A0A096NLH5_PAPAN Loading...

Cytokine-like nuclear factor N-PAC

AlphaFold DB , UniProt , Accession A0A096NLH5, Species PAPAN (Papio anubis, Olive baboon), Gene GLYR1, Length 553 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	40	Very low	71.7	Confident	240 Å²	240	92.7 Å²	92.7	100%	1.182	55%	0.547	S	S	*	.				0	117.5	0	-79.8	-170.9	-104.8	0	0	108.2	A3	M1-A3 PolarHBondContact O-N 2.74Å
2	A	36.3	Very low	73.6	Confident	95 Å²	95	85 Å²	85	79%	0.785	50%	0.502	S	S	*	.			trans	-59.2	125.6	-179.4	0	0	0	0	0	110.2	V4	A2-V4 PolarHBondContact O-N 3.18Å
3	A	45.6	Very low	75	Confident	103 Å²	103	78.7 Å²	78.7	85%	0.851	46%	0.464	S	S	*	.			trans	-68.8	99.4	175.1	0	0	0	0	0	108.4	M1 S5	M1-A3 PolarHBondContact O-N 2.74Å; A3-S5 PolarHBondContact O-N 3.41Å; A3-S5 VanDerWaalsContact O-N 3.09Å
4	V	59.3	Low	76.2	Confident	91 Å²	91	73.1 Å²	73.1	55%	0.552	43%	0.432	S	S	*	.			trans	-66.1	113.9	178.9	-175.5	0	0	0	0	108.8	A2 L6 P62	A2-V4 PolarHBondContact O-N 3.18Å; V4-L6 HydrophobicContact CG1-CD2 4.37Å; V4-L6 PolarHBondContact O-N 3.27Å; V4-P62 HydrophobicContact CB-CG 4.12Å; V4-P62 HydrophobicContact CG1-CG 3.56Å; V4-P62 HydrophobicContact CG2-CG 4.2Å
5	S	76.4	Confident	77.1	Confident	87 Å²	87	75.3 Å²	75.3	61%	0.608	43%	0.433	S	S	*	.			trans	-77.3	101.1	175.9	-177	0	0	0	0	109.2	A3	A3-S5 PolarHBondContact O-N 3.41Å; A3-S5 VanDerWaalsContact O-N 3.09Å
6	L	86.2	Confident	77.6	Confident	21 Å²	21	75.4 Å²	75.4	11%	0.11	43%	0.432	C	S	.	.			trans	-81.1	140.6	174.2	-64.4	173.3	0	0	0	110.9	V4 D10 V12 I26 F42 L60 P62	V4-L6 HydrophobicContact CG1-CD2 4.37Å; V4-L6 PolarHBondContact O-N 3.27Å; L6-D10 WeakPolarHBondContact CA-OD2 3.44Å; L6-V12 HydrophobicContact CD1-CG1 4.31Å; L6-V12 HydrophobicContact CD2-CG1 3.81Å; L6-I26 HydrophobicContact CB-CD1 3.95Å; L6-I26 HydrophobicContact CD1-CD1 4.5Å; L6-F42 HydrophobicContact CB-CE2 3.89Å; L6-F42 HydrophobicContact CB-CZ 4.28Å; L6-F42 VanDerWaalsContact O-CZ 3.27Å; L6-F42 WeakPolarHBondContact O-CZ 3.45Å; L6-L60 HydrophobicContact CD1-CB 3.62Å; L6-L60 HydrophobicContact CD1-CD1 3.98Å; L6-L60 HydrophobicContact CD1-CG 4.44Å; L6-P62 HydrophobicContact CD2-CG 4.23Å
7	R	88.3	Confident	77.9	Confident	172 Å²	172	74.5 Å²	74.5	65%	0.649	44%	0.443	S	S	*	.			trans	-128.9	165.1	-177.8	-56.4	-178	-164.1	-179.1	5.2	111.9	G9 D10	R7-G9 PolarHBondContact O-N 2.99Å; R7-D10 PolarHBondContact N-OD2 3.13Å; R7-D10 WeakPolarHBondContact O-CB 3.49Å; R7-D10 PolarHBondContact O-N 3.07Å; R7-D10 VanDerWaalsContact O-N 3.17Å
8	L	86.3	Confident	78.1	Confident	102 Å²	102	84.5 Å²	84.5	53%	0.534	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	130.3	169.4	-80.4	161.8	0	0	0	109.8	I26 N28	L8-I26 HydrophobicContact CD2-CG2 4.07Å; L8-N28 WeakPolarHBondContact CD1-OD1 3.44Å; L8-N28 VanDerWaalsContact CD2-OD1 3.29Å; L8-N28 WeakPolarHBondContact CD2-OD1 3.45Å
9	G	86.4	Confident	78.4	Confident	34 Å²	34	88.9 Å²	88.9	35%	0.351	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.6	-15.5	-177.2	0	0	0	0	0	114.9	R7 K25 I26	R7-G9 PolarHBondContact O-N 2.99Å; G9-K25 WeakPolarHBondContact O-CE 3.44Å; G9-I26 WeakPolarHBondContact CA-O 3.5Å; G9-I26 PolarHBondContact N-O 3.47Å
10	D	91.7	Very high	78.8	Confident	56 Å²	56	87.1 Å²	87.1	30%	0.299	47%	0.474	S	S	.	.			trans	-68.3	142.7	-178.6	-70.7	-10.4	0	0	0	112.1	L6 R7 K25 I26	L6-D10 WeakPolarHBondContact CA-OD2 3.44Å; R7-D10 PolarHBondContact N-OD2 3.13Å; R7-D10 WeakPolarHBondContact O-CB 3.49Å; R7-D10 PolarHBondContact O-N 3.07Å; R7-D10 VanDerWaalsContact O-N 3.17Å; D10-K25 WeakPolarHBondContact O-CA 3.4Å; D10-I26 HydrophobicContact CB-CD1 4.32Å; D10-I26 PolarHBondContact O-N 2.81Å
11	L	92.6	Very high	79.4	Confident	19 Å²	19	84 Å²	84	10%	0.099	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.5	171	-63.2	173	0	0	0	109.7	G24 K25 F47 Y63 V86 F89 L90	L11-G24 WeakPolarHBondContact CA-O 3.49Å; L11-K25 HydrophobicContact CD2-CB 4.12Å; L11-K25 HydrophobicContact CD2-CG 4.25Å; L11-F47 HydrophobicContact CD2-CE2 3.56Å; L11-F47 HydrophobicContact CD2-CZ 3.74Å; L11-Y63 VanDerWaalsContact C-CB 3.49Å; L11-Y63 HydrophobicContact CB-CG 4.13Å; L11-Y63 VanDerWaalsContact O-CB 3.27Å; L11-Y63 WeakPolarHBondContact O-CB 3.35Å; L11-Y63 PolarHBondContact O-N 2.83Å; L11-V86 HydrophobicContact CD1-CG1 3.75Å; L11-V86 HydrophobicContact CD2-CG1 4.28Å; L11-F89 HydrophobicContact CD2-CD1 4.29Å; L11-F89 HydrophobicContact CD2-CE1 4.42Å; L11-L90 HydrophobicContact CD1-CD1 4.01Å; L11-L90 HydrophobicContact CD1-CD2 3.52Å; L11-L90 HydrophobicContact CD1-CG 3.76Å
12	V	94.5	Very high	82	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155.5	-172.6	-67.4	0	0	0	0	111.6	L6 G24 I26 V44 L60 K61	L6-V12 HydrophobicContact CD1-CG1 4.31Å; L6-V12 HydrophobicContact CD2-CG1 3.81Å; V12-G24 PolarHBondContact N-O 3.34Å; V12-G24 PolarHBondContact O-N 2.92Å; V12-I26 HydrophobicContact CG1-CD1 3.92Å; V12-I26 HydrophobicContact CG1-CG1 4.14Å; V12-I26 HydrophobicContact CG2-CG1 3.97Å; V12-V44 HydrophobicContact CG2-CG1 4.03Å; V12-V44 HydrophobicContact CG2-CG2 4.2Å; V12-L60 HydrophobicContact CB-CD2 4.17Å; V12-L60 HydrophobicContact CG2-CD2 3.88Å; V12-K61 CarbonylContact C-O 3.55Å; V12-K61 VanDerWaalsContact CA-O 3.32Å; V12-K61 WeakPolarHBondContact CA-O 3.35Å
13	W	91.8	Very high	84.7	Confident	3 Å²	3	70.3 Å²	70.3	1%	0.011	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.9	161.2	-60.5	100.1	0	0	0	108.3	P21 P23 L60 K61 Y63 K67 M70 I71 F79 V83	W13-P21 HydrophobicContact CB-CB 4.43Å; W13-P23 HydrophobicContact CE3-CB 4.01Å; W13-P23 HydrophobicContact CH2-CB 4.25Å; W13-P23 HydrophobicContact CZ3-CB 3.81Å; W13-P23 HydrophobicContact CZ3-CG 4.02Å; W13-L60 WeakPolarHBondContact O-CA 3.21Å; W13-K61 HydrophobicContact CB-CB 4.32Å; W13-K61 PolarHBondContact N-O 3.4Å; W13-K61 PolarHBondContact O-N 3.45Å; W13-Y63 HydrophobicContact CD2-CD2 4.05Å; W13-Y63 HydrophobicContact CD2-CE2 4.38Å; W13-Y63 AromaticContact CE2-CD2 3.42Å; W13-Y63 VanDerWaalsContact CE2-CD2 3.42Å; W13-Y63 AromaticContact CE2-CE2 3.63Å; W13-Y63 HydrophobicContact CH2-CD2 4.3Å; W13-Y63 AromaticContact CH2-CE2 3.67Å; W13-Y63 HydrophobicContact CH2-CE2 3.67Å; W13-Y63 AromaticContact CZ2-CD2 3.55Å; W13-Y63 HydrophobicContact CZ2-CD2 3.55Å; W13-Y63 AromaticContact CZ2-CE2 3.2Å; W13-Y63 HydrophobicContact CZ2-CE2 3.2Å; W13-Y63 HydrophobicContact CZ2-CG 4.49Å; W13-Y63 AromaticContact CZ2-CZ 3.94Å; W13-Y63 HydrophobicContact CZ3-CE2 4.39Å; W13-Y63 AromaticContact NE1-CD2 3.58Å; W13-Y63 PolarHBondContact NE1-O 3.25Å; W13-K67 HydrophobicContact CZ2-CB 4.5Å; W13-K67 HydrophobicContact CZ2-CG 4.49Å; W13-M70 HydrophobicContact CB-CG 4.3Å; W13-M70 HydrophobicContact CB-SD 4.43Å; W13-M70 HydrophobicContact CD2-CB 3.65Å; W13-M70 HydrophobicContact CD2-CG 3.58Å; W13-M70 HydrophobicContact CE3-CB 3.75Å; W13-M70 HydrophobicContact CE3-CG 4.06Å; W13-M70 HydrophobicContact CG-CB 4.28Å; W13-M70 HydrophobicContact CG-CG 3.66Å; W13-M70 HydrophobicContact CG-SD 4.4Å; W13-M70 HydrophobicContact CH2-CB 3.82Å; W13-M70 HydrophobicContact CZ2-CB 3.75Å; W13-M70 HydrophobicContact CZ2-CG 4.39Å; W13-M70 HydrophobicContact CZ3-CB 3.81Å; W13-I71 HydrophobicContact CH2-CG1 4.49Å; W13-F79 HydrophobicContact CH2-CZ 4.1Å; W13-F79 AromaticContact CZ3-CE2 3.8Å; W13-F79 HydrophobicContact CZ3-CE2 3.8Å; W13-F79 AromaticContact CZ3-CZ 3.61Å; W13-F79 HydrophobicContact CZ3-CZ 3.61Å; W13-V83 HydrophobicContact CH2-CG2 3.86Å; W13-V83 HydrophobicContact CZ3-CG2 4.34Å
14	G	91.7	Very high	87	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.2	177.7	0	0	0	0	0	111.9	P21 W22	G14-P21 WeakPolarHBondContact O-CA 3.22Å; G14-W22 PolarHBondContact N-O 3.38Å; G14-W22 PolarHBondContact O-N 3.12Å
15	K	89.2	Confident	88.7	Confident	105 Å²	105	63.7 Å²	63.7	46%	0.457	32%	0.318	S	S	.	.			trans	-104.1	119.9	173.9	-172.6	176.3	-179	176.1	0	110.8	P21 Q59	K15-P21 HydrophobicContact CB-CG 4.34Å; K15-P21 HydrophobicContact CD-CG 4.39Å; K15-P21 HydrophobicContact CG-CG 4.41Å; K15-Q59 HydrophobicContact CB-CB 4.5Å; K15-Q59 PolarHBondContact N-O 3.26Å; K15-Q59 VanDerWaalsContact N-O 3.09Å
16	L	85.3	Confident	89.5	Confident	78 Å²	78	59.6 Å²	59.6	41%	0.408	29%	0.289	S	S	.	.			trans	-115.6	114.7	179.1	-173.8	67.6	0	0	0	110.8	R18 Y19 A53 I55	L16-R18 PolarHBondContact O-N 3.47Å; L16-Y19 WeakPolarHBondContact O-CB 3.35Å; L16-Y19 WeakPolarHBondContact O-CD2 3.32Å; L16-Y19 PolarHBondContact O-N 3.1Å; L16-A53 HydrophobicContact CD2-CB 4.34Å; L16-I55 HydrophobicContact CB-CD1 4.22Å; L16-I55 HydrophobicContact CD1-CD1 3.82Å
17	G	82.3	Confident	89.8	Confident	60 Å²	60	60.6 Å²	60.6	62%	0.619	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	-124.7	175.6	0	0	0	0	0	113.5
18	R	81.6	Confident	89.7	Confident	254 Å²	254	58.1 Å²	58.1	96%	0.958	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-3.9	178.6	-63.8	-171.8	-175.6	-100.8	2.1	113.7	L16	L16-R18 PolarHBondContact O-N 3.47Å
19	Y	84	Confident	89.8	Confident	168 Å²	168	55.7 Å²	55.7	66%	0.659	29%	0.286	S	S	*	.	S	Bend	trans	-75.7	147.4	-178.9	-62	-72.8	0	0	0	111.5	L16	L16-Y19 WeakPolarHBondContact O-CB 3.35Å; L16-Y19 WeakPolarHBondContact O-CD2 3.32Å; L16-Y19 PolarHBondContact O-N 3.1Å
20	P	87.1	Confident	89.6	Confident	52 Å²	52	57.1 Å²	57.1	34%	0.338	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-61.7	152.3	172.7	27.1	-33.8	0	0	0	110.4	W22 N74	P20-W22 PolarHBondContact O-N 3.09Å; P20-N74 WeakPolarHBondContact CG-ND2 3.34Å
21	P	91	Very high	88.9	Confident	23 Å²	23	64.4 Å²	64.4	15%	0.149	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-54.2	131.4	174.8	-23.9	34	0	0	0	111.2	W13 G14 K15 M70 F79	W13-P21 HydrophobicContact CB-CB 4.43Å; G14-P21 WeakPolarHBondContact O-CA 3.22Å; K15-P21 HydrophobicContact CB-CG 4.34Å; K15-P21 HydrophobicContact CD-CG 4.39Å; K15-P21 HydrophobicContact CG-CG 4.41Å; P21-M70 HydrophobicContact CB-SD 3.6Å; P21-M70 VanDerWaalsContact CB-SD 3.6Å; P21-M70 HydrophobicContact CG-SD 3.75Å; P21-F79 WeakPolarHBondContact O-CE2 3.33Å
22	W	93.6	Very high	88.1	Confident	47 Å²	47	71 Å²	71	18%	0.178	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.6	-176	-159.2	-85.7	0	0	0	110.7	G14 P20 F46 F47 T49 R78 F79 A82	G14-W22 PolarHBondContact N-O 3.38Å; G14-W22 PolarHBondContact O-N 3.12Å; P20-W22 PolarHBondContact O-N 3.09Å; W22-F46 HydrophobicContact CB-CD1 3.87Å; W22-F46 HydrophobicContact CB-CE1 4.14Å; W22-F46 AromaticContact CD1-CD1 3.83Å; W22-F46 HydrophobicContact CG-CD1 4.22Å; W22-F47 PolarHBondContact NE1-O 3.21Å; W22-T49 HydrophobicContact CZ2-CG2 4Å; W22-R78 HydrophobicContact CH2-CB 4.27Å; W22-F79 HydrophobicContact CD2-CD2 4.13Å; W22-F79 AromaticContact CE3-CD2 3.7Å; W22-F79 HydrophobicContact CE3-CD2 3.7Å; W22-F79 HydrophobicContact CE3-CE2 4.48Å; W22-F79 VanDerWaalsContact CH2-CA 3.46Å; W22-F79 HydrophobicContact CH2-CB 3.76Å; W22-F79 HydrophobicContact CH2-CD2 4.23Å; W22-F79 HydrophobicContact CZ2-CB 4.5Å; W22-F79 HydrophobicContact CZ3-CB 3.82Å; W22-F79 AromaticContact CZ3-CD2 3.76Å; W22-F79 HydrophobicContact CZ3-CD2 3.76Å; W22-F79 HydrophobicContact CZ3-CG 4.29Å; W22-A82 HydrophobicContact CZ2-CB 3.63Å
23	P	94.3	Very high	87.4	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	138	-178.8	30.2	-35.6	0	0	0	111.9	W13 F46 F47 Y63 A82 V83 V86	W13-P23 HydrophobicContact CE3-CB 4.01Å; W13-P23 HydrophobicContact CH2-CB 4.25Å; W13-P23 HydrophobicContact CZ3-CB 3.81Å; W13-P23 HydrophobicContact CZ3-CG 4.02Å; P23-F46 WeakPolarHBondContact O-CA 3.2Å; P23-F47 PolarHBondContact O-N 3.44Å; P23-Y63 HydrophobicContact CB-CD2 4.15Å; P23-Y63 HydrophobicContact CB-CE2 3.74Å; P23-A82 HydrophobicContact CG-CB 3.85Å; P23-V83 HydrophobicContact CG-CG2 4.32Å; P23-V86 HydrophobicContact CB-CG2 3.82Å; P23-V86 HydrophobicContact CG-CG2 4.38Å
24	G	93.9	Very high	86.7	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	173	-175.8	0	0	0	0	0	113.2	L11 V12 K45	L11-G24 WeakPolarHBondContact CA-O 3.49Å; V12-G24 PolarHBondContact N-O 3.34Å; V12-G24 PolarHBondContact O-N 2.92Å; G24-K45 CarbonylContact C-O 3.4Å; G24-K45 WeakPolarHBondContact CA-O 3.22Å
25	K	94.1	Very high	86.1	Confident	56 Å²	56	89.5 Å²	89.5	24%	0.243	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.9	174.4	-171.9	176	-179.3	179	0	110.1	G9 D10 L11 V27 V44 K45 F47 F89	G9-K25 WeakPolarHBondContact O-CE 3.44Å; D10-K25 WeakPolarHBondContact O-CA 3.4Å; L11-K25 HydrophobicContact CD2-CB 4.12Å; L11-K25 HydrophobicContact CD2-CG 4.25Å; K25-V27 HydrophobicContact CB-CG1 4.31Å; K25-V27 HydrophobicContact CD-CG1 4.33Å; K25-V27 HydrophobicContact CG-CG1 4.13Å; K25-V27 PolarHBondContact O-N 3.31Å; K25-V44 WeakPolarHBondContact O-CA 3.46Å; K25-K45 PolarHBondContact N-O 2.92Å; K25-K45 PolarHBondContact O-N 3.45Å; K25-F47 HydrophobicContact CB-CE2 3.83Å; K25-F47 HydrophobicContact CB-CZ 4.29Å; K25-F89 HydrophobicContact CD-CE1 4.49Å; K25-F89 HydrophobicContact CD-CZ 4.35Å; K25-F89 VanDerWaalsContact NZ-CZ 3.29Å
26	I	93.1	Very high	85.7	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.005	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	120.5	171.3	-59.4	179.2	0	0	0	108.6	L6 L8 G9 D10 V12 F42 F43 V44 L60	L6-I26 HydrophobicContact CB-CD1 3.95Å; L6-I26 HydrophobicContact CD1-CD1 4.5Å; L8-I26 HydrophobicContact CD2-CG2 4.07Å; G9-I26 WeakPolarHBondContact CA-O 3.5Å; G9-I26 PolarHBondContact N-O 3.47Å; D10-I26 HydrophobicContact CB-CD1 4.32Å; D10-I26 PolarHBondContact O-N 2.81Å; V12-I26 HydrophobicContact CG1-CD1 3.92Å; V12-I26 HydrophobicContact CG1-CG1 4.14Å; V12-I26 HydrophobicContact CG2-CG1 3.97Å; I26-F42 HydrophobicContact CD1-CB 4.14Å; I26-F42 HydrophobicContact CD1-CD1 4.15Å; I26-F42 HydrophobicContact CD1-CD2 4.08Å; I26-F42 HydrophobicContact CD1-CG 3.86Å; I26-F42 HydrophobicContact CG1-CB 4.22Å; I26-F42 HydrophobicContact CG1-CG 4.43Å; I26-F42 HydrophobicContact CG2-CB 3.94Å; I26-F42 HydrophobicContact CG2-CD1 3.51Å; I26-F42 HydrophobicContact CG2-CE1 4.29Å; I26-F42 HydrophobicContact CG2-CG 3.96Å; I26-F43 WeakPolarHBondContact CA-O 3.43Å; I26-V44 HydrophobicContact CG1-CG2 4.3Å; I26-L60 HydrophobicContact CD1-CD1 4.48Å
27	V	92.3	Very high	85	Confident	42 Å²	42	95.8 Å²	95.8	26%	0.255	46%	0.461	S	S	.	.			trans	-131.3	164.6	-178.4	-59.6	0	0	0	0	111.1	K25 F43 K45	K25-V27 HydrophobicContact CB-CG1 4.31Å; K25-V27 HydrophobicContact CD-CG1 4.33Å; K25-V27 HydrophobicContact CG-CG1 4.13Å; K25-V27 PolarHBondContact O-N 3.31Å; V27-F43 HydrophobicContact CG2-CD1 3.74Å; V27-F43 HydrophobicContact CG2-CE1 4.08Å; V27-F43 PolarHBondContact N-O 3.16Å; V27-K45 HydrophobicContact CG1-CB 4.4Å; V27-K45 HydrophobicContact CG2-CB 3.89Å
28	N	87.7	Confident	84.3	Confident	119 Å²	119	97 Å²	97	64%	0.636	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-67.8	137.5	172.3	-77.9	-33.5	0	0	0	110	L8	L8-N28 WeakPolarHBondContact CD1-OD1 3.44Å; L8-N28 VanDerWaalsContact CD2-OD1 3.29Å; L8-N28 WeakPolarHBondContact CD2-OD1 3.45Å
29	P	87.6	Confident	83.9	Confident	51 Å²	51	91 Å²	91	33%	0.331	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-66.3	150.1	175.2	30.6	-36.6	0	0	0	111.1	F43 W54	P29-F43 HydrophobicContact CB-CB 4.22Å; P29-F43 HydrophobicContact CB-CD1 4.07Å; P29-F43 HydrophobicContact CB-CD2 4.3Å; P29-F43 HydrophobicContact CB-CE1 4.47Å; P29-F43 HydrophobicContact CB-CG 3.94Å; P29-W54 HydrophobicContact CB-CH2 3.99Å; P29-W54 HydrophobicContact CB-CZ2 3.64Å; P29-W54 HydrophobicContact CG-CH2 3.8Å; P29-W54 HydrophobicContact CG-CZ2 3.9Å
30	P	83.4	Confident	83.8	Confident	65 Å²	65	91.7 Å²	91.7	42%	0.422	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-56.4	150.9	167.3	-23.2	33.1	0	0	0	111.5	D32 L33 F43	P30-D32 PolarHBondContact O-N 2.94Å; P30-L33 PolarHBondContact O-N 3.49Å; P30-L33 VanDerWaalsContact O-N 3.12Å; P30-F43 VanDerWaalsContact CD-CE1 3.47Å; P30-F43 VanDerWaalsContact CD-CZ 3.49Å; P30-F43 HydrophobicContact CG-CE1 4.45Å; P30-F43 HydrophobicContact CG-CZ 4.31Å
31	K	75.3	Confident	83.9	Confident	209 Å²	209	89.6 Å²	89.6	91%	0.909	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.3	-172.9	-68.7	-176.5	179	179.2	0	113.9
32	D	75.6	Confident	84	Confident	157 Å²	157	90.9 Å²	90.9	84%	0.84	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-3.3	-173.6	-47.5	-47.5	0	0	0	113.4	P30	P30-D32 PolarHBondContact O-N 2.94Å
33	L	79.9	Confident	83.9	Confident	74 Å²	74	89.1 Å²	89.1	39%	0.387	44%	0.444	S	S	.	.			trans	-97.6	110.4	-171.2	-149.1	83.8	0	0	0	112.1	P30 F43	P30-L33 PolarHBondContact O-N 3.49Å; P30-L33 VanDerWaalsContact O-N 3.12Å; L33-F43 HydrophobicContact CD2-CD2 3.9Å; L33-F43 HydrophobicContact CD2-CE2 3.19Å; L33-F43 HydrophobicContact CD2-CZ 3.83Å
34	K	77.4	Confident	83.8	Confident	197 Å²	197	89.1 Å²	89.1	86%	0.857	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-71.1	130.5	178	-68.7	-175.7	-178.5	176	0	111.6
35	K	79.5	Confident	83.8	Confident	121 Å²	121	94.4 Å²	94.4	53%	0.526	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-68.4	134.4	173.8	-174	172.9	-174.8	174.4	0	111	R37 C41 W54	K35-R37 PolarHBondContact O-N 2.97Å; K35-C41 VanDerWaalsContact CE-SG 3.52Å; K35-W54 HydrophobicContact CB-CH2 3.75Å; K35-W54 HydrophobicContact CB-CZ2 3.77Å; K35-W54 HydrophobicContact CB-CZ3 4.3Å; K35-W54 HydrophobicContact CD-CH2 3.9Å; K35-W54 HydrophobicContact CD-CZ3 3.85Å; K35-W54 HydrophobicContact CG-CD2 4.47Å; K35-W54 HydrophobicContact CG-CE3 4.1Å; K35-W54 HydrophobicContact CG-CH2 3.64Å; K35-W54 HydrophobicContact CG-CZ2 4.05Å; K35-W54 HydrophobicContact CG-CZ3 3.67Å
36	P	81.1	Confident	83.7	Confident	66 Å²	66	92.6 Å²	92.6	43%	0.429	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-56.9	133.6	173.5	-24.9	33.6	0	0	0	112.2	W54	P36-W54 VanDerWaalsContact CD-CG 3.46Å; P36-W54 HydrophobicContact CG-CB 3.83Å; P36-W54 HydrophobicContact CG-CD2 4.41Å; P36-W54 HydrophobicContact CG-CG 3.83Å
37	R	70.9	Confident	83.5	Confident	250 Å²	250	94 Å²	94	94%	0.943	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	141	178.3	-71.7	-176.5	175.7	-178.9	-1.7	111	K35	K35-R37 PolarHBondContact O-N 2.97Å
38	G	66.7	Low	83.1	Confident	85 Å²	85	94.9 Å²	94.9	88%	0.876	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.4	-8.7	162.7	0	0	0	0	0	118.4
39	K	73.1	Confident	82.6	Confident	127 Å²	127	91.2 Å²	91.2	55%	0.552	47%	0.465	S	S	*	.	S	Bend	trans	-135.2	143.2	176.5	-66.1	-171	176.2	-167	0	112.7	C41 K56	K39-C41 PolarHBondContact O-N 3.19Å; K39-C41 PolarHBondContact O-SG 3.05Å; K39-C41 VanDerWaalsContact O-SG 3.41Å; K39-K56 HydrophobicContact CD-CD 4.01Å
40	K	82.8	Confident	82.1	Confident	184 Å²	184	97 Å²	97	80%	0.8	49%	0.487	S	S	*	.			trans	-63.2	111	169.8	-74.3	-173.9	-179.2	177.9	0	108.2	V57	K40-V57 HydrophobicContact CB-CG2 3.84Å; K40-V57 WeakPolarHBondContact O-CG2 3.34Å; K40-V57 PolarHBondContact O-N 3.22Å; K40-V57 VanDerWaalsContact O-N 3.1Å
41	C	88.9	Confident	82.2	Confident	8 Å²	8	98.7 Å²	98.7	5%	0.054	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	148.8	178.1	53	0	0	0	0	109.9	K35 K39 W54 I55	K35-C41 VanDerWaalsContact CE-SG 3.52Å; K39-C41 PolarHBondContact O-N 3.19Å; K39-C41 PolarHBondContact O-SG 3.05Å; K39-C41 VanDerWaalsContact O-SG 3.41Å; C41-W54 HydrophobicContact CB-CE3 4.31Å; C41-I55 CarbonylContact C-O 3.48Å; C41-I55 WeakPolarHBondContact CA-O 3.27Å; C41-I55 WeakPolarHBondContact CB-O 3.38Å
42	F	92.1	Very high	83	Confident	50 Å²	50	93.5 Å²	93.5	22%	0.219	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	148.2	173.2	-76	-74.1	0	0	0	109.5	L6 I26 V44 W54 I55 V57 L60	L6-F42 HydrophobicContact CB-CE2 3.89Å; L6-F42 HydrophobicContact CB-CZ 4.28Å; L6-F42 VanDerWaalsContact O-CZ 3.27Å; L6-F42 WeakPolarHBondContact O-CZ 3.45Å; I26-F42 HydrophobicContact CD1-CB 4.14Å; I26-F42 HydrophobicContact CD1-CD1 4.15Å; I26-F42 HydrophobicContact CD1-CD2 4.08Å; I26-F42 HydrophobicContact CD1-CG 3.86Å; I26-F42 HydrophobicContact CG1-CB 4.22Å; I26-F42 HydrophobicContact CG1-CG 4.43Å; I26-F42 HydrophobicContact CG2-CB 3.94Å; I26-F42 HydrophobicContact CG2-CD1 3.51Å; I26-F42 HydrophobicContact CG2-CE1 4.29Å; I26-F42 HydrophobicContact CG2-CG 3.96Å; F42-V44 HydrophobicContact CB-CG2 4.49Å; F42-W54 WeakPolarHBondContact O-CA 3.45Å; F42-I55 PolarHBondContact N-O 3.17Å; F42-I55 PolarHBondContact O-N 3.05Å; F42-V57 HydrophobicContact CD2-CG2 3.82Å; F42-V57 HydrophobicContact CE2-CG2 3.75Å; F42-L60 HydrophobicContact CB-CD1 3.95Å; F42-L60 HydrophobicContact CD2-CD1 3.84Å; F42-L60 HydrophobicContact CG-CD1 4.34Å
43	F	92.7	Very high	83.7	Confident	9 Å²	9	87 Å²	87	4%	0.039	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	119.3	172.7	-171.7	-104.9	0	0	0	108.5	I26 V27 P29 P30 L33 H52 W54	I26-F43 WeakPolarHBondContact CA-O 3.43Å; V27-F43 HydrophobicContact CG2-CD1 3.74Å; V27-F43 HydrophobicContact CG2-CE1 4.08Å; V27-F43 PolarHBondContact N-O 3.16Å; P29-F43 HydrophobicContact CB-CB 4.22Å; P29-F43 HydrophobicContact CB-CD1 4.07Å; P29-F43 HydrophobicContact CB-CD2 4.3Å; P29-F43 HydrophobicContact CB-CE1 4.47Å; P29-F43 HydrophobicContact CB-CG 3.94Å; P30-F43 VanDerWaalsContact CD-CE1 3.47Å; P30-F43 VanDerWaalsContact CD-CZ 3.49Å; P30-F43 HydrophobicContact CG-CE1 4.45Å; P30-F43 HydrophobicContact CG-CZ 4.31Å; L33-F43 HydrophobicContact CD2-CD2 3.9Å; L33-F43 HydrophobicContact CD2-CE2 3.19Å; L33-F43 HydrophobicContact CD2-CZ 3.83Å; F43-H52 HydrophobicContact CE1-CB 4.03Å; F43-H52 HydrophobicContact CE2-CB 4.2Å; F43-H52 AromaticContact CE2-CD2 3.76Å; F43-H52 HydrophobicContact CZ-CB 3.62Å; F43-H52 AromaticContact CZ-CD2 3.28Å; F43-H52 WeakPolarHBondContact CZ-CD2 3.44Å; F43-H52 AromaticContact CZ-CG 3.68Å; F43-W54 HydrophobicContact CB-CD2 4.21Å; F43-W54 HydrophobicContact CB-CE3 3.95Å; F43-W54 HydrophobicContact CB-CH2 4.09Å; F43-W54 HydrophobicContact CB-CZ2 4.35Å; F43-W54 HydrophobicContact CB-CZ3 3.88Å; F43-W54 AromaticContact CD2-CD2 3.96Å; F43-W54 HydrophobicContact CD2-CD2 3.96Å; F43-W54 AromaticContact CD2-CE2 3.83Å; F43-W54 HydrophobicContact CD2-CG 4.14Å; F43-W54 HydrophobicContact CD2-CZ2 4.33Å; F43-W54 AromaticContact CD2-NE1 3.91Å
44	V	92.3	Very high	84.2	Confident	0 Å²	0	86 Å²	86	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.2	-172.5	-178.2	0	0	0	0	108.9	V12 K25 I26 F42 F46 H52 A53 I55 L60	V12-V44 HydrophobicContact CG2-CG1 4.03Å; V12-V44 HydrophobicContact CG2-CG2 4.2Å; K25-V44 WeakPolarHBondContact O-CA 3.46Å; I26-V44 HydrophobicContact CG1-CG2 4.3Å; F42-V44 HydrophobicContact CB-CG2 4.49Å; V44-F46 HydrophobicContact CG1-CD1 4.34Å; V44-F46 HydrophobicContact CG1-CE1 4.1Å; V44-F46 HydrophobicContact CG1-CZ 4.24Å; V44-H52 CarbonylContact O-C 3.47Å; V44-H52 WeakPolarHBondContact O-CA 3.34Å; V44-A53 PolarHBondContact N-O 2.91Å; V44-A53 PolarHBondContact O-N 2.96Å; V44-I55 HydrophobicContact CB-CG1 4.11Å; V44-I55 HydrophobicContact CG2-CB 4.19Å; V44-I55 HydrophobicContact CG2-CG1 3.99Å; V44-L60 HydrophobicContact CG2-CD1 4.5Å; V44-L60 HydrophobicContact CG2-CD2 3.98Å
45	K	92.4	Very high	84.9	Confident	112 Å²	112	76.6 Å²	76.6	49%	0.487	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.3	166.7	-178.3	174.8	-178.1	173.8	0	108.4	G24 K25 V27	G24-K45 CarbonylContact C-O 3.4Å; G24-K45 WeakPolarHBondContact CA-O 3.22Å; K25-K45 PolarHBondContact N-O 2.92Å; K25-K45 PolarHBondContact O-N 3.45Å; V27-K45 HydrophobicContact CG1-CB 4.4Å; V27-K45 HydrophobicContact CG2-CB 3.89Å
46	F	93.1	Very high	85.4	Confident	17 Å²	17	74.3 Å²	74.3	8%	0.075	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	149.4	-177.9	-67.9	-75.5	0	0	0	111.1	W22 P23 V44 T49 D51 A53 I55	W22-F46 HydrophobicContact CB-CD1 3.87Å; W22-F46 HydrophobicContact CB-CE1 4.14Å; W22-F46 AromaticContact CD1-CD1 3.83Å; W22-F46 HydrophobicContact CG-CD1 4.22Å; P23-F46 WeakPolarHBondContact O-CA 3.2Å; V44-F46 HydrophobicContact CG1-CD1 4.34Å; V44-F46 HydrophobicContact CG1-CE1 4.1Å; V44-F46 HydrophobicContact CG1-CZ 4.24Å; F46-T49 WeakPolarHBondContact CB-OG1 3.39Å; F46-D51 HydrophobicContact CD2-CB 4.25Å; F46-D51 PolarHBondContact N-O 3.49Å; F46-A53 HydrophobicContact CE2-CB 4.19Å; F46-I55 HydrophobicContact CZ-CD1 4.02Å; F46-I55 HydrophobicContact CZ-CG1 4.09Å
47	F	88.9	Confident	85.8	Confident	31 Å²	31	73.7 Å²	73.7	14%	0.136	38%	0.375	C	S	.	.	S	Bend	trans	-87	147.8	175.7	-78.2	-96.7	0	0	0	110.3	L11 W22 P23 K25 T49 A82 A85 V86 F89	L11-F47 HydrophobicContact CD2-CE2 3.56Å; L11-F47 HydrophobicContact CD2-CZ 3.74Å; W22-F47 PolarHBondContact NE1-O 3.21Å; P23-F47 PolarHBondContact O-N 3.44Å; K25-F47 HydrophobicContact CB-CE2 3.83Å; K25-F47 HydrophobicContact CB-CZ 4.29Å; F47-T49 PolarHBondContact O-N 3.08Å; F47-A82 HydrophobicContact CB-CB 4.5Å; F47-A82 WeakPolarHBondContact O-CB 3.23Å; F47-A85 HydrophobicContact CD1-CB 4.19Å; F47-V86 HydrophobicContact CB-CG2 3.84Å; F47-V86 HydrophobicContact CD1-CG2 3.9Å; F47-V86 HydrophobicContact CD2-CG2 3.47Å; F47-V86 VanDerWaalsContact CD2-CG2 3.47Å; F47-V86 HydrophobicContact CE1-CG2 4.3Å; F47-V86 HydrophobicContact CE2-CG2 3.9Å; F47-V86 HydrophobicContact CG-CG2 3.46Å; F47-V86 VanDerWaalsContact CG-CG2 3.46Å; F47-V86 HydrophobicContact CZ-CG2 4.29Å; F47-F89 HydrophobicContact CE1-CB 3.86Å; F47-F89 HydrophobicContact CE1-CD2 4.47Å; F47-F89 HydrophobicContact CE1-CG 4.02Å; F47-F89 HydrophobicContact CZ-CB 4.32Å; F47-F89 HydrophobicContact CZ-CD1 4.17Å; F47-F89 HydrophobicContact CZ-CG 4.09Å
48	G	83.8	Confident	86.6	Confident	60 Å²	60	68.7 Å²	68.7	62%	0.619	36%	0.362	S	S	*	.	S	Bend	trans	68.5	-3.8	-179.4	0	0	0	0	0	114.8
49	T	76.2	Confident	87.7	Confident	43 Å²	43	67.6 Å²	67.6	26%	0.264	33%	0.334	S	S	.	.	S	Bend	trans	-129.7	153.3	166.4	76.4	0	0	0	0	108.3	W22 F46 F47 D51	W22-T49 HydrophobicContact CZ2-CG2 4Å; F46-T49 WeakPolarHBondContact CB-OG1 3.39Å; F47-T49 PolarHBondContact O-N 3.08Å; T49-D51 WeakPolarHBondContact CB-OD2 3.42Å; T49-D51 PolarHBondContact O-N 3.45Å; T49-D51 WeakPolarHBondContact OG1-CB 3.35Å; T49-D51 PolarHBondContact OG1-N 2.68Å; T49-D51 PolarHBondContact OG1-OD2 2.88Å
50	E	78.2	Confident	88.6	Confident	172 Å²	172	62.2 Å²	62.2	80%	0.804	31%	0.312	S	S	*	.			trans	-85	10.6	173	-60.6	-152.8	141.9	0	0	112.3	H52	E50-H52 PolarHBondContact O-ND1 3.22Å
51	D	86	Confident	89	Confident	101 Å²	101	57 Å²	57	54%	0.54	29%	0.289	S	S	.	.			trans	-73.4	148.4	-176.6	-55.5	-46.3	0	0	0	112	F46 T49	F46-D51 HydrophobicContact CD2-CB 4.25Å; F46-D51 PolarHBondContact N-O 3.49Å; T49-D51 WeakPolarHBondContact CB-OD2 3.42Å; T49-D51 PolarHBondContact O-N 3.45Å; T49-D51 WeakPolarHBondContact OG1-CB 3.35Å; T49-D51 PolarHBondContact OG1-N 2.68Å; T49-D51 PolarHBondContact OG1-OD2 2.88Å
52	H	90.9	Very high	89.2	Confident	100 Å²	100	58 Å²	58	46%	0.463	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	140.7	176.9	52	-88.8	0	0	0	110.2	F43 V44 E50	F43-H52 HydrophobicContact CE1-CB 4.03Å; F43-H52 HydrophobicContact CE2-CB 4.2Å; F43-H52 AromaticContact CE2-CD2 3.76Å; F43-H52 HydrophobicContact CZ-CB 3.62Å; F43-H52 AromaticContact CZ-CD2 3.28Å; F43-H52 WeakPolarHBondContact CZ-CD2 3.44Å; F43-H52 AromaticContact CZ-CG 3.68Å; V44-H52 CarbonylContact O-C 3.47Å; V44-H52 WeakPolarHBondContact O-CA 3.34Å; E50-H52 PolarHBondContact O-ND1 3.22Å
53	A	91	Very high	89.1	Confident	20 Å²	20	55.7 Å²	55.7	17%	0.165	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	156.6	-177.9	0	0	0	0	0	112.6	L16 V44 F46 I55	L16-A53 HydrophobicContact CD2-CB 4.34Å; V44-A53 PolarHBondContact N-O 2.91Å; V44-A53 PolarHBondContact O-N 2.96Å; F46-A53 HydrophobicContact CE2-CB 4.19Å; A53-I55 HydrophobicContact CB-CD1 3.88Å; A53-I55 PolarHBondContact O-N 3.35Å
54	W	91.1	Very high	88.8	Confident	52 Å²	52	60.9 Å²	60.9	20%	0.197	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	112.1	165.7	-70.6	101.7	0	0	0	109.7	P29 K35 P36 C41 F42 F43	P29-W54 HydrophobicContact CB-CH2 3.99Å; P29-W54 HydrophobicContact CB-CZ2 3.64Å; P29-W54 HydrophobicContact CG-CH2 3.8Å; P29-W54 HydrophobicContact CG-CZ2 3.9Å; K35-W54 HydrophobicContact CB-CH2 3.75Å; K35-W54 HydrophobicContact CB-CZ2 3.77Å; K35-W54 HydrophobicContact CB-CZ3 4.3Å; K35-W54 HydrophobicContact CD-CH2 3.9Å; K35-W54 HydrophobicContact CD-CZ3 3.85Å; K35-W54 HydrophobicContact CG-CD2 4.47Å; K35-W54 HydrophobicContact CG-CE3 4.1Å; K35-W54 HydrophobicContact CG-CH2 3.64Å; K35-W54 HydrophobicContact CG-CZ2 4.05Å; K35-W54 HydrophobicContact CG-CZ3 3.67Å; P36-W54 VanDerWaalsContact CD-CG 3.46Å; P36-W54 HydrophobicContact CG-CB 3.83Å; P36-W54 HydrophobicContact CG-CD2 4.41Å; P36-W54 HydrophobicContact CG-CG 3.83Å; C41-W54 HydrophobicContact CB-CE3 4.31Å; F42-W54 WeakPolarHBondContact O-CA 3.45Å; F43-W54 HydrophobicContact CB-CD2 4.21Å; F43-W54 HydrophobicContact CB-CE3 3.95Å; F43-W54 HydrophobicContact CB-CH2 4.09Å; F43-W54 HydrophobicContact CB-CZ2 4.35Å; F43-W54 HydrophobicContact CB-CZ3 3.88Å; F43-W54 AromaticContact CD2-CD2 3.96Å; F43-W54 HydrophobicContact CD2-CD2 3.96Å; F43-W54 AromaticContact CD2-CE2 3.83Å; F43-W54 HydrophobicContact CD2-CG 4.14Å; F43-W54 HydrophobicContact CD2-CZ2 4.33Å; F43-W54 AromaticContact CD2-NE1 3.91Å
55	I	90.7	Very high	88.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.5	-180	-51	-60.5	0	0	0	109.5	L16 C41 F42 V44 F46 A53 Q59 L60	L16-I55 HydrophobicContact CB-CD1 4.22Å; L16-I55 HydrophobicContact CD1-CD1 3.82Å; C41-I55 CarbonylContact C-O 3.48Å; C41-I55 WeakPolarHBondContact CA-O 3.27Å; C41-I55 WeakPolarHBondContact CB-O 3.38Å; F42-I55 PolarHBondContact N-O 3.17Å; F42-I55 PolarHBondContact O-N 3.05Å; V44-I55 HydrophobicContact CB-CG1 4.11Å; V44-I55 HydrophobicContact CG2-CB 4.19Å; V44-I55 HydrophobicContact CG2-CG1 3.99Å; F46-I55 HydrophobicContact CZ-CD1 4.02Å; F46-I55 HydrophobicContact CZ-CG1 4.09Å; A53-I55 HydrophobicContact CB-CD1 3.88Å; A53-I55 PolarHBondContact O-N 3.35Å; I55-Q59 HydrophobicContact CG2-CB 3.73Å; I55-L60 HydrophobicContact CB-CD2 3.88Å; I55-L60 HydrophobicContact CB-CG 4.27Å; I55-L60 HydrophobicContact CG2-CD2 3.51Å; I55-L60 HydrophobicContact CG2-CG 3.79Å
56	K	90.9	Very high	88.2	Confident	73 Å²	73	61.7 Å²	61.7	32%	0.317	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	146.3	176.8	-61.8	175.7	-171.4	162.6	0	109.8	K39 E58 Q59	K39-K56 HydrophobicContact CD-CD 4.01Å; K56-E58 HydrophobicContact CB-CG 3.96Å; K56-E58 WeakPolarHBondContact CD-OE1 3.38Å; K56-E58 IonicContact NZ-OE1 2.79Å; K56-E58 PolarHBondContact O-N 2.94Å; K56-Q59 HydrophobicContact CB-CG 4.42Å; K56-Q59 WeakPolarHBondContact O-CA 3.36Å; K56-Q59 WeakPolarHBondContact O-CB 3.4Å; K56-Q59 PolarHBondContact O-N 3.3Å
57	V	89.1	Confident	87.8	Confident	54 Å²	54	63.8 Å²	63.8	33%	0.327	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-56.3	-36.3	-179.4	176.4	0	0	0	0	112.3	K40 F42 Q59 L60	K40-V57 HydrophobicContact CB-CG2 3.84Å; K40-V57 WeakPolarHBondContact O-CG2 3.34Å; K40-V57 PolarHBondContact O-N 3.22Å; K40-V57 VanDerWaalsContact O-N 3.1Å; F42-V57 HydrophobicContact CD2-CG2 3.82Å; F42-V57 HydrophobicContact CE2-CG2 3.75Å; V57-Q59 PolarHBondContact O-N 2.87Å; V57-Q59 VanDerWaalsContact O-N 3.17Å; V57-L60 PolarHBondContact O-N 3.1Å; V57-L60 VanDerWaalsContact O-N 3.1Å
58	E	88.1	Confident	87.7	Confident	144 Å²	144	69.6 Å²	69.6	67%	0.673	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-63.3	-17.9	176.5	70.2	-159	-179.3	0	0	114.2	K56	K56-E58 HydrophobicContact CB-CG 3.96Å; K56-E58 WeakPolarHBondContact CD-OE1 3.38Å; K56-E58 IonicContact NZ-OE1 2.79Å; K56-E58 PolarHBondContact O-N 2.94Å
59	Q	90.3	Very high	87.9	Confident	62 Å²	62	71.1 Å²	71.1	29%	0.29	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-103.8	8.6	179.7	-62.7	175.4	-43	0	0	112.4	K15 I55 K56 V57	K15-Q59 HydrophobicContact CB-CB 4.5Å; K15-Q59 PolarHBondContact N-O 3.26Å; K15-Q59 VanDerWaalsContact N-O 3.09Å; I55-Q59 HydrophobicContact CG2-CB 3.73Å; K56-Q59 HydrophobicContact CB-CG 4.42Å; K56-Q59 WeakPolarHBondContact O-CA 3.36Å; K56-Q59 WeakPolarHBondContact O-CB 3.4Å; K56-Q59 PolarHBondContact O-N 3.3Å; V57-Q59 PolarHBondContact O-N 2.87Å; V57-Q59 VanDerWaalsContact O-N 3.17Å
60	L	91.4	Very high	88.4	Confident	14 Å²	14	69.4 Å²	69.4	7%	0.073	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.7	177.4	-64.9	175.6	0	0	0	110.4	L6 V12 W13 I26 F42 V44 I55 V57	L6-L60 HydrophobicContact CD1-CB 3.62Å; L6-L60 HydrophobicContact CD1-CD1 3.98Å; L6-L60 HydrophobicContact CD1-CG 4.44Å; V12-L60 HydrophobicContact CB-CD2 4.17Å; V12-L60 HydrophobicContact CG2-CD2 3.88Å; W13-L60 WeakPolarHBondContact O-CA 3.21Å; I26-L60 HydrophobicContact CD1-CD1 4.48Å; F42-L60 HydrophobicContact CB-CD1 3.95Å; F42-L60 HydrophobicContact CD2-CD1 3.84Å; F42-L60 HydrophobicContact CG-CD1 4.34Å; V44-L60 HydrophobicContact CG2-CD1 4.5Å; V44-L60 HydrophobicContact CG2-CD2 3.98Å; I55-L60 HydrophobicContact CB-CD2 3.88Å; I55-L60 HydrophobicContact CB-CG 4.27Å; I55-L60 HydrophobicContact CG2-CD2 3.51Å; I55-L60 HydrophobicContact CG2-CG 3.79Å; V57-L60 PolarHBondContact O-N 3.1Å; V57-L60 VanDerWaalsContact O-N 3.1Å
61	K	91.2	Very high	88.7	Confident	75 Å²	75	63.6 Å²	63.6	33%	0.326	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.6	169.5	-72.2	-178	168.7	-163	0	109.4	V12 W13 Y63 H66 E69 M70	V12-K61 CarbonylContact C-O 3.55Å; V12-K61 VanDerWaalsContact CA-O 3.32Å; V12-K61 WeakPolarHBondContact CA-O 3.35Å; W13-K61 HydrophobicContact CB-CB 4.32Å; W13-K61 PolarHBondContact N-O 3.4Å; W13-K61 PolarHBondContact O-N 3.45Å; K61-Y63 PolarHBondContact O-N 3.29Å; K61-H66 HydrophobicContact CB-CB 4.42Å; K61-H66 HydrophobicContact CD-CB 4.44Å; K61-E69 IonicContact NZ-OE1 3.62Å; K61-E69 PolarHBondContact NZ-OE1 2.94Å; K61-E69 IonicContact NZ-OE2 3.14Å; K61-E69 PolarHBondContact NZ-OE2 3.35Å; K61-M70 HydrophobicContact CD-CE 3.7Å
62	P	91.9	Very high	88.7	Confident	29 Å²	29	66.5 Å²	66.5	19%	0.188	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	136.1	174.3	-23.1	31.1	0	0	0	111.7	V4 L6 A65 H66	V4-P62 HydrophobicContact CB-CG 4.12Å; V4-P62 HydrophobicContact CG1-CG 3.56Å; V4-P62 HydrophobicContact CG2-CG 4.2Å; L6-P62 HydrophobicContact CD2-CG 4.23Å; P62-A65 HydrophobicContact CB-CB 4.37Å; P62-H66 PolarHBondContact O-ND1 2.96Å; P62-H66 VanDerWaalsContact O-ND1 3.13Å
63	Y	89.8	Confident	88.4	Confident	1 Å²	1	66.3 Å²	66.3	0%	0.004	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-56.5	-170.6	-178.5	-98.1	0	0	0	113.1	L11 W13 P23 K61 A65 H66 K67 V86 E87 L90	L11-Y63 VanDerWaalsContact C-CB 3.49Å; L11-Y63 HydrophobicContact CB-CG 4.13Å; L11-Y63 VanDerWaalsContact O-CB 3.27Å; L11-Y63 WeakPolarHBondContact O-CB 3.35Å; L11-Y63 PolarHBondContact O-N 2.83Å; W13-Y63 HydrophobicContact CD2-CD2 4.05Å; W13-Y63 HydrophobicContact CD2-CE2 4.38Å; W13-Y63 AromaticContact CE2-CD2 3.42Å; W13-Y63 VanDerWaalsContact CE2-CD2 3.42Å; W13-Y63 AromaticContact CE2-CE2 3.63Å; W13-Y63 HydrophobicContact CH2-CD2 4.3Å; W13-Y63 AromaticContact CH2-CE2 3.67Å; W13-Y63 HydrophobicContact CH2-CE2 3.67Å; W13-Y63 AromaticContact CZ2-CD2 3.55Å; W13-Y63 HydrophobicContact CZ2-CD2 3.55Å; W13-Y63 AromaticContact CZ2-CE2 3.2Å; W13-Y63 HydrophobicContact CZ2-CE2 3.2Å; W13-Y63 HydrophobicContact CZ2-CG 4.49Å; W13-Y63 AromaticContact CZ2-CZ 3.94Å; W13-Y63 HydrophobicContact CZ3-CE2 4.39Å; W13-Y63 AromaticContact NE1-CD2 3.58Å; W13-Y63 PolarHBondContact NE1-O 3.25Å; P23-Y63 HydrophobicContact CB-CD2 4.15Å; P23-Y63 HydrophobicContact CB-CE2 3.74Å; K61-Y63 PolarHBondContact O-N 3.29Å; Y63-A65 PolarHBondContact O-N 3.17Å; Y63-H66 PolarHBondContact O-N 3.4Å; Y63-K67 HydrophobicContact CE1-CD 4.28Å; Y63-K67 PolarHBondContact O-N 3.17Å; Y63-K67 VanDerWaalsContact O-N 3.12Å; Y63-V86 HydrophobicContact CD1-CG1 3.99Å; Y63-V86 HydrophobicContact CD2-CG1 4.35Å; Y63-V86 HydrophobicContact CE1-CB 4.33Å; Y63-V86 HydrophobicContact CE1-CG1 3.51Å; Y63-V86 HydrophobicContact CE2-CB 4.21Å; Y63-V86 HydrophobicContact CE2-CG1 3.9Å; Y63-V86 HydrophobicContact CE2-CG2 4.09Å; Y63-V86 HydrophobicContact CG-CG1 4.39Å; Y63-V86 VanDerWaalsContact CZ-CG1 3.46Å; Y63-E87 PolarHBondContact OH-OE1 2.94Å; Y63-L90 HydrophobicContact CE1-CD1 4.5Å
