A0A077Z510_TRITR Loading...

ATP synthase subunit beta

Produces ATP from ADP in the presence of a proton gradient across the membrane.

AlphaFold DB , UniProt , Accession A0A077Z510, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 460 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	69.6	Low	90.8	Very high	142 Å²	142	58.5 Å²	58.5	70%	0.7	33%	0.329	S	S	*	.				0	103.6	0	-69.6	-173.8	173.8	0	0	110.2	D71 E73	M1-D71 WeakPolarHBondContact CG-O 3.42Å; M1-E73 WeakPolarHBondContact CA-OE1 3.29Å; M1-E73 PolarHBondContact N-OE1 3.29Å
2	A	86.2	Confident	90.7	Very high	17 Å²	17	54.7 Å²	54.7	14%	0.14	31%	0.31	C	S	.	.			trans	-74.2	150.5	169	0	0	0	0	0	110.4	F18 A22 D71	A2-F18 HydrophobicContact CB-CD1 3.94Å; A2-F18 HydrophobicContact CB-CE1 4.26Å; A2-A22 HydrophobicContact CB-CB 3.64Å; A2-D71 HydrophobicContact CB-CB 4.45Å; A2-D71 PolarHBondContact O-N 3.47Å
3	T	92.6	Very high	91	Very high	74 Å²	74	50.6 Å²	50.6	45%	0.454	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.1	173.2	-52.2	0	0	0	0	108.6	D68 V69	T3-D68 HydrophobicContact CG2-CB 3.8Å; T3-V69 CarbonylContact C-O 3.39Å; T3-V69 WeakPolarHBondContact CA-O 3.4Å
4	G	94.2	Very high	91.4	Very high	1 Å²	1	47 Å²	47	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	177.9	172.6	0	0	0	0	0	111.9	E17 D68 V69	G4-E17 CarbonylContact C-O 3.36Å; G4-E17 WeakPolarHBondContact CA-O 3.21Å; G4-D68 WeakPolarHBondContact O-CA 3.24Å; G4-V69 PolarHBondContact N-O 3.24Å; G4-V69 PolarHBondContact O-N 2.94Å
5	K	96.4	Very high	91.8	Very high	111 Å²	111	44.2 Å²	44.2	48%	0.483	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.4	175.9	-65.6	-165.2	177.3	-156.4	0	111.9	V7 V16 E17 L67 D68	K5-V7 PolarHBondContact O-N 3.05Å; K5-V16 CarbonylContact O-C 3.58Å; K5-V16 WeakPolarHBondContact O-CA 3.41Å; K5-E17 PolarHBondContact N-O 2.69Å; K5-E17 PolarHBondContact O-N 2.77Å; K5-L67 WeakPolarHBondContact CA-O 3.35Å; K5-D68 VanDerWaalsContact CE-OD1 3.29Å; K5-D68 WeakPolarHBondContact CE-OD1 3.4Å; K5-D68 IonicContact NZ-OD1 2.76Å
6	I	96.9	Very high	92.1	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.015	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	121.7	173.3	-62.5	-173	0	0	0	109.4	V9 V14 V16 V32 L63 R65 G66 L67 V69	I6-V9 HydrophobicContact CG2-CG2 3.61Å; I6-V14 HydrophobicContact CB-CG1 4.47Å; I6-V14 HydrophobicContact CD1-CG1 3.84Å; I6-V14 HydrophobicContact CG1-CG1 3.94Å; I6-V14 HydrophobicContact CG2-CG1 3.87Å; I6-V16 HydrophobicContact CG1-CG2 4.43Å; I6-V32 HydrophobicContact CD1-CG2 4.02Å; I6-L63 HydrophobicContact CD1-CD1 4.46Å; I6-L63 HydrophobicContact CD1-CD2 4.11Å; I6-R65 CarbonylContact O-C 3.58Å; I6-R65 VanDerWaalsContact O-CA 3.32Å; I6-R65 WeakPolarHBondContact O-CA 3.42Å; I6-G66 PolarHBondContact O-N 2.87Å; I6-L67 HydrophobicContact CD1-CB 4.13Å; I6-L67 HydrophobicContact CD1-CD1 4.44Å; I6-L67 HydrophobicContact CG1-CB 4.34Å; I6-L67 PolarHBondContact N-O 3.46Å; I6-V69 HydrophobicContact CD1-CG2 4.15Å; I6-V69 HydrophobicContact CG1-CG2 3.47Å; I6-V69 VanDerWaalsContact CG1-CG2 3.47Å
7	V	96.4	Very high	92.4	Very high	42 Å²	42	44.6 Å²	44.6	26%	0.255	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-29.5	175.9	-68.2	0	0	0	0	112.3	K5 D15 E17 I51 R65	K5-V7 PolarHBondContact O-N 3.05Å; V7-D15 HydrophobicContact CG2-CB 3.93Å; V7-D15 WeakPolarHBondContact CG2-O 3.47Å; V7-D15 PolarHBondContact N-O 3.21Å; V7-E17 HydrophobicContact CG1-CB 3.63Å; V7-I51 HydrophobicContact CG2-CG2 4.35Å; V7-R65 WeakPolarHBondContact O-CD 3.49Å; V7-R65 WeakPolarHBondContact O-CG 3.48Å; V7-R65 PolarHBondContact O-NE 3.2Å
8	Q	94.8	Very high	92.7	Very high	75 Å²	75	42.4 Å²	42.4	35%	0.35	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	145.6	-179	-172	168.1	9.9	0	0	111.7	I10 V14 D15	Q8-I10 HydrophobicContact CG-CD1 4.17Å; Q8-I10 HydrophobicContact CG-CG1 4.04Å; Q8-V14 WeakPolarHBondContact O-CA 3.48Å; Q8-D15 HydrophobicContact CB-CB 4.11Å; Q8-D15 PolarHBondContact N-O 3.43Å; Q8-D15 PolarHBondContact O-N 3.1Å
9	V	93.6	Very high	92.7	Very high	47 Å²	47	43.4 Å²	43.4	29%	0.285	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	121.5	174.9	-177.1	0	0	0	0	107.1	I6 V14 L63	I6-V9 HydrophobicContact CG2-CG2 3.61Å; V9-V14 HydrophobicContact CG1-CG2 4.39Å; V9-V14 HydrophobicContact CG2-CG1 4.39Å; V9-L63 HydrophobicContact CG2-CB 4.19Å
10	I	90.3	Very high	92.5	Very high	83 Å²	83	49.1 Å²	49.1	43%	0.426	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	93.1	176.3	-58.5	162.2	0	0	0	107.7	Q8 A12 V13	Q8-I10 HydrophobicContact CG-CD1 4.17Å; Q8-I10 HydrophobicContact CG-CG1 4.04Å; I10-A12 PolarHBondContact O-N 2.79Å; I10-V13 PolarHBondContact N-O 2.97Å; I10-V13 PolarHBondContact O-N 2.73Å
11	G	87.8	Confident	92.4	Very high	49 Å²	49	54 Å²	54	51%	0.505	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	-126.8	-171.1	0	0	0	0	0	110.3	V13 S60	G11-V13 VanDerWaalsContact C-N 3.27Å; G11-V13 PolarHBondContact O-N 3.42Å; G11-S60 WeakPolarHBondContact O-CB 3.34Å; G11-S60 PolarHBondContact O-OG 3.13Å
12	A	90.1	Very high	93.4	Very high	12 Å²	12	48.8 Å²	48.8	10%	0.099	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-8.1	178	0	0	0	0	0	114.5	I10 I55 A56 L258	I10-A12 PolarHBondContact O-N 2.79Å; A12-I55 HydrophobicContact CB-CD1 3.84Å; A12-A56 PolarHBondContact O-N 3.37Å; A12-L258 HydrophobicContact CB-CD1 4.32Å
13	V	94.7	Very high	93.8	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.9	178.5	176.7	0	0	0	0	109.8	I10 G11 R53 T54 I55 L258 L259	I10-V13 PolarHBondContact N-O 2.97Å; I10-V13 PolarHBondContact O-N 2.73Å; G11-V13 VanDerWaalsContact C-N 3.27Å; G11-V13 PolarHBondContact O-N 3.42Å; V13-R53 HydrophobicContact CG1-CG 3.71Å; V13-T54 WeakPolarHBondContact CA-O 3.23Å; V13-I55 HydrophobicContact CG2-CD1 3.99Å; V13-L258 HydrophobicContact CG2-CB 3.68Å; V13-L259 HydrophobicContact CG2-CD2 4.36Å
14	V	95.9	Very high	93.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121	-179.2	-176.5	0	0	0	0	108.3	I6 Q8 V9 V16 L41 T54 L63	I6-V14 HydrophobicContact CB-CG1 4.47Å; I6-V14 HydrophobicContact CD1-CG1 3.84Å; I6-V14 HydrophobicContact CG1-CG1 3.94Å; I6-V14 HydrophobicContact CG2-CG1 3.87Å; Q8-V14 WeakPolarHBondContact O-CA 3.48Å; V9-V14 HydrophobicContact CG1-CG2 4.39Å; V9-V14 HydrophobicContact CG2-CG1 4.39Å; V14-V16 HydrophobicContact CG1-CG2 4.01Å; V14-L41 HydrophobicContact CB-CD1 4.09Å; V14-L41 HydrophobicContact CB-CD2 4.4Å; V14-L41 HydrophobicContact CG1-CD1 3.94Å; V14-L41 HydrophobicContact CG2-CD2 4.14Å; V14-T54 PolarHBondContact N-O 2.88Å; V14-T54 WeakPolarHBondContact O-CB 3.21Å; V14-T54 PolarHBondContact O-N 3.42Å; V14-T54 PolarHBondContact O-OG1 3.41Å; V14-L63 HydrophobicContact CG2-CD1 3.73Å
15	D	97.2	Very high	93.9	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.027	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130.3	173.1	-63.4	-21.2	0	0	0	108.7	V7 Q8 I51 V52 R53	V7-D15 HydrophobicContact CG2-CB 3.93Å; V7-D15 WeakPolarHBondContact CG2-O 3.47Å; V7-D15 PolarHBondContact N-O 3.21Å; Q8-D15 HydrophobicContact CB-CB 4.11Å; Q8-D15 PolarHBondContact N-O 3.43Å; Q8-D15 PolarHBondContact O-N 3.1Å; D15-I51 HydrophobicContact CB-CG2 4.09Å; D15-V52 WeakPolarHBondContact CA-O 3.45Å; D15-R53 WeakPolarHBondContact OD1-CA 3.38Å; D15-R53 VanDerWaalsContact OD1-CB 3.29Å; D15-R53 WeakPolarHBondContact OD1-CB 3.28Å; D15-R53 VanDerWaalsContact OD1-CG 3.29Å; D15-R53 WeakPolarHBondContact OD1-CG 3.39Å; D15-R53 IonicContact OD1-CZ 3.41Å; D15-R53 IonicContact OD1-NE 3.76Å; D15-R53 PolarHBondContact OD1-NE 2.9Å; D15-R53 IonicContact OD1-NH2 3.65Å; D15-R53 IonicContact OD2-CZ 3.62Å; D15-R53 IonicContact OD2-NE 3.25Å; D15-R53 IonicContact OD2-NH2 2.66Å; D15-R53 PolarHBondContact OD2-NH2 3.34Å
16	V	97.5	Very high	93.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.3	-174.8	-172	0	0	0	0	108.9	K5 I6 V14 F18 L30 L41 I51 V52 T54 V69	K5-V16 CarbonylContact O-C 3.58Å; K5-V16 WeakPolarHBondContact O-CA 3.41Å; I6-V16 HydrophobicContact CG1-CG2 4.43Å; V14-V16 HydrophobicContact CG1-CG2 4.01Å; V16-F18 HydrophobicContact CB-CD2 4.39Å; V16-F18 HydrophobicContact CB-CE2 3.93Å; V16-F18 HydrophobicContact CG1-CD2 3.89Å; V16-F18 HydrophobicContact CG1-CE2 3.35Å; V16-F18 HydrophobicContact CG1-CZ 4.04Å; V16-L30 HydrophobicContact CG2-CD1 4.4Å; V16-L41 HydrophobicContact CG2-CD1 4.15Å; V16-I51 WeakPolarHBondContact O-CA 3.4Å; V16-V52 HydrophobicContact CB-CG2 4.09Å; V16-V52 PolarHBondContact N-O 3.09Å; V16-V52 WeakPolarHBondContact O-CG2 3.22Å; V16-V52 PolarHBondContact O-N 2.89Å; V16-T54 HydrophobicContact CG2-CG2 4.37Å; V16-V69 HydrophobicContact CG1-CB 3.68Å; V16-V69 HydrophobicContact CG1-CG1 4.05Å; V16-V69 HydrophobicContact CG1-CG2 3.74Å; V16-V69 HydrophobicContact CG2-CG1 4.35Å; V16-V69 HydrophobicContact CG2-CG2 4.06Å
17	E	97.3	Very high	93.7	Very high	95 Å²	95	56 Å²	56	44%	0.444	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.7	176.8	-176	178.1	-157	0	0	110.1	G4 K5 V7 I51	G4-E17 CarbonylContact C-O 3.36Å; G4-E17 WeakPolarHBondContact CA-O 3.21Å; K5-E17 PolarHBondContact N-O 2.69Å; K5-E17 PolarHBondContact O-N 2.77Å; V7-E17 HydrophobicContact CG1-CB 3.63Å; E17-I51 HydrophobicContact CB-CG1 4.17Å; E17-I51 HydrophobicContact CG-CG1 4.17Å
18	F	96.7	Very high	93.7	Very high	5 Å²	5	54.3 Å²	54.3	2%	0.022	29%	0.287	C	S	.	.			trans	-107.3	161.2	172.6	-76.9	-95.7	0	0	0	110.8	A2 V16 P24 L30 G50 V52 V69 D71	A2-F18 HydrophobicContact CB-CD1 3.94Å; A2-F18 HydrophobicContact CB-CE1 4.26Å; V16-F18 HydrophobicContact CB-CD2 4.39Å; V16-F18 HydrophobicContact CB-CE2 3.93Å; V16-F18 HydrophobicContact CG1-CD2 3.89Å; V16-F18 HydrophobicContact CG1-CE2 3.35Å; V16-F18 HydrophobicContact CG1-CZ 4.04Å; F18-P24 HydrophobicContact CD1-CG 4.05Å; F18-P24 HydrophobicContact CD2-CG 3.79Å; F18-P24 HydrophobicContact CE1-CG 3.94Å; F18-P24 HydrophobicContact CE2-CG 3.66Å; F18-P24 HydrophobicContact CG-CG 3.98Å; F18-P24 HydrophobicContact CZ-CG 3.75Å; F18-L30 HydrophobicContact CE2-CD1 3.76Å; F18-L30 HydrophobicContact CE2-CD2 4.39Å; F18-L30 HydrophobicContact CZ-CD1 3.98Å; F18-L30 HydrophobicContact CZ-CD2 4.02Å; F18-G50 PolarHBondContact N-O 3.42Å; F18-G50 WeakPolarHBondContact O-CA 3.47Å; F18-V52 HydrophobicContact CD2-CG2 3.97Å; F18-V52 HydrophobicContact CE2-CG2 3.94Å; F18-V69 HydrophobicContact CZ-CG1 4.32Å; F18-D71 HydrophobicContact CE1-CB 3.87Å; F18-D71 HydrophobicContact CZ-CB 4.26Å
19	P	93.6	Very high	93.8	Very high	62 Å²	62	50.8 Å²	50.8	40%	0.403	27%	0.271	S	S	.	.			trans	-52.9	140.4	165.3	-23.9	34.9	0	0	0	111.5	D21 A22	P19-D21 VanDerWaalsContact CB-OD1 3.26Å; P19-D21 WeakPolarHBondContact CB-OD1 3.44Å; P19-D21 PolarHBondContact O-N 3Å; P19-D21 VanDerWaalsContact O-N 3.16Å; P19-A22 HydrophobicContact CB-CB 4.38Å; P19-A22 CarbonylContact O-C 3.6Å; P19-A22 PolarHBondContact O-N 3.13Å
20	Q	88.6	Confident	94	Very high	157 Å²	157	48.6 Å²	48.6	73%	0.734	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.9	-173.7	-69.1	-173.1	1.7	0	0	114.1
21	D	89.8	Confident	94.2	Very high	151 Å²	151	46.1 Å²	46.1	81%	0.807	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-5.6	176.8	60	-34.5	0	0	0	113.4	P19	P19-D21 VanDerWaalsContact CB-OD1 3.26Å; P19-D21 WeakPolarHBondContact CB-OD1 3.44Å; P19-D21 PolarHBondContact O-N 3Å; P19-D21 VanDerWaalsContact O-N 3.16Å
22	A	91.4	Very high	94.6	Very high	33 Å²	33	43.8 Å²	43.8	27%	0.273	22%	0.22	S	C	.	.	S	Bend	trans	-137.1	44	-174.6	0	0	0	0	0	112.1	A2 P19 P24	A2-A22 HydrophobicContact CB-CB 3.64Å; P19-A22 HydrophobicContact CB-CB 4.38Å; P19-A22 CarbonylContact O-C 3.6Å; P19-A22 PolarHBondContact O-N 3.13Å; A22-P24 WeakPolarHBondContact O-CD 3.21Å
23	V	93.8	Very high	94.7	Very high	45 Å²	45	48.1 Å²	48.1	27%	0.273	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-77.7	122.4	179.4	-174.9	0	0	0	0	110.1	Q46 V52	V23-Q46 HydrophobicContact CG1-CG 4.15Å; V23-V52 HydrophobicContact CG1-CG1 3.6Å
24	P	94.5	Very high	94.3	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-61.2	149.1	177.6	-23.4	33.4	0	0	0	112.5	F18 A22 D28 L30 V43 Q46 D71	F18-P24 HydrophobicContact CD1-CG 4.05Å; F18-P24 HydrophobicContact CD2-CG 3.79Å; F18-P24 HydrophobicContact CE1-CG 3.94Å; F18-P24 HydrophobicContact CE2-CG 3.66Å; F18-P24 HydrophobicContact CG-CG 3.98Å; F18-P24 HydrophobicContact CZ-CG 3.75Å; A22-P24 WeakPolarHBondContact O-CD 3.21Å; P24-D28 HydrophobicContact CB-CB 4.35Å; P24-L30 HydrophobicContact CB-CD2 3.91Å; P24-L30 HydrophobicContact CG-CD2 3.8Å; P24-V43 HydrophobicContact CB-CG2 4.04Å; P24-Q46 PolarHBondContact O-NE2 3.29Å; P24-D71 HydrophobicContact CG-CB 4.04Å
25	R	94.2	Very high	93.7	Very high	149 Å²	149	52 Å²	52	56%	0.562	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-79.4	164	179.4	-56.2	168.1	-65.1	-173.2	0.3	110.8	Y27 D28 V43 E73	R25-Y27 PolarHBondContact O-N 2.9Å; R25-D28 WeakPolarHBondContact CA-OD2 3.18Å; R25-D28 WeakPolarHBondContact CB-OD2 3.04Å; R25-D28 IonicContact CZ-OD1 3.15Å; R25-D28 IonicContact CZ-OD2 2.67Å; R25-D28 PolarHBondContact N-OD2 3.48Å; R25-D28 IonicContact NE-OD1 2.8Å; R25-D28 IonicContact NE-OD2 3.04Å; R25-D28 PolarHBondContact NE-OD2 3.26Å; R25-D28 VanDerWaalsContact NE-OD2 3.08Å; R25-D28 IonicContact NH2-OD1 3.77Å; R25-D28 PolarHBondContact NH2-OD1 2.95Å; R25-D28 VanDerWaalsContact NH2-OD1 3.12Å; R25-D28 IonicContact NH2-OD2 3.74Å; R25-D28 WeakPolarHBondContact O-CB 3.37Å; R25-D28 PolarHBondContact O-N 3.04Å; R25-D28 VanDerWaalsContact O-N 3.15Å; R25-V43 WeakPolarHBondContact O-CB 3.44Å; R25-V43 WeakPolarHBondContact O-CG1 3.49Å; R25-E73 PolarHBondContact NH2-O 3Å; R25-E73 VanDerWaalsContact NH2-O 3.16Å
26	V	94.7	Very high	92.8	Very high	61 Å²	61	59.8 Å²	59.8	37%	0.37	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	136.2	170.6	-177.8	0	0	0	0	109.1	D28	V26-D28 VanDerWaalsContact C-N 3.26Å; V26-D28 PolarHBondContact O-N 3.19Å
27	Y	95.1	Very high	92.3	Very high	103 Å²	103	66.5 Å²	66.5	40%	0.404	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	-3	-173.5	-48.4	-54.5	0	0	0	117.1	R25 V43 P75 H111	R25-Y27 PolarHBondContact O-N 2.9Å; Y27-V43 WeakPolarHBondContact CA-O 3.39Å; Y27-V43 PolarHBondContact N-O 3.43Å; Y27-P75 VanDerWaalsContact O-CA 3.22Å; Y27-P75 WeakPolarHBondContact O-CA 3.4Å; Y27-P75 WeakPolarHBondContact O-CB 3.3Å; Y27-H111 AromaticContact CD1-CE1 3.79Å; Y27-H111 AromaticContact CD1-NE2 3.73Å; Y27-H111 AromaticContact CG-CD2 3.98Å
28	D	96.4	Very high	92	Very high	6 Å²	6	68.2 Å²	68.2	3%	0.032	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	141.8	170	-72.4	-21.3	0	0	0	109.4	P24 R25 V26 V43	P24-D28 HydrophobicContact CB-CB 4.35Å; R25-D28 WeakPolarHBondContact CA-OD2 3.18Å; R25-D28 WeakPolarHBondContact CB-OD2 3.04Å; R25-D28 IonicContact CZ-OD1 3.15Å; R25-D28 IonicContact CZ-OD2 2.67Å; R25-D28 PolarHBondContact N-OD2 3.48Å; R25-D28 IonicContact NE-OD1 2.8Å; R25-D28 IonicContact NE-OD2 3.04Å; R25-D28 PolarHBondContact NE-OD2 3.26Å; R25-D28 VanDerWaalsContact NE-OD2 3.08Å; R25-D28 IonicContact NH2-OD1 3.77Å; R25-D28 PolarHBondContact NH2-OD1 2.95Å; R25-D28 VanDerWaalsContact NH2-OD1 3.12Å; R25-D28 IonicContact NH2-OD2 3.74Å; R25-D28 WeakPolarHBondContact O-CB 3.37Å; R25-D28 PolarHBondContact O-N 3.04Å; R25-D28 VanDerWaalsContact O-N 3.15Å; V26-D28 VanDerWaalsContact C-N 3.26Å; V26-D28 PolarHBondContact O-N 3.19Å; D28-V43 WeakPolarHBondContact O-CG2 3.36Å; D28-V43 PolarHBondContact O-N 3.14Å
29	A	96.8	Very high	91.9	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.008	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	134.8	178.3	0	0	0	0	0	109.9	V40 L72 H74 I76	A29-V40 HydrophobicContact CB-CG1 4.2Å; A29-L72 HydrophobicContact CB-CD1 3.97Å; A29-L72 WeakPolarHBondContact O-CB 3.28Å; A29-L72 WeakPolarHBondContact O-CG 3.47Å; A29-L72 PolarHBondContact O-N 2.98Å; A29-L72 VanDerWaalsContact O-N 3.08Å; A29-H74 WeakPolarHBondContact CB-O 3.35Å; A29-H74 PolarHBondContact N-O 3.5Å; A29-I76 HydrophobicContact CB-CG1 3.88Å
30	L	97	Very high	92	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	148.4	174.9	-44.4	-177.7	0	0	0	109.9	V16 F18 P24 V40 L41 V43 V52 T54 V69 K70 D71	V16-L30 HydrophobicContact CG2-CD1 4.4Å; F18-L30 HydrophobicContact CE2-CD1 3.76Å; F18-L30 HydrophobicContact CE2-CD2 4.39Å; F18-L30 HydrophobicContact CZ-CD1 3.98Å; F18-L30 HydrophobicContact CZ-CD2 4.02Å; P24-L30 HydrophobicContact CB-CD2 3.91Å; P24-L30 HydrophobicContact CG-CD2 3.8Å; L30-V40 CarbonylContact O-C 3.53Å; L30-V40 WeakPolarHBondContact O-CA 3.37Å; L30-L41 HydrophobicContact CB-CB 4.24Å; L30-L41 PolarHBondContact N-O 3.13Å; L30-L41 PolarHBondContact O-N 2.91Å; L30-V43 HydrophobicContact CD1-CG2 3.95Å; L30-V43 HydrophobicContact CD2-CG2 4.01Å; L30-V43 HydrophobicContact CG-CG2 3.88Å; L30-V52 HydrophobicContact CD1-CG2 4.19Å; L30-T54 HydrophobicContact CD1-CG2 3.71Å; L30-V69 HydrophobicContact CB-CG1 3.62Å; L30-V69 HydrophobicContact CD1-CG1 3.93Å; L30-V69 HydrophobicContact CG-CG1 4.4Å; L30-K70 CarbonylContact C-O 3.59Å; L30-K70 VanDerWaalsContact CA-O 3.24Å; L30-K70 WeakPolarHBondContact CA-O 3.46Å; L30-D71 HydrophobicContact CD2-CB 4.06Å
31	E	96.2	Very high	92.4	Very high	31 Å²	31	58.2 Å²	58.2	15%	0.145	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.1	178	-174.8	-176.4	84.7	0	0	110.5	R38 V69 K70 L72	E31-R38 HydrophobicContact CG-CG 3.99Å; E31-R38 VanDerWaalsContact OE2-CD 3.26Å; E31-R38 WeakPolarHBondContact OE2-CD 3.31Å; E31-R38 IonicContact OE2-CZ 3.86Å; E31-R38 VanDerWaalsContact OE2-CZ 3.25Å; E31-R38 IonicContact OE2-NE 2.75Å; E31-R38 PolarHBondContact OE2-NE 2.93Å; E31-R38 IonicContact OE2-NH1 3.39Å; E31-R38 PolarHBondContact OE2-NH1 3.38Å; E31-V69 CarbonylContact O-C 3.53Å; E31-V69 WeakPolarHBondContact O-CA 3.21Å; E31-K70 PolarHBondContact N-O 3.41Å; E31-K70 PolarHBondContact O-N 3.31Å; E31-K70 IonicContact OE1-NZ 3.86Å; E31-L72 HydrophobicContact CB-CD2 4.14Å; E31-L72 HydrophobicContact CB-CG 4.44Å
32	V	95.1	Very high	92.8	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.2	169.5	63.7	0	0	0	0	110.5	I6 N34 L39 L41 L63 L67 V69	I6-V32 HydrophobicContact CD1-CG2 4.02Å; V32-N34 PolarHBondContact O-N 2.97Å; V32-L39 HydrophobicContact CG1-CB 3.87Å; V32-L39 HydrophobicContact CG1-CD2 4.06Å; V32-L39 HydrophobicContact CG1-CG 4.22Å; V32-L39 PolarHBondContact N-O 3.4Å; V32-L39 PolarHBondContact O-N 2.83Å; V32-L41 HydrophobicContact CG1-CD1 4.12Å; V32-L41 HydrophobicContact CG1-CD2 4.4Å; V32-L41 HydrophobicContact CG1-CG 4.17Å; V32-L63 HydrophobicContact CG1-CD2 3.95Å; V32-L63 HydrophobicContact CG2-CD2 4.22Å; V32-L67 HydrophobicContact CG2-CB 4.24Å; V32-L67 HydrophobicContact CG2-CD1 4.4Å; V32-V69 HydrophobicContact CB-CG2 4.11Å; V32-V69 HydrophobicContact CG2-CG2 4.13Å
33	Q	91.6	Very high	93	Very high	102 Å²	102	49.4 Å²	49.4	48%	0.477	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	109.2	173.1	-170	67	29.9	0	0	109.4	G35 N36	Q33-G35 WeakPolarHBondContact CG-O 3.49Å; Q33-G35 PolarHBondContact NE2-O 3.47Å; Q33-N36 PolarHBondContact NE2-O 3.42Å
34	N	86.4	Confident	93.1	Very high	25 Å²	25	48 Å²	48	13%	0.134	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	87	176.1	-171.8	17.2	0	0	0	110	V32 N36 E37 D61 G62 L63	V32-N34 PolarHBondContact O-N 2.97Å; N34-N36 PolarHBondContact O-N 2.96Å; N34-N36 VanDerWaalsContact O-N 3.16Å; N34-E37 PolarHBondContact N-O 2.76Å; N34-E37 PolarHBondContact O-N 3.06Å; N34-E37 VanDerWaalsContact O-N 3.09Å; N34-D61 PolarHBondContact ND2-O 3.35Å; N34-G62 VanDerWaalsContact OD1-C 3.28Å; N34-G62 PolarHBondContact OD1-O 3.42Å; N34-L63 HydrophobicContact CB-CD2 3.91Å
35	G	83.3	Confident	93	Very high	59 Å²	59	50.8 Å²	50.8	61%	0.608	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	-116	-171.5	0	0	0	0	0	110.8	Q33	Q33-G35 WeakPolarHBondContact CG-O 3.49Å; Q33-G35 PolarHBondContact NE2-O 3.47Å
36	N	79.9	Confident	93	Very high	168 Å²	168	48.6 Å²	48.6	90%	0.898	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	-7.4	177.7	-68.2	-9.1	0	0	0	113.2	Q33 N34	Q33-N36 PolarHBondContact NE2-O 3.42Å; N34-N36 PolarHBondContact O-N 2.96Å; N34-N36 VanDerWaalsContact O-N 3.16Å
37	E	86	Confident	92.9	Very high	142 Å²	142	49.7 Å²	49.7	66%	0.664	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101	139.1	-176.4	-66.4	-179.1	-178.5	0	0	110.9	N34	N34-E37 PolarHBondContact N-O 2.76Å; N34-E37 PolarHBondContact O-N 3.06Å; N34-E37 VanDerWaalsContact O-N 3.09Å
38	R	90.8	Very high	92.7	Very high	130 Å²	130	46.9 Å²	46.9	49%	0.491	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.9	170.2	172.3	-179	144.7	143.7	-10.6	108.2	E31	E31-R38 HydrophobicContact CG-CG 3.99Å; E31-R38 VanDerWaalsContact OE2-CD 3.26Å; E31-R38 WeakPolarHBondContact OE2-CD 3.31Å; E31-R38 IonicContact OE2-CZ 3.86Å; E31-R38 VanDerWaalsContact OE2-CZ 3.25Å; E31-R38 IonicContact OE2-NE 2.75Å; E31-R38 PolarHBondContact OE2-NE 2.93Å; E31-R38 IonicContact OE2-NH1 3.39Å; E31-R38 PolarHBondContact OE2-NH1 3.38Å
39	L	94.5	Very high	92.4	Very high	10 Å²	10	49 Å²	49	5%	0.052	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.2	173.4	179.6	68.2	0	0	0	109.9	V32 L41 A56 G58 L63	V32-L39 HydrophobicContact CG1-CB 3.87Å; V32-L39 HydrophobicContact CG1-CD2 4.06Å; V32-L39 HydrophobicContact CG1-CG 4.22Å; V32-L39 PolarHBondContact N-O 3.4Å; V32-L39 PolarHBondContact O-N 2.83Å; L39-L41 HydrophobicContact CD2-CD2 3.93Å; L39-L41 HydrophobicContact CG-CD2 4.11Å; L39-A56 HydrophobicContact CD1-CB 4.37Å; L39-A56 HydrophobicContact CD2-CB 4.22Å; L39-G58 VanDerWaalsContact CD1-CA 3.49Å; L39-L63 HydrophobicContact CD2-CD1 3.72Å; L39-L63 HydrophobicContact CD2-CD2 4.09Å; L39-L63 HydrophobicContact CD2-CG 4.16Å
40	V	96.4	Very high	92.2	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.024	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.2	174.2	178.1	0	0	0	0	109.5	A29 L30 M57 I76 L92	A29-V40 HydrophobicContact CB-CG1 4.2Å; L30-V40 CarbonylContact O-C 3.53Å; L30-V40 WeakPolarHBondContact O-CA 3.37Å; V40-M57 HydrophobicContact CB-CB 4.39Å; V40-M57 PolarHBondContact O-N 2.88Å; V40-I76 HydrophobicContact CG1-CD1 4.36Å; V40-I76 HydrophobicContact CG1-CG1 4.23Å; V40-L92 HydrophobicContact CB-CD1 4Å; V40-L92 HydrophobicContact CB-CD2 4.02Å; V40-L92 HydrophobicContact CG1-CD2 4.07Å; V40-L92 HydrophobicContact CG2-CD1 3.7Å; V40-L92 HydrophobicContact CG2-CD2 4.24Å
41	L	96.7	Very high	92.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	139.5	172.1	-47.3	175.3	0	0	0	108.5	V14 V16 L30 V32 L39 T54 I55 A56 V69	V14-L41 HydrophobicContact CB-CD1 4.09Å; V14-L41 HydrophobicContact CB-CD2 4.4Å; V14-L41 HydrophobicContact CG1-CD1 3.94Å; V14-L41 HydrophobicContact CG2-CD2 4.14Å; V16-L41 HydrophobicContact CG2-CD1 4.15Å; L30-L41 HydrophobicContact CB-CB 4.24Å; L30-L41 PolarHBondContact N-O 3.13Å; L30-L41 PolarHBondContact O-N 2.91Å; V32-L41 HydrophobicContact CG1-CD1 4.12Å; V32-L41 HydrophobicContact CG1-CD2 4.4Å; V32-L41 HydrophobicContact CG1-CG 4.17Å; L39-L41 HydrophobicContact CD2-CD2 3.93Å; L39-L41 HydrophobicContact CG-CD2 4.11Å; L41-T54 HydrophobicContact CB-CG2 4.36Å; L41-I55 CarbonylContact C-O 3.53Å; L41-I55 WeakPolarHBondContact CA-O 3.04Å; L41-A56 HydrophobicContact CD2-CB 3.65Å; L41-V69 HydrophobicContact CD1-CG1 4.39Å
42	E	97.3	Very high	92.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.7	174.5	-170.2	-168.5	77.1	0	0	110.3	Q44 T54 I55 M57 I76 H111 R219	E42-Q44 PolarHBondContact O-N 3.18Å; E42-Q44 PolarHBondContact O-NE2 3.44Å; E42-Q44 VanDerWaalsContact O-NE2 3.09Å; E42-Q44 PolarHBondContact OE1-NE2 3.23Å; E42-T54 CarbonylContact O-C 3.56Å; E42-T54 WeakPolarHBondContact O-CA 3.48Å; E42-T54 WeakPolarHBondContact O-CB 3.47Å; E42-I55 HydrophobicContact CB-CG2 4.21Å; E42-I55 PolarHBondContact N-O 3.33Å; E42-I55 PolarHBondContact O-N 3.25Å; E42-M57 HydrophobicContact CB-CE 3.36Å; E42-M57 HydrophobicContact CG-CE 4.19Å; E42-I76 HydrophobicContact CB-CD1 4.2Å; E42-I76 HydrophobicContact CG-CD1 4.37Å; E42-H111 IonicContact OE1-NE2 3.45Å; E42-H111 IonicContact OE2-CD2 3.22Å; E42-H111 IonicContact OE2-CE1 3.81Å; E42-H111 IonicContact OE2-NE2 2.9Å; E42-H111 PolarHBondContact OE2-NE2 3.2Å; E42-R219 VanDerWaalsContact CD-NE 3.33Å; E42-R219 IonicContact OE1-CZ 3.65Å; E42-R219 IonicContact OE1-NE 3.59Å; E42-R219 PolarHBondContact OE1-NE 3.15Å; E42-R219 IonicContact OE1-NH2 3.75Å; E42-R219 PolarHBondContact OE1-NH2 3.17Å; E42-R219 IonicContact OE2-NE 2.81Å; E42-R219 PolarHBondContact OE2-NE 3Å
43	V	97.2	Very high	92.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	119.7	178.3	-179.2	0	0	0	0	110.5	P24 R25 Y27 D28 L30 V52 T54	P24-V43 HydrophobicContact CB-CG2 4.04Å; R25-V43 WeakPolarHBondContact O-CB 3.44Å; R25-V43 WeakPolarHBondContact O-CG1 3.49Å; Y27-V43 WeakPolarHBondContact CA-O 3.39Å; Y27-V43 PolarHBondContact N-O 3.43Å; D28-V43 WeakPolarHBondContact O-CG2 3.36Å; D28-V43 PolarHBondContact O-N 3.14Å; L30-V43 HydrophobicContact CD1-CG2 3.95Å; L30-V43 HydrophobicContact CD2-CG2 4.01Å; L30-V43 HydrophobicContact CG-CG2 3.88Å; V43-V52 HydrophobicContact CG1-CB 4.1Å; V43-V52 HydrophobicContact CG1-CG1 4.42Å; V43-V52 HydrophobicContact CG2-CG2 4.35Å; V43-T54 HydrophobicContact CG2-CG2 4.14Å
44	Q	94.9	Very high	92.5	Very high	16 Å²	16	47.3 Å²	47.3	8%	0.075	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-36.3	176.8	-60.1	-52.3	-65.1	0	0	112.4	E42 R53 I55 L259	E42-Q44 PolarHBondContact O-N 3.18Å; E42-Q44 PolarHBondContact O-NE2 3.44Å; E42-Q44 VanDerWaalsContact O-NE2 3.09Å; E42-Q44 PolarHBondContact OE1-NE2 3.23Å; Q44-R53 PolarHBondContact N-O 3.05Å; Q44-I55 HydrophobicContact CG-CB 4.09Å; Q44-I55 HydrophobicContact CG-CG2 3.98Å; Q44-L259 HydrophobicContact CB-CD1 3.96Å; Q44-L259 HydrophobicContact CB-CD2 3.89Å; Q44-L259 HydrophobicContact CG-CD1 4.05Å; Q44-L259 HydrophobicContact CG-CD2 4Å
45	Q	93.6	Very high	92.9	Very high	58 Å²	58	46.2 Å²	46.2	27%	0.271	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	149.5	-174	-60.5	179	-27.9	0	0	111.2	V52 R53	Q45-V52 CarbonylContact O-C 3.42Å; Q45-V52 WeakPolarHBondContact O-CA 3.3Å; Q45-R53 HydrophobicContact CB-CB 4.28Å; Q45-R53 PolarHBondContact N-O 3.17Å; Q45-R53 PolarHBondContact O-N 3.24Å
46	Q	93.6	Very high	93.5	Very high	104 Å²	104	43.4 Å²	43.4	49%	0.486	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	118	166.3	-64.6	178.1	-17.7	0	0	108.3	V23 P24 V52	V23-Q46 HydrophobicContact CG1-CG 4.15Å; P24-Q46 PolarHBondContact O-NE2 3.29Å; Q46-V52 HydrophobicContact CG-CG1 4.16Å
47	L	91.4	Very high	94.1	Very high	83 Å²	83	35.8 Å²	35.8	44%	0.435	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-13	-177.2	-60.7	-177.4	0	0	0	112.9	I51 R53	L47-I51 HydrophobicContact CB-CB 4.36Å; L47-I51 HydrophobicContact CB-CG2 4.37Å; L47-I51 HydrophobicContact CD1-CG2 4Å; L47-I51 PolarHBondContact N-O 2.95Å; L47-R53 HydrophobicContact CD1-CB 4.2Å; L47-R53 HydrophobicContact CD2-CB 4.38Å; L47-R53 HydrophobicContact CG-CB 4.18Å
48	G	91	Very high	94.4	Very high	45 Å²	45	29.7 Å²	29.7	46%	0.464	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	96.1	167.5	-173.5	0	0	0	0	0	112.6	G50 I51	G48-G50 PolarHBondContact O-N 2.84Å; G48-G50 VanDerWaalsContact O-N 3.16Å; G48-I51 PolarHBondContact O-N 3.27Å
49	G	91.3	Very high	94.4	Very high	49 Å²	49	26.4 Å²	26.4	51%	0.505	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	15.4	-177.6	0	0	0	0	0	114.9	I51	G49-I51 VanDerWaalsContact C-N 3.35Å
50	G	91.9	Very high	94.1	Very high	6 Å²	6	27 Å²	27	6%	0.062	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	-3.5	-172.8	0	0	0	0	0	114.4	F18 G48	F18-G50 PolarHBondContact N-O 3.42Å; F18-G50 WeakPolarHBondContact O-CA 3.47Å; G48-G50 PolarHBondContact O-N 2.84Å; G48-G50 VanDerWaalsContact O-N 3.16Å
51	I	96.1	Very high	93.8	Very high	50 Å²	50	32.9 Å²	32.9	26%	0.256	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	127.5	-179.5	-55.8	176.6	0	0	0	110.2	V7 D15 V16 E17 L47 G48 G49	V7-I51 HydrophobicContact CG2-CG2 4.35Å; D15-I51 HydrophobicContact CB-CG2 4.09Å; V16-I51 WeakPolarHBondContact O-CA 3.4Å; E17-I51 HydrophobicContact CB-CG1 4.17Å; E17-I51 HydrophobicContact CG-CG1 4.17Å; L47-I51 HydrophobicContact CB-CB 4.36Å; L47-I51 HydrophobicContact CB-CG2 4.37Å; L47-I51 HydrophobicContact CD1-CG2 4Å; L47-I51 PolarHBondContact N-O 2.95Å; G48-I51 PolarHBondContact O-N 3.27Å; G49-I51 VanDerWaalsContact C-N 3.35Å
52	V	96.5	Very high	93.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	141	170.4	-59.1	0	0	0	0	110.1	D15 V16 F18 V23 L30 V43 Q45 Q46 T54	D15-V52 WeakPolarHBondContact CA-O 3.45Å; V16-V52 HydrophobicContact CB-CG2 4.09Å; V16-V52 PolarHBondContact N-O 3.09Å; V16-V52 WeakPolarHBondContact O-CG2 3.22Å; V16-V52 PolarHBondContact O-N 2.89Å; F18-V52 HydrophobicContact CD2-CG2 3.97Å; F18-V52 HydrophobicContact CE2-CG2 3.94Å; V23-V52 HydrophobicContact CG1-CG1 3.6Å; L30-V52 HydrophobicContact CD1-CG2 4.19Å; V43-V52 HydrophobicContact CG1-CB 4.1Å; V43-V52 HydrophobicContact CG1-CG1 4.42Å; V43-V52 HydrophobicContact CG2-CG2 4.35Å; Q45-V52 CarbonylContact O-C 3.42Å; Q45-V52 WeakPolarHBondContact O-CA 3.3Å; Q46-V52 HydrophobicContact CG-CG1 4.16Å; V52-T54 HydrophobicContact CG2-CG2 4.05Å
53	R	96.8	Very high	93.1	Very high	45 Å²	45	36.1 Å²	36.1	17%	0.17	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.6	173.4	175.1	158.8	-69.6	172.1	2.9	109.5	V13 D15 Q44 Q45 L47 L259	V13-R53 HydrophobicContact CG1-CG 3.71Å; D15-R53 WeakPolarHBondContact OD1-CA 3.38Å; D15-R53 VanDerWaalsContact OD1-CB 3.29Å; D15-R53 WeakPolarHBondContact OD1-CB 3.28Å; D15-R53 VanDerWaalsContact OD1-CG 3.29Å; D15-R53 WeakPolarHBondContact OD1-CG 3.39Å; D15-R53 IonicContact OD1-CZ 3.41Å; D15-R53 IonicContact OD1-NE 3.76Å; D15-R53 PolarHBondContact OD1-NE 2.9Å; D15-R53 IonicContact OD1-NH2 3.65Å; D15-R53 IonicContact OD2-CZ 3.62Å; D15-R53 IonicContact OD2-NE 3.25Å; D15-R53 IonicContact OD2-NH2 2.66Å; D15-R53 PolarHBondContact OD2-NH2 3.34Å; Q44-R53 PolarHBondContact N-O 3.05Å; Q45-R53 HydrophobicContact CB-CB 4.28Å; Q45-R53 PolarHBondContact N-O 3.17Å; Q45-R53 PolarHBondContact O-N 3.24Å; L47-R53 HydrophobicContact CD1-CB 4.2Å; L47-R53 HydrophobicContact CD2-CB 4.38Å; L47-R53 HydrophobicContact CG-CB 4.18Å; R53-L259 HydrophobicContact CG-CD2 3.7Å; R53-L259 PolarHBondContact NH1-O 2.69Å
54	T	96.7	Very high	92.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	160.3	-173.8	73.8	0	0	0	0	111.4	V13 V14 V16 L30 L41 E42 V43 V52	V13-T54 WeakPolarHBondContact CA-O 3.23Å; V14-T54 PolarHBondContact N-O 2.88Å; V14-T54 WeakPolarHBondContact O-CB 3.21Å; V14-T54 PolarHBondContact O-N 3.42Å; V14-T54 PolarHBondContact O-OG1 3.41Å; V16-T54 HydrophobicContact CG2-CG2 4.37Å; L30-T54 HydrophobicContact CD1-CG2 3.71Å; L41-T54 HydrophobicContact CB-CG2 4.36Å; E42-T54 CarbonylContact O-C 3.56Å; E42-T54 WeakPolarHBondContact O-CA 3.48Å; E42-T54 WeakPolarHBondContact O-CB 3.47Å; V43-T54 HydrophobicContact CG2-CG2 4.14Å; V52-T54 HydrophobicContact CG2-CG2 4.05Å
55	I	95.7	Very high	92.7	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.5	169.3	-166.3	72.2	0	0	0	109.1	A12 V13 L41 E42 Q44 M57 V255 L258	A12-I55 HydrophobicContact CB-CD1 3.84Å; V13-I55 HydrophobicContact CG2-CD1 3.99Å; L41-I55 CarbonylContact C-O 3.53Å; L41-I55 WeakPolarHBondContact CA-O 3.04Å; E42-I55 HydrophobicContact CB-CG2 4.21Å; E42-I55 PolarHBondContact N-O 3.33Å; E42-I55 PolarHBondContact O-N 3.25Å; Q44-I55 HydrophobicContact CG-CB 4.09Å; Q44-I55 HydrophobicContact CG-CG2 3.98Å; I55-M57 HydrophobicContact CG2-CE 3.62Å; I55-V255 HydrophobicContact CD1-CG1 4.48Å; I55-V255 HydrophobicContact CD1-CG2 4.46Å; I55-V255 HydrophobicContact CG1-CG1 4.49Å; I55-V255 HydrophobicContact CG1-CG2 4.38Å; I55-L258 HydrophobicContact CD1-CD1 4.3Å
