Å²	114	118.2 Å²	118.2	74%	0.74	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-61.6	130.1	176.8	24.8	-32	0	0	0	109.7
700	P	85	Confident	80.3	Confident	96 Å²	96	115.7 Å²	115.7	62%	0.623	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-60.4	145.8	176.6	24.6	-32.5	0	0	0	110.2	V702	P700-V702 PolarHBondContact O-N 3.17Å
701	P	88.8	Confident	80.6	Confident	120 Å²	120	118.6 Å²	118.6	78%	0.779	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-62.5	133.9	-177.8	25.8	-33.6	0	0	0	110.5	P703	P701-P703 WeakPolarHBondContact O-CD 3.15Å
702	V	89.5	Confident	80.8	Confident	137 Å²	137	118.1 Å²	118.1	83%	0.83	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-67.4	121.8	171.5	-177.3	0	0	0	0	107.6	P700	P700-V702 PolarHBondContact O-N 3.17Å
703	P	89	Confident	81.1	Confident	102 Å²	102	119 Å²	119	66%	0.662	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-62.1	152.3	178.7	25.9	-33.4	0	0	0	110.5	P701	P701-P703 WeakPolarHBondContact O-CD 3.15Å
704	P	87.2	Confident	81.1	Confident	112 Å²	112	120.9 Å²	120.9	73%	0.727	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-58.1	150.1	176.2	26.2	-34.2	0	0	0	110.4
705	P	85	Confident	80.8	Confident	105 Å²	105	122.6 Å²	122.6	68%	0.682	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-56.4	146.4	176.9	25	-33.6	0	0	0	110
706	P	85.8	Confident	80.4	Confident	83 Å²	83	123.6 Å²	123.6	54%	0.539	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-59.4	147.9	179.9	26.8	-34.7	0	0	0	110.2	N708	P706-N708 WeakPolarHBondContact CB-O 3.32Å; P706-N708 WeakPolarHBondContact CG-O 3.24Å; P706-N708 PolarHBondContact O-N 3.33Å; P706-N708 VanDerWaalsContact O-N 3.08Å
707	T	85	Confident	79.6	Confident	149 Å²	149	127 Å²	127	91%	0.914	70%	0.7	S	S	*	*	S	Bend	trans	-64.6	-14.5	-178.3	49.1	0	0	0	0	113.5
708	N	82	Confident	78.6	Confident	80 Å²	80	125.6 Å²	125.6	43%	0.428	70%	0.697	S	S	.	*	S	Bend	trans	-141.6	155.1	171.6	60.8	53.7	0	0	0	109.6	P706 N710	P706-N708 WeakPolarHBondContact CB-O 3.32Å; P706-N708 WeakPolarHBondContact CG-O 3.24Å; P706-N708 PolarHBondContact O-N 3.33Å; P706-N708 VanDerWaalsContact O-N 3.08Å; N708-N710 PolarHBondContact O-N 3.08Å; N708-N710 WeakPolarHBondContact OD1-CB 3.21Å; N708-N710 PolarHBondContact OD1-N 3.03Å
709	F	83.8	Confident	77.3	Confident	152 Å²	152	126.4 Å²	126.4	67%	0.667	70%	0.7	S	S	*	*			trans	-93.4	29.5	174.7	-62.9	-82	0	0	0	111.5	F711	F709-F711 VanDerWaalsContact C-N 3.27Å; F709-F711 HydrophobicContact CB-CE2 4.14Å; F709-F711 HydrophobicContact CB-CZ 4.39Å; F709-F711 HydrophobicContact CD1-CZ 4.1Å; F709-F711 WeakPolarHBondContact O-CD2 3.14Å; F709-F711 WeakPolarHBondContact O-CE2 3.49Å; F709-F711 PolarHBondContact O-N 3.44Å
710	N	81.1	Confident	76.3	Confident	133 Å²	133	130.4 Å²	130.4	71%	0.711	73%	0.726	S	S	*	*			trans	-80.8	81.6	173.5	-65.9	-14.3	0	0	0	107.8	N708	N708-N710 PolarHBondContact O-N 3.08Å; N708-N710 WeakPolarHBondContact OD1-CB 3.21Å; N708-N710 PolarHBondContact OD1-N 3.03Å