64	H	87.2	Confident	87.8	Confident	119 Å²	119	66.9 Å²	66.9	55%	0.551	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-63.8	-43.2	-174	-63.8	86.2	0	0	0	113	H66 K67 L90	H64-H66 PolarHBondContact O-N 2.95Å; H64-K67 PolarHBondContact O-N 3.14Å; H64-L90 WeakPolarHBondContact NE2-CD1 3.08Å
65	A	85.7	Confident	87.1	Confident	79 Å²	79	73.6 Å²	73.6	65%	0.653	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-65.7	-21.6	-176.4	0	0	0	0	0	113.5	P62 Y63	P62-A65 HydrophobicContact CB-CB 4.37Å; Y63-A65 PolarHBondContact O-N 3.17Å
66	H	86.4	Confident	86.8	Confident	50 Å²	50	75 Å²	75	23%	0.231	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-122.7	12.5	-174.8	-57.5	85.2	0	0	0	113	K61 P62 Y63 H64 E68 E69 M70	K61-H66 HydrophobicContact CB-CB 4.42Å; K61-H66 HydrophobicContact CD-CB 4.44Å; P62-H66 PolarHBondContact O-ND1 2.96Å; P62-H66 VanDerWaalsContact O-ND1 3.13Å; Y63-H66 PolarHBondContact O-N 3.4Å; H64-H66 PolarHBondContact O-N 2.95Å; H66-E68 PolarHBondContact O-N 2.64Å; H66-E69 IonicContact CD2-OE2 2.85Å; H66-E69 PolarHBondContact CD2-OE2 3.07Å; H66-E69 PolarHBondContact O-N 3.03Å; H66-M70 HydrophobicContact CB-CE 4.44Å; H66-M70 HydrophobicContact CB-CG 4.13Å; H66-M70 WeakPolarHBondContact O-CB 3.39Å; H66-M70 WeakPolarHBondContact O-CG 3.27Å; H66-M70 PolarHBondContact O-N 3.05Å
67	K	85.9	Confident	86.6	Confident	61 Å²	61	79.8 Å²	79.8	27%	0.265	40%	0.395	S	S	.	.	H	α-helix	trans	-58	-50.2	-173.1	180	177.8	174	-179.1	0	112.6	W13 Y63 H64 E69 M70 I71 E87	W13-K67 HydrophobicContact CZ2-CB 4.5Å; W13-K67 HydrophobicContact CZ2-CG 4.49Å; Y63-K67 HydrophobicContact CE1-CD 4.28Å; Y63-K67 PolarHBondContact O-N 3.17Å; Y63-K67 VanDerWaalsContact O-N 3.12Å; H64-K67 PolarHBondContact O-N 3.14Å; K67-E69 PolarHBondContact O-N 3.26Å; K67-M70 PolarHBondContact O-N 2.96Å; K67-I71 HydrophobicContact CD-CD1 4.47Å; K67-I71 HydrophobicContact CG-CD1 3.67Å; K67-I71 HydrophobicContact CG-CG1 4.5Å; K67-I71 VanDerWaalsContact O-CG1 3.26Å; K67-I71 WeakPolarHBondContact O-CG1 3.43Å; K67-I71 PolarHBondContact O-N 3.43Å; K67-E87 VanDerWaalsContact CE-OE1 3.28Å; K67-E87 WeakPolarHBondContact CE-OE1 3.45Å; K67-E87 IonicContact NZ-OE1 2.91Å; K67-E87 PolarHBondContact NZ-OE1 3.1Å; K67-E87 IonicContact NZ-OE2 2.67Å; K67-E87 PolarHBondContact NZ-OE2 3.29Å
68	E	86.1	Confident	86.4	Confident	153 Å²	153	87 Å²	87	72%	0.715	42%	0.416	S	S	*	.	H	α-helix	trans	-67.3	-36.2	-178	-63.6	-176.7	-174.3	0	0	113	H66 K72	H66-E68 PolarHBondContact O-N 2.64Å; E68-K72 WeakPolarHBondContact O-CG 3.43Å
69	E	88.3	Confident	86.4	Confident	92 Å²	92	80.2 Å²	80.2	43%	0.43	38%	0.384	S	S	.	.	H	α-helix	trans	-63.7	-49	174.8	-173.6	-164.3	148.9	0	0	110.1	K61 H66 K67 K72 I73	K61-E69 IonicContact NZ-OE1 3.62Å; K61-E69 PolarHBondContact NZ-OE1 2.94Å; K61-E69 IonicContact NZ-OE2 3.14Å; K61-E69 PolarHBondContact NZ-OE2 3.35Å; H66-E69 IonicContact CD2-OE2 2.85Å; H66-E69 PolarHBondContact CD2-OE2 3.07Å; H66-E69 PolarHBondContact O-N 3.03Å; K67-E69 PolarHBondContact O-N 3.26Å; E69-K72 PolarHBondContact O-N 3.31Å; E69-I73 WeakPolarHBondContact O-CG1 3.17Å
70	M	85.3	Confident	86.3	Confident	6 Å²	6	80.9 Å²	80.9	3%	0.03	39%	0.388	C	S	.	.	H	α-helix	trans	-72.1	-33.9	-173.6	-63.4	-68.1	130.3	0	0	112.9	W13 P21 K61 H66 K67 K72 I73	W13-M70 HydrophobicContact CB-CG 4.3Å; W13-M70 HydrophobicContact CB-SD 4.43Å; W13-M70 HydrophobicContact CD2-CB 3.65Å; W13-M70 HydrophobicContact CD2-CG 3.58Å; W13-M70 HydrophobicContact CE3-CB 3.75Å; W13-M70 HydrophobicContact CE3-CG 4.06Å; W13-M70 HydrophobicContact CG-CB 4.28Å; W13-M70 HydrophobicContact CG-CG 3.66Å; W13-M70 HydrophobicContact CG-SD 4.4Å; W13-M70 HydrophobicContact CH2-CB 3.82Å; W13-M70 HydrophobicContact CZ2-CB 3.75Å; W13-M70 HydrophobicContact CZ2-CG 4.39Å; W13-M70 HydrophobicContact CZ3-CB 3.81Å; P21-M70 HydrophobicContact CB-SD 3.6Å; P21-M70 VanDerWaalsContact CB-SD 3.6Å; P21-M70 HydrophobicContact CG-SD 3.75Å; K61-M70 HydrophobicContact CD-CE 3.7Å; H66-M70 HydrophobicContact CB-CE 4.44Å; H66-M70 HydrophobicContact CB-CG 4.13Å; H66-M70 WeakPolarHBondContact O-CB 3.39Å; H66-M70 WeakPolarHBondContact O-CG 3.27Å; H66-M70 PolarHBondContact O-N 3.05Å; K67-M70 PolarHBondContact O-N 2.96Å; M70-K72 VanDerWaalsContact C-N 3.28Å; M70-K72 PolarHBondContact O-N 3.22Å; M70-I73 HydrophobicContact CE-CD1 3.96Å; M70-I73 PolarHBondContact O-N 3.31Å; M70-I73 HydrophobicContact SD-CD1 3.95Å
71	I	85.7	Confident	86.2	Confident	51 Å²	51	85.5 Å²	85.5	26%	0.262	41%	0.409	S	S	.	.	H	α-helix	trans	-65.3	-32.1	175.5	-69.3	169.5	0	0	0	111.6	W13 K67 I73 V83	W13-I71 HydrophobicContact CH2-CG1 4.49Å; K67-I71 HydrophobicContact CD-CD1 4.47Å; K67-I71 HydrophobicContact CG-CD1 3.67Å; K67-I71 HydrophobicContact CG-CG1 4.5Å; K67-I71 VanDerWaalsContact O-CG1 3.26Å; K67-I71 WeakPolarHBondContact O-CG1 3.43Å; K67-I71 PolarHBondContact O-N 3.43Å; I71-I73 VanDerWaalsContact C-N 3.3Å; I71-I73 PolarHBondContact O-N 2.87Å; I71-V83 HydrophobicContact CD1-CG1 4.05Å; I71-V83 HydrophobicContact CG1-CG1 4.38Å; I71-V83 HydrophobicContact CG1-CG2 4.48Å
72	K	85.9	Confident	86.1	Confident	162 Å²	162	81.9 Å²	81.9	70%	0.704	39%	0.393	S	S	*	.	H	α-helix	trans	-70.5	-25.9	177.2	-70.9	173.1	-175.1	175.8	0	113	E68 E69 M70	E68-K72 WeakPolarHBondContact O-CG 3.43Å; E69-K72 PolarHBondContact O-N 3.31Å; M70-K72 VanDerWaalsContact C-N 3.28Å; M70-K72 PolarHBondContact O-N 3.22Å
73	I	83.5	Confident	85.9	Confident	95 Å²	95	80.7 Å²	80.7	49%	0.487	39%	0.385	S	S	.	.	H	α-helix	trans	-73.9	-31.6	-176.4	-65	170.3	0	0	0	111.9	E69 M70 I71	E69-I73 WeakPolarHBondContact O-CG1 3.17Å; M70-I73 HydrophobicContact CE-CD1 3.96Å; M70-I73 PolarHBondContact O-N 3.31Å; M70-I73 HydrophobicContact SD-CD1 3.95Å; I71-I73 VanDerWaalsContact C-N 3.3Å; I71-I73 PolarHBondContact O-N 2.87Å
74	N	79	Confident	85.9	Confident	32 Å²	32	84.6 Å²	84.6	17%	0.171	41%	0.406	C	S	.	.			trans	-137.5	121.6	-175.5	-170.5	-14.1	0	0	0	111.5	P20 G76 F79	P20-N74 WeakPolarHBondContact CG-ND2 3.34Å; N74-G76 PolarHBondContact OD1-N 3.14Å; N74-F79 HydrophobicContact CB-CD1 3.8Å; N74-F79 HydrophobicContact CB-CD2 4.1Å; N74-F79 HydrophobicContact CB-CE1 3.9Å; N74-F79 HydrophobicContact CB-CE2 4.19Å; N74-F79 HydrophobicContact CB-CG 3.88Å; N74-F79 HydrophobicContact CB-CZ 4.08Å; N74-F79 WeakPolarHBondContact O-CD1 3.31Å; N74-F79 VanDerWaalsContact O-CE1 3.24Å; N74-F79 WeakPolarHBondContact O-CE1 3.15Å
75	K	76	Confident	86	Confident	193 Å²	193	80.5 Å²	80.5	84%	0.839	39%	0.393	S	S	*	.			trans	-106.6	13.1	179.5	-60.9	-174.7	-179.2	-179.3	0	113.4
76	G	85.4	Confident	86.1	Confident	31 Å²	31	76.7 Å²	76.7	32%	0.32	36%	0.361	S	S	.	.			trans	-66.5	140.8	-178.3	0	0	0	0	0	112.5	N74 R78 F79 Q80	N74-G76 PolarHBondContact OD1-N 3.14Å; G76-R78 VanDerWaalsContact C-N 3.31Å; G76-R78 PolarHBondContact O-N 3.16Å; G76-F79 WeakPolarHBondContact O-CA 3.46Å; G76-F79 WeakPolarHBondContact O-CB 3.5Å; G76-F79 PolarHBondContact O-N 3.17Å; G76-Q80 PolarHBondContact O-N 3.11Å
77	K	86.1	Confident	86.2	Confident	172 Å²	172	77.5 Å²	77.5	75%	0.748	37%	0.365	S	S	*	.	H	α-helix	trans	-56.2	-40.6	-179.7	-172.7	175.8	179.5	179	0	113.4	F79 Q80 Q81	K77-F79 VanDerWaalsContact C-N 3.35Å; K77-Q80 PolarHBondContact O-N 3.02Å; K77-Q81 WeakPolarHBondContact O-CG 3.32Å; K77-Q81 PolarHBondContact O-N 2.92Å; K77-Q81 VanDerWaalsContact O-N 3.11Å
78	R	85	Confident	86.3	Confident	205 Å²	205	78.3 Å²	78.3	77%	0.774	37%	0.37	S	S	*	.	H	α-helix	trans	-67	-34.9	175.7	-73.6	-174.5	175.2	177.4	-2.2	112.9	W22 G76 Q81 A82	W22-R78 HydrophobicContact CH2-CB 4.27Å; G76-R78 VanDerWaalsContact C-N 3.31Å; G76-R78 PolarHBondContact O-N 3.16Å; R78-Q81 PolarHBondContact O-N 3.05Å; R78-A82 PolarHBondContact O-N 3.3Å
79	F	88.2	Confident	86.4	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.009	35%	0.352	C	S	.	.	H	α-helix	trans	-68.6	-42	176.7	176.2	-97.1	0	0	0	110.6	W13 P21 W22 N74 G76 K77 Q81 A82 V83	W13-F79 HydrophobicContact CH2-CZ 4.1Å; W13-F79 AromaticContact CZ3-CE2 3.8Å; W13-F79 HydrophobicContact CZ3-CE2 3.8Å; W13-F79 AromaticContact CZ3-CZ 3.61Å; W13-F79 HydrophobicContact CZ3-CZ 3.61Å; P21-F79 WeakPolarHBondContact O-CE2 3.33Å; W22-F79 HydrophobicContact CD2-CD2 4.13Å; W22-F79 AromaticContact CE3-CD2 3.7Å; W22-F79 HydrophobicContact CE3-CD2 3.7Å; W22-F79 HydrophobicContact CE3-CE2 4.48Å; W22-F79 VanDerWaalsContact CH2-CA 3.46Å; W22-F79 HydrophobicContact CH2-CB 3.76Å; W22-F79 HydrophobicContact CH2-CD2 4.23Å; W22-F79 HydrophobicContact CZ2-CB 4.5Å; W22-F79 HydrophobicContact CZ3-CB 3.82Å; W22-F79 AromaticContact CZ3-CD2 3.76Å; W22-F79 HydrophobicContact CZ3-CD2 3.76Å; W22-F79 HydrophobicContact CZ3-CG 4.29Å; N74-F79 HydrophobicContact CB-CD1 3.8Å; N74-F79 HydrophobicContact CB-CD2 4.1Å; N74-F79 HydrophobicContact CB-CE1 3.9Å; N74-F79 HydrophobicContact CB-CE2 4.19Å; N74-F79 HydrophobicContact CB-CG 3.88Å; N74-F79 HydrophobicContact CB-CZ 4.08Å; N74-F79 WeakPolarHBondContact O-CD1 3.31Å; N74-F79 VanDerWaalsContact O-CE1 3.24Å; N74-F79 WeakPolarHBondContact O-CE1 3.15Å; G76-F79 WeakPolarHBondContact O-CA 3.46Å; G76-F79 WeakPolarHBondContact O-CB 3.5Å; G76-F79 PolarHBondContact O-N 3.17Å; K77-F79 VanDerWaalsContact C-N 3.35Å; F79-Q81 VanDerWaalsContact C-N 3.34Å; F79-Q81 PolarHBondContact O-N 2.82Å; F79-A82 WeakPolarHBondContact O-CB 3.44Å; F79-A82 PolarHBondContact O-N 2.88Å; F79-A82 VanDerWaalsContact O-N 3.15Å; F79-V83 HydrophobicContact CD1-CG2 4.31Å; F79-V83 HydrophobicContact CE1-CG2 3.95Å; F79-V83 HydrophobicContact CZ-CG2 4.11Å; F79-V83 WeakPolarHBondContact O-CG2 3.44Å; F79-V83 PolarHBondContact O-N 3.13Å
80	Q	88.3	Confident	86.3	Confident	77 Å²	77	72.1 Å²	72.1	36%	0.36	34%	0.341	S	S	.	.	H	α-helix	trans	-60.1	-44.2	174.2	-169.5	59.4	52.3	0	0	111.6	G76 K77 A82 V83 D84	G76-Q80 PolarHBondContact O-N 3.11Å; K77-Q80 PolarHBondContact O-N 3.02Å; Q80-A82 VanDerWaalsContact C-N 3.29Å; Q80-A82 PolarHBondContact O-N 3.04Å; Q80-V83 WeakPolarHBondContact O-CB 3.43Å; Q80-V83 PolarHBondContact O-N 3.42Å; Q80-V83 VanDerWaalsContact O-N 3.13Å; Q80-D84 PolarHBondContact NE2-OD1 3.48Å; Q80-D84 PolarHBondContact O-N 2.95Å
81	Q	89.3	Confident	86.3	Confident	110 Å²	110	80.6 Å²	80.6	51%	0.514	37%	0.372	S	S	.	.	H	α-helix	trans	-59.2	-38.7	174.8	-71.5	172.2	-29.9	0	0	112.9	K77 R78 F79 D84 A85	K77-Q81 WeakPolarHBondContact O-CG 3.32Å; K77-Q81 PolarHBondContact O-N 2.92Å; K77-Q81 VanDerWaalsContact O-N 3.11Å; R78-Q81 PolarHBondContact O-N 3.05Å; F79-Q81 VanDerWaalsContact C-N 3.34Å; F79-Q81 PolarHBondContact O-N 2.82Å; Q81-D84 PolarHBondContact O-N 3.33Å; Q81-A85 WeakPolarHBondContact O-CB 3.37Å; Q81-A85 PolarHBondContact O-N 3.24Å
82	A	89	Confident	86.2	Confident	0 Å²	0	86.2 Å²	86.2	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-65.8	-40.3	175.5	0	0	0	0	0	112.3	W22 P23 F47 R78 F79 Q80 A85 V86	W22-A82 HydrophobicContact CZ2-CB 3.63Å; P23-A82 HydrophobicContact CG-CB 3.85Å; F47-A82 HydrophobicContact CB-CB 4.5Å; F47-A82 WeakPolarHBondContact O-CB 3.23Å; R78-A82 PolarHBondContact O-N 3.3Å; F79-A82 WeakPolarHBondContact O-CB 3.44Å; F79-A82 PolarHBondContact O-N 2.88Å; F79-A82 VanDerWaalsContact O-N 3.15Å; Q80-A82 VanDerWaalsContact C-N 3.29Å; Q80-A82 PolarHBondContact O-N 3.04Å; A82-A85 PolarHBondContact O-N 3.16Å; A82-V86 WeakPolarHBondContact O-CG2 3.41Å; A82-V86 PolarHBondContact O-N 2.62Å
83	V	88.8	Confident	85.8	Confident	3 Å²	3	80.6 Å²	80.6	2%	0.018	37%	0.374	C	S	.	.	H	α-helix	trans	-64	-46.6	174.2	173.2	0	0	0	0	110.5	W13 P23 I71 F79 Q80 A85 V86 E87	W13-V83 HydrophobicContact CH2-CG2 3.86Å; W13-V83 HydrophobicContact CZ3-CG2 4.34Å; P23-V83 HydrophobicContact CG-CG2 4.32Å; I71-V83 HydrophobicContact CD1-CG1 4.05Å; I71-V83 HydrophobicContact CG1-CG1 4.38Å; I71-V83 HydrophobicContact CG1-CG2 4.48Å; F79-V83 HydrophobicContact CD1-CG2 4.31Å; F79-V83 HydrophobicContact CE1-CG2 3.95Å; F79-V83 HydrophobicContact CZ-CG2 4.11Å; F79-V83 WeakPolarHBondContact O-CG2 3.44Å; F79-V83 PolarHBondContact O-N 3.13Å; Q80-V83 WeakPolarHBondContact O-CB 3.43Å; Q80-V83 PolarHBondContact O-N 3.42Å; Q80-V83 VanDerWaalsContact O-N 3.13Å; V83-A85 VanDerWaalsContact C-N 3.28Å; V83-A85 PolarHBondContact O-N 3.44Å; V83-V86 WeakPolarHBondContact O-CB 3.31Å; V83-V86 PolarHBondContact O-N 2.99Å; V83-V86 VanDerWaalsContact O-N 3.08Å; V83-E87 PolarHBondContact O-N 2.95Å; V83-E87 VanDerWaalsContact O-N 3.14Å
84	D	88.5	Confident	85.2	Confident	84 Å²	84	83.5 Å²	83.5	45%	0.449	38%	0.383	S	S	.	.	H	α-helix	trans	-61.5	-37	178.7	-61.1	-18.5	0	0	0	111.6	Q80 Q81 V86 E87 E88	Q80-D84 PolarHBondContact NE2-OD1 3.48Å; Q80-D84 PolarHBondContact O-N 2.95Å; Q81-D84 PolarHBondContact O-N 3.33Å; D84-V86 VanDerWaalsContact C-N 3.33Å; D84-V86 PolarHBondContact O-N 3.23Å; D84-E87 PolarHBondContact O-N 2.92Å; D84-E88 PolarHBondContact O-N 3.4Å
85	A	88.9	Confident	84	Confident	32 Å²	32	83.9 Å²	83.9	26%	0.264	40%	0.395	S	S	.	.	H	α-helix	trans	-65	-33.3	175.2	0	0	0	0	0	113.1	F47 Q81 A82 V83 F89	F47-A85 HydrophobicContact CD1-CB 4.19Å; Q81-A85 WeakPolarHBondContact O-CB 3.37Å; Q81-A85 PolarHBondContact O-N 3.24Å; A82-A85 PolarHBondContact O-N 3.16Å; V83-A85 VanDerWaalsContact C-N 3.28Å; V83-A85 PolarHBondContact O-N 3.44Å; A85-F89 WeakPolarHBondContact O-CB 3.36Å; A85-F89 PolarHBondContact O-N 3.34Å
86	V	89.1	Confident	82.9	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-67.4	-43.2	172.3	179.4	0	0	0	0	110.7	L11 P23 F47 Y63 A82 V83 D84 E88 F89 L90	L11-V86 HydrophobicContact CD1-CG1 3.75Å; L11-V86 HydrophobicContact CD2-CG1 4.28Å; P23-V86 HydrophobicContact CB-CG2 3.82Å; P23-V86 HydrophobicContact CG-CG2 4.38Å; F47-V86 HydrophobicContact CB-CG2 3.84Å; F47-V86 HydrophobicContact CD1-CG2 3.9Å; F47-V86 HydrophobicContact CD2-CG2 3.47Å; F47-V86 VanDerWaalsContact CD2-CG2 3.47Å; F47-V86 HydrophobicContact CE1-CG2 4.3Å; F47-V86 HydrophobicContact CE2-CG2 3.9Å; F47-V86 HydrophobicContact CG-CG2 3.46Å; F47-V86 VanDerWaalsContact CG-CG2 3.46Å; F47-V86 HydrophobicContact CZ-CG2 4.29Å; Y63-V86 HydrophobicContact CD1-CG1 3.99Å; Y63-V86 HydrophobicContact CD2-CG1 4.35Å; Y63-V86 HydrophobicContact CE1-CB 4.33Å; Y63-V86 HydrophobicContact CE1-CG1 3.51Å; Y63-V86 HydrophobicContact CE2-CB 4.21Å; Y63-V86 HydrophobicContact CE2-CG1 3.9Å; Y63-V86 HydrophobicContact CE2-CG2 4.09Å; Y63-V86 HydrophobicContact CG-CG1 4.39Å; Y63-V86 VanDerWaalsContact CZ-CG1 3.46Å; A82-V86 WeakPolarHBondContact O-CG2 3.41Å; A82-V86 PolarHBondContact O-N 2.62Å; V83-V86 WeakPolarHBondContact O-CB 3.31Å; V83-V86 PolarHBondContact O-N 2.99Å; V83-V86 VanDerWaalsContact O-N 3.08Å; D84-V86 VanDerWaalsContact C-N 3.33Å; D84-V86 PolarHBondContact O-N 3.23Å; V86-E88 VanDerWaalsContact C-N 3.34Å; V86-E88 PolarHBondContact O-N 2.96Å; V86-F89 WeakPolarHBondContact O-CB 3.46Å; V86-F89 PolarHBondContact O-N 3.42Å; V86-L90 HydrophobicContact CG1-CD1 4.17Å; V86-L90 HydrophobicContact CG1-CG 4.49Å; V86-L90 WeakPolarHBondContact O-CG 3.24Å; V86-L90 PolarHBondContact O-N 3.18Å
87	E	88.1	Confident	81.2	Confident	67 Å²	67	86.9 Å²	86.9	31%	0.313	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-39.8	178.4	-63.4	-60.8	138.7	0	0	111.6	Y63 K67 V83 D84 L90 R91	Y63-E87 PolarHBondContact OH-OE1 2.94Å; K67-E87 VanDerWaalsContact CE-OE1 3.28Å; K67-E87 WeakPolarHBondContact CE-OE1 3.45Å; K67-E87 IonicContact NZ-OE1 2.91Å; K67-E87 PolarHBondContact NZ-OE1 3.1Å; K67-E87 IonicContact NZ-OE2 2.67Å; K67-E87 PolarHBondContact NZ-OE2 3.29Å; V83-E87 PolarHBondContact O-N 2.95Å; V83-E87 VanDerWaalsContact O-N 3.14Å; D84-E87 PolarHBondContact O-N 2.92Å; E87-L90 PolarHBondContact O-N 3.39Å; E87-R91 WeakPolarHBondContact O-CB 3.5Å; E87-R91 PolarHBondContact O-N 3.39Å
88	E	87.8	Confident	79.3	Confident	78 Å²	78	86.2 Å²	86.2	36%	0.364	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-42.1	173.3	-168.6	-176.6	176.9	0	0	111.6	D84 V86 L90 R91 R92	D84-E88 PolarHBondContact O-N 3.4Å; V86-E88 VanDerWaalsContact C-N 3.34Å; V86-E88 PolarHBondContact O-N 2.96Å; E88-L90 VanDerWaalsContact C-N 3.32Å; E88-L90 PolarHBondContact O-N 3.17Å; E88-R91 PolarHBondContact O-N 3.47Å; E88-R92 WeakPolarHBondContact O-CG 3.33Å; E88-R92 PolarHBondContact O-N 3.12Å; E88-R92 IonicContact OE1-CZ 3.87Å; E88-R92 VanDerWaalsContact OE1-CZ 3.27Å; E88-R92 IonicContact OE1-NE 2.66Å; E88-R92 PolarHBondContact OE1-NE 3.42Å; E88-R92 VanDerWaalsContact OE1-NE 3.14Å; E88-R92 IonicContact OE1-NH2 3.2Å; E88-R92 PolarHBondContact OE1-NH2 2.95Å
89	F	87.3	Confident	77.1	Confident	77 Å²	77	81.6 Å²	81.6	34%	0.338	40%	0.4	S	S	.	.	H	α-helix	trans	-59.1	-43.4	175.2	176.6	-95.1	0	0	0	111.6	L11 K25 F47 A85 V86 R92 A93	L11-F89 HydrophobicContact CD2-CD1 4.29Å; L11-F89 HydrophobicContact CD2-CE1 4.42Å; K25-F89 HydrophobicContact CD-CE1 4.49Å; K25-F89 HydrophobicContact CD-CZ 4.35Å; K25-F89 VanDerWaalsContact NZ-CZ 3.29Å; F47-F89 HydrophobicContact CE1-CB 3.86Å; F47-F89 HydrophobicContact CE1-CD2 4.47Å; F47-F89 HydrophobicContact CE1-CG 4.02Å; F47-F89 HydrophobicContact CZ-CB 4.32Å; F47-F89 HydrophobicContact CZ-CD1 4.17Å; F47-F89 HydrophobicContact CZ-CG 4.09Å; A85-F89 WeakPolarHBondContact O-CB 3.36Å; A85-F89 PolarHBondContact O-N 3.34Å; V86-F89 WeakPolarHBondContact O-CB 3.46Å; V86-F89 PolarHBondContact O-N 3.42Å; F89-R92 PolarHBondContact O-N 3.16Å; F89-A93 PolarHBondContact O-N 3.49Å
90	L	86.9	Confident	74.7	Confident	37 Å²	37	85.8 Å²	85.8	19%	0.194	43%	0.429	C	S	.	.	H	α-helix	trans	-64.3	-40.4	175	-75	171.4	0	0	0	112.3	L11 Y63 H64 V86 E87 E88 A93 K94	L11-L90 HydrophobicContact CD1-CD1 4.01Å; L11-L90 HydrophobicContact CD1-CD2 3.52Å; L11-L90 HydrophobicContact CD1-CG 3.76Å; Y63-L90 HydrophobicContact CE1-CD1 4.5Å; H64-L90 WeakPolarHBondContact NE2-CD1 3.08Å; V86-L90 HydrophobicContact CG1-CD1 4.17Å; V86-L90 HydrophobicContact CG1-CG 4.49Å; V86-L90 WeakPolarHBondContact O-CG 3.24Å; V86-L90 PolarHBondContact O-N 3.18Å; E87-L90 PolarHBondContact O-N 3.39Å; E88-L90 VanDerWaalsContact C-N 3.32Å; E88-L90 PolarHBondContact O-N 3.17Å; L90-A93 PolarHBondContact O-N 3.48Å; L90-K94 PolarHBondContact O-N 3.06Å; L90-K94 VanDerWaalsContact O-N 3.09Å
91	R	85.3	Confident	72.1	Confident	184 Å²	184	86.6 Å²	86.6	69%	0.694	44%	0.443	S	S	*	.	H	α-helix	trans	-63.9	-42.2	176.9	-167.9	176.6	68.6	157.2	0.5	111.7	E87 E88 A93 K94 G95	E87-R91 WeakPolarHBondContact O-CB 3.5Å; E87-R91 PolarHBondContact O-N 3.39Å; E88-R91 PolarHBondContact O-N 3.47Å; R91-A93 VanDerWaalsContact C-N 3.35Å; R91-K94 PolarHBondContact O-N 2.89Å; R91-G95 PolarHBondContact O-N 3.34Å
92	R	83.8	Confident	69.5	Low	169 Å²	169	89.2 Å²	89.2	64%	0.638	46%	0.455	S	S	*	.	H	α-helix	trans	-66.5	-34.6	175.7	-70.7	179	-175.4	-162.9	2.5	112.4	E88 F89 G95 K96	E88-R92 WeakPolarHBondContact O-CG 3.33Å; E88-R92 PolarHBondContact O-N 3.12Å; E88-R92 IonicContact OE1-CZ 3.87Å; E88-R92 VanDerWaalsContact OE1-CZ 3.27Å; E88-R92 IonicContact OE1-NE 2.66Å; E88-R92 PolarHBondContact OE1-NE 3.42Å; E88-R92 VanDerWaalsContact OE1-NE 3.14Å; E88-R92 IonicContact OE1-NH2 3.2Å; E88-R92 PolarHBondContact OE1-NH2 2.95Å; F89-R92 PolarHBondContact O-N 3.16Å; R92-G95 PolarHBondContact O-N 3.43Å; R92-K96 PolarHBondContact O-N 2.93Å
93	A	77.3	Confident	66.8	Low	44 Å²	44	97 Å²	97	36%	0.364	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-43.7	175.8	0	0	0	0	0	112.1	F89 L90 R91 G95 K96	F89-A93 PolarHBondContact O-N 3.49Å; L90-A93 PolarHBondContact O-N 3.48Å; R91-A93 VanDerWaalsContact C-N 3.35Å; A93-G95 VanDerWaalsContact C-N 3.31Å; A93-G95 PolarHBondContact O-N 3.01Å; A93-K96 PolarHBondContact O-N 3.13Å
94	K	71	Confident	64.1	Low	156 Å²	156	103 Å²	103	68%	0.678	54%	0.538	S	S	*	.	H	α-helix	trans	-65.4	-30.7	176	-71.7	-176.8	178	-178	0	113.7	L90 R91 K96 D97	L90-K94 PolarHBondContact O-N 3.06Å; L90-K94 VanDerWaalsContact O-N 3.09Å; R91-K94 PolarHBondContact O-N 2.89Å; K94-K96 VanDerWaalsContact C-N 3.31Å; K94-K96 PolarHBondContact O-N 3.4Å; K94-D97 PolarHBondContact O-N 3.42Å
95	G	54	Low	61.4	Low	41 Å²	41	103 Å²	103	42%	0.423	55%	0.551	S	S	.	*	H	α-helix	trans	-68.7	-25.7	176	0	0	0	0	0	114.1	R91 R92 A93 T99	R91-G95 PolarHBondContact O-N 3.34Å; R92-G95 PolarHBondContact O-N 3.43Å; A93-G95 VanDerWaalsContact C-N 3.31Å; A93-G95 PolarHBondContact O-N 3.01Å; G95-T99 PolarHBondContact O-OG1 3.27Å
96	K	53.6	Low	58.6	Low	164 Å²	164	109.2 Å²	109.2	71%	0.713	58%	0.579	S	S	*	*	H	α-helix	trans	-77.5	-30.3	176.6	-96.8	-178.2	172.7	-177.2	0	113.5	R92 A93 K94 T99	R92-K96 PolarHBondContact O-N 2.93Å; A93-K96 PolarHBondContact O-N 3.13Å; K94-K96 VanDerWaalsContact C-N 3.31Å; K94-K96 PolarHBondContact O-N 3.4Å; K96-T99 PolarHBondContact O-OG1 3.08Å
97	D	49.9	Very low	55.6	Low	122 Å²	122	116.7 Å²	116.7	65%	0.652	62%	0.619	S	S	*	*	H	α-helix	trans	-78.8	-16.5	178.2	-74.9	-23.7	0	0	0	113.4	K94 S100	K94-D97 PolarHBondContact O-N 3.42Å; D97-S100 PolarHBondContact O-OG 2.91Å
98	Q	44.7	Very low	52.9	Low	159 Å²	159	123.1 Å²	123.1	74%	0.743	65%	0.646	S	S	*	*	H	α-helix	trans	-84.7	-22.1	172.4	-74.5	-174.6	3.5	0	0	113.2	S100	Q98-S100 VanDerWaalsContact C-N 3.34Å
99	T	39.2	Very low	50	Low	108 Å²	108	126.3 Å²	126.3	66%	0.663	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-0.4	174	38.8	0	0	0	0	114.5	G95 K96	G95-T99 PolarHBondContact O-OG1 3.27Å; K96-T99 PolarHBondContact O-OG1 3.08Å
100	S	37.7	Very low	47.2	Very low	89 Å²	89	133.8 Å²	133.8	62%	0.622	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	7.2	179	58.7	0	0	0	0	114.6	D97 Q98	D97-S100 PolarHBondContact O-OG 2.91Å; Q98-S100 VanDerWaalsContact C-N 3.34Å
101	S	34.6	Very low	44.3	Very low	94 Å²	94	143.4 Å²	143.4	66%	0.657	73%	0.725	S	S	*	*	S	Bend	trans	-109.2	1.9	174.1	55.8	0	0	0	0	115
102	H	34.9	Very low	41.5	Very low	166 Å²	166	142 Å²	142	77%	0.769	73%	0.732	S	S	*	*	S	Bend	trans	-131.4	81.3	167.4	-97.6	-10.2	0	0	0	109.2
103	N	32	Very low	38.8	Very low	163 Å²	163	139.8 Å²	139.8	87%	0.872	74%	0.742	S	S	*	*			trans	177.9	74.2	150.3	-87.2	-13.5	0	0	0	107.8
104	S	32	Very low	36.4	Very low	128 Å²	128	142.3 Å²	142.3	90%	0.895	76%	0.757	S	S	*	*			trans	-132.5	71	161.3	-171.9	0	0	0	0	107.7
105	A	32.1	Very low	34.4	Very low	86 Å²	86	143.2 Å²	143.2	71%	0.711	76%	0.764	S	S	*	*	S	Bend	trans	-159.7	134	156.8	0	0	0	0	0	105.6
106	D	28.7	Very low	33.1	Very low	162 Å²	162	147.8 Å²	147.8	87%	0.866	77%	0.774	S	S	*	*			trans	77.7	72.3	175.3	-60.3	-22	0	0	0	118.2
107	D	27.4	Very low	31.7	Very low	156 Å²	156	149.8 Å²	149.8	83%	0.834	78%	0.777	S	S	*	*			trans	-144.5	83.8	132.3	-153.4	-4.1	0	0	0	111.1
108	K	31.2	Very low	30.6	Very low	203 Å²	203	149.3 Å²	149.3	88%	0.883	78%	0.784	S	S	*	*			trans	-146.9	80	158.8	-90.9	-167.3	-179.3	177.6	0	108.3
109	N	27.2	Very low	29.8	Very low	145 Å²	145	153 Å²	153	78%	0.775	79%	0.791	S	S	*	*			trans	-176.6	144.9	130.9	-114.4	-26.2	0	0	0	114.2
110	R	28.4	Very low	29.6	Very low	234 Å²	234	153.8 Å²	153.8	88%	0.883	80%	0.798	S	S	*	*			trans	88.8	83.9	158.1	-67.8	172.8	169.1	172.4	-4.3	118.2
111	R	26.7	Very low	29	Very low	238 Å²	238	156.8 Å²	156.8	90%	0.898	81%	0.807	S	S	*	*				-90.1	129.6	128.5	-80	179.6	175.1	177	-1.6	109.4
112	N	26.2	Very low	28.7	Very low	155 Å²	155	157.7 Å²	157.7	83%	0.829	81%	0.813	S	S	*	*			trans	143.6	112.1	145.4	-81.7	0.4	0	0	0	110.5
113	S	26.6	Very low	28.2	Very low	123 Å²	123	153.4 Å²	153.4	86%	0.86	81%	0.814	S	S	*	*				172.4	146.5	117.8	57.5	0	0	0	0	110.9
114	S	26.8	Very low	28.1	Very low	97 Å²	97	152.9 Å²	152.9	68%	0.678	81%	0.811	S	S	*	*			trans	-75.7	179.3	-177.6	39.7	0	0	0	0	114.8
115	E	28.6	Very low	27.8	Very low	175 Å²	175	154.9 Å²	154.9	82%	0.818	81%	0.806	S	S	*	*			trans	76.5	151.8	159.2	-75.2	171.8	-171.4	0	0	117.6
116	E	25.8	Very low	27.7	Very low	136 Å²	136	159.8 Å²	159.8	64%	0.636	81%	0.811	S	S	*	*			cis	-168.3	152.1	-22.1	-144	-164.4	152.9	0	0	104.5
117	R	26.3	Very low	27.5	Very low	206 Å²	206	163.1 Å²	163.1	78%	0.777	81%	0.812	S	S	*	*			trans	61.4	146	151.5	-75.2	172	-174.5	-152.5	-7.4	124
118	S	25.7	Very low	27.6	Very low	113 Å²	113	164.9 Å²	164.9	79%	0.79	81%	0.812	S	S	*	*			trans	94.8	113.2	143.4	-0.7	0	0	0	0	120.9
119	R	27.5	Very low	27.4	Very low	236 Å²	236	163 Å²	163	89%	0.891	81%	0.811	S	S	*	*			trans	-71.8	159.6	144.4	-66.5	179.2	171.8	177.7	-2.6	109.6
120	P	34.9	Very low	27.3	Very low	124 Å²	124	160.9 Å²	160.9	81%	0.805	81%	0.807	S	S	*	*				-138.5	149.6	85.1	22.6	-0.5	0	0	0	112.1
121	N	26.6	Very low	27.2	Very low	152 Å²	152	158.1 Å²	158.1	81%	0.813	81%	0.809	S	S	*	*				89	142.5	63.1	-148	30.3	0	0	0	115.2
122	S	27.6	Very low	27.3	Very low	114 Å²	114	151.4 Å²	151.4	80%	0.797	80%	0.799	S	S	*	*			trans	70.3	128.1	174.2	67.5	0	0	0	0	116.3
123	G	24.9	Very low	27.4	Very low	75 Å²	75	153.4 Å²	153.4	77%	0.773	80%	0.803	S	S	*	*				118.6	143.3	56.5	0	0	0	0	0	104.3
124	D	28.3	Very low	27.4	Very low	153 Å²	153	151.5 Å²	151.5	82%	0.818	80%	0.803	S	S	*	*			cis	-172.6	170.2	19.7	-142.6	-30.4	0	0	0	108.1
125	E	26.8	Very low	27.4	Very low	170 Å²	170	156.7 Å²	156.7	79%	0.794	81%	0.814	S	S	*	*			trans	80.3	132.9	148.7	-74.6	-161.4	122.6	0	0	126.7
126	K	29.1	Very low	27.3	Very low	189 Å²	189	155 Å²	155	82%	0.822	82%	0.815	S	S	*	*			trans	-79.2	156.8	173.8	-69	160.6	167.7	165.5	0	112.7
127	R	25.6	Very low	27.4	Very low	231 Å²	231	157.2 Å²	157.2	87%	0.872	82%	0.822	S	S	*	*				-179.1	112.2	126.3	-98.5	167.7	-165.6	-164.9	5.2	108.3
128	K	28.1	Very low	27.5	Very low	193 Å²	193	154.9 Å²	154.9	84%	0.839	82%	0.818	S	S	*	*				48.5	113.4	88.7	-95.9	-165.5	-179.1	-174.9	0	114.1
129	L	26.8	Very low	27.5	Very low	165 Å²	165	155.8 Å²	155.8	86%	0.864	81%	0.814	S	S	*	*				178.9	147.8	103.4	-94	162	0	0	0	113.3
130	S	26.6	Very low	27.5	Very low	99 Å²	99	152 Å²	152	69%	0.692	81%	0.808	S	S	*	*			trans	-68.8	156.5	176.3	48.5	0	0	0	0	114.9
131	L	25.9	Very low	27	Very low	177 Å²	177	150 Å²	150	93%	0.927	81%	0.81	S	S	*	*			trans	-144.5	143.5	148.2	-98.5	163.7	0	0	0	110.5
132	S	27.8	Very low	27.1	Very low	97 Å²	97	150.7 Å²	150.7	68%	0.678	81%	0.808	S	S	*	*			trans	-112.1	169.6	-172.6	47.5	0	0	0	0	111.3
133	E	29.7	Very low	27	Very low	196 Å²	196	148.6 Å²	148.6	92%	0.916	81%	0.805	S	S	*	*			trans	98.1	134.4	154.1	-59.1	-163.1	144.9	0	0	120.4
134	G	25.7	Very low	27.3	Very low	84 Å²	84	153.4 Å²	153.4	87%	0.866	80%	0.804	S	S	*	*			trans	170.2	72.5	172.4	0	0	0	0	0	111
135	K	27.1	Very low	27.3	Very low	206 Å²	206	154.3 Å²	154.3	90%	0.896	80%	0.801	S	S	*	*			trans	-128.4	125.2	171.5	-139.9	-176.3	-167.9	179.1	0	109.4
136	V	27.3	Very low	27.2	Very low	139 Å²	139	157.6 Å²	157.6	84%	0.842	81%	0.806	S	S	*	*			trans	-132.8	106.3	165.9	175.7	0	0	0	0	104.7
137	K	27.5	Very low	27.1	Very low	183 Å²	183	154.7 Å²	154.7	80%	0.796	80%	0.804	S	S	*	*				50	137.5	91.5	-83.7	-176.6	179.8	171.7	0	112.1
138	K	28.2	Very low	27.2	Very low	156 Å²	156	148.5 Å²	148.5	68%	0.678	80%	0.796	S	S	*	*			cis	-176.7	145.2	16.9	-138.2	179.6	174	-170.6	0	104.7
139	N	24.7	Very low	27.2	Very low	132 Å²	132	145.1 Å²	145.1	71%	0.706	80%	0.797	S	S	*	*				173.9	125.1	88.8	-93.1	-17.3	0	0	0	105.9
140	M	27.2	Very low	27.1	Very low	157 Å²	157	141.2 Å²	141.2	77%	0.773	80%	0.796	S	S	*	*				65.8	121.3	74.4	-80.7	-168.5	81.7	0	0	115.7
141	G	25.8	Very low	27.2	Very low	82 Å²	82	142.2 Å²	142.2	85%	0.845	80%	0.803	S	S	*	*			trans	-178.3	75.1	167.4	0	0	0	0	0	111.1
142	E	29.4	Very low	27.2	Very low	166 Å²	166	139.5 Å²	139.5	78%	0.776	80%	0.799	S	S	*	*			trans	-81	153.5	169.7	-76.3	-176	125.9	0	0	112.5
143	G	25.5	Very low	27.3	Very low	70 Å²	70	143.7 Å²	143.7	72%	0.722	81%	0.808	S	S	*	*			trans	-170.2	100.6	147.8	0	0	0	0	0	109
144	K	30.1	Very low	27.2	Very low	176 Å²	176	145.9 Å²	145.9	77%	0.765	81%	0.808	S	S	*	*				48.4	136.9	84.1	-86.3	-176.7	-176.5	167.1	0	112.7
145	K	27.7	Very low	27.1	Very low	173 Å²	173	145.5 Å²	145.5	75%	0.752	80%	0.804	S	S	*	*			cis	176.2	151.3	-1	-134	-175.3	-174.9	-173.7	0	106.1
146	R	25	Very low	27.1	Very low	239 Å²	239	141.2 Å²	141.2	90%	0.902	80%	0.8	S	S	*	*			trans	149.4	117.3	145.5	-90.5	177.1	170.5	178.5	-2.2	107.6
147	V	27.7	Very low	27.1	Very low	127 Å²	127	144.3 Å²	144.3	77%	0.77	80%	0.802	S	S	*	*			cis	68.7	106.1	46.4	-169.7	0	0	0	0	114.4
148	S	26.8	Very low	27.3	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	80%	0.803	S	S	*	*			trans	177.9	104.3	133.8	55.7	0	0	0	0	107.7
149	S	28.5	Very low	27.9	Very low	122 Å²	122	138.7 Å²	138.7	85%	0.853	80%	0.803	S	S	*	*				69.8	118.2	88	70	0	0	0	0	114.8
150	G	25	Very low	28	Very low	83 Å²	83	138.9 Å²	138.9	86%	0.856	80%	0.803	S	S	*	*			trans	-177.6	86.1	169.5	0	0	0	0	0	111.4
151	S	28	Very low	28.1	Very low	120 Å²	120	140.6 Å²	140.6	84%	0.839	81%	0.807	S	S	*	*			trans	-82	139.9	170.5	51.5	0	0	0	0	111.5
152	S	27.1	Very low	28.2	Very low	120 Å²	120	148.8 Å²	148.8	84%	0.839	81%	0.812	S	S	*	*			trans	-163	113.6	144.3	60	0	0	0	0	111.3
153	E	29.5	Very low	28	Very low	184 Å²	184	145.4 Å²	145.4	86%	0.86	81%	0.813	S	S	*	*			trans	-65.3	141.4	155.5	-65.1	176.8	136	0	0	109.9
154	R	26.6	Very low	28.2	Very low	242 Å²	242	151 Å²	151	91%	0.913	82%	0.82	S	S	*	*				168.3	125.9	119.9	-94.6	177.4	-169.4	-167.6	3.7	111.3
155	G	25.1	Very low	28	Very low	76 Å²	76	152.1 Å²	152.1	78%	0.784	83%	0.828	S	S	*	*			trans	34.4	122.8	138.8	0	0	0	0	0	120.3
156	S	26.9	Very low	28	Very low	116 Å²	116	152.5 Å²	152.5	81%	0.811	83%	0.832	S	S	*	*			trans	-152.7	97.1	146.1	-70.5	0	0	0	0	106.2
157	K	27.3	Very low	28.4	Very low	204 Å²	204	146.3 Å²	146.3	89%	0.887	83%	0.825	S	S	*	*				40.8	111.9	93	-75.9	-170	178.3	-179.3	0	112.2
158	S	31.8	Very low	28.9	Very low	117 Å²	117	146 Å²	146	82%	0.818	83%	0.826	S	S	*	*			trans	-33.9	152.6	158.9	-24.2	0	0	0	0	112
159	P	39.4	Very low	29	Very low	104 Å²	104	152.1 Å²	152.1	68%	0.675	83%	0.834	S	S	*	*				-155.4	160.4	97.1	39.1	-20	0	0	0	117.5
160	L	28.6	Very low	29.2	Very low	137 Å²	137	156 Å²	156	72%	0.717	84%	0.835	S	S	*	*			trans	77.7	101.7	146.4	-66.2	152.6	0	0	0	117.7
161	K	28.1	Very low	29.3	Very low	193 Å²	193	164.3 Å²	164.3	84%	0.839	84%	0.84	S	S	*	*				85.9	104.1	79.8	-87.8	-166.4	-164.6	173.6	0	112.2
162	R	27.2	Very low	29.1	Very low	253 Å²	253	162.1 Å²	162.1	96%	0.955	84%	0.837	S	S	*	*			trans	-135.2	117.7	133.3	-145	170.9	-171.9	174.2	1.2	108.2
163	A	27.1	Very low	29	Very low	96 Å²	96	168.1 Å²	168.1	79%	0.793	84%	0.841	S	S	*	*			trans	-70.5	137.3	-172.8	0	0	0	0	0	111.3
164	Q	29.1	Very low	29.7	Very low	186 Å²	186	164.3 Å²	164.3	87%	0.869	83%	0.833	S	S	*	*			trans	-75.9	141.1	144.3	-83	174.2	-44	0	0	107.9
165	E	24.9	Very low	30.5	Very low	200 Å²	200	157.7 Å²	157.7	94%	0.935	82%	0.821	S	S	*	*			trans	-140.4	143.3	146.1	-126.1	175.4	-163.5	0	0	110.3
166	Q	28.9	Very low	30.6	Very low	181 Å²	181	163 Å²	163	85%	0.846	82%	0.823	S	S	*	*			trans	-88.9	166.7	-166.2	-68	173.4	-15	0	0	112.4
167	S	32.3	Very low	30.6	Very low	109 Å²	109	164.5 Å²	164.5	76%	0.762	82%	0.822	S	S	*	*			trans	-41.8	162.5	168.8	-170.7	0	0	0	0	116
168	P	38.7	Very low	30.6	Very low	120 Å²	120	162.1 Å²	162.1	78%	0.779	81%	0.813	S	S	*	*				-146.1	133.5	118.7	32.2	-13.5	0	0	0	118.1
169	R	28.2	Very low	30.5	Very low	232 Å²	232	163.8 Å²	163.8	88%	0.875	81%	0.806	S	S	*	*			trans	33.4	123.7	133.2	-66.2	-178.5	175.6	-176.2	-0.6	124.2
170	K	34.1	Very low	29.9	Very low	204 Å²	204	165.2 Å²	165.2	89%	0.887	81%	0.808	S	S	*	*			trans	35.5	127.1	131.9	-74.5	-175.6	175.4	-178.8	0	122
171	R	25.7	Very low	29.9	Very low	256 Å²	256	166.9 Å²	166.9	97%	0.966	82%	0.817	S	S	*	*				-176.4	149.8	124.8	-101.4	172.8	-172	-162.7	2.8	111.1
172	G	24.2	Very low	29.9	Very low	75 Å²	75	163.2 Å²	163.2	77%	0.773	81%	0.811	S	S	*	*			trans	-109.8	164.5	-170	0	0	0	0	0	117.2
173	R	26.1	Very low	30.1	Very low	245 Å²	245	158.3 Å²	158.3	93%	0.925	80%	0.802	S	S	*	*			trans	32.7	165	153.1	-106.4	-169.1	-177.1	-167.8	1.5	121.8
174	P	42.8	Very low	30.2	Very low	105 Å²	105	159.6 Å²	159.6	68%	0.682	80%	0.802	S	S	*	*			cis	-134	-145.2	-15.7	40	-17.6	0	0	0	110.6
175	P	44.1	Very low	30	Very low	102 Å²	102	159.1 Å²	159.1	66%	0.662	80%	0.8	S	S	*	*			cis	-140.8	169.6	-9.9	33.4	-10.2	0	0	0	118.1
176	K	26.9	Very low	30	Very low	189 Å²	189	155.1 Å²	155.1	82%	0.822	79%	0.794	S	S	*	*				151.6	109.7	119.7	-88.7	-174.4	174.3	-177.7	0	116.2
177	D	28.1	Very low	29.9	Very low	147 Å²	147	152.3 Å²	152.3	79%	0.786	79%	0.794	S	S	*	*				24.2	150	128.2	-53.1	-39.1	0	0	0	126.2
178	E	27.2	Very low	29.6	Very low	153 Å²	153	153.3 Å²	153.3	72%	0.715	80%	0.796	S	S	*	*			trans	90.5	130.9	158.8	-62.6	-158.2	153.8	0	0	118.6
179	K	29.2	Very low	29	Very low	152 Å²	152	153.4 Å²	153.4	66%	0.661	79%	0.794	S	S	*	*			cis	-163.4	148.6	8.4	-119.6	166.5	-174.3	146	0	111.4
180	D	27.4	Very low	28.9	Very low	135 Å²	135	152.5 Å²	152.5	72%	0.722	80%	0.797	S	S	*	*			trans	17	137.9	155.1	-71.3	-34.8	0	0	0	122.6
181	L	28.7	Very low	28.4	Very low	172 Å²	172	145.6 Å²	145.6	90%	0.901	78%	0.783	S	S	*	*				-164.6	145.3	106.4	-95.2	167.6	0	0	0	112.8
182	T	28.1	Very low	28.4	Very low	116 Å²	116	142.2 Å²	142.2	71%	0.712	78%	0.781	S	S	*	*			trans	-90.3	167.1	-164.1	16.9	0	0	0	0	114.8
183	I	31.1	Very low	28.4	Very low	149 Å²	149	147.5 Å²	147.5	76%	0.764	79%	0.787	S	S	*	*			trans	-42.8	153.2	164.7	-57.6	157.6	0	0	0	112.6
184	P	28.1	Very low	28.5	Very low	123 Å²	123	141 Å²	141	80%	0.799	79%	0.786	S	S	*	*				-135.6	136.4	121.7	32.6	-18.6	0	0	0	114.8
185	E	24.5	Very low	27.7	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.822	79%	0.787	S	S	*	*			trans	-89.1	160.4	150.3	-86.2	-170.6	152.4	0	0	110.5
186	S	25.6	Very low	27.4	Very low	116 Å²	116	140.5 Å²	140.5	81%	0.811	80%	0.795	S	S	*	*			trans	88.8	112.2	158.9	82	0	0	0	0	119.5
187	S	26	Very low	27.4	Very low	122 Å²	122	140.4 Å²	140.4	85%	0.853	80%	0.8	S	S	*	*				-149.8	108.9	124.6	50.8	0	0	0	0	111.5
188	T	27	Very low	27.4	Very low	130 Å²	130	137.5 Å²	137.5	80%	0.798	80%	0.796	S	S	*	*			trans	-9.2	116.3	154.2	-30.4	0	0	0	0	119.6
189	V	26.2	Very low	27.3	Very low	122 Å²	122	135 Å²	135	74%	0.739	80%	0.801	S	S	*	*				21.3	126.1	120.1	-173.2	0	0	0	0	119.2
190	K	24.9	Very low	27.1	Very low	214 Å²	214	137.8 Å²	137.8	93%	0.93	81%	0.814	S	S	*	*			trans	-112.2	116.9	134.1	-102.4	-175.5	178.4	178.4	0	108.2
191	G	25	Very low	26.9	Very low	58 Å²	58	140.2 Å²	140.2	60%	0.598	82%	0.818	S	S	*	*			trans	-88.2	158.2	179.1	0	0	0	0	0	112.5
192	M	24.3	Very low	26.5	Very low	186 Å²	186	144.4 Å²	144.4	92%	0.916	82%	0.822	S	S	*	*			trans	-151.3	109.5	150.9	-144.7	79.3	155.5	0	0	109.4
193	M	26.1	Very low	26.3	Very low	185 Å²	185	146.7 Å²	146.7	91%	0.911	83%	0.825	S	S	*	*			trans	24.2	133.6	156.3	-67.5	-165.3	171.1	0	0	122.9
194	A	27.6	Very low	26.3	Very low	108 Å²	108	145.5 Å²	145.5	89%	0.893	83%	0.827	S	S	*	*			trans	-71.2	141.8	156.6	0	0	0	0	0	112.1
195	G	25.7	Very low	26.1	Very low	69 Å²	69	146.3 Å²	146.3	71%	0.711	83%	0.83	S	S	*	*			trans	-150.3	141.9	164	0	0	0	0	0	109.3
196	P	37	Very low	26.3	Very low	128 Å²	128	142.9 Å²	142.9	83%	0.831	83%	0.831	S	S	*	*			trans	-88.7	139.4	-165.5	34.7	-31.5	0	0	0	111.3
197	M	27.2	Very low	26.4	Very low	188 Å²	188	143 Å²	143	93%	0.926	83%	0.832	S	S	*	*			trans	-138.9	106.5	163.9	-84.3	-137.3	-129.8	0	0	112.9