56	A	94.8	Very high	92.7	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.4	177.1	0	0	0	0	0	111.8	A12 L39 L41 G58	A12-A56 PolarHBondContact O-N 3.37Å; L39-A56 HydrophobicContact CD1-CB 4.37Å; L39-A56 HydrophobicContact CD2-CB 4.22Å; L41-A56 HydrophobicContact CD2-CB 3.65Å; A56-G58 VanDerWaalsContact C-N 3.25Å; A56-G58 PolarHBondContact O-N 3.31Å
57	M	93.9	Very high	92.7	Very high	7 Å²	7	49.6 Å²	49.6	3%	0.034	29%	0.288	C	S	.	.	S	Bend	trans	-93.3	35.9	174.7	-59	-60.2	169.6	0	0	112	V40 E42 I55 I76 L92 G215 N216 R219	V40-M57 HydrophobicContact CB-CB 4.39Å; V40-M57 PolarHBondContact O-N 2.88Å; E42-M57 HydrophobicContact CB-CE 3.36Å; E42-M57 HydrophobicContact CG-CE 4.19Å; I55-M57 HydrophobicContact CG2-CE 3.62Å; M57-I76 HydrophobicContact CE-CD1 3.89Å; M57-I76 HydrophobicContact CG-CD1 3.81Å; M57-I76 HydrophobicContact SD-CD1 4.33Å; M57-L92 HydrophobicContact CB-CD2 3.98Å; M57-L92 HydrophobicContact CG-CD2 4.27Å; M57-G215 VanDerWaalsContact SD-C 3.58Å; M57-N216 WeakPolarHBondContact CA-OD1 3.28Å; M57-N216 PolarHBondContact O-ND2 2.99Å; M57-N216 PolarHBondContact O-OD1 2.79Å; M57-R219 HydrophobicContact CE-CG 3.68Å; M57-R219 HydrophobicContact SD-CG 4.17Å
58	G	91.7	Very high	92.9	Very high	15 Å²	15	50.2 Å²	50.2	16%	0.155	29%	0.291	C	S	.	.	S	Bend	trans	174.8	-177.6	-174.6	0	0	0	0	0	110.6	L39 A56 S60 P213 N216	L39-G58 VanDerWaalsContact CD1-CA 3.49Å; A56-G58 VanDerWaalsContact C-N 3.25Å; A56-G58 PolarHBondContact O-N 3.31Å; G58-S60 PolarHBondContact O-N 3.43Å; G58-P213 VanDerWaalsContact C-CG 3.47Å; G58-P213 VanDerWaalsContact O-CG 3.25Å; G58-P213 WeakPolarHBondContact O-CG 3.4Å; G58-N216 PolarHBondContact N-OD1 2.91Å
59	S	90.6	Very high	93.2	Very high	61 Å²	61	48 Å²	48	43%	0.427	27%	0.269	S	S	.	.			trans	-64.8	127.3	-179.5	-173.7	0	0	0	0	111.1	D61	S59-D61 WeakPolarHBondContact OG-CB 3.34Å; S59-D61 VanDerWaalsContact OG-CG 3.27Å; S59-D61 PolarHBondContact OG-N 2.81Å; S59-D61 PolarHBondContact OG-OD2 3.4Å; S59-D61 VanDerWaalsContact OG-OD2 3.11Å
60	S	88.5	Confident	93.4	Very high	22 Å²	22	50.6 Å²	50.6	15%	0.154	27%	0.267	C	S	.	.			trans	-80.7	-2.4	171.8	54.1	0	0	0	0	112.8	G11 G58 G62 L63	G11-S60 WeakPolarHBondContact O-CB 3.34Å; G11-S60 PolarHBondContact O-OG 3.13Å; G58-S60 PolarHBondContact O-N 3.43Å; S60-G62 PolarHBondContact O-N 2.91Å; S60-L63 WeakPolarHBondContact O-CB 3.14Å; S60-L63 WeakPolarHBondContact O-CG 3.49Å; S60-L63 PolarHBondContact O-N 3.37Å
61	D	89.5	Confident	93.5	Very high	127 Å²	127	50.8 Å²	50.8	68%	0.679	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	128.2	-177.6	-67.4	-28.9	0	0	0	110.8	N34 S59	N34-D61 PolarHBondContact ND2-O 3.35Å; S59-D61 WeakPolarHBondContact OG-CB 3.34Å; S59-D61 VanDerWaalsContact OG-CG 3.27Å; S59-D61 PolarHBondContact OG-N 2.81Å; S59-D61 PolarHBondContact OG-OD2 3.4Å; S59-D61 VanDerWaalsContact OG-OD2 3.11Å
62	G	87.8	Confident	93.5	Very high	48 Å²	48	49.6 Å²	49.6	50%	0.495	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	-11.2	-178.6	0	0	0	0	0	115	N34 S60 R64	N34-G62 VanDerWaalsContact OD1-C 3.28Å; N34-G62 PolarHBondContact OD1-O 3.42Å; S60-G62 PolarHBondContact O-N 2.91Å; G62-R64 WeakPolarHBondContact O-CG 3.44Å
63	L	91.1	Very high	93.3	Very high	20 Å²	20	54.5 Å²	54.5	11%	0.105	28%	0.283	C	S	.	.			trans	-61.8	142.2	173.3	-69.7	-179.2	0	0	0	111.7	I6 V9 V14 V32 N34 L39 S60 L67	I6-L63 HydrophobicContact CD1-CD1 4.46Å; I6-L63 HydrophobicContact CD1-CD2 4.11Å; V9-L63 HydrophobicContact CG2-CB 4.19Å; V14-L63 HydrophobicContact CG2-CD1 3.73Å; V32-L63 HydrophobicContact CG1-CD2 3.95Å; V32-L63 HydrophobicContact CG2-CD2 4.22Å; N34-L63 HydrophobicContact CB-CD2 3.91Å; L39-L63 HydrophobicContact CD2-CD1 3.72Å; L39-L63 HydrophobicContact CD2-CD2 4.09Å; L39-L63 HydrophobicContact CD2-CG 4.16Å; S60-L63 WeakPolarHBondContact O-CB 3.14Å; S60-L63 WeakPolarHBondContact O-CG 3.49Å; S60-L63 PolarHBondContact O-N 3.37Å; L63-L67 HydrophobicContact CD2-CD1 4.15Å
64	R	91.2	Very high	93.2	Very high	185 Å²	185	55.4 Å²	55.4	70%	0.698	29%	0.289	S	S	*	.			trans	-133.1	151.8	-178.7	-51.4	-178.7	-163.1	-165.1	2.2	110.2	G62 L67	G62-R64 WeakPolarHBondContact O-CG 3.44Å; R64-L67 HydrophobicContact CB-CD1 4.36Å; R64-L67 HydrophobicContact CB-CG 4.32Å; R64-L67 VanDerWaalsContact O-CG 3.29Å; R64-L67 WeakPolarHBondContact O-CG 3.32Å; R64-L67 PolarHBondContact O-N 3.25Å
65	R	93.9	Very high	93.2	Very high	181 Å²	181	56.8 Å²	56.8	68%	0.683	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	144.7	171.3	-61.7	-179.3	-175.7	-174.7	-2.1	110.2	I6 V7 L67	I6-R65 CarbonylContact O-C 3.58Å; I6-R65 VanDerWaalsContact O-CA 3.32Å; I6-R65 WeakPolarHBondContact O-CA 3.42Å; V7-R65 WeakPolarHBondContact O-CD 3.49Å; V7-R65 WeakPolarHBondContact O-CG 3.48Å; V7-R65 PolarHBondContact O-NE 3.2Å; R65-L67 VanDerWaalsContact C-N 3.31Å
66	G	92.9	Very high	93.2	Very high	42 Å²	42	57 Å²	57	43%	0.433	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-1.6	-179.6	0	0	0	0	0	115	I6	I6-G66 PolarHBondContact O-N 2.87Å
67	L	93.7	Very high	93.3	Very high	54 Å²	54	60 Å²	60	28%	0.283	31%	0.313	S	S	.	.			trans	-64.2	139	169.6	-69.8	178.3	0	0	0	110.1	K5 I6 V32 L63 R64 R65	K5-L67 WeakPolarHBondContact CA-O 3.35Å; I6-L67 HydrophobicContact CD1-CB 4.13Å; I6-L67 HydrophobicContact CD1-CD1 4.44Å; I6-L67 HydrophobicContact CG1-CB 4.34Å; I6-L67 PolarHBondContact N-O 3.46Å; V32-L67 HydrophobicContact CG2-CB 4.24Å; V32-L67 HydrophobicContact CG2-CD1 4.4Å; L63-L67 HydrophobicContact CD2-CD1 4.15Å; R64-L67 HydrophobicContact CB-CD1 4.36Å; R64-L67 HydrophobicContact CB-CG 4.32Å; R64-L67 VanDerWaalsContact O-CG 3.29Å; R64-L67 WeakPolarHBondContact O-CG 3.32Å; R64-L67 PolarHBondContact O-N 3.25Å; R65-L67 VanDerWaalsContact C-N 3.31Å
68	D	95.2	Very high	93.4	Very high	95 Å²	95	59.7 Å²	59.7	51%	0.508	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	133.8	177.1	-64.6	-37.9	0	0	0	110.2	T3 G4 K5	T3-D68 HydrophobicContact CG2-CB 3.8Å; G4-D68 WeakPolarHBondContact O-CA 3.24Å; K5-D68 VanDerWaalsContact CE-OD1 3.29Å; K5-D68 WeakPolarHBondContact CE-OD1 3.4Å; K5-D68 IonicContact NZ-OD1 2.76Å
69	V	96.5	Very high	93.7	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.4	179.9	-177.7	0	0	0	0	108	T3 G4 I6 V16 F18 L30 E31 V32 L41	T3-V69 CarbonylContact C-O 3.39Å; T3-V69 WeakPolarHBondContact CA-O 3.4Å; G4-V69 PolarHBondContact N-O 3.24Å; G4-V69 PolarHBondContact O-N 2.94Å; I6-V69 HydrophobicContact CD1-CG2 4.15Å; I6-V69 HydrophobicContact CG1-CG2 3.47Å; I6-V69 VanDerWaalsContact CG1-CG2 3.47Å; V16-V69 HydrophobicContact CG1-CB 3.68Å; V16-V69 HydrophobicContact CG1-CG1 4.05Å; V16-V69 HydrophobicContact CG1-CG2 3.74Å; V16-V69 HydrophobicContact CG2-CG1 4.35Å; V16-V69 HydrophobicContact CG2-CG2 4.06Å; F18-V69 HydrophobicContact CZ-CG1 4.32Å; L30-V69 HydrophobicContact CB-CG1 3.62Å; L30-V69 HydrophobicContact CD1-CG1 3.93Å; L30-V69 HydrophobicContact CG-CG1 4.4Å; E31-V69 CarbonylContact O-C 3.53Å; E31-V69 WeakPolarHBondContact O-CA 3.21Å; V32-V69 HydrophobicContact CB-CG2 4.11Å; V32-V69 HydrophobicContact CG2-CG2 4.13Å; L41-V69 HydrophobicContact CD1-CG1 4.39Å
70	K	96.1	Very high	93.9	Very high	103 Å²	103	56.2 Å²	56.2	45%	0.448	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.9	179.9	-60.3	174.7	-169.8	161.8	0	110.1	L30 E31	L30-K70 CarbonylContact C-O 3.59Å; L30-K70 VanDerWaalsContact CA-O 3.24Å; L30-K70 WeakPolarHBondContact CA-O 3.46Å; E31-K70 PolarHBondContact N-O 3.41Å; E31-K70 PolarHBondContact O-N 3.31Å; E31-K70 IonicContact OE1-NZ 3.86Å
71	D	95.5	Very high	94.1	Very high	10 Å²	10	55.5 Å²	55.5	5%	0.053	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	124.1	165.9	-175.9	10.2	0	0	0	110	M1 A2 F18 P24 L30 E73	M1-D71 WeakPolarHBondContact CG-O 3.42Å; A2-D71 HydrophobicContact CB-CB 4.45Å; A2-D71 PolarHBondContact O-N 3.47Å; F18-D71 HydrophobicContact CE1-CB 3.87Å; F18-D71 HydrophobicContact CZ-CB 4.26Å; P24-D71 HydrophobicContact CG-CB 4.04Å; L30-D71 HydrophobicContact CD2-CB 4.06Å; D71-E73 VanDerWaalsContact C-N 3.29Å; D71-E73 PolarHBondContact OD1-N 3.47Å
72	L	94.5	Very high	94.2	Very high	24 Å²	24	55 Å²	55	13%	0.126	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-11.1	175.4	-57.4	179.4	0	0	0	112.3	A29 E31 H74	A29-L72 HydrophobicContact CB-CD1 3.97Å; A29-L72 WeakPolarHBondContact O-CB 3.28Å; A29-L72 WeakPolarHBondContact O-CG 3.47Å; A29-L72 PolarHBondContact O-N 2.98Å; A29-L72 VanDerWaalsContact O-N 3.08Å; E31-L72 HydrophobicContact CB-CD2 4.14Å; E31-L72 HydrophobicContact CB-CG 4.44Å; L72-H74 PolarHBondContact O-CD2 3.43Å; L72-H74 PolarHBondContact O-N 3.1Å; L72-H74 VanDerWaalsContact O-N 3.15Å
73	E	93.2	Very high	94.4	Very high	104 Å²	104	54.3 Å²	54.3	49%	0.486	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	64.6	10.2	178.7	-57.9	173.3	172	0	0	114.2	M1 R25 D71	M1-E73 WeakPolarHBondContact CA-OE1 3.29Å; M1-E73 PolarHBondContact N-OE1 3.29Å; R25-E73 PolarHBondContact NH2-O 3Å; R25-E73 VanDerWaalsContact NH2-O 3.16Å; D71-E73 VanDerWaalsContact C-N 3.29Å; D71-E73 PolarHBondContact OD1-N 3.47Å
74	H	94.8	Very high	94.6	Very high	63 Å²	63	53.4 Å²	53.4	29%	0.292	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	157.2	175.5	62.9	77.8	0	0	0	111.1	A29 L72	A29-H74 WeakPolarHBondContact CB-O 3.35Å; A29-H74 PolarHBondContact N-O 3.5Å; L72-H74 PolarHBondContact O-CD2 3.43Å; L72-H74 PolarHBondContact O-N 3.1Å; L72-H74 VanDerWaalsContact O-N 3.15Å
75	P	96	Very high	94.7	Very high	29 Å²	29	45.7 Å²	45.7	19%	0.188	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	174.7	172.9	-20.9	33.6	0	0	0	113.2	Y27 E77 A109	Y27-P75 VanDerWaalsContact O-CA 3.22Å; Y27-P75 WeakPolarHBondContact O-CA 3.4Å; Y27-P75 WeakPolarHBondContact O-CB 3.3Å; P75-E77 WeakPolarHBondContact O-CG 3.44Å; P75-E77 PolarHBondContact O-N 3.04Å; P75-A109 HydrophobicContact CB-CB 4.17Å; P75-A109 HydrophobicContact CG-CB 4.32Å
76	I	96.7	Very high	94.5	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.031	20%	0.202	C	C	.	.			trans	-58.6	123.9	172.1	-62.6	173.3	0	0	0	109.1	A29 V40 E42 M57 V78 L92 A109 I110	A29-I76 HydrophobicContact CB-CG1 3.88Å; V40-I76 HydrophobicContact CG1-CD1 4.36Å; V40-I76 HydrophobicContact CG1-CG1 4.23Å; E42-I76 HydrophobicContact CB-CD1 4.2Å; E42-I76 HydrophobicContact CG-CD1 4.37Å; M57-I76 HydrophobicContact CE-CD1 3.89Å; M57-I76 HydrophobicContact CG-CD1 3.81Å; M57-I76 HydrophobicContact SD-CD1 4.33Å; I76-V78 HydrophobicContact CG2-CG1 4.4Å; I76-L92 HydrophobicContact CD1-CD2 4.1Å; I76-L92 HydrophobicContact CG1-CD2 4.48Å; I76-L92 HydrophobicContact CG2-CD2 3.91Å; I76-A109 CarbonylContact O-C 3.56Å; I76-A109 WeakPolarHBondContact O-CA 3.35Å; I76-I110 HydrophobicContact CB-CD1 3.82Å; I76-I110 HydrophobicContact CB-CG1 4.08Å; I76-I110 HydrophobicContact CD1-CD1 4.22Å; I76-I110 HydrophobicContact CG2-CD1 4.08Å; I76-I110 HydrophobicContact CG2-CG2 4.33Å; I76-I110 PolarHBondContact O-N 3.01Å
77	E	96.6	Very high	94.6	Very high	64 Å²	64	36.7 Å²	36.7	30%	0.299	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.5	179.2	-62.4	-172.9	152.5	0	0	111.8	P75 R107 W108	P75-E77 WeakPolarHBondContact O-CG 3.44Å; P75-E77 PolarHBondContact O-N 3.04Å; E77-R107 HydrophobicContact CB-CB 4.06Å; E77-R107 PolarHBondContact O-NE 2.88Å; E77-R107 PolarHBondContact O-NH2 3.09Å; E77-W108 VanDerWaalsContact CA-O 3.3Å; E77-W108 WeakPolarHBondContact CA-O 3.47Å
78	V	96.6	Very high	94.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	147.6	-174.5	-61.1	0	0	0	0	109.8	I76 R107 W108 I110 T223 T226 M227	I76-V78 HydrophobicContact CG2-CG1 4.4Å; V78-R107 CarbonylContact O-C 3.58Å; V78-R107 WeakPolarHBondContact O-CA 3.4Å; V78-W108 PolarHBondContact N-O 2.9Å; V78-W108 PolarHBondContact O-N 3.03Å; V78-I110 HydrophobicContact CB-CG2 4.29Å; V78-I110 HydrophobicContact CG1-CG2 3.47Å; V78-I110 VanDerWaalsContact CG1-CG2 3.47Å; V78-I110 HydrophobicContact CG2-CG2 3.85Å; V78-T223 HydrophobicContact CB-CG2 4.01Å; V78-T223 HydrophobicContact CG1-CG2 3.64Å; V78-T223 HydrophobicContact CG2-CG2 4.16Å; V78-T226 HydrophobicContact CG2-CG2 4.03Å; V78-M227 HydrophobicContact CB-CE 4.35Å
79	P	96.7	Very high	94.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	142.3	177	30	-33.9	0	0	0	109.7	T84 M89 G93 I102 E104 M227	P79-T84 HydrophobicContact CB-CG2 4.12Å; P79-T84 HydrophobicContact CG-CG2 4.31Å; P79-T84 WeakPolarHBondContact O-CG2 3.39Å; P79-M89 HydrophobicContact CG-SD 3.82Å; P79-G93 VanDerWaalsContact CD-CA 3.43Å; P79-G93 VanDerWaalsContact CD-O 3.32Å; P79-G93 WeakPolarHBondContact CD-O 3.4Å; P79-G93 VanDerWaalsContact CG-O 3.27Å; P79-G93 WeakPolarHBondContact CG-O 3.32Å; P79-I102 HydrophobicContact CB-CD1 4.38Å; P79-I102 HydrophobicContact CB-CG2 4.34Å; P79-I102 HydrophobicContact CG-CD1 3.64Å; P79-E104 HydrophobicContact CB-CB 3.49Å; P79-E104 VanDerWaalsContact CB-CB 3.49Å; P79-E104 HydrophobicContact CB-CG 3.64Å; P79-M227 HydrophobicContact CG-CE 4.45Å
80	V	95.4	Very high	94.6	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.024	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	163.6	177.7	-62.5	0	0	0	0	111.3	E106 W108 T226 M227 K230	V80-E106 HydrophobicContact CG2-CB 3.93Å; V80-E106 PolarHBondContact N-O 3.44Å; V80-E106 VanDerWaalsContact N-O 3.07Å; V80-W108 HydrophobicContact CG1-CB 3.89Å; V80-W108 HydrophobicContact CG1-CD2 4.36Å; V80-W108 HydrophobicContact CG1-CG 4.07Å; V80-W108 HydrophobicContact CG2-CB 4.33Å; V80-W108 HydrophobicContact CG2-CD2 3.97Å; V80-W108 HydrophobicContact CG2-CG 3.73Å; V80-T226 HydrophobicContact CG1-CG2 4.2Å; V80-M227 HydrophobicContact CG1-CG 4.44Å; V80-K230 HydrophobicContact CB-CB 3.71Å; V80-K230 HydrophobicContact CB-CD 4.44Å; V80-K230 HydrophobicContact CB-CG 3.8Å; V80-K230 HydrophobicContact CG1-CB 4.26Å; V80-K230 HydrophobicContact CG2-CB 4.1Å; V80-K230 HydrophobicContact CG2-CD 3.92Å; V80-K230 HydrophobicContact CG2-CG 3.82Å
81	G	91.8	Very high	94.5	Very high	6 Å²	6	27 Å²	27	6%	0.062	14%	0.138	C	C	.	.	S	Bend	trans	93.8	-174.3	178.5	0	0	0	0	0	113.3	A83 T84 F231	G81-A83 PolarHBondContact O-N 2.94Å; G81-A83 VanDerWaalsContact O-N 3.09Å; G81-T84 PolarHBondContact O-N 3.36Å; G81-T84 VanDerWaalsContact O-N 3.09Å; G81-T84 PolarHBondContact O-OG1 3.43Å; G81-F231 VanDerWaalsContact C-CE1 3.49Å; G81-F231 WeakPolarHBondContact O-CZ 3.49Å
82	K	92.1	Very high	94.4	Very high	118 Å²	118	27.2 Å²	27.2	51%	0.513	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-62.2	-23.4	-167.9	-65.8	178.8	-175.7	169.7	0	114.9	T84 L85 Y174 F231 R236	K82-T84 PolarHBondContact O-N 3.27Å; K82-L85 HydrophobicContact CB-CD1 4.16Å; K82-L85 HydrophobicContact CG-CD1 4.28Å; K82-L85 WeakPolarHBondContact O-CB 3.47Å; K82-L85 PolarHBondContact O-N 3.37Å; K82-L85 VanDerWaalsContact O-N 3.13Å; K82-Y174 HydrophobicContact CG-CE2 4.28Å; K82-F231 HydrophobicContact CG-CE1 4.39Å; K82-R236 VanDerWaalsContact CE-NH2 3.31Å
83	A	93	Very high	94.4	Very high	33 Å²	33	26.1 Å²	26.1	27%	0.273	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-61.3	-24.2	177.1	0	0	0	0	0	112.7	G81 L85 R87 I102 G103	G81-A83 PolarHBondContact O-N 2.94Å; G81-A83 VanDerWaalsContact O-N 3.09Å; A83-L85 VanDerWaalsContact C-N 3.33Å; A83-R87 WeakPolarHBondContact O-CG 3.28Å; A83-I102 HydrophobicContact CB-CG2 3.98Å; A83-I102 WeakPolarHBondContact O-CG2 3.43Å; A83-G103 WeakPolarHBondContact CB-O 3.32Å
84	T	94.1	Very high	94.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-80.1	-12.4	178.7	71	0	0	0	0	113.6	P79 G81 K82 R87 M89 I102 S204	P79-T84 HydrophobicContact CB-CG2 4.12Å; P79-T84 HydrophobicContact CG-CG2 4.31Å; P79-T84 WeakPolarHBondContact O-CG2 3.39Å; G81-T84 PolarHBondContact O-N 3.36Å; G81-T84 VanDerWaalsContact O-N 3.09Å; G81-T84 PolarHBondContact O-OG1 3.43Å; K82-T84 PolarHBondContact O-N 3.27Å; T84-R87 WeakPolarHBondContact O-CB 3.29Å; T84-R87 PolarHBondContact O-N 3.16Å; T84-M89 HydrophobicContact CG2-CE 4.39Å; T84-M89 HydrophobicContact CG2-SD 4.11Å; T84-I102 HydrophobicContact CG2-CG2 4.33Å; T84-S204 PolarHBondContact O-OG 3.29Å; T84-S204 PolarHBondContact OG1-OG 2.66Å
85	L	92.6	Very high	94.4	Very high	24 Å²	24	24.1 Å²	24.1	13%	0.126	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	135.8	-179.4	-62.9	167.6	0	0	0	110.3	K82 A83 R87 Y174 D201 F231	K82-L85 HydrophobicContact CB-CD1 4.16Å; K82-L85 HydrophobicContact CG-CD1 4.28Å; K82-L85 WeakPolarHBondContact O-CB 3.47Å; K82-L85 PolarHBondContact O-N 3.37Å; K82-L85 VanDerWaalsContact O-N 3.13Å; A83-L85 VanDerWaalsContact C-N 3.33Å; L85-R87 PolarHBondContact O-N 2.85Å; L85-Y174 HydrophobicContact CD1-CD1 4.07Å; L85-Y174 HydrophobicContact CD1-CD2 4.15Å; L85-Y174 HydrophobicContact CD1-CE1 3.68Å; L85-Y174 HydrophobicContact CD1-CE2 3.74Å; L85-Y174 HydrophobicContact CD1-CG 4.31Å; L85-Y174 HydrophobicContact CD2-CD1 4.23Å; L85-Y174 HydrophobicContact CD2-CD2 4.42Å; L85-Y174 HydrophobicContact CD2-CG 4.12Å; L85-D201 WeakPolarHBondContact CB-O 2.94Å; L85-F231 HydrophobicContact CD1-CZ 4.33Å; L85-F231 HydrophobicContact CD2-CE2 4.04Å; L85-F231 HydrophobicContact CD2-CZ 3.76Å; L85-F231 HydrophobicContact CG-CZ 3.88Å
86	G	91.1	Very high	94.2	Very high	9 Å²	9	26.4 Å²	26.4	9%	0.093	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	9.7	-175.8	0	0	0	0	0	115.2	K99 I200 V203	G86-K99 PolarHBondContact O-NZ 3.04Å; G86-I200 WeakPolarHBondContact CA-O 3.44Å; G86-I200 PolarHBondContact N-O 3.32Å; G86-I200 VanDerWaalsContact N-O 3.16Å; G86-V203 PolarHBondContact N-O 3.28Å
87	R	94.5	Very high	93.8	Very high	25 Å²	25	27.3 Å²	27.3	9%	0.094	15%	0.148	C	C	.	.			trans	-107.9	150.1	179.4	-53.7	-53.8	-56.9	-88.4	-7.3	111.3	A83 T84 L85 D97 G100 E101 I102 L205	A83-R87 WeakPolarHBondContact O-CG 3.28Å; T84-R87 WeakPolarHBondContact O-CB 3.29Å; T84-R87 PolarHBondContact O-N 3.16Å; L85-R87 PolarHBondContact O-N 2.85Å; R87-D97 WeakPolarHBondContact CA-OD2 3.11Å; R87-D97 IonicContact CZ-OD1 3.58Å; R87-D97 IonicContact CZ-OD2 3.54Å; R87-D97 IonicContact NE-OD1 3.69Å; R87-D97 IonicContact NE-OD2 2.84Å; R87-D97 PolarHBondContact NE-OD2 3.17Å; R87-D97 IonicContact NH2-OD1 2.85Å; R87-D97 PolarHBondContact NH2-OD1 2.71Å; R87-D97 IonicContact NH2-OD2 3.66Å; R87-D97 PolarHBondContact NH2-OD2 3.06Å; R87-G100 PolarHBondContact NH2-O 2.97Å; R87-E101 PolarHBondContact NH1-O 3.09Å; R87-I102 VanDerWaalsContact NH1-CA 3.35Å; R87-L205 PolarHBondContact O-N 3.36Å
88	I	94.5	Very high	93.5	Very high	24 Å²	24	33 Å²	33	12%	0.123	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.6	171.8	-47.9	173.8	0	0	0	109.1	P95 V96 D97 Y191 L205 Y207	I88-P95 WeakPolarHBondContact O-CA 3.32Å; I88-V96 HydrophobicContact CB-CG2 4.13Å; I88-V96 HydrophobicContact CG2-CG2 3.65Å; I88-V96 PolarHBondContact O-N 3.4Å; I88-D97 HydrophobicContact CB-CB 3.95Å; I88-D97 HydrophobicContact CD1-CB 4.18Å; I88-D97 HydrophobicContact CG1-CB 4.05Å; I88-D97 PolarHBondContact N-OD2 2.99Å; I88-D97 VanDerWaalsContact N-OD2 3.17Å; I88-Y191 HydrophobicContact CD1-CD1 4.46Å; I88-Y191 HydrophobicContact CD1-CD2 3.43Å; I88-Y191 VanDerWaalsContact CD1-CD2 3.43Å; I88-Y191 HydrophobicContact CD1-CE2 3.73Å; I88-Y191 HydrophobicContact CD1-CG 3.83Å; I88-Y191 HydrophobicContact CG1-CD2 3.93Å; I88-Y191 HydrophobicContact CG1-CE2 4.07Å; I88-L205 CarbonylContact C-O 3.46Å; I88-L205 WeakPolarHBondContact CA-O 3.04Å; I88-L205 HydrophobicContact CB-CB 4.43Å; I88-L205 HydrophobicContact CG1-CB 4.17Å; I88-L205 HydrophobicContact CG1-CD1 3.92Å; I88-L205 HydrophobicContact CG2-CB 4.28Å; I88-Y207 HydrophobicContact CG2-CD2 3.43Å; I88-Y207 VanDerWaalsContact CG2-CD2 3.43Å; I88-Y207 HydrophobicContact CG2-CE2 3.64Å
89	M	95.6	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151.8	-176.3	-66.5	160	-71.8	0	0	112	P79 T84 E94 I102 L205 V206 Y207 M227	P79-M89 HydrophobicContact CG-SD 3.82Å; T84-M89 HydrophobicContact CG2-CE 4.39Å; T84-M89 HydrophobicContact CG2-SD 4.11Å; M89-E94 VanDerWaalsContact CA-O 3.28Å; M89-E94 WeakPolarHBondContact CA-O 3.4Å; M89-I102 HydrophobicContact CG-CD1 3.63Å; M89-I102 HydrophobicContact SD-CD1 3.69Å; M89-L205 PolarHBondContact N-O 3.37Å; M89-V206 HydrophobicContact CE-CG2 4.22Å; M89-V206 WeakPolarHBondContact O-CA 3.14Å; M89-Y207 PolarHBondContact O-N 3.18Å; M89-M227 HydrophobicContact CB-CE 4.47Å; M89-M227 HydrophobicContact CE-CE 3.53Å; M89-M227 HydrophobicContact CE-SD 3.49Å; M89-M227 WeakPolarHBondContact CE-SD 2.88Å; M89-M227 HydrophobicContact SD-CE 3.34Å; M89-M227 WeakPolarHBondContact SD-CE 3.5Å; M89-M227 HydrophobicContact SD-SD 4.11Å
90	N	94.5	Very high	92.9	Very high	23 Å²	23	40.3 Å²	40.3	12%	0.123	22%	0.221	C	C	.	.			trans	-84.1	-178.3	167.5	71.7	11.3	0	0	0	111.4	L92 G93 E94 V96	N90-L92 PolarHBondContact O-N 3.43Å; N90-L92 WeakPolarHBondContact OD1-CA 3.42Å; N90-L92 WeakPolarHBondContact OD1-CB 3.49Å; N90-L92 PolarHBondContact OD1-N 2.82Å; N90-G93 PolarHBondContact O-N 3.15Å; N90-G93 PolarHBondContact OD1-N 3.22Å; N90-G93 VanDerWaalsContact OD1-N 3.14Å; N90-E94 PolarHBondContact N-O 3.4Å; N90-E94 PolarHBondContact ND2-OE2 3.44Å; N90-E94 PolarHBondContact OD1-N 3.06Å; N90-V96 HydrophobicContact CB-CG1 3.96Å
91	V	94.2	Very high	92.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.6	178.2	66.6	0	0	0	0	114.2	G93 N216 R219 V220 T223	V91-G93 VanDerWaalsContact C-N 3.25Å; V91-G93 PolarHBondContact O-N 2.72Å; V91-N216 HydrophobicContact CB-CB 4.37Å; V91-N216 HydrophobicContact CG1-CB 3.94Å; V91-R219 HydrophobicContact CG2-CB 3.51Å; V91-V220 HydrophobicContact CB-CB 4.49Å; V91-V220 HydrophobicContact CG2-CB 4.37Å; V91-T223 PolarHBondContact O-OG1 3.13Å
92	L	94.9	Very high	92.7	Very high	16 Å²	16	48.8 Å²	48.8	8%	0.084	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	0.7	178.9	-58	179.4	0	0	0	112.7	V40 M57 I76 N90 E94 R107	V40-L92 HydrophobicContact CB-CD1 4Å; V40-L92 HydrophobicContact CB-CD2 4.02Å; V40-L92 HydrophobicContact CG1-CD2 4.07Å; V40-L92 HydrophobicContact CG2-CD1 3.7Å; V40-L92 HydrophobicContact CG2-CD2 4.24Å; M57-L92 HydrophobicContact CB-CD2 3.98Å; M57-L92 HydrophobicContact CG-CD2 4.27Å; I76-L92 HydrophobicContact CD1-CD2 4.1Å; I76-L92 HydrophobicContact CG1-CD2 4.48Å; I76-L92 HydrophobicContact CG2-CD2 3.91Å; N90-L92 PolarHBondContact O-N 3.43Å; N90-L92 WeakPolarHBondContact OD1-CA 3.42Å; N90-L92 WeakPolarHBondContact OD1-CB 3.49Å; N90-L92 PolarHBondContact OD1-N 2.82Å; L92-E94 VanDerWaalsContact C-N 3.3Å; L92-E94 HydrophobicContact CB-CG 4.12Å; L92-R107 PolarHBondContact O-NH2 3.44Å
93	G	92.7	Very high	92.5	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.01	26%	0.261	C	S	.	.	S	Bend	trans	78.2	13.7	-177.8	0	0	0	0	0	114	P79 N90 V91 I102	P79-G93 VanDerWaalsContact CD-CA 3.43Å; P79-G93 VanDerWaalsContact CD-O 3.32Å; P79-G93 WeakPolarHBondContact CD-O 3.4Å; P79-G93 VanDerWaalsContact CG-O 3.27Å; P79-G93 WeakPolarHBondContact CG-O 3.32Å; N90-G93 PolarHBondContact O-N 3.15Å; N90-G93 PolarHBondContact OD1-N 3.22Å; N90-G93 VanDerWaalsContact OD1-N 3.14Å; V91-G93 VanDerWaalsContact C-N 3.25Å; V91-G93 PolarHBondContact O-N 2.72Å; G93-I102 WeakPolarHBondContact O-CD1 3.36Å
94	E	94.2	Very high	92.3	Very high	72 Å²	72	47.1 Å²	47.1	34%	0.336	26%	0.262	S	S	.	.			trans	-84.7	139.7	179.5	-57.4	166	160.1	0	0	109.8	M89 N90 L92 V96	M89-E94 VanDerWaalsContact CA-O 3.28Å; M89-E94 WeakPolarHBondContact CA-O 3.4Å; N90-E94 PolarHBondContact N-O 3.4Å; N90-E94 PolarHBondContact ND2-OE2 3.44Å; N90-E94 PolarHBondContact OD1-N 3.06Å; L92-E94 VanDerWaalsContact C-N 3.3Å; L92-E94 HydrophobicContact CB-CG 4.12Å; E94-V96 PolarHBondContact O-N 3.3Å
95	P	94.3	Very high	92.1	Very high	52 Å²	52	56 Å²	56	34%	0.338	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-69.4	129.8	-179.3	27.6	-32.8	0	0	0	111.2	I88 G100 I102	I88-P95 WeakPolarHBondContact O-CA 3.32Å; P95-G100 WeakPolarHBondContact CG-O 3.22Å; P95-I102 HydrophobicContact CB-CD1 4.19Å; P95-I102 HydrophobicContact CB-CG1 3.96Å; P95-I102 HydrophobicContact CG-CD1 4.39Å; P95-I102 HydrophobicContact CG-CG1 4.19Å
96	V	91.5	Very high	92.1	Very high	78 Å²	78	58.8 Å²	58.8	47%	0.473	32%	0.316	S	S	.	.			trans	-116.3	9.4	176.8	-62.7	0	0	0	0	112.7	I88 N90 E94	I88-V96 HydrophobicContact CB-CG2 4.13Å; I88-V96 HydrophobicContact CG2-CG2 3.65Å; I88-V96 PolarHBondContact O-N 3.4Å; N90-V96 HydrophobicContact CB-CG1 3.96Å; E94-V96 PolarHBondContact O-N 3.3Å
97	D	89.7	Confident	92.3	Very high	24 Å²	24	63 Å²	63	13%	0.128	33%	0.329	C	S	.	.	S	Bend	trans	-91.7	0.1	-178.7	58.5	14.8	0	0	0	114.8	R87 I88 K99	R87-D97 WeakPolarHBondContact CA-OD2 3.11Å; R87-D97 IonicContact CZ-OD1 3.58Å; R87-D97 IonicContact CZ-OD2 3.54Å; R87-D97 IonicContact NE-OD1 3.69Å; R87-D97 IonicContact NE-OD2 2.84Å; R87-D97 PolarHBondContact NE-OD2 3.17Å; R87-D97 IonicContact NH2-OD1 2.85Å; R87-D97 PolarHBondContact NH2-OD1 2.71Å; R87-D97 IonicContact NH2-OD2 3.66Å; R87-D97 PolarHBondContact NH2-OD2 3.06Å; I88-D97 HydrophobicContact CB-CB 3.95Å; I88-D97 HydrophobicContact CD1-CB 4.18Å; I88-D97 HydrophobicContact CG1-CB 4.05Å; I88-D97 PolarHBondContact N-OD2 2.99Å; I88-D97 VanDerWaalsContact N-OD2 3.17Å; D97-K99 HydrophobicContact CB-CD 4.5Å; D97-K99 HydrophobicContact CB-CG 4.25Å; D97-K99 PolarHBondContact O-N 2.88Å; D97-K99 VanDerWaalsContact O-N 3.11Å; D97-K99 WeakPolarHBondContact OD1-CB 3.49Å; D97-K99 PolarHBondContact OD1-N 2.84Å
98	M	88.8	Confident	92.4	Very high	183 Å²	183	63.6 Å²	63.6	90%	0.901	33%	0.331	S	S	*	.	S	Bend	trans	59	18.2	-176.9	-52	-63.1	-74.7	0	0	114.3	G100	M98-G100 VanDerWaalsContact C-N 3.3Å
99	K	88.9	Confident	92.5	Very high	109 Å²	109	63.4 Å²	63.4	47%	0.474	33%	0.333	S	S	.	.	S	Bend	trans	-89.1	9.9	177.3	-63.5	-177.3	-176.8	171.5	0	113.6	G86 D97 Y191	G86-K99 PolarHBondContact O-NZ 3.04Å; D97-K99 HydrophobicContact CB-CD 4.5Å; D97-K99 HydrophobicContact CB-CG 4.25Å; D97-K99 PolarHBondContact O-N 2.88Å; D97-K99 VanDerWaalsContact O-N 3.11Å; D97-K99 WeakPolarHBondContact OD1-CB 3.49Å; D97-K99 PolarHBondContact OD1-N 2.84Å; K99-Y191 VanDerWaalsContact CE-OH 3.22Å; K99-Y191 WeakPolarHBondContact CE-OH 3.22Å; K99-Y191 PolarHBondContact NZ-OH 2.97Å
100	G	91.7	Very high	92.6	Very high	46 Å²	46	63.4 Å²	63.4	47%	0.474	33%	0.333	S	S	.	.			trans	88.6	-162.9	-176	0	0	0	0	0	112.8	R87 P95 M98	R87-G100 PolarHBondContact NH2-O 2.97Å; P95-G100 WeakPolarHBondContact CG-O 3.22Å; M98-G100 VanDerWaalsContact C-N 3.3Å
101	E	92.1	Very high	92.6	Very high	173 Å²	173	64.1 Å²	64.1	81%	0.808	34%	0.336	S	S	*	.			trans	-66.7	156.8	179.5	-64.9	-176.3	171.4	0	0	112	R87	R87-E101 PolarHBondContact NH1-O 3.09Å
102	I	91.7	Very high	92.6	Very high	14 Å²	14	68.3 Å²	68.3	7%	0.072	35%	0.352	C	S	.	.			trans	-73.3	-36	-178.6	-66.6	165.5	0	0	0	110.9	P79 A83 T84 R87 M89 G93 P95 E104	P79-I102 HydrophobicContact CB-CD1 4.38Å; P79-I102 HydrophobicContact CB-CG2 4.34Å; P79-I102 HydrophobicContact CG-CD1 3.64Å; A83-I102 HydrophobicContact CB-CG2 3.98Å; A83-I102 WeakPolarHBondContact O-CG2 3.43Å; T84-I102 HydrophobicContact CG2-CG2 4.33Å; R87-I102 VanDerWaalsContact NH1-CA 3.35Å; M89-I102 HydrophobicContact CG-CD1 3.63Å; M89-I102 HydrophobicContact SD-CD1 3.69Å; G93-I102 WeakPolarHBondContact O-CD1 3.36Å; P95-I102 HydrophobicContact CB-CD1 4.19Å; P95-I102 HydrophobicContact CB-CG1 3.96Å; P95-I102 HydrophobicContact CG-CD1 4.39Å; P95-I102 HydrophobicContact CG-CG1 4.19Å; I102-E104 HydrophobicContact CG2-CB 4.29Å
103	G	88.1	Confident	92.5	Very high	54 Å²	54	71.9 Å²	71.9	56%	0.557	38%	0.384	S	S	*	.			trans	74.6	36	-174.4	0	0	0	0	0	111.1	A83	A83-G103 WeakPolarHBondContact CB-O 3.32Å
104	E	88.6	Confident	92.5	Very high	62 Å²	62	73.9 Å²	73.9	29%	0.29	40%	0.4	S	S	.	.			trans	-66.4	142	178.4	71.4	-85.6	-155.6	0	0	112.2	P79 I102 R107	P79-E104 HydrophobicContact CB-CB 3.49Å; P79-E104 VanDerWaalsContact CB-CB 3.49Å; P79-E104 HydrophobicContact CB-CG 3.64Å; I102-E104 HydrophobicContact CG2-CB 4.29Å; E104-R107 HydrophobicContact CG-CG 3.97Å; E104-R107 IonicContact OE1-CZ 3.37Å; E104-R107 IonicContact OE1-NH1 2.72Å; E104-R107 PolarHBondContact OE1-NH1 3.21Å
105	E	89.3	Confident	92.4	Very high	188 Å²	188	71.6 Å²	71.6	88%	0.879	39%	0.392	S	S	*	.	S	Bend	trans	-90.5	-29.1	173.3	-63.5	-179.7	-177.5	0	0	111.5
106	E	93.8	Very high	92.3	Very high	82 Å²	82	71.8 Å²	71.8	38%	0.383	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.9	-176	-69.5	-179.7	-134	0	0	110.9	V80 W108 K230	V80-E106 HydrophobicContact CG2-CB 3.93Å; V80-E106 PolarHBondContact N-O 3.44Å; V80-E106 VanDerWaalsContact N-O 3.07Å; E106-W108 PolarHBondContact OE2-NE1 3.4Å; E106-K230 IonicContact OE1-NZ 3.08Å; E106-K230 PolarHBondContact OE1-NZ 2.68Å; E106-K230 IonicContact OE2-NZ 3.44Å; E106-K230 PolarHBondContact OE2-NZ 2.92Å
107	R	95.3	Very high	92.2	Very high	97 Å²	97	77.4 Å²	77.4	37%	0.366	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136	168.5	-60	-178.6	74.7	121.1	-4.2	109.5	E77 V78 L92 E104	E77-R107 HydrophobicContact CB-CB 4.06Å; E77-R107 PolarHBondContact O-NE 2.88Å; E77-R107 PolarHBondContact O-NH2 3.09Å; V78-R107 CarbonylContact O-C 3.58Å; V78-R107 WeakPolarHBondContact O-CA 3.4Å; L92-R107 PolarHBondContact O-NH2 3.44Å; E104-R107 HydrophobicContact CG-CG 3.97Å; E104-R107 IonicContact OE1-CZ 3.37Å; E104-R107 IonicContact OE1-NH1 2.72Å; E104-R107 PolarHBondContact OE1-NH1 3.21Å
108	W	96.7	Very high	92.2	Very high	37 Å²	37	83.7 Å²	83.7	14%	0.14	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	143.2	-179	-75.4	12.7	0	0	0	110.5	E77 V78 V80 E106 T226 E229 K230 D233	E77-W108 VanDerWaalsContact CA-O 3.3Å; E77-W108 WeakPolarHBondContact CA-O 3.47Å; V78-W108 PolarHBondContact N-O 2.9Å; V78-W108 PolarHBondContact O-N 3.03Å; V80-W108 HydrophobicContact CG1-CB 3.89Å; V80-W108 HydrophobicContact CG1-CD2 4.36Å; V80-W108 HydrophobicContact CG1-CG 4.07Å; V80-W108 HydrophobicContact CG2-CB 4.33Å; V80-W108 HydrophobicContact CG2-CD2 3.97Å; V80-W108 HydrophobicContact CG2-CG 3.73Å; E106-W108 PolarHBondContact OE2-NE1 3.4Å; W108-T226 HydrophobicContact CB-CG2 3.65Å; W108-T226 HydrophobicContact CE3-CG2 4.32Å; W108-E229 HydrophobicContact CZ3-CB 4.3Å; W108-K230 HydrophobicContact CD2-CD 4.39Å; W108-K230 HydrophobicContact CE3-CB 4.16Å; W108-K230 HydrophobicContact CH2-CB 4.15Å; W108-K230 HydrophobicContact CH2-CD 3.61Å; W108-K230 HydrophobicContact CH2-CG 4.49Å; W108-K230 HydrophobicContact CZ2-CD 3.32Å; W108-K230 HydrophobicContact CZ3-CB 3.92Å; W108-K230 HydrophobicContact CZ3-CD 4.21Å; W108-D233 HydrophobicContact CH2-CB 4.28Å
109	A	97	Very high	92.1	Very high	20 Å²	20	79.6 Å²	79.6	17%	0.165	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	138	172.3	0	0	0	0	0	111.2	P75 I76 H111 R112 T226	P75-A109 HydrophobicContact CB-CB 4.17Å; P75-A109 HydrophobicContact CG-CB 4.32Å; I76-A109 CarbonylContact O-C 3.56Å; I76-A109 WeakPolarHBondContact O-CA 3.35Å; A109-H111 VanDerWaalsContact C-N 3.27Å; A109-H111 PolarHBondContact O-N 3.38Å; A109-R112 WeakPolarHBondContact O-CD 3.47Å; A109-R112 VanDerWaalsContact O-CG 3.24Å; A109-R112 WeakPolarHBondContact O-CG 3.12Å; A109-T226 WeakPolarHBondContact O-CG2 3.35Å