711	F	80.2	Confident	75.8	Confident	146 Å²	146	132.1 Å²	132.1	64%	0.64	73%	0.731	S	S	*	*			trans	-58.8	139.7	-179.6	-61.2	-77.2	0	0	0	110.9	F709 Y713	F709-F711 VanDerWaalsContact C-N 3.27Å; F709-F711 HydrophobicContact CB-CE2 4.14Å; F709-F711 HydrophobicContact CB-CZ 4.39Å; F709-F711 HydrophobicContact CD1-CZ 4.1Å; F709-F711 WeakPolarHBondContact O-CD2 3.14Å; F709-F711 WeakPolarHBondContact O-CE2 3.49Å; F709-F711 PolarHBondContact O-N 3.44Å; F711-Y713 PolarHBondContact O-N 2.85Å; F711-Y713 VanDerWaalsContact O-N 3.13Å
712	C	73.4	Confident	75.2	Confident	126 Å²	126	132.7 Å²	132.7	85%	0.851	73%	0.729	S	S	*	*	S	Bend	trans	-64.1	-16.2	179.4	-61.7	0	0	0	0	113.7
713	Y	74.3	Confident	74.4	Confident	177 Å²	177	132.5 Å²	132.5	69%	0.694	72%	0.723	S	S	*	*	S	Bend	trans	-125.7	132.9	177.3	-62.3	-77.1	0	0	0	108.8	F711 F715	F711-Y713 PolarHBondContact O-N 2.85Å; F711-Y713 VanDerWaalsContact O-N 3.13Å; Y713-F715 WeakPolarHBondContact O-CD2 3.44Å; Y713-F715 PolarHBondContact O-N 3.03Å
714	D	76.4	Confident	73.5	Confident	121 Å²	121	134.3 Å²	134.3	65%	0.647	73%	0.727	S	S	*	*			trans	-86.9	107.6	174.6	-167	-9.1	0	0	0	109.2	S716	D714-S716 PolarHBondContact O-N 3.23Å; D714-S716 WeakPolarHBondContact OD1-CB 3.5Å; D714-S716 PolarHBondContact OD1-N 3.3Å; D714-S716 PolarHBondContact OD1-OG 2.67Å; D714-S716 PolarHBondContact OD2-OG 2.58Å; D714-S716 VanDerWaalsContact OD2-OG 3.1Å
715	F	66.4	Low	72.6	Confident	152 Å²	152	135.7 Å²	135.7	67%	0.667	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	6.1	177.3	-65.2	-82.7	0	0	0	112.7	Y713 I717	Y713-F715 WeakPolarHBondContact O-CD2 3.44Å; Y713-F715 PolarHBondContact O-N 3.03Å; F715-I717 PolarHBondContact O-N 3.18Å
716	S	66.1	Low	71.8	Confident	91 Å²	91	137.7 Å²	137.7	64%	0.636	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-4.2	178.2	66.6	0	0	0	0	114.4	D714	D714-S716 PolarHBondContact O-N 3.23Å; D714-S716 WeakPolarHBondContact OD1-CB 3.5Å; D714-S716 PolarHBondContact OD1-N 3.3Å; D714-S716 PolarHBondContact OD1-OG 2.67Å; D714-S716 PolarHBondContact OD2-OG 2.58Å; D714-S716 VanDerWaalsContact OD2-OG 3.1Å
717	I	59.8	Low	70.8	Confident	143 Å²	143	141.6 Å²	141.6	73%	0.733	74%	0.744	S	S	*	*			trans	-105.9	66.3	172.5	-44.9	173.3	0	0	0	109.5	F715	F715-I717 PolarHBondContact O-N 3.18Å
718	I	52.5	Low	69.7	Low	138 Å²	138	141.1 Å²	141.1	71%	0.708	73%	0.73	S	S	*	*			trans	-127.3	95.7	153.8	-56.5	178.5	0	0	0	104.2
719	E	52.7	Low	68.7	Low	177 Å²	177	146.2 Å²	146.2	83%	0.827	76%	0.756	S	S	*	*			trans	-56.2	142.6	168.6	-81	-176.9	155.2	0	0	109.2
720	P	57.8	Low	67.3	Low	198 Å²	198	145.6 Å²	145.6	100%	1.286	76%	0.764	S	S	*	*			trans	-64.3	0	-173.9	26.6	-34.9	0	0	0	114.8

Retrieved 720 of 720 residues in 206.2 ms (Link to these results)

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