198	A	27.6	Very low	26.4	Very low	85 Å²	85	146.1 Å²	146.1	70%	0.702	83%	0.833	S	S	*	*				49.2	105.9	129.2	0	0	0	0	0	118.9	F200	A198-F200 PolarHBondContact O-N 3.32Å
199	A	26.2	Very low	26.9	Very low	100 Å²	100	145.4 Å²	145.4	83%	0.826	83%	0.831	S	S	*	*			trans	-53.3	120.3	153.7	0	0	0	0	0	110.7	K201	A199-K201 PolarHBondContact O-N 3.44Å
200	F	24	Very low	26.9	Very low	212 Å²	212	146.7 Å²	146.7	93%	0.93	84%	0.839	S	S	*	*			trans	-76.5	106.4	171	-121.8	-99.5	0	0	0	109.1	A198	A198-F200 PolarHBondContact O-N 3.32Å
201	K	24.4	Very low	27.2	Very low	186 Å²	186	145.7 Å²	145.7	81%	0.809	83%	0.834	S	S	*	*			trans	-83.6	132	168.9	-88.4	177.9	173.4	176.4	0	109.2	A199	A199-K201 PolarHBondContact O-N 3.44Å
202	W	20.8	Very low	27.4	Very low	260 Å²	260	150.7 Å²	150.7	99%	0.985	85%	0.847	S	S	*	*			trans	-84.7	126.4	164.4	-149.4	10.6	0	0	0	108.6
203	Q	24	Very low	27.7	Very low	164 Å²	164	146.9 Å²	146.9	77%	0.766	85%	0.845	S	S	*	*			trans	-119.6	146.2	164.2	-87.9	-161	-20.4	0	0	110
204	P	29.4	Very low	27.8	Very low	123 Å²	123	145.8 Å²	145.8	80%	0.799	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-86.3	132	-173	34.2	-30.4	0	0	0	110.6
205	T	25.6	Very low	28.5	Very low	141 Å²	141	145.6 Å²	145.6	87%	0.865	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-99.2	120.7	169.9	40.6	0	0	0	0	110.1
206	A	27.5	Very low	29.1	Very low	103 Å²	103	150.9 Å²	150.9	85%	0.851	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-73.7	140.6	162.5	0	0	0	0	0	109.9
207	S	27.1	Very low	28.8	Very low	120 Å²	120	154.1 Å²	154.1	84%	0.839	84%	0.84	S	S	*	*			trans	-152.6	125.4	156.3	48.4	0	0	0	0	109.1
208	E	26.7	Very low	29	Very low	186 Å²	186	154.4 Å²	154.4	87%	0.869	84%	0.839	S	S	*	*			trans	-87.6	-169.1	171.1	-55.1	-175.3	137	0	0	110.8
209	P	37.4	Very low	29.4	Very low	115 Å²	115	157.9 Å²	157.9	75%	0.747	84%	0.84	S	S	*	*				-117.8	159.8	-95.7	33.7	-14.8	0	0	0	112.8
210	V	26.8	Very low	29.7	Very low	150 Å²	150	162.3 Å²	162.3	91%	0.909	84%	0.841	S	S	*	*			trans	-130.9	134.3	166.7	-178.4	0	0	0	0	110.2
211	K	29.9	Very low	30.1	Very low	193 Å²	193	159.7 Å²	159.7	84%	0.839	84%	0.836	S	S	*	*			trans	-77.2	143.6	-172.7	-72.2	173.1	170.6	176.8	0	113.6
212	D	31.1	Very low	30.8	Very low	163 Å²	163	159 Å²	159	87%	0.872	84%	0.84	S	S	*	*			trans	17.6	124.6	148.8	-67	-33.1	0	0	0	121.1
213	A	29	Very low	31.4	Very low	105 Å²	105	150.7 Å²	150.7	87%	0.868	82%	0.822	S	S	*	*			trans	-157.9	122	131.4	0	0	0	0	0	112.9
214	D	28.7	Very low	31.8	Very low	162 Å²	162	151.8 Å²	151.8	87%	0.866	83%	0.827	S	S	*	*			trans	88	118.3	155.7	-121.6	-1.1	0	0	0	122
215	P	42.2	Very low	32.4	Very low	105 Å²	105	152.8 Å²	152.8	68%	0.682	83%	0.831	S	S	*	*			trans	-110.5	100.3	-167	37.2	-20.4	0	0	0	111.4
216	H	37.6	Very low	33.1	Very low	179 Å²	179	154.3 Å²	154.3	83%	0.829	83%	0.828	S	S	*	*	S	Bend	trans	-151.1	27.5	167	-120.4	-62.2	0	0	0	116.2
217	F	32	Very low	33.5	Very low	196 Å²	196	159.4 Å²	159.4	86%	0.86	83%	0.831	S	S	*	*	S	Bend	trans	-151.8	32.1	173.4	-120.3	-85.3	0	0	0	115.4
218	H	31.9	Very low	33.7	Very low	195 Å²	195	158.6 Å²	158.6	90%	0.903	82%	0.823	S	S	*	*			trans	-147.7	70.8	168.7	-80.6	-73.1	0	0	0	111.4
219	H	34.6	Very low	34.1	Very low	158 Å²	158	154.6 Å²	154.6	73%	0.731	82%	0.822	S	S	*	*			trans	-141.7	63.8	165.9	-146	-75.3	0	0	0	111.3
220	F	33	Very low	34	Very low	193 Å²	193	154.1 Å²	154.1	85%	0.846	82%	0.817	S	S	*	*	S	Bend	trans	-137.7	3.3	163.5	-161.4	-104.6	0	0	0	114.9
221	L	32.6	Very low	34.2	Very low	156 Å²	156	151.5 Å²	151.5	82%	0.817	80%	0.804	S	S	*	*	S	Bend	trans	-133.5	11.6	-176	-75.1	177.6	0	0	0	117.1
222	L	38.8	Very low	34.5	Very low	171 Å²	171	152.7 Å²	152.7	90%	0.895	81%	0.805	S	S	*	*	S	Bend	trans	-148.5	65.2	175.5	-69.1	174.9	0	0	0	113.6
223	S	33.2	Very low	34.6	Very low	86 Å²	86	152.6 Å²	152.6	60%	0.601	80%	0.799	S	S	*	*			trans	-168.2	95.5	146.1	54.5	0	0	0	0	110.6
224	Q	32.8	Very low	34.9	Very low	188 Å²	188	150.8 Å²	150.8	88%	0.879	78%	0.784	S	S	*	*			trans	-148.4	91.8	138.7	-80.3	-127.4	0.7	0	0	107.5	E226	Q224-E226 PolarHBondContact O-N 3.23Å
225	T	42.4	Very low	35.6	Very low	143 Å²	143	150.6 Å²	150.6	88%	0.877	78%	0.781	S	S	*	*			trans	-75.5	87.4	162.1	46.4	0	0	0	0	108.7
226	E	38.9	Very low	35.3	Very low	173 Å²	173	151.5 Å²	151.5	81%	0.808	79%	0.785	S	S	*	*			trans	-138.7	120.3	145.4	-78.8	-162.2	161.8	0	0	107.3	Q224 P228	Q224-E226 PolarHBondContact O-N 3.23Å; E226-P228 WeakPolarHBondContact O-CD 3.4Å
227	K	36.8	Very low	35.6	Very low	211 Å²	211	151.9 Å²	151.9	92%	0.917	78%	0.784	S	S	*	*			trans	-64.2	117.6	-178.6	-67.3	171.1	176.3	174.4	0	110
228	P	30.8	Very low	36	Very low	102 Å²	102	151.7 Å²	151.7	66%	0.662	78%	0.783	S	S	*	*			trans	-81.1	121.3	143.3	20.8	-4.2	0	0	0	106.4	E226 V230	E226-P228 WeakPolarHBondContact O-CD 3.4Å; P228-V230 HydrophobicContact CB-CG2 4.15Å; P228-V230 HydrophobicContact CG-CG2 4.32Å; P228-V230 PolarHBondContact O-N 3.41Å
229	A	35.6	Very low	36.2	Very low	103 Å²	103	150 Å²	150	85%	0.851	78%	0.78	S	S	*	*			trans	-63.8	80.4	163.9	0	0	0	0	0	108.4	C231	A229-C231 VanDerWaalsContact C-N 3.3Å; A229-C231 PolarHBondContact O-N 2.92Å
230	V	36	Very low	36.4	Very low	105 Å²	105	151.6 Å²	151.6	64%	0.636	79%	0.785	S	S	*	*			trans	-74.4	95.2	166.8	-178.7	0	0	0	0	105.2	P228 Y232	P228-V230 HydrophobicContact CB-CG2 4.15Å; P228-V230 HydrophobicContact CG-CG2 4.32Å; P228-V230 PolarHBondContact O-N 3.41Å; V230-Y232 VanDerWaalsContact C-N 3.29Å; V230-Y232 HydrophobicContact CG1-CD2 4.42Å; V230-Y232 PolarHBondContact O-N 3.01Å
231	C	30.9	Very low	36.7	Very low	95 Å²	95	149.1 Å²	149.1	64%	0.642	78%	0.779	S	S	*	*			trans	-62.2	96.5	167.4	-170	0	0	0	0	107.3	A229 Q233	A229-C231 VanDerWaalsContact C-N 3.3Å; A229-C231 PolarHBondContact O-N 2.92Å; C231-Q233 PolarHBondContact O-N 3.27Å
232	Y	35.9	Very low	36.9	Very low	218 Å²	218	146.8 Å²	146.8	86%	0.855	78%	0.775	S	S	*	*			trans	-63.9	76.2	153.1	-91.4	-88.8	0	0	0	106.8	V230 A234	V230-Y232 VanDerWaalsContact C-N 3.29Å; V230-Y232 HydrophobicContact CG1-CD2 4.42Å; V230-Y232 PolarHBondContact O-N 3.01Å; Y232-A234 PolarHBondContact O-N 2.67Å
233	Q	33.8	Very low	36.8	Very low	161 Å²	161	147.3 Å²	147.3	75%	0.752	77%	0.772	S	S	*	*			trans	-68.8	93.2	151.4	-98	175.9	7.4	0	0	104.8	C231 I235	C231-Q233 PolarHBondContact O-N 3.27Å; Q233-I235 PolarHBondContact O-N 3.08Å
234	A	34.9	Very low	37.1	Very low	67 Å²	67	150.3 Å²	150.3	55%	0.554	78%	0.777	S	S	*	*			trans	-42.2	117.5	157.9	0	0	0	0	0	106.5	Y232 T236	Y232-A234 PolarHBondContact O-N 2.67Å; A234-T236 HydrophobicContact CB-CG2 4.25Å; A234-T236 PolarHBondContact O-N 3.45Å; A234-T236 PolarHBondContact O-OG1 2.83Å
235	I	42.6	Very low	37.3	Very low	158 Å²	158	151.1 Å²	151.1	81%	0.81	78%	0.781	S	S	*	*			trans	-70.2	76.6	170	-61.1	171.2	0	0	0	105.2	Q233 K237	Q233-I235 PolarHBondContact O-N 3.08Å; I235-K237 HydrophobicContact CG2-CB 4.22Å; I235-K237 PolarHBondContact O-N 3.12Å
236	T	35.8	Very low	37.2	Very low	124 Å²	124	149.7 Å²	149.7	76%	0.761	77%	0.772	S	S	*	*			trans	-86.1	44.2	164.1	42	0	0	0	0	108.6	A234 K238	A234-T236 HydrophobicContact CB-CG2 4.25Å; A234-T236 PolarHBondContact O-N 3.45Å; A234-T236 PolarHBondContact O-OG1 2.83Å; T236-K238 PolarHBondContact O-N 2.91Å
237	K	44.5	Very low	37.1	Very low	186 Å²	186	144.2 Å²	144.2	81%	0.809	76%	0.762	S	S	*	*			trans	-71.8	93.3	150.4	-90.1	-174.3	175.8	179.5	0	104.7	I235 L239	I235-K237 HydrophobicContact CG2-CB 4.22Å; I235-K237 PolarHBondContact O-N 3.12Å; K237-L239 PolarHBondContact O-N 3.5Å
238	K	39.8	Very low	37.3	Very low	192 Å²	192	138.1 Å²	138.1	84%	0.835	75%	0.746	S	S	*	*			trans	-43.1	122	160.8	-82.8	-175.8	173.5	-176.1	0	106	T236 K240	T236-K238 PolarHBondContact O-N 2.91Å; K238-K240 VanDerWaalsContact C-N 3.34Å; K238-K240 PolarHBondContact O-N 3.07Å
239	L	37.4	Very low	38.1	Very low	161 Å²	161	136.3 Å²	136.3	84%	0.843	73%	0.733	S	S	*	*			trans	-49	110.3	161.8	-82	157.4	0	0	0	104.6	K237 I241	K237-L239 PolarHBondContact O-N 3.5Å; L239-I241 PolarHBondContact O-N 3.31Å
240	K	38.5	Very low	38.9	Very low	191 Å²	191	133.7 Å²	133.7	83%	0.83	71%	0.708	S	S	*	*			trans	-62.7	103.5	164.6	-92.5	-172.9	172.8	-172.6	0	103.2	K238 C242	K238-K240 VanDerWaalsContact C-N 3.34Å; K238-K240 PolarHBondContact O-N 3.07Å; K240-C242 VanDerWaalsContact C-N 3.29Å; K240-C242 PolarHBondContact O-N 3.2Å
241	I	38.3	Very low	40	Very low	140 Å²	140	130.4 Å²	130.4	72%	0.718	69%	0.687	S	S	*	*			trans	-57.9	107.4	161.3	-59.8	174.3	0	0	0	102.8	L239 E243	L239-I241 PolarHBondContact O-N 3.31Å; I241-E243 HydrophobicContact CG2-CG 4.11Å; I241-E243 PolarHBondContact O-N 3.28Å
242	C	37.9	Very low	40.7	Very low	108 Å²	108	132.6 Å²	132.6	73%	0.73	69%	0.688	S	S	*	*			trans	-69	87.2	171.3	-73.4	0	0	0	0	106.1	K240 E244	K240-C242 VanDerWaalsContact C-N 3.29Å; K240-C242 PolarHBondContact O-N 3.2Å; C242-E244 PolarHBondContact O-N 3.37Å
243	E	36.7	Very low	41.4	Very low	181 Å²	181	122.2 Å²	122.2	85%	0.846	65%	0.647	S	S	*	*			trans	-74.6	68.6	155.5	-70.1	179.9	175.1	0	0	106.9	I241	I241-E243 HydrophobicContact CG2-CG 4.11Å; I241-E243 PolarHBondContact O-N 3.28Å
244	E	39.4	Very low	41.8	Very low	150 Å²	150	115.4 Å²	115.4	70%	0.701	62%	0.618	S	S	*	*			trans	-85	126.4	150.3	-82.2	-178.6	167	0	0	105	C242 T246	C242-E244 PolarHBondContact O-N 3.37Å; E244-T246 HydrophobicContact CB-CG2 4.37Å; E244-T246 PolarHBondContact O-N 3.33Å
245	E	35.7	Very low	42	Very low	204 Å²	204	118.5 Å²	118.5	95%	0.953	63%	0.626	S	S	*	*			trans	-61.2	75	162.9	-75.7	-173.4	152.7	0	0	107.9	G247	E245-G247 PolarHBondContact O-N 2.85Å
246	T	40.6	Very low	41.7	Very low	113 Å²	113	115 Å²	115	69%	0.693	62%	0.615	S	S	*	*			trans	-70.4	86.8	160.6	56.5	0	0	0	0	104.3	E244 S248	E244-T246 HydrophobicContact CB-CG2 4.37Å; E244-T246 PolarHBondContact O-N 3.33Å; T246-S248 VanDerWaalsContact C-N 3.27Å; T246-S248 PolarHBondContact O-N 3.42Å
247	G	36.2	Very low	42.1	Very low	59 Å²	59	110.7 Å²	110.7	61%	0.608	59%	0.589	S	S	*	*			trans	-51.3	102.1	165.4	0	0	0	0	0	106.4	E245 T249	E245-G247 PolarHBondContact O-N 2.85Å; G247-T249 PolarHBondContact O-N 3.02Å
248	S	41.6	Very low	42.1	Very low	83 Å²	83	104.9 Å²	104.9	58%	0.58	58%	0.575	S	S	*	*			trans	-64	93.2	179.4	-178.5	0	0	0	0	106.1	T246 S250	T246-S248 VanDerWaalsContact C-N 3.27Å; T246-S248 PolarHBondContact O-N 3.42Å; S248-S250 PolarHBondContact O-N 3.43Å
249	T	49	Very low	42.4	Very low	64 Å²	64	101.9 Å²	101.9	39%	0.393	57%	0.573	S	S	.	*			trans	-84.5	57.4	173.2	44.6	0	0	0	0	107.4	G247 I251 R407	G247-T249 PolarHBondContact O-N 3.02Å; T249-I251 PolarHBondContact O-N 2.99Å; T249-R407 PolarHBondContact OG1-NH1 2.86Å
250	S	51.8	Low	42.7	Very low	47 Å²	47	100.3 Å²	100.3	33%	0.329	57%	0.566	S	S	.	*			trans	-64.2	130.7	169.7	56.5	0	0	0	0	107.8	S248 Q252 S424	S248-S250 PolarHBondContact O-N 3.43Å; S250-Q252 PolarHBondContact O-N 3.41Å; S250-S424 VanDerWaalsContact CA-O 3.3Å; S250-S424 WeakPolarHBondContact CA-O 3.46Å
251	I	58.1	Low	43.4	Very low	37 Å²	37	94.2 Å²	94.2	19%	0.19	56%	0.556	C	S	.	*	B	Isolated β-bridge	trans	-81.4	111.9	157.7	-64.9	174	0	0	0	102.7	T249 A253 Y410 S424	T249-I251 PolarHBondContact O-N 2.99Å; I251-A253 PolarHBondContact O-N 3.26Å; I251-Y410 HydrophobicContact CD1-CD1 4.1Å; I251-Y410 HydrophobicContact CD1-CE1 3.4Å; I251-Y410 HydrophobicContact CG1-CE1 3.76Å; I251-S424 PolarHBondContact N-O 3.45Å; I251-S424 VanDerWaalsContact N-O 3.11Å; I251-S424 PolarHBondContact O-N 2.91Å
252	Q	47.2	Very low	44.6	Very low	140 Å²	140	91.9 Å²	91.9	65%	0.654	55%	0.553	S	S	*	*			trans	-62	90.7	168.1	-75.9	-172.9	-26.3	0	0	107.1	S250 A254	S250-Q252 PolarHBondContact O-N 3.41Å; Q252-A254 PolarHBondContact O-N 3.11Å
253	A	50.1	Low	46.8	Very low	1 Å²	1	87.7 Å²	87.7	1%	0.008	52%	0.523	C	S	.	.			trans	-76.5	-6.8	-175.7	0	0	0	0	0	112.5	I251 Q418 K422	I251-A253 PolarHBondContact O-N 3.26Å; A253-Q418 HydrophobicContact CB-CG 4.14Å; A253-K422 CarbonylContact C-O 3.48Å
254	A	41.9	Very low	49.4	Very low	17 Å²	17	84.7 Å²	84.7	14%	0.14	52%	0.517	C	S	.	.	S	Bend	trans	-163.4	99.8	171.6	0	0	0	0	0	111.3	Q252 A258 K422	Q252-A254 PolarHBondContact O-N 3.11Å; A254-A258 HydrophobicContact CB-CB 4.2Å; A254-K422 WeakPolarHBondContact CA-O 3.16Å; A254-K422 HydrophobicContact CB-CG 4.11Å; A254-K422 WeakPolarHBondContact CB-O 3.49Å; A254-K422 PolarHBondContact N-O 3.06Å
255	D	38.7	Very low	52	Low	133 Å²	133	79.7 Å²	79.7	71%	0.711	50%	0.498	S	S	*	.	S	Bend	trans	-131.4	2.1	142.3	-97.7	-22.7	0	0	0	112
256	S	36.7	Very low	54.8	Low	84 Å²	84	71.5 Å²	71.5	59%	0.587	46%	0.461	S	S	*	.	S	Bend	trans	-142.6	-21.9	177.5	-53.7	0	0	0	0	115.2	N260	S256-N260 WeakPolarHBondContact O-CB 3.5Å; S256-N260 PolarHBondContact O-N 3.43Å
257	T	44.1	Very low	57.5	Low	33 Å²	33	74.2 Å²	74.2	20%	0.202	47%	0.472	C	S	.	.	H	α-helix	trans	-93.2	-32.8	-169.4	-10.1	0	0	0	0	114.3	V259 N260 G261 S262 I263	T257-V259 PolarHBondContact O-N 3.25Å; T257-N260 PolarHBondContact O-N 2.96Å; T257-G261 PolarHBondContact O-N 3.28Å; T257-S262 WeakPolarHBondContact CG2-O 3.41Å; T257-I263 HydrophobicContact CG2-CG1 3.68Å
258	A	44.3	Very low	60.4	Low	64 Å²	64	74.6 Å²	74.6	53%	0.529	46%	0.457	S	S	.	.	H	α-helix	trans	-69.8	-17.1	176.1	0	0	0	0	0	113.4	A254 M398	A254-A258 HydrophobicContact CB-CB 4.2Å; A258-M398 HydrophobicContact CB-CE 3.74Å
259	V	45.3	Very low	63.1	Low	129 Å²	129	75.8 Å²	75.8	78%	0.782	45%	0.451	S	S	*	.	H	α-helix	trans	-97.3	-25.5	176.5	-173.2	0	0	0	0	112	T257	T257-V259 PolarHBondContact O-N 3.25Å
260	N	44.5	Very low	65.5	Low	129 Å²	129	72.7 Å²	72.7	69%	0.69	43%	0.433	S	S	*	.	H	α-helix	trans	-114.9	2.4	-173.7	-73.5	-14.2	0	0	0	116.2	S256 T257 S262	S256-N260 WeakPolarHBondContact O-CB 3.5Å; S256-N260 PolarHBondContact O-N 3.43Å; T257-N260 PolarHBondContact O-N 2.96Å; N260-S262 VanDerWaalsContact C-N 3.3Å; N260-S262 PolarHBondContact O-N 3.06Å; N260-S262 VanDerWaalsContact O-N 3.08Å
261	G	53.3	Low	67.7	Low	62 Å²	62	70.5 Å²	70.5	64%	0.639	42%	0.417	S	S	*	.			trans	64.6	17.7	162.8	0	0	0	0	0	117.6	T257	T257-G261 PolarHBondContact O-N 3.28Å
262	S	64.5	Low	69.7	Low	92 Å²	92	68.7 Å²	68.7	64%	0.643	41%	0.408	S	S	*	.			trans	-117	71.3	179.5	-166.6	0	0	0	0	111.6	T257 N260	T257-S262 WeakPolarHBondContact CG2-O 3.41Å; N260-S262 VanDerWaalsContact C-N 3.3Å; N260-S262 PolarHBondContact O-N 3.06Å; N260-S262 VanDerWaalsContact O-N 3.08Å
263	I	82.5	Confident	72.1	Confident	19 Å²	19	62 Å²	62	10%	0.097	38%	0.377	C	S	.	.			trans	-87.9	124.3	160.1	-60.6	175.6	0	0	0	106.2	T257 P265 M289 Q418 A419	T257-I263 HydrophobicContact CG2-CG1 3.68Å; I263-P265 WeakPolarHBondContact O-CD 3.47Å; I263-M289 HydrophobicContact CB-CE 3.62Å; I263-M289 HydrophobicContact CD1-CE 3.77Å; I263-M289 HydrophobicContact CD1-CG 4.16Å; I263-M289 HydrophobicContact CG1-CE 3.72Å; I263-Q418 HydrophobicContact CD1-CB 3.63Å; I263-Q418 HydrophobicContact CG1-CB 4.28Å; I263-A419 HydrophobicContact CD1-CB 4.28Å
264	T	90.9	Very high	74.4	Confident	118 Å²	118	62.2 Å²	62.2	72%	0.724	38%	0.378	S	S	*	.			trans	-81	113.2	166.4	-58.1	0	0	0	0	107.7	S415	T264-S415 WeakPolarHBondContact O-CB 3.46Å
265	P	94.6	Very high	77.1	Confident	46 Å²	46	61.7 Å²	61.7	30%	0.299	37%	0.373	S	S	.	.			trans	-65.3	153.3	-178.8	27.1	-33.9	0	0	0	110.5	I263	I263-P265 WeakPolarHBondContact O-CD 3.47Å
266	T	95.6	Very high	79.8	Confident	31 Å²	31	56.6 Å²	56.6	19%	0.19	35%	0.352	C	S	.	.			trans	-71.8	145.8	173.5	-175.3	0	0	0	0	111.1	K268 I270 S415	T266-K268 HydrophobicContact CG2-CB 3.97Å; T266-K268 PolarHBondContact O-N 2.87Å; T266-K268 PolarHBondContact OG1-N 2.84Å; T266-I270 HydrophobicContact CG2-CD1 4.07Å; T266-S415 PolarHBondContact N-OG 3.34Å
267	D	96.4	Very high	82.5	Confident	170 Å²	170	53.5 Å²	53.5	91%	0.909	33%	0.329	S	S	*	.	S	Bend	trans	-69.3	-13.5	171.4	-61.8	-37.7	0	0	0	113
268	K	97.8	Very high	85	Confident	67 Å²	67	53 Å²	53	29%	0.291	32%	0.324	S	S	.	.	S	Bend	trans	-66.6	136.6	178.9	-70	-173.5	174.7	86.3	0	110.8	T266 I270 D325 I326 D412	T266-K268 HydrophobicContact CG2-CB 3.97Å; T266-K268 PolarHBondContact O-N 2.87Å; T266-K268 PolarHBondContact OG1-N 2.84Å; K268-I270 HydrophobicContact CB-CD1 4.49Å; K268-I270 PolarHBondContact O-N 2.83Å; K268-D325 HydrophobicContact CB-CB 4.08Å; K268-D325 HydrophobicContact CD-CB 4.48Å; K268-D325 HydrophobicContact CG-CB 4.3Å; K268-I326 HydrophobicContact CD-CD1 3.6Å; K268-I326 HydrophobicContact CD-CG1 4.03Å; K268-D412 IonicContact NZ-OD1 2.7Å; K268-D412 PolarHBondContact NZ-OD1 3.48Å; K268-D412 IonicContact NZ-OD2 3.98Å
269	K	98.4	Very high	87.5	Confident	108 Å²	108	49.9 Å²	49.9	47%	0.47	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-73.8	127.1	174.5	-68	176.4	-176.5	173.6	0	109.8	C324 D325 I326	K269-C324 HydrophobicContact CB-CB 4.37Å; K269-C324 CarbonylContact O-C 3.3Å; K269-C324 WeakPolarHBondContact O-CB 3.29Å; K269-D325 PolarHBondContact N-OD2 3.43Å; K269-D325 PolarHBondContact O-N 2.98Å; K269-I326 PolarHBondContact O-N 3.39Å
270	I	98.8	Very high	90	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.8	-176.8	-53.3	-53.4	0	0	0	110.4	T266 K268 L286 H291 T292 V293 T294 C324 I326 F328	T266-I270 HydrophobicContact CG2-CD1 4.07Å; K268-I270 HydrophobicContact CB-CD1 4.49Å; K268-I270 PolarHBondContact O-N 2.83Å; I270-L286 HydrophobicContact CG2-CD1 4.38Å; I270-H291 HydrophobicContact CG1-CB 4.45Å; I270-T292 PolarHBondContact N-O 2.98Å; I270-V293 HydrophobicContact CB-CG2 4.42Å; I270-V293 CarbonylContact O-C 3.55Å; I270-V293 VanDerWaalsContact O-CA 3.32Å; I270-V293 WeakPolarHBondContact O-CA 3.21Å; I270-T294 PolarHBondContact O-N 3.21Å; I270-C324 VanDerWaalsContact C-SG 3.52Å; I270-C324 PolarHBondContact O-SG 3.29Å; I270-C324 VanDerWaalsContact O-SG 3.35Å; I270-I326 CarbonylContact C-O 3.27Å; I270-I326 WeakPolarHBondContact CA-O 3.33Å; I270-I326 HydrophobicContact CD1-CB 4.04Å; I270-I326 HydrophobicContact CD1-CD1 4.46Å; I270-F328 HydrophobicContact CD1-CE2 4.38Å; I270-F328 HydrophobicContact CG2-CD2 3.55Å; I270-F328 HydrophobicContact CG2-CE2 3.61Å
271	G	98.9	Very high	92.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	146	168	0	0	0	0	0	110.4	T294 V320 I326 T327 F328	G271-T294 CarbonylContact C-O 3.46Å; G271-T294 VanDerWaalsContact CA-O 3.3Å; G271-T294 WeakPolarHBondContact CA-O 3.4Å; G271-V320 VanDerWaalsContact CA-CG1 3.49Å; G271-I326 PolarHBondContact N-O 3.16Å; G271-T327 CarbonylContact O-C 3.54Å; G271-T327 WeakPolarHBondContact O-CA 3.49Å; G271-F328 PolarHBondContact O-N 3.42Å
272	F	98.9	Very high	94.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	124.2	174.3	-154.7	-78.4	0	0	0	111.9	G274 L275 I282 V283 L286 V293 T294 V295 W296 F328 C330	F272-G274 WeakPolarHBondContact CE1-O 3.34Å; F272-L275 HydrophobicContact CD1-CD2 4.15Å; F272-I282 HydrophobicContact CD2-CG2 4.4Å; F272-I282 HydrophobicContact CE2-CB 4.08Å; F272-I282 HydrophobicContact CE2-CG2 3.42Å; F272-I282 VanDerWaalsContact CE2-CG2 3.42Å; F272-I282 HydrophobicContact CZ-CB 4Å; F272-I282 HydrophobicContact CZ-CD1 4.26Å; F272-I282 HydrophobicContact CZ-CG2 3.84Å; F272-V283 HydrophobicContact CB-CG2 3.7Å; F272-V283 HydrophobicContact CD1-CG2 3.35Å; F272-V283 HydrophobicContact CD2-CG2 3.64Å; F272-V283 HydrophobicContact CE1-CG2 3.84Å; F272-V283 HydrophobicContact CE2-CG2 4.1Å; F272-V283 HydrophobicContact CG-CG2 3.24Å; F272-V283 HydrophobicContact CZ-CG2 4.19Å; F272-L286 HydrophobicContact CD2-CD1 4.13Å; F272-L286 HydrophobicContact CE2-CD1 4.47Å; F272-V293 HydrophobicContact CB-CG1 4.15Å; F272-T294 PolarHBondContact N-O 2.94Å; F272-V295 HydrophobicContact CB-CG1 4.4Å; F272-V295 CarbonylContact O-C 3.53Å; F272-V295 WeakPolarHBondContact O-CA 3.24Å; F272-W296 PolarHBondContact O-N 3.17Å; F272-F328 CarbonylContact C-O 3.59Å; F272-F328 WeakPolarHBondContact CA-O 3.25Å; F272-F328 HydrophobicContact CD2-CB 3.62Å; F272-F328 HydrophobicContact CD2-CG 4.35Å; F272-F328 HydrophobicContact CE2-CB 3.71Å; F272-F328 HydrophobicContact CE2-CG 4.42Å; F272-F328 HydrophobicContact CG-CB 4.42Å; F272-C330 HydrophobicContact CE1-CB 4.11Å; F272-C330 HydrophobicContact CZ-CB 4.03Å
273	L	98.8	Very high	96.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.2	-176.5	-51.6	-179.5	0	0	0	110.7	W296 P317 V320 T327 F328 A329 C330 L340 V347 Y357	L273-W296 HydrophobicContact CB-CE3 4.3Å; L273-W296 HydrophobicContact CD2-CB 3.75Å; L273-W296 HydrophobicContact CD2-CD2 4.43Å; L273-W296 HydrophobicContact CD2-CE3 4.08Å; L273-W296 HydrophobicContact CD2-CG 4.34Å; L273-P317 HydrophobicContact CD1-CB 4.01Å; L273-P317 HydrophobicContact CD2-CB 4.4Å; L273-V320 HydrophobicContact CD2-CB 3.91Å; L273-V320 HydrophobicContact CD2-CG1 3.89Å; L273-V320 HydrophobicContact CD2-CG2 3.96Å; L273-T327 HydrophobicContact CD1-CG2 3.82Å; L273-T327 HydrophobicContact CD2-CG2 4.37Å; L273-T327 HydrophobicContact CG-CG2 3.75Å; L273-F328 PolarHBondContact N-O 3.33Å; L273-A329 HydrophobicContact CB-CB 4.14Å; L273-A329 CarbonylContact O-C 3.57Å; L273-A329 WeakPolarHBondContact O-CA 3.43Å; L273-C330 PolarHBondContact O-N 3.19Å; L273-L340 HydrophobicContact CB-CD1 4.5Å; L273-L340 HydrophobicContact CB-CD2 3.97Å; L273-L340 HydrophobicContact CD1-CD1 4.22Å; L273-L340 HydrophobicContact CD1-CD2 4.06Å; L273-L340 HydrophobicContact CD1-CG 4.27Å; L273-V347 HydrophobicContact CD1-CG2 3.56Å; L273-Y357 HydrophobicContact CD1-CE2 4.19Å
274	G	98.1	Very high	97.1	Very high	4 Å²	4	31.8 Å²	31.8	4%	0.041	18%	0.181	C	C	.	.			trans	99.8	102.8	177.2	0	0	0	0	0	113.1	F272 G276 W296	F272-G274 WeakPolarHBondContact CE1-O 3.34Å; G274-G276 PolarHBondContact O-N 3.44Å; G274-W296 PolarHBondContact N-O 3Å
275	L	97.6	Very high	97.4	Very high	6 Å²	6	27 Å²	27	3%	0.031	15%	0.15	C	C	.	.			trans	-103.6	54.1	-176.7	-57.3	174	0	0	0	110.1	F272 V283 V295 N297 K302 C303 F306	F272-L275 HydrophobicContact CD1-CD2 4.15Å; L275-V283 HydrophobicContact CD2-CB 4.4Å; L275-V283 HydrophobicContact CD2-CG2 3.77Å; L275-V295 HydrophobicContact CD1-CB 4.19Å; L275-V295 HydrophobicContact CD1-CG2 4.36Å; L275-V295 HydrophobicContact CD2-CB 4.38Å; L275-V295 HydrophobicContact CD2-CG1 4.3Å; L275-N297 HydrophobicContact CB-CB 4.03Å; L275-N297 HydrophobicContact CD1-CB 3.86Å; L275-N297 HydrophobicContact CG-CB 3.9Å; L275-N297 PolarHBondContact N-OD1 3.36Å; L275-K302 HydrophobicContact CB-CB 4.23Å; L275-K302 WeakPolarHBondContact O-CD 3.43Å; L275-C303 HydrophobicContact CD1-CB 4.17Å; L275-C303 WeakPolarHBondContact CD1-SG 3.49Å; L275-F306 HydrophobicContact CB-CE2 4.17Å; L275-F306 HydrophobicContact CD1-CD2 3.71Å; L275-F306 HydrophobicContact CD1-CE2 3.77Å; L275-F306 HydrophobicContact CD2-CD2 4.2Å; L275-F306 HydrophobicContact CD2-CE2 3.95Å; L275-F306 HydrophobicContact CD2-CZ 4.44Å; L275-F306 HydrophobicContact CG-CD2 4.47Å; L275-F306 HydrophobicContact CG-CE2 4.17Å
276	G	95.6	Very high	97.6	Very high	26 Å²	26	24.8 Å²	24.8	27%	0.268	14%	0.136	S	C	.	.	S	Bend	trans	-82	-161.8	177.1	0	0	0	0	0	112.8	G274 M278 G279 S280	G274-G276 PolarHBondContact O-N 3.44Å; G276-M278 VanDerWaalsContact C-N 3.29Å; G276-M278 PolarHBondContact O-N 3.5Å; G276-G279 PolarHBondContact O-N 3.05Å; G276-S280 WeakPolarHBondContact O-CB 3.27Å; G276-S280 PolarHBondContact O-N 2.98Å; G276-S280 VanDerWaalsContact O-N 3.09Å
277	L	94.4	Very high	97.7	Very high	19 Å²	19	24.4 Å²	24.4	10%	0.099	13%	0.133	C	C	.	.	H	α-helix	trans	-53	-45	-179.7	-163.9	73.1	0	0	0	112.5	Q391 D497 Y499	L277-Q391 HydrophobicContact CD1-CB 4.08Å; L277-Q391 VanDerWaalsContact CD1-CD 3.41Å; L277-Q391 HydrophobicContact CD1-CG 3.93Å; L277-Q391 HydrophobicContact CD2-CB 4.31Å; L277-Q391 HydrophobicContact CG-CB 3.88Å; L277-Q391 HydrophobicContact CG-CG 4.05Å; L277-D497 WeakPolarHBondContact CD2-O 3.17Å; L277-Y499 HydrophobicContact CB-CD2 4.47Å; L277-Y499 HydrophobicContact CB-CE2 3.98Å; L277-Y499 HydrophobicContact CD1-CE2 4.25Å; L277-Y499 HydrophobicContact CD2-CD2 3.94Å; L277-Y499 HydrophobicContact CD2-CE2 3.97Å; L277-Y499 HydrophobicContact CG-CE2 4.31Å
278	M	96	Very high	97.7	Very high	22 Å²	22	23.2 Å²	23.2	11%	0.108	12%	0.119	C	C	.	.	H	α-helix	trans	-85.5	-48.6	177.6	-61.5	-61.7	-173.6	0	0	112.2	G276 S280 G281 I282 G389 S394 F498	G276-M278 VanDerWaalsContact C-N 3.29Å; G276-M278 PolarHBondContact O-N 3.5Å; M278-S280 PolarHBondContact O-N 3.22Å; M278-G281 PolarHBondContact O-N 3.09Å; M278-G281 VanDerWaalsContact O-N 3.14Å; M278-I282 HydrophobicContact CB-CD1 4.42Å; M278-I282 WeakPolarHBondContact O-CG1 3.45Å; M278-I282 PolarHBondContact O-N 3.18Å; M278-G389 WeakPolarHBondContact CE-O 3.22Å; M278-S394 PolarHBondContact O-OG 3.42Å; M278-F498 HydrophobicContact CE-CD2 3.69Å; M278-F498 HydrophobicContact CE-CE2 4.01Å
279	G	97.6	Very high	97.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-55.5	-32.9	-175.3	0	0	0	0	0	113.9	G276 V283	G276-G279 PolarHBondContact O-N 3.05Å; G279-V283 VanDerWaalsContact O-CG2 3.32Å; G279-V283 WeakPolarHBondContact O-CG2 3.37Å; G279-V283 PolarHBondContact O-N 3.3Å
280	S	97.6	Very high	97.4	Very high	34 Å²	34	19.6 Å²	19.6	24%	0.238	12%	0.119	C	C	.	.	H	α-helix	trans	-59.1	-54.3	176.1	-177.4	0	0	0	0	112.9	G276 M278 I282 V283 S284 F306	G276-S280 WeakPolarHBondContact O-CB 3.27Å; G276-S280 PolarHBondContact O-N 2.98Å; G276-S280 VanDerWaalsContact O-N 3.09Å; M278-S280 PolarHBondContact O-N 3.22Å; S280-I282 VanDerWaalsContact C-N 3.34Å; S280-I282 PolarHBondContact O-N 2.99Å; S280-V283 PolarHBondContact O-N 3.1Å; S280-S284 PolarHBondContact O-N 3.3Å; S280-S284 VanDerWaalsContact O-N 3.13Å; S280-F306 WeakPolarHBondContact O-CE1 3.19Å; S280-F306 WeakPolarHBondContact OG-CZ 3.4Å
281	G	97.7	Very high	97.4	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-65.3	-39.6	-178.4	0	0	0	0	0	111.9	M278 V283 S284 N285 S394 N395	M278-G281 PolarHBondContact O-N 3.09Å; M278-G281 VanDerWaalsContact O-N 3.14Å; G281-V283 PolarHBondContact O-N 3.11Å; G281-S284 PolarHBondContact O-N 2.91Å; G281-N285 PolarHBondContact O-N 2.85Å; G281-N285 PolarHBondContact O-ND2 3.41Å; G281-S394 CarbonylContact C-O 3.56Å; G281-S394 VanDerWaalsContact C-O 3.27Å; G281-S394 WeakPolarHBondContact CA-O 3.37Å; G281-N395 WeakPolarHBondContact CA-OD1 3.42Å
282	I	98.5	Very high	97.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-48.8	177	-62.8	166.3	0	0	0	111	F272 M278 S280 N285 L286 M360 S394 L399 M420	F272-I282 HydrophobicContact CD2-CG2 4.4Å; F272-I282 HydrophobicContact CE2-CB 4.08Å; F272-I282 HydrophobicContact CE2-CG2 3.42Å; F272-I282 VanDerWaalsContact CE2-CG2 3.42Å; F272-I282 HydrophobicContact CZ-CB 4Å; F272-I282 HydrophobicContact CZ-CD1 4.26Å; F272-I282 HydrophobicContact CZ-CG2 3.84Å; M278-I282 HydrophobicContact CB-CD1 4.42Å; M278-I282 WeakPolarHBondContact O-CG1 3.45Å; M278-I282 PolarHBondContact O-N 3.18Å; S280-I282 VanDerWaalsContact C-N 3.34Å; S280-I282 PolarHBondContact O-N 2.99Å; I282-N285 PolarHBondContact O-N 3.49Å; I282-L286 HydrophobicContact CG2-CD1 4.15Å; I282-L286 WeakPolarHBondContact O-CG 3.47Å; I282-L286 PolarHBondContact O-N 3Å; I282-M360 HydrophobicContact CD1-CE 4.23Å; I282-M360 HydrophobicContact CD1-SD 4.37Å; I282-S394 PolarHBondContact N-OG 2.82Å; I282-L399 HydrophobicContact CD1-CD1 4.04Å; I282-L399 HydrophobicContact CG1-CD1 3.81Å; I282-M420 HydrophobicContact CG1-CB 4.42Å; I282-M420 HydrophobicContact CG2-CB 3.93Å; I282-M420 HydrophobicContact CG2-CE 3.61Å; I282-M420 HydrophobicContact CG2-CG 4.45Å; I282-M420 HydrophobicContact CG2-SD 3.73Å
283	V	98.6	Very high	97.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-45.4	-179.1	169.7	0	0	0	0	111.9	F272 L275 G279 S280 G281 N285 L286 L287 V293 V295 F306	F272-V283 HydrophobicContact CB-CG2 3.7Å; F272-V283 HydrophobicContact CD1-CG2 3.35Å; F272-V283 HydrophobicContact CD2-CG2 3.64Å; F272-V283 HydrophobicContact CE1-CG2 3.84Å; F272-V283 HydrophobicContact CE2-CG2 4.1Å; F272-V283 HydrophobicContact CG-CG2 3.24Å; F272-V283 HydrophobicContact CZ-CG2 4.19Å; L275-V283 HydrophobicContact CD2-CB 4.4Å; L275-V283 HydrophobicContact CD2-CG2 3.77Å; G279-V283 VanDerWaalsContact O-CG2 3.32Å; G279-V283 WeakPolarHBondContact O-CG2 3.37Å; G279-V283 PolarHBondContact O-N 3.3Å; S280-V283 PolarHBondContact O-N 3.1Å; G281-V283 PolarHBondContact O-N 3.11Å; V283-N285 PolarHBondContact O-N 3.31Å; V283-L286 PolarHBondContact O-N 3.35Å; V283-L287 HydrophobicContact CG1-CD1 3.85Å; V283-L287 HydrophobicContact CG1-CG 4.36Å; V283-L287 WeakPolarHBondContact O-CG 3.34Å; V283-L287 PolarHBondContact O-N 2.98Å; V283-V293 HydrophobicContact CG1-CG1 4.43Å; V283-V295 HydrophobicContact CG1-CG1 3.7Å; V283-V295 HydrophobicContact CG2-CG1 4.28Å; V283-F306 HydrophobicContact CB-CD1 4.05Å; V283-F306 HydrophobicContact CB-CE1 4.01Å; V283-F306 HydrophobicContact CG1-CB 4.22Å; V283-F306 HydrophobicContact CG1-CD1 3.41Å; V283-F306 VanDerWaalsContact CG1-CD1 3.41Å; V283-F306 HydrophobicContact CG1-CE1 3.91Å; V283-F306 HydrophobicContact CG1-CG 3.82Å
284	S	98	Very high	97.4	Very high	16 Å²	16	24.1 Å²	24.1	11%	0.112	15%	0.146	C	C	.	.	H	α-helix	trans	-59.1	-38.4	177.4	-73.9	0	0	0	0	111.7	S280 G281 L287 K288 F306 E309	S280-S284 PolarHBondContact O-N 3.3Å; S280-S284 VanDerWaalsContact O-N 3.13Å; G281-S284 PolarHBondContact O-N 2.91Å; S284-L287 PolarHBondContact O-N 3.35Å; S284-K288 WeakPolarHBondContact O-CB 3.49Å; S284-K288 WeakPolarHBondContact O-CG 3.28Å; S284-K288 PolarHBondContact O-N 2.95Å; S284-F306 WeakPolarHBondContact OG-CE1 3.35Å; S284-E309 PolarHBondContact OG-OE2 3.34Å
285	N	97.8	Very high	97.4	Very high	16 Å²	16	24 Å²	24	9%	0.086	14%	0.144	C	C	.	.	H	α-helix	trans	-69.5	-38.9	176.8	-74.3	-39	0	0	0	112.8	G281 I282 V283 L287 K288 M289 S394 N395 G397 A419	G281-N285 PolarHBondContact O-N 2.85Å; G281-N285 PolarHBondContact O-ND2 3.41Å; I282-N285 PolarHBondContact O-N 3.49Å; V283-N285 PolarHBondContact O-N 3.31Å; N285-L287 VanDerWaalsContact C-N 3.34Å; N285-L287 PolarHBondContact O-N 3.45Å; N285-K288 PolarHBondContact O-N 3.46Å; N285-M289 WeakPolarHBondContact O-CG 3.4Å; N285-M289 PolarHBondContact O-N 3.44Å; N285-S394 PolarHBondContact ND2-O 3.07Å; N285-N395 PolarHBondContact ND2-O 3.33Å; N285-N395 PolarHBondContact OD1-O 2.73Å; N285-G397 PolarHBondContact ND2-N 3.45Å; N285-A419 WeakPolarHBondContact CB-O 3.46Å
286	L	98	Very high	97.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-44.2	172.4	-69.5	171.6	0	0	0	111.9	I270 F272 I282 V283 M289 G290 H291 V293 C416 A419 M420	I270-L286 HydrophobicContact CG2-CD1 4.38Å; F272-L286 HydrophobicContact CD2-CD1 4.13Å; F272-L286 HydrophobicContact CE2-CD1 4.47Å; I282-L286 HydrophobicContact CG2-CD1 4.15Å; I282-L286 WeakPolarHBondContact O-CG 3.47Å; I282-L286 PolarHBondContact O-N 3Å; V283-L286 PolarHBondContact O-N 3.35Å; L286-M289 PolarHBondContact O-N 2.68Å; L286-G290 PolarHBondContact O-N 3.11Å; L286-H291 HydrophobicContact CB-CB 4.37Å; L286-H291 WeakPolarHBondContact O-CB 3.36Å; L286-H291 PolarHBondContact O-CD2 2.79Å; L286-H291 VanDerWaalsContact O-CD2 3.31Å; L286-H291 PolarHBondContact O-N 3.23Å; L286-V293 HydrophobicContact CB-CG2 3.89Å; L286-C416 HydrophobicContact CD2-CB 3.71Å; L286-A419 HydrophobicContact CD2-CB 4.21Å; L286-M420 HydrophobicContact CD1-CE 4.14Å; L286-M420 HydrophobicContact CD2-CE 3.94Å; L286-M420 HydrophobicContact CG-CE 4.25Å
287	L	97.8	Very high	97.6	Very high	23 Å²	23	25.7 Å²	25.7	12%	0.12	14%	0.144	C	C	.	.	H	α-helix	trans	-65.2	-46.4	177.8	-69.5	168.3	0	0	0	111.9	V283 S284 N285 M289 G290 V293 F306 E309 A311	V283-L287 HydrophobicContact CG1-CD1 3.85Å; V283-L287 HydrophobicContact CG1-CG 4.36Å; V283-L287 WeakPolarHBondContact O-CG 3.34Å; V283-L287 PolarHBondContact O-N 2.98Å; S284-L287 PolarHBondContact O-N 3.35Å; N285-L287 VanDerWaalsContact C-N 3.34Å; N285-L287 PolarHBondContact O-N 3.45Å; L287-M289 VanDerWaalsContact C-N 3.25Å; L287-M289 PolarHBondContact O-N 3.05Å; L287-G290 PolarHBondContact O-N 3.37Å; L287-V293 HydrophobicContact CD2-CB 3.86Å; L287-V293 HydrophobicContact CD2-CG2 3.88Å; L287-V293 HydrophobicContact CG-CB 4.42Å; L287-V293 HydrophobicContact CG-CG2 4.21Å; L287-F306 HydrophobicContact CD1-CB 4.17Å; L287-F306 HydrophobicContact CD1-CD1 4.26Å; L287-E309 HydrophobicContact CD1-CB 3.73Å; L287-A311 HydrophobicContact CD1-CB 4.02Å; L287-A311 HydrophobicContact CD2-CB 4.09Å
288	K	95.8	Very high	97.6	Very high	145 Å²	145	32.9 Å²	32.9	63%	0.63	17%	0.17	S	C	*	.	H	α-helix	trans	-59	-35.7	177.7	-75.6	169.8	-172.8	173.3	0	112.8	S284 N285 G290	S284-K288 WeakPolarHBondContact O-CB 3.49Å; S284-K288 WeakPolarHBondContact O-CG 3.28Å; S284-K288 PolarHBondContact O-N 2.95Å; N285-K288 PolarHBondContact O-N 3.46Å; K288-G290 PolarHBondContact O-N 3.01Å
289	M	95.3	Very high	97.6	Very high	50 Å²	50	35.1 Å²	35.1	25%	0.246	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	8.2	176.6	-59.3	-46.4	-60.5	0	0	113.6	I263 N285 L286 L287 A419	I263-M289 HydrophobicContact CB-CE 3.62Å; I263-M289 HydrophobicContact CD1-CE 3.77Å; I263-M289 HydrophobicContact CD1-CG 4.16Å; I263-M289 HydrophobicContact CG1-CE 3.72Å; N285-M289 WeakPolarHBondContact O-CG 3.4Å; N285-M289 PolarHBondContact O-N 3.44Å; L286-M289 PolarHBondContact O-N 2.68Å; L287-M289 VanDerWaalsContact C-N 3.25Å; L287-M289 PolarHBondContact O-N 3.05Å; M289-A419 HydrophobicContact CB-CB 3.92Å; M289-A419 HydrophobicContact CG-CB 3.6Å
290	G	96.1	Very high	97.5	Very high	49 Å²	49	38.2 Å²	38.2	51%	0.505	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	13	169.9	0	0	0	0	0	115.4	L286 L287 K288	L286-G290 PolarHBondContact O-N 3.11Å; L287-G290 PolarHBondContact O-N 3.37Å; K288-G290 PolarHBondContact O-N 3.01Å
291	H	98.1	Very high	97.4	Very high	7 Å²	7	43.8 Å²	43.8	3%	0.032	23%	0.233	C	C	.	.			trans	-72.4	143.9	175.9	-66.8	-85.5	0	0	0	111.9	I270 L286 V293 S415	I270-H291 HydrophobicContact CG1-CB 4.45Å; L286-H291 HydrophobicContact CB-CB 4.37Å; L286-H291 WeakPolarHBondContact O-CB 3.36Å; L286-H291 PolarHBondContact O-CD2 2.79Å; L286-H291 VanDerWaalsContact O-CD2 3.31Å; L286-H291 PolarHBondContact O-N 3.23Å; H291-V293 HydrophobicContact CB-CG2 4.12Å; H291-V293 PolarHBondContact O-N 2.91Å; H291-S415 PolarHBondContact CE1-OG 3.05Å
292	T	98.4	Very high	97.3	Very high	76 Å²	76	48.7 Å²	48.7	47%	0.466	25%	0.254	S	S	.	.			trans	-81.2	105.9	170.7	-63.6	0	0	0	0	109.8	I270	I270-T292 PolarHBondContact N-O 2.98Å
293	V	98.8	Very high	97.2	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.2	-175	-170	0	0	0	0	112	I270 F272 V283 L286 L287 H291 V295 A311 R312	I270-V293 HydrophobicContact CB-CG2 4.42Å; I270-V293 CarbonylContact O-C 3.55Å; I270-V293 VanDerWaalsContact O-CA 3.32Å; I270-V293 WeakPolarHBondContact O-CA 3.21Å; F272-V293 HydrophobicContact CB-CG1 4.15Å; V283-V293 HydrophobicContact CG1-CG1 4.43Å; L286-V293 HydrophobicContact CB-CG2 3.89Å; L287-V293 HydrophobicContact CD2-CB 3.86Å; L287-V293 HydrophobicContact CD2-CG2 3.88Å; L287-V293 HydrophobicContact CG-CB 4.42Å; L287-V293 HydrophobicContact CG-CG2 4.21Å; H291-V293 HydrophobicContact CB-CG2 4.12Å; H291-V293 PolarHBondContact O-N 2.91Å; V293-V295 HydrophobicContact CG1-CG1 3.89Å; V293-A311 WeakPolarHBondContact O-CA 3.27Å; V293-R312 PolarHBondContact O-N 3.15Å
294	T	98.9	Very high	97.1	Very high	11 Å²	11	52.8 Å²	52.8	7%	0.067	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.3	165.3	-54.9	0	0	0	0	109.1	I270 G271 F272 R312 V320	I270-T294 PolarHBondContact O-N 3.21Å; G271-T294 CarbonylContact C-O 3.46Å; G271-T294 VanDerWaalsContact CA-O 3.3Å; G271-T294 WeakPolarHBondContact CA-O 3.4Å; F272-T294 PolarHBondContact N-O 2.94Å; T294-R312 CarbonylContact C-O 3.48Å; T294-R312 VanDerWaalsContact CA-O 3.25Å; T294-R312 WeakPolarHBondContact CA-O 3.26Å; T294-R312 HydrophobicContact CG2-CB 4.14Å; T294-V320 HydrophobicContact CG2-CG2 4.17Å