110	I	96	Very high	92.1	Very high	0 Å²	0	77.1 Å²	77.1	0%	0	41%	0.407	C	S	.	.	S	Bend	trans	-71.6	-24	178.5	65.6	174.7	0	0	0	113	I76 V78 R219 L222 T226 R282	I76-I110 HydrophobicContact CB-CD1 3.82Å; I76-I110 HydrophobicContact CB-CG1 4.08Å; I76-I110 HydrophobicContact CD1-CD1 4.22Å; I76-I110 HydrophobicContact CG2-CD1 4.08Å; I76-I110 HydrophobicContact CG2-CG2 4.33Å; I76-I110 PolarHBondContact O-N 3.01Å; V78-I110 HydrophobicContact CB-CG2 4.29Å; V78-I110 HydrophobicContact CG1-CG2 3.47Å; V78-I110 VanDerWaalsContact CG1-CG2 3.47Å; V78-I110 HydrophobicContact CG2-CG2 3.85Å; I110-R219 HydrophobicContact CD1-CB 4.02Å; I110-R219 HydrophobicContact CD1-CG 4.19Å; I110-L222 HydrophobicContact CB-CB 4.21Å; I110-T226 WeakPolarHBondContact CA-OG1 3.35Å; I110-T226 PolarHBondContact O-OG1 2.93Å; I110-R282 PolarHBondContact O-NH1 3.19Å; I110-R282 PolarHBondContact O-NH2 3.1Å
111	H	95.1	Very high	91.7	Very high	39 Å²	39	77 Å²	77	18%	0.181	40%	0.399	C	S	.	.			trans	-93.5	108.3	175.8	-64.9	-69.6	0	0	0	109	Y27 E42 A109	Y27-H111 AromaticContact CD1-CE1 3.79Å; Y27-H111 AromaticContact CD1-NE2 3.73Å; Y27-H111 AromaticContact CG-CD2 3.98Å; E42-H111 IonicContact OE1-NE2 3.45Å; E42-H111 IonicContact OE2-CD2 3.22Å; E42-H111 IonicContact OE2-CE1 3.81Å; E42-H111 IonicContact OE2-NE2 2.9Å; E42-H111 PolarHBondContact OE2-NE2 3.2Å; A109-H111 VanDerWaalsContact C-N 3.27Å; A109-H111 PolarHBondContact O-N 3.38Å
112	R	93.6	Very high	90.9	Very high	87 Å²	87	75.7 Å²	75.7	33%	0.328	40%	0.398	S	S	.	.			trans	-134.1	154.1	-179.1	-63.6	177.6	65.6	107.1	-6.9	110.1	A109 E229 R282	A109-R112 WeakPolarHBondContact O-CD 3.47Å; A109-R112 VanDerWaalsContact O-CG 3.24Å; A109-R112 WeakPolarHBondContact O-CG 3.12Å; R112-E229 WeakPolarHBondContact CD-OE2 3.23Å; R112-E229 IonicContact NE-OE2 3.29Å; R112-R282 WeakPolarHBondContact O-CD 3.42Å
113	A	93.1	Very high	89.8	Confident	92 Å²	92	77.3 Å²	77.3	76%	0.76	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-72.5	148.1	171	0	0	0	0	0	110.2
114	A	93.4	Very high	89.1	Confident	43 Å²	43	80.8 Å²	80.8	36%	0.355	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-63.7	152.6	168.2	0	0	0	0	0	110.7	E281 R282	A114-E281 HydrophobicContact CB-CB 3.98Å; A114-E281 WeakPolarHBondContact CB-O 3.06Å; A114-R282 HydrophobicContact CB-CG 4.07Å
115	P	92.6	Very high	88.9	Confident	23 Å²	23	83 Å²	83	15%	0.149	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-53.7	145.4	173.6	-26.9	36.6	0	0	0	112.2	E119 L120 T284 T286	P115-E119 HydrophobicContact CB-CB 4.33Å; P115-L120 HydrophobicContact CB-CD2 4.27Å; P115-T284 HydrophobicContact CB-CG2 4.19Å; P115-T284 HydrophobicContact CG-CG2 3.63Å; P115-T286 HydrophobicContact CB-CG2 3.9Å; P115-T286 HydrophobicContact CG-CG2 3.85Å
116	S	91.9	Very high	88.8	Confident	56 Å²	56	76.9 Å²	76.9	39%	0.392	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-70.1	157.6	177.8	66	0	0	0	0	111.3	E118 E119 L120	S116-E118 PolarHBondContact O-N 3.11Å; S116-E118 VanDerWaalsContact O-N 3.12Å; S116-E119 PolarHBondContact N-OE2 3.38Å; S116-E119 WeakPolarHBondContact O-CB 3.47Å; S116-E119 PolarHBondContact O-N 3.08Å; S116-E119 VanDerWaalsContact OG-CD 3.28Å; S116-E119 WeakPolarHBondContact OG-CG 3.47Å; S116-E119 PolarHBondContact OG-OE2 2.9Å; S116-L120 PolarHBondContact O-N 3.36Å
117	Y	88.8	Confident	88.5	Confident	197 Å²	197	74 Å²	74	77%	0.773	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.7	177.5	-177.8	-101.7	0	0	0	113.1	E119 L120	Y117-E119 VanDerWaalsContact C-N 3.27Å; Y117-E119 PolarHBondContact O-N 3.34Å; Y117-L120 HydrophobicContact CD2-CD1 4.24Å; Y117-L120 PolarHBondContact O-N 3.25Å
118	E	89.7	Confident	88.3	Confident	156 Å²	156	72.3 Å²	72.3	73%	0.729	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-23.1	178.1	-63.2	-176.2	-179.3	0	0	113.1	S116 K287	S116-E118 PolarHBondContact O-N 3.11Å; S116-E118 VanDerWaalsContact O-N 3.12Å; E118-K287 WeakPolarHBondContact O-CE 3.24Å; E118-K287 PolarHBondContact O-NZ 3.03Å
119	E	87.5	Confident	88	Confident	97 Å²	97	70.5 Å²	70.5	45%	0.453	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-18.9	-180	-69.9	165.4	144.4	0	0	112.6	P115 S116 Y117 T286 K287	P115-E119 HydrophobicContact CB-CB 4.33Å; S116-E119 PolarHBondContact N-OE2 3.38Å; S116-E119 WeakPolarHBondContact O-CB 3.47Å; S116-E119 PolarHBondContact O-N 3.08Å; S116-E119 VanDerWaalsContact OG-CD 3.28Å; S116-E119 WeakPolarHBondContact OG-CG 3.47Å; S116-E119 PolarHBondContact OG-OE2 2.9Å; Y117-E119 VanDerWaalsContact C-N 3.27Å; Y117-E119 PolarHBondContact O-N 3.34Å; E119-T286 CarbonylContact O-C 3.49Å; E119-T286 WeakPolarHBondContact O-CA 3.39Å; E119-K287 PolarHBondContact O-N 2.86Å
120	L	88.6	Confident	87.7	Confident	56 Å²	56	69.6 Å²	69.6	29%	0.293	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-63.9	138.9	-178.3	-62.2	-178.9	0	0	0	111.7	P115 S116 Y117 T284	P115-L120 HydrophobicContact CB-CD2 4.27Å; S116-L120 PolarHBondContact O-N 3.36Å; Y117-L120 HydrophobicContact CD2-CD1 4.24Å; Y117-L120 PolarHBondContact O-N 3.25Å; L120-T284 HydrophobicContact CD2-CG2 3.58Å; L120-T284 WeakPolarHBondContact CD2-OG1 3.35Å
121	S	83.9	Confident	87.6	Confident	43 Å²	43	69.6 Å²	69.6	30%	0.301	36%	0.364	S	S	.	.			trans	-91.1	140.2	170.7	-177.9	0	0	0	0	110.9	S123 S285	S121-S123 WeakPolarHBondContact OG-CB 3.15Å; S121-S123 PolarHBondContact OG-N 3.18Å; S121-S123 PolarHBondContact OG-OG 2.88Å; S121-S285 PolarHBondContact N-O 3.39Å; S121-S285 VanDerWaalsContact N-O 3.09Å
122	N	74.5	Confident	87.6	Confident	147 Å²	147	67.7 Å²	67.7	79%	0.786	36%	0.355	S	S	*	.			trans	-93.5	9.3	172.4	-70	-23.3	0	0	0	112.8	Q124	N122-Q124 PolarHBondContact O-N 3.33Å
123	S	68.9	Low	87.6	Confident	47 Å²	47	63.6 Å²	63.6	33%	0.329	34%	0.34	S	S	.	.			trans	-66	121.7	-176.5	56.1	0	0	0	0	111.7	S121 E125	S121-S123 WeakPolarHBondContact OG-CB 3.15Å; S121-S123 PolarHBondContact OG-N 3.18Å; S121-S123 PolarHBondContact OG-OG 2.88Å; S123-E125 VanDerWaalsContact C-N 3.3Å; S123-E125 PolarHBondContact O-N 3.41Å
124	Q	72.5	Confident	87.6	Confident	128 Å²	128	59.2 Å²	59.2	60%	0.598	30%	0.304	S	S	*	.			trans	-96.1	46.2	172.8	-64	-179.7	-7.5	0	0	110.9	N122	N122-Q124 PolarHBondContact O-N 3.33Å
125	E	84.2	Confident	87.7	Confident	107 Å²	107	57.4 Å²	57.4	50%	0.5	29%	0.288	S	S	.	.			trans	-72	131.4	176.3	-70.7	-178.7	178	0	0	109.7	S123 K142	S123-E125 VanDerWaalsContact C-N 3.3Å; S123-E125 PolarHBondContact O-N 3.41Å; E125-K142 HydrophobicContact CB-CB 4.12Å; E125-K142 HydrophobicContact CB-CD 4.14Å; E125-K142 WeakPolarHBondContact O-CB 3.46Å; E125-K142 PolarHBondContact O-N 2.97Å; E125-K142 WeakPolarHBondContact OE2-CD 3.25Å; E125-K142 IonicContact OE2-NZ 2.79Å; E125-K142 PolarHBondContact OE2-NZ 3Å
126	L	88.1	Confident	87.7	Confident	61 Å²	61	56.3 Å²	56.3	32%	0.319	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	137.7	174.3	-63.6	177.9	0	0	0	110.1	P139 F140 Q344 V349 V350	L126-P139 HydrophobicContact CD2-CB 4.23Å; L126-F140 CarbonylContact C-O 3.59Å; L126-F140 WeakPolarHBondContact CA-O 3.47Å; L126-Q344 HydrophobicContact CD2-CB 3.93Å; L126-Q344 HydrophobicContact CD2-CG 4.24Å; L126-V349 HydrophobicContact CD2-CG1 4.16Å; L126-V350 HydrophobicContact CD1-CB 4.49Å; L126-V350 HydrophobicContact CD1-CG1 3.74Å; L126-V350 HydrophobicContact CD2-CG1 4.43Å
127	L	87.9	Confident	87.8	Confident	22 Å²	22	53.7 Å²	53.7	12%	0.115	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	105.2	172.6	-178.1	63.9	0	0	0	108.9	T129 F140 I167 L239 T292	L127-T129 PolarHBondContact O-N 3.08Å; L127-F140 HydrophobicContact CB-CB 4.16Å; L127-F140 PolarHBondContact N-O 3.26Å; L127-I167 HydrophobicContact CD1-CG2 4.47Å; L127-I167 HydrophobicContact CD2-CD1 3.9Å; L127-I167 HydrophobicContact CG-CD1 4.3Å; L127-L239 HydrophobicContact CD2-CD2 3.96Å; L127-T292 HydrophobicContact CD2-CG2 3.93Å
128	E	90.6	Very high	87.9	Confident	60 Å²	60	44.3 Å²	44.3	28%	0.28	23%	0.226	S	C	.	.			trans	-72.6	116.1	177.1	-170.4	176.9	171.1	0	0	110.4	H171 Y418 S420 L421	E128-H171 PolarHBondContact O-NE2 3.38Å; E128-Y418 WeakPolarHBondContact CG-OH 3.2Å; E128-S420 WeakPolarHBondContact OE1-CA 3.47Å; E128-S420 WeakPolarHBondContact OE1-CB 3.18Å; E128-L421 HydrophobicContact CG-CB 4.22Å; E128-L421 PolarHBondContact OE1-N 2.92Å
129	T	90.5	Very high	88.1	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.			trans	-88.2	-19.7	-176.2	65.5	0	0	0	0	112.9	L127 I131 I134 D135 F140 L163 N166	L127-T129 PolarHBondContact O-N 3.08Å; T129-I131 PolarHBondContact O-N 2.85Å; T129-I131 PolarHBondContact OG1-N 3Å; T129-I134 HydrophobicContact CG2-CG2 4Å; T129-D135 WeakPolarHBondContact CB-OD1 3.28Å; T129-D135 PolarHBondContact N-OD1 3.3Å; T129-D135 PolarHBondContact N-OD2 2.8Å; T129-D135 VanDerWaalsContact OG1-CG 3.25Å; T129-D135 PolarHBondContact OG1-OD1 3.11Å; T129-D135 PolarHBondContact OG1-OD2 3.3Å; T129-F140 HydrophobicContact CG2-CD2 3.5Å; T129-F140 VanDerWaalsContact CG2-CD2 3.5Å; T129-F140 HydrophobicContact CG2-CE2 3.74Å; T129-F140 HydrophobicContact CG2-CG 4.12Å; T129-L163 HydrophobicContact CG2-CD2 3.59Å; T129-N166 WeakPolarHBondContact O-CB 3.27Å; T129-N166 PolarHBondContact O-ND2 3.33Å; T129-N166 VanDerWaalsContact O-ND2 3.08Å
130	G	91.1	Very high	88.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	77.8	5.2	-172.5	0	0	0	0	0	113.7	D135 Q403 V419	G130-D135 WeakPolarHBondContact CA-OD2 3.49Å; G130-D135 PolarHBondContact N-OD2 2.99Å; G130-Q403 PolarHBondContact O-NE2 3.28Å; G130-Q403 PolarHBondContact O-OE1 3.26Å; G130-V419 CarbonylContact C-O 3.19Å; G130-V419 WeakPolarHBondContact CA-O 3.19Å; G130-V419 PolarHBondContact O-N 3.11Å; G130-V419 VanDerWaalsContact O-N 3.14Å
131	I	93.7	Very high	88.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.			trans	-103.7	110.8	-179.4	-62	173.6	0	0	0	108.1	T129 V133 I134 D135 E162 L163 P333 F405	T129-I131 PolarHBondContact O-N 2.85Å; T129-I131 PolarHBondContact OG1-N 3Å; I131-V133 VanDerWaalsContact C-N 3.34Å; I131-V133 HydrophobicContact CG2-CG1 3.91Å; I131-V133 PolarHBondContact O-N 2.84Å; I131-V133 VanDerWaalsContact O-N 3.16Å; I131-I134 HydrophobicContact CB-CB 4.2Å; I131-I134 HydrophobicContact CB-CD1 4.17Å; I131-I134 HydrophobicContact CB-CG1 4.3Å; I131-I134 HydrophobicContact CD1-CD1 3.97Å; I131-I134 HydrophobicContact CG2-CB 4.23Å; I131-I134 HydrophobicContact CG2-CD1 3.99Å; I131-I134 HydrophobicContact CG2-CG1 3.92Å; I131-I134 PolarHBondContact O-N 3.43Å; I131-D135 PolarHBondContact N-OD2 2.77Å; I131-D135 PolarHBondContact O-N 3.16Å; I131-E162 HydrophobicContact CD1-CB 4.41Å; I131-E162 HydrophobicContact CD1-CG 4.02Å; I131-E162 HydrophobicContact CG1-CG 4.43Å; I131-L163 HydrophobicContact CD1-CD2 3.77Å; I131-L163 HydrophobicContact CD1-CG 4.09Å; I131-P333 HydrophobicContact CG2-CG 4.08Å; I131-F405 HydrophobicContact CD1-CE1 4.13Å; I131-F405 HydrophobicContact CD1-CZ 3.82Å; I131-F405 HydrophobicContact CG1-CE1 4.04Å; I131-F405 HydrophobicContact CG1-CZ 4.22Å; I131-F405 HydrophobicContact CG2-CE1 4.16Å; I131-F405 HydrophobicContact CG2-CZ 4.18Å
132	K	94.8	Very high	88.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-46.3	-51.6	-173.3	-76.7	-173	-71	-173.2	0	114.2	I134 L136 F400 S402 V419 T424 F428 V447 G448	K132-I134 VanDerWaalsContact C-N 3.33Å; K132-I134 PolarHBondContact O-N 3.43Å; K132-L136 WeakPolarHBondContact O-CB 3.33Å; K132-L136 PolarHBondContact O-N 3.29Å; K132-F400 HydrophobicContact CD-CE1 4.28Å; K132-F400 HydrophobicContact CD-CZ 4.22Å; K132-F400 WeakPolarHBondContact CE-O 3.37Å; K132-F400 PolarHBondContact NZ-O 3.2Å; K132-S402 WeakPolarHBondContact CE-O 3.15Å; K132-S402 PolarHBondContact NZ-O 3.22Å; K132-V419 HydrophobicContact CD-CB 4.41Å; K132-V419 HydrophobicContact CD-CG1 4.11Å; K132-V419 HydrophobicContact CD-CG2 4.25Å; K132-V419 HydrophobicContact CG-CB 3.83Å; K132-V419 HydrophobicContact CG-CG1 3.8Å; K132-V419 HydrophobicContact CG-CG2 4.06Å; K132-T424 HydrophobicContact CB-CG2 3.97Å; K132-T424 HydrophobicContact CG-CG2 4.01Å; K132-F428 HydrophobicContact CB-CE2 4.26Å; K132-F428 HydrophobicContact CD-CE2 4.37Å; K132-V447 PolarHBondContact NZ-O 3.18Å; K132-G448 WeakPolarHBondContact CD-O 3.26Å; K132-G448 WeakPolarHBondContact CE-O 3.34Å; K132-G448 PolarHBondContact NZ-O 3.35Å
133	V	93.2	Very high	88.9	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-67.1	-35.7	-176.7	61.4	0	0	0	0	112	I131 M137 P333 V335 L401	I131-V133 VanDerWaalsContact C-N 3.34Å; I131-V133 HydrophobicContact CG2-CG1 3.91Å; I131-V133 PolarHBondContact O-N 2.84Å; I131-V133 VanDerWaalsContact O-N 3.16Å; V133-M137 HydrophobicContact CG2-CG 4.17Å; V133-M137 WeakPolarHBondContact O-CB 3.34Å; V133-M137 VanDerWaalsContact O-CG 3.28Å; V133-M137 WeakPolarHBondContact O-CG 3.19Å; V133-M137 PolarHBondContact O-N 3.5Å; V133-P333 HydrophobicContact CG1-CG 3.67Å; V133-V335 HydrophobicContact CB-CB 4.43Å; V133-V335 HydrophobicContact CG1-CB 3.79Å; V133-V335 HydrophobicContact CG1-CG1 4.27Å; V133-V335 HydrophobicContact CG1-CG2 3.83Å; V133-V335 HydrophobicContact CG2-CB 3.74Å; V133-V335 HydrophobicContact CG2-CG1 3.61Å; V133-L401 HydrophobicContact CB-CD2 3.79Å; V133-L401 HydrophobicContact CG2-CD2 3.86Å
134	I	93.8	Very high	89.8	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-73.1	-53.6	179.3	-65.2	178.8	0	0	0	109.5	T129 I131 K132 L136 M137 C138 P139 F140 L163	T129-I134 HydrophobicContact CG2-CG2 4Å; I131-I134 HydrophobicContact CB-CB 4.2Å; I131-I134 HydrophobicContact CB-CD1 4.17Å; I131-I134 HydrophobicContact CB-CG1 4.3Å; I131-I134 HydrophobicContact CD1-CD1 3.97Å; I131-I134 HydrophobicContact CG2-CB 4.23Å; I131-I134 HydrophobicContact CG2-CD1 3.99Å; I131-I134 HydrophobicContact CG2-CG1 3.92Å; I131-I134 PolarHBondContact O-N 3.43Å; K132-I134 VanDerWaalsContact C-N 3.33Å; K132-I134 PolarHBondContact O-N 3.43Å; I134-L136 VanDerWaalsContact C-N 3.27Å; I134-L136 PolarHBondContact O-N 2.89Å; I134-M137 PolarHBondContact O-N 3.13Å; I134-C138 CarbonylContact O-C 3.51Å; I134-C138 WeakPolarHBondContact O-CA 3.37Å; I134-C138 PolarHBondContact O-N 3.15Å; I134-P139 VanDerWaalsContact O-N 3.16Å; I134-F140 HydrophobicContact CD1-CZ 4.24Å; I134-F140 HydrophobicContact CG2-CD1 3.82Å; I134-F140 HydrophobicContact CG2-CE1 3.34Å; I134-F140 HydrophobicContact CG2-CE2 4.13Å; I134-F140 HydrophobicContact CG2-CG 4.38Å; I134-F140 HydrophobicContact CG2-CZ 3.5Å; I134-L163 HydrophobicContact CD1-CD2 4.27Å
135	D	93.9	Very high	90.8	Very high	5 Å²	5	17 Å²	17	3%	0.027	9%	0.087	C	C	.	.	H	α-helix	trans	-62.2	-35.7	-176.9	-69	-20.1	0	0	0	111.8	T129 G130 I131 H354 L421	T129-D135 WeakPolarHBondContact CB-OD1 3.28Å; T129-D135 PolarHBondContact N-OD1 3.3Å; T129-D135 PolarHBondContact N-OD2 2.8Å; T129-D135 VanDerWaalsContact OG1-CG 3.25Å; T129-D135 PolarHBondContact OG1-OD1 3.11Å; T129-D135 PolarHBondContact OG1-OD2 3.3Å; G130-D135 WeakPolarHBondContact CA-OD2 3.49Å; G130-D135 PolarHBondContact N-OD2 2.99Å; I131-D135 PolarHBondContact N-OD2 2.77Å; I131-D135 PolarHBondContact O-N 3.16Å; D135-H354 PolarHBondContact O-CE1 3.09Å; D135-H354 PolarHBondContact O-NE2 3.09Å; D135-L421 HydrophobicContact CB-CD1 3.99Å
136	L	94.2	Very high	91.2	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-76.4	-53	176.6	-174.4	67.4	0	0	0	112.8	K132 I134 H354 T357 A358 V361 T424 I425 F428	K132-L136 WeakPolarHBondContact O-CB 3.33Å; K132-L136 PolarHBondContact O-N 3.29Å; I134-L136 VanDerWaalsContact C-N 3.27Å; I134-L136 PolarHBondContact O-N 2.89Å; L136-H354 PolarHBondContact O-NE2 2.87Å; L136-T357 HydrophobicContact CD1-CG2 4.02Å; L136-A358 HydrophobicContact CD1-CB 4.16Å; L136-A358 HydrophobicContact CG-CB 4.2Å; L136-V361 HydrophobicContact CD2-CG2 4.19Å; L136-T424 HydrophobicContact CB-CG2 3.93Å; L136-I425 HydrophobicContact CD1-CG1 4.38Å; L136-F428 HydrophobicContact CD2-CB 4.09Å; L136-F428 HydrophobicContact CD2-CD1 4.12Å; L136-F428 HydrophobicContact CD2-CD2 3.49Å; L136-F428 VanDerWaalsContact CD2-CD2 3.49Å; L136-F428 HydrophobicContact CD2-CE1 4.48Å; L136-F428 HydrophobicContact CD2-CE2 3.9Å; L136-F428 HydrophobicContact CD2-CG 3.62Å; L136-F428 HydrophobicContact CD2-CZ 4.39Å
137	M	93.2	Very high	91.4	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-93.4	-37.1	-164.1	-55.2	-60.1	-61	0	0	113.3	V133 I134 P337 A358 V361 Q362	V133-M137 HydrophobicContact CG2-CG 4.17Å; V133-M137 WeakPolarHBondContact O-CB 3.34Å; V133-M137 VanDerWaalsContact O-CG 3.28Å; V133-M137 WeakPolarHBondContact O-CG 3.19Å; V133-M137 PolarHBondContact O-N 3.5Å; I134-M137 PolarHBondContact O-N 3.13Å; M137-P337 HydrophobicContact CE-CB 3.62Å; M137-P337 WeakPolarHBondContact CE-O 3.4Å; M137-P337 HydrophobicContact CG-CB 4Å; M137-P337 HydrophobicContact SD-CB 4.28Å; M137-A358 HydrophobicContact SD-CB 4.5Å; M137-V361 HydrophobicContact SD-CG1 4.11Å; M137-Q362 HydrophobicContact CE-CG 3.15Å
138	C	91.8	Very high	91.5	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.043	C	C	.	.	S	Bend	trans	-137.2	61.9	-174.8	48.7	0	0	0	0	110.6	I134 F140 V320	I134-C138 CarbonylContact O-C 3.51Å; I134-C138 WeakPolarHBondContact O-CA 3.37Å; I134-C138 PolarHBondContact O-N 3.15Å; C138-F140 VanDerWaalsContact O-CD1 3.23Å; C138-F140 WeakPolarHBondContact O-CD1 3.49Å; C138-F140 WeakPolarHBondContact O-CE1 3.07Å; C138-V320 HydrophobicContact CB-CG2 4.49Å
139	P	92.5	Very high	91.4	Very high	4 Å²	4	5.5 Å²	5.5	3%	0.026	3%	0.031	C	C	.	.	P	Polyproline II helix	trans	-59.2	140.8	-176.1	21	-30.5	0	0	0	111.2	L126 I134 S342 Q344 V350	L126-P139 HydrophobicContact CD2-CB 4.23Å; I134-P139 VanDerWaalsContact O-N 3.16Å; P139-S342 PolarHBondContact O-OG 2.9Å; P139-Q344 HydrophobicContact CG-CB 4.09Å; P139-V350 HydrophobicContact CB-CG1 4.43Å; P139-V350 HydrophobicContact CG-CG1 3.83Å
140	F	91.1	Very high	90.9	Very high	2 Å²	2	6 Å²	6	1%	0.009	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	138.8	-177.7	-68.6	-0.2	0	0	0	110.6	L126 L127 T129 I134 C138 V146 L163 V294 V320	L126-F140 CarbonylContact C-O 3.59Å; L126-F140 WeakPolarHBondContact CA-O 3.47Å; L127-F140 HydrophobicContact CB-CB 4.16Å; L127-F140 PolarHBondContact N-O 3.26Å; T129-F140 HydrophobicContact CG2-CD2 3.5Å; T129-F140 VanDerWaalsContact CG2-CD2 3.5Å; T129-F140 HydrophobicContact CG2-CE2 3.74Å; T129-F140 HydrophobicContact CG2-CG 4.12Å; I134-F140 HydrophobicContact CD1-CZ 4.24Å; I134-F140 HydrophobicContact CG2-CD1 3.82Å; I134-F140 HydrophobicContact CG2-CE1 3.34Å; I134-F140 HydrophobicContact CG2-CE2 4.13Å; I134-F140 HydrophobicContact CG2-CG 4.38Å; I134-F140 HydrophobicContact CG2-CZ 3.5Å; C138-F140 VanDerWaalsContact O-CD1 3.23Å; C138-F140 WeakPolarHBondContact O-CD1 3.49Å; C138-F140 WeakPolarHBondContact O-CE1 3.07Å; F140-V146 HydrophobicContact CD1-CG1 4.24Å; F140-V146 HydrophobicContact CD1-CG2 3.63Å; F140-V146 HydrophobicContact CD2-CG2 3.99Å; F140-V146 HydrophobicContact CE1-CB 4.22Å; F140-V146 HydrophobicContact CE1-CG1 3.48Å; F140-V146 VanDerWaalsContact CE1-CG1 3.48Å; F140-V146 HydrophobicContact CE1-CG2 3.72Å; F140-V146 HydrophobicContact CE2-CG1 4.36Å; F140-V146 HydrophobicContact CE2-CG2 4.05Å; F140-V146 HydrophobicContact CG-CG2 3.8Å; F140-V146 HydrophobicContact CZ-CB 4.24Å; F140-V146 HydrophobicContact CZ-CG1 3.56Å; F140-V146 HydrophobicContact CZ-CG2 3.94Å; F140-L163 HydrophobicContact CE2-CD1 4.07Å; F140-L163 HydrophobicContact CE2-CD2 4.06Å; F140-L163 HydrophobicContact CZ-CD1 4.42Å; F140-V294 HydrophobicContact CE2-CG2 4.33Å; F140-V320 HydrophobicContact CE1-CG2 4.01Å; F140-V320 HydrophobicContact CZ-CG2 4.31Å
141	A	88.5	Confident	90.1	Very high	12 Å²	12	6.7 Å²	6.7	10%	0.099	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	143.5	165.6	0	0	0	0	0	110	G143 G144 Q344	A141-G143 PolarHBondContact O-N 2.93Å; A141-G144 WeakPolarHBondContact O-CA 3.41Å; A141-G144 PolarHBondContact O-N 2.85Å; A141-Q344 HydrophobicContact CB-CG 3.81Å
142	K	86.1	Confident	89.2	Confident	50 Å²	50	10.6 Å²	10.6	22%	0.217	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	119.1	169.5	-170.5	177.8	-177.4	178.1	0	110.5	E125 G144 D237 S285 S290	E125-K142 HydrophobicContact CB-CB 4.12Å; E125-K142 HydrophobicContact CB-CD 4.14Å; E125-K142 WeakPolarHBondContact O-CB 3.46Å; E125-K142 PolarHBondContact O-N 2.97Å; E125-K142 WeakPolarHBondContact OE2-CD 3.25Å; E125-K142 IonicContact OE2-NZ 2.79Å; E125-K142 PolarHBondContact OE2-NZ 3Å; K142-G144 VanDerWaalsContact C-N 3.28Å; K142-D237 WeakPolarHBondContact CE-OD1 3.49Å; K142-D237 WeakPolarHBondContact CE-OD2 3.5Å; K142-D237 VanDerWaalsContact NZ-CG 3.3Å; K142-D237 IonicContact NZ-OD1 3.37Å; K142-D237 PolarHBondContact NZ-OD1 2.72Å; K142-D237 IonicContact NZ-OD2 3.73Å; K142-D237 PolarHBondContact NZ-OD2 3.34Å; K142-S285 PolarHBondContact O-OG 3.37Å; K142-S290 WeakPolarHBondContact CG-OG 3.34Å
143	G	85.3	Confident	88.3	Confident	10 Å²	10	14.4 Å²	14.4	10%	0.103	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	4.1	-169.2	0	0	0	0	0	115.2	A141 S285 I291 T292	A141-G143 PolarHBondContact O-N 2.93Å; G143-S285 WeakPolarHBondContact CA-OG 3.31Å; G143-I291 CarbonylContact C-O 3.57Å; G143-I291 WeakPolarHBondContact CA-O 3.45Å; G143-T292 PolarHBondContact N-OG1 2.99Å
144	G	88.9	Confident	87.8	Confident	3 Å²	3	14.5 Å²	14.5	3%	0.031	12%	0.115	C	C	.	.			trans	-73.6	161.8	177.7	0	0	0	0	0	112.2	A141 K142 S293 D317	A141-G144 WeakPolarHBondContact O-CA 3.41Å; A141-G144 PolarHBondContact O-N 2.85Å; K142-G144 VanDerWaalsContact C-N 3.28Å; G144-S293 PolarHBondContact O-N 2.84Å; G144-D317 VanDerWaalsContact CA-OD2 3.31Å; G144-D317 WeakPolarHBondContact CA-OD2 3.45Å
145	K	93	Very high	87.2	Confident	20 Å²	20	15.5 Å²	15.5	9%	0.087	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.7	175.3	-63	158.2	-176.2	173.9	0	109.8	Q280 E281 I283 S293 H315 L316 D317 A318	K145-Q280 WeakPolarHBondContact CE-O 3.35Å; K145-Q280 PolarHBondContact NZ-O 2.9Å; K145-E281 IonicContact NZ-OE1 2.97Å; K145-I283 WeakPolarHBondContact CE-O 3.27Å; K145-I283 HydrophobicContact CG-CG2 4.02Å; K145-S293 WeakPolarHBondContact CA-OG 3.43Å; K145-H315 HydrophobicContact CD-CB 4.41Å; K145-H315 WeakPolarHBondContact CD-O 3.4Å; K145-L316 HydrophobicContact CB-CD2 4.03Å; K145-D317 PolarHBondContact N-OD2 2.99Å; K145-D317 PolarHBondContact O-N 2.96Å; K145-A318 PolarHBondContact O-N 3.34Å
146	V	93.2	Very high	86.6	Confident	2 Å²	2	16.6 Å²	16.6	1%	0.012	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.6	-178.9	-173.6	0	0	0	0	109.8	F140 L148 S293 V294 Q295 A318 V320	F140-V146 HydrophobicContact CD1-CG1 4.24Å; F140-V146 HydrophobicContact CD1-CG2 3.63Å; F140-V146 HydrophobicContact CD2-CG2 3.99Å; F140-V146 HydrophobicContact CE1-CB 4.22Å; F140-V146 HydrophobicContact CE1-CG1 3.48Å; F140-V146 VanDerWaalsContact CE1-CG1 3.48Å; F140-V146 HydrophobicContact CE1-CG2 3.72Å; F140-V146 HydrophobicContact CE2-CG1 4.36Å; F140-V146 HydrophobicContact CE2-CG2 4.05Å; F140-V146 HydrophobicContact CG-CG2 3.8Å; F140-V146 HydrophobicContact CZ-CB 4.24Å; F140-V146 HydrophobicContact CZ-CG1 3.56Å; F140-V146 HydrophobicContact CZ-CG2 3.94Å; V146-L148 HydrophobicContact CG1-CD2 4.49Å; V146-S293 WeakPolarHBondContact CB-O 3.37Å; V146-S293 PolarHBondContact N-O 3.17Å; V146-V294 HydrophobicContact CB-CG2 4.42Å; V146-Q295 PolarHBondContact O-N 3.11Å; V146-A318 WeakPolarHBondContact CA-O 3.39Å; V146-A318 HydrophobicContact CG1-CB 4.38Å; V146-A318 HydrophobicContact CG2-CB 4.37Å; V146-V320 HydrophobicContact CG1-CG2 3.84Å
147	G	92.5	Very high	85.9	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.7	169.8	0	0	0	0	0	111.9	F149 Q295 A318 V320	G147-F149 WeakPolarHBondContact O-CD2 3.33Å; G147-Q295 CarbonylContact C-O 3.48Å; G147-Q295 WeakPolarHBondContact CA-O 3.27Å; G147-A318 PolarHBondContact N-O 3.36Å; G147-V320 PolarHBondContact O-N 3Å
148	L	90.4	Very high	85.4	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	100.5	168	-61	-175.9	0	0	0	109.5	V146 M160 V294 Q295 A296 V297 V320	V146-L148 HydrophobicContact CG1-CD2 4.49Å; L148-M160 HydrophobicContact CD1-CG 3.43Å; L148-M160 VanDerWaalsContact CD1-CG 3.43Å; L148-M160 HydrophobicContact CD1-SD 4.2Å; L148-V294 HydrophobicContact CD1-CG1 3.44Å; L148-V294 VanDerWaalsContact CD1-CG1 3.44Å; L148-V294 HydrophobicContact CD2-CG1 4.2Å; L148-V294 HydrophobicContact CG-CG1 3.57Å; L148-Q295 PolarHBondContact N-O 3.33Å; L148-A296 WeakPolarHBondContact O-CA 3.42Å; L148-V297 PolarHBondContact O-N 3.15Å; L148-V320 CarbonylContact C-O 2.95Å; L148-V320 HydrophobicContact CD2-CB 3.64Å; L148-V320 HydrophobicContact CD2-CG1 4.06Å; L148-V320 HydrophobicContact CD2-CG2 3.97Å
149	F	87.4	Confident	85.2	Confident	5 Å²	5	20.8 Å²	20.8	2%	0.022	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	142.3	178.9	-65.7	-94.2	0	0	0	110.1	G147 V297 V299 F313 L316 T319 V320 V321 L322	G147-F149 WeakPolarHBondContact O-CD2 3.33Å; F149-V297 HydrophobicContact CD1-CB 3.69Å; F149-V297 HydrophobicContact CD1-CG1 3.94Å; F149-V297 HydrophobicContact CD1-CG2 4.35Å; F149-V297 HydrophobicContact CE1-CB 3.51Å; F149-V297 HydrophobicContact CE1-CG1 3.47Å; F149-V297 VanDerWaalsContact CE1-CG1 3.47Å; F149-V297 HydrophobicContact CE1-CG2 3.86Å; F149-V297 HydrophobicContact CE2-CG2 4.2Å; F149-V297 HydrophobicContact CG-CB 4.29Å; F149-V297 HydrophobicContact CZ-CB 3.96Å; F149-V297 HydrophobicContact CZ-CG1 4.17Å; F149-V297 HydrophobicContact CZ-CG2 3.76Å; F149-V299 HydrophobicContact CD1-CG2 3.58Å; F149-V299 HydrophobicContact CE1-CG2 4.28Å; F149-F313 HydrophobicContact CD1-CE2 4.35Å; F149-F313 AromaticContact CD1-CZ 3.91Å; F149-F313 HydrophobicContact CD1-CZ 3.91Å; F149-F313 HydrophobicContact CD2-CZ 4.45Å; F149-F313 HydrophobicContact CE1-CD2 4.27Å; F149-F313 AromaticContact CE1-CE1 3.86Å; F149-F313 HydrophobicContact CE1-CE1 3.86Å; F149-F313 AromaticContact CE1-CE2 3.44Å; F149-F313 HydrophobicContact CE1-CE2 3.44Å; F149-F313 VanDerWaalsContact CE1-CE2 3.44Å; F149-F313 AromaticContact CE1-CZ 3.2Å; F149-F313 HydrophobicContact CE1-CZ 3.2Å; F149-F313 HydrophobicContact CE2-CD1 4.42Å; F149-F313 AromaticContact CE2-CE1 3.69Å; F149-F313 HydrophobicContact CE2-CE1 3.69Å; F149-F313 AromaticContact CE2-CZ 3.85Å; F149-F313 HydrophobicContact CE2-CZ 3.85Å; F149-F313 HydrophobicContact CG-CZ 4.49Å; F149-F313 AromaticContact CZ-CD1 3.87Å; F149-F313 HydrophobicContact CZ-CD1 3.87Å; F149-F313 HydrophobicContact CZ-CD2 4.23Å; F149-F313 AromaticContact CZ-CE1 3.29Å; F149-F313 HydrophobicContact CZ-CE1 3.29Å; F149-F313 AromaticContact CZ-CE2 3.68Å; F149-F313 HydrophobicContact CZ-CE2 3.68Å; F149-F313 HydrophobicContact CZ-CG 4.3Å; F149-F313 AromaticContact CZ-CZ 3.17Å; F149-F313 HydrophobicContact CZ-CZ 3.17Å; F149-L316 HydrophobicContact CE2-CD1 3.71Å; F149-L316 HydrophobicContact CZ-CD1 3.62Å; F149-T319 HydrophobicContact CE2-CG2 3.98Å; F149-V320 PolarHBondContact N-O 2.81Å; F149-V321 HydrophobicContact CB-CG2 4.21Å; F149-L322 WeakPolarHBondContact O-CB 3.49Å; F149-L322 PolarHBondContact O-N 2.72Å
150	G	80.2	Confident	84.9	Confident	10 Å²	10	20.6 Å²	20.6	10%	0.103	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.8	155.7	172.2	0	0	0	0	0	113.7	K156	G150-K156 PolarHBondContact O-NZ 3.38Å
151	G	74.5	Confident	84.6	Confident	15 Å²	15	20.7 Å²	20.7	16%	0.155	16%	0.155	C	C	.	.			trans	-68.8	-173.2	176.9	0	0	0	0	0	113.7	V154	G151-V154 WeakPolarHBondContact O-CG2 3.48Å
152	A	74.6	Confident	84.6	Confident	83 Å²	83	20.1 Å²	20.1	69%	0.686	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	141.1	172.6	0	0	0	0	0	111.2	V154	A152-V154 VanDerWaalsContact C-N 3.35Å; A152-V154 PolarHBondContact O-N 3.35Å
153	G	76.6	Confident	84.6	Confident	79 Å²	79	17.7 Å²	17.7	81%	0.814	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.5	7	171.1	0	0	0	0	0	116.6	G155	G153-G155 VanDerWaalsContact C-N 3.29Å; G153-G155 PolarHBondContact O-N 2.65Å
154	V	81.6	Confident	84.6	Confident	4 Å²	4	17.2 Å²	17.2	2%	0.024	14%	0.135	C	C	.	.	S	Bend	trans	-85.3	4.4	178.5	-58.1	0	0	0	0	114.1	G151 A152 K156 L322 R324	G151-V154 WeakPolarHBondContact O-CG2 3.48Å; A152-V154 VanDerWaalsContact C-N 3.35Å; A152-V154 PolarHBondContact O-N 3.35Å; V154-K156 HydrophobicContact CG2-CG 4.26Å; V154-L322 HydrophobicContact CB-CB 3.93Å; V154-L322 HydrophobicContact CG2-CB 3.42Å; V154-L322 VanDerWaalsContact CG2-CB 3.42Å; V154-L322 HydrophobicContact CG2-CD1 3.96Å; V154-L322 HydrophobicContact CG2-CG 4.36Å; V154-R324 HydrophobicContact CG1-CB 4.41Å
155	G	82	Confident	84.5	Confident	21 Å²	21	19.3 Å²	19.3	22%	0.216	14%	0.141	C	C	.	.	S	Bend	trans	87.6	26.4	176.1	0	0	0	0	0	115.9	G153 T157 V158 N159	G153-G155 VanDerWaalsContact C-N 3.29Å; G153-G155 PolarHBondContact O-N 2.65Å; G155-T157 PolarHBondContact O-N 3.49Å; G155-V158 PolarHBondContact O-N 3.48Å; G155-N159 PolarHBondContact O-N 3.22Å; G155-N159 PolarHBondContact O-ND2 3.09Å
156	K	82	Confident	84.1	Confident	28 Å²	28	18.4 Å²	18.4	12%	0.122	14%	0.138	C	C	.	.	H	α-helix	trans	-51.7	-55.6	175.7	-77.7	-176.4	-62	-166.4	0	112.4	G150 V154 V158 N159 M160 A296 L322	G150-K156 PolarHBondContact O-NZ 3.38Å; V154-K156 HydrophobicContact CG2-CG 4.26Å; K156-V158 VanDerWaalsContact C-N 3.31Å; K156-V158 PolarHBondContact O-N 2.89Å; K156-N159 PolarHBondContact O-N 3Å; K156-M160 HydrophobicContact CB-CE 4.29Å; K156-M160 PolarHBondContact O-N 3.28Å; K156-A296 HydrophobicContact CD-CB 4.36Å; K156-L322 HydrophobicContact CB-CD1 4.22Å; K156-L322 HydrophobicContact CG-CD1 3.46Å; K156-L322 VanDerWaalsContact CG-CD1 3.46Å
157	T	77.6	Confident	83.4	Confident	42 Å²	42	18.7 Å²	18.7	26%	0.258	14%	0.139	S	C	.	.	H	α-helix	trans	-59.1	-44.2	-179.9	-42.3	0	0	0	0	110.8	G155 N159 M160 M161 F190	G155-T157 PolarHBondContact O-N 3.49Å; T157-N159 PolarHBondContact O-N 3.03Å; T157-M160 PolarHBondContact O-N 2.81Å; T157-M160 VanDerWaalsContact O-N 3.15Å; T157-M161 HydrophobicContact CG2-CE 3.89Å; T157-M161 HydrophobicContact CG2-CG 4.44Å; T157-M161 HydrophobicContact CG2-SD 4.16Å; T157-M161 VanDerWaalsContact O-CG 3.24Å; T157-M161 WeakPolarHBondContact O-CG 3.16Å; T157-M161 PolarHBondContact O-N 3.45Å; T157-F190 HydrophobicContact CG2-CD2 4.02Å
158	V	84	Confident	82.7	Confident	41 Å²	41	18.8 Å²	18.8	25%	0.248	14%	0.139	C	C	.	.	H	α-helix	trans	-61.4	-42.5	178.1	-171.8	0	0	0	0	111.7	G155 K156 M161 E162 F405 A408	G155-V158 PolarHBondContact O-N 3.48Å; K156-V158 VanDerWaalsContact C-N 3.31Å; K156-V158 PolarHBondContact O-N 2.89Å; V158-M161 HydrophobicContact CB-CE 4.48Å; V158-M161 HydrophobicContact CG2-CE 4.28Å; V158-M161 PolarHBondContact O-N 3.34Å; V158-E162 WeakPolarHBondContact O-CB 3.43Å; V158-E162 PolarHBondContact O-N 3.46Å; V158-F405 HydrophobicContact CG1-CD2 4.04Å; V158-A408 HydrophobicContact CG1-CB 4.21Å
159	N	87.7	Confident	82.1	Confident	4 Å²	4	22 Å²	22	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-62.8	-43.9	173.9	-80	-89.2	0	0	0	111.7	G155 K156 T157 M161 E162 L163 P333	G155-N159 PolarHBondContact O-N 3.22Å; G155-N159 PolarHBondContact O-ND2 3.09Å; K156-N159 PolarHBondContact O-N 3Å; T157-N159 PolarHBondContact O-N 3.03Å; N159-M161 VanDerWaalsContact C-N 3.34Å; N159-M161 PolarHBondContact O-N 2.97Å; N159-E162 PolarHBondContact O-N 2.82Å; N159-L163 WeakPolarHBondContact O-CB 3.47Å; N159-L163 VanDerWaalsContact O-CG 3.23Å; N159-L163 WeakPolarHBondContact O-CG 3.23Å; N159-L163 PolarHBondContact O-N 3.03Å; N159-P333 VanDerWaalsContact OD1-CB 3.22Å; N159-P333 WeakPolarHBondContact OD1-CB 3.32Å