295	V	98.8	Very high	96.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	150	-176.3	-61.6	0	0	0	0	111.8	F272 L275 V283 V293 C303 F306 A311 R312 G314	F272-V295 HydrophobicContact CB-CG1 4.4Å; F272-V295 CarbonylContact O-C 3.53Å; F272-V295 WeakPolarHBondContact O-CA 3.24Å; L275-V295 HydrophobicContact CD1-CB 4.19Å; L275-V295 HydrophobicContact CD1-CG2 4.36Å; L275-V295 HydrophobicContact CD2-CB 4.38Å; L275-V295 HydrophobicContact CD2-CG1 4.3Å; V283-V295 HydrophobicContact CG1-CG1 3.7Å; V283-V295 HydrophobicContact CG2-CG1 4.28Å; V293-V295 HydrophobicContact CG1-CG1 3.89Å; V295-C303 HydrophobicContact CG2-CB 4.13Å; V295-F306 HydrophobicContact CG1-CB 4.45Å; V295-F306 HydrophobicContact CG2-CB 4.46Å; V295-A311 HydrophobicContact CG1-CB 4.02Å; V295-A311 HydrophobicContact CG2-CB 4.15Å; V295-R312 PolarHBondContact N-O 3.01Å; V295-G314 PolarHBondContact O-N 3.23Å
296	W	98.8	Very high	96.9	Very high	47 Å²	47	56.6 Å²	56.6	18%	0.178	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	143.1	165.4	173.4	92.4	0	0	0	110	F272 L273 G274 R298 R315 P317 V320 L340	F272-W296 PolarHBondContact O-N 3.17Å; L273-W296 HydrophobicContact CB-CE3 4.3Å; L273-W296 HydrophobicContact CD2-CB 3.75Å; L273-W296 HydrophobicContact CD2-CD2 4.43Å; L273-W296 HydrophobicContact CD2-CE3 4.08Å; L273-W296 HydrophobicContact CD2-CG 4.34Å; G274-W296 PolarHBondContact N-O 3Å; W296-R298 HydrophobicContact CH2-CB 3.99Å; W296-R298 HydrophobicContact CZ2-CB 4.35Å; W296-R315 PolarHBondContact NE1-O 3.43Å; W296-R315 VanDerWaalsContact NE1-O 3.17Å; W296-P317 HydrophobicContact CD2-CG 3.94Å; W296-P317 HydrophobicContact CE3-CG 3.93Å; W296-P317 HydrophobicContact CH2-CG 3.82Å; W296-P317 HydrophobicContact CZ2-CG 3.84Å; W296-P317 HydrophobicContact CZ3-CG 3.88Å; W296-V320 HydrophobicContact CB-CG2 3.8Å; W296-L340 HydrophobicContact CE3-CD1 4.23Å; W296-L340 HydrophobicContact CH2-CD1 4Å; W296-L340 HydrophobicContact CZ3-CD1 3.49Å; W296-L340 VanDerWaalsContact CZ3-CD1 3.49Å
297	N	98.3	Very high	96.8	Very high	22 Å²	22	59.9 Å²	59.9	12%	0.118	31%	0.311	C	S	.	.			trans	-142.9	147.7	169.5	-172	65.5	0	0	0	109.8	L275 T299	L275-N297 HydrophobicContact CB-CB 4.03Å; L275-N297 HydrophobicContact CD1-CB 3.86Å; L275-N297 HydrophobicContact CG-CB 3.9Å; L275-N297 PolarHBondContact N-OD1 3.36Å; N297-T299 PolarHBondContact ND2-N 3Å; N297-T299 VanDerWaalsContact ND2-N 3.11Å; N297-T299 PolarHBondContact ND2-O 3.49Å; N297-T299 PolarHBondContact O-N 3.35Å
298	R	95.9	Very high	96.6	Very high	170 Å²	170	66.4 Å²	66.4	64%	0.642	34%	0.341	S	S	*	.	S	Bend	trans	-56.1	-38.1	177.1	171.4	165.1	41.5	-159.1	-10.7	112.8	W296	W296-R298 HydrophobicContact CH2-CB 3.99Å; W296-R298 HydrophobicContact CZ2-CB 4.35Å
299	T	95.9	Very high	96.6	Very high	69 Å²	69	63.9 Å²	63.9	42%	0.423	33%	0.331	S	S	.	.	S	Bend	trans	-95.3	105.4	169.6	-51.5	0	0	0	0	108	N297 E301 K302	N297-T299 PolarHBondContact ND2-N 3Å; N297-T299 VanDerWaalsContact ND2-N 3.11Å; N297-T299 PolarHBondContact ND2-O 3.49Å; N297-T299 PolarHBondContact O-N 3.35Å; T299-E301 VanDerWaalsContact C-N 3.29Å; T299-E301 HydrophobicContact CG2-CB 4.48Å; T299-E301 PolarHBondContact O-N 2.98Å; T299-K302 PolarHBondContact O-N 3.43Å
300	A	94.4	Very high	96.6	Very high	64 Å²	64	64.3 Å²	64.3	53%	0.529	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-60.3	-35.8	-171.4	0	0	0	0	0	113.4	K302 C303	A300-K302 PolarHBondContact O-N 3.01Å; A300-C303 WeakPolarHBondContact O-CB 3.39Å; A300-C303 PolarHBondContact O-N 3.35Å
301	E	96	Very high	96.7	Very high	151 Å²	151	62.3 Å²	62.3	71%	0.706	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-56.2	-26.4	179.7	-62.9	167.6	-172.6	0	0	113.2	T299 C303 D304	T299-E301 VanDerWaalsContact C-N 3.29Å; T299-E301 HydrophobicContact CG2-CB 4.48Å; T299-E301 PolarHBondContact O-N 2.98Å; E301-C303 PolarHBondContact O-N 3.2Å; E301-D304 PolarHBondContact O-N 2.66Å
302	K	95.4	Very high	96.8	Very high	104 Å²	104	70.1 Å²	70.1	45%	0.452	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-68.7	-15	175.7	-64.7	-160.2	179.5	-172.8	0	113.4	L275 T299 A300 F306	L275-K302 HydrophobicContact CB-CB 4.23Å; L275-K302 WeakPolarHBondContact O-CD 3.43Å; T299-K302 PolarHBondContact O-N 3.43Å; A300-K302 PolarHBondContact O-N 3.01Å; K302-F306 WeakPolarHBondContact O-CD2 3.35Å; K302-F306 VanDerWaalsContact O-CE2 3.28Å; K302-F306 WeakPolarHBondContact O-CE2 3.29Å
303	C	96.7	Very high	96.8	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-80.3	-21.8	178.5	-61.9	0	0	0	0	112.8	L275 V295 A300 E301 L305 F306 I307 L313	L275-C303 HydrophobicContact CD1-CB 4.17Å; L275-C303 WeakPolarHBondContact CD1-SG 3.49Å; V295-C303 HydrophobicContact CG2-CB 4.13Å; A300-C303 WeakPolarHBondContact O-CB 3.39Å; A300-C303 PolarHBondContact O-N 3.35Å; E301-C303 PolarHBondContact O-N 3.2Å; C303-L305 VanDerWaalsContact C-N 3.28Å; C303-L305 PolarHBondContact O-N 3.35Å; C303-F306 PolarHBondContact O-N 3.37Å; C303-I307 HydrophobicContact CB-CD1 4.38Å; C303-I307 WeakPolarHBondContact O-CG1 3.32Å; C303-I307 PolarHBondContact O-N 3.48Å; C303-I307 VanDerWaalsContact O-N 3.1Å; C303-L313 HydrophobicContact CB-CD1 3.66Å
304	D	95.6	Very high	96.7	Very high	86 Å²	86	71 Å²	71	46%	0.46	36%	0.359	S	S	.	.	H	α-helix	trans	-58.8	-38.3	-169.1	-68.1	-9.8	0	0	0	113.1	E301 F306 I307 Q308	E301-D304 PolarHBondContact O-N 2.66Å; D304-F306 VanDerWaalsContact C-N 3.31Å; D304-F306 PolarHBondContact O-N 2.97Å; D304-I307 PolarHBondContact O-N 3.45Å; D304-Q308 WeakPolarHBondContact O-CG 3.48Å; D304-Q308 PolarHBondContact O-N 2.93Å; D304-Q308 PolarHBondContact O-NE2 3.46Å
305	L	94.5	Very high	96.6	Very high	108 Å²	108	80 Å²	80	57%	0.565	39%	0.392	S	S	*	.	H	α-helix	trans	-59.1	-42.2	176.4	-65.6	173.1	0	0	0	111.7	C303 Q308 E309	C303-L305 VanDerWaalsContact C-N 3.28Å; C303-L305 PolarHBondContact O-N 3.35Å; L305-Q308 WeakPolarHBondContact O-CB 3.41Å; L305-Q308 PolarHBondContact O-N 2.92Å; L305-E309 PolarHBondContact O-N 3.12Å
306	F	97.4	Very high	96.6	Very high	4 Å²	4	82.1 Å²	82.1	2%	0.018	41%	0.405	C	S	.	.	H	α-helix	trans	-81.5	-27.1	-175.5	-52.1	-74	0	0	0	112.6	L275 S280 V283 S284 L287 V295 K302 C303 D304 Q308 E309 G310 A311	L275-F306 HydrophobicContact CB-CE2 4.17Å; L275-F306 HydrophobicContact CD1-CD2 3.71Å; L275-F306 HydrophobicContact CD1-CE2 3.77Å; L275-F306 HydrophobicContact CD2-CD2 4.2Å; L275-F306 HydrophobicContact CD2-CE2 3.95Å; L275-F306 HydrophobicContact CD2-CZ 4.44Å; L275-F306 HydrophobicContact CG-CD2 4.47Å; L275-F306 HydrophobicContact CG-CE2 4.17Å; S280-F306 WeakPolarHBondContact O-CE1 3.19Å; S280-F306 WeakPolarHBondContact OG-CZ 3.4Å; V283-F306 HydrophobicContact CB-CD1 4.05Å; V283-F306 HydrophobicContact CB-CE1 4.01Å; V283-F306 HydrophobicContact CG1-CB 4.22Å; V283-F306 HydrophobicContact CG1-CD1 3.41Å; V283-F306 VanDerWaalsContact CG1-CD1 3.41Å; V283-F306 HydrophobicContact CG1-CE1 3.91Å; V283-F306 HydrophobicContact CG1-CG 3.82Å; S284-F306 WeakPolarHBondContact OG-CE1 3.35Å; L287-F306 HydrophobicContact CD1-CB 4.17Å; L287-F306 HydrophobicContact CD1-CD1 4.26Å; V295-F306 HydrophobicContact CG1-CB 4.45Å; V295-F306 HydrophobicContact CG2-CB 4.46Å; K302-F306 WeakPolarHBondContact O-CD2 3.35Å; K302-F306 VanDerWaalsContact O-CE2 3.28Å; K302-F306 WeakPolarHBondContact O-CE2 3.29Å; C303-F306 PolarHBondContact O-N 3.37Å; D304-F306 VanDerWaalsContact C-N 3.31Å; D304-F306 PolarHBondContact O-N 2.97Å; F306-Q308 PolarHBondContact O-N 3.11Å; F306-E309 CarbonylContact O-C 3.59Å; F306-E309 WeakPolarHBondContact O-CA 3.5Å; F306-E309 PolarHBondContact O-N 3.44Å; F306-E309 VanDerWaalsContact O-N 3.12Å; F306-G310 PolarHBondContact O-N 3.13Å; F306-G310 VanDerWaalsContact O-N 3.11Å; F306-A311 HydrophobicContact CB-CB 3.83Å; F306-A311 WeakPolarHBondContact O-CB 3.28Å; F306-A311 PolarHBondContact O-N 2.98Å
307	I	96.3	Very high	96.6	Very high	70 Å²	70	80.4 Å²	80.4	36%	0.359	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-39.9	171.9	-65.1	168.7	0	0	0	109.7	C303 D304 E309 G310 L313	C303-I307 HydrophobicContact CB-CD1 4.38Å; C303-I307 WeakPolarHBondContact O-CG1 3.32Å; C303-I307 PolarHBondContact O-N 3.48Å; C303-I307 VanDerWaalsContact O-N 3.1Å; D304-I307 PolarHBondContact O-N 3.45Å; I307-E309 VanDerWaalsContact C-N 3.27Å; I307-E309 PolarHBondContact O-N 2.86Å; I307-G310 PolarHBondContact O-N 2.98Å; I307-G310 VanDerWaalsContact O-N 3.09Å; I307-L313 HydrophobicContact CD1-CB 4.09Å; I307-L313 HydrophobicContact CD1-CD2 4.19Å; I307-L313 HydrophobicContact CG1-CB 4.48Å
308	Q	94.5	Very high	96.6	Very high	159 Å²	159	80 Å²	80	74%	0.743	40%	0.399	S	S	*	.	H	α-helix	trans	-65.2	-31.9	174.3	-63.4	169.4	37.4	0	0	112.2	D304 L305 F306 G310	D304-Q308 WeakPolarHBondContact O-CG 3.48Å; D304-Q308 PolarHBondContact O-N 2.93Å; D304-Q308 PolarHBondContact O-NE2 3.46Å; L305-Q308 WeakPolarHBondContact O-CB 3.41Å; L305-Q308 PolarHBondContact O-N 2.92Å; F306-Q308 PolarHBondContact O-N 3.11Å; Q308-G310 VanDerWaalsContact C-N 3.26Å; Q308-G310 PolarHBondContact O-N 3.42Å
309	E	94.8	Very high	96.8	Very high	92 Å²	92	75.4 Å²	75.4	43%	0.43	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	2.4	173.7	-65.6	-177.4	174.5	0	0	113.7	S284 L287 L305 F306 I307	S284-E309 PolarHBondContact OG-OE2 3.34Å; L287-E309 HydrophobicContact CD1-CB 3.73Å; L305-E309 PolarHBondContact O-N 3.12Å; F306-E309 CarbonylContact O-C 3.59Å; F306-E309 WeakPolarHBondContact O-CA 3.5Å; F306-E309 PolarHBondContact O-N 3.44Å; F306-E309 VanDerWaalsContact O-N 3.12Å; I307-E309 VanDerWaalsContact C-N 3.27Å; I307-E309 PolarHBondContact O-N 2.86Å
310	G	96.3	Very high	96.9	Very high	59 Å²	59	72.1 Å²	72.1	61%	0.608	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.8	7.7	175	0	0	0	0	0	115.7	F306 I307 Q308	F306-G310 PolarHBondContact O-N 3.13Å; F306-G310 VanDerWaalsContact O-N 3.11Å; I307-G310 PolarHBondContact O-N 2.98Å; I307-G310 VanDerWaalsContact O-N 3.09Å; Q308-G310 VanDerWaalsContact C-N 3.26Å; Q308-G310 PolarHBondContact O-N 3.42Å
311	A	98.1	Very high	97.1	Very high	8 Å²	8	69.1 Å²	69.1	7%	0.066	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-69.4	148.3	172.2	0	0	0	0	0	112	L287 V293 V295 F306	L287-A311 HydrophobicContact CD1-CB 4.02Å; L287-A311 HydrophobicContact CD2-CB 4.09Å; V293-A311 WeakPolarHBondContact O-CA 3.27Å; V295-A311 HydrophobicContact CG1-CB 4.02Å; V295-A311 HydrophobicContact CG2-CB 4.15Å; F306-A311 HydrophobicContact CB-CB 3.83Å; F306-A311 WeakPolarHBondContact O-CB 3.28Å; F306-A311 PolarHBondContact O-N 2.98Å
312	R	98.4	Very high	97.2	Very high	170 Å²	170	64 Å²	64	64%	0.642	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	147.3	167.8	-63.6	178.9	-178.9	-119.4	-1.4	109.9	V293 T294 V295	V293-R312 PolarHBondContact O-N 3.15Å; T294-R312 CarbonylContact C-O 3.48Å; T294-R312 VanDerWaalsContact CA-O 3.25Å; T294-R312 WeakPolarHBondContact CA-O 3.26Å; T294-R312 HydrophobicContact CG2-CB 4.14Å; V295-R312 PolarHBondContact N-O 3.01Å
313	L	98.2	Very high	97.4	Very high	93 Å²	93	62.3 Å²	62.3	49%	0.487	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121	174.9	-177.9	63.2	0	0	0	110.5	C303 I307	C303-L313 HydrophobicContact CB-CD1 3.66Å; I307-L313 HydrophobicContact CD1-CB 4.09Å; I307-L313 HydrophobicContact CD1-CD2 4.19Å; I307-L313 HydrophobicContact CG1-CB 4.48Å
314	G	97.9	Very high	97.5	Very high	5 Å²	5	62.3 Å²	62.3	5%	0.052	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-88.6	145.8	165.4	0	0	0	0	0	110.8	V295	V295-G314 PolarHBondContact O-N 3.23Å
315	R	97.1	Very high	97.6	Very high	200 Å²	200	61.2 Å²	61.2	76%	0.755	31%	0.314	S	S	*	.	S	Bend	trans	-87.8	-31.3	-177.8	-51.4	160.3	59.8	179.7	-0.7	111.9	W296 E319	W296-R315 PolarHBondContact NE1-O 3.43Å; W296-R315 VanDerWaalsContact NE1-O 3.17Å; R315-E319 WeakPolarHBondContact CA-OE2 3.36Å; R315-E319 WeakPolarHBondContact CB-OE2 3.5Å; R315-E319 WeakPolarHBondContact CD-OE2 3.45Å; R315-E319 VanDerWaalsContact CG-OE2 3.22Å; R315-E319 WeakPolarHBondContact CG-OE2 3.43Å; R315-E319 PolarHBondContact N-OE2 2.98Å
316	T	98.7	Very high	97.8	Very high	43 Å²	43	56.1 Å²	56.1	26%	0.264	29%	0.287	S	S	.	.	S	Bend	trans	-141	158.1	177.7	68.7	0	0	0	0	111.7	A318 E319 V320	T316-A318 VanDerWaalsContact C-N 3.28Å; T316-A318 PolarHBondContact O-N 2.91Å; T316-E319 PolarHBondContact O-N 2.92Å; T316-E319 VanDerWaalsContact O-N 3.14Å; T316-E319 PolarHBondContact OG1-N 2.96Å; T316-V320 WeakPolarHBondContact O-CG2 3.16Å; T316-V320 PolarHBondContact O-N 3.11Å; T316-V320 VanDerWaalsContact O-N 3.11Å
317	P	98.8	Very high	97.9	Very high	11 Å²	11	56 Å²	56	7%	0.071	29%	0.286	C	S	.	.	H	α-helix	trans	-53.6	-43	172.4	-27.8	36.1	0	0	0	113.2	L273 W296 E319 V320 V321 L340 S345 V347	L273-P317 HydrophobicContact CD1-CB 4.01Å; L273-P317 HydrophobicContact CD2-CB 4.4Å; W296-P317 HydrophobicContact CD2-CG 3.94Å; W296-P317 HydrophobicContact CE3-CG 3.93Å; W296-P317 HydrophobicContact CH2-CG 3.82Å; W296-P317 HydrophobicContact CZ2-CG 3.84Å; W296-P317 HydrophobicContact CZ3-CG 3.88Å; P317-E319 VanDerWaalsContact C-N 3.32Å; P317-E319 PolarHBondContact O-N 3.47Å; P317-V320 PolarHBondContact O-N 2.87Å; P317-V321 VanDerWaalsContact O-CG2 3.27Å; P317-V321 WeakPolarHBondContact O-CG2 3.43Å; P317-V321 PolarHBondContact O-N 3.36Å; P317-L340 HydrophobicContact CB-CD1 3.96Å; P317-L340 HydrophobicContact CG-CD1 3.52Å; P317-S345 VanDerWaalsContact CD-O 3.32Å; P317-S345 WeakPolarHBondContact CD-O 3.18Å; P317-V347 HydrophobicContact CB-CG2 4.21Å
318	A	98.8	Very high	98	Very high	14 Å²	14	52.6 Å²	52.6	12%	0.116	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-41.1	177.2	0	0	0	0	0	112.8	T316 S322 S345 G346 Q349 G350	T316-A318 VanDerWaalsContact C-N 3.28Å; T316-A318 PolarHBondContact O-N 2.91Å; A318-S322 VanDerWaalsContact O-CB 3.31Å; A318-S322 WeakPolarHBondContact O-CB 3.42Å; A318-S322 PolarHBondContact O-N 3.32Å; A318-S345 WeakPolarHBondContact CB-O 3.44Å; A318-S345 PolarHBondContact N-O 2.86Å; A318-G346 WeakPolarHBondContact CB-O 3.25Å; A318-Q349 HydrophobicContact CB-CB 4Å; A318-G350 WeakPolarHBondContact O-CA 3.49Å
319	E	98.6	Very high	98.2	Very high	73 Å²	73	45 Å²	45	34%	0.341	23%	0.234	S	C	.	.	H	α-helix	trans	-68	-42	178.9	-174.9	-179.4	-155.7	0	0	111.9	R315 T316 P317 S322 T323	R315-E319 WeakPolarHBondContact CA-OE2 3.36Å; R315-E319 WeakPolarHBondContact CB-OE2 3.5Å; R315-E319 WeakPolarHBondContact CD-OE2 3.45Å; R315-E319 VanDerWaalsContact CG-OE2 3.22Å; R315-E319 WeakPolarHBondContact CG-OE2 3.43Å; R315-E319 PolarHBondContact N-OE2 2.98Å; T316-E319 PolarHBondContact O-N 2.92Å; T316-E319 VanDerWaalsContact O-N 3.14Å; T316-E319 PolarHBondContact OG1-N 2.96Å; P317-E319 VanDerWaalsContact C-N 3.32Å; P317-E319 PolarHBondContact O-N 3.47Å; E319-S322 PolarHBondContact O-N 3.2Å; E319-T323 WeakPolarHBondContact O-CB 3.41Å; E319-T323 PolarHBondContact O-N 2.95Å; E319-T323 PolarHBondContact O-OG1 2.87Å
320	V	98.8	Very high	98.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.8	-51.1	175.8	175.2	0	0	0	0	110.1	G271 L273 T294 W296 T316 P317 S322 T323 C324 T327	G271-V320 VanDerWaalsContact CA-CG1 3.49Å; L273-V320 HydrophobicContact CD2-CB 3.91Å; L273-V320 HydrophobicContact CD2-CG1 3.89Å; L273-V320 HydrophobicContact CD2-CG2 3.96Å; T294-V320 HydrophobicContact CG2-CG2 4.17Å; W296-V320 HydrophobicContact CB-CG2 3.8Å; T316-V320 WeakPolarHBondContact O-CG2 3.16Å; T316-V320 PolarHBondContact O-N 3.11Å; T316-V320 VanDerWaalsContact O-N 3.11Å; P317-V320 PolarHBondContact O-N 2.87Å; V320-S322 VanDerWaalsContact C-N 3.3Å; V320-S322 PolarHBondContact O-N 3.11Å; V320-T323 PolarHBondContact O-N 2.99Å; V320-T323 VanDerWaalsContact O-N 3.13Å; V320-C324 WeakPolarHBondContact O-CB 3.38Å; V320-C324 PolarHBondContact O-N 3.29Å; V320-T327 HydrophobicContact CG1-CG2 3.96Å
321	V	98.8	Very high	98.5	Very high	1 Å²	1	40 Å²	40	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-37	179.9	175.5	0	0	0	0	111.8	P317 T323 C324 T327 V347 I351 K355	P317-V321 VanDerWaalsContact O-CG2 3.27Å; P317-V321 WeakPolarHBondContact O-CG2 3.43Å; P317-V321 PolarHBondContact O-N 3.36Å; V321-T323 VanDerWaalsContact C-N 3.31Å; V321-T323 PolarHBondContact O-N 3.13Å; V321-C324 VanDerWaalsContact O-O 3.07Å; V321-T327 HydrophobicContact CG2-CG2 3.9Å; V321-V347 HydrophobicContact CG2-CB 4.24Å; V321-V347 HydrophobicContact CG2-CG1 3.85Å; V321-V347 HydrophobicContact CG2-CG2 4.23Å; V321-I351 HydrophobicContact CG1-CD1 3.53Å; V321-I351 HydrophobicContact CG1-CG1 4.02Å; V321-K355 WeakPolarHBondContact O-CD 3.43Å; V321-K355 VanDerWaalsContact O-CE 3.29Å; V321-K355 WeakPolarHBondContact O-CE 3.21Å; V321-K355 PolarHBondContact O-NZ 3.48Å
322	S	98.4	Very high	98.3	Very high	44 Å²	44	41 Å²	41	31%	0.308	21%	0.205	S	C	.	.	H	α-helix	trans	-65.6	-36.3	176.6	-174.9	0	0	0	0	112.2	A318 E319 V320 R352 K355	A318-S322 VanDerWaalsContact O-CB 3.31Å; A318-S322 WeakPolarHBondContact O-CB 3.42Å; A318-S322 PolarHBondContact O-N 3.32Å; E319-S322 PolarHBondContact O-N 3.2Å; V320-S322 VanDerWaalsContact C-N 3.3Å; V320-S322 PolarHBondContact O-N 3.11Å; S322-R352 PolarHBondContact O-NH1 3.13Å; S322-R352 PolarHBondContact O-NH2 2.94Å; S322-R352 PolarHBondContact OG-NH1 3.47Å; S322-K355 WeakPolarHBondContact O-CE 3.28Å; S322-K355 PolarHBondContact O-NZ 3.22Å
323	T	98.3	Very high	98.2	Very high	69 Å²	69	35.3 Å²	35.3	42%	0.423	19%	0.187	S	C	.	.	H	α-helix	trans	-86	-33.3	-174.6	-56	0	0	0	0	113.1	E319 V320 V321	E319-T323 WeakPolarHBondContact O-CB 3.41Å; E319-T323 PolarHBondContact O-N 2.95Å; E319-T323 PolarHBondContact O-OG1 2.87Å; V320-T323 PolarHBondContact O-N 2.99Å; V320-T323 VanDerWaalsContact O-N 3.13Å; V321-T323 VanDerWaalsContact C-N 3.31Å; V321-T323 PolarHBondContact O-N 3.13Å
324	C	98.8	Very high	98.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.169	C	C	.	.			trans	-100.2	153.9	-174.3	-62.8	0	0	0	0	112.4	K269 I270 V320 V321 K355	K269-C324 HydrophobicContact CB-CB 4.37Å; K269-C324 CarbonylContact O-C 3.3Å; K269-C324 WeakPolarHBondContact O-CB 3.29Å; I270-C324 VanDerWaalsContact C-SG 3.52Å; I270-C324 PolarHBondContact O-SG 3.29Å; I270-C324 VanDerWaalsContact O-SG 3.35Å; V320-C324 WeakPolarHBondContact O-CB 3.38Å; V320-C324 PolarHBondContact O-N 3.29Å; V321-C324 VanDerWaalsContact O-O 3.07Å; C324-K355 WeakPolarHBondContact O-CD 3.4Å; C324-K355 PolarHBondContact O-NZ 3Å
325	D	98.6	Very high	98.2	Very high	63 Å²	63	39.8 Å²	39.8	34%	0.337	20%	0.203	S	C	.	.	S	Bend	trans	-84.2	-42.4	-179.9	-55.8	-53	0	0	0	111	K268 K269 C356	K268-D325 HydrophobicContact CB-CB 4.08Å; K268-D325 HydrophobicContact CD-CB 4.48Å; K268-D325 HydrophobicContact CG-CB 4.3Å; K269-D325 PolarHBondContact N-OD2 3.43Å; K269-D325 PolarHBondContact O-N 2.98Å; D325-C356 WeakPolarHBondContact O-CB 3.43Å; D325-C356 PolarHBondContact O-N 2.87Å
326	I	98.9	Very high	98.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127	174.8	-56.6	173.2	0	0	0	108.2	K268 K269 I270 G271 F328 C356 V358 L409 D412	K268-I326 HydrophobicContact CD-CD1 3.6Å; K268-I326 HydrophobicContact CD-CG1 4.03Å; K269-I326 PolarHBondContact O-N 3.39Å; I270-I326 CarbonylContact C-O 3.27Å; I270-I326 WeakPolarHBondContact CA-O 3.33Å; I270-I326 HydrophobicContact CD1-CB 4.04Å; I270-I326 HydrophobicContact CD1-CD1 4.46Å; G271-I326 PolarHBondContact N-O 3.16Å; I326-F328 HydrophobicContact CG2-CD2 4.32Å; I326-F328 HydrophobicContact CG2-CE2 3.77Å; I326-F328 HydrophobicContact CG2-CZ 3.95Å; I326-C356 HydrophobicContact CB-CB 4.35Å; I326-C356 HydrophobicContact CG1-CB 3.95Å; I326-C356 HydrophobicContact CG2-CB 4.46Å; I326-V358 HydrophobicContact CG2-CG2 3.85Å; I326-L409 HydrophobicContact CD1-CD1 4.08Å; I326-L409 HydrophobicContact CG1-CD1 4.08Å; I326-L409 HydrophobicContact CG2-CD1 4.32Å; I326-D412 HydrophobicContact CD1-CB 4.09Å
327	T	98.9	Very high	98.2	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.3	176.1	-57.8	0	0	0	0	110.4	G271 L273 V320 V321 C356 Y357 V358	G271-T327 CarbonylContact O-C 3.54Å; G271-T327 WeakPolarHBondContact O-CA 3.49Å; L273-T327 HydrophobicContact CD1-CG2 3.82Å; L273-T327 HydrophobicContact CD2-CG2 4.37Å; L273-T327 HydrophobicContact CG-CG2 3.75Å; V320-T327 HydrophobicContact CG1-CG2 3.96Å; V321-T327 HydrophobicContact CG2-CG2 3.9Å; T327-C356 PolarHBondContact N-O 3.4Å; T327-Y357 HydrophobicContact CG2-CD2 4.35Å; T327-Y357 CarbonylContact O-C 3.14Å; T327-Y357 WeakPolarHBondContact O-CA 3.37Å; T327-V358 PolarHBondContact O-N 3.22Å
328	F	98.9	Very high	98.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	148.6	172.2	-62.4	-90.6	0	0	0	110.8	I270 G271 F272 L273 I326 V358 M360 C413 C416 F417 M420	I270-F328 HydrophobicContact CD1-CE2 4.38Å; I270-F328 HydrophobicContact CG2-CD2 3.55Å; I270-F328 HydrophobicContact CG2-CE2 3.61Å; G271-F328 PolarHBondContact O-N 3.42Å; F272-F328 CarbonylContact C-O 3.59Å; F272-F328 WeakPolarHBondContact CA-O 3.25Å; F272-F328 HydrophobicContact CD2-CB 3.62Å; F272-F328 HydrophobicContact CD2-CG 4.35Å; F272-F328 HydrophobicContact CE2-CB 3.71Å; F272-F328 HydrophobicContact CE2-CG 4.42Å; F272-F328 HydrophobicContact CG-CB 4.42Å; L273-F328 PolarHBondContact N-O 3.33Å; I326-F328 HydrophobicContact CG2-CD2 4.32Å; I326-F328 HydrophobicContact CG2-CE2 3.77Å; I326-F328 HydrophobicContact CG2-CZ 3.95Å; F328-V358 CarbonylContact C-O 3.48Å; F328-V358 VanDerWaalsContact CA-O 3.24Å; F328-V358 WeakPolarHBondContact CA-O 3.47Å; F328-V358 HydrophobicContact CD1-CB 3.54Å; F328-V358 HydrophobicContact CD1-CG1 3.64Å; F328-V358 HydrophobicContact CD1-CG2 4.17Å; F328-V358 HydrophobicContact CE1-CB 3.78Å; F328-V358 HydrophobicContact CE1-CG1 3.73Å; F328-V358 HydrophobicContact CE1-CG2 3.94Å; F328-V358 HydrophobicContact CG-CB 4.28Å; F328-V358 HydrophobicContact CZ-CG2 4.46Å; F328-M360 HydrophobicContact CB-SD 4.47Å; F328-M360 HydrophobicContact CD1-CG 4.27Å; F328-M360 HydrophobicContact CD1-SD 3.76Å; F328-M360 HydrophobicContact CG-SD 4.48Å; F328-C413 HydrophobicContact CZ-CB 4.35Å; F328-C416 HydrophobicContact CE2-CB 4.22Å; F328-C416 HydrophobicContact CZ-CB 3.8Å; F328-F417 AromaticContact CE1-CE1 3.93Å; F328-F417 HydrophobicContact CE1-CE1 3.93Å; F328-M420 HydrophobicContact CE1-CE 4.35Å
329	A	98.9	Very high	98.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.1	169.5	0	0	0	0	0	111.5	L273 L340 Y357 V358 M360	L273-A329 HydrophobicContact CB-CB 4.14Å; L273-A329 CarbonylContact O-C 3.57Å; L273-A329 WeakPolarHBondContact O-CA 3.43Å; A329-L340 HydrophobicContact CB-CD2 3.82Å; A329-Y357 HydrophobicContact CB-CE2 3.9Å; A329-Y357 WeakPolarHBondContact CB-OH 3.39Å; A329-V358 PolarHBondContact N-O 2.92Å; A329-M360 WeakPolarHBondContact O-CA 3.41Å; A329-M360 VanDerWaalsContact O-CB 3.32Å; A329-M360 WeakPolarHBondContact O-CB 3.45Å; A329-M360 PolarHBondContact O-N 2.9Å
330	C	98.4	Very high	98.2	Very high	17 Å²	17	31.9 Å²	31.9	12%	0.115	17%	0.172	C	C	.	.			trans	-141.8	93.1	176.1	-169.3	0	0	0	0	109.9	F272 L273 M360	F272-C330 HydrophobicContact CE1-CB 4.11Å; F272-C330 HydrophobicContact CZ-CB 4.03Å; L273-C330 PolarHBondContact O-N 3.19Å; C330-M360 HydrophobicContact CB-CB 4.48Å
331	V	98.1	Very high	98.2	Very high	29 Å²	29	31.9 Å²	31.9	18%	0.176	17%	0.172	C	C	.	.			trans	-122.9	170.5	-176.2	-62.3	0	0	0	0	112.9	A336 A337 L340 S361	V331-A336 HydrophobicContact CB-CB 4.1Å; V331-A336 HydrophobicContact CG2-CB 4.02Å; V331-A337 HydrophobicContact CG2-CB 3.93Å; V331-L340 HydrophobicContact CG1-CD2 3.92Å; V331-S361 VanDerWaalsContact CG2-OG 3.3Å; V331-S361 WeakPolarHBondContact CG2-OG 3.34Å; V331-S361 PolarHBondContact N-OG 2.82Å
332	S	94.3	Very high	98.2	Very high	29 Å²	29	35.6 Å²	35.6	20%	0.203	19%	0.192	C	C	.	.	S	Bend	trans	-70	-38.6	-161.6	50.5	0	0	0	0	115.6	K505	S332-K505 PolarHBondContact O-NZ 3.48Å
333	D	96.1	Very high	98.2	Very high	50 Å²	50	34 Å²	34	27%	0.267	18%	0.183	S	C	.	.	S	Bend	trans	-160.6	168.3	-165.4	60.2	66.1	0	0	0	112	K335 A336 A337 K505	D333-K335 PolarHBondContact O-N 3.22Å; D333-K335 WeakPolarHBondContact OD1-CA 3.34Å; D333-K335 VanDerWaalsContact OD1-CB 3.29Å; D333-K335 WeakPolarHBondContact OD1-CB 3.4Å; D333-K335 PolarHBondContact OD1-N 2.85Å; D333-A336 PolarHBondContact O-N 3.17Å; D333-A336 VanDerWaalsContact O-N 3.13Å; D333-A336 PolarHBondContact OD1-N 3.39Å; D333-A337 PolarHBondContact O-N 2.95Å; D333-K505 HydrophobicContact CB-CD 3.84Å
334	P	98.1	Very high	98.2	Very high	17 Å²	17	36.3 Å²	36.3	11%	0.11	20%	0.199	C	C	.	.	H	α-helix	trans	-55.9	-33.7	179.8	-27.7	33.7	0	0	0	114.4	A337 K338 V363 D364 T367 L509	P334-A337 PolarHBondContact O-N 2.94Å; P334-K338 WeakPolarHBondContact O-CB 3.32Å; P334-K338 WeakPolarHBondContact O-CG 3.24Å; P334-K338 PolarHBondContact O-N 3.17Å; P334-V363 HydrophobicContact CB-CB 4.31Å; P334-V363 HydrophobicContact CB-CG1 4.27Å; P334-V363 HydrophobicContact CG-CB 3.89Å; P334-V363 HydrophobicContact CG-CG1 4Å; P334-D364 VanDerWaalsContact CG-OD1 3.25Å; P334-D364 WeakPolarHBondContact CG-OD1 3.3Å; P334-T367 HydrophobicContact CB-CG2 4.18Å; P334-L509 HydrophobicContact CG-CD1 4.01Å; P334-L509 HydrophobicContact CG-CD2 4.48Å
335	K	98.3	Very high	98.1	Very high	175 Å²	175	38.8 Å²	38.8	76%	0.761	22%	0.216	S	C	*	.	H	α-helix	trans	-69.6	-43.5	179.3	-178.4	-176.3	176.3	-175.2	0	110.3	D333 K338 D339	D333-K335 PolarHBondContact O-N 3.22Å; D333-K335 WeakPolarHBondContact OD1-CA 3.34Å; D333-K335 VanDerWaalsContact OD1-CB 3.29Å; D333-K335 WeakPolarHBondContact OD1-CB 3.4Å; D333-K335 PolarHBondContact OD1-N 2.85Å; K335-K338 PolarHBondContact O-N 3.11Å; K335-D339 VanDerWaalsContact O-CB 3.28Å; K335-D339 WeakPolarHBondContact O-CB 3.42Å; K335-D339 PolarHBondContact O-N 2.91Å
336	A	98.1	Very high	98.1	Very high	12 Å²	12	35.9 Å²	35.9	10%	0.099	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-39.9	175.6	0	0	0	0	0	112.1	V331 D333 L340	V331-A336 HydrophobicContact CB-CB 4.1Å; V331-A336 HydrophobicContact CG2-CB 4.02Å; D333-A336 PolarHBondContact O-N 3.17Å; D333-A336 VanDerWaalsContact O-N 3.13Å; D333-A336 PolarHBondContact OD1-N 3.39Å; A336-L340 VanDerWaalsContact O-CB 3.24Å; A336-L340 WeakPolarHBondContact O-CB 3.49Å; A336-L340 PolarHBondContact O-N 3.48Å
337	A	98.5	Very high	98.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-46.9	176.4	0	0	0	0	0	111.6	V331 D333 P334 L340 V341 V363 L371	V331-A337 HydrophobicContact CG2-CB 3.93Å; D333-A337 PolarHBondContact O-N 2.95Å; P334-A337 PolarHBondContact O-N 2.94Å; A337-L340 PolarHBondContact O-N 2.76Å; A337-V341 WeakPolarHBondContact O-CG2 3.22Å; A337-V341 PolarHBondContact O-N 2.84Å; A337-V341 VanDerWaalsContact O-N 3.11Å; A337-V363 HydrophobicContact CB-CG1 4.12Å; A337-L371 HydrophobicContact CB-CD1 4.15Å
338	K	98.6	Very high	98.1	Very high	61 Å²	61	36.9 Å²	36.9	27%	0.265	21%	0.206	S	C	.	.	H	α-helix	trans	-62.4	-44.1	175.9	-69.9	-175.8	-168.9	-162.2	0	112.6	P334 K335 V341 L342 T367 E370 L371	P334-K338 WeakPolarHBondContact O-CB 3.32Å; P334-K338 WeakPolarHBondContact O-CG 3.24Å; P334-K338 PolarHBondContact O-N 3.17Å; K335-K338 PolarHBondContact O-N 3.11Å; K338-V341 PolarHBondContact O-N 2.73Å; K338-L342 HydrophobicContact CB-CD1 4.48Å; K338-L342 VanDerWaalsContact O-CB 3.28Å; K338-L342 WeakPolarHBondContact O-CB 3.03Å; K338-L342 WeakPolarHBondContact O-CG 3.39Å; K338-L342 PolarHBondContact O-N 3.35Å; K338-T367 HydrophobicContact CD-CG2 4.46Å; K338-T367 WeakPolarHBondContact CE-OG1 3.23Å; K338-T367 HydrophobicContact CG-CG2 4.06Å; K338-E370 VanDerWaalsContact CE-OE2 3.28Å; K338-E370 WeakPolarHBondContact CE-OE2 3.36Å; K338-E370 IonicContact NZ-OE2 3.58Å; K338-E370 PolarHBondContact NZ-OE2 3.23Å; K338-L371 HydrophobicContact CG-CD2 4.31Å
339	D	98.6	Very high	98.1	Very high	90 Å²	90	42.3 Å²	42.3	48%	0.481	23%	0.231	S	C	.	.	H	α-helix	trans	-62.8	-42.7	177	-175.7	60.6	0	0	0	111.9	K335 V341 G343	K335-D339 VanDerWaalsContact O-CB 3.28Å; K335-D339 WeakPolarHBondContact O-CB 3.42Å; K335-D339 PolarHBondContact O-N 2.91Å; D339-V341 VanDerWaalsContact C-N 3.26Å; D339-V341 PolarHBondContact O-N 2.96Å; D339-G343 WeakPolarHBondContact O-CA 3.48Å; D339-G343 PolarHBondContact O-N 2.87Å
340	L	98.7	Very high	98	Very high	11 Å²	11	42.6 Å²	42.6	6%	0.058	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-37.4	176.8	-177.4	64.8	0	0	0	112.2	L273 W296 P317 A329 V331 A336 A337 G346 V347	L273-L340 HydrophobicContact CB-CD1 4.5Å; L273-L340 HydrophobicContact CB-CD2 3.97Å; L273-L340 HydrophobicContact CD1-CD1 4.22Å; L273-L340 HydrophobicContact CD1-CD2 4.06Å; L273-L340 HydrophobicContact CD1-CG 4.27Å; W296-L340 HydrophobicContact CE3-CD1 4.23Å; W296-L340 HydrophobicContact CH2-CD1 4Å; W296-L340 HydrophobicContact CZ3-CD1 3.49Å; W296-L340 VanDerWaalsContact CZ3-CD1 3.49Å; P317-L340 HydrophobicContact CB-CD1 3.96Å; P317-L340 HydrophobicContact CG-CD1 3.52Å; A329-L340 HydrophobicContact CB-CD2 3.82Å; V331-L340 HydrophobicContact CG1-CD2 3.92Å; A336-L340 VanDerWaalsContact O-CB 3.24Å; A336-L340 WeakPolarHBondContact O-CB 3.49Å; A336-L340 PolarHBondContact O-N 3.48Å; A337-L340 PolarHBondContact O-N 2.76Å; L340-G346 CarbonylContact O-C 3.58Å; L340-G346 WeakPolarHBondContact O-CA 3.35Å; L340-V347 HydrophobicContact CG-CG2 4.17Å; L340-V347 PolarHBondContact O-N 3.44Å
341	V	98.8	Very high	98	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-85.1	-49.9	-177.4	176.9	0	0	0	0	112.7	A337 K338 D339 V347 L348 Y357 L371 V374 I375	A337-V341 WeakPolarHBondContact O-CG2 3.22Å; A337-V341 PolarHBondContact O-N 2.84Å; A337-V341 VanDerWaalsContact O-N 3.11Å; K338-V341 PolarHBondContact O-N 2.73Å; D339-V341 VanDerWaalsContact C-N 3.26Å; D339-V341 PolarHBondContact O-N 2.96Å; V341-V347 HydrophobicContact CB-CB 4.39Å; V341-V347 HydrophobicContact CG1-CB 4.38Å; V341-V347 HydrophobicContact CG2-CB 4.17Å; V341-V347 HydrophobicContact CG2-CG2 4.24Å; V341-V347 PolarHBondContact O-N 3.07Å; V341-L348 HydrophobicContact CG1-CB 4.26Å; V341-L348 VanDerWaalsContact O-CB 3.23Å; V341-L348 WeakPolarHBondContact O-CB 3.41Å; V341-L348 PolarHBondContact O-N 3.44Å; V341-Y357 HydrophobicContact CG2-CE1 4.08Å; V341-L371 HydrophobicContact CB-CD2 3.74Å; V341-L371 HydrophobicContact CG1-CD2 3.9Å; V341-L371 HydrophobicContact CG2-CD1 4.32Å; V341-L371 HydrophobicContact CG2-CD2 3.95Å; V341-V374 HydrophobicContact CG1-CG2 4.35Å; V341-I375 HydrophobicContact CG1-CD1 4.34Å; V341-I375 HydrophobicContact CG1-CG1 4.4Å
342	L	98.5	Very high	97.9	Very high	79 Å²	79	46.4 Å²	46.4	41%	0.414	24%	0.244	S	C	.	.	H	α-helix	trans	-93.5	-17	-169.9	-57.2	176.5	0	0	0	113.4	K338 L348 V374	K338-L342 HydrophobicContact CB-CD1 4.48Å; K338-L342 VanDerWaalsContact O-CB 3.28Å; K338-L342 WeakPolarHBondContact O-CB 3.03Å; K338-L342 WeakPolarHBondContact O-CG 3.39Å; K338-L342 PolarHBondContact O-N 3.35Å; L342-L348 HydrophobicContact CD2-CD2 4.04Å; L342-V374 HydrophobicContact CD2-CG2 4.03Å
343	G	98.2	Very high	98.1	Very high	12 Å²	12	50.4 Å²	50.4	12%	0.124	27%	0.269	C	S	.	.	S	Bend	trans	-66.5	171.5	-177.4	0	0	0	0	0	114.1	D339 S345 G346	D339-G343 WeakPolarHBondContact O-CA 3.48Å; D339-G343 PolarHBondContact O-N 2.87Å; G343-S345 PolarHBondContact O-N 2.79Å; G343-G346 WeakPolarHBondContact O-CA 3.33Å; G343-G346 PolarHBondContact O-N 3.48Å
344	P	97.4	Very high	98	Very high	117 Å²	117	50.5 Å²	50.5	76%	0.76	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	133.8	175.6	28.1	-34.3	0	0	0	110.4	G346	P344-G346 PolarHBondContact O-N 3.06Å; P344-G346 VanDerWaalsContact O-N 3.11Å
345	S	97.9	Very high	98	Very high	51 Å²	51	50.3 Å²	50.3	36%	0.357	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	23.3	-171.7	-53.6	0	0	0	0	113.8	P317 A318 G343 Q349	P317-S345 VanDerWaalsContact CD-O 3.32Å; P317-S345 WeakPolarHBondContact CD-O 3.18Å; A318-S345 WeakPolarHBondContact CB-O 3.44Å; A318-S345 PolarHBondContact N-O 2.86Å; G343-S345 PolarHBondContact O-N 2.79Å; S345-Q349 VanDerWaalsContact N-CD 3.35Å
346	G	98.4	Very high	98.1	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.021	25%	0.245	C	C	.	.			trans	-75.4	173.8	175.5	0	0	0	0	0	113.4	A318 L340 G343 P344 L348 Q349	A318-G346 WeakPolarHBondContact CB-O 3.25Å; L340-G346 CarbonylContact O-C 3.58Å; L340-G346 WeakPolarHBondContact O-CA 3.35Å; G343-G346 WeakPolarHBondContact O-CA 3.33Å; G343-G346 PolarHBondContact O-N 3.48Å; P344-G346 PolarHBondContact O-N 3.06Å; P344-G346 VanDerWaalsContact O-N 3.11Å; G346-L348 PolarHBondContact O-N 3.45Å; G346-L348 VanDerWaalsContact O-N 3.16Å; G346-Q349 PolarHBondContact O-N 2.89Å; G346-Q349 VanDerWaalsContact O-N 3.07Å
347	V	98.8	Very high	98.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-49.6	-45.3	-175.7	170.5	0	0	0	0	111.8	L273 P317 V321 L340 V341 Q349 G350 I351 Y357	L273-V347 HydrophobicContact CD1-CG2 3.56Å; P317-V347 HydrophobicContact CB-CG2 4.21Å; V321-V347 HydrophobicContact CG2-CB 4.24Å; V321-V347 HydrophobicContact CG2-CG1 3.85Å; V321-V347 HydrophobicContact CG2-CG2 4.23Å; L340-V347 HydrophobicContact CG-CG2 4.17Å; L340-V347 PolarHBondContact O-N 3.44Å; V341-V347 HydrophobicContact CB-CB 4.39Å; V341-V347 HydrophobicContact CG1-CB 4.38Å; V341-V347 HydrophobicContact CG2-CB 4.17Å; V341-V347 HydrophobicContact CG2-CG2 4.24Å; V341-V347 PolarHBondContact O-N 3.07Å; V347-Q349 PolarHBondContact O-N 3.23Å; V347-Q349 VanDerWaalsContact O-N 3.08Å; V347-G350 PolarHBondContact O-N 2.88Å; V347-I351 HydrophobicContact CG1-CD1 4.2Å; V347-I351 HydrophobicContact CG1-CG1 4.08Å; V347-I351 WeakPolarHBondContact O-CG1 3.37Å; V347-I351 PolarHBondContact O-N 3.43Å; V347-Y357 HydrophobicContact CB-CD2 4.49Å; V347-Y357 HydrophobicContact CB-CE2 4.18Å; V347-Y357 HydrophobicContact CG1-CD2 3.49Å; V347-Y357 VanDerWaalsContact CG1-CD2 3.49Å; V347-Y357 HydrophobicContact CG1-CE2 3.64Å; V347-Y357 HydrophobicContact CG1-CG 3.97Å; V347-Y357 HydrophobicContact CG2-CD2 4.18Å; V347-Y357 HydrophobicContact CG2-CE2 3.49Å; V347-Y357 VanDerWaalsContact CG2-CE2 3.49Å
348	L	98.5	Very high	98.1	Very high	23 Å²	23	41.7 Å²	41.7	12%	0.12	24%	0.24	C	C	.	.	H	α-helix	trans	-60.7	-25.4	-174	-168.7	65.5	0	0	0	113.3	V341 L342 G346 G350 V374 R378	V341-L348 HydrophobicContact CG1-CB 4.26Å; V341-L348 VanDerWaalsContact O-CB 3.23Å; V341-L348 WeakPolarHBondContact O-CB 3.41Å; V341-L348 PolarHBondContact O-N 3.44Å; L342-L348 HydrophobicContact CD2-CD2 4.04Å; G346-L348 PolarHBondContact O-N 3.45Å; G346-L348 VanDerWaalsContact O-N 3.16Å; L348-G350 VanDerWaalsContact C-N 3.35Å; L348-V374 HydrophobicContact CD1-CB 4.17Å; L348-V374 HydrophobicContact CD1-CG2 4.23Å; L348-V374 WeakPolarHBondContact CD1-O 3.39Å; L348-V374 HydrophobicContact CD2-CB 4.31Å; L348-R378 HydrophobicContact CD1-CG 3.95Å; L348-R378 PolarHBondContact O-NH1 2.88Å
349	Q	98.4	Very high	98.1	Very high	113 Å²	113	38.8 Å²	38.8	53%	0.528	23%	0.228	S	C	.	.	H	α-helix	trans	-77.5	-21.4	177.4	-57.6	-173.7	-0	0	0	112.7	A318 S345 G346 V347	A318-Q349 HydrophobicContact CB-CB 4Å; S345-Q349 VanDerWaalsContact N-CD 3.35Å; G346-Q349 PolarHBondContact O-N 2.89Å; G346-Q349 VanDerWaalsContact O-N 3.07Å; V347-Q349 PolarHBondContact O-N 3.23Å; V347-Q349 VanDerWaalsContact O-N 3.08Å
350	G	98.2	Very high	98.1	Very high	6 Å²	6	34.6 Å²	34.6	6%	0.062	21%	0.206	C	C	.	.	H	α-helix	trans	-92.6	-16.6	174.8	0	0	0	0	0	114.4	A318 V347 L348	A318-G350 WeakPolarHBondContact O-CA 3.49Å; V347-G350 PolarHBondContact O-N 2.88Å; L348-G350 VanDerWaalsContact C-N 3.35Å
351	I	98.6	Very high	98.1	Very high	13 Å²	13	34.4 Å²	34.4	7%	0.067	21%	0.205	C	C	.	.			trans	-68.2	133.3	180	-64.9	-68.7	0	0	0	110.9	V321 V347 K355 I375 R378	V321-I351 HydrophobicContact CG1-CD1 3.53Å; V321-I351 HydrophobicContact CG1-CG1 4.02Å; V347-I351 HydrophobicContact CG1-CD1 4.2Å; V347-I351 HydrophobicContact CG1-CG1 4.08Å; V347-I351 WeakPolarHBondContact O-CG1 3.37Å; V347-I351 PolarHBondContact O-N 3.43Å; I351-K355 HydrophobicContact CD1-CB 4.1Å; I351-I375 HydrophobicContact CD1-CG2 4.2Å; I351-I375 HydrophobicContact CG1-CG2 4.47Å; I351-R378 HydrophobicContact CB-CB 4.33Å; I351-R378 HydrophobicContact CG2-CB 3.68Å
352	R	95.7	Very high	98.1	Very high	114 Å²	114	35.3 Å²	35.3	43%	0.43	21%	0.21	S	C	.	.			trans	-145.1	167.1	171.3	61.4	177.7	177.8	-100.5	4.1	109	S322 G354 K355	S322-R352 PolarHBondContact O-NH1 3.13Å; S322-R352 PolarHBondContact O-NH2 2.94Å; S322-R352 PolarHBondContact OG-NH1 3.47Å; R352-G354 PolarHBondContact O-N 3.4Å; R352-K355 HydrophobicContact CG-CG 3.64Å; R352-K355 VanDerWaalsContact CZ-CE 3.41Å; R352-K355 VanDerWaalsContact NH2-CE 3.31Å; R352-K355 WeakPolarHBondContact O-CB 3.31Å; R352-K355 WeakPolarHBondContact O-CG 3.18Å; R352-K355 PolarHBondContact O-N 3.03Å
353	P	98.3	Very high	98.1	Very high	112 Å²	112	31.6 Å²	31.6	73%	0.727	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.7	125.9	178.6	-32.6	37.9	0	0	0	113.5	G379	P353-G379 VanDerWaalsContact CA-O 3.29Å; P353-G379 WeakPolarHBondContact CA-O 3.34Å
354	G	93.8	Very high	98.1	Very high	53 Å²	53	32.7 Å²	32.7	55%	0.546	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.8	-10.5	178.7	0	0	0	0	0	115.8	R352 G379	R352-G354 PolarHBondContact O-N 3.4Å; G354-G379 PolarHBondContact N-O 3.06Å; G354-G379 VanDerWaalsContact N-O 3.11Å
355	K	98.3	Very high	98.2	Very high	13 Å²	13	27.8 Å²	27.8	6%	0.057	16%	0.164	C	C	.	.			trans	-71.1	140.4	174.1	-67.3	-58.9	-169.8	175.5	0	111.4	V321 S322 C324 I351 R352 G380 R381	V321-K355 WeakPolarHBondContact O-CD 3.43Å; V321-K355 VanDerWaalsContact O-CE 3.29Å; V321-K355 WeakPolarHBondContact O-CE 3.21Å; V321-K355 PolarHBondContact O-NZ 3.48Å; S322-K355 WeakPolarHBondContact O-CE 3.28Å; S322-K355 PolarHBondContact O-NZ 3.22Å; C324-K355 WeakPolarHBondContact O-CD 3.4Å; C324-K355 PolarHBondContact O-NZ 3Å; I351-K355 HydrophobicContact CD1-CB 4.1Å; R352-K355 HydrophobicContact CG-CG 3.64Å; R352-K355 VanDerWaalsContact CZ-CE 3.41Å; R352-K355 VanDerWaalsContact NH2-CE 3.31Å; R352-K355 WeakPolarHBondContact O-CB 3.31Å; R352-K355 WeakPolarHBondContact O-CG 3.18Å; R352-K355 PolarHBondContact O-N 3.03Å; K355-G380 CarbonylContact O-C 3.52Å; K355-G380 WeakPolarHBondContact O-CA 3.46Å; K355-R381 PolarHBondContact O-N 3.22Å
356	C	98.8	Very high	98.2	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.034	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	136.5	-176.6	-58.9	0	0	0	0	111	D325 I326 T327 R381 L409	D325-C356 WeakPolarHBondContact O-CB 3.43Å; D325-C356 PolarHBondContact O-N 2.87Å; I326-C356 HydrophobicContact CB-CB 4.35Å; I326-C356 HydrophobicContact CG1-CB 3.95Å; I326-C356 HydrophobicContact CG2-CB 4.46Å; T327-C356 PolarHBondContact N-O 3.4Å; C356-R381 WeakPolarHBondContact CA-O 3.28Å; C356-L409 HydrophobicContact CB-CD1 3.45Å; C356-L409 VanDerWaalsContact CB-CD1 3.45Å; C356-L409 HydrophobicContact CB-CD2 3.73Å; C356-L409 HydrophobicContact CB-CG 4.25Å
357	Y	98.9	Very high	98.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128	177	-175.1	-102.3	0	0	0	110.3	L273 T327 A329 V341 V347 D359 I375 R381 F382 L383	L273-Y357 HydrophobicContact CD1-CE2 4.19Å; T327-Y357 HydrophobicContact CG2-CD2 4.35Å; T327-Y357 CarbonylContact O-C 3.14Å; T327-Y357 WeakPolarHBondContact O-CA 3.37Å; A329-Y357 HydrophobicContact CB-CE2 3.9Å; A329-Y357 WeakPolarHBondContact CB-OH 3.39Å; V341-Y357 HydrophobicContact CG2-CE1 4.08Å; V347-Y357 HydrophobicContact CB-CD2 4.49Å; V347-Y357 HydrophobicContact CB-CE2 4.18Å; V347-Y357 HydrophobicContact CG1-CD2 3.49Å; V347-Y357 VanDerWaalsContact CG1-CD2 3.49Å; V347-Y357 HydrophobicContact CG1-CE2 3.64Å; V347-Y357 HydrophobicContact CG1-CG 3.97Å; V347-Y357 HydrophobicContact CG2-CD2 4.18Å; V347-Y357 HydrophobicContact CG2-CE2 3.49Å; V347-Y357 VanDerWaalsContact CG2-CE2 3.49Å; Y357-D359 HydrophobicContact CD1-CB 4.47Å; Y357-D359 HydrophobicContact CE1-CB 3.81Å; Y357-D359 PolarHBondContact OH-OD2 3.14Å; Y357-I375 HydrophobicContact CD1-CD1 3.4Å; Y357-I375 HydrophobicContact CE1-CD1 4Å; Y357-I375 HydrophobicContact CG-CD1 3.91Å; Y357-R381 PolarHBondContact N-O 3.44Å; Y357-F382 AromaticContact CD1-CD2 3.8Å; Y357-F382 HydrophobicContact CD1-CD2 3.8Å; Y357-F382 AromaticContact CD1-CE2 3.67Å; Y357-F382 HydrophobicContact CD1-CE2 3.67Å; Y357-F382 HydrophobicContact CE1-CE2 4.03Å; Y357-F382 WeakPolarHBondContact O-CA 3.48Å; Y357-L383 PolarHBondContact O-N 3.43Å
358	V	98.9	Very high	98.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	108.9	-179.3	-174.6	0	0	0	0	108.9	I326 T327 F328 A329 M360 L383 A385 L409	I326-V358 HydrophobicContact CG2-CG2 3.85Å; T327-V358 PolarHBondContact O-N 3.22Å; F328-V358 CarbonylContact C-O 3.48Å; F328-V358 VanDerWaalsContact CA-O 3.24Å; F328-V358 WeakPolarHBondContact CA-O 3.47Å; F328-V358 HydrophobicContact CD1-CB 3.54Å; F328-V358 HydrophobicContact CD1-CG1 3.64Å; F328-V358 HydrophobicContact CD1-CG2 4.17Å; F328-V358 HydrophobicContact CE1-CB 3.78Å; F328-V358 HydrophobicContact CE1-CG1 3.73Å; F328-V358 HydrophobicContact CE1-CG2 3.94Å; F328-V358 HydrophobicContact CG-CB 4.28Å; F328-V358 HydrophobicContact CZ-CG2 4.46Å; A329-V358 PolarHBondContact N-O 2.92Å; V358-M360 HydrophobicContact CG1-CG 4.32Å; V358-L383 CarbonylContact C-O 3.46Å; V358-L383 VanDerWaalsContact CA-O 3.23Å; V358-L383 WeakPolarHBondContact CA-O 3.32Å; V358-L383 HydrophobicContact CG1-CB 4.37Å; V358-L383 HydrophobicContact CG1-CD2 4.15Å; V358-L383 HydrophobicContact CG1-CG 4.5Å; V358-L383 HydrophobicContact CG2-CB 4.24Å; V358-L383 HydrophobicContact CG2-CD2 4.38Å; V358-A385 HydrophobicContact CG1-CB 3.66Å; V358-L409 HydrophobicContact CG2-CD1 4.44Å; V358-L409 HydrophobicContact CG2-CD2 4.11Å; V358-L409 HydrophobicContact CG2-CG 4.26Å
359	D	98.9	Very high	98.2	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	114.7	178.4	-151.8	-41.6	0	0	0	110.7	Y357 S361 F382 L383 E384 A385	Y357-D359 HydrophobicContact CD1-CB 4.47Å; Y357-D359 HydrophobicContact CE1-CB 3.81Å; Y357-D359 PolarHBondContact OH-OD2 3.14Å; D359-S361 WeakPolarHBondContact OD1-CB 3.48Å; D359-S361 PolarHBondContact OD1-N 2.93Å; D359-S361 PolarHBondContact OD1-OG 3.39Å; D359-F382 HydrophobicContact CB-CE2 4.21Å; D359-F382 HydrophobicContact CB-CZ 4.11Å; D359-L383 PolarHBondContact N-O 3Å; D359-E384 CarbonylContact O-C 3.42Å; D359-E384 WeakPolarHBondContact O-CA 3.23Å; D359-A385 PolarHBondContact O-N 2.96Å
360	M	98.8	Very high	98.2	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	18%	0.184	C	C	.	.			trans	-99.1	7.5	179.6	-53.1	-172.9	70.8	0	0	112.5	I282 F328 A329 C330 V358 A385 V387 M420	I282-M360 HydrophobicContact CD1-CE 4.23Å; I282-M360 HydrophobicContact CD1-SD 4.37Å; F328-M360 HydrophobicContact CB-SD 4.47Å; F328-M360 HydrophobicContact CD1-CG 4.27Å; F328-M360 HydrophobicContact CD1-SD 3.76Å; F328-M360 HydrophobicContact CG-SD 4.48Å; A329-M360 WeakPolarHBondContact O-CA 3.41Å; A329-M360 VanDerWaalsContact O-CB 3.32Å; A329-M360 WeakPolarHBondContact O-CB 3.45Å; A329-M360 PolarHBondContact O-N 2.9Å; C330-M360 HydrophobicContact CB-CB 4.48Å; V358-M360 HydrophobicContact CG1-CG 4.32Å; M360-A385 WeakPolarHBondContact CA-O 3.43Å; M360-A385 WeakPolarHBondContact CB-O 3.42Å; M360-A385 HydrophobicContact CG-CB 4.29Å; M360-A385 WeakPolarHBondContact CG-O 3.25Å; M360-V387 HydrophobicContact CE-CG1 3.3Å; M360-M420 HydrophobicContact CE-SD 3.44Å; M360-M420 WeakPolarHBondContact CE-SD 3.34Å; M360-M420 HydrophobicContact SD-SD 3.93Å
361	S	98.5	Very high	98.2	Very high	6 Å²	6	31.5 Å²	31.5	4%	0.042	18%	0.182	C	C	.	.	S	Bend	trans	-76.4	136.3	-179.6	-45	0	0	0	0	110.6	V331 D359 V363	V331-S361 VanDerWaalsContact CG2-OG 3.3Å; V331-S361 WeakPolarHBondContact CG2-OG 3.34Å; V331-S361 PolarHBondContact N-OG 2.82Å; D359-S361 WeakPolarHBondContact OD1-CB 3.48Å; D359-S361 PolarHBondContact OD1-N 2.93Å; D359-S361 PolarHBondContact OD1-OG 3.39Å; S361-V363 PolarHBondContact O-N 2.84Å; S361-V363 VanDerWaalsContact O-N 3.14Å
362	T	98.5	Very high	98.2	Very high	19 Å²	19	31.3 Å²	31.3	12%	0.117	18%	0.182	C	C	.	.			trans	-76	104.7	172.3	-51.7	0	0	0	0	110.3	M437 L438 K505 D506	T362-M437 HydrophobicContact CG2-CB 4.49Å; T362-M437 HydrophobicContact CG2-CG 3.59Å; T362-L438 HydrophobicContact CG2-CD2 4.05Å; T362-K505 PolarHBondContact O-NZ 3.36Å; T362-D506 WeakPolarHBondContact CG2-OD1 3.39Å
363	V	98.5	Very high	98.4	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.012	19%	0.194	C	C	.	.			trans	-133	174.8	-179.7	-55.9	0	0	0	0	110.8	P334 A337 S361 T367 V368	P334-V363 HydrophobicContact CB-CB 4.31Å; P334-V363 HydrophobicContact CB-CG1 4.27Å; P334-V363 HydrophobicContact CG-CB 3.89Å; P334-V363 HydrophobicContact CG-CG1 4Å; A337-V363 HydrophobicContact CB-CG1 4.12Å; S361-V363 PolarHBondContact O-N 2.84Å; S361-V363 VanDerWaalsContact O-N 3.14Å; V363-T367 HydrophobicContact CB-CG2 4.09Å; V363-T367 HydrophobicContact CG1-CG2 4.47Å; V363-T367 HydrophobicContact CG2-CG2 3.95Å; V363-V368 HydrophobicContact CG2-CG1 3.38Å
364	D	98.4	Very high	98.4	Very high	35 Å²	35	29 Å²	29	19%	0.187	17%	0.169	C	C	.	.			trans	-76.7	157.6	173.5	51.3	-85.7	0	0	0	113.4	P334 D366 T367 V368 L509	P334-D364 VanDerWaalsContact CG-OD1 3.25Å; P334-D364 WeakPolarHBondContact CG-OD1 3.3Å; D364-D366 VanDerWaalsContact C-N 3.3Å; D364-D366 PolarHBondContact O-N 3.09Å; D364-T367 VanDerWaalsContact CG-OG1 3.27Å; D364-T367 WeakPolarHBondContact O-CB 3.47Å; D364-T367 PolarHBondContact O-N 3.44Å; D364-T367 VanDerWaalsContact O-N 3.16Å; D364-T367 PolarHBondContact OD1-OG1 3.04Å; D364-T367 VanDerWaalsContact OD2-CB 3.3Å; D364-T367 WeakPolarHBondContact OD2-CB 3.23Å; D364-T367 PolarHBondContact OD2-N 3.11Å; D364-T367 PolarHBondContact OD2-OG1 2.96Å; D364-V368 PolarHBondContact O-N 3.27Å; D364-L509 HydrophobicContact CB-CD2 4.23Å
365	A	98.2	Very high	98.6	Very high	14 Å²	14	26.5 Å²	26.5	12%	0.116	14%	0.143	C	C	.	.	H	α-helix	trans	-57.5	-40.9	-179	0	0	0	0	0	112.5	T367 V368 T369 K435	A365-T367 VanDerWaalsContact C-N 3.29Å; A365-T367 PolarHBondContact O-N 3.12Å; A365-V368 WeakPolarHBondContact O-CG2 3.41Å; A365-V368 PolarHBondContact O-N 3.24Å; A365-T369 WeakPolarHBondContact O-CB 3.43Å; A365-T369 PolarHBondContact O-N 2.85Å; A365-T369 PolarHBondContact O-OG1 3.44Å; A365-T369 VanDerWaalsContact O-OG1 3.05Å; A365-K435 HydrophobicContact CB-CG 4.22Å
366	D	98.2	Very high	98.6	Very high	130 Å²	130	29.9 Å²	29.9	70%	0.695	16%	0.164	S	C	*	.	H	α-helix	trans	-62	-40.5	179.2	-65.2	-12.5	0	0	0	111.2	D364 T369 E370	D364-D366 VanDerWaalsContact C-N 3.3Å; D364-D366 PolarHBondContact O-N 3.09Å; D366-T369 PolarHBondContact O-N 2.96Å; D366-E370 WeakPolarHBondContact O-CB 3.34Å; D366-E370 PolarHBondContact O-N 3.31Å
367	T	98.6	Very high	98.6	Very high	1 Å²	1	34 Å²	34	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-62.5	-50.2	175.4	-64.9	0	0	0	0	112.1	P334 K338 V363 D364 A365 T369 E370 L371	P334-T367 HydrophobicContact CB-CG2 4.18Å; K338-T367 HydrophobicContact CD-CG2 4.46Å; K338-T367 WeakPolarHBondContact CE-OG1 3.23Å; K338-T367 HydrophobicContact CG-CG2 4.06Å; V363-T367 HydrophobicContact CB-CG2 4.09Å; V363-T367 HydrophobicContact CG1-CG2 4.47Å; V363-T367 HydrophobicContact CG2-CG2 3.95Å; D364-T367 VanDerWaalsContact CG-OG1 3.27Å; D364-T367 WeakPolarHBondContact O-CB 3.47Å; D364-T367 PolarHBondContact O-N 3.44Å; D364-T367 VanDerWaalsContact O-N 3.16Å; D364-T367 PolarHBondContact OD1-OG1 3.04Å; D364-T367 VanDerWaalsContact OD2-CB 3.3Å; D364-T367 WeakPolarHBondContact OD2-CB 3.23Å; D364-T367 PolarHBondContact OD2-N 3.11Å; D364-T367 PolarHBondContact OD2-OG1 2.96Å; A365-T367 VanDerWaalsContact C-N 3.29Å; A365-T367 PolarHBondContact O-N 3.12Å; T367-T369 VanDerWaalsContact C-N 3.31Å; T367-T369 PolarHBondContact O-N 2.86Å; T367-E370 PolarHBondContact O-N 3.1Å; T367-L371 HydrophobicContact CG2-CD1 4.05Å; T367-L371 HydrophobicContact CG2-CG 4.38Å; T367-L371 VanDerWaalsContact O-CG 3.26Å; T367-L371 WeakPolarHBondContact O-CG 3.41Å; T367-L371 PolarHBondContact O-N 2.85Å
368	V	98.3	Very high	98.6	Very high	2 Å²	2	40 Å²	40	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-64.6	-36.3	178.7	-68.4	0	0	0	0	112.3	V363 D364 A365 L371 A372 F382 E384 V430 A434	V363-V368 HydrophobicContact CG2-CG1 3.38Å; D364-V368 PolarHBondContact O-N 3.27Å; A365-V368 WeakPolarHBondContact O-CG2 3.41Å; A365-V368 PolarHBondContact O-N 3.24Å; V368-L371 PolarHBondContact O-N 2.99Å; V368-A372 VanDerWaalsContact O-CB 3.23Å; V368-A372 WeakPolarHBondContact O-CB 3.37Å; V368-A372 PolarHBondContact O-N 3.29Å; V368-F382 HydrophobicContact CB-CE1 4.45Å; V368-E384 HydrophobicContact CG1-CB 4.12Å; V368-V430 HydrophobicContact CB-CG1 4.02Å; V368-V430 HydrophobicContact CG2-CG1 3.9Å; V368-A434 HydrophobicContact CG1-CB 4.48Å; V368-A434 HydrophobicContact CG2-CB 4.02Å
369	T	98.5	Very high	98.5	Very high	68 Å²	68	41.6 Å²	41.6	42%	0.417	23%	0.233	S	C	.	.	H	α-helix	trans	-64.9	-43.6	176.3	-62.4	0	0	0	0	111.5	A365 D366 T367 A372 Q373	A365-T369 WeakPolarHBondContact O-CB 3.43Å; A365-T369 PolarHBondContact O-N 2.85Å; A365-T369 PolarHBondContact O-OG1 3.44Å; A365-T369 VanDerWaalsContact O-OG1 3.05Å; D366-T369 PolarHBondContact O-N 2.96Å; T367-T369 VanDerWaalsContact C-N 3.31Å; T367-T369 PolarHBondContact O-N 2.86Å; T369-A372 PolarHBondContact O-N 3.39Å; T369-Q373 WeakPolarHBondContact O-CB 3.12Å; T369-Q373 PolarHBondContact O-N 3.4Å
370	E	98.6	Very high	98.5	Very high	71 Å²	71	41.9 Å²	41.9	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-59.4	-48.7	174.6	-177.9	-172.6	161.5	0	0	111.4	K338 D366 T367 Q373 V374	K338-E370 VanDerWaalsContact CE-OE2 3.28Å; K338-E370 WeakPolarHBondContact CE-OE2 3.36Å; K338-E370 IonicContact NZ-OE2 3.58Å; K338-E370 PolarHBondContact NZ-OE2 3.23Å; D366-E370 WeakPolarHBondContact O-CB 3.34Å; D366-E370 PolarHBondContact O-N 3.31Å; T367-E370 PolarHBondContact O-N 3.1Å; E370-Q373 PolarHBondContact O-N 3.12Å; E370-V374 PolarHBondContact O-N 3.27Å; E370-V374 VanDerWaalsContact O-N 3.17Å
371	L	98.8	Very high	98.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-43.3	-179.5	-66.7	-177.5	0	0	0	112	A337 K338 V341 T367 V368 Q373 V374 I375 F382	A337-L371 HydrophobicContact CB-CD1 4.15Å; K338-L371 HydrophobicContact CG-CD2 4.31Å; V341-L371 HydrophobicContact CB-CD2 3.74Å; V341-L371 HydrophobicContact CG1-CD2 3.9Å; V341-L371 HydrophobicContact CG2-CD1 4.32Å; V341-L371 HydrophobicContact CG2-CD2 3.95Å; T367-L371 HydrophobicContact CG2-CD1 4.05Å; T367-L371 HydrophobicContact CG2-CG 4.38Å; T367-L371 VanDerWaalsContact O-CG 3.26Å; T367-L371 WeakPolarHBondContact O-CG 3.41Å; T367-L371 PolarHBondContact O-N 2.85Å; V368-L371 PolarHBondContact O-N 2.99Å; L371-Q373 VanDerWaalsContact C-N 3.35Å; L371-Q373 PolarHBondContact O-N 3.43Å; L371-V374 WeakPolarHBondContact O-CG2 3.45Å; L371-V374 PolarHBondContact O-N 3.41Å; L371-I375 WeakPolarHBondContact O-CB 3.45Å; L371-I375 VanDerWaalsContact O-CG1 3.32Å; L371-I375 WeakPolarHBondContact O-CG1 3.33Å; L371-I375 PolarHBondContact O-N 3.2Å; L371-F382 HydrophobicContact CB-CE2 4.22Å; L371-F382 HydrophobicContact CB-CZ 4.4Å
372	A	98.8	Very high	98.5	Very high	10 Å²	10	44.9 Å²	44.9	8%	0.083	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-47.5	175.5	0	0	0	0	0	111.1	V368 T369 V374 I375 V376 F382 V430	V368-A372 VanDerWaalsContact O-CB 3.23Å; V368-A372 WeakPolarHBondContact O-CB 3.37Å; V368-A372 PolarHBondContact O-N 3.29Å; T369-A372 PolarHBondContact O-N 3.39Å; A372-V374 PolarHBondContact O-N 3.48Å; A372-I375 PolarHBondContact O-N 3.19Å; A372-V376 WeakPolarHBondContact O-CB 3.47Å; A372-V376 VanDerWaalsContact O-CG2 3.27Å; A372-V376 WeakPolarHBondContact O-CG2 3.39Å; A372-V376 PolarHBondContact O-N 3.34Å; A372-F382 HydrophobicContact CB-CB 4.16Å; A372-F382 HydrophobicContact CB-CD1 3.41Å; A372-F382 VanDerWaalsContact CB-CD1 3.41Å; A372-F382 HydrophobicContact CB-CD2 4.44Å; A372-F382 HydrophobicContact CB-CE1 3.85Å; A372-F382 HydrophobicContact CB-CG 3.75Å; A372-V430 HydrophobicContact CB-CG1 4.02Å; A372-V430 HydrophobicContact CB-CG2 4.27Å
373	Q	98.7	Very high	98.5	Very high	143 Å²	143	44 Å²	44	67%	0.668	24%	0.24	S	C	*	.	H	α-helix	trans	-58.7	-46.9	-178.8	-175.7	179.3	-2.6	0	0	111.9	T369 E370 L371 S377	T369-Q373 WeakPolarHBondContact O-CB 3.12Å; T369-Q373 PolarHBondContact O-N 3.4Å; E370-Q373 PolarHBondContact O-N 3.12Å; L371-Q373 VanDerWaalsContact C-N 3.35Å; L371-Q373 PolarHBondContact O-N 3.43Å; Q373-S377 WeakPolarHBondContact O-CB 3.15Å; Q373-S377 PolarHBondContact O-N 3.1Å
374	V	98.6	Very high	98.5	Very high	35 Å²	35	44 Å²	44	21%	0.212	24%	0.24	C	C	.	.	H	α-helix	trans	-69.7	-36.9	-179.1	-61.8	0	0	0	0	112.1	V341 L342 L348 E370 L371 A372 S377	V341-V374 HydrophobicContact CG1-CG2 4.35Å; L342-V374 HydrophobicContact CD2-CG2 4.03Å; L348-V374 HydrophobicContact CD1-CB 4.17Å; L348-V374 HydrophobicContact CD1-CG2 4.23Å; L348-V374 WeakPolarHBondContact CD1-O 3.39Å; L348-V374 HydrophobicContact CD2-CB 4.31Å; E370-V374 PolarHBondContact O-N 3.27Å; E370-V374 VanDerWaalsContact O-N 3.17Å; L371-V374 WeakPolarHBondContact O-CG2 3.45Å; L371-V374 PolarHBondContact O-N 3.41Å; A372-V374 PolarHBondContact O-N 3.48Å; V374-S377 PolarHBondContact O-N 3.45Å; V374-S377 PolarHBondContact O-OG 3.45Å
375	I	98.8	Very high	98.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-47.1	177.9	-73.4	167.8	0	0	0	110.6	V341 I351 Y357 L371 A372 S377 R378 G380 F382	V341-I375 HydrophobicContact CG1-CD1 4.34Å; V341-I375 HydrophobicContact CG1-CG1 4.4Å; I351-I375 HydrophobicContact CD1-CG2 4.2Å; I351-I375 HydrophobicContact CG1-CG2 4.47Å; Y357-I375 HydrophobicContact CD1-CD1 3.4Å; Y357-I375 HydrophobicContact CE1-CD1 4Å; Y357-I375 HydrophobicContact CG-CD1 3.91Å; L371-I375 WeakPolarHBondContact O-CB 3.45Å; L371-I375 VanDerWaalsContact O-CG1 3.32Å; L371-I375 WeakPolarHBondContact O-CG1 3.33Å; L371-I375 PolarHBondContact O-N 3.2Å; A372-I375 PolarHBondContact O-N 3.19Å; I375-S377 VanDerWaalsContact C-N 3.31Å; I375-S377 PolarHBondContact O-N 3.13Å; I375-R378 PolarHBondContact O-N 3.35Å; I375-R378 VanDerWaalsContact O-N 3.13Å; I375-G380 PolarHBondContact O-N 3.35Å; I375-G380 VanDerWaalsContact O-N 3.09Å; I375-F382 HydrophobicContact CD1-CD2 3.53Å; I375-F382 HydrophobicContact CD1-CE2 3.9Å; I375-F382 HydrophobicContact CG2-CB 4.31Å
376	V	98.5	Very high	98.6	Very high	83 Å²	83	41.8 Å²	41.8	50%	0.503	23%	0.226	S	C	.	.	H	α-helix	trans	-64.4	-36.8	177.8	173.5	0	0	0	0	111.2	A372 R378 G379 G380	A372-V376 WeakPolarHBondContact O-CB 3.47Å; A372-V376 VanDerWaalsContact O-CG2 3.27Å; A372-V376 WeakPolarHBondContact O-CG2 3.39Å; A372-V376 PolarHBondContact O-N 3.34Å; V376-R378 PolarHBondContact O-N 2.87Å; V376-G379 PolarHBondContact O-N 3.49Å; V376-G380 WeakPolarHBondContact CA-O 3.38Å
377	S	98.3	Very high	98.6	Very high	93 Å²	93	36.2 Å²	36.2	65%	0.65	20%	0.197	S	C	*	.	H	α-helix	trans	-59.8	-18.4	176.2	79.6	0	0	0	0	114	Q373 V374 I375	Q373-S377 WeakPolarHBondContact O-CB 3.15Å; Q373-S377 PolarHBondContact O-N 3.1Å; V374-S377 PolarHBondContact O-N 3.45Å; V374-S377 PolarHBondContact O-OG 3.45Å; I375-S377 VanDerWaalsContact C-N 3.31Å; I375-S377 PolarHBondContact O-N 3.13Å
378	R	98.3	Very high	98.5	Very high	126 Å²	126	37.4 Å²	37.4	48%	0.475	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	11.1	174.9	-63.8	-144.1	178.5	179.5	-2.8	114.1	L348 I351 I375 V376 G380	L348-R378 HydrophobicContact CD1-CG 3.95Å; L348-R378 PolarHBondContact O-NH1 2.88Å; I351-R378 HydrophobicContact CB-CB 4.33Å; I351-R378 HydrophobicContact CG2-CB 3.68Å; I375-R378 PolarHBondContact O-N 3.35Å; I375-R378 VanDerWaalsContact O-N 3.13Å; V376-R378 PolarHBondContact O-N 2.87Å; R378-G380 VanDerWaalsContact C-N 3.33Å
379	G	97.9	Very high	98.3	Very high	33 Å²	33	38 Å²	38	34%	0.34	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	10.2	-178.8	0	0	0	0	0	114.3	P353 G354 V376	P353-G379 VanDerWaalsContact CA-O 3.29Å; P353-G379 WeakPolarHBondContact CA-O 3.34Å; G354-G379 PolarHBondContact N-O 3.06Å; G354-G379 VanDerWaalsContact N-O 3.11Å; V376-G379 PolarHBondContact O-N 3.49Å
380	G	98.6	Very high	98.1	Very high	6 Å²	6	36.6 Å²	36.6	6%	0.062	20%	0.202	C	C	.	.			trans	-77.5	163.2	173.1	0	0	0	0	0	112.5	K355 I375 V376 R378	K355-G380 CarbonylContact O-C 3.52Å; K355-G380 WeakPolarHBondContact O-CA 3.46Å; I375-G380 PolarHBondContact O-N 3.35Å; I375-G380 VanDerWaalsContact O-N 3.09Å; V376-G380 WeakPolarHBondContact CA-O 3.38Å; R378-G380 VanDerWaalsContact C-N 3.33Å
381	R	98.8	Very high	98	Very high	66 Å²	66	35.8 Å²	35.8	25%	0.249	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	139.7	170.9	-64.3	168.2	65.2	-158.2	10.7	109	K355 C356 Y357 D406 L409 D412	K355-R381 PolarHBondContact O-N 3.22Å; C356-R381 WeakPolarHBondContact CA-O 3.28Å; Y357-R381 PolarHBondContact N-O 3.44Å; R381-D406 WeakPolarHBondContact CB-OD2 3.38Å; R381-D406 WeakPolarHBondContact CG-OD2 3.28Å; R381-D406 IonicContact CZ-OD1 3.57Å; R381-D406 IonicContact CZ-OD2 2.85Å; R381-D406 IonicContact NE-OD1 3.58Å; R381-D406 IonicContact NE-OD2 2.85Å; R381-D406 PolarHBondContact NE-OD2 3.14Å; R381-D406 IonicContact NH2-OD1 3.68Å; R381-D406 PolarHBondContact NH2-OD1 2.95Å; R381-D406 IonicContact NH2-OD2 3.62Å; R381-L409 HydrophobicContact CB-CD2 4.11Å; R381-D412 IonicContact CZ-OD2 2.93Å; R381-D412 IonicContact NH1-OD2 3.45Å; R381-D412 PolarHBondContact NH1-OD2 3.14Å; R381-D412 IonicContact NH2-OD2 3.45Å
382	F	98.9	Very high	97.8	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.026	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.7	-174.9	-175.3	-91.5	0	0	0	111.6	Y357 D359 V368 L371 A372 I375 E384 D406 V430	Y357-F382 AromaticContact CD1-CD2 3.8Å; Y357-F382 HydrophobicContact CD1-CD2 3.8Å; Y357-F382 AromaticContact CD1-CE2 3.67Å; Y357-F382 HydrophobicContact CD1-CE2 3.67Å; Y357-F382 HydrophobicContact CE1-CE2 4.03Å; Y357-F382 WeakPolarHBondContact O-CA 3.48Å; D359-F382 HydrophobicContact CB-CE2 4.21Å; D359-F382 HydrophobicContact CB-CZ 4.11Å; V368-F382 HydrophobicContact CB-CE1 4.45Å; L371-F382 HydrophobicContact CB-CE2 4.22Å; L371-F382 HydrophobicContact CB-CZ 4.4Å; A372-F382 HydrophobicContact CB-CB 4.16Å; A372-F382 HydrophobicContact CB-CD1 3.41Å; A372-F382 VanDerWaalsContact CB-CD1 3.41Å; A372-F382 HydrophobicContact CB-CD2 4.44Å; A372-F382 HydrophobicContact CB-CE1 3.85Å; A372-F382 HydrophobicContact CB-CG 3.75Å; I375-F382 HydrophobicContact CD1-CD2 3.53Å; I375-F382 HydrophobicContact CD1-CE2 3.9Å; I375-F382 HydrophobicContact CG2-CB 4.31Å; F382-E384 HydrophobicContact CE1-CB 4.14Å; F382-D406 WeakPolarHBondContact O-CB 3.42Å; F382-D406 PolarHBondContact O-N 3.08Å; F382-V430 HydrophobicContact CD1-CG1 4.43Å; F382-V430 HydrophobicContact CD1-CG2 4.11Å; F382-V430 HydrophobicContact CE1-CG1 4.11Å
383	L	98.9	Very high	97.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.2	170.6	-174.6	75.5	0	0	0	107.9	Y357 V358 D359 A403 A404 L409 Y410 F417 F426	Y357-L383 PolarHBondContact O-N 3.43Å; V358-L383 CarbonylContact C-O 3.46Å; V358-L383 VanDerWaalsContact CA-O 3.23Å; V358-L383 WeakPolarHBondContact CA-O 3.32Å; V358-L383 HydrophobicContact CG1-CB 4.37Å; V358-L383 HydrophobicContact CG1-CD2 4.15Å; V358-L383 HydrophobicContact CG1-CG 4.5Å; V358-L383 HydrophobicContact CG2-CB 4.24Å; V358-L383 HydrophobicContact CG2-CD2 4.38Å; D359-L383 PolarHBondContact N-O 3Å; L383-A403 HydrophobicContact CD1-CB 4.36Å; L383-A403 HydrophobicContact CD2-CB 4.43Å; L383-A403 HydrophobicContact CG-CB 4.49Å; L383-A404 WeakPolarHBondContact CD1-O 3.16Å; L383-L409 HydrophobicContact CB-CD2 3.85Å; L383-L409 HydrophobicContact CB-CG 4.14Å; L383-L409 HydrophobicContact CD2-CG 4.48Å; L383-Y410 HydrophobicContact CD2-CD2 4.37Å; L383-F417 HydrophobicContact CD2-CE2 4.14Å; L383-F417 HydrophobicContact CD2-CZ 3.81Å; L383-F426 HydrophobicContact CD1-CE2 4.14Å
384	E	98.8	Very high	97.7	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.009	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	137.6	160.9	52.3	164.9	173.8	0	0	108.4	D359 V368 F382 A403 A404 G431 N432 A433 A434	D359-E384 CarbonylContact O-C 3.42Å; D359-E384 WeakPolarHBondContact O-CA 3.23Å; V368-E384 HydrophobicContact CG1-CB 4.12Å; F382-E384 HydrophobicContact CE1-CB 4.14Å; E384-A403 CarbonylContact O-C 3.16Å; E384-A403 WeakPolarHBondContact O-CA 3.15Å; E384-A404 HydrophobicContact CG-CB 3.96Å; E384-A404 WeakPolarHBondContact CG-O 3.3Å; E384-A404 PolarHBondContact N-O 3.26Å; E384-A404 PolarHBondContact O-N 3.34Å; E384-A404 WeakPolarHBondContact OE1-CB 3.45Å; E384-G431 VanDerWaalsContact OE1-C 3.29Å; E384-G431 VanDerWaalsContact OE1-CA 3.28Å; E384-G431 WeakPolarHBondContact OE1-CA 3.35Å; E384-G431 PolarHBondContact OE1-N 2.93Å; E384-N432 PolarHBondContact OE1-N 3.34Å; E384-A433 HydrophobicContact CG-CB 3.99Å; E384-A433 PolarHBondContact OE1-N 3.09Å; E384-A434 VanDerWaalsContact OE2-CB 3.25Å; E384-A434 WeakPolarHBondContact OE2-CB 3.42Å; E384-A434 PolarHBondContact OE2-N 3.46Å
385	A	98.7	Very high	97.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.			trans	-144.2	54.1	179.2	0	0	0	0	0	112.1	V358 D359 M360 I401 L402 A403 F417	V358-A385 HydrophobicContact CG1-CB 3.66Å; D359-A385 PolarHBondContact O-N 2.96Å; M360-A385 WeakPolarHBondContact CA-O 3.43Å; M360-A385 WeakPolarHBondContact CB-O 3.42Å; M360-A385 HydrophobicContact CG-CB 4.29Å; M360-A385 WeakPolarHBondContact CG-O 3.25Å; A385-I401 HydrophobicContact CB-CG2 4.08Å; A385-L402 CarbonylContact C-O 3.58Å; A385-L402 VanDerWaalsContact CA-O 3.24Å; A385-L402 WeakPolarHBondContact CA-O 3.31Å; A385-A403 HydrophobicContact CB-CB 4.24Å; A385-F417 HydrophobicContact CB-CE1 4.14Å; A385-F417 HydrophobicContact CB-CZ 4.01Å
386	P	98.6	Very high	97.4	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.013	23%	0.226	C	C	.	.			trans	-56.3	149.3	175.4	26.2	-37.2	0	0	0	112	L402 A433 M437	P386-L402 WeakPolarHBondContact CD-O 3.27Å; P386-L402 HydrophobicContact CG-CB 4.47Å; P386-L402 PolarHBondContact O-N 3.14Å; P386-A433 HydrophobicContact CG-CB 3.97Å; P386-M437 HydrophobicContact CB-CB 4.06Å; P386-M437 HydrophobicContact CB-CE 3.95Å; P386-M437 HydrophobicContact CB-CG 3.95Å; P386-M437 HydrophobicContact CG-CB 4.01Å; P386-M437 HydrophobicContact CG-CE 4.43Å; P386-M437 HydrophobicContact CG-CG 4.46Å
387	V	98.1	Very high	97.3	Very high	13 Å²	13	37.7 Å²	37.7	8%	0.079	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138.4	-175.9	-72.1	0	0	0	0	113	M360 L399 V400 I401 M437	M360-V387 HydrophobicContact CE-CG1 3.3Å; V387-L399 HydrophobicContact CB-CB 4.33Å; V387-L399 HydrophobicContact CB-CD1 4.14Å; V387-L399 HydrophobicContact CG1-CB 4.32Å; V387-L399 HydrophobicContact CG1-CD1 4.13Å; V387-L399 HydrophobicContact CG2-CD1 4.17Å; V387-V400 WeakPolarHBondContact CA-O 3.04Å; V387-I401 HydrophobicContact CG1-CB 4.45Å; V387-I401 HydrophobicContact CG1-CG1 3.86Å; V387-M437 WeakPolarHBondContact O-CE 3.43Å
388	S	97.2	Very high	97.2	Very high	27 Å²	27	36.2 Å²	36.2	19%	0.189	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.7	170.3	170.3	0	0	0	0	108.8	V400 M437	S388-V400 PolarHBondContact N-O 3.46Å; S388-V400 PolarHBondContact O-N 3.06Å; S388-M437 VanDerWaalsContact N-CE 3.33Å
389	G	94.7	Very high	97.1	Very high	15 Å²	15	30.2 Å²	30.2	16%	0.155	17%	0.167	C	C	.	.			trans	154.1	-165.1	-175.9	0	0	0	0	0	111.3	M278	M278-G389 WeakPolarHBondContact CE-O 3.22Å
390	N	94.6	Very high	97.1	Very high	37 Å²	37	30.8 Å²	30.8	20%	0.198	16%	0.164	C	C	.	.			trans	-138.7	-177.9	-179.8	62.7	14	0	0	0	109.9	Q392 L393 S394 D497	N390-Q392 VanDerWaalsContact C-N 3.29Å; N390-Q392 PolarHBondContact O-N 3.01Å; N390-Q392 PolarHBondContact OD1-N 3.26Å; N390-L393 PolarHBondContact O-N 2.77Å; N390-L393 WeakPolarHBondContact OD1-CB 3.4Å; N390-L393 VanDerWaalsContact OD1-CG 3.23Å; N390-L393 WeakPolarHBondContact OD1-CG 3.09Å; N390-L393 PolarHBondContact OD1-N 3.08Å; N390-S394 WeakPolarHBondContact O-CB 3.43Å; N390-S394 PolarHBondContact O-N 3.33Å; N390-D497 VanDerWaalsContact CB-CG 3.46Å; N390-D497 WeakPolarHBondContact CB-OD1 3.3Å; N390-D497 VanDerWaalsContact CB-OD2 3.25Å; N390-D497 WeakPolarHBondContact CB-OD2 3.39Å; N390-D497 VanDerWaalsContact CG-OD1 3.31Å; N390-D497 PolarHBondContact ND2-OD2 2.99Å
391	Q	96	Very high	97.1	Very high	55 Å²	55	30.5 Å²	30.5	26%	0.257	16%	0.161	S	C	.	.	H	α-helix	trans	-55.9	-45.7	-180	-171.7	179.7	32	0	0	111.6	L277 S394 N395 P496 D497	L277-Q391 HydrophobicContact CD1-CB 4.08Å; L277-Q391 VanDerWaalsContact CD1-CD 3.41Å; L277-Q391 HydrophobicContact CD1-CG 3.93Å; L277-Q391 HydrophobicContact CD2-CB 4.31Å; L277-Q391 HydrophobicContact CG-CB 3.88Å; L277-Q391 HydrophobicContact CG-CG 4.05Å; Q391-S394 WeakPolarHBondContact O-CB 3.32Å; Q391-S394 PolarHBondContact O-N 3.07Å; Q391-N395 VanDerWaalsContact O-CG 3.23Å; Q391-N395 PolarHBondContact O-N 3.3Å; Q391-N395 PolarHBondContact O-ND2 3.19Å; Q391-P496 PolarHBondContact OE1-O 2.94Å; Q391-D497 WeakPolarHBondContact CB-OD1 3.41Å; Q391-D497 PolarHBondContact N-O 2.9Å; Q391-D497 PolarHBondContact N-OD1 2.92Å
392	Q	95.3	Very high	97.1	Very high	100 Å²	100	28 Å²	28	47%	0.467	15%	0.152	S	C	.	.	H	α-helix	trans	-61	-51.1	-178.7	-173.3	57.4	48.3	0	0	111.6	N390 S394 N395 D396 D497	N390-Q392 VanDerWaalsContact C-N 3.29Å; N390-Q392 PolarHBondContact O-N 3.01Å; N390-Q392 PolarHBondContact OD1-N 3.26Å; Q392-S394 PolarHBondContact O-N 3.16Å; Q392-N395 WeakPolarHBondContact O-CB 3.2Å; Q392-N395 PolarHBondContact O-N 3.11Å; Q392-D396 VanDerWaalsContact NE2-CG 3.26Å; Q392-D396 PolarHBondContact NE2-OD1 2.86Å; Q392-D396 PolarHBondContact NE2-OD2 3.31Å; Q392-D396 PolarHBondContact O-N 2.67Å; Q392-D497 PolarHBondContact N-OD1 3.1Å; Q392-D497 VanDerWaalsContact N-OD1 3.11Å
393	L	95.8	Very high	97.1	Very high	65 Å²	65	27.7 Å²	27.7	34%	0.34	15%	0.151	S	C	.	.	H	α-helix	trans	-62.7	-31.7	177.6	-66.3	172.5	0	0	0	112.4	N390 D396 G397 M398 L399	N390-L393 PolarHBondContact O-N 2.77Å; N390-L393 WeakPolarHBondContact OD1-CB 3.4Å; N390-L393 VanDerWaalsContact OD1-CG 3.23Å; N390-L393 WeakPolarHBondContact OD1-CG 3.09Å; N390-L393 PolarHBondContact OD1-N 3.08Å; L393-D396 PolarHBondContact O-N 2.9Å; L393-G397 PolarHBondContact O-N 3.34Å; L393-G397 VanDerWaalsContact O-N 3.14Å; L393-M398 HydrophobicContact CB-CB 4.4Å; L393-M398 HydrophobicContact CD2-CB 3.77Å; L393-M398 PolarHBondContact O-N 3.25Å; L393-L399 HydrophobicContact CB-CD2 4.2Å
394	S	97.6	Very high	97.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.4	-38.9	173.2	-175.2	0	0	0	0	112.5	M278 G281 I282 N285 N390 Q391 Q392 D396	M278-S394 PolarHBondContact O-OG 3.42Å; G281-S394 CarbonylContact C-O 3.56Å; G281-S394 VanDerWaalsContact C-O 3.27Å; G281-S394 WeakPolarHBondContact CA-O 3.37Å; I282-S394 PolarHBondContact N-OG 2.82Å; N285-S394 PolarHBondContact ND2-O 3.07Å; N390-S394 WeakPolarHBondContact O-CB 3.43Å; N390-S394 PolarHBondContact O-N 3.33Å; Q391-S394 WeakPolarHBondContact O-CB 3.32Å; Q391-S394 PolarHBondContact O-N 3.07Å; Q392-S394 PolarHBondContact O-N 3.16Å; S394-D396 VanDerWaalsContact C-N 3.31Å
395	N	96.5	Very high	97.1	Very high	55 Å²	55	28.4 Å²	28.4	29%	0.294	16%	0.159	S	C	.	.	H	α-helix	trans	-68.9	-35.2	176.4	-65.7	-24	0	0	0	111.2	G281 N285 Q391 Q392 G397	G281-N395 WeakPolarHBondContact CA-OD1 3.42Å; N285-N395 PolarHBondContact ND2-O 3.33Å; N285-N395 PolarHBondContact OD1-O 2.73Å; Q391-N395 VanDerWaalsContact O-CG 3.23Å; Q391-N395 PolarHBondContact O-N 3.3Å; Q391-N395 PolarHBondContact O-ND2 3.19Å; Q392-N395 WeakPolarHBondContact O-CB 3.2Å; Q392-N395 PolarHBondContact O-N 3.11Å; N395-G397 VanDerWaalsContact C-N 3.33Å
396	D	94.9	Very high	97.1	Very high	82 Å²	82	30.7 Å²	30.7	44%	0.439	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-6.2	-177	-61.1	-22.4	0	0	0	113.6	Q392 L393 S394 M398	Q392-D396 VanDerWaalsContact NE2-CG 3.26Å; Q392-D396 PolarHBondContact NE2-OD1 2.86Å; Q392-D396 PolarHBondContact NE2-OD2 3.31Å; Q392-D396 PolarHBondContact O-N 2.67Å; L393-D396 PolarHBondContact O-N 2.9Å; S394-D396 VanDerWaalsContact C-N 3.31Å; D396-M398 VanDerWaalsContact C-N 3.33Å; D396-M398 HydrophobicContact CB-CB 4.42Å; D396-M398 HydrophobicContact CB-CG 3.95Å
397	G	96.2	Very high	97	Very high	8 Å²	8	34.2 Å²	34.2	8%	0.082	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	29.6	-177.1	0	0	0	0	0	112.9	N285 L393 N395 M420 G421 K422	N285-G397 PolarHBondContact ND2-N 3.45Å; L393-G397 PolarHBondContact O-N 3.34Å; L393-G397 VanDerWaalsContact O-N 3.14Å; N395-G397 VanDerWaalsContact C-N 3.33Å; G397-M420 CarbonylContact C-O 3.56Å; G397-M420 VanDerWaalsContact C-O 3.3Å; G397-M420 WeakPolarHBondContact CA-O 3.5Å; G397-M420 CarbonylContact O-C 3.49Å; G397-G421 CarbonylContact O-C 3.51Å; G397-G421 WeakPolarHBondContact O-CA 3.47Å; G397-G421 PolarHBondContact O-N 2.95Å; G397-K422 PolarHBondContact O-N 3.31Å
398	M	96.4	Very high	97	Very high	63 Å²	63	34.9 Å²	34.9	31%	0.31	19%	0.193	S	C	.	.			trans	-112.8	20.7	-171	-66.9	-66.8	154.4	0	0	113.3	A258 L393 D396 K422	A258-M398 HydrophobicContact CB-CE 3.74Å; L393-M398 HydrophobicContact CB-CB 4.4Å; L393-M398 HydrophobicContact CD2-CB 3.77Å; L393-M398 PolarHBondContact O-N 3.25Å; D396-M398 VanDerWaalsContact C-N 3.33Å; D396-M398 HydrophobicContact CB-CB 4.42Å; D396-M398 HydrophobicContact CB-CG 3.95Å; M398-K422 HydrophobicContact CB-CB 4.48Å; M398-K422 HydrophobicContact SD-CB 4.06Å; M398-K422 HydrophobicContact SD-CG 4.41Å
399	L	97.4	Very high	97	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	153.3	178.7	-62.1	173.2	0	0	0	112.3	I282 V387 L393 M420 G421 K422 T423	I282-L399 HydrophobicContact CD1-CD1 4.04Å; I282-L399 HydrophobicContact CG1-CD1 3.81Å; V387-L399 HydrophobicContact CB-CB 4.33Å; V387-L399 HydrophobicContact CB-CD1 4.14Å; V387-L399 HydrophobicContact CG1-CB 4.32Å; V387-L399 HydrophobicContact CG1-CD1 4.13Å; V387-L399 HydrophobicContact CG2-CD1 4.17Å; L393-L399 HydrophobicContact CB-CD2 4.2Å; L399-M420 WeakPolarHBondContact CB-O 3.3Å; L399-M420 PolarHBondContact N-O 2.93Å; L399-G421 CarbonylContact O-C 3.51Å; L399-G421 WeakPolarHBondContact O-CA 3.45Å; L399-K422 PolarHBondContact O-N 3.16Å; L399-T423 PolarHBondContact O-N 2.98Å
400	V	97.9	Very high	97.2	Very high	44 Å²	44	32.9 Å²	32.9	27%	0.267	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.3	166	177.1	0	0	0	0	108	V387 S388 L402 T423 F425	V387-V400 WeakPolarHBondContact CA-O 3.04Å; S388-V400 PolarHBondContact N-O 3.46Å; S388-V400 PolarHBondContact O-N 3.06Å; V400-L402 HydrophobicContact CG1-CD2 4.08Å; V400-T423 HydrophobicContact CB-CG2 4.31Å; V400-T423 HydrophobicContact CG1-CG2 3.94Å; V400-T423 HydrophobicContact CG2-CG2 3.96Å; V400-F425 HydrophobicContact CG1-CD2 4.11Å; V400-F425 HydrophobicContact CG1-CE2 3.95Å
401	I	98.7	Very high	97.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126	-176.7	-57.8	152.3	0	0	0	108.9	A385 V387 F417 M420 T423 S424 F425	A385-I401 HydrophobicContact CB-CG2 4.08Å; V387-I401 HydrophobicContact CG1-CB 4.45Å; V387-I401 HydrophobicContact CG1-CG1 3.86Å; I401-F417 HydrophobicContact CD1-CB 3.62Å; I401-F417 HydrophobicContact CD1-CD1 3.71Å; I401-F417 HydrophobicContact CD1-CG 3.87Å; I401-F417 WeakPolarHBondContact CD1-O 3.36Å; I401-F417 HydrophobicContact CG2-CD1 4.15Å; I401-F417 HydrophobicContact CG2-CE1 4.06Å; I401-F417 HydrophobicContact CG2-CZ 4.39Å; I401-M420 HydrophobicContact CD1-CG 3.9Å; I401-M420 HydrophobicContact CD1-SD 4.41Å; I401-T423 PolarHBondContact N-O 3.44Å; I401-S424 WeakPolarHBondContact O-CA 3.39Å; I401-F425 PolarHBondContact O-N 3.4Å