160	M	85.1	Confident	81.4	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-43.7	176.4	-73	-174.7	-77.7	0	0	111.8	L148 K156 T157 L163 I164 F241 D243 V294 A296	L148-M160 HydrophobicContact CD1-CG 3.43Å; L148-M160 VanDerWaalsContact CD1-CG 3.43Å; L148-M160 HydrophobicContact CD1-SD 4.2Å; K156-M160 HydrophobicContact CB-CE 4.29Å; K156-M160 PolarHBondContact O-N 3.28Å; T157-M160 PolarHBondContact O-N 2.81Å; T157-M160 VanDerWaalsContact O-N 3.15Å; M160-L163 PolarHBondContact O-N 3.28Å; M160-I164 VanDerWaalsContact O-CG1 3.27Å; M160-I164 WeakPolarHBondContact O-CG1 3.43Å; M160-I164 PolarHBondContact O-N 2.83Å; M160-F241 HydrophobicContact CB-CD1 3.92Å; M160-F241 HydrophobicContact CB-CE1 4.14Å; M160-F241 HydrophobicContact CG-CD1 3.89Å; M160-F241 HydrophobicContact CG-CE1 4.27Å; M160-F241 HydrophobicContact SD-CD1 4.16Å; M160-D243 HydrophobicContact CE-CB 3.84Å; M160-D243 WeakPolarHBondContact CE-OD2 3.5Å; M160-D243 HydrophobicContact SD-CB 4.32Å; M160-V294 HydrophobicContact CG-CG1 4.2Å; M160-A296 HydrophobicContact CE-CB 4.15Å; M160-A296 HydrophobicContact SD-CB 4.43Å
161	M	84.8	Confident	80.9	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-41.6	179.5	-67.1	-175.3	-64.5	0	0	112	T157 V158 N159 L163 I164 R165 F190 E193 M194 V407	T157-M161 HydrophobicContact CG2-CE 3.89Å; T157-M161 HydrophobicContact CG2-CG 4.44Å; T157-M161 HydrophobicContact CG2-SD 4.16Å; T157-M161 VanDerWaalsContact O-CG 3.24Å; T157-M161 WeakPolarHBondContact O-CG 3.16Å; T157-M161 PolarHBondContact O-N 3.45Å; V158-M161 HydrophobicContact CB-CE 4.48Å; V158-M161 HydrophobicContact CG2-CE 4.28Å; V158-M161 PolarHBondContact O-N 3.34Å; N159-M161 VanDerWaalsContact C-N 3.34Å; N159-M161 PolarHBondContact O-N 2.97Å; M161-L163 VanDerWaalsContact C-N 3.34Å; M161-I164 PolarHBondContact O-N 3.36Å; M161-R165 WeakPolarHBondContact O-CB 3.28Å; M161-R165 PolarHBondContact O-N 3.41Å; M161-F190 HydrophobicContact CG-CD2 3.5Å; M161-F190 VanDerWaalsContact CG-CD2 3.5Å; M161-F190 HydrophobicContact CG-CE2 3.39Å; M161-F190 HydrophobicContact CG-CZ 4.4Å; M161-F190 HydrophobicContact SD-CD2 3.51Å; M161-F190 VanDerWaalsContact SD-CD2 3.51Å; M161-F190 HydrophobicContact SD-CE2 4.06Å; M161-F190 HydrophobicContact SD-CG 4.25Å; M161-E193 WeakPolarHBondContact CE-OE2 3.49Å; M161-E193 HydrophobicContact SD-CB 4.13Å; M161-M194 HydrophobicContact CB-CE 3.57Å; M161-M194 HydrophobicContact CG-CE 3.44Å; M161-M194 VanDerWaalsContact CG-CE 3.44Å; M161-M194 HydrophobicContact SD-CE 4.3Å; M161-V407 HydrophobicContact CB-CB 4.43Å; M161-V407 HydrophobicContact CB-CG1 3.95Å; M161-V407 HydrophobicContact CB-CG2 4.06Å; M161-V407 HydrophobicContact CE-CG1 3.99Å; M161-V407 HydrophobicContact SD-CG1 4.35Å
162	E	88.5	Confident	80.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-42.5	174.7	-171.5	72.2	175.1	0	0	111.4	I131 V158 N159 R165 N166 F405 F406 V407	I131-E162 HydrophobicContact CD1-CB 4.41Å; I131-E162 HydrophobicContact CD1-CG 4.02Å; I131-E162 HydrophobicContact CG1-CG 4.43Å; V158-E162 WeakPolarHBondContact O-CB 3.43Å; V158-E162 PolarHBondContact O-N 3.46Å; N159-E162 PolarHBondContact O-N 2.82Å; E162-R165 PolarHBondContact O-N 3.22Å; E162-N166 WeakPolarHBondContact O-CB 3.15Å; E162-N166 VanDerWaalsContact O-CG 3.3Å; E162-N166 PolarHBondContact O-N 2.7Å; E162-F405 HydrophobicContact CB-CD2 3.76Å; E162-F405 HydrophobicContact CB-CE2 3.96Å; E162-F405 HydrophobicContact CB-CG 4.1Å; E162-F405 HydrophobicContact CB-CZ 4.45Å; E162-F405 HydrophobicContact CG-CB 4.11Å; E162-F405 HydrophobicContact CG-CD1 3.79Å; E162-F405 HydrophobicContact CG-CD2 3.82Å; E162-F405 HydrophobicContact CG-CE1 4.05Å; E162-F405 HydrophobicContact CG-CE2 4.09Å; E162-F405 HydrophobicContact CG-CG 3.66Å; E162-F405 HydrophobicContact CG-CZ 4.18Å; E162-F405 WeakPolarHBondContact OE1-CA 3.38Å; E162-F405 WeakPolarHBondContact OE2-CB 3.46Å; E162-F406 VanDerWaalsContact OE1-CD2 3.28Å; E162-F406 WeakPolarHBondContact OE1-CD2 3.38Å; E162-F406 PolarHBondContact OE1-N 3.09Å; E162-F406 VanDerWaalsContact OE1-N 3.1Å; E162-F406 PolarHBondContact OE2-N 2.81Å; E162-V407 PolarHBondContact OE2-N 3.44Å; E162-V407 VanDerWaalsContact OE2-N 3.15Å
163	L	87.5	Confident	80.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-46.9	175.5	-72.5	170.9	0	0	0	112	T129 I131 I134 F140 N159 M160 M161 R165 I167 F241 V294	T129-L163 HydrophobicContact CG2-CD2 3.59Å; I131-L163 HydrophobicContact CD1-CD2 3.77Å; I131-L163 HydrophobicContact CD1-CG 4.09Å; I134-L163 HydrophobicContact CD1-CD2 4.27Å; F140-L163 HydrophobicContact CE2-CD1 4.07Å; F140-L163 HydrophobicContact CE2-CD2 4.06Å; F140-L163 HydrophobicContact CZ-CD1 4.42Å; N159-L163 WeakPolarHBondContact O-CB 3.47Å; N159-L163 VanDerWaalsContact O-CG 3.23Å; N159-L163 WeakPolarHBondContact O-CG 3.23Å; N159-L163 PolarHBondContact O-N 3.03Å; M160-L163 PolarHBondContact O-N 3.28Å; M161-L163 VanDerWaalsContact C-N 3.34Å; L163-R165 VanDerWaalsContact C-N 3.32Å; L163-R165 PolarHBondContact O-N 2.97Å; L163-I167 WeakPolarHBondContact O-CB 3.15Å; L163-I167 WeakPolarHBondContact O-CD1 3.16Å; L163-I167 WeakPolarHBondContact O-CG1 3.37Å; L163-I167 PolarHBondContact O-N 3.41Å; L163-F241 HydrophobicContact CB-CE1 4.25Å; L163-F241 HydrophobicContact CB-CZ 4.26Å; L163-V294 HydrophobicContact CD1-CG1 4.19Å; L163-V294 HydrophobicContact CD1-CG2 4.35Å
164	I	85.3	Confident	81.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-55.9	-51.2	175.5	-69.8	164.8	0	0	0	109.7	M160 M161 A168 F190 M194 V203 F241	M160-I164 VanDerWaalsContact O-CG1 3.27Å; M160-I164 WeakPolarHBondContact O-CG1 3.43Å; M160-I164 PolarHBondContact O-N 2.83Å; M161-I164 PolarHBondContact O-N 3.36Å; I164-A168 WeakPolarHBondContact O-CB 3.33Å; I164-A168 PolarHBondContact O-N 3.06Å; I164-F190 HydrophobicContact CD1-CE2 4.01Å; I164-F190 HydrophobicContact CD1-CZ 3.5Å; I164-M194 HydrophobicContact CB-CE 4.09Å; I164-M194 HydrophobicContact CB-SD 4.5Å; I164-M194 HydrophobicContact CD1-CE 3.85Å; I164-M194 HydrophobicContact CG2-CE 4.08Å; I164-M194 HydrophobicContact CG2-SD 3.84Å; I164-V203 HydrophobicContact CG2-CG2 3.82Å; I164-F241 HydrophobicContact CB-CE2 4.34Å; I164-F241 HydrophobicContact CB-CZ 4.36Å; I164-F241 HydrophobicContact CD1-CD1 4.33Å; I164-F241 HydrophobicContact CD1-CD2 3.8Å; I164-F241 HydrophobicContact CD1-CE1 4.34Å; I164-F241 HydrophobicContact CD1-CE2 3.83Å; I164-F241 HydrophobicContact CD1-CG 4.08Å; I164-F241 HydrophobicContact CD1-CZ 4.11Å; I164-F241 HydrophobicContact CG1-CD1 4.31Å; I164-F241 HydrophobicContact CG1-CD2 3.63Å; I164-F241 HydrophobicContact CG1-CE1 3.86Å; I164-F241 HydrophobicContact CG1-CE2 3.1Å; I164-F241 HydrophobicContact CG1-CG 4.21Å; I164-F241 HydrophobicContact CG1-CZ 3.25Å
165	R	85.5	Confident	81.8	Confident	47 Å²	47	28.1 Å²	28.1	18%	0.177	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-53.6	-177.1	-176.5	-163.5	178.4	-80.8	1.2	111.3	M161 E162 L163 I167 A168 I169 F406 V407	M161-R165 WeakPolarHBondContact O-CB 3.28Å; M161-R165 PolarHBondContact O-N 3.41Å; E162-R165 PolarHBondContact O-N 3.22Å; L163-R165 VanDerWaalsContact C-N 3.32Å; L163-R165 PolarHBondContact O-N 2.97Å; R165-I167 VanDerWaalsContact C-N 3.29Å; R165-I167 PolarHBondContact O-N 3.4Å; R165-A168 PolarHBondContact O-N 3.39Å; R165-I169 HydrophobicContact CG-CD1 3.66Å; R165-I169 HydrophobicContact CG-CG1 4.45Å; R165-I169 WeakPolarHBondContact O-CB 3.08Å; R165-I169 VanDerWaalsContact O-CG1 3.3Å; R165-I169 WeakPolarHBondContact O-CG1 3.43Å; R165-I169 PolarHBondContact O-N 3.25Å; R165-F406 VanDerWaalsContact CZ-CB 3.47Å; R165-F406 VanDerWaalsContact NE-CB 3.27Å; R165-F406 VanDerWaalsContact NH1-CE2 3.28Å; R165-F406 VanDerWaalsContact NH2-CD1 3.31Å; R165-V407 HydrophobicContact CB-CG2 4.45Å
166	N	85.3	Confident	82.4	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-60.7	-42.7	-175.6	-73	-4.4	0	0	0	110.7	T129 E162 E170 Y418	T129-N166 WeakPolarHBondContact O-CB 3.27Å; T129-N166 PolarHBondContact O-ND2 3.33Å; T129-N166 VanDerWaalsContact O-ND2 3.08Å; E162-N166 WeakPolarHBondContact O-CB 3.15Å; E162-N166 VanDerWaalsContact O-CG 3.3Å; E162-N166 PolarHBondContact O-N 2.7Å; N166-E170 WeakPolarHBondContact O-CB 3.4Å; N166-E170 VanDerWaalsContact O-CG 3.28Å; N166-E170 WeakPolarHBondContact O-CG 3.4Å; N166-E170 PolarHBondContact O-N 3.3Å; N166-Y418 HydrophobicContact CB-CD2 4.12Å; N166-Y418 HydrophobicContact CB-CE2 4.17Å
167	I	79.2	Confident	82.9	Confident	8 Å²	8	26 Å²	26	4%	0.041	14%	0.138	C	C	.	.	H	α-helix	trans	-77.2	-36.6	-178.3	-60.8	163.1	0	0	0	111.7	L127 L163 R165 I169 H171 S172 L239	L127-I167 HydrophobicContact CD1-CG2 4.47Å; L127-I167 HydrophobicContact CD2-CD1 3.9Å; L127-I167 HydrophobicContact CG-CD1 4.3Å; L163-I167 WeakPolarHBondContact O-CB 3.15Å; L163-I167 WeakPolarHBondContact O-CD1 3.16Å; L163-I167 WeakPolarHBondContact O-CG1 3.37Å; L163-I167 PolarHBondContact O-N 3.41Å; R165-I167 VanDerWaalsContact C-N 3.29Å; R165-I167 PolarHBondContact O-N 3.4Å; I167-I169 VanDerWaalsContact C-N 3.33Å; I167-I169 PolarHBondContact O-N 2.77Å; I167-H171 HydrophobicContact CG2-CB 4.06Å; I167-H171 CarbonylContact O-C 3.52Å; I167-H171 WeakPolarHBondContact O-CA 3.3Å; I167-H171 WeakPolarHBondContact O-CB 3.4Å; I167-H171 PolarHBondContact O-N 3.17Å; I167-S172 PolarHBondContact O-N 3.31Å; I167-L239 HydrophobicContact CB-CD1 3.6Å; I167-L239 HydrophobicContact CD1-CD1 3.51Å; I167-L239 HydrophobicContact CD1-CD2 4.01Å; I167-L239 HydrophobicContact CD1-CG 4.35Å; I167-L239 HydrophobicContact CG1-CD1 4.13Å; I167-L239 HydrophobicContact CG2-CD1 3.55Å; I167-L239 HydrophobicContact CG2-CG 4.21Å
168	A	77.5	Confident	83.8	Confident	1 Å²	1	24 Å²	24	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-67	-33.4	176.6	0	0	0	0	0	112.8	I164 R165 S172 V199 K202	I164-A168 WeakPolarHBondContact O-CB 3.33Å; I164-A168 PolarHBondContact O-N 3.06Å; R165-A168 PolarHBondContact O-N 3.39Å; A168-S172 WeakPolarHBondContact O-CA 3.28Å; A168-V199 HydrophobicContact CB-CG1 4.4Å; A168-K202 HydrophobicContact CB-CD 4.06Å; A168-K202 PolarHBondContact O-NZ 3.34Å
169	I	77.2	Confident	84.2	Confident	68 Å²	68	22 Å²	22	35%	0.349	11%	0.114	S	C	.	.	H	α-helix	trans	-81.8	-50.4	178.5	-66.4	177.2	0	0	0	110.9	R165 I167 V199	R165-I169 HydrophobicContact CG-CD1 3.66Å; R165-I169 HydrophobicContact CG-CG1 4.45Å; R165-I169 WeakPolarHBondContact O-CB 3.08Å; R165-I169 VanDerWaalsContact O-CG1 3.3Å; R165-I169 WeakPolarHBondContact O-CG1 3.43Å; R165-I169 PolarHBondContact O-N 3.25Å; I167-I169 VanDerWaalsContact C-N 3.33Å; I167-I169 PolarHBondContact O-N 2.77Å; I169-V199 HydrophobicContact CD1-CG1 4.43Å; I169-V199 HydrophobicContact CG1-CG1 4.22Å
170	E	72.2	Confident	84.6	Confident	105 Å²	105	21.9 Å²	21.9	49%	0.491	11%	0.113	S	C	.	.	H	α-helix	trans	-80.5	-38.7	-173.2	-62.3	-61.1	151.2	0	0	112.8	N166 Y418	N166-E170 WeakPolarHBondContact O-CB 3.4Å; N166-E170 VanDerWaalsContact O-CG 3.28Å; N166-E170 WeakPolarHBondContact O-CG 3.4Å; N166-E170 PolarHBondContact O-N 3.3Å; E170-Y418 HydrophobicContact CG-CD2 4Å; E170-Y418 HydrophobicContact CG-CE2 3.73Å
171	H	70.1	Confident	84.8	Confident	89 Å²	89	21.9 Å²	21.9	41%	0.412	11%	0.113	S	C	.	.	S	Bend	trans	-105.4	2.4	-175	-61.6	-75	0	0	0	113.9	E128 I167 G173	E128-H171 PolarHBondContact O-NE2 3.38Å; I167-H171 HydrophobicContact CG2-CB 4.06Å; I167-H171 CarbonylContact O-C 3.52Å; I167-H171 WeakPolarHBondContact O-CA 3.3Å; I167-H171 WeakPolarHBondContact O-CB 3.4Å; I167-H171 PolarHBondContact O-N 3.17Å; H171-G173 PolarHBondContact O-N 3.32Å
172	S	66	Low	84.9	Confident	85 Å²	85	22.4 Å²	22.4	59%	0.594	12%	0.116	S	C	*	.			trans	49.8	29.9	-177.7	-65.4	0	0	0	0	114.3	I167 A168	I167-S172 PolarHBondContact O-N 3.31Å; A168-S172 WeakPolarHBondContact O-CA 3.28Å
173	G	79.9	Confident	84.9	Confident	11 Å²	11	27.9 Å²	27.9	11%	0.113	14%	0.136	C	C	.	.			trans	-78.5	158	-179.7	0	0	0	0	0	113	H171	H171-G173 PolarHBondContact O-N 3.32Å
174	Y	89.1	Confident	84.9	Confident	34 Å²	34	31.6 Å²	31.6	13%	0.133	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	149.5	166.6	-68	-26	0	0	0	110.1	K82 L85 K202 F231 R236 V238 L239	K82-Y174 HydrophobicContact CG-CE2 4.28Å; L85-Y174 HydrophobicContact CD1-CD1 4.07Å; L85-Y174 HydrophobicContact CD1-CD2 4.15Å; L85-Y174 HydrophobicContact CD1-CE1 3.68Å; L85-Y174 HydrophobicContact CD1-CE2 3.74Å; L85-Y174 HydrophobicContact CD1-CG 4.31Å; L85-Y174 HydrophobicContact CD2-CD1 4.23Å; L85-Y174 HydrophobicContact CD2-CD2 4.42Å; L85-Y174 HydrophobicContact CD2-CG 4.12Å; Y174-K202 HydrophobicContact CD1-CB 4.37Å; Y174-F231 AromaticContact CD2-CD1 3.69Å; Y174-F231 HydrophobicContact CD2-CD1 3.69Å; Y174-F231 HydrophobicContact CD2-CD2 4.42Å; Y174-F231 AromaticContact CD2-CE1 3.86Å; Y174-F231 HydrophobicContact CD2-CE1 3.86Å; Y174-F231 AromaticContact CD2-CG 3.99Å; Y174-F231 HydrophobicContact CD2-CG 3.99Å; Y174-F231 HydrophobicContact CD2-CZ 4.32Å; Y174-F231 HydrophobicContact CE2-CD1 4.09Å; Y174-F231 HydrophobicContact CE2-CE1 4.05Å; Y174-R236 PolarHBondContact OH-NH1 3.45Å; Y174-R236 VanDerWaalsContact OH-NH1 3.11Å; Y174-V238 WeakPolarHBondContact O-CA 3.43Å; Y174-L239 PolarHBondContact O-N 3.35Å
175	S	91.7	Very high	84.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.007	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145.3	174.9	-60.1	0	0	0	0	110.3	K202 V203 S204 L239	S175-K202 PolarHBondContact N-O 3.23Å; S175-V203 CarbonylContact O-C 3.6Å; S175-V203 VanDerWaalsContact O-CA 3.27Å; S175-V203 WeakPolarHBondContact O-CA 3.47Å; S175-S204 PolarHBondContact O-N 2.91Å; S175-L239 CarbonylContact C-O 3.59Å; S175-L239 VanDerWaalsContact CA-O 3.29Å; S175-L239 WeakPolarHBondContact CA-O 3.46Å
176	V	94.1	Very high	84.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.1	168.7	-176.1	0	0	0	0	108	S204 G224 M227 A228 F231 V238 L239 L240 F241	V176-S204 WeakPolarHBondContact CA-O 3.34Å; V176-G224 WeakPolarHBondContact CG1-O 3.37Å; V176-M227 HydrophobicContact CG1-CB 4.26Å; V176-M227 HydrophobicContact CG2-CB 4.33Å; V176-A228 HydrophobicContact CB-CB 4.23Å; V176-A228 HydrophobicContact CG2-CB 3.94Å; V176-F231 HydrophobicContact CG2-CD2 4.08Å; V176-F231 HydrophobicContact CG2-CE2 4.08Å; V176-V238 HydrophobicContact CG2-CG1 4.24Å; V176-L239 PolarHBondContact N-O 3.01Å; V176-L240 HydrophobicContact CB-CD1 4.15Å; V176-L240 HydrophobicContact CG1-CD1 4.26Å; V176-L240 CarbonylContact O-C 3.53Å; V176-L240 WeakPolarHBondContact O-CA 3.37Å; V176-F241 PolarHBondContact O-N 3.1Å
177	F	93.8	Very high	84.7	Confident	5 Å²	5	39 Å²	39	2%	0.022	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.3	178	-177.6	-86	0	0	0	109.7	F190 V203 S204 L205 V206 Y207 F241 D243	F177-F190 HydrophobicContact CB-CE1 4.35Å; F177-F190 HydrophobicContact CB-CZ 4.34Å; F177-F190 HydrophobicContact CD1-CE1 4.37Å; F177-F190 HydrophobicContact CD2-CE1 4.02Å; F177-F190 AromaticContact CD2-CE2 3.82Å; F177-F190 HydrophobicContact CD2-CE2 3.82Å; F177-F190 AromaticContact CD2-CZ 3.42Å; F177-F190 HydrophobicContact CD2-CZ 3.42Å; F177-F190 VanDerWaalsContact CD2-CZ 3.42Å; F177-F190 HydrophobicContact CE2-CD2 4.28Å; F177-F190 HydrophobicContact CE2-CE1 4.47Å; F177-F190 AromaticContact CE2-CE2 3.69Å; F177-F190 HydrophobicContact CE2-CE2 3.69Å; F177-F190 AromaticContact CE2-CZ 3.8Å; F177-F190 HydrophobicContact CE2-CZ 3.8Å; F177-F190 AromaticContact CG-CE1 3.98Å; F177-F190 HydrophobicContact CG-CE1 3.98Å; F177-F190 AromaticContact CG-CZ 3.85Å; F177-F190 HydrophobicContact CG-CZ 3.85Å; F177-F190 HydrophobicContact CZ-CE2 4.33Å; F177-F190 HydrophobicContact CZ-CZ 4.49Å; F177-V203 HydrophobicContact CB-CG1 4.38Å; F177-S204 PolarHBondContact N-O 3.31Å; F177-L205 HydrophobicContact CB-CD2 3.6Å; F177-L205 HydrophobicContact CD1-CD2 3.91Å; F177-L205 HydrophobicContact CG-CD2 3.97Å; F177-V206 PolarHBondContact O-N 3.32Å; F177-Y207 HydrophobicContact CD1-CE1 4.19Å; F177-Y207 AromaticContact CE1-CE1 3.72Å; F177-Y207 HydrophobicContact CE1-CE1 3.72Å; F177-F241 HydrophobicContact CB-CB 4.49Å; F177-F241 HydrophobicContact CD2-CB 3.59Å; F177-F241 HydrophobicContact CD2-CG 4.43Å; F177-F241 HydrophobicContact CE2-CB 4.23Å; F177-F241 HydrophobicContact CG-CB 4.4Å; F177-D243 HydrophobicContact CE2-CB 4.38Å; F177-D243 HydrophobicContact CZ-CB 4.09Å
178	A	95.2	Very high	85	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	100.6	175.8	0	0	0	0	0	109.7	V180 V206 F241 D243	A178-V180 PolarHBondContact O-N 2.75Å; A178-V206 WeakPolarHBondContact CA-O 3.43Å; A178-F241 PolarHBondContact N-O 3.42Å; A178-D243 PolarHBondContact O-N 3.15Å; A178-D243 VanDerWaalsContact O-N 3.17Å
179	G	93.7	Very high	85.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	90.9	174.7	0	0	0	0	0	111.5	E182 V206 G208 D243	G179-E182 VanDerWaalsContact CA-CG 3.47Å; G179-V206 PolarHBondContact N-O 2.9Å; G179-G208 PolarHBondContact O-N 3.22Å; G179-D243 CarbonylContact C-O 3.57Å; G179-D243 VanDerWaalsContact CA-O 3.27Å; G179-D243 WeakPolarHBondContact CA-O 3.37Å
180	V	94.3	Very high	85.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109	178.2	-172.2	0	0	0	0	111.1	A178 E182 R217 V220 A221 V242 D243 N244 R247	A178-V180 PolarHBondContact O-N 2.75Å; V180-E182 PolarHBondContact O-N 2.85Å; V180-R217 VanDerWaalsContact CG1-O 3.23Å; V180-R217 WeakPolarHBondContact CG1-O 3.45Å; V180-V220 HydrophobicContact CB-CG1 3.99Å; V180-V220 HydrophobicContact CG1-CG1 4.05Å; V180-V220 HydrophobicContact CG2-CG1 3.63Å; V180-A221 HydrophobicContact CG2-CB 3.87Å; V180-V242 HydrophobicContact CG2-CG1 3.83Å; V180-D243 PolarHBondContact N-O 3.37Å; V180-N244 PolarHBondContact O-N 2.95Å; V180-R247 HydrophobicContact CB-CB 4.44Å; V180-R247 HydrophobicContact CG1-CB 3.96Å; V180-R247 WeakPolarHBondContact O-CB 3.38Å; V180-R247 WeakPolarHBondContact O-CG 3.04Å
181	G	90.6	Very high	86.5	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.4	34.3	-176.8	0	0	0	0	0	111.9	G208 M210	G181-G208 WeakPolarHBondContact CA-O 3.49Å; G181-G208 PolarHBondContact N-O 3.27Å; G181-M210 WeakPolarHBondContact O-CE 3.06Å; G181-M210 WeakPolarHBondContact O-CG 3.48Å
182	E	86.9	Confident	87.3	Confident	15 Å²	15	39.3 Å²	39.3	7%	0.07	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	152.3	178.8	-80.5	-56.9	128.5	0	0	111.8	G179 V180 Y207 M210 D243	G179-E182 VanDerWaalsContact CA-CG 3.47Å; V180-E182 PolarHBondContact O-N 2.85Å; E182-Y207 HydrophobicContact CB-CD1 4.27Å; E182-M210 PolarHBondContact O-N 3.14Å; E182-M210 VanDerWaalsContact O-N 3.16Å; E182-D243 VanDerWaalsContact CG-O 3.26Å; E182-D243 WeakPolarHBondContact CG-O 3.32Å
183	R	88.7	Confident	88	Confident	114 Å²	114	37.3 Å²	37.3	43%	0.43	18%	0.176	S	C	.	.			trans	-79.3	139.7	173.3	-62.7	-175.5	-175.6	80.5	0.2	109.3	R185 E186 G187 M210	R183-R185 PolarHBondContact O-N 2.63Å; R183-R185 VanDerWaalsContact O-N 3.15Å; R183-E186 HydrophobicContact CB-CB 4.35Å; R183-E186 HydrophobicContact CB-CG 4.31Å; R183-E186 WeakPolarHBondContact CB-OE2 3.35Å; R183-E186 WeakPolarHBondContact CD-OE2 3.31Å; R183-E186 WeakPolarHBondContact CG-OE2 3.38Å; R183-E186 IonicContact CZ-OE2 3.69Å; R183-E186 IonicContact NH1-OE1 3.68Å; R183-E186 PolarHBondContact NH1-OE1 2.82Å; R183-E186 IonicContact NH1-OE2 2.85Å; R183-E186 PolarHBondContact NH1-OE2 2.63Å; R183-E186 PolarHBondContact O-N 2.65Å; R183-G187 PolarHBondContact O-N 2.89Å; R183-M210 HydrophobicContact CG-CE 3.74Å; R183-M210 HydrophobicContact CG-CG 4.42Å; R183-M210 HydrophobicContact CG-SD 3.63Å
184	T	85.6	Confident	88.2	Confident	79 Å²	79	36.9 Å²	36.9	49%	0.485	17%	0.171	S	C	.	.	H	α-helix	trans	-55.9	-35.6	177.9	-42.3	0	0	0	0	112.6	N188	T184-N188 WeakPolarHBondContact O-CB 3.45Å; T184-N188 PolarHBondContact O-N 2.96Å
185	R	85.9	Confident	88	Confident	147 Å²	147	37.5 Å²	37.5	56%	0.555	18%	0.179	S	C	*	.	H	α-helix	trans	-62.7	-48.8	174.6	-174.9	-176	56.5	65.5	5.4	111.8	R183 N188 D189	R183-R185 PolarHBondContact O-N 2.63Å; R183-R185 VanDerWaalsContact O-N 3.15Å; R185-N188 WeakPolarHBondContact O-CB 3.04Å; R185-N188 PolarHBondContact O-N 3.45Å; R185-D189 IonicContact NH1-OD2 3.65Å; R185-D189 PolarHBondContact NH1-OD2 3.28Å; R185-D189 PolarHBondContact O-N 2.87Å
186	E	81.3	Confident	87.5	Confident	47 Å²	47	43.6 Å²	43.6	22%	0.22	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-42	-177.2	-70.6	164.3	170.3	0	0	110.8	R183 N188 D189 F190	R183-E186 HydrophobicContact CB-CB 4.35Å; R183-E186 HydrophobicContact CB-CG 4.31Å; R183-E186 WeakPolarHBondContact CB-OE2 3.35Å; R183-E186 WeakPolarHBondContact CD-OE2 3.31Å; R183-E186 WeakPolarHBondContact CG-OE2 3.38Å; R183-E186 IonicContact CZ-OE2 3.69Å; R183-E186 IonicContact NH1-OE1 3.68Å; R183-E186 PolarHBondContact NH1-OE1 2.82Å; R183-E186 IonicContact NH1-OE2 2.85Å; R183-E186 PolarHBondContact NH1-OE2 2.63Å; R183-E186 PolarHBondContact O-N 2.65Å; E186-N188 PolarHBondContact O-N 3.41Å; E186-D189 PolarHBondContact O-N 3.43Å; E186-F190 WeakPolarHBondContact O-CB 3.43Å; E186-F190 PolarHBondContact O-N 3.28Å
187	G	84.8	Confident	86.7	Confident	10 Å²	10	45.2 Å²	45.2	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-34.6	173.1	0	0	0	0	0	113.8	R183 Y191 Y207	R183-G187 PolarHBondContact O-N 2.89Å; G187-Y191 WeakPolarHBondContact O-CB 3.33Å; G187-Y191 PolarHBondContact O-N 2.87Å; G187-Y207 PolarHBondContact O-OH 2.84Å
188	N	87.1	Confident	86.1	Confident	83 Å²	83	51.4 Å²	51.4	44%	0.444	26%	0.256	S	S	.	.	H	α-helix	trans	-66.7	-47.1	174.3	179	82.7	0	0	0	111.6	T184 R185 E186 F190 Y191 H192	T184-N188 WeakPolarHBondContact O-CB 3.45Å; T184-N188 PolarHBondContact O-N 2.96Å; R185-N188 WeakPolarHBondContact O-CB 3.04Å; R185-N188 PolarHBondContact O-N 3.45Å; E186-N188 PolarHBondContact O-N 3.41Å; N188-F190 VanDerWaalsContact C-N 3.34Å; N188-Y191 PolarHBondContact O-N 3.48Å; N188-H192 PolarHBondContact O-N 3.16Å; N188-H192 VanDerWaalsContact O-N 3.14Å; N188-H192 PolarHBondContact O-ND1 2.92Å; N188-H192 PolarHBondContact OD1-CE1 3.17Å
189	D	84.3	Confident	85.5	Confident	59 Å²	59	51.5 Å²	51.5	32%	0.316	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-47.5	178.2	-62.5	-16.9	0	0	0	109.5	R185 E186 Y191 H192 E193	R185-D189 IonicContact NH1-OD2 3.65Å; R185-D189 PolarHBondContact NH1-OD2 3.28Å; R185-D189 PolarHBondContact O-N 2.87Å; E186-D189 PolarHBondContact O-N 3.43Å; D189-Y191 PolarHBondContact O-N 2.73Å; D189-H192 PolarHBondContact O-N 3.09Å; D189-E193 WeakPolarHBondContact O-CG 3.37Å; D189-E193 PolarHBondContact O-N 2.99Å
190	F	84.8	Confident	85.1	Confident	3 Å²	3	52.7 Å²	52.7	1%	0.013	26%	0.262	C	S	.	.	H	α-helix	trans	-56.3	-44.9	175.8	-174.3	-83.5	0	0	0	113	T157 M161 I164 F177 E186 N188 H192 E193 M194 L205	T157-F190 HydrophobicContact CG2-CD2 4.02Å; M161-F190 HydrophobicContact CG-CD2 3.5Å; M161-F190 VanDerWaalsContact CG-CD2 3.5Å; M161-F190 HydrophobicContact CG-CE2 3.39Å; M161-F190 HydrophobicContact CG-CZ 4.4Å; M161-F190 HydrophobicContact SD-CD2 3.51Å; M161-F190 VanDerWaalsContact SD-CD2 3.51Å; M161-F190 HydrophobicContact SD-CE2 4.06Å; M161-F190 HydrophobicContact SD-CG 4.25Å; I164-F190 HydrophobicContact CD1-CE2 4.01Å; I164-F190 HydrophobicContact CD1-CZ 3.5Å; F177-F190 HydrophobicContact CB-CE1 4.35Å; F177-F190 HydrophobicContact CB-CZ 4.34Å; F177-F190 HydrophobicContact CD1-CE1 4.37Å; F177-F190 HydrophobicContact CD2-CE1 4.02Å; F177-F190 AromaticContact CD2-CE2 3.82Å; F177-F190 HydrophobicContact CD2-CE2 3.82Å; F177-F190 AromaticContact CD2-CZ 3.42Å; F177-F190 HydrophobicContact CD2-CZ 3.42Å; F177-F190 VanDerWaalsContact CD2-CZ 3.42Å; F177-F190 HydrophobicContact CE2-CD2 4.28Å; F177-F190 HydrophobicContact CE2-CE1 4.47Å; F177-F190 AromaticContact CE2-CE2 3.69Å; F177-F190 HydrophobicContact CE2-CE2 3.69Å; F177-F190 AromaticContact CE2-CZ 3.8Å; F177-F190 HydrophobicContact CE2-CZ 3.8Å; F177-F190 AromaticContact CG-CE1 3.98Å; F177-F190 HydrophobicContact CG-CE1 3.98Å; F177-F190 AromaticContact CG-CZ 3.85Å; F177-F190 HydrophobicContact CG-CZ 3.85Å; F177-F190 HydrophobicContact CZ-CE2 4.33Å; F177-F190 HydrophobicContact CZ-CZ 4.49Å; E186-F190 WeakPolarHBondContact O-CB 3.43Å; E186-F190 PolarHBondContact O-N 3.28Å; N188-F190 VanDerWaalsContact C-N 3.34Å; F190-H192 PolarHBondContact O-N 2.77Å; F190-E193 PolarHBondContact O-N 2.91Å; F190-M194 HydrophobicContact CD1-CG 3.92Å; F190-M194 HydrophobicContact CE1-CE 4.22Å; F190-M194 HydrophobicContact CE1-CG 3.61Å; F190-M194 HydrophobicContact CE1-SD 4.42Å; F190-M194 HydrophobicContact CE2-CE 3.89Å; F190-M194 HydrophobicContact CZ-CE 3.73Å; F190-M194 HydrophobicContact CZ-CG 4.1Å; F190-M194 HydrophobicContact CZ-SD 4.39Å; F190-M194 WeakPolarHBondContact O-CB 3.38Å; F190-M194 VanDerWaalsContact O-CG 3.23Å; F190-M194 WeakPolarHBondContact O-CG 3.25Å; F190-M194 PolarHBondContact O-N 3.45Å; F190-L205 HydrophobicContact CD1-CD2 3.84Å; F190-L205 HydrophobicContact CE1-CD2 3.43Å; F190-L205 VanDerWaalsContact CE1-CD2 3.43Å
191	Y	87.6	Confident	84.8	Confident	44 Å²	44	57.2 Å²	57.2	17%	0.173	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-42.4	178.7	173.4	-100.3	0	0	0	112.5	I88 K99 G187 N188 D189 T195 I200 L205	I88-Y191 HydrophobicContact CD1-CD1 4.46Å; I88-Y191 HydrophobicContact CD1-CD2 3.43Å; I88-Y191 VanDerWaalsContact CD1-CD2 3.43Å; I88-Y191 HydrophobicContact CD1-CE2 3.73Å; I88-Y191 HydrophobicContact CD1-CG 3.83Å; I88-Y191 HydrophobicContact CG1-CD2 3.93Å; I88-Y191 HydrophobicContact CG1-CE2 4.07Å; K99-Y191 VanDerWaalsContact CE-OH 3.22Å; K99-Y191 WeakPolarHBondContact CE-OH 3.22Å; K99-Y191 PolarHBondContact NZ-OH 2.97Å; G187-Y191 WeakPolarHBondContact O-CB 3.33Å; G187-Y191 PolarHBondContact O-N 2.87Å; N188-Y191 PolarHBondContact O-N 3.48Å; D189-Y191 PolarHBondContact O-N 2.73Å; Y191-T195 WeakPolarHBondContact O-CB 3.2Å; Y191-T195 PolarHBondContact O-N 2.54Å; Y191-T195 PolarHBondContact O-OG1 3.2Å; Y191-I200 HydrophobicContact CD2-CD1 3.87Å; Y191-I200 HydrophobicContact CE2-CD1 3.86Å; Y191-I200 HydrophobicContact CE2-CG1 4.06Å; Y191-L205 HydrophobicContact CD2-CD1 3.69Å
192	H	87.6	Confident	84.7	Confident	87 Å²	87	59.7 Å²	59.7	40%	0.403	30%	0.297	S	S	.	.	H	α-helix	trans	-68	-44.4	178.3	-72.1	83.4	0	0	0	111	N188 D189 F190 M194 T195 D196	N188-H192 PolarHBondContact O-N 3.16Å; N188-H192 VanDerWaalsContact O-N 3.14Å; N188-H192 PolarHBondContact O-ND1 2.92Å; N188-H192 PolarHBondContact OD1-CE1 3.17Å; D189-H192 PolarHBondContact O-N 3.09Å; F190-H192 PolarHBondContact O-N 2.77Å; H192-M194 VanDerWaalsContact C-N 3.33Å; H192-M194 PolarHBondContact O-N 2.84Å; H192-T195 WeakPolarHBondContact O-CA 3.49Å; H192-T195 WeakPolarHBondContact O-CB 3.1Å; H192-T195 PolarHBondContact O-N 2.71Å; H192-D196 PolarHBondContact O-N 3.01Å
193	E	80.6	Confident	84.8	Confident	44 Å²	44	59 Å²	59	21%	0.206	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-38.5	178.3	-71.2	-177.4	-152.1	0	0	112.7	M161 D189 F190 T195 S197 V407	M161-E193 WeakPolarHBondContact CE-OE2 3.49Å; M161-E193 HydrophobicContact SD-CB 4.13Å; D189-E193 WeakPolarHBondContact O-CG 3.37Å; D189-E193 PolarHBondContact O-N 2.99Å; F190-E193 PolarHBondContact O-N 2.91Å; E193-T195 VanDerWaalsContact C-N 3.33Å; E193-S197 VanDerWaalsContact O-CB 3.26Å; E193-S197 WeakPolarHBondContact O-CB 3.44Å; E193-S197 PolarHBondContact O-N 2.81Å; E193-S197 PolarHBondContact O-OG 3.38Å; E193-V407 WeakPolarHBondContact OE2-CG1 3.32Å
194	M	84	Confident	85.1	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-67.3	-34.3	173.6	-71.2	-67.1	146.2	0	0	112.7	M161 I164 F190 H192 N198 V199 I200 V203	M161-M194 HydrophobicContact CB-CE 3.57Å; M161-M194 HydrophobicContact CG-CE 3.44Å; M161-M194 VanDerWaalsContact CG-CE 3.44Å; M161-M194 HydrophobicContact SD-CE 4.3Å; I164-M194 HydrophobicContact CB-CE 4.09Å; I164-M194 HydrophobicContact CB-SD 4.5Å; I164-M194 HydrophobicContact CD1-CE 3.85Å; I164-M194 HydrophobicContact CG2-CE 4.08Å; I164-M194 HydrophobicContact CG2-SD 3.84Å; F190-M194 HydrophobicContact CD1-CG 3.92Å; F190-M194 HydrophobicContact CE1-CE 4.22Å; F190-M194 HydrophobicContact CE1-CG 3.61Å; F190-M194 HydrophobicContact CE1-SD 4.42Å; F190-M194 HydrophobicContact CE2-CE 3.89Å; F190-M194 HydrophobicContact CZ-CE 3.73Å; F190-M194 HydrophobicContact CZ-CG 4.1Å; F190-M194 HydrophobicContact CZ-SD 4.39Å; F190-M194 WeakPolarHBondContact O-CB 3.38Å; F190-M194 VanDerWaalsContact O-CG 3.23Å; F190-M194 WeakPolarHBondContact O-CG 3.25Å; F190-M194 PolarHBondContact O-N 3.45Å; H192-M194 VanDerWaalsContact C-N 3.33Å; H192-M194 PolarHBondContact O-N 2.84Å; M194-N198 PolarHBondContact O-N 2.91Å; M194-V199 HydrophobicContact CB-CG2 4.33Å; M194-V199 WeakPolarHBondContact O-CG2 3.43Å; M194-V199 PolarHBondContact O-N 2.97Å; M194-V199 VanDerWaalsContact O-N 3.15Å; M194-V199 HydrophobicContact SD-CG2 3.43Å; M194-V199 WeakPolarHBondContact SD-CG2 3.4Å; M194-I200 HydrophobicContact CB-CB 4.42Å; M194-I200 HydrophobicContact CB-CD1 4.17Å; M194-I200 PolarHBondContact O-N 3.07Å; M194-V203 HydrophobicContact SD-CG2 4.34Å
195	T	85.5	Confident	85.5	Confident	48 Å²	48	49.8 Å²	49.8	29%	0.294	25%	0.25	S	S	.	.	H	α-helix	trans	-69.7	-47.7	176.2	-58.3	0	0	0	0	110.5	Y191 H192 E193 S197 N198	Y191-T195 WeakPolarHBondContact O-CB 3.2Å; Y191-T195 PolarHBondContact O-N 2.54Å; Y191-T195 PolarHBondContact O-OG1 3.2Å; H192-T195 WeakPolarHBondContact O-CA 3.49Å; H192-T195 WeakPolarHBondContact O-CB 3.1Å; H192-T195 PolarHBondContact O-N 2.71Å; E193-T195 VanDerWaalsContact C-N 3.33Å; T195-S197 PolarHBondContact O-N 2.91Å; T195-N198 PolarHBondContact O-N 2.62Å
196	D	81.9	Confident	86	Confident	128 Å²	128	42.8 Å²	42.8	68%	0.684	22%	0.224	S	C	*	.	H	α-helix	trans	-64.2	-32.3	179.1	-68.7	-16.2	0	0	0	111.9	H192 N198	H192-D196 PolarHBondContact O-N 3.01Å; D196-N198 PolarHBondContact O-N 2.94Å
197	S	76.1	Confident	86.6	Confident	34 Å²	34	41.3 Å²	41.3	24%	0.238	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.6	175.2	-61.9	0	0	0	0	114	E193 T195 V199	E193-S197 VanDerWaalsContact O-CB 3.26Å; E193-S197 WeakPolarHBondContact O-CB 3.44Å; E193-S197 PolarHBondContact O-N 2.81Å; E193-S197 PolarHBondContact O-OG 3.38Å; T195-S197 PolarHBondContact O-N 2.91Å; S197-V199 PolarHBondContact O-N 2.77Å
198	N	80.6	Confident	87	Confident	136 Å²	136	40.8 Å²	40.8	73%	0.727	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	35.3	-175.3	-61.8	-57.3	0	0	0	113.9	M194 T195 D196	M194-N198 PolarHBondContact O-N 2.91Å; T195-N198 PolarHBondContact O-N 2.62Å; D196-N198 PolarHBondContact O-N 2.94Å
199	V	82.8	Confident	87.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	20%	0.202	C	C	.	.			trans	-114.3	-5	176.4	-63.9	0	0	0	0	112.5	A168 I169 M194 S197 D201 K202 V203	A168-V199 HydrophobicContact CB-CG1 4.4Å; I169-V199 HydrophobicContact CD1-CG1 4.43Å; I169-V199 HydrophobicContact CG1-CG1 4.22Å; M194-V199 HydrophobicContact CB-CG2 4.33Å; M194-V199 WeakPolarHBondContact O-CG2 3.43Å; M194-V199 PolarHBondContact O-N 2.97Å; M194-V199 VanDerWaalsContact O-N 3.15Å; M194-V199 HydrophobicContact SD-CG2 3.43Å; M194-V199 WeakPolarHBondContact SD-CG2 3.4Å; S197-V199 PolarHBondContact O-N 2.77Å; V199-D201 PolarHBondContact O-N 3.31Å; V199-K202 WeakPolarHBondContact O-CB 3.37Å; V199-K202 PolarHBondContact O-N 2.97Å; V199-V203 WeakPolarHBondContact O-CG2 3.32Å
200	I	87	Confident	87.4	Confident	24 Å²	24	39.8 Å²	39.8	12%	0.123	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-56.4	-34.1	-177.5	-171.6	56.7	0	0	0	112.8	G86 Y191 M194 K202 V203 L205	G86-I200 WeakPolarHBondContact CA-O 3.44Å; G86-I200 PolarHBondContact N-O 3.32Å; G86-I200 VanDerWaalsContact N-O 3.16Å; Y191-I200 HydrophobicContact CD2-CD1 3.87Å; Y191-I200 HydrophobicContact CE2-CD1 3.86Å; Y191-I200 HydrophobicContact CE2-CG1 4.06Å; M194-I200 HydrophobicContact CB-CB 4.42Å; M194-I200 HydrophobicContact CB-CD1 4.17Å; M194-I200 PolarHBondContact O-N 3.07Å; I200-K202 PolarHBondContact O-N 3.43Å; I200-K202 VanDerWaalsContact O-N 3.15Å; I200-V203 PolarHBondContact O-N 3.5Å; I200-V203 VanDerWaalsContact O-N 3.12Å; I200-L205 HydrophobicContact CD1-CD1 3.74Å