402	L	98.6	Very high	97.3	Very high	13 Å²	13	35.6 Å²	35.6	7%	0.068	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	109.9	174	-54.3	-171.4	0	0	0	107.6	A385 P386 V400 F425 L427 A433 M436 M437	A385-L402 CarbonylContact C-O 3.58Å; A385-L402 VanDerWaalsContact CA-O 3.24Å; A385-L402 WeakPolarHBondContact CA-O 3.31Å; P386-L402 WeakPolarHBondContact CD-O 3.27Å; P386-L402 HydrophobicContact CG-CB 4.47Å; P386-L402 PolarHBondContact O-N 3.14Å; V400-L402 HydrophobicContact CG1-CD2 4.08Å; L402-F425 HydrophobicContact CD2-CB 4.27Å; L402-F425 HydrophobicContact CD2-CD2 3.97Å; L402-F425 HydrophobicContact CD2-CG 4.45Å; L402-L427 HydrophobicContact CB-CD1 3.92Å; L402-A433 HydrophobicContact CB-CB 4.27Å; L402-A433 VanDerWaalsContact O-CB 3.31Å; L402-A433 WeakPolarHBondContact O-CB 3.32Å; L402-M436 HydrophobicContact CD1-CB 4.08Å; L402-M436 HydrophobicContact CD1-CG 3.78Å; L402-M437 HydrophobicContact CB-CE 4.48Å; L402-M437 HydrophobicContact CD1-CB 4.39Å; L402-M437 HydrophobicContact CD1-CE 3.69Å; L402-M437 HydrophobicContact CG-CE 3.96Å
403	A	98.7	Very high	97.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	145.8	-173.7	0	0	0	0	0	112.9	L383 E384 A385 Y410 F425 F426 L427	L383-A403 HydrophobicContact CD1-CB 4.36Å; L383-A403 HydrophobicContact CD2-CB 4.43Å; L383-A403 HydrophobicContact CG-CB 4.49Å; E384-A403 CarbonylContact O-C 3.16Å; E384-A403 WeakPolarHBondContact O-CA 3.15Å; A385-A403 HydrophobicContact CB-CB 4.24Å; A403-Y410 HydrophobicContact CB-CD2 3.46Å; A403-Y410 VanDerWaalsContact CB-CD2 3.46Å; A403-Y410 HydrophobicContact CB-CE2 3.57Å; A403-F425 PolarHBondContact N-O 2.92Å; A403-F426 CarbonylContact O-C 3.51Å; A403-F426 WeakPolarHBondContact O-CA 3.39Å; A403-L427 PolarHBondContact O-N 2.96Å
404	A	98.7	Very high	97.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	149.4	173.6	0	0	0	0	0	111.6	L383 E384 L427 G428 E429 N432 A433	L383-A404 WeakPolarHBondContact CD1-O 3.16Å; E384-A404 HydrophobicContact CG-CB 3.96Å; E384-A404 WeakPolarHBondContact CG-O 3.3Å; E384-A404 PolarHBondContact N-O 3.26Å; E384-A404 PolarHBondContact O-N 3.34Å; E384-A404 WeakPolarHBondContact OE1-CB 3.45Å; A404-L427 HydrophobicContact CB-CB 4.36Å; A404-G428 CarbonylContact C-O 3.49Å; A404-G428 WeakPolarHBondContact CA-O 3.43Å; A404-G428 WeakPolarHBondContact CB-O 3.41Å; A404-E429 WeakPolarHBondContact CB-O 3.17Å; A404-N432 HydrophobicContact CB-CB 4.33Å; A404-A433 HydrophobicContact CB-CB 3.81Å
405	G	98.5	Very high	97.3	Very high	17 Å²	17	30 Å²	30	18%	0.175	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	121.5	-129.3	-176.5	0	0	0	0	0	113.4	R407 F426 G428 V430	G405-R407 PolarHBondContact O-N 2.82Å; G405-R407 VanDerWaalsContact O-N 3.11Å; G405-F426 WeakPolarHBondContact O-CZ 3.4Å; G405-G428 PolarHBondContact N-O 3.05Å; G405-V430 VanDerWaalsContact CA-CG2 3.49Å
406	D	98.4	Very high	97.4	Very high	48 Å²	48	27.4 Å²	27.4	26%	0.257	15%	0.153	S	C	.	.			trans	-66.8	110	-177.2	-175.6	-46.6	0	0	0	111.7	R381 F382 G408 L409 Y410	R381-D406 WeakPolarHBondContact CB-OD2 3.38Å; R381-D406 WeakPolarHBondContact CG-OD2 3.28Å; R381-D406 IonicContact CZ-OD1 3.57Å; R381-D406 IonicContact CZ-OD2 2.85Å; R381-D406 IonicContact NE-OD1 3.58Å; R381-D406 IonicContact NE-OD2 2.85Å; R381-D406 PolarHBondContact NE-OD2 3.14Å; R381-D406 IonicContact NH2-OD1 3.68Å; R381-D406 PolarHBondContact NH2-OD1 2.95Å; R381-D406 IonicContact NH2-OD2 3.62Å; F382-D406 WeakPolarHBondContact O-CB 3.42Å; F382-D406 PolarHBondContact O-N 3.08Å; D406-G408 PolarHBondContact O-N 3.04Å; D406-G408 WeakPolarHBondContact OD1-CA 3.2Å; D406-G408 PolarHBondContact OD1-N 3.27Å; D406-L409 HydrophobicContact CB-CB 3.86Å; D406-L409 PolarHBondContact O-N 3Å; D406-L409 VanDerWaalsContact O-N 3.15Å; D406-L409 PolarHBondContact OD1-N 2.9Å; D406-Y410 PolarHBondContact O-N 3.32Å
407	R	97.3	Very high	97.5	Very high	77 Å²	77	23.5 Å²	23.5	29%	0.291	13%	0.133	S	C	.	.	H	α-helix	trans	-63	-39.2	-178.4	179.1	59.8	-171.5	-156.8	-0.9	113.5	T249 G405 L409 Y410 E411 F426	T249-R407 PolarHBondContact OG1-NH1 2.86Å; G405-R407 PolarHBondContact O-N 2.82Å; G405-R407 VanDerWaalsContact O-N 3.11Å; R407-L409 PolarHBondContact O-N 2.83Å; R407-Y410 WeakPolarHBondContact O-CB 3.45Å; R407-Y410 PolarHBondContact O-N 2.97Å; R407-E411 IonicContact CZ-OE1 3.59Å; R407-E411 IonicContact NE-OE1 2.84Å; R407-E411 PolarHBondContact NE-OE1 2.88Å; R407-E411 IonicContact NH2-OE1 3.47Å; R407-E411 PolarHBondContact NH2-OE1 3.41Å; R407-E411 PolarHBondContact O-N 2.78Å; R407-E411 VanDerWaalsContact O-N 3.14Å; R407-F426 HydrophobicContact CB-CE1 4.27Å; R407-F426 HydrophobicContact CB-CE2 4.37Å; R407-F426 HydrophobicContact CB-CZ 3.8Å; R407-F426 HydrophobicContact CG-CE1 4.47Å; R407-F426 HydrophobicContact CG-CZ 4.37Å; R407-F426 VanDerWaalsContact NH1-CD1 3.27Å
408	G	97.4	Very high	97.4	Very high	26 Å²	26	25.5 Å²	25.5	27%	0.268	14%	0.14	S	C	.	.	H	α-helix	trans	-65.6	-32.1	177.2	0	0	0	0	0	111.4	D406 E411 D412	D406-G408 PolarHBondContact O-N 3.04Å; D406-G408 WeakPolarHBondContact OD1-CA 3.2Å; D406-G408 PolarHBondContact OD1-N 3.27Å; G408-E411 PolarHBondContact O-N 3.31Å; G408-D412 WeakPolarHBondContact O-CB 3.44Å; G408-D412 VanDerWaalsContact O-CG 3.27Å; G408-D412 PolarHBondContact O-N 3.26Å
409	L	98.4	Very high	97.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-75.3	-36.6	-179.1	177	52.6	0	0	0	109.8	I326 C356 V358 R381 L383 D406 R407 E411 D412 C413	I326-L409 HydrophobicContact CD1-CD1 4.08Å; I326-L409 HydrophobicContact CG1-CD1 4.08Å; I326-L409 HydrophobicContact CG2-CD1 4.32Å; C356-L409 HydrophobicContact CB-CD1 3.45Å; C356-L409 VanDerWaalsContact CB-CD1 3.45Å; C356-L409 HydrophobicContact CB-CD2 3.73Å; C356-L409 HydrophobicContact CB-CG 4.25Å; V358-L409 HydrophobicContact CG2-CD1 4.44Å; V358-L409 HydrophobicContact CG2-CD2 4.11Å; V358-L409 HydrophobicContact CG2-CG 4.26Å; R381-L409 HydrophobicContact CB-CD2 4.11Å; L383-L409 HydrophobicContact CB-CD2 3.85Å; L383-L409 HydrophobicContact CB-CG 4.14Å; L383-L409 HydrophobicContact CD2-CG 4.48Å; D406-L409 HydrophobicContact CB-CB 3.86Å; D406-L409 PolarHBondContact O-N 3Å; D406-L409 VanDerWaalsContact O-N 3.15Å; D406-L409 PolarHBondContact OD1-N 2.9Å; R407-L409 PolarHBondContact O-N 2.83Å; L409-E411 VanDerWaalsContact C-N 3.28Å; L409-E411 PolarHBondContact O-N 2.62Å; L409-D412 HydrophobicContact CD1-CB 4.33Å; L409-D412 PolarHBondContact O-N 2.93Å; L409-C413 WeakPolarHBondContact O-CB 3.45Å; L409-C413 PolarHBondContact O-N 3.44Å; L409-C413 PolarHBondContact O-SG 3.1Å
410	Y	98.1	Very high	97.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-55.2	-45.3	169.5	175.6	-103.1	0	0	0	111.9	I251 L383 A403 D406 R407 C413 F417 S424 F426	I251-Y410 HydrophobicContact CD1-CD1 4.1Å; I251-Y410 HydrophobicContact CD1-CE1 3.4Å; I251-Y410 HydrophobicContact CG1-CE1 3.76Å; L383-Y410 HydrophobicContact CD2-CD2 4.37Å; A403-Y410 HydrophobicContact CB-CD2 3.46Å; A403-Y410 VanDerWaalsContact CB-CD2 3.46Å; A403-Y410 HydrophobicContact CB-CE2 3.57Å; D406-Y410 PolarHBondContact O-N 3.32Å; R407-Y410 WeakPolarHBondContact O-CB 3.45Å; R407-Y410 PolarHBondContact O-N 2.97Å; Y410-C413 PolarHBondContact O-N 3.33Å; Y410-F417 HydrophobicContact CD2-CD2 4.23Å; Y410-F417 AromaticContact CD2-CE2 3.59Å; Y410-F417 HydrophobicContact CD2-CE2 3.59Å; Y410-F417 HydrophobicContact CE2-CD2 4.13Å; Y410-F417 AromaticContact CE2-CE2 3.88Å; Y410-F417 HydrophobicContact CE2-CE2 3.88Å; Y410-F417 HydrophobicContact CG-CE2 4.48Å; Y410-S424 WeakPolarHBondContact CE2-OG 3.36Å; Y410-S424 PolarHBondContact OH-O 3.22Å; Y410-S424 PolarHBondContact OH-OG 3.14Å; Y410-F426 HydrophobicContact CD1-CB 4.14Å; Y410-F426 AromaticContact CD1-CD2 3.82Å; Y410-F426 HydrophobicContact CD1-CD2 3.82Å; Y410-F426 HydrophobicContact CD1-CG 4.21Å; Y410-F426 AromaticContact CD2-CD2 3.78Å; Y410-F426 HydrophobicContact CD2-CD2 3.78Å; Y410-F426 HydrophobicContact CE1-CB 3.81Å; Y410-F426 HydrophobicContact CE1-CD2 4.33Å; Y410-F426 HydrophobicContact CE1-CG 4.38Å; Y410-F426 HydrophobicContact CE2-CB 4.21Å; Y410-F426 HydrophobicContact CE2-CD2 4.3Å; Y410-F426 HydrophobicContact CG-CB 4.48Å; Y410-F426 AromaticContact CG-CD2 3.52Å; Y410-F426 HydrophobicContact CG-CD2 3.52Å; Y410-F426 HydrophobicContact CG-CE2 4.15Å; Y410-F426 HydrophobicContact CG-CG 4.33Å
411	E	96.4	Very high	97.1	Very high	103 Å²	103	20.8 Å²	20.8	48%	0.481	12%	0.116	S	C	.	.	H	α-helix	trans	-69.4	-41	177.3	-69.1	169.3	-169.5	0	0	112.4	R407 G408 L409 C413 S414	R407-E411 IonicContact CZ-OE1 3.59Å; R407-E411 IonicContact NE-OE1 2.84Å; R407-E411 PolarHBondContact NE-OE1 2.88Å; R407-E411 IonicContact NH2-OE1 3.47Å; R407-E411 PolarHBondContact NH2-OE1 3.41Å; R407-E411 PolarHBondContact O-N 2.78Å; R407-E411 VanDerWaalsContact O-N 3.14Å; G408-E411 PolarHBondContact O-N 3.31Å; L409-E411 VanDerWaalsContact C-N 3.28Å; L409-E411 PolarHBondContact O-N 2.62Å; E411-C413 PolarHBondContact O-N 3.28Å; E411-S414 VanDerWaalsContact O-CB 3.22Å; E411-S414 WeakPolarHBondContact O-CB 3.39Å; E411-S414 PolarHBondContact O-N 3.24Å
412	D	96.9	Very high	96.9	Very high	46 Å²	46	26.2 Å²	26.2	25%	0.246	14%	0.139	C	C	.	.	H	α-helix	trans	-58.1	-28.7	173.3	-78.9	-43	0	0	0	112.5	K268 I326 R381 G408 L409 S414	K268-D412 IonicContact NZ-OD1 2.7Å; K268-D412 PolarHBondContact NZ-OD1 3.48Å; K268-D412 IonicContact NZ-OD2 3.98Å; I326-D412 HydrophobicContact CD1-CB 4.09Å; R381-D412 IonicContact CZ-OD2 2.93Å; R381-D412 IonicContact NH1-OD2 3.45Å; R381-D412 PolarHBondContact NH1-OD2 3.14Å; R381-D412 IonicContact NH2-OD2 3.45Å; G408-D412 WeakPolarHBondContact O-CB 3.44Å; G408-D412 VanDerWaalsContact O-CG 3.27Å; G408-D412 PolarHBondContact O-N 3.26Å; L409-D412 HydrophobicContact CD1-CB 4.33Å; L409-D412 PolarHBondContact O-N 2.93Å; D412-S414 VanDerWaalsContact C-N 3.34Å
413	C	97.9	Very high	96.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	2.4	179.1	-66.9	0	0	0	0	113.9	F328 L409 Y410 E411 S415 C416 F417	F328-C413 HydrophobicContact CZ-CB 4.35Å; L409-C413 WeakPolarHBondContact O-CB 3.45Å; L409-C413 PolarHBondContact O-N 3.44Å; L409-C413 PolarHBondContact O-SG 3.1Å; Y410-C413 PolarHBondContact O-N 3.33Å; E411-C413 PolarHBondContact O-N 3.28Å; C413-S415 PolarHBondContact O-N 2.88Å; C413-C416 WeakPolarHBondContact O-CA 3.32Å; C413-C416 WeakPolarHBondContact O-CB 3.42Å; C413-C416 PolarHBondContact O-N 3.31Å; C413-F417 HydrophobicContact CB-CD1 4.41Å; C413-F417 HydrophobicContact CB-CD2 3.75Å; C413-F417 HydrophobicContact CB-CE1 4.15Å; C413-F417 HydrophobicContact CB-CE2 3.42Å; C413-F417 VanDerWaalsContact CB-CE2 3.42Å; C413-F417 HydrophobicContact CB-CG 4.24Å; C413-F417 HydrophobicContact CB-CZ 3.64Å; C413-F417 PolarHBondContact O-N 3.42Å
414	S	93.9	Very high	96.3	Very high	34 Å²	34	27 Å²	27	24%	0.238	15%	0.145	C	C	.	.	H	α-helix	trans	-51.7	-49.9	-170.6	-179.4	0	0	0	0	114.1	E411 D412 C416 F417 Q418	E411-S414 VanDerWaalsContact O-CB 3.22Å; E411-S414 WeakPolarHBondContact O-CB 3.39Å; E411-S414 PolarHBondContact O-N 3.24Å; D412-S414 VanDerWaalsContact C-N 3.34Å; S414-C416 VanDerWaalsContact C-N 3.34Å; S414-C416 PolarHBondContact O-N 3.47Å; S414-F417 PolarHBondContact O-N 2.98Å; S414-Q418 VanDerWaalsContact O-CG 3.29Å; S414-Q418 WeakPolarHBondContact O-CG 3.27Å; S414-Q418 PolarHBondContact O-N 2.82Å; S414-Q418 PolarHBondContact O-NE2 2.84Å; S414-Q418 PolarHBondContact OG-NE2 3.01Å
415	S	95.7	Very high	96.2	Very high	14 Å²	14	30.4 Å²	30.4	10%	0.098	16%	0.159	C	C	.	.	H	α-helix	trans	-68.4	-31.8	178.5	46.9	0	0	0	0	113	T264 T266 H291 C413 A419	T264-S415 WeakPolarHBondContact O-CB 3.46Å; T266-S415 PolarHBondContact N-OG 3.34Å; H291-S415 PolarHBondContact CE1-OG 3.05Å; C413-S415 PolarHBondContact O-N 2.88Å; S415-A419 WeakPolarHBondContact O-CB 3.41Å; S415-A419 PolarHBondContact O-N 3.46Å; S415-A419 VanDerWaalsContact O-N 3.08Å
416	C	97.9	Very high	96.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67	-44.9	174	-62.4	0	0	0	0	111.1	L286 F328 C413 S414 A419 M420	L286-C416 HydrophobicContact CD2-CB 3.71Å; F328-C416 HydrophobicContact CE2-CB 4.22Å; F328-C416 HydrophobicContact CZ-CB 3.8Å; C413-C416 WeakPolarHBondContact O-CA 3.32Å; C413-C416 WeakPolarHBondContact O-CB 3.42Å; C413-C416 PolarHBondContact O-N 3.31Å; S414-C416 VanDerWaalsContact C-N 3.34Å; S414-C416 PolarHBondContact O-N 3.47Å; C416-A419 PolarHBondContact O-N 3Å; C416-M420 HydrophobicContact CB-CE 4.14Å; C416-M420 VanDerWaalsContact O-CE 3.32Å; C416-M420 WeakPolarHBondContact O-CE 3.33Å; C416-M420 WeakPolarHBondContact O-CG 3.42Å; C416-M420 PolarHBondContact O-N 3.3Å; C416-M420 VanDerWaalsContact O-N 3.17Å
417	F	97.9	Very high	96.1	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-66.5	-36.7	178.3	-69.1	-27.4	0	0	0	112.7	F328 L383 A385 I401 Y410 C413 S414 A419 M420 G421	F328-F417 AromaticContact CE1-CE1 3.93Å; F328-F417 HydrophobicContact CE1-CE1 3.93Å; L383-F417 HydrophobicContact CD2-CE2 4.14Å; L383-F417 HydrophobicContact CD2-CZ 3.81Å; A385-F417 HydrophobicContact CB-CE1 4.14Å; A385-F417 HydrophobicContact CB-CZ 4.01Å; I401-F417 HydrophobicContact CD1-CB 3.62Å; I401-F417 HydrophobicContact CD1-CD1 3.71Å; I401-F417 HydrophobicContact CD1-CG 3.87Å; I401-F417 WeakPolarHBondContact CD1-O 3.36Å; I401-F417 HydrophobicContact CG2-CD1 4.15Å; I401-F417 HydrophobicContact CG2-CE1 4.06Å; I401-F417 HydrophobicContact CG2-CZ 4.39Å; Y410-F417 HydrophobicContact CD2-CD2 4.23Å; Y410-F417 AromaticContact CD2-CE2 3.59Å; Y410-F417 HydrophobicContact CD2-CE2 3.59Å; Y410-F417 HydrophobicContact CE2-CD2 4.13Å; Y410-F417 AromaticContact CE2-CE2 3.88Å; Y410-F417 HydrophobicContact CE2-CE2 3.88Å; Y410-F417 HydrophobicContact CG-CE2 4.48Å; C413-F417 HydrophobicContact CB-CD1 4.41Å; C413-F417 HydrophobicContact CB-CD2 3.75Å; C413-F417 HydrophobicContact CB-CE1 4.15Å; C413-F417 HydrophobicContact CB-CE2 3.42Å; C413-F417 VanDerWaalsContact CB-CE2 3.42Å; C413-F417 HydrophobicContact CB-CG 4.24Å; C413-F417 HydrophobicContact CB-CZ 3.64Å; C413-F417 PolarHBondContact O-N 3.42Å; S414-F417 PolarHBondContact O-N 2.98Å; F417-A419 VanDerWaalsContact C-N 3.32Å; F417-M420 HydrophobicContact CD1-CE 4.43Å; F417-M420 HydrophobicContact CD1-SD 4.14Å; F417-M420 PolarHBondContact O-N 3.43Å; F417-G421 WeakPolarHBondContact O-CA 3.48Å; F417-G421 PolarHBondContact O-N 3.18Å
418	Q	94.1	Very high	96.1	Very high	49 Å²	49	28.9 Å²	28.9	23%	0.229	16%	0.158	C	C	.	.	H	α-helix	trans	-65.7	-32.7	171.8	-71.2	172.2	50.3	0	0	113	A253 I263 S414	A253-Q418 HydrophobicContact CB-CG 4.14Å; I263-Q418 HydrophobicContact CD1-CB 3.63Å; I263-Q418 HydrophobicContact CG1-CB 4.28Å; S414-Q418 VanDerWaalsContact O-CG 3.29Å; S414-Q418 WeakPolarHBondContact O-CG 3.27Å; S414-Q418 PolarHBondContact O-N 2.82Å; S414-Q418 PolarHBondContact O-NE2 2.84Å; S414-Q418 PolarHBondContact OG-NE2 3.01Å
419	A	95.6	Very high	96.1	Very high	8 Å²	8	34.7 Å²	34.7	7%	0.066	18%	0.178	C	C	.	.	H	α-helix	trans	-71.2	-38.3	177.8	0	0	0	0	0	112.2	I263 N285 L286 M289 S415 C416 F417	I263-A419 HydrophobicContact CD1-CB 4.28Å; N285-A419 WeakPolarHBondContact CB-O 3.46Å; L286-A419 HydrophobicContact CD2-CB 4.21Å; M289-A419 HydrophobicContact CB-CB 3.92Å; M289-A419 HydrophobicContact CG-CB 3.6Å; S415-A419 WeakPolarHBondContact O-CB 3.41Å; S415-A419 PolarHBondContact O-N 3.46Å; S415-A419 VanDerWaalsContact O-N 3.08Å; C416-A419 PolarHBondContact O-N 3Å; F417-A419 VanDerWaalsContact C-N 3.32Å
420	M	96.4	Very high	96.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-98.9	-14.3	-173.4	72.2	-178.1	70	0	0	114.6	I282 L286 F328 M360 G397 L399 I401 C416 F417	I282-M420 HydrophobicContact CG1-CB 4.42Å; I282-M420 HydrophobicContact CG2-CB 3.93Å; I282-M420 HydrophobicContact CG2-CE 3.61Å; I282-M420 HydrophobicContact CG2-CG 4.45Å; I282-M420 HydrophobicContact CG2-SD 3.73Å; L286-M420 HydrophobicContact CD1-CE 4.14Å; L286-M420 HydrophobicContact CD2-CE 3.94Å; L286-M420 HydrophobicContact CG-CE 4.25Å; F328-M420 HydrophobicContact CE1-CE 4.35Å; M360-M420 HydrophobicContact CE-SD 3.44Å; M360-M420 WeakPolarHBondContact CE-SD 3.34Å; M360-M420 HydrophobicContact SD-SD 3.93Å; G397-M420 CarbonylContact C-O 3.56Å; G397-M420 VanDerWaalsContact C-O 3.3Å; G397-M420 WeakPolarHBondContact CA-O 3.5Å; G397-M420 CarbonylContact O-C 3.49Å; L399-M420 WeakPolarHBondContact CB-O 3.3Å; L399-M420 PolarHBondContact N-O 2.93Å; I401-M420 HydrophobicContact CD1-CG 3.9Å; I401-M420 HydrophobicContact CD1-SD 4.41Å; C416-M420 HydrophobicContact CB-CE 4.14Å; C416-M420 VanDerWaalsContact O-CE 3.32Å; C416-M420 WeakPolarHBondContact O-CE 3.33Å; C416-M420 WeakPolarHBondContact O-CG 3.42Å; C416-M420 PolarHBondContact O-N 3.3Å; C416-M420 VanDerWaalsContact O-N 3.17Å; F417-M420 HydrophobicContact CD1-CE 4.43Å; F417-M420 HydrophobicContact CD1-SD 4.14Å; F417-M420 PolarHBondContact O-N 3.43Å
421	G	94.6	Very high	96.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.9	-168.6	0	0	0	0	0	114.2	G397 L399 F417	G397-G421 CarbonylContact O-C 3.51Å; G397-G421 WeakPolarHBondContact O-CA 3.47Å; G397-G421 PolarHBondContact O-N 2.95Å; L399-G421 CarbonylContact O-C 3.51Å; L399-G421 WeakPolarHBondContact O-CA 3.45Å; F417-G421 WeakPolarHBondContact O-CA 3.48Å; F417-G421 PolarHBondContact O-N 3.18Å
422	K	92.6	Very high	96.2	Very high	114 Å²	114	34.5 Å²	34.5	50%	0.496	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	-37.4	167.9	178.7	-176.2	176	-179.2	0	111.3	A253 A254 G397 M398 L399	A253-K422 CarbonylContact C-O 3.48Å; A254-K422 WeakPolarHBondContact CA-O 3.16Å; A254-K422 HydrophobicContact CB-CG 4.11Å; A254-K422 WeakPolarHBondContact CB-O 3.49Å; A254-K422 PolarHBondContact N-O 3.06Å; G397-K422 PolarHBondContact O-N 3.31Å; M398-K422 HydrophobicContact CB-CB 4.48Å; M398-K422 HydrophobicContact SD-CB 4.06Å; M398-K422 HydrophobicContact SD-CG 4.41Å; L399-K422 PolarHBondContact O-N 3.16Å
423	T	91.4	Very high	96.3	Very high	29 Å²	29	32.3 Å²	32.3	18%	0.178	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	156.6	-177.7	-171.1	0	0	0	0	111	L399 V400 I401 F425	L399-T423 PolarHBondContact O-N 2.98Å; V400-T423 HydrophobicContact CB-CG2 4.31Å; V400-T423 HydrophobicContact CG1-CG2 3.94Å; V400-T423 HydrophobicContact CG2-CG2 3.96Å; I401-T423 PolarHBondContact N-O 3.44Å; T423-F425 HydrophobicContact CG2-CD2 4.46Å; T423-F425 HydrophobicContact CG2-CE2 3.72Å; T423-F425 HydrophobicContact CG2-CZ 4.46Å
424	S	95	Very high	96.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.7	-178.2	178.6	0	0	0	0	111.2	S250 I251 I401 Y410	S250-S424 VanDerWaalsContact CA-O 3.3Å; S250-S424 WeakPolarHBondContact CA-O 3.46Å; I251-S424 PolarHBondContact N-O 3.45Å; I251-S424 VanDerWaalsContact N-O 3.11Å; I251-S424 PolarHBondContact O-N 2.91Å; I401-S424 WeakPolarHBondContact O-CA 3.39Å; Y410-S424 WeakPolarHBondContact CE2-OG 3.36Å; Y410-S424 PolarHBondContact OH-O 3.22Å; Y410-S424 PolarHBondContact OH-OG 3.14Å
425	F	96.6	Very high	96.6	Very high	71 Å²	71	34.8 Å²	34.8	31%	0.311	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.6	177.9	-65.1	-91.3	0	0	0	110.3	V400 I401 L402 A403 T423 L427	V400-F425 HydrophobicContact CG1-CD2 4.11Å; V400-F425 HydrophobicContact CG1-CE2 3.95Å; I401-F425 PolarHBondContact O-N 3.4Å; L402-F425 HydrophobicContact CD2-CB 4.27Å; L402-F425 HydrophobicContact CD2-CD2 3.97Å; L402-F425 HydrophobicContact CD2-CG 4.45Å; A403-F425 PolarHBondContact N-O 2.92Å; T423-F425 HydrophobicContact CG2-CD2 4.46Å; T423-F425 HydrophobicContact CG2-CE2 3.72Å; T423-F425 HydrophobicContact CG2-CZ 4.46Å; F425-L427 HydrophobicContact CB-CD2 4.09Å; F425-L427 HydrophobicContact CB-CG 4.46Å
426	F	97.7	Very high	96.7	Very high	35 Å²	35	38.1 Å²	38.1	15%	0.154	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.4	170.2	-172	-98.9	0	0	0	110.2	L383 A403 G405 R407 Y410	L383-F426 HydrophobicContact CD1-CE2 4.14Å; A403-F426 CarbonylContact O-C 3.51Å; A403-F426 WeakPolarHBondContact O-CA 3.39Å; G405-F426 WeakPolarHBondContact O-CZ 3.4Å; R407-F426 HydrophobicContact CB-CE1 4.27Å; R407-F426 HydrophobicContact CB-CE2 4.37Å; R407-F426 HydrophobicContact CB-CZ 3.8Å; R407-F426 HydrophobicContact CG-CE1 4.47Å; R407-F426 HydrophobicContact CG-CZ 4.37Å; R407-F426 VanDerWaalsContact NH1-CD1 3.27Å; Y410-F426 HydrophobicContact CD1-CB 4.14Å; Y410-F426 AromaticContact CD1-CD2 3.82Å; Y410-F426 HydrophobicContact CD1-CD2 3.82Å; Y410-F426 HydrophobicContact CD1-CG 4.21Å; Y410-F426 AromaticContact CD2-CD2 3.78Å; Y410-F426 HydrophobicContact CD2-CD2 3.78Å; Y410-F426 HydrophobicContact CE1-CB 3.81Å; Y410-F426 HydrophobicContact CE1-CD2 4.33Å; Y410-F426 HydrophobicContact CE1-CG 4.38Å; Y410-F426 HydrophobicContact CE2-CB 4.21Å; Y410-F426 HydrophobicContact CE2-CD2 4.3Å; Y410-F426 HydrophobicContact CG-CB 4.48Å; Y410-F426 AromaticContact CG-CD2 3.52Å; Y410-F426 HydrophobicContact CG-CD2 3.52Å; Y410-F426 HydrophobicContact CG-CE2 4.15Å; Y410-F426 HydrophobicContact CG-CG 4.33Å
427	L	96.9	Very high	96.7	Very high	49 Å²	49	38.1 Å²	38.1	26%	0.257	19%	0.192	S	C	.	.			trans	-108.5	16.9	-167	-55.4	176.3	0	0	0	112.7	L402 A403 A404 F425 N432 A433 M436	L402-L427 HydrophobicContact CB-CD1 3.92Å; A403-L427 PolarHBondContact O-N 2.96Å; A404-L427 HydrophobicContact CB-CB 4.36Å; F425-L427 HydrophobicContact CB-CD2 4.09Å; F425-L427 HydrophobicContact CB-CG 4.46Å; L427-N432 HydrophobicContact CB-CB 4.16Å; L427-N432 VanDerWaalsContact O-CB 3.28Å; L427-N432 WeakPolarHBondContact O-CB 3.43Å; L427-N432 PolarHBondContact O-ND2 3.46Å; L427-A433 HydrophobicContact CD1-CB 4.09Å; L427-M436 HydrophobicContact CD1-CB 3.87Å; L427-M436 HydrophobicContact CD1-CG 4.15Å
428	G	96.9	Very high	96.8	Very high	27 Å²	27	38.2 Å²	38.2	28%	0.278	19%	0.192	S	C	.	.	S	Bend	trans	83.6	-128.3	176.7	0	0	0	0	0	113	A404 G405	A404-G428 CarbonylContact C-O 3.49Å; A404-G428 WeakPolarHBondContact CA-O 3.43Å; A404-G428 WeakPolarHBondContact CB-O 3.41Å; G405-G428 PolarHBondContact N-O 3.05Å
429	E	97.5	Very high	97	Very high	148 Å²	148	39.7 Å²	39.7	69%	0.692	20%	0.201	S	C	*	.	S	Bend	trans	-70.7	152.4	-171.2	-65.7	-62.3	149.8	0	0	114.2	A404 G431 N432	A404-E429 WeakPolarHBondContact CB-O 3.17Å; E429-G431 PolarHBondContact O-N 3.44Å; E429-N432 VanDerWaalsContact O-CB 3.29Å; E429-N432 WeakPolarHBondContact O-CB 3.37Å; E429-N432 PolarHBondContact O-N 2.85Å; E429-N432 VanDerWaalsContact O-N 3.14Å
430	V	98.6	Very high	97.2	Very high	37 Å²	37	41.6 Å²	41.6	22%	0.224	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	136.4	175.6	-179.5	0	0	0	0	111	V368 A372 F382 G405	V368-V430 HydrophobicContact CB-CG1 4.02Å; V368-V430 HydrophobicContact CG2-CG1 3.9Å; A372-V430 HydrophobicContact CB-CG1 4.02Å; A372-V430 HydrophobicContact CB-CG2 4.27Å; F382-V430 HydrophobicContact CD1-CG1 4.43Å; F382-V430 HydrophobicContact CD1-CG2 4.11Å; F382-V430 HydrophobicContact CE1-CG1 4.11Å; G405-V430 VanDerWaalsContact CA-CG2 3.49Å
431	G	98.1	Very high	97.3	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.01	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.6	-23.7	-172.8	0	0	0	0	0	112.8	E384 E429 K435	E384-G431 VanDerWaalsContact OE1-C 3.29Å; E384-G431 VanDerWaalsContact OE1-CA 3.28Å; E384-G431 WeakPolarHBondContact OE1-CA 3.35Å; E384-G431 PolarHBondContact OE1-N 2.93Å; E429-G431 PolarHBondContact O-N 3.44Å; G431-K435 WeakPolarHBondContact O-CD 3.18Å; G431-K435 WeakPolarHBondContact O-CG 3.2Å; G431-K435 PolarHBondContact O-N 3.31Å; G431-K435 VanDerWaalsContact O-N 3.09Å
432	N	98.4	Very high	97.5	Very high	61 Å²	61	43.9 Å²	43.9	33%	0.326	22%	0.223	S	C	.	.	H	α-helix	trans	-71.4	-38.6	-177.4	-71.3	-11.6	0	0	0	112.5	E384 A404 L427 E429 K435 M436	E384-N432 PolarHBondContact OE1-N 3.34Å; A404-N432 HydrophobicContact CB-CB 4.33Å; L427-N432 HydrophobicContact CB-CB 4.16Å; L427-N432 VanDerWaalsContact O-CB 3.28Å; L427-N432 WeakPolarHBondContact O-CB 3.43Å; L427-N432 PolarHBondContact O-ND2 3.46Å; E429-N432 VanDerWaalsContact O-CB 3.29Å; E429-N432 WeakPolarHBondContact O-CB 3.37Å; E429-N432 PolarHBondContact O-N 2.85Å; E429-N432 VanDerWaalsContact O-N 3.14Å; N432-K435 PolarHBondContact O-N 3.35Å; N432-M436 WeakPolarHBondContact O-CB 3.35Å; N432-M436 PolarHBondContact O-N 3.31Å
433	A	98.5	Very high	97.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-72.4	-40.1	178.8	0	0	0	0	0	111.7	E384 P386 L402 A404 L427 K435 M436 M437	E384-A433 HydrophobicContact CG-CB 3.99Å; E384-A433 PolarHBondContact OE1-N 3.09Å; P386-A433 HydrophobicContact CG-CB 3.97Å; L402-A433 HydrophobicContact CB-CB 4.27Å; L402-A433 VanDerWaalsContact O-CB 3.31Å; L402-A433 WeakPolarHBondContact O-CB 3.32Å; A404-A433 HydrophobicContact CB-CB 3.81Å; L427-A433 HydrophobicContact CD1-CB 4.09Å; A433-K435 PolarHBondContact O-N 2.99Å; A433-M436 PolarHBondContact O-N 3.21Å; A433-M437 WeakPolarHBondContact O-CB 3.26Å; A433-M437 PolarHBondContact O-N 3.18Å
434	A	98.6	Very high	98.1	Very high	2 Å²	2	43.5 Å²	43.5	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-54.4	-49.9	170	0	0	0	0	0	112	V368 E384 M436 M437 L438	V368-A434 HydrophobicContact CG1-CB 4.48Å; V368-A434 HydrophobicContact CG2-CB 4.02Å; E384-A434 VanDerWaalsContact OE2-CB 3.25Å; E384-A434 WeakPolarHBondContact OE2-CB 3.42Å; E384-A434 PolarHBondContact OE2-N 3.46Å; A434-M436 PolarHBondContact O-N 3.3Å; A434-M437 PolarHBondContact O-N 3.26Å; A434-L438 VanDerWaalsContact O-CG 3.3Å; A434-L438 WeakPolarHBondContact O-CG 3.44Å; A434-L438 PolarHBondContact O-N 2.95Å
435	K	98.8	Very high	98.3	Very high	84 Å²	84	43.5 Å²	43.5	37%	0.365	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-48.7	177.5	-71.7	165.9	-168.6	165.7	0	111.8	A365 G431 N432 A433 M437 L438 I439 L513	A365-K435 HydrophobicContact CB-CG 4.22Å; G431-K435 WeakPolarHBondContact O-CD 3.18Å; G431-K435 WeakPolarHBondContact O-CG 3.2Å; G431-K435 PolarHBondContact O-N 3.31Å; G431-K435 VanDerWaalsContact O-N 3.09Å; N432-K435 PolarHBondContact O-N 3.35Å; A433-K435 PolarHBondContact O-N 2.99Å; K435-M437 PolarHBondContact O-N 3.45Å; K435-L438 PolarHBondContact O-N 3.09Å; K435-I439 VanDerWaalsContact O-CG1 3.31Å; K435-I439 WeakPolarHBondContact O-CG1 3.45Å; K435-I439 PolarHBondContact O-N 3.45Å; K435-L513 HydrophobicContact CB-CD2 4.17Å; K435-L513 HydrophobicContact CG-CD1 4.03Å; K435-L513 HydrophobicContact CG-CD2 4.07Å
436	M	98.8	Very high	98.4	Very high	84 Å²	84	41.1 Å²	41.1	41%	0.414	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-44.5	-179	-170.4	61	72	0	0	111.4	L402 L427 N432 A433 A434 L438 I439 V440	L402-M436 HydrophobicContact CD1-CB 4.08Å; L402-M436 HydrophobicContact CD1-CG 3.78Å; L427-M436 HydrophobicContact CD1-CB 3.87Å; L427-M436 HydrophobicContact CD1-CG 4.15Å; N432-M436 WeakPolarHBondContact O-CB 3.35Å; N432-M436 PolarHBondContact O-N 3.31Å; A433-M436 PolarHBondContact O-N 3.21Å; A434-M436 PolarHBondContact O-N 3.3Å; M436-L438 PolarHBondContact O-N 3.32Å; M436-I439 PolarHBondContact O-N 2.97Å; M436-V440 WeakPolarHBondContact O-CG2 3.43Å; M436-V440 PolarHBondContact O-N 2.77Å
437	M	98.8	Very high	98.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-43.9	177.1	-176.3	55	63.8	0	0	112.2	T362 P386 V387 S388 L402 A433 A434 K435 I439 V440 N441	T362-M437 HydrophobicContact CG2-CB 4.49Å; T362-M437 HydrophobicContact CG2-CG 3.59Å; P386-M437 HydrophobicContact CB-CB 4.06Å; P386-M437 HydrophobicContact CB-CE 3.95Å; P386-M437 HydrophobicContact CB-CG 3.95Å; P386-M437 HydrophobicContact CG-CB 4.01Å; P386-M437 HydrophobicContact CG-CE 4.43Å; P386-M437 HydrophobicContact CG-CG 4.46Å; V387-M437 WeakPolarHBondContact O-CE 3.43Å; S388-M437 VanDerWaalsContact N-CE 3.33Å; L402-M437 HydrophobicContact CB-CE 4.48Å; L402-M437 HydrophobicContact CD1-CB 4.39Å; L402-M437 HydrophobicContact CD1-CE 3.69Å; L402-M437 HydrophobicContact CG-CE 3.96Å; A433-M437 WeakPolarHBondContact O-CB 3.26Å; A433-M437 PolarHBondContact O-N 3.18Å; A434-M437 PolarHBondContact O-N 3.26Å; K435-M437 PolarHBondContact O-N 3.45Å; M437-I439 VanDerWaalsContact C-N 3.3Å; M437-I439 PolarHBondContact O-N 3.2Å; M437-V440 PolarHBondContact O-N 2.9Å; M437-N441 PolarHBondContact O-N 3.18Å
438	L	98.8	Very high	98.6	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-36.9	177.6	-70.7	179.5	0	0	0	112.1	T362 A434 K435 M436 M442 D506 L509 A510	T362-L438 HydrophobicContact CG2-CD2 4.05Å; A434-L438 VanDerWaalsContact O-CG 3.3Å; A434-L438 WeakPolarHBondContact O-CG 3.44Å; A434-L438 PolarHBondContact O-N 2.95Å; K435-L438 PolarHBondContact O-N 3.09Å; M436-L438 PolarHBondContact O-N 3.32Å; L438-M442 WeakPolarHBondContact O-CB 3.23Å; L438-M442 PolarHBondContact O-N 3.42Å; L438-D506 HydrophobicContact CD2-CB 4.42Å; L438-L509 HydrophobicContact CD1-CB 3.83Å; L438-L509 HydrophobicContact CD2-CB 3.63Å; L438-L509 HydrophobicContact CD2-CD1 4.15Å; L438-L509 HydrophobicContact CG-CB 4.39Å; L438-A510 HydrophobicContact CB-CB 4.31Å
439	I	98.9	Very high	98.6	Very high	79 Å²	79	38.8 Å²	38.8	41%	0.405	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-46.4	174.7	-67.5	163.2	0	0	0	110.6	K435 M436 M437 N441 M442 V443	K435-I439 VanDerWaalsContact O-CG1 3.31Å; K435-I439 WeakPolarHBondContact O-CG1 3.45Å; K435-I439 PolarHBondContact O-N 3.45Å; M436-I439 PolarHBondContact O-N 2.97Å; M437-I439 VanDerWaalsContact C-N 3.3Å; M437-I439 PolarHBondContact O-N 3.2Å; I439-N441 PolarHBondContact O-N 3.17Å; I439-M442 WeakPolarHBondContact O-CB 3.46Å; I439-M442 PolarHBondContact O-N 2.91Å; I439-V443 WeakPolarHBondContact O-CG2 3.11Å; I439-V443 PolarHBondContact O-N 2.89Å; I439-V443 VanDerWaalsContact O-N 3.1Å
440	V	98.6	Very high	98.7	Very high	48 Å²	48	36 Å²	36	29%	0.291	19%	0.193	S	C	.	.	H	α-helix	trans	-57.8	-50.1	177.1	170.1	0	0	0	0	110.7	M436 M437 M442 V443 Q444	M436-V440 WeakPolarHBondContact O-CG2 3.43Å; M436-V440 PolarHBondContact O-N 2.77Å; M437-V440 PolarHBondContact O-N 2.9Å; V440-M442 VanDerWaalsContact C-N 3.32Å; V440-M442 PolarHBondContact O-N 3.44Å; V440-V443 PolarHBondContact O-N 2.98Å; V440-Q444 PolarHBondContact O-N 3.05Å
441	N	98.7	Very high	98.7	Very high	7 Å²	7	34.9 Å²	34.9	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-71.5	-26	-179.1	-73.8	2.7	0	0	0	112.8	M437 I439 G445 I503 D506	M437-N441 PolarHBondContact O-N 3.18Å; I439-N441 PolarHBondContact O-N 3.17Å; N441-G445 PolarHBondContact O-N 3.1Å; N441-I503 HydrophobicContact CB-CD1 4.14Å; N441-D506 HydrophobicContact CB-CB 3.77Å; N441-D506 PolarHBondContact ND2-OD2 3.3Å
442	M	98.9	Very high	98.7	Very high	42 Å²	42	34.8 Å²	34.8	21%	0.207	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-44.9	170.9	-177.6	-176	69.5	0	0	111.5	L438 I439 V440 S446 L507 A510 T521 A524	L438-M442 WeakPolarHBondContact O-CB 3.23Å; L438-M442 PolarHBondContact O-N 3.42Å; I439-M442 WeakPolarHBondContact O-CB 3.46Å; I439-M442 PolarHBondContact O-N 2.91Å; V440-M442 VanDerWaalsContact C-N 3.32Å; V440-M442 PolarHBondContact O-N 3.44Å; M442-S446 WeakPolarHBondContact O-CB 3.5Å; M442-S446 PolarHBondContact O-N 2.9Å; M442-S446 PolarHBondContact O-OG 3.14Å; M442-L507 HydrophobicContact CG-CD2 4.26Å; M442-A510 HydrophobicContact CB-CB 3.74Å; M442-A510 HydrophobicContact CG-CB 4.02Å; M442-A510 HydrophobicContact SD-CB 4Å; M442-T521 HydrophobicContact SD-CG2 4.22Å; M442-A524 HydrophobicContact CG-CB 3.54Å; M442-A524 HydrophobicContact SD-CB 3.69Å
443	V	98.8	Very high	98.8	Very high	93 Å²	93	36.9 Å²	36.9	56%	0.564	19%	0.193	S	C	*	.	H	α-helix	trans	-63.7	-49.6	175.7	174.5	0	0	0	0	110	I439 V440 G445 S446 F447	I439-V443 WeakPolarHBondContact O-CG2 3.11Å; I439-V443 PolarHBondContact O-N 2.89Å; I439-V443 VanDerWaalsContact O-N 3.1Å; V440-V443 PolarHBondContact O-N 2.98Å; V443-G445 PolarHBondContact O-N 2.8Å; V443-S446 PolarHBondContact O-N 2.68Å; V443-F447 WeakPolarHBondContact O-CB 3.25Å; V443-F447 PolarHBondContact O-N 3.22Å
444	Q	98.6	Very high	98.8	Very high	43 Å²	43	38.3 Å²	38.3	20%	0.201	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-44.4	-179	-166.7	177.1	-67.3	0	0	112.7	V440 F447 M448 F481 M544	V440-Q444 PolarHBondContact O-N 3.05Å; Q444-F447 PolarHBondContact O-N 2.88Å; Q444-M448 PolarHBondContact O-N 2.97Å; Q444-F481 HydrophobicContact CG-CD2 4.22Å; Q444-F481 HydrophobicContact CG-CE1 4.35Å; Q444-F481 HydrophobicContact CG-CE2 3.58Å; Q444-F481 HydrophobicContact CG-CZ 3.66Å; Q444-M544 HydrophobicContact CG-CE 4.07Å
445	G	98.7	Very high	98.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-44.7	178.1	0	0	0	0	0	112.4	N441 V443 M448 A449 Y531	N441-G445 PolarHBondContact O-N 3.1Å; V443-G445 PolarHBondContact O-N 2.8Å; G445-M448 PolarHBondContact O-N 2.9Å; G445-A449 PolarHBondContact O-N 3.04Å; G445-Y531 VanDerWaalsContact O-CE2 3.27Å; G445-Y531 WeakPolarHBondContact O-CE2 3.31Å; G445-Y531 PolarHBondContact O-OH 3.41Å
446	S	98.9	Very high	98.8	Very high	20 Å²	20	35 Å²	35	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-64.7	-43.6	177.4	-53.8	0	0	0	0	111.5	M442 V443 M448 A449 T450	M442-S446 WeakPolarHBondContact O-CB 3.5Å; M442-S446 PolarHBondContact O-N 2.9Å; M442-S446 PolarHBondContact O-OG 3.14Å; V443-S446 PolarHBondContact O-N 2.68Å; S446-M448 PolarHBondContact O-N 3.4Å; S446-A449 PolarHBondContact O-N 2.72Å; S446-T450 PolarHBondContact O-N 3.33Å; S446-T450 PolarHBondContact O-OG1 3.11Å
447	F	98.9	Very high	98.8	Very high	59 Å²	59	35.8 Å²	35.8	26%	0.259	20%	0.2	S	C	.	.	H	α-helix	trans	-61.5	-43.1	178.9	-175.4	-137.6	0	0	0	112.2	V443 Q444 A449 T450 I451 F481 L482	V443-F447 WeakPolarHBondContact O-CB 3.25Å; V443-F447 PolarHBondContact O-N 3.22Å; Q444-F447 PolarHBondContact O-N 2.88Å; F447-A449 VanDerWaalsContact C-N 3.33Å; F447-A449 PolarHBondContact O-N 2.89Å; F447-T450 WeakPolarHBondContact O-CB 3.37Å; F447-T450 PolarHBondContact O-N 3.17Å; F447-I451 HydrophobicContact CD1-CD1 3.86Å; F447-I451 HydrophobicContact CD2-CD1 4.24Å; F447-I451 HydrophobicContact CD2-CG1 4.28Å; F447-I451 HydrophobicContact CE1-CD1 3.71Å; F447-I451 HydrophobicContact CE2-CD1 4.09Å; F447-I451 HydrophobicContact CE2-CG1 4.08Å; F447-I451 HydrophobicContact CG-CD1 4.13Å; F447-I451 HydrophobicContact CZ-CD1 3.83Å; F447-I451 HydrophobicContact CZ-CG1 4.24Å; F447-I451 VanDerWaalsContact O-CG1 3.31Å; F447-I451 WeakPolarHBondContact O-CG1 3.2Å; F447-I451 PolarHBondContact O-N 2.86Å; F447-F481 AromaticContact CD1-CD1 3.73Å; F447-F481 HydrophobicContact CD1-CD1 3.73Å; F447-F481 AromaticContact CD1-CE1 3.95Å; F447-F481 HydrophobicContact CD1-CE1 3.95Å; F447-F481 AromaticContact CE1-CD1 3.93Å; F447-F481 HydrophobicContact CE1-CD1 3.93Å; F447-L482 HydrophobicContact CE1-CB 4.31Å; F447-L482 HydrophobicContact CZ-CB 4.27Å; F447-L482 HydrophobicContact CZ-CD1 4.23Å