201	D	87.4	Confident	87.6	Confident	96 Å²	96	45.4 Å²	45.4	51%	0.513	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-68.4	-7.9	177.1	67.8	-47.3	0	0	0	114	L85 V199	L85-D201 WeakPolarHBondContact CB-O 2.94Å; V199-D201 PolarHBondContact O-N 3.31Å
202	K	87.7	Confident	87.8	Confident	53 Å²	53	45.3 Å²	45.3	23%	0.23	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-110.2	1.7	175.7	-59.9	-179.8	175.2	177.8	0	113.1	A168 Y174 S175 V199 I200	A168-K202 HydrophobicContact CB-CD 4.06Å; A168-K202 PolarHBondContact O-NZ 3.34Å; Y174-K202 HydrophobicContact CD1-CB 4.37Å; S175-K202 PolarHBondContact N-O 3.23Å; V199-K202 WeakPolarHBondContact O-CB 3.37Å; V199-K202 PolarHBondContact O-N 2.97Å; I200-K202 PolarHBondContact O-N 3.43Å; I200-K202 VanDerWaalsContact O-N 3.15Å
203	V	90.5	Very high	88	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.5	-175.3	-172.8	0	0	0	0	110.8	G86 I164 S175 F177 M194 V199 I200 L205	G86-V203 PolarHBondContact N-O 3.28Å; I164-V203 HydrophobicContact CG2-CG2 3.82Å; S175-V203 CarbonylContact O-C 3.6Å; S175-V203 VanDerWaalsContact O-CA 3.27Å; S175-V203 WeakPolarHBondContact O-CA 3.47Å; F177-V203 HydrophobicContact CB-CG1 4.38Å; M194-V203 HydrophobicContact SD-CG2 4.34Å; V199-V203 WeakPolarHBondContact O-CG2 3.32Å; I200-V203 PolarHBondContact O-N 3.5Å; I200-V203 VanDerWaalsContact O-N 3.12Å; V203-L205 HydrophobicContact CG1-CD2 3.97Å; V203-L205 HydrophobicContact CG1-CG 4.23Å
204	S	93.5	Very high	88.6	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.4	166.7	-57.5	0	0	0	0	109.7	T84 S175 V176 F177	T84-S204 PolarHBondContact O-OG 3.29Å; T84-S204 PolarHBondContact OG1-OG 2.66Å; S175-S204 PolarHBondContact O-N 2.91Å; V176-S204 WeakPolarHBondContact CA-O 3.34Å; F177-S204 PolarHBondContact N-O 3.31Å
205	L	94.6	Very high	89.1	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.7	-176.3	-66.8	167.9	0	0	0	110.5	R87 I88 M89 F177 F190 Y191 I200 V203 Y207	R87-L205 PolarHBondContact O-N 3.36Å; I88-L205 CarbonylContact C-O 3.46Å; I88-L205 WeakPolarHBondContact CA-O 3.04Å; I88-L205 HydrophobicContact CB-CB 4.43Å; I88-L205 HydrophobicContact CG1-CB 4.17Å; I88-L205 HydrophobicContact CG1-CD1 3.92Å; I88-L205 HydrophobicContact CG2-CB 4.28Å; M89-L205 PolarHBondContact N-O 3.37Å; F177-L205 HydrophobicContact CB-CD2 3.6Å; F177-L205 HydrophobicContact CD1-CD2 3.91Å; F177-L205 HydrophobicContact CG-CD2 3.97Å; F190-L205 HydrophobicContact CD1-CD2 3.84Å; F190-L205 HydrophobicContact CE1-CD2 3.43Å; F190-L205 VanDerWaalsContact CE1-CD2 3.43Å; Y191-L205 HydrophobicContact CD2-CD1 3.69Å; I200-L205 HydrophobicContact CD1-CD1 3.74Å; V203-L205 HydrophobicContact CG1-CD2 3.97Å; V203-L205 HydrophobicContact CG1-CG 4.23Å; L205-Y207 HydrophobicContact CB-CE2 3.92Å; L205-Y207 HydrophobicContact CD2-CE2 4.49Å
206	V	95.4	Very high	89.5	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.6	174.4	-166.3	0	0	0	0	109	M89 F177 A178 G179 V220 T223 M227	M89-V206 HydrophobicContact CE-CG2 4.22Å; M89-V206 WeakPolarHBondContact O-CA 3.14Å; F177-V206 PolarHBondContact O-N 3.32Å; A178-V206 WeakPolarHBondContact CA-O 3.43Å; G179-V206 PolarHBondContact N-O 2.9Å; V206-V220 HydrophobicContact CB-CG2 4.21Å; V206-V220 HydrophobicContact CG1-CG2 3.47Å; V206-V220 VanDerWaalsContact CG1-CG2 3.47Å; V206-T223 HydrophobicContact CG1-CG2 3.58Å; V206-T223 HydrophobicContact CG2-CG2 4.3Å; V206-M227 HydrophobicContact CG2-CE 3.81Å; V206-M227 HydrophobicContact CG2-SD 3.43Å; V206-M227 WeakPolarHBondContact CG2-SD 2.99Å
207	Y	95.1	Very high	90.2	Very high	15 Å²	15	34 Å²	34	6%	0.059	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.2	179.1	-67.3	-81.5	0	0	0	112.2	I88 M89 F177 E182 G187 L205	I88-Y207 HydrophobicContact CG2-CD2 3.43Å; I88-Y207 VanDerWaalsContact CG2-CD2 3.43Å; I88-Y207 HydrophobicContact CG2-CE2 3.64Å; M89-Y207 PolarHBondContact O-N 3.18Å; F177-Y207 HydrophobicContact CD1-CE1 4.19Å; F177-Y207 AromaticContact CE1-CE1 3.72Å; F177-Y207 HydrophobicContact CE1-CE1 3.72Å; E182-Y207 HydrophobicContact CB-CD1 4.27Å; G187-Y207 PolarHBondContact O-OH 2.84Å; L205-Y207 HydrophobicContact CB-CE2 3.92Å; L205-Y207 HydrophobicContact CD2-CE2 4.49Å
208	G	92.8	Very high	91.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	97.6	164.4	0	0	0	0	0	106.9	G179 G181 E212 V220	G179-G208 PolarHBondContact O-N 3.22Å; G181-G208 WeakPolarHBondContact CA-O 3.49Å; G181-G208 PolarHBondContact N-O 3.27Å; G208-E212 WeakPolarHBondContact CA-OE2 3.35Å; G208-V220 VanDerWaalsContact N-CG2 3.32Å
209	Q	91.6	Very high	91.8	Very high	51 Å²	51	26.8 Å²	26.8	24%	0.238	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	162.7	-162.5	-59.9	-177.9	-22.4	0	0	113	N211 E212	Q209-N211 VanDerWaalsContact C-N 3.27Å; Q209-N211 WeakPolarHBondContact CB-OD1 3.42Å; Q209-N211 PolarHBondContact O-N 2.88Å; Q209-N211 PolarHBondContact OE1-OD1 3.31Å; Q209-E212 HydrophobicContact CB-CG 4.13Å; Q209-E212 PolarHBondContact N-OE2 3.25Å; Q209-E212 WeakPolarHBondContact O-CB 2.93Å; Q209-E212 PolarHBondContact O-N 2.84Å; Q209-E212 VanDerWaalsContact O-N 3.07Å
210	M	89.2	Confident	92.5	Very high	69 Å²	69	26.7 Å²	26.7	34%	0.34	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-32	178	-71.3	-165.1	177.7	0	0	114.4	G181 E182 R183 E212	G181-M210 WeakPolarHBondContact O-CE 3.06Å; G181-M210 WeakPolarHBondContact O-CG 3.48Å; E182-M210 PolarHBondContact O-N 3.14Å; E182-M210 VanDerWaalsContact O-N 3.16Å; R183-M210 HydrophobicContact CG-CE 3.74Å; R183-M210 HydrophobicContact CG-CG 4.42Å; R183-M210 HydrophobicContact CG-SD 3.63Å; M210-E212 PolarHBondContact O-N 3.34Å
211	N	88.9	Confident	92.9	Very high	121 Å²	121	25.6 Å²	25.6	65%	0.647	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-6.5	178	60.9	-55.7	0	0	0	112.8	Q209	Q209-N211 VanDerWaalsContact C-N 3.27Å; Q209-N211 WeakPolarHBondContact CB-OD1 3.42Å; Q209-N211 PolarHBondContact O-N 2.88Å; Q209-N211 PolarHBondContact OE1-OD1 3.31Å
212	E	91.6	Very high	93.4	Very high	43 Å²	43	21.2 Å²	21.2	20%	0.201	11%	0.105	C	C	.	.	S	Bend	trans	-87.6	156.7	179.1	-66.6	-175.1	143	0	0	112.1	G208 Q209 M210 N216 R217	G208-E212 WeakPolarHBondContact CA-OE2 3.35Å; Q209-E212 HydrophobicContact CB-CG 4.13Å; Q209-E212 PolarHBondContact N-OE2 3.25Å; Q209-E212 WeakPolarHBondContact O-CB 2.93Å; Q209-E212 PolarHBondContact O-N 2.84Å; Q209-E212 VanDerWaalsContact O-N 3.07Å; M210-E212 PolarHBondContact O-N 3.34Å; E212-N216 HydrophobicContact CB-CB 3.95Å; E212-R217 PolarHBondContact O-NE 2.8Å
213	P	92.1	Very high	93.8	Very high	27 Å²	27	18.7 Å²	18.7	18%	0.175	9%	0.094	C	C	.	.			trans	-54.3	154.6	175.7	-22.7	31.1	0	0	0	112.8	G58 G215 N216 R217	G58-P213 VanDerWaalsContact C-CG 3.47Å; G58-P213 VanDerWaalsContact O-CG 3.25Å; G58-P213 WeakPolarHBondContact O-CG 3.4Å; P213-G215 PolarHBondContact O-N 3.49Å; P213-G215 VanDerWaalsContact O-N 3.15Å; P213-N216 PolarHBondContact O-N 2.76Å; P213-N216 VanDerWaalsContact O-N 3.11Å; P213-R217 PolarHBondContact O-N 2.83Å
214	P	93.2	Very high	94.1	Very high	14 Å²	14	18.7 Å²	18.7	9%	0.091	9%	0.094	C	C	.	.	H	α-helix	trans	-61.4	-25.7	179.4	26.5	-35.5	0	0	0	112.9	N216 R217 L218 E254 V255 L258	P214-N216 PolarHBondContact O-N 3.08Å; P214-R217 PolarHBondContact O-N 3Å; P214-L218 VanDerWaalsContact O-CB 3.28Å; P214-L218 WeakPolarHBondContact O-CB 3.21Å; P214-L218 PolarHBondContact O-N 3.21Å; P214-E254 HydrophobicContact CB-CB 3.76Å; P214-E254 HydrophobicContact CG-CB 4.24Å; P214-V255 HydrophobicContact CB-CG2 3.92Å; P214-V255 HydrophobicContact CG-CG2 4.26Å; P214-L258 HydrophobicContact CG-CD1 3.88Å
215	G	93.9	Very high	94.2	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.01	9%	0.094	C	C	.	.	H	α-helix	trans	-56.7	-47.3	172.8	0	0	0	0	0	112.7	M57 P213 R217 L218 R219	M57-G215 VanDerWaalsContact SD-C 3.58Å; P213-G215 PolarHBondContact O-N 3.49Å; P213-G215 VanDerWaalsContact O-N 3.15Å; G215-R217 PolarHBondContact O-N 3.28Å; G215-L218 PolarHBondContact O-N 3.28Å; G215-R219 WeakPolarHBondContact O-CG 3.43Å; G215-R219 PolarHBondContact O-N 2.82Å; G215-R219 VanDerWaalsContact O-N 3.09Å
216	N	94.8	Very high	94.4	Very high	6 Å²	6	18.7 Å²	18.7	3%	0.032	9%	0.094	C	C	.	.	H	α-helix	trans	-60.9	-48.9	178.9	-62.4	39.3	0	0	0	110.8	M57 G58 V91 E212 P213 P214 L218 R219 V220	M57-N216 WeakPolarHBondContact CA-OD1 3.28Å; M57-N216 PolarHBondContact O-ND2 2.99Å; M57-N216 PolarHBondContact O-OD1 2.79Å; G58-N216 PolarHBondContact N-OD1 2.91Å; V91-N216 HydrophobicContact CB-CB 4.37Å; V91-N216 HydrophobicContact CG1-CB 3.94Å; E212-N216 HydrophobicContact CB-CB 3.95Å; P213-N216 PolarHBondContact O-N 2.76Å; P213-N216 VanDerWaalsContact O-N 3.11Å; P214-N216 PolarHBondContact O-N 3.08Å; N216-L218 VanDerWaalsContact C-N 3.3Å; N216-L218 PolarHBondContact O-N 2.79Å; N216-R219 PolarHBondContact O-N 2.89Å; N216-R219 VanDerWaalsContact O-N 3.16Å; N216-V220 WeakPolarHBondContact O-CB 3.18Å; N216-V220 PolarHBondContact O-N 3.37Å
217	R	94.9	Very high	94.4	Very high	22 Å²	22	18.7 Å²	18.7	8%	0.083	9%	0.094	C	C	.	.	H	α-helix	trans	-62.9	-36.2	179.2	-67.7	-176.4	-77.8	123.6	-9.1	112.1	V180 E212 P213 P214 G215 R219 A251 E254	V180-R217 VanDerWaalsContact CG1-O 3.23Å; V180-R217 WeakPolarHBondContact CG1-O 3.45Å; E212-R217 PolarHBondContact O-NE 2.8Å; P213-R217 PolarHBondContact O-N 2.83Å; P214-R217 PolarHBondContact O-N 3Å; G215-R217 PolarHBondContact O-N 3.28Å; R217-R219 VanDerWaalsContact C-N 3.32Å; R217-R219 PolarHBondContact O-N 2.91Å; R217-A251 HydrophobicContact CB-CB 3.63Å; R217-E254 IonicContact CZ-OE1 2.72Å; R217-E254 IonicContact CZ-OE2 3.53Å; R217-E254 IonicContact NH1-OE1 3.91Å; R217-E254 PolarHBondContact NH1-OE1 3.44Å; R217-E254 IonicContact NH1-OE2 3.41Å; R217-E254 VanDerWaalsContact NH2-CD 3.3Å; R217-E254 IonicContact NH2-OE1 3.75Å; R217-E254 PolarHBondContact NH2-OE1 3.2Å; R217-E254 VanDerWaalsContact NH2-OE1 3.11Å; R217-E254 IonicContact NH2-OE2 3.84Å; R217-E254 PolarHBondContact NH2-OE2 2.93Å
218	L	94.9	Very high	94.4	Very high	4 Å²	4	18 Å²	18	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-73	-23.6	178	-174	59.7	0	0	0	112.8	P214 G215 N216 Y248 A251 V255	P214-L218 VanDerWaalsContact O-CB 3.28Å; P214-L218 WeakPolarHBondContact O-CB 3.21Å; P214-L218 PolarHBondContact O-N 3.21Å; G215-L218 PolarHBondContact O-N 3.28Å; N216-L218 VanDerWaalsContact C-N 3.3Å; N216-L218 PolarHBondContact O-N 2.79Å; L218-Y248 HydrophobicContact CD1-CD2 4.12Å; L218-Y248 HydrophobicContact CD1-CE1 4.45Å; L218-Y248 HydrophobicContact CD1-CE2 3.83Å; L218-Y248 WeakPolarHBondContact O-CE2 3.17Å; L218-A251 HydrophobicContact CB-CB 3.97Å; L218-V255 HydrophobicContact CB-CG2 4.43Å; L218-V255 HydrophobicContact CD2-CB 3.89Å; L218-V255 HydrophobicContact CD2-CG1 4.08Å; L218-V255 HydrophobicContact CD2-CG2 3.77Å
219	R	96.2	Very high	94.6	Very high	15 Å²	15	18 Å²	18	6%	0.057	9%	0.091	C	C	.	.	H	α-helix	trans	-102.9	-24.2	-177	-66.5	-60.4	178.4	-105.6	-4.3	114.6	E42 M57 V91 I110 G215 N216 R217 A221 L222 T223	E42-R219 VanDerWaalsContact CD-NE 3.33Å; E42-R219 IonicContact OE1-CZ 3.65Å; E42-R219 IonicContact OE1-NE 3.59Å; E42-R219 PolarHBondContact OE1-NE 3.15Å; E42-R219 IonicContact OE1-NH2 3.75Å; E42-R219 PolarHBondContact OE1-NH2 3.17Å; E42-R219 IonicContact OE2-NE 2.81Å; E42-R219 PolarHBondContact OE2-NE 3Å; M57-R219 HydrophobicContact CE-CG 3.68Å; M57-R219 HydrophobicContact SD-CG 4.17Å; V91-R219 HydrophobicContact CG2-CB 3.51Å; I110-R219 HydrophobicContact CD1-CB 4.02Å; I110-R219 HydrophobicContact CD1-CG 4.19Å; G215-R219 WeakPolarHBondContact O-CG 3.43Å; G215-R219 PolarHBondContact O-N 2.82Å; G215-R219 VanDerWaalsContact O-N 3.09Å; N216-R219 PolarHBondContact O-N 2.89Å; N216-R219 VanDerWaalsContact O-N 3.16Å; R217-R219 VanDerWaalsContact C-N 3.32Å; R217-R219 PolarHBondContact O-N 2.91Å; R219-A221 PolarHBondContact O-N 2.81Å; R219-A221 VanDerWaalsContact O-N 3.15Å; R219-L222 WeakPolarHBondContact O-CA 3.36Å; R219-L222 WeakPolarHBondContact O-CB 3.47Å; R219-L222 PolarHBondContact O-N 2.75Å; R219-T223 PolarHBondContact O-N 2.81Å; R219-T223 VanDerWaalsContact O-N 3.07Å; R219-T223 PolarHBondContact O-OG1 3.01Å
220	V	96.4	Very high	94.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-57.6	-34.7	-175.8	72.1	0	0	0	0	113.6	V91 V180 V206 G208 N216 L222 T223 G224	V91-V220 HydrophobicContact CB-CB 4.49Å; V91-V220 HydrophobicContact CG2-CB 4.37Å; V180-V220 HydrophobicContact CB-CG1 3.99Å; V180-V220 HydrophobicContact CG1-CG1 4.05Å; V180-V220 HydrophobicContact CG2-CG1 3.63Å; V206-V220 HydrophobicContact CB-CG2 4.21Å; V206-V220 HydrophobicContact CG1-CG2 3.47Å; V206-V220 VanDerWaalsContact CG1-CG2 3.47Å; G208-V220 VanDerWaalsContact N-CG2 3.32Å; N216-V220 WeakPolarHBondContact O-CB 3.18Å; N216-V220 PolarHBondContact O-N 3.37Å; V220-L222 VanDerWaalsContact C-N 3.31Å; V220-L222 PolarHBondContact O-N 2.79Å; V220-T223 WeakPolarHBondContact O-CB 3.33Å; V220-T223 PolarHBondContact O-N 3.42Å; V220-G224 PolarHBondContact O-N 3.42Å
221	A	96.3	Very high	94.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.4	-40	175	0	0	0	0	0	112.1	V180 R219 L225 Y248 L279	V180-A221 HydrophobicContact CG2-CB 3.87Å; R219-A221 PolarHBondContact O-N 2.81Å; R219-A221 VanDerWaalsContact O-N 3.15Å; A221-L225 VanDerWaalsContact O-CB 3.28Å; A221-L225 WeakPolarHBondContact O-CB 3.28Å; A221-L225 PolarHBondContact O-N 2.92Å; A221-Y248 HydrophobicContact CB-CD2 3.77Å; A221-Y248 HydrophobicContact CB-CE2 4.18Å; A221-L279 HydrophobicContact CB-CD1 4.11Å; A221-L279 HydrophobicContact CB-CD2 4.05Å
222	L	97	Very high	95.1	Very high	4 Å²	4	8 Å²	8	2%	0.021	4%	0.039	C	C	.	.	H	α-helix	trans	-70.1	-37	176.5	-59.6	171.8	0	0	0	111.1	I110 R219 V220 L225 T226 L279	I110-L222 HydrophobicContact CB-CB 4.21Å; R219-L222 WeakPolarHBondContact O-CA 3.36Å; R219-L222 WeakPolarHBondContact O-CB 3.47Å; R219-L222 PolarHBondContact O-N 2.75Å; V220-L222 VanDerWaalsContact C-N 3.31Å; V220-L222 PolarHBondContact O-N 2.79Å; L222-L225 PolarHBondContact O-N 3.31Å; L222-T226 WeakPolarHBondContact O-CB 3.36Å; L222-T226 PolarHBondContact O-N 3.29Å; L222-T226 PolarHBondContact O-OG1 3.15Å; L222-L279 HydrophobicContact CD2-CB 4.37Å; L222-L279 HydrophobicContact CD2-CD1 3.56Å; L222-L279 HydrophobicContact CG-CD1 4.35Å
223	T	97.1	Very high	95.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-59.4	-51.7	173.9	-59.7	0	0	0	0	111.1	V78 V91 V206 R219 V220 L225 T226 M227	V78-T223 HydrophobicContact CB-CG2 4.01Å; V78-T223 HydrophobicContact CG1-CG2 3.64Å; V78-T223 HydrophobicContact CG2-CG2 4.16Å; V91-T223 PolarHBondContact O-OG1 3.13Å; V206-T223 HydrophobicContact CG1-CG2 3.58Å; V206-T223 HydrophobicContact CG2-CG2 4.3Å; R219-T223 PolarHBondContact O-N 2.81Å; R219-T223 VanDerWaalsContact O-N 3.07Å; R219-T223 PolarHBondContact O-OG1 3.01Å; V220-T223 WeakPolarHBondContact O-CB 3.33Å; V220-T223 PolarHBondContact O-N 3.42Å; T223-L225 PolarHBondContact O-N 2.85Å; T223-T226 PolarHBondContact O-N 3.49Å; T223-M227 HydrophobicContact CG2-CE 3.8Å; T223-M227 PolarHBondContact O-N 3.49Å
224	G	96.1	Very high	95.1	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-62.3	-42.5	176.7	0	0	0	0	0	112.5	V176 V220 T226 M227 A228	V176-G224 WeakPolarHBondContact CG1-O 3.37Å; V220-G224 PolarHBondContact O-N 3.42Å; G224-T226 VanDerWaalsContact C-N 3.32Å; G224-T226 PolarHBondContact O-N 3.36Å; G224-M227 PolarHBondContact O-N 2.96Å; G224-A228 PolarHBondContact O-N 2.61Å
225	L	97.1	Very high	94.8	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.2	-41.9	175.3	177.8	54	0	0	0	112.3	A221 L222 T223 M227 A228 E229 L240 L279 R282 I283 I291	A221-L225 VanDerWaalsContact O-CB 3.28Å; A221-L225 WeakPolarHBondContact O-CB 3.28Å; A221-L225 PolarHBondContact O-N 2.92Å; L222-L225 PolarHBondContact O-N 3.31Å; T223-L225 PolarHBondContact O-N 2.85Å; L225-M227 VanDerWaalsContact C-N 3.29Å; L225-M227 PolarHBondContact O-N 3.33Å; L225-A228 CarbonylContact O-C 3.6Å; L225-A228 WeakPolarHBondContact O-CA 3.46Å; L225-A228 WeakPolarHBondContact O-CB 3.43Å; L225-A228 PolarHBondContact O-N 2.69Å; L225-E229 HydrophobicContact CD1-CG 4.07Å; L225-E229 HydrophobicContact CG-CG 4.29Å; L225-E229 VanDerWaalsContact O-CG 3.31Å; L225-E229 WeakPolarHBondContact O-CG 3.19Å; L225-E229 PolarHBondContact O-N 3.44Å; L225-L240 HydrophobicContact CB-CD2 4.2Å; L225-L240 HydrophobicContact CD1-CD2 3.71Å; L225-L240 HydrophobicContact CG-CD2 4.49Å; L225-L279 HydrophobicContact CD2-CD1 3.66Å; L225-L279 WeakPolarHBondContact CD2-O 3.49Å; L225-R282 HydrophobicContact CD2-CB 3.57Å; L225-R282 HydrophobicContact CD2-CG 4.5Å; L225-R282 HydrophobicContact CG-CB 4.37Å; L225-I283 HydrophobicContact CD1-CG1 3.72Å; L225-I283 HydrophobicContact CD2-CG1 4.03Å; L225-I291 HydrophobicContact CD1-CD1 4.04Å
226	T	97.4	Very high	94.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.4	-36.8	-179.8	-56.7	0	0	0	0	111.9	V78 V80 W108 A109 I110 L222 T223 G224 E229 K230 R282	V78-T226 HydrophobicContact CG2-CG2 4.03Å; V80-T226 HydrophobicContact CG1-CG2 4.2Å; W108-T226 HydrophobicContact CB-CG2 3.65Å; W108-T226 HydrophobicContact CE3-CG2 4.32Å; A109-T226 WeakPolarHBondContact O-CG2 3.35Å; I110-T226 WeakPolarHBondContact CA-OG1 3.35Å; I110-T226 PolarHBondContact O-OG1 2.93Å; L222-T226 WeakPolarHBondContact O-CB 3.36Å; L222-T226 PolarHBondContact O-N 3.29Å; L222-T226 PolarHBondContact O-OG1 3.15Å; T223-T226 PolarHBondContact O-N 3.49Å; G224-T226 VanDerWaalsContact C-N 3.32Å; G224-T226 PolarHBondContact O-N 3.36Å; T226-E229 PolarHBondContact O-N 3.02Å; T226-K230 PolarHBondContact O-N 2.92Å; T226-R282 PolarHBondContact OG1-NH2 2.84Å
227	M	95.8	Very high	94.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66	-41.4	172.1	-64.8	173.6	-174.5	0	0	111.7	V78 P79 V80 M89 V176 V206 T223 G224 L225 K230 F231	V78-M227 HydrophobicContact CB-CE 4.35Å; P79-M227 HydrophobicContact CG-CE 4.45Å; V80-M227 HydrophobicContact CG1-CG 4.44Å; M89-M227 HydrophobicContact CB-CE 4.47Å; M89-M227 HydrophobicContact CE-CE 3.53Å; M89-M227 HydrophobicContact CE-SD 3.49Å; M89-M227 WeakPolarHBondContact CE-SD 2.88Å; M89-M227 HydrophobicContact SD-CE 3.34Å; M89-M227 WeakPolarHBondContact SD-CE 3.5Å; M89-M227 HydrophobicContact SD-SD 4.11Å; V176-M227 HydrophobicContact CG1-CB 4.26Å; V176-M227 HydrophobicContact CG2-CB 4.33Å; V206-M227 HydrophobicContact CG2-CE 3.81Å; V206-M227 HydrophobicContact CG2-SD 3.43Å; V206-M227 WeakPolarHBondContact CG2-SD 2.99Å; T223-M227 HydrophobicContact CG2-CE 3.8Å; T223-M227 PolarHBondContact O-N 3.49Å; G224-M227 PolarHBondContact O-N 2.96Å; L225-M227 VanDerWaalsContact C-N 3.29Å; L225-M227 PolarHBondContact O-N 3.33Å; M227-K230 PolarHBondContact O-N 2.66Å; M227-F231 VanDerWaalsContact O-CD2 3.27Å; M227-F231 WeakPolarHBondContact O-CD2 3.46Å; M227-F231 PolarHBondContact O-N 2.82Å
228	A	95.5	Very high	94.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-65.4	-38.7	176.7	0	0	0	0	0	112.2	V176 G224 L225 K230 F231 R232 V238 L240 I291	V176-A228 HydrophobicContact CB-CB 4.23Å; V176-A228 HydrophobicContact CG2-CB 3.94Å; G224-A228 PolarHBondContact O-N 2.61Å; L225-A228 CarbonylContact O-C 3.6Å; L225-A228 WeakPolarHBondContact O-CA 3.46Å; L225-A228 WeakPolarHBondContact O-CB 3.43Å; L225-A228 PolarHBondContact O-N 2.69Å; A228-K230 PolarHBondContact O-N 3.42Å; A228-F231 PolarHBondContact O-N 3.09Å; A228-R232 PolarHBondContact O-N 2.84Å; A228-V238 HydrophobicContact CB-CG1 4.02Å; A228-L240 HydrophobicContact CB-CB 4.49Å; A228-L240 HydrophobicContact CB-CD1 4.33Å; A228-I291 HydrophobicContact CB-CD1 4.21Å; A228-I291 HydrophobicContact CB-CG1 4.47Å; A228-I291 HydrophobicContact CB-CG2 4.41Å
229	E	95.7	Very high	93.9	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-60.2	-42	175.7	-73.7	175.2	151.2	0	0	112	W108 R112 L225 T226 F231 R232 D233 R282 I291	W108-E229 HydrophobicContact CZ3-CB 4.3Å; R112-E229 WeakPolarHBondContact CD-OE2 3.23Å; R112-E229 IonicContact NE-OE2 3.29Å; L225-E229 HydrophobicContact CD1-CG 4.07Å; L225-E229 HydrophobicContact CG-CG 4.29Å; L225-E229 VanDerWaalsContact O-CG 3.31Å; L225-E229 WeakPolarHBondContact O-CG 3.19Å; L225-E229 PolarHBondContact O-N 3.44Å; T226-E229 PolarHBondContact O-N 3.02Å; E229-F231 VanDerWaalsContact C-N 3.31Å; E229-F231 PolarHBondContact O-N 2.91Å; E229-R232 WeakPolarHBondContact O-CB 3.45Å; E229-R232 PolarHBondContact O-N 2.6Å; E229-D233 WeakPolarHBondContact O-CB 3.43Å; E229-D233 PolarHBondContact O-N 3.46Å; E229-R282 VanDerWaalsContact CD-NH2 3.35Å; E229-R282 WeakPolarHBondContact OE1-CB 3.3Å; E229-R282 IonicContact OE1-CZ 3.32Å; E229-R282 IonicContact OE1-NE 2.63Å; E229-R282 PolarHBondContact OE1-NE 3.29Å; E229-R282 IonicContact OE1-NH2 2.69Å; E229-R282 PolarHBondContact OE1-NH2 2.82Å; E229-R282 IonicContact OE2-CZ 2.65Å; E229-R282 IonicContact OE2-NE 3.38Å; E229-R282 IonicContact OE2-NH2 3Å; E229-R282 PolarHBondContact OE2-NH2 2.84Å; E229-I291 HydrophobicContact CG-CD1 3.88Å
230	K	95.1	Very high	93.8	Very high	22 Å²	22	17.8 Å²	17.8	10%	0.096	9%	0.094	C	C	.	.	H	α-helix	trans	-57.7	-46.4	175.3	178.5	67.4	175.7	-176.8	0	111.4	V80 E106 W108 T226 M227 A228 D233 E234	V80-K230 HydrophobicContact CB-CB 3.71Å; V80-K230 HydrophobicContact CB-CD 4.44Å; V80-K230 HydrophobicContact CB-CG 3.8Å; V80-K230 HydrophobicContact CG1-CB 4.26Å; V80-K230 HydrophobicContact CG2-CB 4.1Å; V80-K230 HydrophobicContact CG2-CD 3.92Å; V80-K230 HydrophobicContact CG2-CG 3.82Å; E106-K230 IonicContact OE1-NZ 3.08Å; E106-K230 PolarHBondContact OE1-NZ 2.68Å; E106-K230 IonicContact OE2-NZ 3.44Å; E106-K230 PolarHBondContact OE2-NZ 2.92Å; W108-K230 HydrophobicContact CD2-CD 4.39Å; W108-K230 HydrophobicContact CE3-CB 4.16Å; W108-K230 HydrophobicContact CH2-CB 4.15Å; W108-K230 HydrophobicContact CH2-CD 3.61Å; W108-K230 HydrophobicContact CH2-CG 4.49Å; W108-K230 HydrophobicContact CZ2-CD 3.32Å; W108-K230 HydrophobicContact CZ3-CB 3.92Å; W108-K230 HydrophobicContact CZ3-CD 4.21Å; T226-K230 PolarHBondContact O-N 2.92Å; M227-K230 PolarHBondContact O-N 2.66Å; A228-K230 PolarHBondContact O-N 3.42Å; K230-D233 PolarHBondContact O-N 3.04Å; K230-E234 WeakPolarHBondContact CE-OE1 3.29Å; K230-E234 WeakPolarHBondContact O-CG 3.48Å; K230-E234 PolarHBondContact O-N 3.37Å
231	F	93.8	Very high	93.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.4	-38.5	179	-65.2	-48.3	0	0	0	112.5	G81 K82 L85 Y174 V176 M227 A228 E229 E234 R236 V238	G81-F231 VanDerWaalsContact C-CE1 3.49Å; G81-F231 WeakPolarHBondContact O-CZ 3.49Å; K82-F231 HydrophobicContact CG-CE1 4.39Å; L85-F231 HydrophobicContact CD1-CZ 4.33Å; L85-F231 HydrophobicContact CD2-CE2 4.04Å; L85-F231 HydrophobicContact CD2-CZ 3.76Å; L85-F231 HydrophobicContact CG-CZ 3.88Å; Y174-F231 AromaticContact CD2-CD1 3.69Å; Y174-F231 HydrophobicContact CD2-CD1 3.69Å; Y174-F231 HydrophobicContact CD2-CD2 4.42Å; Y174-F231 AromaticContact CD2-CE1 3.86Å; Y174-F231 HydrophobicContact CD2-CE1 3.86Å; Y174-F231 AromaticContact CD2-CG 3.99Å; Y174-F231 HydrophobicContact CD2-CG 3.99Å; Y174-F231 HydrophobicContact CD2-CZ 4.32Å; Y174-F231 HydrophobicContact CE2-CD1 4.09Å; Y174-F231 HydrophobicContact CE2-CE1 4.05Å; V176-F231 HydrophobicContact CG2-CD2 4.08Å; V176-F231 HydrophobicContact CG2-CE2 4.08Å; M227-F231 VanDerWaalsContact O-CD2 3.27Å; M227-F231 WeakPolarHBondContact O-CD2 3.46Å; M227-F231 PolarHBondContact O-N 2.82Å; A228-F231 PolarHBondContact O-N 3.09Å; E229-F231 VanDerWaalsContact C-N 3.31Å; E229-F231 PolarHBondContact O-N 2.91Å; F231-E234 PolarHBondContact O-N 3.45Å; F231-R236 VanDerWaalsContact O-CB 3.26Å; F231-R236 WeakPolarHBondContact O-CB 3.35Å; F231-R236 PolarHBondContact O-N 2.88Å; F231-R236 VanDerWaalsContact O-N 3.09Å; F231-V238 HydrophobicContact CB-CG1 4.43Å; F231-V238 HydrophobicContact CB-CG2 3.36Å; F231-V238 HydrophobicContact CD2-CG1 4.44Å; F231-V238 HydrophobicContact CG-CG2 4.48Å
232	R	92.4	Very high	93.6	Very high	8 Å²	8	17.9 Å²	17.9	3%	0.03	10%	0.095	C	C	.	.	H	α-helix	trans	-60.4	-47.3	173.1	-179.5	-160.2	58.9	-149.9	-5.7	111.6	A228 E229 E234 G235 R282 T284 T288 G289 I291	A228-R232 PolarHBondContact O-N 2.84Å; E229-R232 WeakPolarHBondContact O-CB 3.45Å; E229-R232 PolarHBondContact O-N 2.6Å; R232-E234 PolarHBondContact O-N 3.38Å; R232-G235 WeakPolarHBondContact O-CA 3.27Å; R232-G235 PolarHBondContact O-N 3.12Å; R232-R282 PolarHBondContact NH1-O 3.3Å; R232-T284 WeakPolarHBondContact CD-O 3.15Å; R232-T288 PolarHBondContact O-OG1 3.15Å; R232-G289 WeakPolarHBondContact CG-O 3.34Å; R232-I291 HydrophobicContact CB-CD1 4.08Å; R232-I291 HydrophobicContact CB-CG1 3.75Å; R232-I291 HydrophobicContact CG-CD1 4.48Å; R232-I291 HydrophobicContact CG-CG1 4.06Å
233	D	92.6	Very high	93.3	Very high	63 Å²	63	18 Å²	18	34%	0.337	10%	0.096	S	C	.	.	H	α-helix	trans	-70.9	-24.3	-176.4	-63.7	-4.5	0	0	0	111.2	W108 E229 K230 G235	W108-D233 HydrophobicContact CH2-CB 4.28Å; E229-D233 WeakPolarHBondContact O-CB 3.43Å; E229-D233 PolarHBondContact O-N 3.46Å; K230-D233 PolarHBondContact O-N 3.04Å; D233-G235 PolarHBondContact O-N 2.85Å
234	E	90.8	Very high	92.9	Very high	87 Å²	87	18.4 Å²	18.4	41%	0.407	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-1	166.7	-75.4	179.2	-177.5	0	0	114.1	K230 F231 R232	K230-E234 WeakPolarHBondContact CE-OE1 3.29Å; K230-E234 WeakPolarHBondContact O-CG 3.48Å; K230-E234 PolarHBondContact O-N 3.37Å; F231-E234 PolarHBondContact O-N 3.45Å; R232-E234 PolarHBondContact O-N 3.38Å
235	G	88	Confident	92.7	Very high	40 Å²	40	18.4 Å²	18.4	41%	0.412	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	27.7	176.7	0	0	0	0	0	114.7	R232 D233 T288	R232-G235 WeakPolarHBondContact O-CA 3.27Å; R232-G235 PolarHBondContact O-N 3.12Å; D233-G235 PolarHBondContact O-N 2.85Å; G235-T288 CarbonylContact C-O 3.55Å; G235-T288 WeakPolarHBondContact CA-O 3.47Å
236	R	87.6	Confident	92.4	Very high	73 Å²	73	19.5 Å²	19.5	28%	0.275	10%	0.102	S	C	.	.			trans	-106	157.9	178.4	-57.3	177.7	173.5	-103.2	-9.7	111.9	K82 Y174 F231 V238 G289 S290	K82-R236 VanDerWaalsContact CE-NH2 3.31Å; Y174-R236 PolarHBondContact OH-NH1 3.45Å; Y174-R236 VanDerWaalsContact OH-NH1 3.11Å; F231-R236 VanDerWaalsContact O-CB 3.26Å; F231-R236 WeakPolarHBondContact O-CB 3.35Å; F231-R236 PolarHBondContact O-N 2.88Å; F231-R236 VanDerWaalsContact O-N 3.09Å; R236-V238 HydrophobicContact CB-CG2 4.25Å; R236-G289 WeakPolarHBondContact O-CA 3.4Å; R236-S290 PolarHBondContact O-N 3.43Å; R236-S290 VanDerWaalsContact O-N 3.16Å
237	D	88.2	Confident	92.1	Very high	67 Å²	67	23.5 Å²	23.5	36%	0.358	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.5	167.4	-59	-48.6	0	0	0	109	K142 S290	K142-D237 WeakPolarHBondContact CE-OD1 3.49Å; K142-D237 WeakPolarHBondContact CE-OD2 3.5Å; K142-D237 VanDerWaalsContact NZ-CG 3.3Å; K142-D237 IonicContact NZ-OD1 3.37Å; K142-D237 PolarHBondContact NZ-OD1 2.72Å; K142-D237 IonicContact NZ-OD2 3.73Å; K142-D237 PolarHBondContact NZ-OD2 3.34Å; D237-S290 WeakPolarHBondContact CB-OG 3.27Å; D237-S290 WeakPolarHBondContact OD1-CB 3.38Å; D237-S290 PolarHBondContact OD1-N 2.88Å; D237-S290 PolarHBondContact OD1-OG 3.2Å
238	V	91.2	Very high	92.1	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139	-168.1	-169.5	0	0	0	0	108.7	Y174 V176 A228 F231 R236 S290 I291 T292	Y174-V238 WeakPolarHBondContact O-CA 3.43Å; V176-V238 HydrophobicContact CG2-CG1 4.24Å; A228-V238 HydrophobicContact CB-CG1 4.02Å; F231-V238 HydrophobicContact CB-CG1 4.43Å; F231-V238 HydrophobicContact CB-CG2 3.36Å; F231-V238 HydrophobicContact CD2-CG1 4.44Å; F231-V238 HydrophobicContact CG-CG2 4.48Å; R236-V238 HydrophobicContact CB-CG2 4.25Å; V238-S290 PolarHBondContact N-O 2.93Å; V238-I291 CarbonylContact O-C 3.54Å; V238-I291 WeakPolarHBondContact O-CA 3.48Å; V238-T292 PolarHBondContact O-N 3.24Å
239	L	91.5	Very high	92	Very high	6 Å²	6	23.8 Å²	23.8	3%	0.031	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128	167.8	-65.9	168.7	0	0	0	110.5	L127 I167 Y174 S175 V176 F241 T292	L127-L239 HydrophobicContact CD2-CD2 3.96Å; I167-L239 HydrophobicContact CB-CD1 3.6Å; I167-L239 HydrophobicContact CD1-CD1 3.51Å; I167-L239 HydrophobicContact CD1-CD2 4.01Å; I167-L239 HydrophobicContact CD1-CG 4.35Å; I167-L239 HydrophobicContact CG1-CD1 4.13Å; I167-L239 HydrophobicContact CG2-CD1 3.55Å; I167-L239 HydrophobicContact CG2-CG 4.21Å; Y174-L239 PolarHBondContact O-N 3.35Å; S175-L239 CarbonylContact C-O 3.59Å; S175-L239 VanDerWaalsContact CA-O 3.29Å; S175-L239 WeakPolarHBondContact CA-O 3.46Å; V176-L239 PolarHBondContact N-O 3.01Å; L239-F241 HydrophobicContact CB-CD2 4.16Å; L239-F241 HydrophobicContact CB-CE2 3.39Å; L239-F241 HydrophobicContact CB-CZ 4.05Å; L239-F241 HydrophobicContact CD1-CE2 3.88Å; L239-F241 HydrophobicContact CD1-CZ 3.94Å; L239-F241 HydrophobicContact CG-CE2 4.25Å; L239-T292 CarbonylContact C-O 3.35Å; L239-T292 VanDerWaalsContact CA-O 3.29Å; L239-T292 WeakPolarHBondContact CA-O 3.46Å; L239-T292 HydrophobicContact CD2-CG2 4.03Å
240	L	94.8	Very high	91.8	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	117.2	171.8	177.5	65.2	0	0	0	109.8	V176 L225 A228 V242 I283 I291 T292 S293 V294	V176-L240 HydrophobicContact CB-CD1 4.15Å; V176-L240 HydrophobicContact CG1-CD1 4.26Å; V176-L240 CarbonylContact O-C 3.53Å; V176-L240 WeakPolarHBondContact O-CA 3.37Å; L225-L240 HydrophobicContact CB-CD2 4.2Å; L225-L240 HydrophobicContact CD1-CD2 3.71Å; L225-L240 HydrophobicContact CG-CD2 4.49Å; A228-L240 HydrophobicContact CB-CB 4.49Å; A228-L240 HydrophobicContact CB-CD1 4.33Å; L240-V242 HydrophobicContact CD1-CG2 4.49Å; L240-V242 HydrophobicContact CD2-CG2 4.28Å; L240-V242 HydrophobicContact CG-CG2 4.04Å; L240-I283 HydrophobicContact CD2-CD1 3.91Å; L240-I283 HydrophobicContact CD2-CG1 3.94Å; L240-I291 HydrophobicContact CB-CG2 3.68Å; L240-I291 HydrophobicContact CD2-CG2 4.28Å; L240-T292 PolarHBondContact N-O 3.39Å; L240-S293 CarbonylContact O-C 3.6Å; L240-S293 WeakPolarHBondContact O-CA 3.31Å; L240-V294 PolarHBondContact O-N 3.18Å
241	F	93.2	Very high	91.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	127.1	174.3	-66.1	-90.9	0	0	0	109.6	M160 L163 I164 V176 F177 A178 L239 V294	M160-F241 HydrophobicContact CB-CD1 3.92Å; M160-F241 HydrophobicContact CB-CE1 4.14Å; M160-F241 HydrophobicContact CG-CD1 3.89Å; M160-F241 HydrophobicContact CG-CE1 4.27Å; M160-F241 HydrophobicContact SD-CD1 4.16Å; L163-F241 HydrophobicContact CB-CE1 4.25Å; L163-F241 HydrophobicContact CB-CZ 4.26Å; I164-F241 HydrophobicContact CB-CE2 4.34Å; I164-F241 HydrophobicContact CB-CZ 4.36Å; I164-F241 HydrophobicContact CD1-CD1 4.33Å; I164-F241 HydrophobicContact CD1-CD2 3.8Å; I164-F241 HydrophobicContact CD1-CE1 4.34Å; I164-F241 HydrophobicContact CD1-CE2 3.83Å; I164-F241 HydrophobicContact CD1-CG 4.08Å; I164-F241 HydrophobicContact CD1-CZ 4.11Å; I164-F241 HydrophobicContact CG1-CD1 4.31Å; I164-F241 HydrophobicContact CG1-CD2 3.63Å; I164-F241 HydrophobicContact CG1-CE1 3.86Å; I164-F241 HydrophobicContact CG1-CE2 3.1Å; I164-F241 HydrophobicContact CG1-CG 4.21Å; I164-F241 HydrophobicContact CG1-CZ 3.25Å; V176-F241 PolarHBondContact O-N 3.1Å; F177-F241 HydrophobicContact CB-CB 4.49Å; F177-F241 HydrophobicContact CD2-CB 3.59Å; F177-F241 HydrophobicContact CD2-CG 4.43Å; F177-F241 HydrophobicContact CE2-CB 4.23Å; F177-F241 HydrophobicContact CG-CB 4.4Å; A178-F241 PolarHBondContact N-O 3.42Å; L239-F241 HydrophobicContact CB-CD2 4.16Å; L239-F241 HydrophobicContact CB-CE2 3.39Å; L239-F241 HydrophobicContact CB-CZ 4.05Å; L239-F241 HydrophobicContact CD1-CE2 3.88Å; L239-F241 HydrophobicContact CD1-CZ 3.94Å; L239-F241 HydrophobicContact CG-CE2 4.25Å; F241-V294 WeakPolarHBondContact CA-O 3.29Å; F241-V294 HydrophobicContact CD1-CB 3.7Å; F241-V294 HydrophobicContact CD1-CG1 4.15Å; F241-V294 HydrophobicContact CD1-CG2 4.4Å; F241-V294 HydrophobicContact CE1-CB 3.64Å; F241-V294 HydrophobicContact CE1-CG1 4.06Å; F241-V294 HydrophobicContact CE1-CG2 3.86Å; F241-V294 HydrophobicContact CZ-CG2 4.35Å