448	M	98.8	Very high	98.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-36.3	176.1	-177.6	72.3	-107.6	0	0	112.9	Q444 G445 S446 I451 A452 F481 K485 I489 Y531 M544 V547	Q444-M448 PolarHBondContact O-N 2.97Å; G445-M448 PolarHBondContact O-N 2.9Å; S446-M448 PolarHBondContact O-N 3.4Å; M448-I451 HydrophobicContact CE-CB 4.05Å; M448-I451 HydrophobicContact CE-CG2 3.88Å; M448-I451 PolarHBondContact O-N 3.47Å; M448-A452 WeakPolarHBondContact O-CB 3.29Å; M448-A452 PolarHBondContact O-N 2.95Å; M448-F481 HydrophobicContact CB-CE1 4.16Å; M448-F481 HydrophobicContact CB-CZ 4.07Å; M448-F481 HydrophobicContact SD-CE1 4.24Å; M448-F481 HydrophobicContact SD-CZ 4.12Å; M448-K485 HydrophobicContact CE-CB 4.12Å; M448-K485 HydrophobicContact SD-CB 3.68Å; M448-K485 HydrophobicContact SD-CD 4.34Å; M448-K485 HydrophobicContact SD-CG 3.82Å; M448-I489 HydrophobicContact CE-CD1 3.74Å; M448-Y531 WeakPolarHBondContact CB-OH 3.37Å; M448-M544 HydrophobicContact CB-CE 3.7Å; M448-M544 HydrophobicContact CG-CE 3.95Å; M448-M544 HydrophobicContact CG-CG 4.37Å; M448-V547 HydrophobicContact CG-CG1 3.91Å
449	A	98.8	Very high	98.7	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.033	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-42.3	173.3	0	0	0	0	0	111.3	G445 S446 F447 A452 E453 A527 Y531	G445-A449 PolarHBondContact O-N 3.04Å; S446-A449 PolarHBondContact O-N 2.72Å; F447-A449 VanDerWaalsContact C-N 3.33Å; F447-A449 PolarHBondContact O-N 2.89Å; A449-A452 WeakPolarHBondContact O-CB 3.43Å; A449-A452 PolarHBondContact O-N 3.05Å; A449-E453 PolarHBondContact O-N 3.24Å; A449-A527 HydrophobicContact CB-CB 4.08Å; A449-Y531 HydrophobicContact CB-CE2 4.37Å
450	T	98.9	Very high	98.7	Very high	89 Å²	89	41.5 Å²	41.5	55%	0.546	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-40.8	174.7	-57	0	0	0	0	112.7	S446 F447 E453 G454	S446-T450 PolarHBondContact O-N 3.33Å; S446-T450 PolarHBondContact O-OG1 3.11Å; F447-T450 WeakPolarHBondContact O-CB 3.37Å; F447-T450 PolarHBondContact O-N 3.17Å; T450-E453 PolarHBondContact O-N 3.48Å; T450-G454 PolarHBondContact O-N 2.9Å
451	I	98.8	Very high	98.7	Very high	13 Å²	13	43 Å²	43	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-47.9	174.6	-69.6	164	0	0	0	110.5	F447 M448 E453 G454 L455 F481 L482 C486	F447-I451 HydrophobicContact CD1-CD1 3.86Å; F447-I451 HydrophobicContact CD2-CD1 4.24Å; F447-I451 HydrophobicContact CD2-CG1 4.28Å; F447-I451 HydrophobicContact CE1-CD1 3.71Å; F447-I451 HydrophobicContact CE2-CD1 4.09Å; F447-I451 HydrophobicContact CE2-CG1 4.08Å; F447-I451 HydrophobicContact CG-CD1 4.13Å; F447-I451 HydrophobicContact CZ-CD1 3.83Å; F447-I451 HydrophobicContact CZ-CG1 4.24Å; F447-I451 VanDerWaalsContact O-CG1 3.31Å; F447-I451 WeakPolarHBondContact O-CG1 3.2Å; F447-I451 PolarHBondContact O-N 2.86Å; M448-I451 HydrophobicContact CE-CB 4.05Å; M448-I451 HydrophobicContact CE-CG2 3.88Å; M448-I451 PolarHBondContact O-N 3.47Å; I451-E453 PolarHBondContact O-N 3.44Å; I451-G454 PolarHBondContact O-N 3.48Å; I451-L455 HydrophobicContact CG2-CD1 3.81Å; I451-L455 HydrophobicContact CG2-CG 4.46Å; I451-L455 WeakPolarHBondContact O-CG 3.37Å; I451-L455 PolarHBondContact O-N 2.86Å; I451-F481 HydrophobicContact CD1-CD1 4.29Å; I451-F481 HydrophobicContact CD1-CE1 4.12Å; I451-L482 HydrophobicContact CD1-CD1 3.52Å; I451-L482 HydrophobicContact CG1-CD1 3.56Å; I451-L482 HydrophobicContact CG2-CD1 4.29Å; I451-C486 VanDerWaalsContact CG2-SG 3.57Å
452	A	98.8	Very high	98.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.8	-47.2	178.4	0	0	0	0	0	111.8	M448 A449 L455 T456 V547 Y548 Y551	M448-A452 WeakPolarHBondContact O-CB 3.29Å; M448-A452 PolarHBondContact O-N 2.95Å; A449-A452 WeakPolarHBondContact O-CB 3.43Å; A449-A452 PolarHBondContact O-N 3.05Å; A452-L455 PolarHBondContact O-N 3.29Å; A452-T456 PolarHBondContact O-N 3.03Å; A452-T456 PolarHBondContact O-OG1 3.42Å; A452-T456 VanDerWaalsContact O-OG1 3.05Å; A452-V547 HydrophobicContact CB-CG1 4Å; A452-Y548 HydrophobicContact CB-CD2 4.39Å; A452-Y551 HydrophobicContact CB-CD2 4.01Å; A452-Y551 HydrophobicContact CB-CE2 3.96Å
453	E	98.8	Very high	98.6	Very high	104 Å²	104	49.7 Å²	49.7	49%	0.486	29%	0.289	S	S	.	.	H	α-helix	trans	-57.6	-50	176.6	-172.5	168.5	103.8	0	0	111.5	A449 T450 I451 L455 T456 L457 Y551	A449-E453 PolarHBondContact O-N 3.24Å; T450-E453 PolarHBondContact O-N 3.48Å; I451-E453 PolarHBondContact O-N 3.44Å; E453-L455 PolarHBondContact O-N 3.01Å; E453-T456 PolarHBondContact O-N 2.91Å; E453-T456 PolarHBondContact O-OG1 2.99Å; E453-L457 WeakPolarHBondContact O-CB 3.33Å; E453-L457 PolarHBondContact O-N 3.07Å; E453-Y551 HydrophobicContact CB-CD1 4.39Å; E453-Y551 HydrophobicContact CB-CE1 3.74Å; E453-Y551 HydrophobicContact CG-CD1 4.46Å; E453-Y551 HydrophobicContact CG-CE1 3.85Å; E453-Y551 WeakPolarHBondContact OE2-CE1 3.36Å; E453-Y551 PolarHBondContact OE2-OH 2.86Å
454	G	98.6	Very high	98.6	Very high	30 Å²	30	48.1 Å²	48.1	31%	0.309	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-43.5	178.8	0	0	0	0	0	113.5	T450 I451 L457 A458	T450-G454 PolarHBondContact O-N 2.9Å; I451-G454 PolarHBondContact O-N 3.48Å; G454-L457 PolarHBondContact O-N 3.33Å; G454-A458 WeakPolarHBondContact O-CB 3.39Å; G454-A458 PolarHBondContact O-N 2.94Å
455	L	98.7	Very high	98.6	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-43.3	176.8	-74.8	168.4	0	0	0	111.9	I451 A452 E453 Q459 Q465 L468 C486 I489 Y548	I451-L455 HydrophobicContact CG2-CD1 3.81Å; I451-L455 HydrophobicContact CG2-CG 4.46Å; I451-L455 WeakPolarHBondContact O-CG 3.37Å; I451-L455 PolarHBondContact O-N 2.86Å; A452-L455 PolarHBondContact O-N 3.29Å; E453-L455 PolarHBondContact O-N 3.01Å; L455-Q459 PolarHBondContact O-N 3.42Å; L455-Q459 VanDerWaalsContact O-N 3.08Å; L455-Q465 HydrophobicContact CD2-CB 3.94Å; L455-Q465 HydrophobicContact CD2-CG 4.24Å; L455-Q465 PolarHBondContact O-NE2 3.49Å; L455-L468 HydrophobicContact CD2-CD2 4.22Å; L455-C486 HydrophobicContact CD1-CB 4.43Å; L455-I489 HydrophobicContact CD1-CB 4.19Å; L455-I489 HydrophobicContact CD1-CD1 3.52Å; L455-I489 HydrophobicContact CD1-CG1 4.45Å; L455-I489 HydrophobicContact CD1-CG2 4.02Å; L455-Y548 HydrophobicContact CB-CD2 4.4Å; L455-Y548 HydrophobicContact CB-CE2 3.95Å
456	T	98.6	Very high	98.6	Very high	13 Å²	13	51.3 Å²	51.3	8%	0.08	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-37.8	176	53.1	0	0	0	0	112.4	A452 E453 Q459 V460 Y548	A452-T456 PolarHBondContact O-N 3.03Å; A452-T456 PolarHBondContact O-OG1 3.42Å; A452-T456 VanDerWaalsContact O-OG1 3.05Å; E453-T456 PolarHBondContact O-N 2.91Å; E453-T456 PolarHBondContact O-OG1 2.99Å; T456-Q459 WeakPolarHBondContact O-CB 3.23Å; T456-Q459 PolarHBondContact O-N 3.48Å; T456-V460 WeakPolarHBondContact O-CG1 3.39Å; T456-V460 WeakPolarHBondContact O-CG2 3.24Å; T456-V460 PolarHBondContact O-N 3.38Å; T456-Y548 HydrophobicContact CG2-CD2 3.69Å; T456-Y548 HydrophobicContact CG2-CE1 4.49Å; T456-Y548 HydrophobicContact CG2-CE2 3.23Å; T456-Y548 HydrophobicContact CG2-CG 4.48Å
457	L	98.8	Very high	98.5	Very high	102 Å²	102	53.8 Å²	53.8	53%	0.534	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-43.7	176.7	-176.8	60.5	0	0	0	111.3	E453 G454 Q459 V460 T461	E453-L457 WeakPolarHBondContact O-CB 3.33Å; E453-L457 PolarHBondContact O-N 3.07Å; G454-L457 PolarHBondContact O-N 3.33Å; L457-Q459 VanDerWaalsContact C-N 3.32Å; L457-Q459 PolarHBondContact O-N 2.95Å; L457-V460 HydrophobicContact CD1-CG2 4.23Å; L457-V460 WeakPolarHBondContact O-CG2 3.43Å; L457-V460 PolarHBondContact O-N 3.16Å; L457-T461 HydrophobicContact CD1-CG2 3.96Å; L457-T461 HydrophobicContact CG-CG2 4.48Å; L457-T461 WeakPolarHBondContact O-CB 3.1Å; L457-T461 WeakPolarHBondContact O-CG2 3.24Å; L457-T461 PolarHBondContact O-N 3.35Å; L457-T461 PolarHBondContact O-OG1 3.33Å
458	A	98.5	Very high	98.5	Very high	9 Å²	9	53.2 Å²	53.2	7%	0.074	31%	0.311	C	S	.	.	H	α-helix	trans	-56.6	-47.3	172.6	0	0	0	0	0	111.1	G454 V460 T461 G462 Q463 L468	G454-A458 WeakPolarHBondContact O-CB 3.39Å; G454-A458 PolarHBondContact O-N 2.94Å; A458-V460 PolarHBondContact O-N 3.05Å; A458-T461 PolarHBondContact O-N 2.82Å; A458-T461 PolarHBondContact O-OG1 3.23Å; A458-G462 PolarHBondContact O-N 2.89Å; A458-Q463 CarbonylContact C-O 3.45Å; A458-Q463 HydrophobicContact CB-CB 4.06Å; A458-Q463 WeakPolarHBondContact O-CA 3.37Å; A458-Q463 WeakPolarHBondContact O-CB 3.31Å; A458-Q463 PolarHBondContact O-N 3.09Å; A458-L468 HydrophobicContact CB-CD2 3.9Å
459	Q	97.9	Very high	98.5	Very high	108 Å²	108	53.3 Å²	53.3	51%	0.505	31%	0.312	S	S	.	.	H	α-helix	trans	-60.1	-48.7	179.5	-177.5	62.1	43.2	0	0	112.8	L455 T456 L457 T461 G462 Q465	L455-Q459 PolarHBondContact O-N 3.42Å; L455-Q459 VanDerWaalsContact O-N 3.08Å; T456-Q459 WeakPolarHBondContact O-CB 3.23Å; T456-Q459 PolarHBondContact O-N 3.48Å; L457-Q459 VanDerWaalsContact C-N 3.32Å; L457-Q459 PolarHBondContact O-N 2.95Å; Q459-T461 VanDerWaalsContact C-N 3.28Å; Q459-T461 PolarHBondContact O-N 3.31Å; Q459-G462 PolarHBondContact O-N 3.19Å; Q459-Q465 HydrophobicContact CB-CG 4.28Å
460	V	98.1	Very high	98.5	Very high	85 Å²	85	56.6 Å²	56.6	52%	0.515	33%	0.329	S	S	.	.	H	α-helix	trans	-74.1	-19.7	-176.8	-58.4	0	0	0	0	113.2	T456 L457 A458 G462	T456-V460 WeakPolarHBondContact O-CG1 3.39Å; T456-V460 WeakPolarHBondContact O-CG2 3.24Å; T456-V460 PolarHBondContact O-N 3.38Å; L457-V460 HydrophobicContact CD1-CG2 4.23Å; L457-V460 WeakPolarHBondContact O-CG2 3.43Å; L457-V460 PolarHBondContact O-N 3.16Å; A458-V460 PolarHBondContact O-N 3.05Å; V460-G462 VanDerWaalsContact C-N 3.34Å
461	T	98.4	Very high	98.4	Very high	79 Å²	79	57.7 Å²	57.7	49%	0.485	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	11.8	174.5	58	0	0	0	0	113.2	L457 A458 Q459 Q463	L457-T461 HydrophobicContact CD1-CG2 3.96Å; L457-T461 HydrophobicContact CG-CG2 4.48Å; L457-T461 WeakPolarHBondContact O-CB 3.1Å; L457-T461 WeakPolarHBondContact O-CG2 3.24Å; L457-T461 PolarHBondContact O-N 3.35Å; L457-T461 PolarHBondContact O-OG1 3.33Å; A458-T461 PolarHBondContact O-N 2.82Å; A458-T461 PolarHBondContact O-OG1 3.23Å; Q459-T461 VanDerWaalsContact C-N 3.28Å; Q459-T461 PolarHBondContact O-N 3.31Å; T461-Q463 VanDerWaalsContact C-N 3.3Å; T461-Q463 PolarHBondContact O-N 3.47Å; T461-Q463 PolarHBondContact O-NE2 2.86Å
462	G	97.9	Very high	98.4	Very high	68 Å²	68	59.5 Å²	59.5	70%	0.701	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	17.8	175.7	0	0	0	0	0	114.6	A458 Q459 V460	A458-G462 PolarHBondContact O-N 2.89Å; Q459-G462 PolarHBondContact O-N 3.19Å; V460-G462 VanDerWaalsContact C-N 3.34Å
463	Q	98.6	Very high	98.3	Very high	121 Å²	121	61.6 Å²	61.6	57%	0.565	35%	0.351	S	S	*	.			trans	-91.8	150.8	175.6	-52.4	-55.4	-61.1	0	0	111.1	A458 T461 Q465	A458-Q463 CarbonylContact C-O 3.45Å; A458-Q463 HydrophobicContact CB-CB 4.06Å; A458-Q463 WeakPolarHBondContact O-CA 3.37Å; A458-Q463 WeakPolarHBondContact O-CB 3.31Å; A458-Q463 PolarHBondContact O-N 3.09Å; T461-Q463 VanDerWaalsContact C-N 3.3Å; T461-Q463 PolarHBondContact O-N 3.47Å; T461-Q463 PolarHBondContact O-NE2 2.86Å; Q463-Q465 PolarHBondContact O-N 2.99Å
464	S	98.4	Very high	98.3	Very high	60 Å²	60	65 Å²	65	42%	0.42	37%	0.367	S	S	.	.			trans	-74.4	121.9	176.3	170.4	0	0	0	0	111.2	Q466 T467 L468	S464-Q466 VanDerWaalsContact C-N 3.27Å; S464-Q466 PolarHBondContact O-N 3.13Å; S464-Q466 PolarHBondContact OG-N 3.47Å; S464-T467 WeakPolarHBondContact CB-OG1 3.39Å; S464-T467 PolarHBondContact O-N 2.87Å; S464-T467 PolarHBondContact OG-N 3.4Å; S464-T467 PolarHBondContact OG-OG1 3.47Å; S464-T467 VanDerWaalsContact OG-OG1 3.14Å; S464-L468 PolarHBondContact O-N 3.36Å
465	Q	98.1	Very high	98.1	Very high	22 Å²	22	65.1 Å²	65.1	10%	0.103	37%	0.369	C	S	.	.	H	α-helix	trans	-62	-35.3	173.5	-67.4	-173.4	-32.3	0	0	112.4	L455 Q459 Q463 L468 L469 L490 Y548	L455-Q465 HydrophobicContact CD2-CB 3.94Å; L455-Q465 HydrophobicContact CD2-CG 4.24Å; L455-Q465 PolarHBondContact O-NE2 3.49Å; Q459-Q465 HydrophobicContact CB-CG 4.28Å; Q463-Q465 PolarHBondContact O-N 2.99Å; Q465-L468 PolarHBondContact O-N 3.48Å; Q465-L469 PolarHBondContact O-N 3.46Å; Q465-L469 VanDerWaalsContact O-N 3.08Å; Q465-L490 HydrophobicContact CB-CD2 3.47Å; Q465-L490 VanDerWaalsContact CB-CD2 3.47Å; Q465-Y548 PolarHBondContact NE2-OH 3.05Å
466	Q	98.4	Very high	98	Very high	88 Å²	88	74.5 Å²	74.5	41%	0.411	41%	0.412	S	S	.	.	H	α-helix	trans	-64.2	-46.1	175.5	-178.6	62.7	57.3	0	0	110.8	S464 L468 L469 D470	S464-Q466 VanDerWaalsContact C-N 3.27Å; S464-Q466 PolarHBondContact O-N 3.13Å; S464-Q466 PolarHBondContact OG-N 3.47Å; Q466-L468 VanDerWaalsContact C-N 3.3Å; Q466-L468 PolarHBondContact O-N 2.9Å; Q466-L469 WeakPolarHBondContact O-CB 3.38Å; Q466-L469 PolarHBondContact O-N 2.79Å; Q466-L469 VanDerWaalsContact O-N 3.13Å; Q466-D470 PolarHBondContact NE2-OD1 2.7Å; Q466-D470 PolarHBondContact O-N 2.97Å
467	T	98.4	Very high	97.9	Very high	72 Å²	72	79.2 Å²	79.2	44%	0.442	44%	0.437	S	S	.	.	H	α-helix	trans	-65.8	-35.7	179.5	-53.5	0	0	0	0	111.5	S464 D470 I471	S464-T467 WeakPolarHBondContact CB-OG1 3.39Å; S464-T467 PolarHBondContact O-N 2.87Å; S464-T467 PolarHBondContact OG-N 3.4Å; S464-T467 PolarHBondContact OG-OG1 3.47Å; S464-T467 VanDerWaalsContact OG-OG1 3.14Å; T467-D470 PolarHBondContact O-N 3.49Å; T467-I471 HydrophobicContact CG2-CD1 4.11Å; T467-I471 WeakPolarHBondContact O-CD1 3.32Å; T467-I471 VanDerWaalsContact O-CG1 3.27Å; T467-I471 WeakPolarHBondContact O-CG1 3.35Å; T467-I471 PolarHBondContact O-N 2.97Å
468	L	98.6	Very high	97.8	Very high	47 Å²	47	76.8 Å²	76.8	25%	0.246	43%	0.431	C	S	.	.	H	α-helix	trans	-59.1	-47.2	171.4	175.1	62	0	0	0	111.2	L455 A458 S464 Q465 Q466 D470 I471 L472	L455-L468 HydrophobicContact CD2-CD2 4.22Å; A458-L468 HydrophobicContact CB-CD2 3.9Å; S464-L468 PolarHBondContact O-N 3.36Å; Q465-L468 PolarHBondContact O-N 3.48Å; Q466-L468 VanDerWaalsContact C-N 3.3Å; Q466-L468 PolarHBondContact O-N 2.9Å; L468-D470 PolarHBondContact O-N 3.32Å; L468-I471 PolarHBondContact O-N 3.21Å; L468-L472 HydrophobicContact CD1-CD1 4.11Å; L468-L472 HydrophobicContact CD1-CG 4.13Å; L468-L472 HydrophobicContact CG-CD1 4.04Å; L468-L472 HydrophobicContact CG-CG 4.47Å; L468-L472 VanDerWaalsContact O-CG 3.29Å; L468-L472 WeakPolarHBondContact O-CG 3.39Å; L468-L472 PolarHBondContact O-N 2.83Å
469	L	98.2	Very high	97.8	Very high	2 Å²	2	78.5 Å²	78.5	1%	0.01	44%	0.443	C	S	.	.	H	α-helix	trans	-58.9	-46.9	176.1	171.8	58.4	0	0	0	111.6	Q465 Q466 I471 L472 N473 C486 Q487 L490	Q465-L469 PolarHBondContact O-N 3.46Å; Q465-L469 VanDerWaalsContact O-N 3.08Å; Q466-L469 WeakPolarHBondContact O-CB 3.38Å; Q466-L469 PolarHBondContact O-N 2.79Å; Q466-L469 VanDerWaalsContact O-N 3.13Å; L469-I471 VanDerWaalsContact C-N 3.31Å; L469-I471 PolarHBondContact O-N 2.82Å; L469-L472 PolarHBondContact O-N 2.95Å; L469-L472 VanDerWaalsContact O-N 3.17Å; L469-N473 WeakPolarHBondContact CD1-ND2 3.48Å; L469-N473 WeakPolarHBondContact O-CB 3.44Å; L469-N473 PolarHBondContact O-N 2.87Å; L469-C486 HydrophobicContact CB-CB 4.43Å; L469-C486 HydrophobicContact CD1-CB 3.68Å; L469-C486 HydrophobicContact CD2-CB 3.77Å; L469-C486 HydrophobicContact CG-CB 4.16Å; L469-Q487 HydrophobicContact CD2-CG 4.19Å; L469-L490 HydrophobicContact CD2-CD1 3.88Å
470	D	98.3	Very high	97.7	Very high	74 Å²	74	80.7 Å²	80.7	40%	0.396	46%	0.456	S	S	.	.	H	α-helix	trans	-58.1	-44.4	179.6	-59	-22.3	0	0	0	111.2	Q466 T467 L468 N473 Q474	Q466-D470 PolarHBondContact NE2-OD1 2.7Å; Q466-D470 PolarHBondContact O-N 2.97Å; T467-D470 PolarHBondContact O-N 3.49Å; L468-D470 PolarHBondContact O-N 3.32Å; D470-N473 PolarHBondContact O-N 3.35Å; D470-Q474 WeakPolarHBondContact O-CG 3.32Å; D470-Q474 PolarHBondContact O-N 2.9Å
471	I	98.4	Very high	97.7	Very high	112 Å²	112	78.7 Å²	78.7	57%	0.574	44%	0.441	S	S	*	.	H	α-helix	trans	-61.9	-46.9	176.4	-69.2	164.8	0	0	0	111	T467 L468 L469 N473 Q474 G475	T467-I471 HydrophobicContact CG2-CD1 4.11Å; T467-I471 WeakPolarHBondContact O-CD1 3.32Å; T467-I471 VanDerWaalsContact O-CG1 3.27Å; T467-I471 WeakPolarHBondContact O-CG1 3.35Å; T467-I471 PolarHBondContact O-N 2.97Å; L468-I471 PolarHBondContact O-N 3.21Å; L469-I471 VanDerWaalsContact C-N 3.31Å; L469-I471 PolarHBondContact O-N 2.82Å; I471-N473 VanDerWaalsContact C-N 3.29Å; I471-N473 PolarHBondContact O-N 3.47Å; I471-Q474 PolarHBondContact O-N 2.82Å; I471-G475 PolarHBondContact O-N 3.06Å
472	L	97.8	Very high	97.7	Very high	51 Å²	51	75.1 Å²	75.1	27%	0.267	42%	0.418	S	S	.	.	H	α-helix	trans	-63.8	-36.1	-178.9	-69.2	171.8	0	0	0	112.2	L468 L469 Q474 G475 L482	L468-L472 HydrophobicContact CD1-CD1 4.11Å; L468-L472 HydrophobicContact CD1-CG 4.13Å; L468-L472 HydrophobicContact CG-CD1 4.04Å; L468-L472 HydrophobicContact CG-CG 4.47Å; L468-L472 VanDerWaalsContact O-CG 3.29Å; L468-L472 WeakPolarHBondContact O-CG 3.39Å; L468-L472 PolarHBondContact O-N 2.83Å; L469-L472 PolarHBondContact O-N 2.95Å; L469-L472 VanDerWaalsContact O-N 3.17Å; L472-Q474 VanDerWaalsContact C-N 3.29Å; L472-Q474 PolarHBondContact O-N 3.29Å; L472-G475 PolarHBondContact O-N 3.01Å; L472-G475 VanDerWaalsContact O-N 3.1Å; L472-L482 HydrophobicContact CB-CD2 3.83Å; L472-L482 HydrophobicContact CD1-CD1 4.28Å; L472-L482 HydrophobicContact CD1-CD2 4.36Å
473	N	97.8	Very high	97.7	Very high	44 Å²	44	74.1 Å²	74.1	24%	0.235	40%	0.397	C	S	.	.	H	α-helix	trans	-70.5	-20.3	177.5	-81.6	-20.8	0	0	0	113.8	L469 D470 I471 G475 A478 D483	L469-N473 WeakPolarHBondContact CD1-ND2 3.48Å; L469-N473 WeakPolarHBondContact O-CB 3.44Å; L469-N473 PolarHBondContact O-N 2.87Å; D470-N473 PolarHBondContact O-N 3.35Å; I471-N473 VanDerWaalsContact C-N 3.29Å; I471-N473 PolarHBondContact O-N 3.47Å; N473-G475 VanDerWaalsContact C-N 3.35Å; N473-A478 WeakPolarHBondContact O-CB 3.44Å; N473-D483 PolarHBondContact ND2-OD1 2.78Å
474	Q	97.4	Very high	97.7	Very high	174 Å²	174	72.3 Å²	72.3	81%	0.813	39%	0.388	S	S	*	.	H	α-helix	trans	-84.5	-12.2	170.3	-62.3	-56.6	-54	0	0	112.8	D470 I471 L472	D470-Q474 WeakPolarHBondContact O-CG 3.32Å; D470-Q474 PolarHBondContact O-N 2.9Å; I471-Q474 PolarHBondContact O-N 2.82Å; L472-Q474 VanDerWaalsContact C-N 3.29Å; L472-Q474 PolarHBondContact O-N 3.29Å
475	G	95.1	Very high	97.7	Very high	34 Å²	34	69.7 Å²	69.7	35%	0.351	37%	0.37	S	S	.	.	S	Bend	trans	-94.6	-178	-174.1	0	0	0	0	0	114.6	I471 L472 N473 L477 A478	I471-G475 PolarHBondContact O-N 3.06Å; L472-G475 PolarHBondContact O-N 3.01Å; L472-G475 VanDerWaalsContact O-N 3.1Å; N473-G475 VanDerWaalsContact C-N 3.35Å; G475-L477 PolarHBondContact O-N 2.78Å; G475-A478 WeakPolarHBondContact O-CB 3.11Å; G475-A478 PolarHBondContact O-N 2.8Å
476	Q	96.1	Very high	97.7	Very high	200 Å²	200	68.7 Å²	68.7	94%	0.935	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-10.7	-179.7	-61.9	-65.2	-60.3	0	0	114.1
477	L	96.6	Very high	97.7	Very high	112 Å²	112	67.5 Å²	67.5	59%	0.586	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-1.5	177.6	-68.9	176.7	0	0	0	113	G475 S479	G475-L477 PolarHBondContact O-N 2.78Å; L477-S479 PolarHBondContact O-N 2.77Å
478	A	97.4	Very high	97.6	Very high	50 Å²	50	64.7 Å²	64.7	41%	0.413	34%	0.342	S	S	.	.			trans	-54.7	123.7	179.8	0	0	0	0	0	110.6	N473 G475	N473-A478 WeakPolarHBondContact O-CB 3.44Å; G475-A478 WeakPolarHBondContact O-CB 3.11Å; G475-A478 PolarHBondContact O-N 2.8Å
479	S	97.8	Very high	97.6	Very high	46 Å²	46	62.9 Å²	62.9	32%	0.322	33%	0.332	S	S	.	.			trans	-154.3	152.5	178.6	62.3	0	0	0	0	110.2	L477 F481 L482 D483	L477-S479 PolarHBondContact O-N 2.77Å; S479-F481 PolarHBondContact O-N 2.95Å; S479-L482 PolarHBondContact O-N 3.17Å; S479-L482 VanDerWaalsContact O-N 3.12Å; S479-L482 WeakPolarHBondContact OG-CB 3.32Å; S479-L482 PolarHBondContact OG-N 3.22Å; S479-D483 PolarHBondContact O-N 3.47Å; S479-D483 VanDerWaalsContact O-N 3.1Å
480	I	97	Very high	97.6	Very high	154 Å²	154	65.5 Å²	65.5	79%	0.79	35%	0.346	S	S	*	.	H	α-helix	trans	-55.5	-38.9	176.8	-62.5	171.5	0	0	0	110.6	Q484	I480-Q484 WeakPolarHBondContact O-CB 3.49Å; I480-Q484 PolarHBondContact O-N 3.31Å
481	F	97.8	Very high	97.6	Very high	43 Å²	43	68.2 Å²	68.2	19%	0.189	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-47.7	178.1	-177.3	-91.3	0	0	0	112.1	Q444 F447 M448 I451 S479 K485 M544	Q444-F481 HydrophobicContact CG-CD2 4.22Å; Q444-F481 HydrophobicContact CG-CE1 4.35Å; Q444-F481 HydrophobicContact CG-CE2 3.58Å; Q444-F481 HydrophobicContact CG-CZ 3.66Å; F447-F481 AromaticContact CD1-CD1 3.73Å; F447-F481 HydrophobicContact CD1-CD1 3.73Å; F447-F481 AromaticContact CD1-CE1 3.95Å; F447-F481 HydrophobicContact CD1-CE1 3.95Å; F447-F481 AromaticContact CE1-CD1 3.93Å; F447-F481 HydrophobicContact CE1-CD1 3.93Å; M448-F481 HydrophobicContact CB-CE1 4.16Å; M448-F481 HydrophobicContact CB-CZ 4.07Å; M448-F481 HydrophobicContact SD-CE1 4.24Å; M448-F481 HydrophobicContact SD-CZ 4.12Å; I451-F481 HydrophobicContact CD1-CD1 4.29Å; I451-F481 HydrophobicContact CD1-CE1 4.12Å; S479-F481 PolarHBondContact O-N 2.95Å; F481-K485 HydrophobicContact CD1-CG 4.36Å; F481-K485 HydrophobicContact CD2-CG 4.23Å; F481-K485 HydrophobicContact CE1-CG 4.1Å; F481-K485 HydrophobicContact CE2-CG 3.95Å; F481-K485 HydrophobicContact CG-CG 4.43Å; F481-K485 HydrophobicContact CZ-CG 3.88Å; F481-K485 WeakPolarHBondContact O-CB 3.32Å; F481-K485 VanDerWaalsContact O-CG 3.24Å; F481-K485 WeakPolarHBondContact O-CG 3.38Å; F481-K485 PolarHBondContact O-N 3.03Å; F481-M544 HydrophobicContact CE2-CE 4.36Å; F481-M544 HydrophobicContact CE2-SD 3.97Å; F481-M544 HydrophobicContact CZ-CE 3.85Å; F481-M544 HydrophobicContact CZ-SD 3.99Å
482	L	98.2	Very high	97.5	Very high	3 Å²	3	65 Å²	65	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-59.3	-53.6	179.4	174.6	64.5	0	0	0	111	F447 I451 L472 S479 K485 C486	F447-L482 HydrophobicContact CE1-CB 4.31Å; F447-L482 HydrophobicContact CZ-CB 4.27Å; F447-L482 HydrophobicContact CZ-CD1 4.23Å; I451-L482 HydrophobicContact CD1-CD1 3.52Å; I451-L482 HydrophobicContact CG1-CD1 3.56Å; I451-L482 HydrophobicContact CG2-CD1 4.29Å; L472-L482 HydrophobicContact CB-CD2 3.83Å; L472-L482 HydrophobicContact CD1-CD1 4.28Å; L472-L482 HydrophobicContact CD1-CD2 4.36Å; S479-L482 PolarHBondContact O-N 3.17Å; S479-L482 VanDerWaalsContact O-N 3.12Å; S479-L482 WeakPolarHBondContact OG-CB 3.32Å; S479-L482 PolarHBondContact OG-N 3.22Å; L482-K485 PolarHBondContact O-N 3.42Å; L482-C486 WeakPolarHBondContact O-CB 3.38Å; L482-C486 PolarHBondContact O-N 3.05Å; L482-C486 PolarHBondContact O-SG 2.9Å
483	D	97.9	Very high	97.5	Very high	47 Å²	47	65.9 Å²	65.9	25%	0.251	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-51.8	-177.1	-178.3	60.7	0	0	0	111.7	N473 S479 K485 C486 Q487	N473-D483 PolarHBondContact ND2-OD1 2.78Å; S479-D483 PolarHBondContact O-N 3.47Å; S479-D483 VanDerWaalsContact O-N 3.1Å; D483-K485 PolarHBondContact O-N 3.46Å; D483-C486 PolarHBondContact O-N 3.43Å; D483-Q487 WeakPolarHBondContact O-CG 3.45Å; D483-Q487 PolarHBondContact O-N 2.89Å; D483-Q487 PolarHBondContact OD1-NE2 3.47Å; D483-Q487 PolarHBondContact OD2-NE2 3.08Å
484	Q	97.8	Very high	97.5	Very high	83 Å²	83	64.4 Å²	64.4	39%	0.388	35%	0.347	S	S	.	.	H	α-helix	trans	-61.4	-42.9	-178.5	-174.4	61.8	70.7	0	0	112.5	I480 Q487 N488	I480-Q484 WeakPolarHBondContact O-CB 3.49Å; I480-Q484 PolarHBondContact O-N 3.31Å; Q484-Q487 PolarHBondContact O-N 3.28Å; Q484-N488 PolarHBondContact NE2-OD1 3.5Å; Q484-N488 VanDerWaalsContact O-CG 3.25Å; Q484-N488 PolarHBondContact O-N 3.39Å; Q484-N488 PolarHBondContact O-OD1 3.09Å
485	K	98.1	Very high	97.5	Very high	6 Å²	6	63.1 Å²	63.1	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-75	-32.8	-177.9	-63.5	-57.8	-177.3	-175.3	0	112.3	M448 F481 L482 D483 N488 I489 D497 D543	M448-K485 HydrophobicContact CE-CB 4.12Å; M448-K485 HydrophobicContact SD-CB 3.68Å; M448-K485 HydrophobicContact SD-CD 4.34Å; M448-K485 HydrophobicContact SD-CG 3.82Å; F481-K485 HydrophobicContact CD1-CG 4.36Å; F481-K485 HydrophobicContact CD2-CG 4.23Å; F481-K485 HydrophobicContact CE1-CG 4.1Å; F481-K485 HydrophobicContact CE2-CG 3.95Å; F481-K485 HydrophobicContact CG-CG 4.43Å; F481-K485 HydrophobicContact CZ-CG 3.88Å; F481-K485 WeakPolarHBondContact O-CB 3.32Å; F481-K485 VanDerWaalsContact O-CG 3.24Å; F481-K485 WeakPolarHBondContact O-CG 3.38Å; F481-K485 PolarHBondContact O-N 3.03Å; L482-K485 PolarHBondContact O-N 3.42Å; D483-K485 PolarHBondContact O-N 3.46Å; K485-N488 PolarHBondContact O-N 3.39Å; K485-I489 WeakPolarHBondContact O-CG1 3.4Å; K485-I489 PolarHBondContact O-N 3.48Å; K485-I489 VanDerWaalsContact O-N 3.16Å; K485-D497 IonicContact NZ-OD2 2.64Å; K485-D543 IonicContact NZ-OD1 2.68Å; K485-D543 PolarHBondContact NZ-OD1 3.35Å; K485-D543 IonicContact NZ-OD2 3.27Å; K485-D543 PolarHBondContact NZ-OD2 3.06Å
486	C	98.3	Very high	97.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65	-44.5	170.8	-71.9	0	0	0	0	111.4	I451 L455 L469 L482 D483 N488 I489 L490	I451-C486 VanDerWaalsContact CG2-SG 3.57Å; L455-C486 HydrophobicContact CD1-CB 4.43Å; L469-C486 HydrophobicContact CB-CB 4.43Å; L469-C486 HydrophobicContact CD1-CB 3.68Å; L469-C486 HydrophobicContact CD2-CB 3.77Å; L469-C486 HydrophobicContact CG-CB 4.16Å; L482-C486 WeakPolarHBondContact O-CB 3.38Å; L482-C486 PolarHBondContact O-N 3.05Å; L482-C486 PolarHBondContact O-SG 2.9Å; D483-C486 PolarHBondContact O-N 3.43Å; C486-N488 VanDerWaalsContact C-N 3.31Å; C486-N488 PolarHBondContact O-N 3.27Å; C486-I489 PolarHBondContact O-N 3.24Å; C486-I489 VanDerWaalsContact O-N 3.12Å; C486-L490 VanDerWaalsContact O-CG 3.31Å; C486-L490 WeakPolarHBondContact O-CG 3.19Å; C486-L490 PolarHBondContact O-N 3.31Å
487	Q	97.9	Very high	97.5	Very high	63 Å²	63	54.4 Å²	54.4	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-59.6	-41.4	175.7	-72.2	175.2	22.3	0	0	112.1	L469 D483 Q484 I489 L490 Q491	L469-Q487 HydrophobicContact CD2-CG 4.19Å; D483-Q487 WeakPolarHBondContact O-CG 3.45Å; D483-Q487 PolarHBondContact O-N 2.89Å; D483-Q487 PolarHBondContact OD1-NE2 3.47Å; D483-Q487 PolarHBondContact OD2-NE2 3.08Å; Q484-Q487 PolarHBondContact O-N 3.28Å; Q487-I489 VanDerWaalsContact C-N 3.32Å; Q487-I489 PolarHBondContact O-N 3.49Å; Q487-L490 PolarHBondContact O-N 3.49Å; Q487-Q491 WeakPolarHBondContact O-CB 3.42Å; Q487-Q491 VanDerWaalsContact O-CG 3.27Å; Q487-Q491 WeakPolarHBondContact O-CG 3.47Å; Q487-Q491 PolarHBondContact O-N 3.4Å
488	N	97.9	Very high	97.6	Very high	14 Å²	14	49.9 Å²	49.9	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-57.1	-45.4	173.8	-73.6	4.6	0	0	0	111.9	Q484 K485 C486 Q491 G492 N493	Q484-N488 PolarHBondContact NE2-OD1 3.5Å; Q484-N488 VanDerWaalsContact O-CG 3.25Å; Q484-N488 PolarHBondContact O-N 3.39Å; Q484-N488 PolarHBondContact O-OD1 3.09Å; K485-N488 PolarHBondContact O-N 3.39Å; C486-N488 VanDerWaalsContact C-N 3.31Å; C486-N488 PolarHBondContact O-N 3.27Å; N488-Q491 PolarHBondContact O-N 3.32Å; N488-G492 PolarHBondContact O-N 3.03Å; N488-G492 VanDerWaalsContact O-N 3.1Å; N488-N493 WeakPolarHBondContact CB-O 3.47Å; N488-N493 PolarHBondContact O-N 2.75Å
489	I	98.5	Very high	97.6	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.046	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-48.6	177.9	-70.6	166.2	0	0	0	111	M448 L455 K485 C486 Q487 Q491 G492 F494 Y548	M448-I489 HydrophobicContact CE-CD1 3.74Å; L455-I489 HydrophobicContact CD1-CB 4.19Å; L455-I489 HydrophobicContact CD1-CD1 3.52Å; L455-I489 HydrophobicContact CD1-CG1 4.45Å; L455-I489 HydrophobicContact CD1-CG2 4.02Å; K485-I489 WeakPolarHBondContact O-CG1 3.4Å; K485-I489 PolarHBondContact O-N 3.48Å; K485-I489 VanDerWaalsContact O-N 3.16Å; C486-I489 PolarHBondContact O-N 3.24Å; C486-I489 VanDerWaalsContact O-N 3.12Å; Q487-I489 VanDerWaalsContact C-N 3.32Å; Q487-I489 PolarHBondContact O-N 3.49Å; I489-Q491 PolarHBondContact O-N 3.25Å; I489-G492 PolarHBondContact O-N 3.17Å; I489-F494 HydrophobicContact CG1-CE1 3.93Å; I489-F494 HydrophobicContact CG1-CZ 4.34Å; I489-Y548 HydrophobicContact CD1-CD2 3.96Å; I489-Y548 HydrophobicContact CD1-CG 4.16Å; I489-Y548 HydrophobicContact CG1-CD2 4.31Å; I489-Y548 HydrophobicContact CG1-CG 4.17Å; I489-Y548 HydrophobicContact CG2-CD1 4Å; I489-Y548 HydrophobicContact CG2-CD2 3.58Å; I489-Y548 HydrophobicContact CG2-CE1 3.98Å; I489-Y548 HydrophobicContact CG2-CE2 3.55Å; I489-Y548 HydrophobicContact CG2-CG 3.8Å
490	L	97.5	Very high	97.7	Very high	56 Å²	56	48 Å²	48	29%	0.293	24%	0.243	S	C	.	.	H	α-helix	trans	-59.7	-35	180	-71.5	167.7	0	0	0	112.3	Q465 L469 C486 Q487 G492	Q465-L490 HydrophobicContact CB-CD2 3.47Å; Q465-L490 VanDerWaalsContact CB-CD2 3.47Å; L469-L490 HydrophobicContact CD2-CD1 3.88Å; C486-L490 VanDerWaalsContact O-CG 3.31Å; C486-L490 WeakPolarHBondContact O-CG 3.19Å; C486-L490 PolarHBondContact O-N 3.31Å; Q487-L490 PolarHBondContact O-N 3.49Å; L490-G492 VanDerWaalsContact C-N 3.33Å
491	Q	98.1	Very high	97.7	Very high	132 Å²	132	43.8 Å²	43.8	62%	0.617	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.7	176	-66	174	20.5	0	0	113.4	Q487 N488 I489 N493	Q487-Q491 WeakPolarHBondContact O-CB 3.42Å; Q487-Q491 VanDerWaalsContact O-CG 3.27Å; Q487-Q491 WeakPolarHBondContact O-CG 3.47Å; Q487-Q491 PolarHBondContact O-N 3.4Å; N488-Q491 PolarHBondContact O-N 3.32Å; I489-Q491 PolarHBondContact O-N 3.25Å; Q491-N493 HydrophobicContact CB-CB 4.24Å; Q491-N493 PolarHBondContact O-N 2.82Å
492	G	96.9	Very high	97.8	Very high	43 Å²	43	44.2 Å²	44.2	44%	0.443	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	19	-172.3	0	0	0	0	0	114	N488 I489 L490 F494	N488-G492 PolarHBondContact O-N 3.03Å; N488-G492 VanDerWaalsContact O-N 3.1Å; I489-G492 PolarHBondContact O-N 3.17Å; L490-G492 VanDerWaalsContact C-N 3.33Å; G492-F494 WeakPolarHBondContact O-CD2 3.32Å
493	N	97.8	Very high	97.8	Very high	70 Å²	70	44.1 Å²	44.1	37%	0.374	22%	0.219	S	C	.	.			trans	-96.3	104.6	-175.9	176.4	21.6	0	0	0	111	N488 Q491 K495	N488-N493 WeakPolarHBondContact CB-O 3.47Å; N488-N493 PolarHBondContact O-N 2.75Å; Q491-N493 HydrophobicContact CB-CB 4.24Å; Q491-N493 PolarHBondContact O-N 2.82Å; N493-K495 WeakPolarHBondContact OD1-CB 3.38Å; N493-K495 PolarHBondContact OD1-N 2.95Å; N493-K495 VanDerWaalsContact OD1-N 3.16Å
494	F	98.1	Very high	97.8	Very high	14 Å²	14	42.3 Å²	42.3	6%	0.061	21%	0.209	C	C	.	.			trans	-109.8	27.2	179.2	-57.6	-77.9	0	0	0	113.1	I489 G492 N542 D543 S545 A546 Y548 R549	I489-F494 HydrophobicContact CG1-CE1 3.93Å; I489-F494 HydrophobicContact CG1-CZ 4.34Å; G492-F494 WeakPolarHBondContact O-CD2 3.32Å; F494-N542 HydrophobicContact CB-CB 4.1Å; F494-D543 PolarHBondContact O-N 3.37Å; F494-S545 WeakPolarHBondContact CE1-O 3.18Å; F494-A546 HydrophobicContact CB-CB 4.13Å; F494-A546 VanDerWaalsContact CD1-CA 3.46Å; F494-A546 HydrophobicContact CD1-CB 3.79Å; F494-A546 HydrophobicContact CE1-CB 4.45Å; F494-A546 HydrophobicContact CG-CB 4.04Å; F494-Y548 HydrophobicContact CZ-CD1 4.21Å; F494-R549 VanDerWaalsContact CD2-NH2 3.28Å
495	K	97.6	Very high	97.9	Very high	147 Å²	147	39 Å²	39	64%	0.639	19%	0.193	S	C	*	.			trans	-54.9	128.9	172.4	-179.3	-178.1	173.4	175.5	0	109.4	N493 D497	N493-K495 WeakPolarHBondContact OD1-CB 3.38Å; N493-K495 PolarHBondContact OD1-N 2.95Å; N493-K495 VanDerWaalsContact OD1-N 3.16Å; K495-D497 PolarHBondContact O-N 3.35Å
496	P	95.4	Very high	97.9	Very high	26 Å²	26	38.7 Å²	38.7	17%	0.169	19%	0.192	C	C	.	.			trans	-68.4	119.4	-170.3	27.5	-36.2	0	0	0	112.1	Q391 Y499	Q391-P496 PolarHBondContact OE1-O 2.94Å; P496-Y499 HydrophobicContact CB-CD1 3.5Å; P496-Y499 VanDerWaalsContact CB-CD1 3.5Å; P496-Y499 HydrophobicContact CB-CE1 3.42Å; P496-Y499 VanDerWaalsContact CB-CE1 3.42Å; P496-Y499 HydrophobicContact CB-CG 4.29Å; P496-Y499 HydrophobicContact CG-CD1 4.14Å; P496-Y499 HydrophobicContact CG-CE1 3.54Å
497	D	95.1	Very high	97.9	Very high	24 Å²	24	38.7 Å²	38.7	13%	0.128	19%	0.192	C	C	.	.	S	Bend	trans	-108.8	-29.4	166.4	-177.4	39.7	0	0	0	109.8	L277 N390 Q391 Q392 K485 K495 D543	L277-D497 WeakPolarHBondContact CD2-O 3.17Å; N390-D497 VanDerWaalsContact CB-CG 3.46Å; N390-D497 WeakPolarHBondContact CB-OD1 3.3Å; N390-D497 VanDerWaalsContact CB-OD2 3.25Å; N390-D497 WeakPolarHBondContact CB-OD2 3.39Å; N390-D497 VanDerWaalsContact CG-OD1 3.31Å; N390-D497 PolarHBondContact ND2-OD2 2.99Å; Q391-D497 WeakPolarHBondContact CB-OD1 3.41Å; Q391-D497 PolarHBondContact N-O 2.9Å; Q391-D497 PolarHBondContact N-OD1 2.92Å; Q392-D497 PolarHBondContact N-OD1 3.1Å; Q392-D497 VanDerWaalsContact N-OD1 3.11Å; K485-D497 IonicContact NZ-OD2 2.64Å; K495-D497 PolarHBondContact O-N 3.35Å; D497-D543 PolarHBondContact N-OD2 2.98Å; D497-D543 VanDerWaalsContact N-OD2 3.11Å
498	F	97.6	Very high	98	Very high	18 Å²	18	41.2 Å²	41.2	8%	0.079	20%	0.199	C	C	.	.	S	Bend	trans	-140.4	122.8	156.3	-168.3	-102.6	0	0	0	110.1	M278 I503 D543 M544	M278-F498 HydrophobicContact CE-CD2 3.69Å; M278-F498 HydrophobicContact CE-CE2 4.01Å; F498-I503 HydrophobicContact CD1-CB 4.13Å; F498-I503 HydrophobicContact CD1-CD1 4.35Å; F498-I503 HydrophobicContact CE1-CB 3.84Å; F498-I503 HydrophobicContact CE1-CD1 3.86Å; F498-I503 HydrophobicContact CE1-CG1 4.48Å; F498-D543 PolarHBondContact N-OD2 3.23Å; F498-D543 CarbonylContact O-C 3.59Å; F498-D543 WeakPolarHBondContact O-CA 3.2Å; F498-M544 HydrophobicContact CB-SD 4.37Å; F498-M544 HydrophobicContact CD1-SD 4.2Å; F498-M544 PolarHBondContact O-N 2.89Å
499	Y	98.6	Very high	98	Very high	55 Å²	55	41.1 Å²	41.1	22%	0.216	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-62.8	138.3	-173.3	-72.6	-67	0	0	0	113.4	L277 P496 K501 Y502 I503 D541 N542	L277-Y499 HydrophobicContact CB-CD2 4.47Å; L277-Y499 HydrophobicContact CB-CE2 3.98Å; L277-Y499 HydrophobicContact CD1-CE2 4.25Å; L277-Y499 HydrophobicContact CD2-CD2 3.94Å; L277-Y499 HydrophobicContact CD2-CE2 3.97Å; L277-Y499 HydrophobicContact CG-CE2 4.31Å; P496-Y499 HydrophobicContact CB-CD1 3.5Å; P496-Y499 VanDerWaalsContact CB-CD1 3.5Å; P496-Y499 HydrophobicContact CB-CE1 3.42Å; P496-Y499 VanDerWaalsContact CB-CE1 3.42Å; P496-Y499 HydrophobicContact CB-CG 4.29Å; P496-Y499 HydrophobicContact CG-CD1 4.14Å; P496-Y499 HydrophobicContact CG-CE1 3.54Å; Y499-K501 VanDerWaalsContact C-N 3.29Å; Y499-K501 PolarHBondContact O-N 3.43Å; Y499-Y502 AromaticContact CD2-CD2 3.92Å; Y499-Y502 HydrophobicContact CD2-CD2 3.92Å; Y499-Y502 AromaticContact CD2-CE2 3.52Å; Y499-Y502 HydrophobicContact CD2-CE2 3.52Å; Y499-Y502 AromaticContact CD2-CZ 3.94Å; Y499-Y502 HydrophobicContact CE2-CE2 4.35Å; Y499-Y502 HydrophobicContact CG-CD2 4.43Å; Y499-Y502 HydrophobicContact CG-CE2 4.4Å; Y499-Y502 WeakPolarHBondContact O-CB 3.46Å; Y499-Y502 PolarHBondContact O-N 2.83Å; Y499-I503 PolarHBondContact O-N 2.82Å; Y499-D541 VanDerWaalsContact CD1-O 3.27Å; Y499-D541 WeakPolarHBondContact CD1-O 3.27Å; Y499-D541 HydrophobicContact CE1-CB 4.37Å; Y499-D541 WeakPolarHBondContact CE1-O 3.29Å; Y499-N542 WeakPolarHBondContact CA-O 3.49Å
500	L	98.8	Very high	98	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-39.3	176.2	-171.2	145.7	0	0	0	112.5	Y502 I503 Q504 Y531 A534 K535 Q539 N542 A546 V547	L500-Y502 PolarHBondContact O-N 3.44Å; L500-I503 WeakPolarHBondContact O-CG2 3.33Å; L500-I503 PolarHBondContact O-N 2.68Å; L500-Q504 WeakPolarHBondContact O-CB 3.41Å; L500-Q504 PolarHBondContact O-N 3.4Å; L500-Y531 HydrophobicContact CD1-CD1 4.23Å; L500-Y531 HydrophobicContact CD1-CE1 4.49Å; L500-Y531 HydrophobicContact CD2-CD1 4.16Å; L500-Y531 HydrophobicContact CG-CD1 3.85Å; L500-Y531 HydrophobicContact CG-CE1 4.26Å; L500-A534 HydrophobicContact CD1-CB 3.71Å; L500-A534 HydrophobicContact CD2-CB 4.09Å; L500-K535 HydrophobicContact CD2-CD 4.46Å; L500-K535 HydrophobicContact CD2-CG 3.5Å; L500-K535 VanDerWaalsContact CD2-CG 3.5Å; L500-Q539 VanDerWaalsContact CB-O 3.31Å; L500-Q539 WeakPolarHBondContact CB-O 3.47Å; L500-Q539 HydrophobicContact CD1-CB 3.9Å; L500-N542 PolarHBondContact N-O 3.32Å; L500-A546 HydrophobicContact CD1-CB 3.99Å; L500-V547 HydrophobicContact CD1-CB 4.38Å
501	K	98.6	Very high	98.1	Very high	66 Å²	66	40.2 Å²	40.2	29%	0.287	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-28.6	175.5	68.2	-170.6	173.6	-171.4	0	113.2	Y499 K505 S540 D541	Y499-K501 VanDerWaalsContact C-N 3.29Å; Y499-K501 PolarHBondContact O-N 3.43Å; K501-K505 WeakPolarHBondContact O-CB 3.27Å; K501-K505 PolarHBondContact O-N 3.01Å; K501-K505 VanDerWaalsContact O-N 3.12Å; K501-S540 WeakPolarHBondContact CB-O 3.46Å; K501-S540 WeakPolarHBondContact CG-O 3.41Å; K501-S540 PolarHBondContact N-O 2.7Å; K501-D541 WeakPolarHBondContact CD-OD1 3.29Å; K501-D541 WeakPolarHBondContact CE-OD1 3.38Å; K501-D541 IonicContact NZ-OD1 3.97Å; K501-D541 PolarHBondContact NZ-OD1 3.2Å
502	Y	98.6	Very high	98.1	Very high	53 Å²	53	36.6 Å²	36.6	21%	0.208	19%	0.186	C	C	.	.	H	α-helix	trans	-76	-46.1	178.7	-66.6	-12	0	0	0	111.2	Y499 L500 Q504 K505 D506	Y499-Y502 AromaticContact CD2-CD2 3.92Å; Y499-Y502 HydrophobicContact CD2-CD2 3.92Å; Y499-Y502 AromaticContact CD2-CE2 3.52Å; Y499-Y502 HydrophobicContact CD2-CE2 3.52Å; Y499-Y502 AromaticContact CD2-CZ 3.94Å; Y499-Y502 HydrophobicContact CE2-CE2 4.35Å; Y499-Y502 HydrophobicContact CG-CD2 4.43Å; Y499-Y502 HydrophobicContact CG-CE2 4.4Å; Y499-Y502 WeakPolarHBondContact O-CB 3.46Å; Y499-Y502 PolarHBondContact O-N 2.83Å; L500-Y502 PolarHBondContact O-N 3.44Å; Y502-Q504 VanDerWaalsContact C-N 3.27Å; Y502-Q504 PolarHBondContact O-N 3.45Å; Y502-K505 WeakPolarHBondContact O-CA 3.45Å; Y502-K505 WeakPolarHBondContact O-CB 3.38Å; Y502-K505 PolarHBondContact O-N 2.98Å; Y502-K505 VanDerWaalsContact O-N 3.08Å; Y502-D506 PolarHBondContact O-N 3.43Å
503	I	98.8	Very high	98.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-35.4	177	-158.6	74.9	0	0	0	111.7	N441 F498 Y499 L500 K505 D506 L507 Y531 M544	N441-I503 HydrophobicContact CB-CD1 4.14Å; F498-I503 HydrophobicContact CD1-CB 4.13Å; F498-I503 HydrophobicContact CD1-CD1 4.35Å; F498-I503 HydrophobicContact CE1-CB 3.84Å; F498-I503 HydrophobicContact CE1-CD1 3.86Å; F498-I503 HydrophobicContact CE1-CG1 4.48Å; Y499-I503 PolarHBondContact O-N 2.82Å; L500-I503 WeakPolarHBondContact O-CG2 3.33Å; L500-I503 PolarHBondContact O-N 2.68Å; I503-K505 PolarHBondContact O-N 3.09Å; I503-D506 PolarHBondContact O-N 3.44Å; I503-L507 WeakPolarHBondContact O-CG 3.28Å; I503-L507 PolarHBondContact O-N 3Å; I503-Y531 HydrophobicContact CG2-CD1 3.64Å; I503-Y531 HydrophobicContact CG2-CE1 3.24Å; I503-Y531 HydrophobicContact CG2-CE2 4.37Å; I503-Y531 HydrophobicContact CG2-CG 4.33Å; I503-M544 HydrophobicContact CB-CB 4.34Å; I503-M544 HydrophobicContact CB-CE 4.37Å; I503-M544 HydrophobicContact CD1-CE 3.88Å; I503-M544 HydrophobicContact CG1-CE 3.76Å; I503-M544 HydrophobicContact CG2-CB 3.83Å
504	Q	98.8	Very high	98.3	Very high	9 Å²	9	33.5 Å²	33.5	4%	0.042	16%	0.161	C	C	.	.	H	α-helix	trans	-65.2	-39.8	174.1	-167.1	-81.9	-51.9	0	0	111.8	L500 Y502 R508 N528 K532 K535	L500-Q504 WeakPolarHBondContact O-CB 3.41Å; L500-Q504 PolarHBondContact O-N 3.4Å; Y502-Q504 VanDerWaalsContact C-N 3.27Å; Y502-Q504 PolarHBondContact O-N 3.45Å; Q504-R508 WeakPolarHBondContact O-CB 3.48Å; Q504-R508 PolarHBondContact O-N 2.95Å; Q504-R508 VanDerWaalsContact O-N 3.07Å; Q504-N528 PolarHBondContact NE2-OD1 3.36Å; Q504-K532 HydrophobicContact CG-CG 4.35Å; Q504-K535 HydrophobicContact CB-CD 3.93Å; Q504-K535 HydrophobicContact CG-CD 3.68Å
505	K	98.8	Very high	98.3	Very high	14 Å²	14	38.8 Å²	38.8	6%	0.061	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-45.6	173.4	173.4	-134.1	63.1	177.2	0	110.3	S332 D333 T362 K501 Y502 I503 R508 L509	S332-K505 PolarHBondContact O-NZ 3.48Å; D333-K505 HydrophobicContact CB-CD 3.84Å; T362-K505 PolarHBondContact O-NZ 3.36Å; K501-K505 WeakPolarHBondContact O-CB 3.27Å; K501-K505 PolarHBondContact O-N 3.01Å; K501-K505 VanDerWaalsContact O-N 3.12Å; Y502-K505 WeakPolarHBondContact O-CA 3.45Å; Y502-K505 WeakPolarHBondContact O-CB 3.38Å; Y502-K505 PolarHBondContact O-N 2.98Å; Y502-K505 VanDerWaalsContact O-N 3.08Å; I503-K505 PolarHBondContact O-N 3.09Å; K505-R508 PolarHBondContact O-N 3.13Å; K505-L509 HydrophobicContact CD-CD1 4.37Å; K505-L509 HydrophobicContact CG-CD1 4.26Å; K505-L509 WeakPolarHBondContact O-CG 3.37Å; K505-L509 PolarHBondContact O-N 3.02Å
506	D	98.8	Very high	98.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-44.9	179.6	-64.8	-26.6	0	0	0	112	T362 L438 N441 Y502 I503 R508 L509 A510	T362-D506 WeakPolarHBondContact CG2-OD1 3.39Å; L438-D506 HydrophobicContact CD2-CB 4.42Å; N441-D506 HydrophobicContact CB-CB 3.77Å; N441-D506 PolarHBondContact ND2-OD2 3.3Å; Y502-D506 PolarHBondContact O-N 3.43Å; I503-D506 PolarHBondContact O-N 3.44Å; D506-R508 VanDerWaalsContact C-N 3.33Å; D506-R508 PolarHBondContact O-N 3.23Å; D506-L509 PolarHBondContact O-N 2.9Å; D506-L509 VanDerWaalsContact O-N 3.16Å; D506-A510 WeakPolarHBondContact O-CB 3.48Å; D506-A510 PolarHBondContact O-N 2.9Å
507	L	98.9	Very high	98.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.3	-44.6	174.4	-76.4	168.5	0	0	0	112	M442 I503 L509 A510 I511 A524 A527 N528 Y531	M442-L507 HydrophobicContact CG-CD2 4.26Å; I503-L507 WeakPolarHBondContact O-CG 3.28Å; I503-L507 PolarHBondContact O-N 3Å; L507-L509 VanDerWaalsContact C-N 3.32Å; L507-L509 PolarHBondContact O-N 3.05Å; L507-A510 PolarHBondContact O-N 3.27Å; L507-I511 WeakPolarHBondContact O-CD1 3.43Å; L507-I511 VanDerWaalsContact O-CG1 3.23Å; L507-I511 WeakPolarHBondContact O-CG1 3.19Å; L507-I511 PolarHBondContact O-N 3.03Å; L507-A524 HydrophobicContact CD2-CB 4.28Å; L507-A527 HydrophobicContact CD1-CB 4.26Å; L507-N528 HydrophobicContact CB-CB 4.13Å; L507-Y531 HydrophobicContact CD1-CD2 3.23Å; L507-Y531 HydrophobicContact CD1-CE2 3.48Å; L507-Y531 VanDerWaalsContact CD1-CE2 3.48Å; L507-Y531 HydrophobicContact CD1-CG 4.17Å
508	R	98.8	Very high	98.5	Very high	115 Å²	115	44.9 Å²	44.9	43%	0.434	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-41.7	176.2	176.4	175.8	54.4	72.9	2.1	112.1	Q504 K505 D506 A512	Q504-R508 WeakPolarHBondContact O-CB 3.48Å; Q504-R508 PolarHBondContact O-N 2.95Å; Q504-R508 VanDerWaalsContact O-N 3.07Å; K505-R508 PolarHBondContact O-N 3.13Å; D506-R508 VanDerWaalsContact C-N 3.33Å; D506-R508 PolarHBondContact O-N 3.23Å; R508-A512 PolarHBondContact O-N 2.84Å; R508-A512 VanDerWaalsContact O-N 3.11Å
509	L	98.8	Very high	98.5	Very high	12 Å²	12	49.8 Å²	49.8	6%	0.063	27%	0.265	C	S	.	.	H	α-helix	trans	-71.1	-37.8	178.4	-66	178.8	0	0	0	111.8	P334 D364 L438 K505 D506 L507 A512 L513	P334-L509 HydrophobicContact CG-CD1 4.01Å; P334-L509 HydrophobicContact CG-CD2 4.48Å; D364-L509 HydrophobicContact CB-CD2 4.23Å; L438-L509 HydrophobicContact CD1-CB 3.83Å; L438-L509 HydrophobicContact CD2-CB 3.63Å; L438-L509 HydrophobicContact CD2-CD1 4.15Å; L438-L509 HydrophobicContact CG-CB 4.39Å; K505-L509 HydrophobicContact CD-CD1 4.37Å; K505-L509 HydrophobicContact CG-CD1 4.26Å; K505-L509 WeakPolarHBondContact O-CG 3.37Å; K505-L509 PolarHBondContact O-N 3.02Å; D506-L509 PolarHBondContact O-N 2.9Å; D506-L509 VanDerWaalsContact O-N 3.16Å; L507-L509 VanDerWaalsContact C-N 3.32Å; L507-L509 PolarHBondContact O-N 3.05Å; L509-A512 PolarHBondContact O-N 2.66Å; L509-L513 PolarHBondContact O-N 3.04Å
510	A	98.8	Very high	98.5	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-38.6	174.8	0	0	0	0	0	112.4	L438 M442 D506 L507 L513 G514	L438-A510 HydrophobicContact CB-CB 4.31Å; M442-A510 HydrophobicContact CB-CB 3.74Å; M442-A510 HydrophobicContact CG-CB 4.02Å; M442-A510 HydrophobicContact SD-CB 4Å; D506-A510 WeakPolarHBondContact O-CB 3.48Å; D506-A510 PolarHBondContact O-N 2.9Å; L507-A510 PolarHBondContact O-N 3.27Å; A510-L513 WeakPolarHBondContact O-CB 3.43Å; A510-L513 PolarHBondContact O-N 3.2Å; A510-G514 PolarHBondContact O-N 2.98Å
511	I	98.8	Very high	98.4	Very high	43 Å²	43	53.5 Å²	53.5	22%	0.221	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-44.2	172.3	-67.9	160.3	0	0	0	110.5	L507 L513 G514 D515 A524 N528	L507-I511 WeakPolarHBondContact O-CD1 3.43Å; L507-I511 VanDerWaalsContact O-CG1 3.23Å; L507-I511 WeakPolarHBondContact O-CG1 3.19Å; L507-I511 PolarHBondContact O-N 3.03Å; I511-L513 VanDerWaalsContact C-N 3.31Å; I511-L513 PolarHBondContact O-N 3.14Å; I511-G514 PolarHBondContact O-N 3.07Å; I511-G514 VanDerWaalsContact O-N 3.16Å; I511-D515 PolarHBondContact O-N 2.9Å; I511-A524 HydrophobicContact CG1-CB 4.02Å; I511-N528 HydrophobicContact CD1-CB 3.57Å
512	A	98.8	Very high	98.5	Very high	55 Å²	55	54.4 Å²	54.4	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-36.3	176.3	0	0	0	0	0	112.5	R508 L509 D515 A516	R508-A512 PolarHBondContact O-N 2.84Å; R508-A512 VanDerWaalsContact O-N 3.11Å; L509-A512 PolarHBondContact O-N 2.66Å; A512-D515 WeakPolarHBondContact O-CB 3.28Å; A512-D515 PolarHBondContact O-N 3.45Å; A512-A516 PolarHBondContact O-N 2.75Å
513	L	98.6	Very high	98.5	Very high	42 Å²	42	58.3 Å²	58.3	22%	0.22	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-42.7	172	176.5	61.9	0	0	0	111.4	K435 L509 A510 I511 A516	K435-L513 HydrophobicContact CB-CD2 4.17Å; K435-L513 HydrophobicContact CG-CD1 4.03Å; K435-L513 HydrophobicContact CG-CD2 4.07Å; L509-L513 PolarHBondContact O-N 3.04Å; A510-L513 WeakPolarHBondContact O-CB 3.43Å; A510-L513 PolarHBondContact O-N 3.2Å; I511-L513 VanDerWaalsContact C-N 3.31Å; I511-L513 PolarHBondContact O-N 3.14Å; L513-A516 PolarHBondContact O-N 2.86Å
514	G	98.4	Very high	98.5	Very high	6 Å²	6	58.4 Å²	58.4	6%	0.062	33%	0.331	C	S	.	.	H	α-helix	trans	-60.9	-44.3	173.6	0	0	0	0	0	112.6	A510 I511 A516 V517 N518 H519	A510-G514 PolarHBondContact O-N 2.98Å; I511-G514 PolarHBondContact O-N 3.07Å; I511-G514 VanDerWaalsContact O-N 3.16Å; G514-A516 PolarHBondContact O-N 3.12Å; G514-V517 CarbonylContact O-C 3.38Å; G514-V517 WeakPolarHBondContact O-CG2 3.2Å; G514-V517 PolarHBondContact O-N 2.78Å; G514-N518 PolarHBondContact O-N 3.31Å; G514-N518 VanDerWaalsContact O-N 3.11Å; G514-H519 CarbonylContact C-O 3.51Å; G514-H519 PolarHBondContact O-N 2.93Å
515	D	98.4	Very high	98.5	Very high	125 Å²	125	59.9 Å²	59.9	67%	0.668	34%	0.344	S	S	*	.	H	α-helix	trans	-57.3	-48	175.9	-169.6	-66.6	0	0	0	111.6	I511 A512 V517 N518	I511-D515 PolarHBondContact O-N 2.9Å; A512-D515 WeakPolarHBondContact O-CB 3.28Å; A512-D515 PolarHBondContact O-N 3.45Å; D515-V517 PolarHBondContact O-N 2.89Å; D515-N518 PolarHBondContact O-N 2.98Å
516	A	97.9	Very high	98.5	Very high	77 Å²	77	62 Å²	62	64%	0.636	37%	0.365	S	S	*	.	H	α-helix	trans	-57.2	-25.6	-179.6	0	0	0	0	0	114.1	A512 L513 G514	A512-A516 PolarHBondContact O-N 2.75Å; L513-A516 PolarHBondContact O-N 2.86Å; G514-A516 PolarHBondContact O-N 3.12Å
517	V	97.4	Very high	98.5	Very high	99 Å²	99	62.3 Å²	62.3	60%	0.6	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	11.8	177.7	-58.6	0	0	0	0	113.3	G514 D515 H519	G514-V517 CarbonylContact O-C 3.38Å; G514-V517 WeakPolarHBondContact O-CG2 3.2Å; G514-V517 PolarHBondContact O-N 2.78Å; D515-V517 PolarHBondContact O-N 2.89Å; V517-H519 HydrophobicContact CG2-CB 3.73Å; V517-H519 PolarHBondContact O-N 3.29Å
518	N	97.2	Very high	98.5	Very high	149 Å²	149	62.7 Å²	62.7	80%	0.797	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	38	-175.4	-58.2	-77.6	0	0	0	113.2	G514 D515	G514-N518 PolarHBondContact O-N 3.31Å; G514-N518 VanDerWaalsContact O-N 3.11Å; D515-N518 PolarHBondContact O-N 2.98Å
519	H	97.8	Very high	98.5	Very high	122 Å²	122	62 Å²	62	57%	0.565	37%	0.37	S	S	*	.			trans	-104.4	110.1	177.2	-173.5	86.9	0	0	0	110.5	G514 V517 T521	G514-H519 CarbonylContact C-O 3.51Å; G514-H519 PolarHBondContact O-N 2.93Å; V517-H519 HydrophobicContact CG2-CB 3.73Å; V517-H519 PolarHBondContact O-N 3.29Å; H519-T521 PolarHBondContact O-N 3.45Å
520	P	98.1	Very high	98.5	Very high	105 Å²	105	62.8 Å²	62.8	68%	0.682	38%	0.376	S	S	*	.			trans	-62.3	131.7	178.1	-23	34.2	0	0	0	112.5	P522	P520-P522 VanDerWaalsContact C-CD 3.41Å; P520-P522 WeakPolarHBondContact O-CD 3.28Å
521	T	98.6	Very high	98.5	Very high	28 Å²	28	62.6 Å²	62.6	17%	0.172	37%	0.374	C	S	.	.			trans	-121.4	60.9	178.9	50	0	0	0	0	111.9	M442 H519 M523 A524 A525	M442-T521 HydrophobicContact SD-CG2 4.22Å; H519-T521 PolarHBondContact O-N 3.45Å; T521-M523 VanDerWaalsContact C-N 3.31Å; T521-M523 PolarHBondContact O-N 3.26Å; T521-A524 PolarHBondContact O-N 2.87Å; T521-A525 PolarHBondContact O-N 3.34Å
522	P	98.6	Very high	98.5	Very high	84 Å²	84	64.6 Å²	64.6	55%	0.545	38%	0.381	S	S	.	.	H	α-helix	trans	-60.8	-35.5	-169.3	24.9	-35.1	0	0	0	113.9	P520 A525 A526	P520-P522 VanDerWaalsContact C-CD 3.41Å; P520-P522 WeakPolarHBondContact O-CD 3.28Å; P522-A525 PolarHBondContact O-N 3.45Å; P522-A526 PolarHBondContact O-N 2.86Å
523	M	98.9	Very high	98.5	Very high	136 Å²	136	69.4 Å²	69.4	67%	0.67	39%	0.388	S	S	*	.	H	α-helix	trans	-65.9	-45.4	177.5	-62.9	-60.9	86.6	0	0	112.1	T521 A525 A526 A527	T521-M523 VanDerWaalsContact C-N 3.31Å; T521-M523 PolarHBondContact O-N 3.26Å; M523-A525 VanDerWaalsContact C-N 3.33Å; M523-A525 PolarHBondContact O-N 2.97Å; M523-A526 PolarHBondContact O-N 3.33Å; M523-A527 WeakPolarHBondContact O-CB 3.29Å; M523-A527 PolarHBondContact O-N 3.38Å
524	A	98.8	Very high	98.5	Very high	2 Å²	2	67.4 Å²	67.4	2%	0.017	38%	0.377	C	S	.	.	H	α-helix	trans	-64.5	-39.6	175.4	0	0	0	0	0	111.5	M442 L507 I511 T521 A527 N528	M442-A524 HydrophobicContact CG-CB 3.54Å; M442-A524 HydrophobicContact SD-CB 3.69Å; L507-A524 HydrophobicContact CD2-CB 4.28Å; I511-A524 HydrophobicContact CG1-CB 4.02Å; T521-A524 PolarHBondContact O-N 2.87Å; A524-A527 PolarHBondContact O-N 3.31Å; A524-N528 WeakPolarHBondContact O-CB 3.42Å; A524-N528 PolarHBondContact O-N 2.8Å
525	A	98.8	Very high	98.5	Very high	40 Å²	40	70.5 Å²	70.5	33%	0.331	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-47.5	176.8	0	0	0	0	0	111.8	T521 P522 M523 N528 E529	T521-A525 PolarHBondContact O-N 3.34Å; P522-A525 PolarHBondContact O-N 3.45Å; M523-A525 VanDerWaalsContact C-N 3.33Å; M523-A525 PolarHBondContact O-N 2.97Å; A525-N528 PolarHBondContact O-N 3.34Å; A525-E529 PolarHBondContact O-N 3.49Å
526	A	98.9	Very high	98.5	Very high	59 Å²	59	68.4 Å²	68.4	49%	0.488	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-51.7	175.6	0	0	0	0	0	111.6	P522 M523 N528 E529 V530	P522-A526 PolarHBondContact O-N 2.86Å; M523-A526 PolarHBondContact O-N 3.33Å; A526-N528 VanDerWaalsContact C-N 3.31Å; A526-N528 PolarHBondContact O-N 3.08Å; A526-E529 PolarHBondContact O-N 3.29Å; A526-V530 PolarHBondContact O-N 2.84Å
527	A	98.9	Very high	98.5	Very high	5 Å²	5	68.8 Å²	68.8	4%	0.041	38%	0.38	C	S	.	.	H	α-helix	trans	-57	-44.7	178.7	0	0	0	0	0	111.8	A449 L507 M523 A524 E529 V530 Y531	A449-A527 HydrophobicContact CB-CB 4.08Å; L507-A527 HydrophobicContact CD1-CB 4.26Å; M523-A527 WeakPolarHBondContact O-CB 3.29Å; M523-A527 PolarHBondContact O-N 3.38Å; A524-A527 PolarHBondContact O-N 3.31Å; A527-E529 VanDerWaalsContact C-N 3.31Å; A527-E529 PolarHBondContact O-N 3.15Å; A527-V530 WeakPolarHBondContact O-CB 3.38Å; A527-V530 PolarHBondContact O-N 3.36Å; A527-V530 VanDerWaalsContact O-N 3.1Å; A527-Y531 WeakPolarHBondContact O-CD2 3.35Å; A527-Y531 PolarHBondContact O-N 2.93Å
528	N	98.9	Very high	98.6	Very high	8 Å²	8	70.9 Å²	70.9	4%	0.043	39%	0.388	C	S	.	.	H	α-helix	trans	-57.9	-39.7	179.8	177.9	61.5	0	0	0	113	Q504 L507 I511 A524 A525 A526 Y531 K532	Q504-N528 PolarHBondContact NE2-OD1 3.36Å; L507-N528 HydrophobicContact CB-CB 4.13Å; I511-N528 HydrophobicContact CD1-CB 3.57Å; A524-N528 WeakPolarHBondContact O-CB 3.42Å; A524-N528 PolarHBondContact O-N 2.8Å; A525-N528 PolarHBondContact O-N 3.34Å; A526-N528 VanDerWaalsContact C-N 3.31Å; A526-N528 PolarHBondContact O-N 3.08Å; N528-Y531 PolarHBondContact O-N 3Å; N528-K532 VanDerWaalsContact ND2-CE 3.33Å; N528-K532 WeakPolarHBondContact ND2-CE 3.48Å; N528-K532 PolarHBondContact ND2-NZ 2.88Å; N528-K532 WeakPolarHBondContact O-CG 3.37Å; N528-K532 PolarHBondContact O-N 3.07Å
529	E	98.9	Very high	98.7	Very high	101 Å²	101	64.8 Å²	64.8	47%	0.472	36%	0.355	S	S	.	.	H	α-helix	trans	-68.3	-36.1	176.7	-61.1	-43.9	117.5	0	0	112.2	A525 A526 A527 K532 R533	A525-E529 PolarHBondContact O-N 3.49Å; A526-E529 PolarHBondContact O-N 3.29Å; A527-E529 VanDerWaalsContact C-N 3.31Å; A527-E529 PolarHBondContact O-N 3.15Å; E529-K532 VanDerWaalsContact CD-NZ 3.28Å; E529-K532 PolarHBondContact O-N 3.44Å; E529-K532 WeakPolarHBondContact OE1-CE 3.46Å; E529-K532 IonicContact OE1-NZ 3.07Å; E529-K532 PolarHBondContact OE1-NZ 2.87Å; E529-K532 WeakPolarHBondContact OE2-CD 3.17Å; E529-K532 IonicContact OE2-NZ 2.67Å; E529-K532 PolarHBondContact OE2-NZ 2.96Å; E529-R533 PolarHBondContact O-N 3.02Å
530	V	98.9	Very high	98.7	Very high	29 Å²	29	60.5 Å²	60.5	18%	0.176	34%	0.338	C	S	.	.	H	α-helix	trans	-64.3	-42.4	173.2	-177.6	0	0	0	0	110.9	A526 A527 K532 R533 A534 V547 A550 Y551	A526-V530 PolarHBondContact O-N 2.84Å; A527-V530 WeakPolarHBondContact O-CB 3.38Å; A527-V530 PolarHBondContact O-N 3.36Å; A527-V530 VanDerWaalsContact O-N 3.1Å; V530-K532 VanDerWaalsContact C-N 3.33Å; V530-K532 PolarHBondContact O-N 3.39Å; V530-R533 WeakPolarHBondContact O-CB 3.39Å; V530-R533 PolarHBondContact O-N 3.06Å; V530-R533 VanDerWaalsContact O-N 3.17Å; V530-A534 PolarHBondContact O-N 3.11Å; V530-V547 HydrophobicContact CB-CG2 4.42Å; V530-V547 HydrophobicContact CG1-CG2 3.58Å; V530-A550 HydrophobicContact CG1-CB 3.98Å; V530-Y551 HydrophobicContact CG1-CD2 4.14Å; V530-Y551 HydrophobicContact CG1-CE2 3.39Å
531	Y	98.9	Very high	98.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-64.6	-35.7	174.3	-80.3	-75.2	0	0	0	112.9	G445 M448 A449 L500 I503 L507 A527 N528 R533 A534 K535 V547	G445-Y531 VanDerWaalsContact O-CE2 3.27Å; G445-Y531 WeakPolarHBondContact O-CE2 3.31Å; G445-Y531 PolarHBondContact O-OH 3.41Å; M448-Y531 WeakPolarHBondContact CB-OH 3.37Å; A449-Y531 HydrophobicContact CB-CE2 4.37Å; L500-Y531 HydrophobicContact CD1-CD1 4.23Å; L500-Y531 HydrophobicContact CD1-CE1 4.49Å; L500-Y531 HydrophobicContact CD2-CD1 4.16Å; L500-Y531 HydrophobicContact CG-CD1 3.85Å; L500-Y531 HydrophobicContact CG-CE1 4.26Å; I503-Y531 HydrophobicContact CG2-CD1 3.64Å; I503-Y531 HydrophobicContact CG2-CE1 3.24Å; I503-Y531 HydrophobicContact CG2-CE2 4.37Å; I503-Y531 HydrophobicContact CG2-CG 4.33Å; L507-Y531 HydrophobicContact CD1-CD2 3.23Å; L507-Y531 HydrophobicContact CD1-CE2 3.48Å; L507-Y531 VanDerWaalsContact CD1-CE2 3.48Å; L507-Y531 HydrophobicContact CD1-CG 4.17Å; A527-Y531 WeakPolarHBondContact O-CD2 3.35Å; A527-Y531 PolarHBondContact O-N 2.93Å; N528-Y531 PolarHBondContact O-N 3Å; Y531-R533 VanDerWaalsContact C-N 3.34Å; Y531-A534 PolarHBondContact O-N 2.79Å; Y531-K535 WeakPolarHBondContact O-CG 3.29Å; Y531-K535 PolarHBondContact O-N 2.87Å; Y531-V547 HydrophobicContact CD1-CB 3.94Å; Y531-V547 HydrophobicContact CD1-CG2 3.79Å; Y531-V547 HydrophobicContact CD2-CG2 4.34Å; Y531-V547 HydrophobicContact CE1-CB 3.56Å; Y531-V547 HydrophobicContact CE1-CG1 4.05Å; Y531-V547 HydrophobicContact CE1-CG2 3.77Å; Y531-V547 HydrophobicContact CE2-CG2 4.3Å; Y531-V547 HydrophobicContact CG-CG2 4.1Å
532	K	98.9	Very high	98.7	Very high	84 Å²	84	60.6 Å²	60.6	37%	0.365	33%	0.332	S	S	.	.	H	α-helix	trans	-63.9	-40	172.1	-72.6	173.3	-172.9	167	0	111.7	Q504 N528 E529 V530 K535 A536	Q504-K532 HydrophobicContact CG-CG 4.35Å; N528-K532 VanDerWaalsContact ND2-CE 3.33Å; N528-K532 WeakPolarHBondContact ND2-CE 3.48Å; N528-K532 PolarHBondContact ND2-NZ 2.88Å; N528-K532 WeakPolarHBondContact O-CG 3.37Å; N528-K532 PolarHBondContact O-N 3.07Å; E529-K532 VanDerWaalsContact CD-NZ 3.28Å; E529-K532 PolarHBondContact O-N 3.44Å; E529-K532 WeakPolarHBondContact OE1-CE 3.46Å; E529-K532 IonicContact OE1-NZ 3.07Å; E529-K532 PolarHBondContact OE1-NZ 2.87Å; E529-K532 WeakPolarHBondContact OE2-CD 3.17Å; E529-K532 IonicContact OE2-NZ 2.67Å; E529-K532 PolarHBondContact OE2-NZ 2.96Å; V530-K532 VanDerWaalsContact C-N 3.33Å; V530-K532 PolarHBondContact O-N 3.39Å; K532-K535 WeakPolarHBondContact O-CB 3.33Å; K532-K535 PolarHBondContact O-N 2.73Å; K532-A536 PolarHBondContact O-N 2.84Å
533	R	98.8	Very high	98.7	Very high	156 Å²	156	56.6 Å²	56.6	59%	0.589	31%	0.306	S	S	*	.	H	α-helix	trans	-58.4	-48.4	171.5	179.6	-174.5	-64.8	-89.8	2.4	110.8	E529 V530 Y531 K535 A536 L537 A550	E529-R533 PolarHBondContact O-N 3.02Å; V530-R533 WeakPolarHBondContact O-CB 3.39Å; V530-R533 PolarHBondContact O-N 3.06Å; V530-R533 VanDerWaalsContact O-N 3.17Å; Y531-R533 VanDerWaalsContact C-N 3.34Å; R533-K535 VanDerWaalsContact C-N 3.3Å; R533-K535 PolarHBondContact O-N 2.96Å; R533-A536 WeakPolarHBondContact O-CB 3.42Å; R533-A536 PolarHBondContact O-N 3.37Å; R533-L537 HydrophobicContact CG-CD1 4.35Å; R533-L537 WeakPolarHBondContact O-CG 3.33Å; R533-L537 PolarHBondContact O-N 2.85Å; R533-L537 VanDerWaalsContact O-N 3.09Å; R533-A550 HydrophobicContact CB-CB 4.26Å; R533-A550 WeakPolarHBondContact CD-O 3.3Å; R533-A550 HydrophobicContact CG-CB 4Å
534	A	98.8	Very high	98.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-40.5	176.4	0	0	0	0	0	112.4	L500 V530 Y531 A536 L537 Q539 V547 A550	L500-A534 HydrophobicContact CD1-CB 3.71Å; L500-A534 HydrophobicContact CD2-CB 4.09Å; V530-A534 PolarHBondContact O-N 3.11Å; Y531-A534 PolarHBondContact O-N 2.79Å; A534-A536 VanDerWaalsContact C-N 3.34Å; A534-A536 PolarHBondContact O-N 3.15Å; A534-L537 CarbonylContact O-C 3.57Å; A534-L537 WeakPolarHBondContact O-CA 3.18Å; A534-L537 PolarHBondContact O-N 2.96Å; A534-L537 VanDerWaalsContact O-N 3.12Å; A534-Q539 HydrophobicContact CB-CB 4.31Å; A534-Q539 WeakPolarHBondContact O-CB 3.34Å; A534-Q539 VanDerWaalsContact O-CG 3.32Å; A534-Q539 WeakPolarHBondContact O-CG 3.45Å; A534-Q539 PolarHBondContact O-N 3.04Å; A534-Q539 VanDerWaalsContact O-N 3.1Å; A534-V547 HydrophobicContact CB-CG2 4.47Å; A534-A550 HydrophobicContact CB-CB 4.01Å
535	K	98.6	Very high	98.7	Very high	71 Å²	71	50 Å²	50	31%	0.309	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-38.7	174.2	-71.1	177	69.6	-173	0	112.9	L500 Q504 Y531 K532 R533 L537 D538	L500-K535 HydrophobicContact CD2-CD 4.46Å; L500-K535 HydrophobicContact CD2-CG 3.5Å; L500-K535 VanDerWaalsContact CD2-CG 3.5Å; Q504-K535 HydrophobicContact CB-CD 3.93Å; Q504-K535 HydrophobicContact CG-CD 3.68Å; Y531-K535 WeakPolarHBondContact O-CG 3.29Å; Y531-K535 PolarHBondContact O-N 2.87Å; K532-K535 WeakPolarHBondContact O-CB 3.33Å; K532-K535 PolarHBondContact O-N 2.73Å; R533-K535 VanDerWaalsContact C-N 3.3Å; R533-K535 PolarHBondContact O-N 2.96Å; K535-L537 PolarHBondContact O-N 2.9Å; K535-D538 PolarHBondContact O-N 2.85Å; K535-D538 VanDerWaalsContact O-N 3.13Å
536	A	98.6	Very high	98.7	Very high	81 Å²	81	48.1 Å²	48.1	67%	0.669	26%	0.257	S	S	*	.	H	α-helix	trans	-68.2	-19.5	175.7	0	0	0	0	0	112.8	K532 R533 A534 D538	K532-A536 PolarHBondContact O-N 2.84Å; R533-A536 WeakPolarHBondContact O-CB 3.42Å; R533-A536 PolarHBondContact O-N 3.37Å; A534-A536 VanDerWaalsContact C-N 3.34Å; A534-A536 PolarHBondContact O-N 3.15Å; A536-D538 VanDerWaalsContact C-N 3.28Å
537	L	98.5	Very high	98.7	Very high	86 Å²	86	45.3 Å²	45.3	45%	0.45	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	25	171.2	-61.3	171.9	0	0	0	112	R533 A534 K535 Q539	R533-L537 HydrophobicContact CG-CD1 4.35Å; R533-L537 WeakPolarHBondContact O-CG 3.33Å; R533-L537 PolarHBondContact O-N 2.85Å; R533-L537 VanDerWaalsContact O-N 3.09Å; A534-L537 CarbonylContact O-C 3.57Å; A534-L537 WeakPolarHBondContact O-CA 3.18Å; A534-L537 PolarHBondContact O-N 2.96Å; A534-L537 VanDerWaalsContact O-N 3.12Å; K535-L537 PolarHBondContact O-N 2.9Å; L537-Q539 VanDerWaalsContact C-N 3.25Å; L537-Q539 HydrophobicContact CB-CG 4.3Å; L537-Q539 WeakPolarHBondContact O-CG 3.49Å; L537-Q539 PolarHBondContact O-N 3.11Å; L537-Q539 PolarHBondContact O-NE2 3.45Å
538	D	98.6	Very high	98.7	Very high	142 Å²	142	46.4 Å²	46.4	76%	0.759	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	25.9	177.9	-60.9	-51.2	0	0	0	115.7	K535 A536 S540	K535-D538 PolarHBondContact O-N 2.85Å; K535-D538 VanDerWaalsContact O-N 3.13Å; A536-D538 VanDerWaalsContact C-N 3.28Å; D538-S540 VanDerWaalsContact C-N 3.33Å; D538-S540 PolarHBondContact O-N 2.81Å
539	Q	98.7	Very high	98.7	Very high	22 Å²	22	50 Å²	50	10%	0.103	25%	0.251	C	S	.	.			trans	-89.1	6	-179.4	-53.4	-54.1	-53.8	0	0	114.2	L500 A534 L537 D541 N542 A546 R549	L500-Q539 VanDerWaalsContact CB-O 3.31Å; L500-Q539 WeakPolarHBondContact CB-O 3.47Å; L500-Q539 HydrophobicContact CD1-CB 3.9Å; A534-Q539 HydrophobicContact CB-CB 4.31Å; A534-Q539 WeakPolarHBondContact O-CB 3.34Å; A534-Q539 VanDerWaalsContact O-CG 3.32Å; A534-Q539 WeakPolarHBondContact O-CG 3.45Å; A534-Q539 PolarHBondContact O-N 3.04Å; A534-Q539 VanDerWaalsContact O-N 3.1Å; L537-Q539 VanDerWaalsContact C-N 3.25Å; L537-Q539 HydrophobicContact CB-CG 4.3Å; L537-Q539 WeakPolarHBondContact O-CG 3.49Å; L537-Q539 PolarHBondContact O-N 3.11Å; L537-Q539 PolarHBondContact O-NE2 3.45Å; Q539-D541 VanDerWaalsContact C-N 3.27Å; Q539-D541 PolarHBondContact O-N 3Å; Q539-D541 VanDerWaalsContact O-N 3.16Å; Q539-N542 PolarHBondContact O-N 3.31Å; Q539-N542 VanDerWaalsContact O-N 3.14Å; Q539-N542 PolarHBondContact OE1-ND2 2.88Å; Q539-A546 HydrophobicContact CB-CB 4.07Å; Q539-A546 HydrophobicContact CG-CB 4.42Å; Q539-R549 VanDerWaalsContact CD-CD 3.48Å; Q539-R549 HydrophobicContact CG-CB 4.36Å
540	S	98.4	Very high	98.7	Very high	32 Å²	32	45.9 Å²	45.9	22%	0.224	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-37.8	-171.6	-70.3	0	0	0	0	114.3	K501 D538	K501-S540 WeakPolarHBondContact CB-O 3.46Å; K501-S540 WeakPolarHBondContact CG-O 3.41Å; K501-S540 PolarHBondContact N-O 2.7Å; D538-S540 VanDerWaalsContact C-N 3.33Å; D538-S540 PolarHBondContact O-N 2.81Å
541	D	98.3	Very high	98.6	Very high	91 Å²	91	46.9 Å²	46.9	49%	0.487	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	6.4	-174.8	-67.2	-20.5	0	0	0	113.5	Y499 K501 Q539	Y499-D541 VanDerWaalsContact CD1-O 3.27Å; Y499-D541 WeakPolarHBondContact CD1-O 3.27Å; Y499-D541 HydrophobicContact CE1-CB 4.37Å; Y499-D541 WeakPolarHBondContact CE1-O 3.29Å; K501-D541 WeakPolarHBondContact CD-OD1 3.29Å; K501-D541 WeakPolarHBondContact CE-OD1 3.38Å; K501-D541 IonicContact NZ-OD1 3.97Å; K501-D541 PolarHBondContact NZ-OD1 3.2Å; Q539-D541 VanDerWaalsContact C-N 3.27Å; Q539-D541 PolarHBondContact O-N 3Å; Q539-D541 VanDerWaalsContact O-N 3.16Å
542	N	98.6	Very high	98.5	Very high	43 Å²	43	51.6 Å²	51.6	23%	0.23	26%	0.259	C	S	.	.	S	Bend	trans	-89.7	174.1	169.3	-67.8	-37.3	0	0	0	110.7	F494 Y499 L500 Q539 A546 R549	F494-N542 HydrophobicContact CB-CB 4.1Å; Y499-N542 WeakPolarHBondContact CA-O 3.49Å; L500-N542 PolarHBondContact N-O 3.32Å; Q539-N542 PolarHBondContact O-N 3.31Å; Q539-N542 VanDerWaalsContact O-N 3.14Å; Q539-N542 PolarHBondContact OE1-ND2 2.88Å; N542-A546 HydrophobicContact CB-CB 3.74Å; N542-R549 PolarHBondContact ND2-NH1 3.43Å
543	D	98.8	Very high	97.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-59.5	154.2	172.1	-170.4	-109.2	0	0	0	112.1	K485 F494 D497 F498 S545 A546	K485-D543 IonicContact NZ-OD1 2.68Å; K485-D543 PolarHBondContact NZ-OD1 3.35Å; K485-D543 IonicContact NZ-OD2 3.27Å; K485-D543 PolarHBondContact NZ-OD2 3.06Å; F494-D543 PolarHBondContact O-N 3.37Å; D497-D543 PolarHBondContact N-OD2 2.98Å; D497-D543 VanDerWaalsContact N-OD2 3.11Å; F498-D543 PolarHBondContact N-OD2 3.23Å; F498-D543 CarbonylContact O-C 3.59Å; F498-D543 WeakPolarHBondContact O-CA 3.2Å; D543-S545 PolarHBondContact O-N 3.14Å; D543-S545 VanDerWaalsContact O-N 3.11Å; D543-S545 WeakPolarHBondContact OD1-CB 3.41Å; D543-S545 PolarHBondContact OD1-N 2.76Å; D543-S545 PolarHBondContact OD1-OG 3.41Å; D543-A546 WeakPolarHBondContact O-CB 3.44Å; D543-A546 PolarHBondContact O-N 3.44Å
544	M	98.6	Very high	97.8	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-55.1	-28.8	175	65.2	-177.4	-64.1	0	0	113.8	Q444 M448 F481 F498 I503 A546 V547	Q444-M544 HydrophobicContact CG-CE 4.07Å; M448-M544 HydrophobicContact CB-CE 3.7Å; M448-M544 HydrophobicContact CG-CE 3.95Å; M448-M544 HydrophobicContact CG-CG 4.37Å; F481-M544 HydrophobicContact CE2-CE 4.36Å; F481-M544 HydrophobicContact CE2-SD 3.97Å; F481-M544 HydrophobicContact CZ-CE 3.85Å; F481-M544 HydrophobicContact CZ-SD 3.99Å; F498-M544 HydrophobicContact CB-SD 4.37Å; F498-M544 HydrophobicContact CD1-SD 4.2Å; F498-M544 PolarHBondContact O-N 2.89Å; I503-M544 HydrophobicContact CB-CB 4.34Å; I503-M544 HydrophobicContact CB-CE 4.37Å; I503-M544 HydrophobicContact CD1-CE 3.88Å; I503-M544 HydrophobicContact CG1-CE 3.76Å; I503-M544 HydrophobicContact CG2-CB 3.83Å; M544-A546 PolarHBondContact O-N 3.03Å; M544-V547 WeakPolarHBondContact O-CB 3.39Å; M544-V547 WeakPolarHBondContact O-CG1 3.44Å; M544-V547 PolarHBondContact O-N 3.11Å; M544-V547 VanDerWaalsContact O-N 3.13Å
545	S	98.7	Very high	97.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-61	-19.3	173.3	52.3	0	0	0	0	113.8	F494 D543 V547 Y548	F494-S545 WeakPolarHBondContact CE1-O 3.18Å; D543-S545 PolarHBondContact O-N 3.14Å; D543-S545 VanDerWaalsContact O-N 3.11Å; D543-S545 WeakPolarHBondContact OD1-CB 3.41Å; D543-S545 PolarHBondContact OD1-N 2.76Å; D543-S545 PolarHBondContact OD1-OG 3.41Å; S545-V547 PolarHBondContact O-N 3.04Å; S545-Y548 VanDerWaalsContact O-CB 3.23Å; S545-Y548 WeakPolarHBondContact O-CB 3.37Å; S545-Y548 PolarHBondContact O-N 2.86Å
546	A	98.8	Very high	97.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-64.9	-7.7	174.3	0	0	0	0	0	113.4	F494 L500 Q539 N542 D543 M544 Y548 R549	F494-A546 HydrophobicContact CB-CB 4.13Å; F494-A546 VanDerWaalsContact CD1-CA 3.46Å; F494-A546 HydrophobicContact CD1-CB 3.79Å; F494-A546 HydrophobicContact CE1-CB 4.45Å; F494-A546 HydrophobicContact CG-CB 4.04Å; L500-A546 HydrophobicContact CD1-CB 3.99Å; Q539-A546 HydrophobicContact CB-CB 4.07Å; Q539-A546 HydrophobicContact CG-CB 4.42Å; N542-A546 HydrophobicContact CB-CB 3.74Å; D543-A546 WeakPolarHBondContact O-CB 3.44Å; D543-A546 PolarHBondContact O-N 3.44Å; M544-A546 PolarHBondContact O-N 3.03Å; A546-Y548 PolarHBondContact O-N 3.12Å; A546-Y548 VanDerWaalsContact O-N 3.17Å; A546-R549 WeakPolarHBondContact O-CB 3.11Å; A546-R549 PolarHBondContact O-N 2.84Å
547	V	98.8	Very high	97.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55.4	-25.9	165.9	73.7	0	0	0	0	112.1	M448 A452 L500 V530 Y531 A534 M544 S545 R549 A550	M448-V547 HydrophobicContact CG-CG1 3.91Å; A452-V547 HydrophobicContact CB-CG1 4Å; L500-V547 HydrophobicContact CD1-CB 4.38Å; V530-V547 HydrophobicContact CB-CG2 4.42Å; V530-V547 HydrophobicContact CG1-CG2 3.58Å; Y531-V547 HydrophobicContact CD1-CB 3.94Å; Y531-V547 HydrophobicContact CD1-CG2 3.79Å; Y531-V547 HydrophobicContact CD2-CG2 4.34Å; Y531-V547 HydrophobicContact CE1-CB 3.56Å; Y531-V547 HydrophobicContact CE1-CG1 4.05Å; Y531-V547 HydrophobicContact CE1-CG2 3.77Å; Y531-V547 HydrophobicContact CE2-CG2 4.3Å; Y531-V547 HydrophobicContact CG-CG2 4.1Å; A534-V547 HydrophobicContact CB-CG2 4.47Å; M544-V547 WeakPolarHBondContact O-CB 3.39Å; M544-V547 WeakPolarHBondContact O-CG1 3.44Å; M544-V547 PolarHBondContact O-N 3.11Å; M544-V547 VanDerWaalsContact O-N 3.13Å; S545-V547 PolarHBondContact O-N 3.04Å; V547-R549 PolarHBondContact O-N 3.47Å; V547-A550 WeakPolarHBondContact O-CB 3.22Å; V547-A550 PolarHBondContact O-N 2.76Å
548	Y	98.8	Very high	97.6	Very high	28 Å²	28	51.7 Å²	51.7	11%	0.11	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-47.9	-40.3	168.5	179.7	-96.4	0	0	0	113.2	A452 L455 T456 Q465 I489 F494 S545 A546 A550 Y551 I552	A452-Y548 HydrophobicContact CB-CD2 4.39Å; L455-Y548 HydrophobicContact CB-CD2 4.4Å; L455-Y548 HydrophobicContact CB-CE2 3.95Å; T456-Y548 HydrophobicContact CG2-CD2 3.69Å; T456-Y548 HydrophobicContact CG2-CE1 4.49Å; T456-Y548 HydrophobicContact CG2-CE2 3.23Å; T456-Y548 HydrophobicContact CG2-CG 4.48Å; Q465-Y548 PolarHBondContact NE2-OH 3.05Å; I489-Y548 HydrophobicContact CD1-CD2 3.96Å; I489-Y548 HydrophobicContact CD1-CG 4.16Å; I489-Y548 HydrophobicContact CG1-CD2 4.31Å; I489-Y548 HydrophobicContact CG1-CG 4.17Å; I489-Y548 HydrophobicContact CG2-CD1 4Å; I489-Y548 HydrophobicContact CG2-CD2 3.58Å; I489-Y548 HydrophobicContact CG2-CE1 3.98Å; I489-Y548 HydrophobicContact CG2-CE2 3.55Å; I489-Y548 HydrophobicContact CG2-CG 3.8Å; F494-Y548 HydrophobicContact CZ-CD1 4.21Å; S545-Y548 VanDerWaalsContact O-CB 3.23Å; S545-Y548 WeakPolarHBondContact O-CB 3.37Å; S545-Y548 PolarHBondContact O-N 2.86Å; A546-Y548 PolarHBondContact O-N 3.12Å; A546-Y548 VanDerWaalsContact O-N 3.17Å; Y548-A550 PolarHBondContact O-N 2.77Å; Y548-A550 VanDerWaalsContact O-N 3.16Å; Y548-Y551 PolarHBondContact O-N 2.69Å; Y548-I552 HydrophobicContact CD1-CD1 4.04Å; Y548-I552 HydrophobicContact CD1-CG1 4.32Å; Y548-I552 HydrophobicContact CE1-CD1 3.81Å; Y548-I552 HydrophobicContact CE1-CG1 4.02Å
549	R	98.6	Very high	97.5	Very high	85 Å²	85	45.7 Å²	45.7	32%	0.321	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-67.4	-15.6	-179.8	-67.7	171.1	168.6	172.5	-4.9	113.6	F494 Q539 N542 A546 V547 Y551 I552	F494-R549 VanDerWaalsContact CD2-NH2 3.28Å; Q539-R549 VanDerWaalsContact CD-CD 3.48Å; Q539-R549 HydrophobicContact CG-CB 4.36Å; N542-R549 PolarHBondContact ND2-NH1 3.43Å; A546-R549 WeakPolarHBondContact O-CB 3.11Å; A546-R549 PolarHBondContact O-N 2.84Å; V547-R549 PolarHBondContact O-N 3.47Å; R549-Y551 VanDerWaalsContact C-N 3.25Å; R549-Y551 PolarHBondContact O-N 2.84Å; R549-I552 HydrophobicContact CB-CD1 4.41Å; R549-I552 HydrophobicContact CG-CD1 4.12Å
550	A	98.4	Very high	97.4	Very high	14 Å²	14	47.4 Å²	47.4	12%	0.116	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-76.1	-13.6	174	0	0	0	0	0	113.4	V530 R533 A534 V547 Y548	V530-A550 HydrophobicContact CG1-CB 3.98Å; R533-A550 HydrophobicContact CB-CB 4.26Å; R533-A550 WeakPolarHBondContact CD-O 3.3Å; R533-A550 HydrophobicContact CG-CB 4Å; A534-A550 HydrophobicContact CB-CB 4.01Å; V547-A550 WeakPolarHBondContact O-CB 3.22Å; V547-A550 PolarHBondContact O-N 2.76Å; Y548-A550 PolarHBondContact O-N 2.77Å; Y548-A550 VanDerWaalsContact O-N 3.16Å
551	Y	97.9	Very high	97.3	Very high	49 Å²	49	48.5 Å²	48.5	19%	0.192	23%	0.23	C	C	.	.	S	Bend	trans	-103.5	-10.1	180	-71.5	-90.8	0	0	0	113.7	A452 E453 V530 Y548 R549	A452-Y551 HydrophobicContact CB-CD2 4.01Å; A452-Y551 HydrophobicContact CB-CE2 3.96Å; E453-Y551 HydrophobicContact CB-CD1 4.39Å; E453-Y551 HydrophobicContact CB-CE1 3.74Å; E453-Y551 HydrophobicContact CG-CD1 4.46Å; E453-Y551 HydrophobicContact CG-CE1 3.85Å; E453-Y551 WeakPolarHBondContact OE2-CE1 3.36Å; E453-Y551 PolarHBondContact OE2-OH 2.86Å; V530-Y551 HydrophobicContact CG1-CD2 4.14Å; V530-Y551 HydrophobicContact CG1-CE2 3.39Å; Y548-Y551 PolarHBondContact O-N 2.69Å; R549-Y551 VanDerWaalsContact C-N 3.25Å; R549-Y551 PolarHBondContact O-N 2.84Å
552	I	95.4	Very high	97.3	Very high	100 Å²	100	45 Å²	45	51%	0.513	21%	0.209	S	C	.	.			trans	-68.2	134.1	178.6	-62.1	176.2	0	0	0	109.2	Y548 R549	Y548-I552 HydrophobicContact CD1-CD1 4.04Å; Y548-I552 HydrophobicContact CD1-CG1 4.32Å; Y548-I552 HydrophobicContact CE1-CD1 3.81Å; Y548-I552 HydrophobicContact CE1-CG1 4.02Å; R549-I552 HydrophobicContact CB-CD1 4.41Å; R549-I552 HydrophobicContact CG-CD1 4.12Å
553	H	85.8	Confident	97.1	Very high	221 Å²	221	45.2 Å²	45.2	100%	1.023	21%	0.207	S	C	*	.			trans	-76.1	0	-179.5	-75.9	-82.5	0	0	0	114.1

Retrieved 553 of 553 residues in 153.7 ms (Link to these results)

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