242	V	94	Very high	91.8	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.012	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	100	175.6	-173.6	0	0	0	0	108.5	V180 L240 I245 V294 Q295 A296	V180-V242 HydrophobicContact CG2-CG1 3.83Å; L240-V242 HydrophobicContact CD1-CG2 4.49Å; L240-V242 HydrophobicContact CD2-CG2 4.28Å; L240-V242 HydrophobicContact CG-CG2 4.04Å; V242-I245 HydrophobicContact CG1-CB 4.36Å; V242-I245 HydrophobicContact CG1-CD1 4.1Å; V242-V294 PolarHBondContact N-O 3.38Å; V242-Q295 HydrophobicContact CB-CB 4.43Å; V242-Q295 HydrophobicContact CB-CG 4.22Å; V242-Q295 HydrophobicContact CG2-CG 4.35Å; V242-Q295 CarbonylContact O-C 3.59Å; V242-Q295 WeakPolarHBondContact O-CA 3.46Å; V242-A296 PolarHBondContact O-N 3.39Å
243	D	90.7	Very high	91.9	Very high	8 Å²	8	25.8 Å²	25.8	4%	0.043	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	106.5	169.4	-158.9	2.9	0	0	0	108.2	M160 F177 A178 G179 V180 E182 A296	M160-D243 HydrophobicContact CE-CB 3.84Å; M160-D243 WeakPolarHBondContact CE-OD2 3.5Å; M160-D243 HydrophobicContact SD-CB 4.32Å; F177-D243 HydrophobicContact CE2-CB 4.38Å; F177-D243 HydrophobicContact CZ-CB 4.09Å; A178-D243 PolarHBondContact O-N 3.15Å; A178-D243 VanDerWaalsContact O-N 3.17Å; G179-D243 CarbonylContact C-O 3.57Å; G179-D243 VanDerWaalsContact CA-O 3.27Å; G179-D243 WeakPolarHBondContact CA-O 3.37Å; V180-D243 PolarHBondContact N-O 3.37Å; E182-D243 VanDerWaalsContact CG-O 3.26Å; E182-D243 WeakPolarHBondContact CG-O 3.32Å; D243-A296 HydrophobicContact CB-CB 4.21Å; D243-A296 WeakPolarHBondContact OD1-CB 3.43Å
244	N	88.5	Confident	91.9	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.043	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	cis	-124.9	134.8	4.5	-158	-79.1	0	0	0	112.2	V180 Y246 R247 Y248 A296 Y298	V180-N244 PolarHBondContact O-N 2.95Å; N244-Y246 PolarHBondContact O-N 2.93Å; N244-Y246 WeakPolarHBondContact OD1-CB 3.32Å; N244-Y246 PolarHBondContact OD1-N 2.97Å; N244-R247 HydrophobicContact CB-CB 4.23Å; N244-R247 HydrophobicContact CB-CG 3.8Å; N244-R247 WeakPolarHBondContact O-CA 3.22Å; N244-R247 VanDerWaalsContact O-CB 3.31Å; N244-R247 WeakPolarHBondContact O-CB 3.17Å; N244-R247 PolarHBondContact O-N 2.86Å; N244-Y248 PolarHBondContact O-N 2.82Å; N244-A296 VanDerWaalsContact ND2-CB 3.27Å; N244-A296 WeakPolarHBondContact ND2-CB 3.49Å; N244-A296 PolarHBondContact ND2-O 3.2Å; N244-A296 VanDerWaalsContact ND2-O 3.17Å; N244-A296 PolarHBondContact OD1-O 3.28Å; N244-Y298 PolarHBondContact OD1-N 3.3Å
245	I	92.5	Very high	92	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.8	-27.4	178.3	-163.1	66.5	0	0	0	112.1	V242 R247 Y248 T249 M276 L279 Q295 A296 V297 T312	V242-I245 HydrophobicContact CG1-CB 4.36Å; V242-I245 HydrophobicContact CG1-CD1 4.1Å; I245-R247 VanDerWaalsContact C-N 3.27Å; I245-R247 PolarHBondContact O-N 3.15Å; I245-Y248 HydrophobicContact CD1-CD1 4.34Å; I245-Y248 HydrophobicContact CD1-CG 4.39Å; I245-Y248 VanDerWaalsContact O-CB 3.31Å; I245-Y248 WeakPolarHBondContact O-CB 3.39Å; I245-Y248 PolarHBondContact O-N 2.94Å; I245-T249 PolarHBondContact O-N 3.41Å; I245-M276 HydrophobicContact CD1-CE 4.46Å; I245-M276 HydrophobicContact CD1-SD 4.2Å; I245-M276 HydrophobicContact CG1-CE 4.01Å; I245-M276 HydrophobicContact CG1-SD 4.06Å; I245-L279 HydrophobicContact CD1-CD2 3.52Å; I245-Q295 HydrophobicContact CB-CB 4.41Å; I245-Q295 HydrophobicContact CG2-CB 4.43Å; I245-A296 WeakPolarHBondContact CG2-O 3.27Å; I245-A296 PolarHBondContact N-O 2.78Å; I245-V297 HydrophobicContact CG2-CB 4.29Å; I245-V297 HydrophobicContact CG2-CG1 4.35Å; I245-V297 HydrophobicContact CG2-CG2 3.72Å; I245-T312 HydrophobicContact CG2-CG2 3.98Å
246	Y	91.5	Very high	92.2	Very high	23 Å²	23	20.8 Å²	20.8	9%	0.09	10%	0.097	C	C	.	.	H	α-helix	trans	-64.5	-34.2	172	179.3	-101	0	0	0	111.9	N244 Y248 T249 L250 Y298 P300 S308	N244-Y246 PolarHBondContact O-N 2.93Å; N244-Y246 WeakPolarHBondContact OD1-CB 3.32Å; N244-Y246 PolarHBondContact OD1-N 2.97Å; Y246-Y248 VanDerWaalsContact C-N 3.33Å; Y246-T249 WeakPolarHBondContact O-CB 3.41Å; Y246-T249 PolarHBondContact O-N 3.47Å; Y246-L250 HydrophobicContact CD1-CD1 3.88Å; Y246-L250 HydrophobicContact CD1-CG 4.09Å; Y246-L250 HydrophobicContact CE1-CD1 3.32Å; Y246-L250 HydrophobicContact CE1-CD2 4.11Å; Y246-L250 HydrophobicContact CE1-CG 3.61Å; Y246-L250 PolarHBondContact O-N 2.88Å; Y246-Y298 AromaticContact CD1-CD1 3.61Å; Y246-Y298 HydrophobicContact CD1-CD1 3.61Å; Y246-Y298 HydrophobicContact CD1-CG 4.15Å; Y246-Y298 VanDerWaalsContact CD2-O 3.32Å; Y246-Y298 WeakPolarHBondContact CD2-O 3.23Å; Y246-Y298 AromaticContact CE1-CD1 3.54Å; Y246-Y298 HydrophobicContact CE1-CD1 3.54Å; Y246-Y298 HydrophobicContact CE1-CE1 4.17Å; Y246-Y298 HydrophobicContact CE1-CG 4.49Å; Y246-Y298 HydrophobicContact CG-CD1 4.16Å; Y246-P300 HydrophobicContact CD2-CG 4.31Å; Y246-P300 HydrophobicContact CE1-CG 4.42Å; Y246-P300 HydrophobicContact CE2-CG 3.37Å; Y246-P300 VanDerWaalsContact CZ-CG 3.44Å; Y246-P300 VanDerWaalsContact OH-CG 3.22Å; Y246-P300 WeakPolarHBondContact OH-CG 3.44Å; Y246-S308 VanDerWaalsContact CD2-OG 3.24Å; Y246-S308 WeakPolarHBondContact CD2-OG 3.28Å
247	R	91.8	Very high	92.5	Very high	84 Å²	84	20.6 Å²	20.6	32%	0.317	11%	0.111	S	C	.	.	H	α-helix	trans	-70.6	-30.9	176.9	-67.4	-72.5	-176.5	-169.9	-0.1	112	V180 N244 I245 L250 A251	V180-R247 HydrophobicContact CB-CB 4.44Å; V180-R247 HydrophobicContact CG1-CB 3.96Å; V180-R247 WeakPolarHBondContact O-CB 3.38Å; V180-R247 WeakPolarHBondContact O-CG 3.04Å; N244-R247 HydrophobicContact CB-CB 4.23Å; N244-R247 HydrophobicContact CB-CG 3.8Å; N244-R247 WeakPolarHBondContact O-CA 3.22Å; N244-R247 VanDerWaalsContact O-CB 3.31Å; N244-R247 WeakPolarHBondContact O-CB 3.17Å; N244-R247 PolarHBondContact O-N 2.86Å; I245-R247 VanDerWaalsContact C-N 3.27Å; I245-R247 PolarHBondContact O-N 3.15Å; R247-L250 PolarHBondContact O-N 3.35Å; R247-A251 WeakPolarHBondContact O-CB 3.22Å; R247-A251 PolarHBondContact O-N 3.28Å
248	Y	94.8	Very high	92.6	Very high	6 Å²	6	20.5 Å²	20.5	2%	0.024	11%	0.11	C	C	.	.	H	α-helix	trans	-59.6	-49.2	169	172.8	-92.6	0	0	0	110.4	L218 A221 N244 I245 Y246 L250 A251 G252 E275 M276 L279	L218-Y248 HydrophobicContact CD1-CD2 4.12Å; L218-Y248 HydrophobicContact CD1-CE1 4.45Å; L218-Y248 HydrophobicContact CD1-CE2 3.83Å; L218-Y248 WeakPolarHBondContact O-CE2 3.17Å; A221-Y248 HydrophobicContact CB-CD2 3.77Å; A221-Y248 HydrophobicContact CB-CE2 4.18Å; N244-Y248 PolarHBondContact O-N 2.82Å; I245-Y248 HydrophobicContact CD1-CD1 4.34Å; I245-Y248 HydrophobicContact CD1-CG 4.39Å; I245-Y248 VanDerWaalsContact O-CB 3.31Å; I245-Y248 WeakPolarHBondContact O-CB 3.39Å; I245-Y248 PolarHBondContact O-N 2.94Å; Y246-Y248 VanDerWaalsContact C-N 3.33Å; Y248-L250 PolarHBondContact O-N 3.27Å; Y248-A251 PolarHBondContact O-N 2.88Å; Y248-G252 PolarHBondContact O-N 3.34Å; Y248-E275 PolarHBondContact OH-O 3.12Å; Y248-M276 HydrophobicContact CD1-CE 4.21Å; Y248-L279 HydrophobicContact CD1-CD2 4.16Å; Y248-L279 HydrophobicContact CD2-CD2 4.24Å; Y248-L279 HydrophobicContact CE1-CD2 3.99Å; Y248-L279 HydrophobicContact CE2-CD2 4.03Å; Y248-L279 HydrophobicContact CG-CD2 4.29Å
249	T	93.1	Very high	92.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.8	-45.9	176.5	-60.1	0	0	0	0	112.7	I245 Y246 A251 G252 T253 Y268 L272 M276 S308	I245-T249 PolarHBondContact O-N 3.41Å; Y246-T249 WeakPolarHBondContact O-CB 3.41Å; Y246-T249 PolarHBondContact O-N 3.47Å; T249-A251 PolarHBondContact O-N 3.25Å; T249-G252 WeakPolarHBondContact O-CA 3.49Å; T249-G252 PolarHBondContact O-N 3.29Å; T249-G252 VanDerWaalsContact O-N 3.11Å; T249-T253 PolarHBondContact O-N 2.96Å; T249-T253 PolarHBondContact O-OG1 3.38Å; T249-Y268 HydrophobicContact CG2-CD1 3.72Å; T249-Y268 HydrophobicContact CG2-CE1 3.67Å; T249-L272 HydrophobicContact CG2-CD1 3.43Å; T249-L272 VanDerWaalsContact CG2-CD1 3.43Å; T249-L272 HydrophobicContact CG2-CD2 4.34Å; T249-M276 VanDerWaalsContact OG1-CE 3.3Å; T249-M276 WeakPolarHBondContact OG1-CE 3.29Å; T249-S308 WeakPolarHBondContact CB-OG 3.32Å; T249-S308 VanDerWaalsContact CG2-OG 3.31Å; T249-S308 WeakPolarHBondContact CG2-OG 2.84Å; T249-S308 PolarHBondContact OG1-OG 3.44Å
250	L	92.2	Very high	92.5	Very high	40 Å²	40	23.4 Å²	23.4	21%	0.209	14%	0.14	C	C	.	.	H	α-helix	trans	-61	-43.2	177.2	-75.3	-175	0	0	0	112.3	Y246 R247 Y248 G252 T253 E254	Y246-L250 HydrophobicContact CD1-CD1 3.88Å; Y246-L250 HydrophobicContact CD1-CG 4.09Å; Y246-L250 HydrophobicContact CE1-CD1 3.32Å; Y246-L250 HydrophobicContact CE1-CD2 4.11Å; Y246-L250 HydrophobicContact CE1-CG 3.61Å; Y246-L250 PolarHBondContact O-N 2.88Å; R247-L250 PolarHBondContact O-N 3.35Å; Y248-L250 PolarHBondContact O-N 3.27Å; L250-G252 PolarHBondContact O-N 2.82Å; L250-T253 WeakPolarHBondContact O-CB 3.36Å; L250-T253 PolarHBondContact O-N 2.8Å; L250-T253 VanDerWaalsContact O-N 3.16Å; L250-E254 WeakPolarHBondContact O-CG 3.26Å; L250-E254 PolarHBondContact O-N 3.05Å
251	A	93.9	Very high	92.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-38.7	175	0	0	0	0	0	111.1	R217 L218 R247 Y248 T249 E254 V255	R217-A251 HydrophobicContact CB-CB 3.63Å; L218-A251 HydrophobicContact CB-CB 3.97Å; R247-A251 WeakPolarHBondContact O-CB 3.22Å; R247-A251 PolarHBondContact O-N 3.28Å; Y248-A251 PolarHBondContact O-N 2.88Å; T249-A251 PolarHBondContact O-N 3.25Å; A251-E254 PolarHBondContact O-N 3.14Å; A251-V255 WeakPolarHBondContact O-CG2 3.04Å; A251-V255 PolarHBondContact O-N 2.83Å
252	G	93.9	Very high	92.1	Very high	1 Å²	1	34 Å²	34	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-63.4	-41	174.3	0	0	0	0	0	112.8	Y248 T249 L250 V255 S256	Y248-G252 PolarHBondContact O-N 3.34Å; T249-G252 WeakPolarHBondContact O-CA 3.49Å; T249-G252 PolarHBondContact O-N 3.29Å; T249-G252 VanDerWaalsContact O-N 3.11Å; L250-G252 PolarHBondContact O-N 2.82Å; G252-V255 PolarHBondContact O-N 3.41Å; G252-S256 WeakPolarHBondContact O-CB 3.3Å; G252-S256 PolarHBondContact O-N 3.31Å
253	T	94.1	Very high	91.9	Very high	31 Å²	31	38.6 Å²	38.6	19%	0.19	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-45.2	173.2	-62.2	0	0	0	0	111.7	T249 L250 S256 A257 G267 Y268 Q269	T249-T253 PolarHBondContact O-N 2.96Å; T249-T253 PolarHBondContact O-OG1 3.38Å; L250-T253 WeakPolarHBondContact O-CB 3.36Å; L250-T253 PolarHBondContact O-N 2.8Å; L250-T253 VanDerWaalsContact O-N 3.16Å; T253-S256 PolarHBondContact O-N 2.89Å; T253-A257 WeakPolarHBondContact O-CB 3.49Å; T253-A257 PolarHBondContact O-N 3.43Å; T253-G267 WeakPolarHBondContact CG2-O 3.49Å; T253-Y268 WeakPolarHBondContact OG1-CD1 3.29Å; T253-Q269 PolarHBondContact OG1-OE1 2.63Å
254	E	93.1	Very high	91.9	Very high	77 Å²	77	41.5 Å²	41.5	36%	0.36	24%	0.24	S	C	.	.	H	α-helix	trans	-62.6	-48.4	177	-70.1	174.1	-115.4	0	0	111.9	P214 R217 L250 A251 S256 A257 L258	P214-E254 HydrophobicContact CB-CB 3.76Å; P214-E254 HydrophobicContact CG-CB 4.24Å; R217-E254 IonicContact CZ-OE1 2.72Å; R217-E254 IonicContact CZ-OE2 3.53Å; R217-E254 IonicContact NH1-OE1 3.91Å; R217-E254 PolarHBondContact NH1-OE1 3.44Å; R217-E254 IonicContact NH1-OE2 3.41Å; R217-E254 VanDerWaalsContact NH2-CD 3.3Å; R217-E254 IonicContact NH2-OE1 3.75Å; R217-E254 PolarHBondContact NH2-OE1 3.2Å; R217-E254 VanDerWaalsContact NH2-OE1 3.11Å; R217-E254 IonicContact NH2-OE2 3.84Å; R217-E254 PolarHBondContact NH2-OE2 2.93Å; L250-E254 WeakPolarHBondContact O-CG 3.26Å; L250-E254 PolarHBondContact O-N 3.05Å; A251-E254 PolarHBondContact O-N 3.14Å; E254-S256 VanDerWaalsContact C-N 3.34Å; E254-S256 PolarHBondContact O-N 2.87Å; E254-A257 PolarHBondContact O-N 2.8Å; E254-L258 VanDerWaalsContact O-CG 3.29Å; E254-L258 WeakPolarHBondContact O-CG 3.39Å; E254-L258 PolarHBondContact O-N 2.82Å
255	V	93.2	Very high	91.7	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.024	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-43.7	176.6	172.8	0	0	0	0	110.6	I55 P214 L218 A251 G252 A257 L258 L259	I55-V255 HydrophobicContact CD1-CG1 4.48Å; I55-V255 HydrophobicContact CD1-CG2 4.46Å; I55-V255 HydrophobicContact CG1-CG1 4.49Å; I55-V255 HydrophobicContact CG1-CG2 4.38Å; P214-V255 HydrophobicContact CB-CG2 3.92Å; P214-V255 HydrophobicContact CG-CG2 4.26Å; L218-V255 HydrophobicContact CB-CG2 4.43Å; L218-V255 HydrophobicContact CD2-CB 3.89Å; L218-V255 HydrophobicContact CD2-CG1 4.08Å; L218-V255 HydrophobicContact CD2-CG2 3.77Å; A251-V255 WeakPolarHBondContact O-CG2 3.04Å; A251-V255 PolarHBondContact O-N 2.83Å; G252-V255 PolarHBondContact O-N 3.41Å; V255-A257 PolarHBondContact O-N 3.4Å; V255-L258 PolarHBondContact O-N 3.28Å; V255-L259 HydrophobicContact CG1-CD1 3.86Å; V255-L259 HydrophobicContact CG1-CG 4.23Å; V255-L259 WeakPolarHBondContact O-CB 3.49Å; V255-L259 VanDerWaalsContact O-CG 3.27Å; V255-L259 WeakPolarHBondContact O-CG 3.34Å; V255-L259 PolarHBondContact O-N 3.48Å
256	S	93.4	Very high	91.4	Very high	4 Å²	4	49.3 Å²	49.3	3%	0.028	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-44	178.1	178	0	0	0	0	112.3	G252 T253 E254 L259 G260 R261 Q269	G252-S256 WeakPolarHBondContact O-CB 3.3Å; G252-S256 PolarHBondContact O-N 3.31Å; T253-S256 PolarHBondContact O-N 2.89Å; E254-S256 VanDerWaalsContact C-N 3.34Å; E254-S256 PolarHBondContact O-N 2.87Å; S256-L259 PolarHBondContact O-N 3.47Å; S256-G260 PolarHBondContact O-N 3.4Å; S256-R261 WeakPolarHBondContact O-CB 3.36Å; S256-R261 PolarHBondContact O-N 3.05Å; S256-R261 WeakPolarHBondContact OG-CB 3.43Å; S256-R261 WeakPolarHBondContact OG-CD 3.39Å; S256-Q269 VanDerWaalsContact OG-CB 3.3Å; S256-Q269 WeakPolarHBondContact OG-CB 3.39Å
257	A	92.3	Very high	91.2	Very high	69 Å²	69	50 Å²	50	57%	0.57	31%	0.307	S	S	*	.	H	α-helix	trans	-64.3	-43.1	176.1	0	0	0	0	0	111.7	T253 E254 V255 L259 G260	T253-A257 WeakPolarHBondContact O-CB 3.49Å; T253-A257 PolarHBondContact O-N 3.43Å; E254-A257 PolarHBondContact O-N 2.8Å; V255-A257 PolarHBondContact O-N 3.4Å; A257-L259 VanDerWaalsContact C-N 3.31Å; A257-L259 PolarHBondContact O-N 3.14Å; A257-G260 PolarHBondContact O-N 2.67Å
258	L	91.5	Very high	91.3	Very high	66 Å²	66	46.6 Å²	46.6	35%	0.346	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-36.3	176.4	-72.6	174.1	0	0	0	112.7	A12 V13 I55 P214 E254 V255 G260	A12-L258 HydrophobicContact CB-CD1 4.32Å; V13-L258 HydrophobicContact CG2-CB 3.68Å; I55-L258 HydrophobicContact CD1-CD1 4.3Å; P214-L258 HydrophobicContact CG-CD1 3.88Å; E254-L258 VanDerWaalsContact O-CG 3.29Å; E254-L258 WeakPolarHBondContact O-CG 3.39Å; E254-L258 PolarHBondContact O-N 2.82Å; V255-L258 PolarHBondContact O-N 3.28Å; L258-G260 PolarHBondContact O-N 3.01Å
259	L	90.7	Very high	91.2	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.026	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-8	174.8	-68	175.1	0	0	0	113.3	V13 Q44 R53 V255 S256 A257 R261	V13-L259 HydrophobicContact CG2-CD2 4.36Å; Q44-L259 HydrophobicContact CB-CD1 3.96Å; Q44-L259 HydrophobicContact CB-CD2 3.89Å; Q44-L259 HydrophobicContact CG-CD1 4.05Å; Q44-L259 HydrophobicContact CG-CD2 4Å; R53-L259 HydrophobicContact CG-CD2 3.7Å; R53-L259 PolarHBondContact NH1-O 2.69Å; V255-L259 HydrophobicContact CG1-CD1 3.86Å; V255-L259 HydrophobicContact CG1-CG 4.23Å; V255-L259 WeakPolarHBondContact O-CB 3.49Å; V255-L259 VanDerWaalsContact O-CG 3.27Å; V255-L259 WeakPolarHBondContact O-CG 3.34Å; V255-L259 PolarHBondContact O-N 3.48Å; S256-L259 PolarHBondContact O-N 3.47Å; A257-L259 VanDerWaalsContact C-N 3.31Å; A257-L259 PolarHBondContact O-N 3.14Å; L259-R261 HydrophobicContact CB-CG 4.35Å
260	G	88.3	Confident	91.2	Very high	63 Å²	63	50 Å²	50	65%	0.649	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	22.6	-179.7	0	0	0	0	0	113.9	S256 A257 L258	S256-G260 PolarHBondContact O-N 3.4Å; A257-G260 PolarHBondContact O-N 2.67Å; L258-G260 PolarHBondContact O-N 3.01Å
261	R	88.7	Confident	91.1	Very high	60 Å²	60	49.5 Å²	49.5	23%	0.226	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-72.2	144.7	173.9	-61.7	178.9	-178	172	2	109.6	S256 L259 P270 T271 E275	S256-R261 WeakPolarHBondContact O-CB 3.36Å; S256-R261 PolarHBondContact O-N 3.05Å; S256-R261 WeakPolarHBondContact OG-CB 3.43Å; S256-R261 WeakPolarHBondContact OG-CD 3.39Å; L259-R261 HydrophobicContact CB-CG 4.35Å; R261-P270 HydrophobicContact CB-CG 4.38Å; R261-T271 PolarHBondContact NH1-OG1 3.39Å; R261-E275 IonicContact NH1-OE1 3.12Å; R261-E275 PolarHBondContact NH1-OE1 3.35Å
262	M	91.9	Very high	91.1	Very high	163 Å²	163	50.1 Å²	50.1	80%	0.803	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-66.6	131.5	173.8	-68.8	-175.3	-172.9	0	0	109.8	P270	M262-P270 WeakPolarHBondContact O-CD 3.47Å
263	P	90.4	Very high	91	Very high	98 Å²	98	53.1 Å²	53.1	64%	0.636	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-66.4	148	175	27.3	-33.1	0	0	0	110.9
264	S	90	Very high	90.9	Very high	69 Å²	69	58 Å²	58	48%	0.483	37%	0.365	S	S	.	.			trans	-97	-155.8	175.4	-167.2	0	0	0	0	110.6	V266 G267 Y268	S264-V266 PolarHBondContact O-N 3.47Å; S264-G267 PolarHBondContact O-N 3.47Å; S264-G267 VanDerWaalsContact O-N 3.12Å; S264-Y268 WeakPolarHBondContact CB-O 3.29Å; S264-Y268 PolarHBondContact N-O 3.32Å
265	A	84.5	Confident	90.9	Very high	57 Å²	57	55.9 Å²	55.9	47%	0.471	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-49.9	131.6	177.1	0	0	0	0	0	111.7	G267 Y268 P307	A265-G267 PolarHBondContact O-N 3.03Å; A265-Y268 WeakPolarHBondContact O-CD2 3.27Å; A265-Y268 PolarHBondContact O-N 2.85Å; A265-Y268 VanDerWaalsContact O-N 3.15Å; A265-P307 HydrophobicContact CB-CG 4.16Å
266	V	86.2	Confident	91	Very high	115 Å²	115	55.7 Å²	55.7	70%	0.697	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	59.6	11.6	177.2	-162.2	0	0	0	0	114	S264 Y268 P307	S264-V266 PolarHBondContact O-N 3.47Å; V266-Y268 HydrophobicContact CB-CD2 4.05Å; V266-Y268 HydrophobicContact CB-CE2 4.12Å; V266-Y268 HydrophobicContact CG1-CE2 4.34Å; V266-P307 HydrophobicContact CB-CG 4.26Å; V266-P307 HydrophobicContact CG2-CG 3.84Å
267	G	88.2	Confident	91	Very high	37 Å²	37	56.2 Å²	56.2	38%	0.381	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	94.5	-1.3	-179.9	0	0	0	0	0	115	T253 S264 A265	T253-G267 WeakPolarHBondContact CG2-O 3.49Å; S264-G267 PolarHBondContact O-N 3.47Å; S264-G267 VanDerWaalsContact O-N 3.12Å; A265-G267 PolarHBondContact O-N 3.03Å
268	Y	92.8	Very high	91	Very high	14 Å²	14	56.4 Å²	56.4	6%	0.055	35%	0.353	C	S	.	.			trans	-67.6	162.3	178.6	-72.3	-73.8	0	0	0	112.9	T249 T253 S264 A265 V266 L272 D306 P307 S308	T249-Y268 HydrophobicContact CG2-CD1 3.72Å; T249-Y268 HydrophobicContact CG2-CE1 3.67Å; T253-Y268 WeakPolarHBondContact OG1-CD1 3.29Å; S264-Y268 WeakPolarHBondContact CB-O 3.29Å; S264-Y268 PolarHBondContact N-O 3.32Å; A265-Y268 WeakPolarHBondContact O-CD2 3.27Å; A265-Y268 PolarHBondContact O-N 2.85Å; A265-Y268 VanDerWaalsContact O-N 3.15Å; V266-Y268 HydrophobicContact CB-CD2 4.05Å; V266-Y268 HydrophobicContact CB-CE2 4.12Å; V266-Y268 HydrophobicContact CG1-CE2 4.34Å; Y268-L272 HydrophobicContact CD1-CD2 4.28Å; Y268-L272 HydrophobicContact CG-CD2 4.12Å; Y268-D306 VanDerWaalsContact CE2-OD1 3.27Å; Y268-D306 WeakPolarHBondContact CE2-OD1 3.45Å; Y268-D306 VanDerWaalsContact CZ-OD1 3.23Å; Y268-D306 PolarHBondContact OH-OD1 3.24Å; Y268-D306 PolarHBondContact OH-OD2 2.95Å; Y268-P307 HydrophobicContact CD2-CB 3.68Å; Y268-P307 HydrophobicContact CD2-CG 3.81Å; Y268-P307 HydrophobicContact CE2-CB 3.98Å; Y268-P307 HydrophobicContact CE2-CG 4.04Å; Y268-P307 HydrophobicContact CG-CB 4.44Å; Y268-S308 WeakPolarHBondContact OH-CB 3.47Å
269	Q	92.5	Very high	91.2	Very high	3 Å²	3	53.4 Å²	53.4	1%	0.014	34%	0.337	C	S	.	.			trans	-64.9	143	175.6	70.7	-85.3	35.4	0	0	111.8	T253 S256 T271 L272 E275	T253-Q269 PolarHBondContact OG1-OE1 2.63Å; S256-Q269 VanDerWaalsContact OG-CB 3.3Å; S256-Q269 WeakPolarHBondContact OG-CB 3.39Å; Q269-T271 PolarHBondContact O-N 3.08Å; Q269-L272 HydrophobicContact CG-CB 4.04Å; Q269-L272 WeakPolarHBondContact O-CB 3.46Å; Q269-L272 PolarHBondContact O-N 3.45Å; Q269-E275 PolarHBondContact NE2-OE2 2.84Å
270	P	92.4	Very high	91.4	Very high	75 Å²	75	53.1 Å²	53.1	49%	0.487	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.3	177.2	27.9	-34.3	0	0	0	112.7	R261 M262 L272	R261-P270 HydrophobicContact CB-CG 4.38Å; M262-P270 WeakPolarHBondContact O-CD 3.47Å; P270-L272 VanDerWaalsContact C-N 3.34Å
271	T	91.6	Very high	91.6	Very high	28 Å²	28	54.8 Å²	54.8	17%	0.172	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	9.2	179.2	46.6	0	0	0	0	113.4	R261 Q269 A273 E274 E275	R261-T271 PolarHBondContact NH1-OG1 3.39Å; Q269-T271 PolarHBondContact O-N 3.08Å; T271-A273 PolarHBondContact O-N 3.24Å; T271-E274 PolarHBondContact O-N 3.09Å; T271-E274 VanDerWaalsContact O-N 3.11Å; T271-E275 WeakPolarHBondContact CB-OE1 3.24Å; T271-E275 WeakPolarHBondContact O-CG 3.44Å; T271-E275 PolarHBondContact O-N 2.95Å; T271-E275 PolarHBondContact OG1-OE1 3.16Å
272	L	92.6	Very high	91.9	Very high	13 Å²	13	52 Å²	52	7%	0.068	32%	0.316	C	S	.	.	H	α-helix	trans	-55.3	-50.7	-171.3	172.5	57.6	0	0	0	112.3	T249 Y268 Q269 P270 E274 E275 M276 P307	T249-L272 HydrophobicContact CG2-CD1 3.43Å; T249-L272 VanDerWaalsContact CG2-CD1 3.43Å; T249-L272 HydrophobicContact CG2-CD2 4.34Å; Y268-L272 HydrophobicContact CD1-CD2 4.28Å; Y268-L272 HydrophobicContact CG-CD2 4.12Å; Q269-L272 HydrophobicContact CG-CB 4.04Å; Q269-L272 WeakPolarHBondContact O-CB 3.46Å; Q269-L272 PolarHBondContact O-N 3.45Å; P270-L272 VanDerWaalsContact C-N 3.34Å; L272-E274 VanDerWaalsContact C-N 3.28Å; L272-E274 PolarHBondContact O-N 2.81Å; L272-E275 PolarHBondContact O-N 3.33Å; L272-M276 VanDerWaalsContact O-CB 3.25Å; L272-M276 WeakPolarHBondContact O-CB 3.13Å; L272-M276 PolarHBondContact O-N 2.98Å; L272-P307 HydrophobicContact CD2-CB 4.27Å
273	A	92.8	Very high	92	Very high	65 Å²	65	44.3 Å²	44.3	54%	0.537	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-35.4	-178.8	0	0	0	0	0	112.5	T271 G277 T311	T271-A273 PolarHBondContact O-N 3.24Å; A273-G277 PolarHBondContact O-N 2.83Å; A273-T311 HydrophobicContact CB-CG2 4.38Å
274	E	93	Very high	92	Very high	133 Å²	133	41.1 Å²	41.1	62%	0.621	26%	0.257	S	S	*	.	H	α-helix	trans	-71.8	-50.5	177.9	-176.6	-177.8	-174.1	0	0	111.3	T271 L272 M276 G277 V278	T271-E274 PolarHBondContact O-N 3.09Å; T271-E274 VanDerWaalsContact O-N 3.11Å; L272-E274 VanDerWaalsContact C-N 3.28Å; L272-E274 PolarHBondContact O-N 2.81Å; E274-M276 VanDerWaalsContact C-N 3.33Å; E274-M276 PolarHBondContact O-N 3.45Å; E274-G277 PolarHBondContact O-N 3.36Å; E274-G277 VanDerWaalsContact O-N 3.15Å; E274-V278 WeakPolarHBondContact O-CG2 3.35Å; E274-V278 PolarHBondContact O-N 2.84Å
275	E	92.6	Very high	92	Very high	33 Å²	33	38.3 Å²	38.3	15%	0.154	24%	0.238	C	C	.	.	H	α-helix	trans	-60.2	-44	179.2	-73.1	170.4	-167.6	0	0	111.3	Y248 R261 Q269 T271 L272 L279	Y248-E275 PolarHBondContact OH-O 3.12Å; R261-E275 IonicContact NH1-OE1 3.12Å; R261-E275 PolarHBondContact NH1-OE1 3.35Å; Q269-E275 PolarHBondContact NE2-OE2 2.84Å; T271-E275 WeakPolarHBondContact CB-OE1 3.24Å; T271-E275 WeakPolarHBondContact O-CG 3.44Å; T271-E275 PolarHBondContact O-N 2.95Å; T271-E275 PolarHBondContact OG1-OE1 3.16Å; L272-E275 PolarHBondContact O-N 3.33Å; E275-L279 PolarHBondContact O-N 2.78Å
276	M	93.8	Very high	92.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-46.5	173.9	-170.8	61	68.3	0	0	111	I245 Y248 T249 L272 E274 V278 L279 Q280 T311	I245-M276 HydrophobicContact CD1-CE 4.46Å; I245-M276 HydrophobicContact CD1-SD 4.2Å; I245-M276 HydrophobicContact CG1-CE 4.01Å; I245-M276 HydrophobicContact CG1-SD 4.06Å; Y248-M276 HydrophobicContact CD1-CE 4.21Å; T249-M276 VanDerWaalsContact OG1-CE 3.3Å; T249-M276 WeakPolarHBondContact OG1-CE 3.29Å; L272-M276 VanDerWaalsContact O-CB 3.25Å; L272-M276 WeakPolarHBondContact O-CB 3.13Å; L272-M276 PolarHBondContact O-N 2.98Å; E274-M276 VanDerWaalsContact C-N 3.33Å; E274-M276 PolarHBondContact O-N 3.45Å; M276-V278 PolarHBondContact O-N 3.06Å; M276-L279 PolarHBondContact O-N 2.91Å; M276-Q280 HydrophobicContact CG-CG 3.89Å; M276-Q280 WeakPolarHBondContact O-CB 3.21Å; M276-Q280 WeakPolarHBondContact O-CG 3.39Å; M276-Q280 PolarHBondContact O-N 3.38Å; M276-Q280 HydrophobicContact SD-CG 3.8Å; M276-Q280 PolarHBondContact SD-NE2 2.94Å; M276-Q280 VanDerWaalsContact SD-NE2 3.44Å; M276-T311 HydrophobicContact CB-CG2 4.03Å; M276-T311 HydrophobicContact CG-CG2 4.11Å
277	G	93.6	Very high	92.4	Very high	14 Å²	14	38.2 Å²	38.2	14%	0.144	22%	0.218	C	C	.	.	H	α-helix	trans	-58.7	-45.2	178.3	0	0	0	0	0	112.7	A273 E274 L279 Q280 E281	A273-G277 PolarHBondContact O-N 2.83Å; E274-G277 PolarHBondContact O-N 3.36Å; E274-G277 VanDerWaalsContact O-N 3.15Å; G277-L279 VanDerWaalsContact C-N 3.27Å; G277-L279 PolarHBondContact O-N 2.94Å; G277-Q280 PolarHBondContact O-N 2.87Å; G277-E281 VanDerWaalsContact O-CB 3.29Å; G277-E281 WeakPolarHBondContact O-CB 3.45Å; G277-E281 VanDerWaalsContact O-CG 3.27Å; G277-E281 WeakPolarHBondContact O-CG 3.33Å; G277-E281 PolarHBondContact O-N 3.21Å
278	V	93.3	Very high	92.4	Very high	74 Å²	74	40.5 Å²	40.5	45%	0.448	23%	0.225	S	C	.	.	H	α-helix	trans	-59.3	-39.1	178	169.4	0	0	0	0	111.7	E274 M276 R282	E274-V278 WeakPolarHBondContact O-CG2 3.35Å; E274-V278 PolarHBondContact O-N 2.84Å; M276-V278 PolarHBondContact O-N 3.06Å; V278-R282 VanDerWaalsContact O-CD 3.26Å; V278-R282 WeakPolarHBondContact O-CD 3.31Å; V278-R282 WeakPolarHBondContact O-CG 3.25Å
279	L	95	Very high	92.3	Very high	2 Å²	2	40 Å²	40	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-72.4	-49	175.9	179.1	68.1	0	0	0	111.6	A221 L222 L225 I245 Y248 E275 M276 G277	A221-L279 HydrophobicContact CB-CD1 4.11Å; A221-L279 HydrophobicContact CB-CD2 4.05Å; L222-L279 HydrophobicContact CD2-CB 4.37Å; L222-L279 HydrophobicContact CD2-CD1 3.56Å; L222-L279 HydrophobicContact CG-CD1 4.35Å; L225-L279 HydrophobicContact CD2-CD1 3.66Å; L225-L279 WeakPolarHBondContact CD2-O 3.49Å; I245-L279 HydrophobicContact CD1-CD2 3.52Å; Y248-L279 HydrophobicContact CD1-CD2 4.16Å; Y248-L279 HydrophobicContact CD2-CD2 4.24Å; Y248-L279 HydrophobicContact CE1-CD2 3.99Å; Y248-L279 HydrophobicContact CE2-CD2 4.03Å; Y248-L279 HydrophobicContact CG-CD2 4.29Å; E275-L279 PolarHBondContact O-N 2.78Å; M276-L279 PolarHBondContact O-N 2.91Å; G277-L279 VanDerWaalsContact C-N 3.27Å; G277-L279 PolarHBondContact O-N 2.94Å
280	Q	95	Very high	92.2	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.9	-38.8	-172.8	-65.5	-63.9	-18.9	0	0	112.5	K145 M276 G277 R282 I283 H315	K145-Q280 WeakPolarHBondContact CE-O 3.35Å; K145-Q280 PolarHBondContact NZ-O 2.9Å; M276-Q280 HydrophobicContact CG-CG 3.89Å; M276-Q280 WeakPolarHBondContact O-CB 3.21Å; M276-Q280 WeakPolarHBondContact O-CG 3.39Å; M276-Q280 PolarHBondContact O-N 3.38Å; M276-Q280 HydrophobicContact SD-CG 3.8Å; M276-Q280 PolarHBondContact SD-NE2 2.94Å; M276-Q280 VanDerWaalsContact SD-NE2 3.44Å; G277-Q280 PolarHBondContact O-N 2.87Å; Q280-R282 PolarHBondContact O-N 3.26Å; Q280-I283 WeakPolarHBondContact O-CB 3.13Å; Q280-I283 PolarHBondContact O-N 2.85Å; Q280-I283 VanDerWaalsContact O-N 3.1Å; Q280-H315 HydrophobicContact CB-CB 3.87Å; Q280-H315 HydrophobicContact CG-CB 3.86Å
281	E	93.1	Very high	92.3	Very high	98 Å²	98	36.4 Å²	36.4	46%	0.458	20%	0.201	S	C	.	.	H	α-helix	trans	-69.6	-20.8	-177.9	-67.4	-52.4	121.3	0	0	113.1	A114 K145 G277 H315	A114-E281 HydrophobicContact CB-CB 3.98Å; A114-E281 WeakPolarHBondContact CB-O 3.06Å; K145-E281 IonicContact NZ-OE1 2.97Å; G277-E281 VanDerWaalsContact O-CB 3.29Å; G277-E281 WeakPolarHBondContact O-CB 3.45Å; G277-E281 VanDerWaalsContact O-CG 3.27Å; G277-E281 WeakPolarHBondContact O-CG 3.33Å; G277-E281 PolarHBondContact O-N 3.21Å; E281-H315 IonicContact OE1-CE1 3.91Å; E281-H315 IonicContact OE1-ND1 3.25Å; E281-H315 PolarHBondContact OE1-ND1 2.8Å
282	R	94.6	Very high	92.3	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-75.4	-25.5	172	-76.4	171.6	66.5	-178.2	1.5	113.2	I110 R112 A114 L225 T226 E229 R232 V278 Q280 T284	I110-R282 PolarHBondContact O-NH1 3.19Å; I110-R282 PolarHBondContact O-NH2 3.1Å; R112-R282 WeakPolarHBondContact O-CD 3.42Å; A114-R282 HydrophobicContact CB-CG 4.07Å; L225-R282 HydrophobicContact CD2-CB 3.57Å; L225-R282 HydrophobicContact CD2-CG 4.5Å; L225-R282 HydrophobicContact CG-CB 4.37Å; T226-R282 PolarHBondContact OG1-NH2 2.84Å; E229-R282 VanDerWaalsContact CD-NH2 3.35Å; E229-R282 WeakPolarHBondContact OE1-CB 3.3Å; E229-R282 IonicContact OE1-CZ 3.32Å; E229-R282 IonicContact OE1-NE 2.63Å; E229-R282 PolarHBondContact OE1-NE 3.29Å; E229-R282 IonicContact OE1-NH2 2.69Å; E229-R282 PolarHBondContact OE1-NH2 2.82Å; E229-R282 IonicContact OE2-CZ 2.65Å; E229-R282 IonicContact OE2-NE 3.38Å; E229-R282 IonicContact OE2-NH2 3Å; E229-R282 PolarHBondContact OE2-NH2 2.84Å; R232-R282 PolarHBondContact NH1-O 3.3Å; V278-R282 VanDerWaalsContact O-CD 3.26Å; V278-R282 WeakPolarHBondContact O-CD 3.31Å; V278-R282 WeakPolarHBondContact O-CG 3.25Å; Q280-R282 PolarHBondContact O-N 3.26Å; R282-T284 PolarHBondContact O-N 3.31Å
283	I	93.8	Very high	92.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.191	C	C	.	.	S	Bend	trans	-80.5	93.7	174.6	-59	170	0	0	0	107.8	K145 L225 L240 Q280 I291 S293	K145-I283 WeakPolarHBondContact CE-O 3.27Å; K145-I283 HydrophobicContact CG-CG2 4.02Å; L225-I283 HydrophobicContact CD1-CG1 3.72Å; L225-I283 HydrophobicContact CD2-CG1 4.03Å; L240-I283 HydrophobicContact CD2-CD1 3.91Å; L240-I283 HydrophobicContact CD2-CG1 3.94Å; Q280-I283 WeakPolarHBondContact O-CB 3.13Å; Q280-I283 PolarHBondContact O-N 2.85Å; Q280-I283 VanDerWaalsContact O-N 3.1Å; I283-I291 HydrophobicContact CG2-CG2 4.01Å; I283-S293 WeakPolarHBondContact CG2-OG 3.48Å
284	T	90.8	Very high	92.3	Very high	31 Å²	31	31.7 Å²	31.7	19%	0.19	17%	0.166	C	C	.	.			trans	-157.6	163.3	-177.6	-168.4	0	0	0	0	111.9	P115 L120 R232 R282	P115-T284 HydrophobicContact CB-CG2 4.19Å; P115-T284 HydrophobicContact CG-CG2 3.63Å; L120-T284 HydrophobicContact CD2-CG2 3.58Å; L120-T284 WeakPolarHBondContact CD2-OG1 3.35Å; R232-T284 WeakPolarHBondContact CD-O 3.15Å; R282-T284 PolarHBondContact O-N 3.31Å
285	S	90.4	Very high	92.4	Very high	11 Å²	11	25.3 Å²	25.3	8%	0.077	14%	0.137	C	C	.	.			trans	-82.7	130.6	169.6	-79	0	0	0	0	111.6	S121 K142 G143 S290	S121-S285 PolarHBondContact N-O 3.39Å; S121-S285 VanDerWaalsContact N-O 3.09Å; K142-S285 PolarHBondContact O-OG 3.37Å; G143-S285 WeakPolarHBondContact CA-OG 3.31Å; S285-S290 WeakPolarHBondContact OG-CB 3.4Å
286	T	91.4	Very high	92.2	Very high	12 Å²	12	23.8 Å²	23.8	7%	0.074	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-105.1	174.4	169.6	62.7	0	0	0	0	110.3	P115 E119 T288 G289	P115-T286 HydrophobicContact CB-CG2 3.9Å; P115-T286 HydrophobicContact CG-CG2 3.85Å; E119-T286 CarbonylContact O-C 3.49Å; E119-T286 WeakPolarHBondContact O-CA 3.39Å; T286-T288 PolarHBondContact O-N 2.84Å; T286-T288 PolarHBondContact OG1-N 3.43Å; T286-T288 PolarHBondContact OG1-OG1 2.92Å; T286-G289 PolarHBondContact N-O 3.28Å; T286-G289 VanDerWaalsContact O-O 3.12Å; T286-G289 PolarHBondContact OG1-N 2.84Å; T286-G289 PolarHBondContact OG1-O 3.44Å; T286-G289 VanDerWaalsContact OG1-O 3.12Å
287	K	88.1	Confident	92	Very high	158 Å²	158	23.8 Å²	23.8	69%	0.687	13%	0.129	S	C	*	.	S	Bend	trans	-61.1	-21.1	171.7	-72.4	170	174.5	169.7	0	113.9	E118 E119	E118-K287 WeakPolarHBondContact O-CE 3.24Å; E118-K287 PolarHBondContact O-NZ 3.03Å; E119-K287 PolarHBondContact O-N 2.86Å
288	T	88	Confident	91.5	Very high	84 Å²	84	27.8 Å²	27.8	52%	0.515	14%	0.141	S	C	.	.	S	Bend	trans	-93.1	-42.2	-177.3	55.6	0	0	0	0	112.1	R232 G235 T286	R232-T288 PolarHBondContact O-OG1 3.15Å; G235-T288 CarbonylContact C-O 3.55Å; G235-T288 WeakPolarHBondContact CA-O 3.47Å; T286-T288 PolarHBondContact O-N 2.84Å; T286-T288 PolarHBondContact OG1-N 3.43Å; T286-T288 PolarHBondContact OG1-OG1 2.92Å
289	G	90.3	Very high	90.8	Very high	5 Å²	5	24.9 Å²	24.9	5%	0.052	12%	0.123	C	C	.	.			trans	-163.2	-177.6	-175.5	0	0	0	0	0	111.7	R232 R236 T286	R232-G289 WeakPolarHBondContact CG-O 3.34Å; R236-G289 WeakPolarHBondContact O-CA 3.4Å; T286-G289 PolarHBondContact N-O 3.28Å; T286-G289 VanDerWaalsContact O-O 3.12Å; T286-G289 PolarHBondContact OG1-N 2.84Å; T286-G289 PolarHBondContact OG1-O 3.44Å; T286-G289 VanDerWaalsContact OG1-O 3.12Å
290	S	90.9	Very high	90.1	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.8	-176.7	64.5	0	0	0	0	113.5	K142 R236 D237 V238 S285	K142-S290 WeakPolarHBondContact CG-OG 3.34Å; R236-S290 PolarHBondContact O-N 3.43Å; R236-S290 VanDerWaalsContact O-N 3.16Å; D237-S290 WeakPolarHBondContact CB-OG 3.27Å; D237-S290 WeakPolarHBondContact OD1-CB 3.38Å; D237-S290 PolarHBondContact OD1-N 2.88Å; D237-S290 PolarHBondContact OD1-OG 3.2Å; V238-S290 PolarHBondContact N-O 2.93Å; S285-S290 WeakPolarHBondContact OG-CB 3.4Å
291	I	93.3	Very high	89.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	102.5	165.3	-58.7	170.4	0	0	0	107.4	G143 L225 A228 E229 R232 V238 L240 I283	G143-I291 CarbonylContact C-O 3.57Å; G143-I291 WeakPolarHBondContact CA-O 3.45Å; L225-I291 HydrophobicContact CD1-CD1 4.04Å; A228-I291 HydrophobicContact CB-CD1 4.21Å; A228-I291 HydrophobicContact CB-CG1 4.47Å; A228-I291 HydrophobicContact CB-CG2 4.41Å; E229-I291 HydrophobicContact CG-CD1 3.88Å; R232-I291 HydrophobicContact CB-CD1 4.08Å; R232-I291 HydrophobicContact CB-CG1 3.75Å; R232-I291 HydrophobicContact CG-CD1 4.48Å; R232-I291 HydrophobicContact CG-CG1 4.06Å; V238-I291 CarbonylContact O-C 3.54Å; V238-I291 WeakPolarHBondContact O-CA 3.48Å; L240-I291 HydrophobicContact CB-CG2 3.68Å; L240-I291 HydrophobicContact CD2-CG2 4.28Å; I283-I291 HydrophobicContact CG2-CG2 4.01Å
292	T	92.1	Very high	88.3	Confident	4 Å²	4	31.9 Å²	31.9	3%	0.025	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.9	170	-51.4	0	0	0	0	107.7	L127 G143 V238 L239 L240	L127-T292 HydrophobicContact CD2-CG2 3.93Å; G143-T292 PolarHBondContact N-OG1 2.99Å; V238-T292 PolarHBondContact O-N 3.24Å; L239-T292 CarbonylContact C-O 3.35Å; L239-T292 VanDerWaalsContact CA-O 3.29Å; L239-T292 WeakPolarHBondContact CA-O 3.46Å; L239-T292 HydrophobicContact CD2-CG2 4.03Å; L240-T292 PolarHBondContact N-O 3.39Å
293	S	93.4	Very high	87.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	141.2	-179.6	67.2	0	0	0	0	112.9	G144 K145 V146 L240 I283 Q295	G144-S293 PolarHBondContact O-N 2.84Å; K145-S293 WeakPolarHBondContact CA-OG 3.43Å; V146-S293 WeakPolarHBondContact CB-O 3.37Å; V146-S293 PolarHBondContact N-O 3.17Å; L240-S293 CarbonylContact O-C 3.6Å; L240-S293 WeakPolarHBondContact O-CA 3.31Å; I283-S293 WeakPolarHBondContact CG2-OG 3.48Å; S293-Q295 PolarHBondContact OG-NE2 3.03Å
294	V	93	Very high	86.6	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	108.6	170.6	-177.9	0	0	0	0	107.2	F140 V146 L148 M160 L163 L240 F241 V242	F140-V294 HydrophobicContact CE2-CG2 4.33Å; V146-V294 HydrophobicContact CB-CG2 4.42Å; L148-V294 HydrophobicContact CD1-CG1 3.44Å; L148-V294 VanDerWaalsContact CD1-CG1 3.44Å; L148-V294 HydrophobicContact CD2-CG1 4.2Å; L148-V294 HydrophobicContact CG-CG1 3.57Å; M160-V294 HydrophobicContact CG-CG1 4.2Å; L163-V294 HydrophobicContact CD1-CG1 4.19Å; L163-V294 HydrophobicContact CD1-CG2 4.35Å; L240-V294 PolarHBondContact O-N 3.18Å; F241-V294 WeakPolarHBondContact CA-O 3.29Å; F241-V294 HydrophobicContact CD1-CB 3.7Å; F241-V294 HydrophobicContact CD1-CG1 4.15Å; F241-V294 HydrophobicContact CD1-CG2 4.4Å; F241-V294 HydrophobicContact CE1-CB 3.64Å; F241-V294 HydrophobicContact CE1-CG1 4.06Å; F241-V294 HydrophobicContact CE1-CG2 3.86Å; F241-V294 HydrophobicContact CZ-CG2 4.35Å; V242-V294 PolarHBondContact N-O 3.38Å
295	Q	93.2	Very high	86.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.7	-169.2	-53.5	-177.6	32.5	0	0	108.7	V146 G147 L148 V242 I245 S293 V297	V146-Q295 PolarHBondContact O-N 3.11Å; G147-Q295 CarbonylContact C-O 3.48Å; G147-Q295 WeakPolarHBondContact CA-O 3.27Å; L148-Q295 PolarHBondContact N-O 3.33Å; V242-Q295 HydrophobicContact CB-CB 4.43Å; V242-Q295 HydrophobicContact CB-CG 4.22Å; V242-Q295 HydrophobicContact CG2-CG 4.35Å; V242-Q295 CarbonylContact O-C 3.59Å; V242-Q295 WeakPolarHBondContact O-CA 3.46Å; I245-Q295 HydrophobicContact CB-CB 4.41Å; I245-Q295 HydrophobicContact CG2-CB 4.43Å; S293-Q295 PolarHBondContact OG-NE2 3.03Å; Q295-V297 PolarHBondContact O-N 3.2Å
296	A	90.2	Very high	86.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	127.7	174.1	0	0	0	0	0	109	L148 K156 M160 V242 D243 N244 I245	L148-A296 WeakPolarHBondContact O-CA 3.42Å; K156-A296 HydrophobicContact CD-CB 4.36Å; M160-A296 HydrophobicContact CE-CB 4.15Å; M160-A296 HydrophobicContact SD-CB 4.43Å; V242-A296 PolarHBondContact O-N 3.39Å; D243-A296 HydrophobicContact CB-CB 4.21Å; D243-A296 WeakPolarHBondContact OD1-CB 3.43Å; N244-A296 VanDerWaalsContact ND2-CB 3.27Å; N244-A296 WeakPolarHBondContact ND2-CB 3.49Å; N244-A296 PolarHBondContact ND2-O 3.2Å; N244-A296 VanDerWaalsContact ND2-O 3.17Å; N244-A296 PolarHBondContact OD1-O 3.28Å; I245-A296 WeakPolarHBondContact CG2-O 3.27Å; I245-A296 PolarHBondContact N-O 2.78Å
297	V	87.9	Confident	86	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115	179	-167.2	0	0	0	0	108.7	L148 F149 I245 Q295 P309 T312	L148-V297 PolarHBondContact O-N 3.15Å; F149-V297 HydrophobicContact CD1-CB 3.69Å; F149-V297 HydrophobicContact CD1-CG1 3.94Å; F149-V297 HydrophobicContact CD1-CG2 4.35Å; F149-V297 HydrophobicContact CE1-CB 3.51Å; F149-V297 HydrophobicContact CE1-CG1 3.47Å; F149-V297 VanDerWaalsContact CE1-CG1 3.47Å; F149-V297 HydrophobicContact CE1-CG2 3.86Å; F149-V297 HydrophobicContact CE2-CG2 4.2Å; F149-V297 HydrophobicContact CG-CB 4.29Å; F149-V297 HydrophobicContact CZ-CB 3.96Å; F149-V297 HydrophobicContact CZ-CG1 4.17Å; F149-V297 HydrophobicContact CZ-CG2 3.76Å; I245-V297 HydrophobicContact CG2-CB 4.29Å; I245-V297 HydrophobicContact CG2-CG1 4.35Å; I245-V297 HydrophobicContact CG2-CG2 3.72Å; Q295-V297 PolarHBondContact O-N 3.2Å; V297-P309 HydrophobicContact CG1-CB 4.3Å; V297-T312 HydrophobicContact CG2-CG2 4.23Å
298	Y	84.3	Confident	86	Confident	99 Å²	99	37.1 Å²	37.1	39%	0.388	22%	0.216	S	C	.	.			trans	-81.8	126.9	168	177.7	-96.5	0	0	0	109.9	N244 Y246 P300	N244-Y298 PolarHBondContact OD1-N 3.3Å; Y246-Y298 AromaticContact CD1-CD1 3.61Å; Y246-Y298 HydrophobicContact CD1-CD1 3.61Å; Y246-Y298 HydrophobicContact CD1-CG 4.15Å; Y246-Y298 VanDerWaalsContact CD2-O 3.32Å; Y246-Y298 WeakPolarHBondContact CD2-O 3.23Å; Y246-Y298 AromaticContact CE1-CD1 3.54Å; Y246-Y298 HydrophobicContact CE1-CD1 3.54Å; Y246-Y298 HydrophobicContact CE1-CE1 4.17Å; Y246-Y298 HydrophobicContact CE1-CG 4.49Å; Y246-Y298 HydrophobicContact CG-CD1 4.16Å; Y298-P300 HydrophobicContact CD1-CG 4.32Å; Y298-P300 HydrophobicContact CE1-CB 4.35Å; Y298-P300 HydrophobicContact CE1-CG 4.27Å
299	V	78.7	Confident	85.9	Confident	12 Å²	12	33.1 Å²	33.1	7%	0.073	19%	0.192	C	C	.	.			trans	-99.1	113.8	176.2	-171.6	0	0	0	0	108.7	F149 A301 D302 D303 L304	F149-V299 HydrophobicContact CD1-CG2 3.58Å; F149-V299 HydrophobicContact CE1-CG2 4.28Å; V299-A301 PolarHBondContact O-N 2.97Å; V299-D302 PolarHBondContact O-N 3.12Å; V299-D303 WeakPolarHBondContact CG1-O 3.26Å; V299-L304 HydrophobicContact CG1-CD2 3.87Å; V299-L304 HydrophobicContact CG2-CD2 3.89Å
300	P	79.3	Confident	85.8	Confident	23 Å²	23	35 Å²	35	15%	0.149	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-65.7	128.2	178	-20.7	34.9	0	0	0	110.8	Y246 Y298 D302 D303	Y246-P300 HydrophobicContact CD2-CG 4.31Å; Y246-P300 HydrophobicContact CE1-CG 4.42Å; Y246-P300 HydrophobicContact CE2-CG 3.37Å; Y246-P300 VanDerWaalsContact CZ-CG 3.44Å; Y246-P300 VanDerWaalsContact OH-CG 3.22Å; Y246-P300 WeakPolarHBondContact OH-CG 3.44Å; Y298-P300 HydrophobicContact CD1-CG 4.32Å; Y298-P300 HydrophobicContact CE1-CB 4.35Å; Y298-P300 HydrophobicContact CE1-CG 4.27Å; P300-D302 PolarHBondContact O-N 3.37Å; P300-D303 PolarHBondContact O-N 3.32Å
301	A	77.9	Confident	85.8	Confident	95 Å²	95	36.3 Å²	36.3	79%	0.785	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	51	25.8	179.2	0	0	0	0	0	114.4	V299 D303	V299-A301 PolarHBondContact O-N 2.97Å; A301-D303 PolarHBondContact O-N 2.91Å; A301-D303 VanDerWaalsContact O-N 3.15Å
302	D	72.3	Confident	85.5	Confident	130 Å²	130	36.3 Å²	36.3	70%	0.695	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	56.4	20.9	-174.1	-54.7	-46.7	0	0	0	114.1	V299 P300 L304	V299-D302 PolarHBondContact O-N 3.12Å; P300-D302 PolarHBondContact O-N 3.37Å; D302-L304 PolarHBondContact O-N 2.99Å
303	D	79.8	Confident	85.3	Confident	72 Å²	72	38.9 Å²	38.9	39%	0.385	23%	0.226	S	C	.	.			trans	-89.4	102.2	176.8	-173.8	2.1	0	0	0	111.7	V299 P300 A301 T305 D306	V299-D303 WeakPolarHBondContact CG1-O 3.26Å; P300-D303 PolarHBondContact O-N 3.32Å; A301-D303 PolarHBondContact O-N 2.91Å; A301-D303 VanDerWaalsContact O-N 3.15Å; D303-T305 PolarHBondContact O-N 3.39Å; D303-T305 WeakPolarHBondContact OD1-CA 3.26Å; D303-T305 WeakPolarHBondContact OD1-CB 3.39Å; D303-T305 PolarHBondContact OD1-N 3.4Å; D303-T305 PolarHBondContact OD1-OG1 3.11Å; D303-T305 PolarHBondContact OD2-OG1 3.37Å; D303-D306 WeakPolarHBondContact O-CB 3.41Å; D303-D306 PolarHBondContact O-N 2.85Å
304	L	74.3	Confident	85.1	Confident	95 Å²	95	42.3 Å²	42.3	50%	0.497	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.5	176.5	-59	176.3	0	0	0	113.2	V299 D302 D306 F313	V299-L304 HydrophobicContact CG1-CD2 3.87Å; V299-L304 HydrophobicContact CG2-CD2 3.89Å; D302-L304 PolarHBondContact O-N 2.99Å; L304-D306 VanDerWaalsContact C-N 3.32Å; L304-F313 HydrophobicContact CB-CE2 4.38Å; L304-F313 HydrophobicContact CD2-CE2 3.74Å; L304-F313 HydrophobicContact CD2-CZ 3.85Å
305	T	83.4	Confident	85	Confident	111 Å²	111	44 Å²	44	68%	0.681	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-5.9	177.7	75.2	0	0	0	0	112.9	D303	D303-T305 PolarHBondContact O-N 3.39Å; D303-T305 WeakPolarHBondContact OD1-CA 3.26Å; D303-T305 WeakPolarHBondContact OD1-CB 3.39Å; D303-T305 PolarHBondContact OD1-N 3.4Å; D303-T305 PolarHBondContact OD1-OG1 3.11Å; D303-T305 PolarHBondContact OD2-OG1 3.37Å
306	D	87.4	Confident	84.9	Confident	17 Å²	17	44.2 Å²	44.2	9%	0.091	26%	0.263	C	S	.	.	S	Bend	trans	-55.9	136.1	170.7	-178.6	-80	0	0	0	110	Y268 D303 L304 S308 P309 A310	Y268-D306 VanDerWaalsContact CE2-OD1 3.27Å; Y268-D306 WeakPolarHBondContact CE2-OD1 3.45Å; Y268-D306 VanDerWaalsContact CZ-OD1 3.23Å; Y268-D306 PolarHBondContact OH-OD1 3.24Å; Y268-D306 PolarHBondContact OH-OD2 2.95Å; D303-D306 WeakPolarHBondContact O-CB 3.41Å; D303-D306 PolarHBondContact O-N 2.85Å; L304-D306 VanDerWaalsContact C-N 3.32Å; D306-S308 PolarHBondContact O-N 2.94Å; D306-S308 VanDerWaalsContact O-N 3.08Å; D306-S308 WeakPolarHBondContact OD1-CB 3.41Å; D306-S308 PolarHBondContact OD1-N 3.38Å; D306-P309 HydrophobicContact CB-CG 3.82Å; D306-P309 WeakPolarHBondContact O-CD 3.46Å; D306-P309 VanDerWaalsContact O-CG 3.32Å; D306-P309 WeakPolarHBondContact O-CG 3.4Å; D306-P309 WeakPolarHBondContact OD1-CD 3.33Å; D306-A310 WeakPolarHBondContact O-CB 3.08Å; D306-A310 PolarHBondContact O-N 3.22Å
307	P	88.8	Confident	84.8	Confident	28 Å²	28	46.3 Å²	46.3	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-54.1	-31.8	-175.9	-29.7	34.1	0	0	0	115.2	A265 V266 Y268 L272 T311	A265-P307 HydrophobicContact CB-CG 4.16Å; V266-P307 HydrophobicContact CB-CG 4.26Å; V266-P307 HydrophobicContact CG2-CG 3.84Å; Y268-P307 HydrophobicContact CD2-CB 3.68Å; Y268-P307 HydrophobicContact CD2-CG 3.81Å; Y268-P307 HydrophobicContact CE2-CB 3.98Å; Y268-P307 HydrophobicContact CE2-CG 4.04Å; Y268-P307 HydrophobicContact CG-CB 4.44Å; L272-P307 HydrophobicContact CD2-CB 4.27Å; P307-T311 VanDerWaalsContact O-CB 3.29Å; P307-T311 WeakPolarHBondContact O-CB 3.31Å; P307-T311 PolarHBondContact O-N 3.15Å; P307-T311 PolarHBondContact O-OG1 3.18Å
308	S	87.8	Confident	85	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.6	-59.7	-178.2	178.8	0	0	0	0	113	Y246 T249 Y268 D306 A310 T311 T312	Y246-S308 VanDerWaalsContact CD2-OG 3.24Å; Y246-S308 WeakPolarHBondContact CD2-OG 3.28Å; T249-S308 WeakPolarHBondContact CB-OG 3.32Å; T249-S308 VanDerWaalsContact CG2-OG 3.31Å; T249-S308 WeakPolarHBondContact CG2-OG 2.84Å; T249-S308 PolarHBondContact OG1-OG 3.44Å; Y268-S308 WeakPolarHBondContact OH-CB 3.47Å; D306-S308 PolarHBondContact O-N 2.94Å; D306-S308 VanDerWaalsContact O-N 3.08Å; D306-S308 WeakPolarHBondContact OD1-CB 3.41Å; D306-S308 PolarHBondContact OD1-N 3.38Å; S308-A310 VanDerWaalsContact C-N 3.34Å; S308-A310 PolarHBondContact O-N 2.95Å; S308-T311 PolarHBondContact O-N 2.93Å; S308-T312 PolarHBondContact O-N 3.15Å; S308-T312 VanDerWaalsContact O-N 3.14Å; S308-T312 PolarHBondContact O-OG1 3.01Å
309	P	86.5	Confident	85.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-41.4	173.7	24.6	-32.8	0	0	0	111.4	V297 D306 T311 T312 F313	V297-P309 HydrophobicContact CG1-CB 4.3Å; D306-P309 HydrophobicContact CB-CG 3.82Å; D306-P309 WeakPolarHBondContact O-CD 3.46Å; D306-P309 VanDerWaalsContact O-CG 3.32Å; D306-P309 WeakPolarHBondContact O-CG 3.4Å; D306-P309 WeakPolarHBondContact OD1-CD 3.33Å; P309-T311 VanDerWaalsContact C-N 3.32Å; P309-T311 PolarHBondContact O-N 3.17Å; P309-T312 CarbonylContact O-C 3.57Å; P309-T312 WeakPolarHBondContact O-CA 3.47Å; P309-T312 WeakPolarHBondContact O-CB 3.26Å; P309-T312 PolarHBondContact O-N 3.26Å; P309-F313 HydrophobicContact CB-CD2 4.29Å; P309-F313 HydrophobicContact CB-CE2 4.14Å; P309-F313 WeakPolarHBondContact O-CD2 3.49Å; P309-F313 PolarHBondContact O-N 3.47Å
310	A	88.3	Confident	85.9	Confident	44 Å²	44	42 Å²	42	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-57.9	-42.6	-179.2	0	0	0	0	0	112.8	D306 S308	D306-A310 WeakPolarHBondContact O-CB 3.08Å; D306-A310 PolarHBondContact O-N 3.22Å; S308-A310 VanDerWaalsContact C-N 3.34Å; S308-A310 PolarHBondContact O-N 2.95Å
311	T	89.8	Confident	86.5	Confident	31 Å²	31	42.5 Å²	42.5	19%	0.19	26%	0.261	C	S	.	.	H	α-helix	trans	-66.9	-40.9	175.5	-55.8	0	0	0	0	111.1	A273 M276 P307 S308 P309 A314 H315	A273-T311 HydrophobicContact CB-CG2 4.38Å; M276-T311 HydrophobicContact CB-CG2 4.03Å; M276-T311 HydrophobicContact CG-CG2 4.11Å; P307-T311 VanDerWaalsContact O-CB 3.29Å; P307-T311 WeakPolarHBondContact O-CB 3.31Å; P307-T311 PolarHBondContact O-N 3.15Å; P307-T311 PolarHBondContact O-OG1 3.18Å; S308-T311 PolarHBondContact O-N 2.93Å; P309-T311 VanDerWaalsContact C-N 3.32Å; P309-T311 PolarHBondContact O-N 3.17Å; T311-A314 WeakPolarHBondContact O-CB 3.16Å; T311-A314 PolarHBondContact O-N 3.36Å; T311-H315 PolarHBondContact O-CD2 3.48Å; T311-H315 VanDerWaalsContact O-CD2 3.31Å
312	T	88.2	Confident	87	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-43.8	178.2	-51.4	0	0	0	0	111	I245 V297 S308 P309 A314 H315 L316	I245-T312 HydrophobicContact CG2-CG2 3.98Å; V297-T312 HydrophobicContact CG2-CG2 4.23Å; S308-T312 PolarHBondContact O-N 3.15Å; S308-T312 VanDerWaalsContact O-N 3.14Å; S308-T312 PolarHBondContact O-OG1 3.01Å; P309-T312 CarbonylContact O-C 3.57Å; P309-T312 WeakPolarHBondContact O-CA 3.47Å; P309-T312 WeakPolarHBondContact O-CB 3.26Å; P309-T312 PolarHBondContact O-N 3.26Å; T312-A314 PolarHBondContact O-N 3.22Å; T312-H315 PolarHBondContact O-N 3.4Å; T312-L316 HydrophobicContact CG2-CD1 4.24Å; T312-L316 HydrophobicContact CG2-CD2 4.46Å; T312-L316 HydrophobicContact CG2-CG 4.32Å; T312-L316 WeakPolarHBondContact O-CG 3.23Å; T312-L316 PolarHBondContact O-N 3.06Å
313	F	87.3	Confident	87.7	Confident	57 Å²	57	32.9 Å²	32.9	25%	0.25	20%	0.198	C	C	.	.	H	α-helix	trans	-54.4	-35.6	178.7	-89	-69.4	0	0	0	113.4	F149 L304 P309 H315 L316 T319	F149-F313 HydrophobicContact CD1-CE2 4.35Å; F149-F313 AromaticContact CD1-CZ 3.91Å; F149-F313 HydrophobicContact CD1-CZ 3.91Å; F149-F313 HydrophobicContact CD2-CZ 4.45Å; F149-F313 HydrophobicContact CE1-CD2 4.27Å; F149-F313 AromaticContact CE1-CE1 3.86Å; F149-F313 HydrophobicContact CE1-CE1 3.86Å; F149-F313 AromaticContact CE1-CE2 3.44Å; F149-F313 HydrophobicContact CE1-CE2 3.44Å; F149-F313 VanDerWaalsContact CE1-CE2 3.44Å; F149-F313 AromaticContact CE1-CZ 3.2Å; F149-F313 HydrophobicContact CE1-CZ 3.2Å; F149-F313 HydrophobicContact CE2-CD1 4.42Å; F149-F313 AromaticContact CE2-CE1 3.69Å; F149-F313 HydrophobicContact CE2-CE1 3.69Å; F149-F313 AromaticContact CE2-CZ 3.85Å; F149-F313 HydrophobicContact CE2-CZ 3.85Å; F149-F313 HydrophobicContact CG-CZ 4.49Å; F149-F313 AromaticContact CZ-CD1 3.87Å; F149-F313 HydrophobicContact CZ-CD1 3.87Å; F149-F313 HydrophobicContact CZ-CD2 4.23Å; F149-F313 AromaticContact CZ-CE1 3.29Å; F149-F313 HydrophobicContact CZ-CE1 3.29Å; F149-F313 AromaticContact CZ-CE2 3.68Å; F149-F313 HydrophobicContact CZ-CE2 3.68Å; F149-F313 HydrophobicContact CZ-CG 4.3Å; F149-F313 AromaticContact CZ-CZ 3.17Å; F149-F313 HydrophobicContact CZ-CZ 3.17Å; L304-F313 HydrophobicContact CB-CE2 4.38Å; L304-F313 HydrophobicContact CD2-CE2 3.74Å; L304-F313 HydrophobicContact CD2-CZ 3.85Å; P309-F313 HydrophobicContact CB-CD2 4.29Å; P309-F313 HydrophobicContact CB-CE2 4.14Å; P309-F313 WeakPolarHBondContact O-CD2 3.49Å; P309-F313 PolarHBondContact O-N 3.47Å; F313-H315 PolarHBondContact O-N 3.47Å; F313-H315 VanDerWaalsContact O-N 3.15Å; F313-L316 HydrophobicContact CD1-CD1 4.49Å; F313-L316 PolarHBondContact O-N 3.06Å; F313-T319 HydrophobicContact CD1-CG2 3.8Å; F313-T319 HydrophobicContact CE1-CG2 3.53Å
314	A	88.3	Confident	88	Confident	72 Å²	72	37.8 Å²	37.8	60%	0.595	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.4	179.6	0	0	0	0	0	112.7	T311 T312	T311-A314 WeakPolarHBondContact O-CB 3.16Å; T311-A314 PolarHBondContact O-N 3.36Å; T312-A314 PolarHBondContact O-N 3.22Å
315	H	90.9	Very high	88.6	Confident	39 Å²	39	39.1 Å²	39.1	18%	0.181	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-14.2	-179.4	-59.5	-79.6	0	0	0	114	K145 Q280 E281 T311 T312 F313	K145-H315 HydrophobicContact CD-CB 4.41Å; K145-H315 WeakPolarHBondContact CD-O 3.4Å; Q280-H315 HydrophobicContact CB-CB 3.87Å; Q280-H315 HydrophobicContact CG-CB 3.86Å; E281-H315 IonicContact OE1-CE1 3.91Å; E281-H315 IonicContact OE1-ND1 3.25Å; E281-H315 PolarHBondContact OE1-ND1 2.8Å; T311-H315 PolarHBondContact O-CD2 3.48Å; T311-H315 VanDerWaalsContact O-CD2 3.31Å; T312-H315 PolarHBondContact O-N 3.4Å; F313-H315 PolarHBondContact O-N 3.47Å; F313-H315 VanDerWaalsContact O-N 3.15Å
316	L	91	Very high	88.9	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	19%	0.187	C	C	.	.			trans	-81.1	142.6	-176	-61.9	176.8	0	0	0	112	K145 F149 T312 F313 T319 R343	K145-L316 HydrophobicContact CB-CD2 4.03Å; F149-L316 HydrophobicContact CE2-CD1 3.71Å; F149-L316 HydrophobicContact CZ-CD1 3.62Å; T312-L316 HydrophobicContact CG2-CD1 4.24Å; T312-L316 HydrophobicContact CG2-CD2 4.46Å; T312-L316 HydrophobicContact CG2-CG 4.32Å; T312-L316 WeakPolarHBondContact O-CG 3.23Å; T312-L316 PolarHBondContact O-N 3.06Å; F313-L316 HydrophobicContact CD1-CD1 4.49Å; F313-L316 PolarHBondContact O-N 3.06Å; L316-T319 HydrophobicContact CD1-CG2 4.47Å; L316-R343 PolarHBondContact O-NH1 3.22Å; L316-R343 PolarHBondContact O-NH2 2.67Å
317	D	89.6	Confident	88.9	Confident	44 Å²	44	34.6 Å²	34.6	24%	0.235	19%	0.188	C	C	.	.	S	Bend	trans	-93.6	-30.6	174.3	-61.8	-58.1	0	0	0	113	G144 K145 R343	G144-D317 VanDerWaalsContact CA-OD2 3.31Å; G144-D317 WeakPolarHBondContact CA-OD2 3.45Å; K145-D317 PolarHBondContact N-OD2 2.99Å; K145-D317 PolarHBondContact O-N 2.96Å; D317-R343 PolarHBondContact O-N 3.45Å; D317-R343 IonicContact OD1-NH1 3.87Å; D317-R343 PolarHBondContact OD1-NH1 2.85Å
318	A	91	Very high	88.8	Confident	3 Å²	3	37.9 Å²	37.9	3%	0.025	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147	177.7	0	0	0	0	0	111	K145 V146 G147 T341	K145-A318 PolarHBondContact O-N 3.34Å; V146-A318 WeakPolarHBondContact CA-O 3.39Å; V146-A318 HydrophobicContact CG1-CB 4.38Å; V146-A318 HydrophobicContact CG2-CB 4.37Å; G147-A318 PolarHBondContact N-O 3.36Å; A318-T341 CarbonylContact C-O 3.55Å; A318-T341 WeakPolarHBondContact CA-O 3.43Å
319	T	90.9	Very high	88.7	Confident	16 Å²	16	42.8 Å²	42.8	10%	0.098	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.1	-177.3	64.1	0	0	0	0	107.8	F149 F313 L316 S340 T341	F149-T319 HydrophobicContact CE2-CG2 3.98Å; F313-T319 HydrophobicContact CD1-CG2 3.8Å; F313-T319 HydrophobicContact CE1-CG2 3.53Å; L316-T319 HydrophobicContact CD1-CG2 4.47Å; T319-S340 CarbonylContact O-C 3.53Å; T319-S340 WeakPolarHBondContact O-CA 3.43Å; T319-S340 WeakPolarHBondContact O-CB 3.5Å; T319-T341 PolarHBondContact N-O 2.69Å; T319-T341 PolarHBondContact O-N 3.26Å; T319-T341 PolarHBondContact OG1-N 3.22Å; T319-T341 PolarHBondContact OG1-OG1 3.41Å
320	V	92	Very high	88.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	112.3	177.2	-173.6	0	0	0	0	107.4	C138 F140 V146 G147 L148 F149 V335	C138-V320 HydrophobicContact CB-CG2 4.49Å; F140-V320 HydrophobicContact CE1-CG2 4.01Å; F140-V320 HydrophobicContact CZ-CG2 4.31Å; V146-V320 HydrophobicContact CG1-CG2 3.84Å; G147-V320 PolarHBondContact O-N 3Å; L148-V320 CarbonylContact C-O 2.95Å; L148-V320 HydrophobicContact CD2-CB 3.64Å; L148-V320 HydrophobicContact CD2-CG1 4.06Å; L148-V320 HydrophobicContact CD2-CG2 3.97Å; F149-V320 PolarHBondContact N-O 2.81Å; V320-V335 HydrophobicContact CG1-CB 4.32Å; V320-V335 HydrophobicContact CG1-CG1 3.66Å; V320-V335 HydrophobicContact CG1-CG2 3.7Å
321	V	90.2	Very high	88.7	Confident	34 Å²	34	42.3 Å²	42.3	21%	0.206	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.3	-178	-179.5	0	0	0	0	109	F149 V335 D336 D339 S340	F149-V321 HydrophobicContact CB-CG2 4.21Å; V321-V335 CarbonylContact O-C 3.6Å; V321-V335 WeakPolarHBondContact O-CA 3.47Å; V321-D336 HydrophobicContact CB-CB 4.46Å; V321-D336 PolarHBondContact O-N 3.41Å; V321-D339 HydrophobicContact CB-CB 3.96Å; V321-D339 HydrophobicContact CG1-CB 4.11Å; V321-D339 HydrophobicContact CG2-CB 3.97Å; V321-D339 WeakPolarHBondContact CG2-O 3.38Å; V321-S340 PolarHBondContact N-OG 2.93Å
322	L	89.2	Confident	88.7	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	110.5	174.4	-63.5	170.9	0	0	0	109.7	F149 V154 K156 A334 V335	F149-L322 WeakPolarHBondContact O-CB 3.49Å; F149-L322 PolarHBondContact O-N 2.72Å; V154-L322 HydrophobicContact CB-CB 3.93Å; V154-L322 HydrophobicContact CG2-CB 3.42Å; V154-L322 VanDerWaalsContact CG2-CB 3.42Å; V154-L322 HydrophobicContact CG2-CD1 3.96Å; V154-L322 HydrophobicContact CG2-CG 4.36Å; K156-L322 HydrophobicContact CB-CD1 4.22Å; K156-L322 HydrophobicContact CG-CD1 3.46Å; K156-L322 VanDerWaalsContact CG-CD1 3.46Å; L322-A334 CarbonylContact C-O 3.53Å; L322-A334 VanDerWaalsContact CA-O 3.25Å; L322-A334 WeakPolarHBondContact CA-O 3.43Å; L322-V335 HydrophobicContact CD2-CB 4.38Å; L322-V335 HydrophobicContact CD2-CG2 3.54Å
323	S	87	Confident	88.9	Confident	18 Å²	18	46.1 Å²	46.1	13%	0.126	25%	0.245	C	C	.	.			trans	-94.3	132.2	-172.7	176.7	0	0	0	0	112.2	Q325 I326 A327 A334	S323-Q325 PolarHBondContact O-N 3.32Å; S323-Q325 PolarHBondContact OG-N 3.41Å; S323-I326 PolarHBondContact O-N 3.42Å; S323-A327 PolarHBondContact O-N 3.48Å; S323-A327 VanDerWaalsContact O-N 3.13Å; S323-A334 PolarHBondContact N-O 3.24Å
324	R	86.5	Confident	89.1	Confident	175 Å²	175	43.4 Å²	43.4	66%	0.66	23%	0.233	S	C	*	.	H	α-helix	trans	-63	-32.4	171.9	-173	-178.4	-63.8	168	6.1	111.9	V154 I326 A327 S328	V154-R324 HydrophobicContact CG1-CB 4.41Å; R324-I326 VanDerWaalsContact C-N 3.33Å; R324-A327 PolarHBondContact O-N 3.43Å; R324-S328 WeakPolarHBondContact O-CB 3.47Å; R324-S328 PolarHBondContact O-N 3.01Å
325	Q	87.1	Confident	89.3	Confident	124 Å²	124	40.1 Å²	40.1	58%	0.579	21%	0.206	S	C	*	.	H	α-helix	trans	-63.8	-43.5	179.9	-59.7	-175.5	14.8	0	0	110.3	S323 S328 L329	S323-Q325 PolarHBondContact O-N 3.32Å; S323-Q325 PolarHBondContact OG-N 3.41Å; Q325-S328 PolarHBondContact O-N 2.76Å; Q325-S328 PolarHBondContact O-OG 3.49Å; Q325-L329 WeakPolarHBondContact O-CG 3.34Å; Q325-L329 PolarHBondContact O-N 2.93Å
326	I	89.2	Confident	89.4	Confident	21 Å²	21	39.3 Å²	39.3	11%	0.108	20%	0.203	C	C	.	.	H	α-helix	trans	-67.8	-43.5	178.1	-61.7	179.4	0	0	0	110.9	S323 R324 S328 L329 I331 A334 V335 D336	S323-I326 PolarHBondContact O-N 3.42Å; R324-I326 VanDerWaalsContact C-N 3.33Å; I326-S328 VanDerWaalsContact C-N 3.26Å; I326-S328 PolarHBondContact O-N 3.4Å; I326-L329 WeakPolarHBondContact O-CB 2.98Å; I326-L329 PolarHBondContact O-N 2.79Å; I326-L329 VanDerWaalsContact O-N 3.07Å; I326-I331 HydrophobicContact CG2-CB 3.67Å; I326-I331 HydrophobicContact CG2-CG2 3.72Å; I326-I331 PolarHBondContact O-N 2.85Å; I326-A334 HydrophobicContact CB-CB 4.45Å; I326-A334 HydrophobicContact CG2-CB 4.34Å; I326-V335 VanDerWaalsContact CD1-O 3.28Å; I326-V335 WeakPolarHBondContact CD1-O 3.33Å; I326-D336 VanDerWaalsContact CD1-CA 3.43Å; I326-D336 HydrophobicContact CD1-CB 3.86Å
327	A	87.2	Confident	89.4	Confident	12 Å²	12	39.6 Å²	39.6	10%	0.099	21%	0.205	C	C	.	.	H	α-helix	trans	-58.3	-38.2	174.2	0	0	0	0	0	112.3	S323 R324 L329 G330 Y332 A334	S323-A327 PolarHBondContact O-N 3.48Å; S323-A327 VanDerWaalsContact O-N 3.13Å; R324-A327 PolarHBondContact O-N 3.43Å; A327-L329 VanDerWaalsContact C-N 3.26Å; A327-L329 PolarHBondContact O-N 2.94Å; A327-G330 WeakPolarHBondContact O-CA 3.36Å; A327-G330 PolarHBondContact O-N 3.2Å; A327-Y332 HydrophobicContact CB-CE1 4.27Å; A327-Y332 PolarHBondContact O-OH 3.17Å; A327-A334 HydrophobicContact CB-CB 3.82Å
328	S	86.4	Confident	89.5	Confident	96 Å²	96	39.8 Å²	39.8	67%	0.671	21%	0.206	S	C	*	.	H	α-helix	trans	-68	-24.1	178.1	77	0	0	0	0	113.8	R324 Q325 I326 G330	R324-S328 WeakPolarHBondContact O-CB 3.47Å; R324-S328 PolarHBondContact O-N 3.01Å; Q325-S328 PolarHBondContact O-N 2.76Å; Q325-S328 PolarHBondContact O-OG 3.49Å; I326-S328 VanDerWaalsContact C-N 3.26Å; I326-S328 PolarHBondContact O-N 3.4Å; S328-G330 PolarHBondContact O-N 3.35Å
329	L	86.5	Confident	89.4	Confident	104 Å²	104	44.5 Å²	44.5	55%	0.545	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.6	171.3	-62.1	173.3	0	0	0	112.5	Q325 I326 A327 I331	Q325-L329 WeakPolarHBondContact O-CG 3.34Å; Q325-L329 PolarHBondContact O-N 2.93Å; I326-L329 WeakPolarHBondContact O-CB 2.98Å; I326-L329 PolarHBondContact O-N 2.79Å; I326-L329 VanDerWaalsContact O-N 3.07Å; A327-L329 VanDerWaalsContact C-N 3.26Å; A327-L329 PolarHBondContact O-N 2.94Å; L329-I331 VanDerWaalsContact C-N 3.28Å; L329-I331 HydrophobicContact CB-CD1 4.05Å; L329-I331 HydrophobicContact CB-CG1 4.19Å; L329-I331 HydrophobicContact CD1-CD1 4.3Å; L329-I331 PolarHBondContact O-N 3.22Å
330	G	86.1	Confident	89.4	Confident	21 Å²	21	43.8 Å²	43.8	22%	0.216	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	14.5	-175.9	0	0	0	0	0	113.8	A327 S328 Y332 Y445	A327-G330 WeakPolarHBondContact O-CA 3.36Å; A327-G330 PolarHBondContact O-N 3.2Å; S328-G330 PolarHBondContact O-N 3.35Å; G330-Y332 WeakPolarHBondContact O-CD2 3.3Å; G330-Y445 WeakPolarHBondContact O-CE2 3.47Å; G330-Y445 PolarHBondContact O-OH 3.26Å
331	I	88	Confident	89.4	Confident	13 Å²	13	47.5 Å²	47.5	7%	0.067	25%	0.249	C	C	.	.			trans	-87.9	119.1	-179.9	-63.4	169.3	0	0	0	108.6	I326 L329 Q398	I326-I331 HydrophobicContact CG2-CB 3.67Å; I326-I331 HydrophobicContact CG2-CG2 3.72Å; I326-I331 PolarHBondContact O-N 2.85Å; L329-I331 VanDerWaalsContact C-N 3.28Å; L329-I331 HydrophobicContact CB-CD1 4.05Å; L329-I331 HydrophobicContact CB-CG1 4.19Å; L329-I331 HydrophobicContact CD1-CD1 4.3Å; L329-I331 PolarHBondContact O-N 3.22Å; I331-Q398 HydrophobicContact CD1-CB 4.05Å
332	Y	89.3	Confident	89.4	Confident	106 Å²	106	46.6 Å²	46.6	42%	0.416	24%	0.244	S	C	.	.	S	Bend	trans	-126.9	134.2	178	-64.4	-78.9	0	0	0	110.7	A327 G330 S402 Q403	A327-Y332 HydrophobicContact CB-CE1 4.27Å; A327-Y332 PolarHBondContact O-OH 3.17Å; G330-Y332 WeakPolarHBondContact O-CD2 3.3Å; Y332-S402 CarbonylContact O-C 3.6Å; Y332-S402 WeakPolarHBondContact O-CA 3.47Å; Y332-S402 VanDerWaalsContact O-CB 3.3Å; Y332-S402 WeakPolarHBondContact O-CB 3.42Å; Y332-Q403 PolarHBondContact O-N 3.48Å
333	P	92.5	Very high	89.4	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.026	27%	0.269	C	S	.	.	S	Bend	cis	-68.5	147.6	-0	31.3	-37.3	0	0	0	112.5	I131 V133 N159 V335 F405	I131-P333 HydrophobicContact CG2-CG 4.08Å; V133-P333 HydrophobicContact CG1-CG 3.67Å; N159-P333 VanDerWaalsContact OD1-CB 3.22Å; N159-P333 WeakPolarHBondContact OD1-CB 3.32Å; P333-V335 HydrophobicContact CB-CG2 4.14Å; P333-V335 HydrophobicContact CG-CG2 4.36Å; P333-V335 PolarHBondContact O-N 3.49Å; P333-F405 HydrophobicContact CB-CE1 4.39Å; P333-F405 HydrophobicContact CB-CE2 3.97Å; P333-F405 HydrophobicContact CB-CZ 3.54Å; P333-F405 HydrophobicContact CG-CE1 4.03Å; P333-F405 HydrophobicContact CG-CE2 4.48Å; P333-F405 HydrophobicContact CG-CZ 3.59Å
334	A	91.3	Very high	89.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.268	C	S	.	.			trans	-79.9	36.7	-173.5	0	0	0	0	0	113.2	L322 S323 I326 A327	L322-A334 CarbonylContact C-O 3.53Å; L322-A334 VanDerWaalsContact CA-O 3.25Å; L322-A334 WeakPolarHBondContact CA-O 3.43Å; S323-A334 PolarHBondContact N-O 3.24Å; I326-A334 HydrophobicContact CB-CB 4.45Å; I326-A334 HydrophobicContact CG2-CB 4.34Å; A327-A334 HydrophobicContact CB-CB 3.82Å
335	V	93	Very high	89.7	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.024	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-76.9	129.6	-177.1	178.6	0	0	0	0	109.8	V133 V320 V321 L322 I326 P333 P337 S340	V133-V335 HydrophobicContact CB-CB 4.43Å; V133-V335 HydrophobicContact CG1-CB 3.79Å; V133-V335 HydrophobicContact CG1-CG1 4.27Å; V133-V335 HydrophobicContact CG1-CG2 3.83Å; V133-V335 HydrophobicContact CG2-CB 3.74Å; V133-V335 HydrophobicContact CG2-CG1 3.61Å; V320-V335 HydrophobicContact CG1-CB 4.32Å; V320-V335 HydrophobicContact CG1-CG1 3.66Å; V320-V335 HydrophobicContact CG1-CG2 3.7Å; V321-V335 CarbonylContact O-C 3.6Å; V321-V335 WeakPolarHBondContact O-CA 3.47Å; L322-V335 HydrophobicContact CD2-CB 4.38Å; L322-V335 HydrophobicContact CD2-CG2 3.54Å; I326-V335 VanDerWaalsContact CD1-O 3.28Å; I326-V335 WeakPolarHBondContact CD1-O 3.33Å; P333-V335 HydrophobicContact CB-CG2 4.14Å; P333-V335 HydrophobicContact CG-CG2 4.36Å; P333-V335 PolarHBondContact O-N 3.49Å; V335-P337 WeakPolarHBondContact O-CD 3.37Å; V335-S340 WeakPolarHBondContact CG1-OG 3.2Å
336	D	92.5	Very high	89.8	Confident	22 Å²	22	43.1 Å²	43.1	12%	0.118	23%	0.23	C	C	.	.			trans	-84	111.4	173.8	-161.3	-46.4	0	0	0	110.6	V321 I326 L338 D339 S340	V321-D336 HydrophobicContact CB-CB 4.46Å; V321-D336 PolarHBondContact O-N 3.41Å; I326-D336 VanDerWaalsContact CD1-CA 3.43Å; I326-D336 HydrophobicContact CD1-CB 3.86Å; D336-L338 PolarHBondContact O-N 2.95Å; D336-L338 WeakPolarHBondContact OD1-CB 3.06Å; D336-L338 PolarHBondContact OD1-N 3.33Å; D336-D339 HydrophobicContact CB-CB 4.18Å; D336-D339 PolarHBondContact OD1-N 2.87Å; D336-S340 WeakPolarHBondContact O-CB 3.49Å; D336-S340 PolarHBondContact O-N 3.47Å; D336-S340 PolarHBondContact O-OG 3.23Å
337	P	91.3	Very high	89.9	Confident	9 Å²	9	44.1 Å²	44.1	6%	0.058	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-15.4	-178.1	30.5	-35.8	0	0	0	113.7	M137 V335 Q362 L365 L401	M137-P337 HydrophobicContact CE-CB 3.62Å; M137-P337 WeakPolarHBondContact CE-O 3.4Å; M137-P337 HydrophobicContact CG-CB 4Å; M137-P337 HydrophobicContact SD-CB 4.28Å; V335-P337 WeakPolarHBondContact O-CD 3.37Å; P337-Q362 PolarHBondContact O-NE2 2.85Å; P337-L365 HydrophobicContact CB-CD1 3.97Å; P337-L365 HydrophobicContact CG-CD1 3.36Å; P337-L401 HydrophobicContact CB-CD1 4.36Å; P337-L401 HydrophobicContact CG-CD1 3.98Å
338	L	92	Very high	90.1	Very high	49 Å²	49	51 Å²	51	26%	0.257	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-39.8	179.2	-61.8	177.1	0	0	0	111.2	D336 Q362 L365 Q366	D336-L338 PolarHBondContact O-N 2.95Å; D336-L338 WeakPolarHBondContact OD1-CB 3.06Å; D336-L338 PolarHBondContact OD1-N 3.33Å; L338-Q362 HydrophobicContact CD2-CB 4.41Å; L338-L365 HydrophobicContact CD2-CB 4.15Å; L338-Q366 HydrophobicContact CD2-CB 4.26Å
339	D	89.4	Confident	90.2	Very high	102 Å²	102	48.3 Å²	48.3	55%	0.545	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-14.4	179.1	-68	-24.2	0	0	0	113.4	V321 D336	V321-D339 HydrophobicContact CB-CB 3.96Å; V321-D339 HydrophobicContact CG1-CB 4.11Å; V321-D339 HydrophobicContact CG2-CB 3.97Å; V321-D339 WeakPolarHBondContact CG2-O 3.38Å; D336-D339 HydrophobicContact CB-CB 4.18Å; D336-D339 PolarHBondContact OD1-N 2.87Å
340	S	91.5	Very high	90.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.			trans	-84.6	136.3	174.8	-57.8	0	0	0	0	111.6	T319 V321 V335 D336	T319-S340 CarbonylContact O-C 3.53Å; T319-S340 WeakPolarHBondContact O-CA 3.43Å; T319-S340 WeakPolarHBondContact O-CB 3.5Å; V321-S340 PolarHBondContact N-OG 2.93Å; V335-S340 WeakPolarHBondContact CG1-OG 3.2Å; D336-S340 WeakPolarHBondContact O-CB 3.49Å; D336-S340 PolarHBondContact O-N 3.47Å; D336-S340 PolarHBondContact O-OG 3.23Å
341	T	90.8	Very high	90.7	Very high	78 Å²	78	44.7 Å²	44.7	48%	0.479	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.6	-176.4	72.7	0	0	0	0	111.4	A318 T319	A318-T341 CarbonylContact C-O 3.55Å; A318-T341 WeakPolarHBondContact CA-O 3.43Å; T319-T341 PolarHBondContact N-O 2.69Å; T319-T341 PolarHBondContact O-N 3.26Å; T319-T341 PolarHBondContact OG1-N 3.22Å; T319-T341 PolarHBondContact OG1-OG1 3.41Å
342	S	91.6	Very high	91	Very high	16 Å²	16	49.1 Å²	49.1	11%	0.112	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	139.6	171.5	175.4	0	0	0	0	109.7	P139 Q344 L345	P139-S342 PolarHBondContact O-OG 2.9Å; S342-Q344 PolarHBondContact O-N 3.37Å; S342-Q344 WeakPolarHBondContact OG-CB 3.4Å; S342-Q344 PolarHBondContact OG-N 3.02Å; S342-Q344 VanDerWaalsContact OG-N 3.09Å; S342-L345 PolarHBondContact O-N 2.93Å
343	R	88.2	Confident	91.3	Very high	145 Å²	145	49.3 Å²	49.3	55%	0.547	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.1	170.3	-69.3	-175.5	-178.4	122.1	10.4	112.7	L316 D317 L345	L316-R343 PolarHBondContact O-NH1 3.22Å; L316-R343 PolarHBondContact O-NH2 2.67Å; D317-R343 PolarHBondContact O-N 3.45Å; D317-R343 IonicContact OD1-NH1 3.87Å; D317-R343 PolarHBondContact OD1-NH1 2.85Å; R343-L345 PolarHBondContact O-N 3.11Å
344	Q	89	Confident	91.4	Very high	22 Å²	22	49.3 Å²	49.3	10%	0.103	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.8	179.7	-53.8	-51.1	-44	0	0	112.7	L126 P139 A141 S342 D346 V349 V350	L126-Q344 HydrophobicContact CD2-CB 3.93Å; L126-Q344 HydrophobicContact CD2-CG 4.24Å; P139-Q344 HydrophobicContact CG-CB 4.09Å; A141-Q344 HydrophobicContact CB-CG 3.81Å; S342-Q344 PolarHBondContact O-N 3.37Å; S342-Q344 WeakPolarHBondContact OG-CB 3.4Å; S342-Q344 PolarHBondContact OG-N 3.02Å; S342-Q344 VanDerWaalsContact OG-N 3.09Å; Q344-D346 PolarHBondContact O-N 2.98Å; Q344-V349 HydrophobicContact CB-CG1 4.43Å; Q344-V350 WeakPolarHBondContact O-CG1 3.49Å
345	L	90.4	Very high	91.6	Very high	15 Å²	15	52 Å²	52	8%	0.079	27%	0.271	C	S	.	.			trans	-77.3	60.1	175.4	-164.6	70.4	0	0	0	111.2	S342 R343 V350 Y355 A358	S342-L345 PolarHBondContact O-N 2.93Å; R343-L345 PolarHBondContact O-N 3.11Å; L345-V350 HydrophobicContact CD1-CG2 4.36Å; L345-Y355 HydrophobicContact CG-CD2 4.29Å; L345-Y355 WeakPolarHBondContact O-CE2 3.38Å; L345-A358 HydrophobicContact CD1-CB 3.75Å; L345-A358 HydrophobicContact CD2-CB 4.18Å
346	D	90.6	Very high	91.8	Very high	66 Å²	66	55.7 Å²	55.7	35%	0.353	29%	0.29	S	S	.	.	S	Bend	trans	-120.6	132.6	175.6	-174.4	-51.1	0	0	0	108.3	Q344 L348 V349 V350	Q344-D346 PolarHBondContact O-N 2.98Å; D346-L348 PolarHBondContact O-N 2.93Å; D346-L348 VanDerWaalsContact OD1-CB 3.32Å; D346-L348 WeakPolarHBondContact OD1-CB 3.48Å; D346-L348 WeakPolarHBondContact OD1-CG 3.36Å; D346-L348 PolarHBondContact OD1-N 3.27Å; D346-V349 HydrophobicContact CB-CG2 4.15Å; D346-V349 PolarHBondContact O-N 3.38Å; D346-V350 WeakPolarHBondContact O-CG2 3.43Å; D346-V350 PolarHBondContact O-N 3.47Å
347	P	91.1	Very high	92	Very high	42 Å²	42	54.8 Å²	54.8	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-57.1	-23.2	-179.5	25.4	-36.5	0	0	0	114	V349 G351 Y355	P347-V349 VanDerWaalsContact C-N 3.32Å; P347-G351 CarbonylContact O-C 3.46Å; P347-G351 WeakPolarHBondContact O-CA 3.42Å; P347-G351 PolarHBondContact O-N 3.45Å; P347-Y355 HydrophobicContact CB-CD1 4.34Å; P347-Y355 HydrophobicContact CB-CG 4.08Å; P347-Y355 HydrophobicContact CG-CG 4.41Å
348	L	89.7	Confident	92.2	Very high	158 Å²	158	54.3 Å²	54.3	83%	0.827	28%	0.282	S	S	*	.	H	α-helix	trans	-75	-21.7	175.3	-61.6	177	0	0	0	113.1	D346	D346-L348 PolarHBondContact O-N 2.93Å; D346-L348 VanDerWaalsContact OD1-CB 3.32Å; D346-L348 WeakPolarHBondContact OD1-CB 3.48Å; D346-L348 WeakPolarHBondContact OD1-CG 3.36Å; D346-L348 PolarHBondContact OD1-N 3.27Å
349	V	89.1	Confident	92.3	Very high	38 Å²	38	57.2 Å²	57.2	23%	0.23	29%	0.29	C	S	.	.	H	α-helix	trans	-100.2	-58.6	-178.4	-178	0	0	0	0	110.8	L126 Q344 D346 P347	L126-V349 HydrophobicContact CD2-CG1 4.16Å; Q344-V349 HydrophobicContact CB-CG1 4.43Å; D346-V349 HydrophobicContact CB-CG2 4.15Å; D346-V349 PolarHBondContact O-N 3.38Å; P347-V349 VanDerWaalsContact C-N 3.32Å
350	V	90.9	Very high	92.6	Very high	21 Å²	21	53.4 Å²	53.4	13%	0.127	27%	0.274	C	S	.	.	H	α-helix	trans	-84	-13.3	-176.4	-70.1	0	0	0	0	113.4	L126 P139 Q344 L345 D346 H354	L126-V350 HydrophobicContact CD1-CB 4.49Å; L126-V350 HydrophobicContact CD1-CG1 3.74Å; L126-V350 HydrophobicContact CD2-CG1 4.43Å; P139-V350 HydrophobicContact CB-CG1 4.43Å; P139-V350 HydrophobicContact CG-CG1 3.83Å; Q344-V350 WeakPolarHBondContact O-CG1 3.49Å; L345-V350 HydrophobicContact CD1-CG2 4.36Å; D346-V350 WeakPolarHBondContact O-CG2 3.43Å; D346-V350 PolarHBondContact O-N 3.47Å; V350-H354 HydrophobicContact CB-CB 3.94Å; V350-H354 HydrophobicContact CG2-CB 4.11Å; V350-H354 WeakPolarHBondContact O-CB 3.24Å
351	G	92.5	Very high	92.8	Very high	29 Å²	29	53.4 Å²	53.4	30%	0.299	27%	0.274	S	S	.	.			trans	85.1	157.2	-171.9	0	0	0	0	0	113.1	P347 E353 H354 Y355	P347-G351 CarbonylContact O-C 3.46Å; P347-G351 WeakPolarHBondContact O-CA 3.42Å; P347-G351 PolarHBondContact O-N 3.45Å; G351-E353 PolarHBondContact O-N 2.93Å; G351-H354 PolarHBondContact O-N 2.83Å; G351-Y355 WeakPolarHBondContact O-CB 3.39Å; G351-Y355 PolarHBondContact O-N 3.13Å; G351-Y355 VanDerWaalsContact O-N 3.09Å
352	Q	94	Very high	93	Very high	106 Å²	106	51 Å²	51	50%	0.495	26%	0.258	S	S	.	.	H	α-helix	trans	-62.1	-40	-173.4	-168.9	62.2	40.6	0	0	112.9	Y355 D356	Q352-Y355 PolarHBondContact O-N 3.48Å; Q352-D356 WeakPolarHBondContact CG-OD2 3.43Å; Q352-D356 PolarHBondContact NE2-OD1 3.33Å; Q352-D356 PolarHBondContact NE2-OD2 3.36Å; Q352-D356 WeakPolarHBondContact O-CB 3.47Å; Q352-D356 VanDerWaalsContact O-CG 3.26Å; Q352-D356 PolarHBondContact O-N 2.96Å
353	E	95.2	Very high	93.2	Very high	109 Å²	109	54 Å²	54	51%	0.509	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-43.4	-177.3	-177.5	171.9	-148.5	0	0	112.2	G351 T357 I425 K429	G351-E353 PolarHBondContact O-N 2.93Å; E353-T357 VanDerWaalsContact O-CB 3.28Å; E353-T357 WeakPolarHBondContact O-CB 3.46Å; E353-T357 PolarHBondContact O-N 3.27Å; E353-T357 PolarHBondContact O-OG1 3.15Å; E353-I425 HydrophobicContact CG-CG2 3.91Å; E353-K429 IonicContact OE1-NZ 3.35Å; E353-K429 PolarHBondContact OE1-NZ 2.8Å
354	H	96	Very high	93.5	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.023	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-49.8	175.4	-172.2	162.8	0	0	0	109.7	D135 L136 V350 G351 D356 T357 A358 L421 I425	D135-H354 PolarHBondContact O-CE1 3.09Å; D135-H354 PolarHBondContact O-NE2 3.09Å; L136-H354 PolarHBondContact O-NE2 2.87Å; V350-H354 HydrophobicContact CB-CB 3.94Å; V350-H354 HydrophobicContact CG2-CB 4.11Å; V350-H354 WeakPolarHBondContact O-CB 3.24Å; G351-H354 PolarHBondContact O-N 2.83Å; H354-D356 PolarHBondContact O-N 3.16Å; H354-T357 PolarHBondContact O-N 2.94Å; H354-A358 WeakPolarHBondContact O-CB 3.35Å; H354-A358 PolarHBondContact O-N 2.72Å; H354-L421 VanDerWaalsContact CE1-CD1 3.47Å; H354-L421 WeakPolarHBondContact CE1-CD1 3.36Å; H354-I425 HydrophobicContact CB-CD1 3.7Å; H354-I425 HydrophobicContact CB-CG1 4.43Å
355	Y	95.6	Very high	93.8	Very high	57 Å²	57	47.6 Å²	47.6	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-56.8	-50.5	-179.8	-177.8	-96	0	0	0	112.5	L345 P347 G351 Q352 T357 A358 R359	L345-Y355 HydrophobicContact CG-CD2 4.29Å; L345-Y355 WeakPolarHBondContact O-CE2 3.38Å; P347-Y355 HydrophobicContact CB-CD1 4.34Å; P347-Y355 HydrophobicContact CB-CG 4.08Å; P347-Y355 HydrophobicContact CG-CG 4.41Å; G351-Y355 WeakPolarHBondContact O-CB 3.39Å; G351-Y355 PolarHBondContact O-N 3.13Å; G351-Y355 VanDerWaalsContact O-N 3.09Å; Q352-Y355 PolarHBondContact O-N 3.48Å; Y355-T357 VanDerWaalsContact C-N 3.3Å; Y355-T357 PolarHBondContact O-N 3.16Å; Y355-A358 PolarHBondContact O-N 3.12Å; Y355-R359 HydrophobicContact CD1-CG 4.11Å; Y355-R359 HydrophobicContact CD2-CG 4.37Å; Y355-R359 HydrophobicContact CE1-CG 3.7Å; Y355-R359 HydrophobicContact CE2-CG 3.99Å; Y355-R359 HydrophobicContact CG-CG 4.44Å; Y355-R359 WeakPolarHBondContact O-CB 3.47Å; Y355-R359 VanDerWaalsContact O-CG 3.32Å; Y355-R359 WeakPolarHBondContact O-CG 3.19Å; Y355-R359 PolarHBondContact O-N 3.22Å; Y355-R359 PolarHBondContact OH-NE 3.29Å
356	D	96.6	Very high	94	Very high	80 Å²	80	51.1 Å²	51.1	43%	0.428	27%	0.272	S	S	.	.	H	α-helix	trans	-64.7	-36.7	-180	-70.5	-22.1	0	0	0	111.7	Q352 H354 G360	Q352-D356 WeakPolarHBondContact CG-OD2 3.43Å; Q352-D356 PolarHBondContact NE2-OD1 3.33Å; Q352-D356 PolarHBondContact NE2-OD2 3.36Å; Q352-D356 WeakPolarHBondContact O-CB 3.47Å; Q352-D356 VanDerWaalsContact O-CG 3.26Å; Q352-D356 PolarHBondContact O-N 2.96Å; H354-D356 PolarHBondContact O-N 3.16Å; D356-G360 PolarHBondContact O-N 2.76Å
357	T	96.2	Very high	94.2	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.018	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-48.7	176.1	-57	0	0	0	0	111.2	L136 E353 H354 Y355 G360 V361 I425 F428 K429 M432	L136-T357 HydrophobicContact CD1-CG2 4.02Å; E353-T357 VanDerWaalsContact O-CB 3.28Å; E353-T357 WeakPolarHBondContact O-CB 3.46Å; E353-T357 PolarHBondContact O-N 3.27Å; E353-T357 PolarHBondContact O-OG1 3.15Å; H354-T357 PolarHBondContact O-N 2.94Å; Y355-T357 VanDerWaalsContact C-N 3.3Å; Y355-T357 PolarHBondContact O-N 3.16Å; T357-G360 PolarHBondContact O-N 3.05Å; T357-V361 WeakPolarHBondContact O-CB 3.27Å; T357-V361 WeakPolarHBondContact O-CG2 3.48Å; T357-V361 PolarHBondContact O-N 2.92Å; T357-I425 HydrophobicContact CG2-CG2 4.41Å; T357-F428 HydrophobicContact CG2-CB 3.73Å; T357-K429 HydrophobicContact CG2-CB 4.25Å; T357-M432 HydrophobicContact CG2-CE 4.1Å
358	A	95.1	Very high	94.3	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-45.7	178.4	0	0	0	0	0	111.8	L136 M137 L345 H354 Y355 V361 Q362	L136-A358 HydrophobicContact CD1-CB 4.16Å; L136-A358 HydrophobicContact CG-CB 4.2Å; M137-A358 HydrophobicContact SD-CB 4.5Å; L345-A358 HydrophobicContact CD1-CB 3.75Å; L345-A358 HydrophobicContact CD2-CB 4.18Å; H354-A358 WeakPolarHBondContact O-CB 3.35Å; H354-A358 PolarHBondContact O-N 2.72Å; Y355-A358 PolarHBondContact O-N 3.12Å; A358-V361 PolarHBondContact O-N 2.82Å; A358-Q362 WeakPolarHBondContact O-CG 3.36Å; A358-Q362 PolarHBondContact O-N 3.44Å
359	R	95.4	Very high	94.4	Very high	109 Å²	109	48.1 Å²	48.1	41%	0.411	24%	0.243	S	C	.	.	H	α-helix	trans	-65.7	-38.9	177.7	-69.9	-56.8	-171.5	-172.5	0.6	112.7	Y355 Q362 S363	Y355-R359 HydrophobicContact CD1-CG 4.11Å; Y355-R359 HydrophobicContact CD2-CG 4.37Å; Y355-R359 HydrophobicContact CE1-CG 3.7Å; Y355-R359 HydrophobicContact CE2-CG 3.99Å; Y355-R359 HydrophobicContact CG-CG 4.44Å; Y355-R359 WeakPolarHBondContact O-CB 3.47Å; Y355-R359 VanDerWaalsContact O-CG 3.32Å; Y355-R359 WeakPolarHBondContact O-CG 3.19Å; Y355-R359 PolarHBondContact O-N 3.22Å; Y355-R359 PolarHBondContact OH-NE 3.29Å; R359-Q362 PolarHBondContact O-N 2.83Å; R359-S363 WeakPolarHBondContact O-CB 3.28Å; R359-S363 PolarHBondContact O-N 3.26Å
360	G	95.4	Very high	94.5	Very high	22 Å²	22	50.8 Å²	50.8	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-62.8	-43.7	174.2	0	0	0	0	0	111.8	D356 T357 S363 I364 M432	D356-G360 PolarHBondContact O-N 2.76Å; T357-G360 PolarHBondContact O-N 3.05Å; G360-S363 PolarHBondContact O-N 2.97Å; G360-I364 WeakPolarHBondContact O-CG1 3.45Å; G360-I364 PolarHBondContact O-N 2.83Å; G360-M432 VanDerWaalsContact CA-SD 3.52Å
361	V	95.4	Very high	94.6	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-47.6	174.4	165.8	0	0	0	0	110.8	L136 M137 T357 A358 S363 I364 L365 I397 F428 M432	L136-V361 HydrophobicContact CD2-CG2 4.19Å; M137-V361 HydrophobicContact SD-CG1 4.11Å; T357-V361 WeakPolarHBondContact O-CB 3.27Å; T357-V361 WeakPolarHBondContact O-CG2 3.48Å; T357-V361 PolarHBondContact O-N 2.92Å; A358-V361 PolarHBondContact O-N 2.82Å; V361-S363 VanDerWaalsContact C-N 3.33Å; V361-S363 PolarHBondContact O-N 2.83Å; V361-I364 PolarHBondContact O-N 3.03Å; V361-L365 HydrophobicContact CG1-CD1 3.82Å; V361-L365 HydrophobicContact CG1-CG 4.41Å; V361-L365 WeakPolarHBondContact O-CB 3.16Å; V361-L365 VanDerWaalsContact O-CG 3.29Å; V361-L365 WeakPolarHBondContact O-CG 3.47Å; V361-L365 PolarHBondContact O-N 3.05Å; V361-I397 HydrophobicContact CG1-CG2 3.73Å; V361-I397 HydrophobicContact CG2-CD1 4.4Å; V361-F428 HydrophobicContact CG2-CB 3.95Å; V361-F428 HydrophobicContact CG2-CD1 3.72Å; V361-F428 HydrophobicContact CG2-CG 4.11Å; V361-M432 HydrophobicContact CG2-CG 4.15Å; V361-M432 HydrophobicContact CG2-SD 3.81Å; V361-M432 PolarHBondContact N-SD 2.85Å
362	Q	94.8	Very high	94.5	Very high	27 Å²	27	52.6 Å²	52.6	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-45.6	175.1	-74.1	-174.2	-38.3	0	0	111.8	M137 P337 L338 A358 R359 I364 L365 Q366	M137-Q362 HydrophobicContact CE-CG 3.15Å; P337-Q362 PolarHBondContact O-NE2 2.85Å; L338-Q362 HydrophobicContact CD2-CB 4.41Å; A358-Q362 WeakPolarHBondContact O-CG 3.36Å; A358-Q362 PolarHBondContact O-N 3.44Å; R359-Q362 PolarHBondContact O-N 2.83Å; Q362-I364 PolarHBondContact O-N 3.3Å; Q362-L365 PolarHBondContact O-N 2.66Å; Q362-Q366 WeakPolarHBondContact O-CB 3.12Å; Q362-Q366 PolarHBondContact O-N 3.5Å
363	S	95.3	Very high	94.3	Very high	79 Å²	79	52.8 Å²	52.8	55%	0.552	26%	0.255	S	S	*	.	H	α-helix	trans	-62.1	-41.9	-179.5	-170.8	0	0	0	0	112.2	R359 G360 V361 R367	R359-S363 WeakPolarHBondContact O-CB 3.28Å; R359-S363 PolarHBondContact O-N 3.26Å; G360-S363 PolarHBondContact O-N 2.97Å; V361-S363 VanDerWaalsContact C-N 3.33Å; V361-S363 PolarHBondContact O-N 2.83Å; S363-R367 VanDerWaalsContact O-CB 3.3Å; S363-R367 WeakPolarHBondContact O-CB 3.5Å; S363-R367 PolarHBondContact O-N 3.23Å
364	I	95.7	Very high	94	Very high	27 Å²	27	51 Å²	51	14%	0.138	25%	0.248	C	C	.	.	H	α-helix	trans	-66.1	-43.7	178	-69	167	0	0	0	110.5	G360 V361 Q362 R367 Y368 V390 R393 A394 I397 M432	G360-I364 WeakPolarHBondContact O-CG1 3.45Å; G360-I364 PolarHBondContact O-N 2.83Å; V361-I364 PolarHBondContact O-N 3.03Å; Q362-I364 PolarHBondContact O-N 3.3Å; I364-R367 PolarHBondContact O-N 3.07Å; I364-Y368 WeakPolarHBondContact O-CB 2.94Å; I364-Y368 PolarHBondContact O-N 2.96Å; I364-V390 HydrophobicContact CG2-CG1 4.33Å; I364-R393 HydrophobicContact CG2-CB 4.45Å; I364-A394 HydrophobicContact CG2-CB 3.77Å; I364-I397 HydrophobicContact CB-CD1 4.13Å; I364-I397 HydrophobicContact CD1-CD1 3.91Å; I364-I397 HydrophobicContact CG2-CD1 3.79Å; I364-M432 HydrophobicContact CD1-CB 4.1Å; I364-M432 HydrophobicContact CD1-CG 3.74Å; I364-M432 HydrophobicContact CD1-SD 4.33Å
365	L	95.1	Very high	93.7	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-67.9	-40.7	179.3	-69.4	177.1	0	0	0	112.5	P337 L338 V361 Q362 Y368 Q369 A394 I397 Q398 L401	P337-L365 HydrophobicContact CB-CD1 3.97Å; P337-L365 HydrophobicContact CG-CD1 3.36Å; L338-L365 HydrophobicContact CD2-CB 4.15Å; V361-L365 HydrophobicContact CG1-CD1 3.82Å; V361-L365 HydrophobicContact CG1-CG 4.41Å; V361-L365 WeakPolarHBondContact O-CB 3.16Å; V361-L365 VanDerWaalsContact O-CG 3.29Å; V361-L365 WeakPolarHBondContact O-CG 3.47Å; V361-L365 PolarHBondContact O-N 3.05Å; Q362-L365 PolarHBondContact O-N 2.66Å; L365-Y368 WeakPolarHBondContact O-CB 3.37Å; L365-Y368 PolarHBondContact O-N 2.8Å; L365-Q369 PolarHBondContact O-N 2.79Å; L365-A394 HydrophobicContact CD2-CB 4.38Å; L365-I397 HydrophobicContact CD1-CG2 3.98Å; L365-I397 HydrophobicContact CD2-CB 4.35Å; L365-I397 HydrophobicContact CD2-CG2 3.85Å; L365-I397 HydrophobicContact CG-CG2 4Å; L365-Q398 HydrophobicContact CD2-CG 3.62Å; L365-L401 HydrophobicContact CD1-CD1 4.16Å
366	Q	94.7	Very high	93.5	Very high	90 Å²	90	53.6 Å²	53.6	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-47	175	-176	64.4	30.8	0	0	110.6	L338 Q362 Y368 Q369 E370	L338-Q366 HydrophobicContact CD2-CB 4.26Å; Q362-Q366 WeakPolarHBondContact O-CB 3.12Å; Q362-Q366 PolarHBondContact O-N 3.5Å; Q366-Y368 VanDerWaalsContact C-N 3.3Å; Q366-Y368 PolarHBondContact O-N 3.29Å; Q366-Q369 WeakPolarHBondContact O-CB 3.27Å; Q366-Q369 PolarHBondContact O-N 3.14Å; Q366-Q369 VanDerWaalsContact O-N 3.09Å; Q366-E370 PolarHBondContact O-N 2.93Å; Q366-E370 VanDerWaalsContact O-N 3.1Å
367	R	93.7	Very high	93.3	Very high	100 Å²	100	56.5 Å²	56.5	38%	0.377	29%	0.292	S	S	.	.	H	α-helix	trans	-62.1	-40	177.1	-176.3	58.1	175.6	-175	-0.9	111.7	S363 I364 Q369 E370 L371 D387 V390	S363-R367 VanDerWaalsContact O-CB 3.3Å; S363-R367 WeakPolarHBondContact O-CB 3.5Å; S363-R367 PolarHBondContact O-N 3.23Å; I364-R367 PolarHBondContact O-N 3.07Å; R367-Q369 VanDerWaalsContact C-N 3.29Å; R367-Q369 PolarHBondContact O-N 3.42Å; R367-E370 WeakPolarHBondContact CD-OE2 3.46Å; R367-E370 IonicContact CZ-OE2 3.13Å; R367-E370 IonicContact NH1-OE2 2.96Å; R367-E370 PolarHBondContact NH1-OE2 2.91Å; R367-E370 PolarHBondContact O-N 3.24Å; R367-L371 HydrophobicContact CG-CD1 4.17Å; R367-L371 VanDerWaalsContact O-CG 3.28Å; R367-L371 WeakPolarHBondContact O-CG 3.29Å; R367-L371 PolarHBondContact O-N 2.91Å; R367-D387 IonicContact CZ-OD1 3.99Å; R367-D387 IonicContact NE-OD1 3.06Å; R367-D387 PolarHBondContact NE-OD1 3.15Å; R367-D387 IonicContact NH2-OD1 3.97Å; R367-D387 PolarHBondContact NH2-OD1 3.49Å; R367-D387 IonicContact NH2-OD2 3.61Å; R367-V390 HydrophobicContact CB-CG1 3.96Å; R367-V390 HydrophobicContact CG-CG1 3.7Å
368	Y	94.4	Very high	92.9	Very high	26 Å²	26	61.7 Å²	61.7	10%	0.102	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-39.2	173.7	172.9	-124.3	0	0	0	112.5	I364 L365 Q366 E370 L371 K372 V391 A394	I364-Y368 WeakPolarHBondContact O-CB 2.94Å; I364-Y368 PolarHBondContact O-N 2.96Å; L365-Y368 WeakPolarHBondContact O-CB 3.37Å; L365-Y368 PolarHBondContact O-N 2.8Å; Q366-Y368 VanDerWaalsContact C-N 3.3Å; Q366-Y368 PolarHBondContact O-N 3.29Å; Y368-E370 PolarHBondContact O-N 2.98Å; Y368-L371 PolarHBondContact O-N 2.91Å; Y368-K372 PolarHBondContact O-N 3.04Å; Y368-V391 HydrophobicContact CD2-CB 4.3Å; Y368-V391 HydrophobicContact CD2-CG1 4.09Å; Y368-V391 HydrophobicContact CD2-CG2 4.03Å; Y368-V391 HydrophobicContact CE2-CG1 3.89Å; Y368-V391 HydrophobicContact CE2-CG2 4.48Å; Y368-A394 HydrophobicContact CD1-CB 3.92Å; Y368-A394 HydrophobicContact CD2-CB 4.22Å; Y368-A394 HydrophobicContact CG-CB 3.55Å
369	Q	91.3	Very high	92.7	Very high	77 Å²	77	63 Å²	63	36%	0.36	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-40.3	177	-170.2	66.5	3.3	0	0	111.9	L365 Q366 R367 K372	L365-Q369 PolarHBondContact O-N 2.79Å; Q366-Q369 WeakPolarHBondContact O-CB 3.27Å; Q366-Q369 PolarHBondContact O-N 3.14Å; Q366-Q369 VanDerWaalsContact O-N 3.09Å; R367-Q369 VanDerWaalsContact C-N 3.29Å; R367-Q369 PolarHBondContact O-N 3.42Å; Q369-K372 WeakPolarHBondContact O-CB 3.47Å; Q369-K372 PolarHBondContact O-N 2.8Å
370	E	91.4	Very high	92.3	Very high	94 Å²	94	62 Å²	62	44%	0.439	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-42.2	173.4	-65.5	171.2	-177.5	0	0	112.3	Q366 R367 Y368 K372	Q366-E370 PolarHBondContact O-N 2.93Å; Q366-E370 VanDerWaalsContact O-N 3.1Å; R367-E370 WeakPolarHBondContact CD-OE2 3.46Å; R367-E370 IonicContact CZ-OE2 3.13Å; R367-E370 IonicContact NH1-OE2 2.96Å; R367-E370 PolarHBondContact NH1-OE2 2.91Å; R367-E370 PolarHBondContact O-N 3.24Å; Y368-E370 PolarHBondContact O-N 2.98Å; E370-K372 VanDerWaalsContact C-N 3.28Å; E370-K372 PolarHBondContact O-N 3.49Å
371	L	93.3	Very high	92.1	Very high	3 Å²	3	67.4 Å²	67.4	2%	0.016	36%	0.357	C	S	.	.	H	α-helix	trans	-72.6	-21.7	-179.6	-66.3	174.3	0	0	0	112.6	R367 Y368 D373 I374 I375 L383 D387 V391	R367-L371 HydrophobicContact CG-CD1 4.17Å; R367-L371 VanDerWaalsContact O-CG 3.28Å; R367-L371 WeakPolarHBondContact O-CG 3.29Å; R367-L371 PolarHBondContact O-N 2.91Å; Y368-L371 PolarHBondContact O-N 2.91Å; L371-D373 VanDerWaalsContact C-N 3.32Å; L371-D373 PolarHBondContact O-N 3.16Å; L371-I374 HydrophobicContact CD2-CD1 4.18Å; L371-I374 WeakPolarHBondContact O-CB 3.47Å; L371-I374 PolarHBondContact O-N 3.38Å; L371-I374 VanDerWaalsContact O-N 3.16Å; L371-I375 HydrophobicContact CB-CD1 4.32Å; L371-I375 WeakPolarHBondContact O-CD1 3.27Å; L371-I375 WeakPolarHBondContact O-CG1 3.32Å; L371-I375 PolarHBondContact O-N 2.67Å; L371-L383 HydrophobicContact CD2-CD2 3.93Å; L371-D387 HydrophobicContact CD1-CB 3.73Å; L371-D387 HydrophobicContact CD2-CB 4.13Å; L371-V391 HydrophobicContact CB-CG2 4.28Å; L371-V391 HydrophobicContact CD1-CG2 3.79Å
372	K	90.3	Very high	91.8	Very high	84 Å²	84	74.1 Å²	74.1	37%	0.365	39%	0.388	S	S	.	.	H	α-helix	trans	-59.6	-41.6	-177.5	-168.4	-179.1	179.5	-176.8	0	112.3	Y368 Q369 E370 I375 A376	Y368-K372 PolarHBondContact O-N 3.04Å; Q369-K372 WeakPolarHBondContact O-CB 3.47Å; Q369-K372 PolarHBondContact O-N 2.8Å; E370-K372 VanDerWaalsContact C-N 3.28Å; E370-K372 PolarHBondContact O-N 3.49Å; K372-I375 PolarHBondContact O-N 3.49Å; K372-A376 WeakPolarHBondContact O-CB 3.33Å; K372-A376 PolarHBondContact O-N 3.38Å
373	D	89	Confident	91.5	Very high	111 Å²	111	73.5 Å²	73.5	59%	0.594	39%	0.386	S	S	*	.	H	α-helix	trans	-67.6	-38.4	178	-69.4	-19.1	0	0	0	111.2	L371 A376 I377	L371-D373 VanDerWaalsContact C-N 3.32Å; L371-D373 PolarHBondContact O-N 3.16Å; D373-A376 PolarHBondContact O-N 2.7Å; D373-I377 WeakPolarHBondContact O-CG1 3.44Å; D373-I377 PolarHBondContact O-N 3.09Å
374	I	89.6	Confident	91.4	Very high	71 Å²	71	72.2 Å²	72.2	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-64.1	-47.9	175	-57.8	-179.7	0	0	0	110.4	L371 A376 I377 L378 L383	L371-I374 HydrophobicContact CD2-CD1 4.18Å; L371-I374 WeakPolarHBondContact O-CB 3.47Å; L371-I374 PolarHBondContact O-N 3.38Å; L371-I374 VanDerWaalsContact O-N 3.16Å; I374-A376 VanDerWaalsContact C-N 3.27Å; I374-A376 PolarHBondContact O-N 2.86Å; I374-I377 PolarHBondContact O-N 3.27Å; I374-I377 VanDerWaalsContact O-N 3.15Å; I374-L378 HydrophobicContact CG2-CD1 4.04Å; I374-L378 PolarHBondContact O-N 2.89Å; I374-L383 HydrophobicContact CG2-CD2 4.03Å
375	I	90.4	Very high	91.2	Very high	32 Å²	32	77.6 Å²	77.6	16%	0.164	40%	0.401	C	S	.	.	H	α-helix	trans	-60.3	-39.4	178.5	-66.6	161.9	0	0	0	110.8	L371 K372 I377 G379 L383 V391	L371-I375 HydrophobicContact CB-CD1 4.32Å; L371-I375 WeakPolarHBondContact O-CD1 3.27Å; L371-I375 WeakPolarHBondContact O-CG1 3.32Å; L371-I375 PolarHBondContact O-N 2.67Å; K372-I375 PolarHBondContact O-N 3.49Å; I375-I377 VanDerWaalsContact C-N 3.29Å; I375-I377 PolarHBondContact O-N 3.48Å; I375-G379 VanDerWaalsContact O-CA 3.23Å; I375-G379 WeakPolarHBondContact O-CA 3.2Å; I375-G379 PolarHBondContact O-N 3.16Å; I375-L383 HydrophobicContact CD1-CD1 3.89Å; I375-L383 HydrophobicContact CG1-CD1 3.64Å; I375-L383 HydrophobicContact CG1-CG 4.34Å; I375-V391 HydrophobicContact CD1-CG1 4.17Å; I375-V391 HydrophobicContact CD1-CG2 3.76Å
376	A	90.1	Very high	91	Very high	85 Å²	85	84.7 Å²	84.7	70%	0.702	44%	0.435	S	S	*	.	H	α-helix	trans	-66.7	-29.8	179.4	0	0	0	0	0	113.1	K372 D373 I374	K372-A376 WeakPolarHBondContact O-CB 3.33Å; K372-A376 PolarHBondContact O-N 3.38Å; D373-A376 PolarHBondContact O-N 2.7Å; I374-A376 VanDerWaalsContact C-N 3.27Å; I374-A376 PolarHBondContact O-N 2.86Å
377	I	92.3	Very high	90.9	Very high	141 Å²	141	81.8 Å²	81.8	72%	0.723	42%	0.422	S	S	*	.	H	α-helix	trans	-93.8	-51.8	-177.4	-63.8	169.1	0	0	0	112.1	D373 I374 I375	D373-I377 WeakPolarHBondContact O-CG1 3.44Å; D373-I377 PolarHBondContact O-N 3.09Å; I374-I377 PolarHBondContact O-N 3.27Å; I374-I377 VanDerWaalsContact O-N 3.15Å; I375-I377 VanDerWaalsContact C-N 3.29Å; I375-I377 PolarHBondContact O-N 3.48Å
378	L	88.9	Confident	90.8	Very high	112 Å²	112	79.7 Å²	79.7	59%	0.586	42%	0.416	S	S	*	.	H	α-helix	trans	-98.7	-21.1	-171	-63.5	-179.2	0	0	0	113.2	I374 E382	I374-L378 HydrophobicContact CG2-CD1 4.04Å; I374-L378 PolarHBondContact O-N 2.89Å; L378-E382 HydrophobicContact CB-CB 4.07Å; L378-E382 HydrophobicContact CB-CG 4.06Å
379	G	89.3	Confident	90.7	Very high	27 Å²	27	82 Å²	82	28%	0.278	43%	0.429	S	S	.	.			trans	90.9	171.3	-172.4	0	0	0	0	0	113.3	I375	I375-G379 VanDerWaalsContact O-CA 3.23Å; I375-G379 WeakPolarHBondContact O-CA 3.2Å; I375-G379 PolarHBondContact O-N 3.16Å
380	M	87.9	Confident	90.8	Very high	89 Å²	89	80.1 Å²	80.1	44%	0.438	42%	0.423	S	S	.	.	S	Bend	trans	-77	-23.1	-174.4	-163.2	171	78.2	0	0	113.1	E382 L383 K388	M380-E382 VanDerWaalsContact C-N 3.31Å; M380-E382 PolarHBondContact O-N 3Å; M380-L383 PolarHBondContact O-N 3.31Å; M380-K388 WeakPolarHBondContact O-CE 3.34Å
381	D	90.7	Very high	90.9	Very high	134 Å²	134	75.8 Å²	75.8	72%	0.717	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-25.8	-175.3	-63.8	-45	0	0	0	112.9	L383	D381-L383 VanDerWaalsContact C-N 3.26Å; D381-L383 PolarHBondContact O-N 3.15Å
382	E	88.8	Confident	90.9	Very high	141 Å²	141	77.2 Å²	77.2	66%	0.659	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.3	179.4	-64	-60.2	147.7	0	0	113.5	L378 M380	L378-E382 HydrophobicContact CB-CB 4.07Å; L378-E382 HydrophobicContact CB-CG 4.06Å; M380-E382 VanDerWaalsContact C-N 3.31Å; M380-E382 PolarHBondContact O-N 3Å
383	L	89.6	Confident	91.1	Very high	14 Å²	14	75.5 Å²	75.5	7%	0.073	41%	0.406	C	S	.	.	S	Bend	trans	-76.3	148.4	175.2	-67.4	-177.4	0	0	0	111.4	L371 I374 I375 M380 D381 D387 K388 V391	L371-L383 HydrophobicContact CD2-CD2 3.93Å; I374-L383 HydrophobicContact CG2-CD2 4.03Å; I375-L383 HydrophobicContact CD1-CD1 3.89Å; I375-L383 HydrophobicContact CG1-CD1 3.64Å; I375-L383 HydrophobicContact CG1-CG 4.34Å; M380-L383 PolarHBondContact O-N 3.31Å; D381-L383 VanDerWaalsContact C-N 3.26Å; D381-L383 PolarHBondContact O-N 3.15Å; L383-D387 HydrophobicContact CB-CB 4.12Å; L383-D387 HydrophobicContact CD1-CB 4.46Å; L383-D387 HydrophobicContact CD2-CB 4.27Å; L383-K388 HydrophobicContact CB-CG 3.82Å; L383-K388 VanDerWaalsContact O-CE 3.24Å; L383-K388 WeakPolarHBondContact O-CE 3.45Å; L383-V391 HydrophobicContact CD1-CG2 3.96Å
384	S	92.5	Very high	91.3	Very high	53 Å²	53	70.2 Å²	70.2	37%	0.371	38%	0.378	S	S	.	.			trans	-60.9	155.4	166.9	72.6	0	0	0	0	110.5	E386 D387 K388	S384-E386 PolarHBondContact O-N 3.06Å; S384-D387 PolarHBondContact O-N 2.89Å; S384-D387 VanDerWaalsContact O-N 3.13Å; S384-D387 WeakPolarHBondContact OG-CB 3.22Å; S384-D387 PolarHBondContact OG-N 2.84Å; S384-D387 PolarHBondContact OG-OD2 3.48Å; S384-K388 WeakPolarHBondContact O-CG 3.38Å; S384-K388 PolarHBondContact O-N 2.75Å
385	E	91.4	Very high	91.5	Very high	139 Å²	139	70.1 Å²	70.1	65%	0.65	37%	0.373	S	S	*	.	H	α-helix	trans	-60.4	-31.1	176.7	-65.5	-58.3	122.2	0	0	112	K388 L389	E385-K388 IonicContact OE1-NZ 3.11Å; E385-K388 PolarHBondContact OE1-NZ 3.31Å; E385-L389 WeakPolarHBondContact O-CB 3.3Å; E385-L389 PolarHBondContact O-N 3.36Å
386	E	90.9	Very high	91.7	Very high	156 Å²	156	69 Å²	69	73%	0.729	37%	0.367	S	S	*	.	H	α-helix	trans	-66.1	-47.1	173.2	-65.9	-179	-179.5	0	0	111.6	S384 K388 L389 V390	S384-E386 PolarHBondContact O-N 3.06Å; E386-K388 PolarHBondContact O-N 3.46Å; E386-L389 WeakPolarHBondContact O-CB 3.28Å; E386-L389 PolarHBondContact O-N 3.4Å; E386-V390 WeakPolarHBondContact O-CG2 3.38Å; E386-V390 PolarHBondContact O-N 2.96Å
387	D	92.8	Very high	92	Very high	29 Å²	29	65 Å²	65	16%	0.155	33%	0.334	C	S	.	.	H	α-helix	trans	-66.5	-37	177.6	-69.9	-50.9	0	0	0	111.4	R367 L371 L383 S384 L389 V390 V391	R367-D387 IonicContact CZ-OD1 3.99Å; R367-D387 IonicContact NE-OD1 3.06Å; R367-D387 PolarHBondContact NE-OD1 3.15Å; R367-D387 IonicContact NH2-OD1 3.97Å; R367-D387 PolarHBondContact NH2-OD1 3.49Å; R367-D387 IonicContact NH2-OD2 3.61Å; L371-D387 HydrophobicContact CD1-CB 3.73Å; L371-D387 HydrophobicContact CD2-CB 4.13Å; L383-D387 HydrophobicContact CB-CB 4.12Å; L383-D387 HydrophobicContact CD1-CB 4.46Å; L383-D387 HydrophobicContact CD2-CB 4.27Å; S384-D387 PolarHBondContact O-N 2.89Å; S384-D387 VanDerWaalsContact O-N 3.13Å; S384-D387 WeakPolarHBondContact OG-CB 3.22Å; S384-D387 PolarHBondContact OG-N 2.84Å; S384-D387 PolarHBondContact OG-OD2 3.48Å; D387-L389 VanDerWaalsContact C-N 3.29Å; D387-L389 PolarHBondContact O-N 3.24Å; D387-V390 PolarHBondContact O-N 2.76Å; D387-V391 WeakPolarHBondContact O-CG2 3.37Å; D387-V391 PolarHBondContact O-N 3.43Å
388	K	92.1	Very high	92.1	Very high	56 Å²	56	60.4 Å²	60.4	24%	0.243	31%	0.309	C	S	.	.	H	α-helix	trans	-59	-42.3	172.3	-73	177.7	-172.2	163.9	0	111.3	M380 L383 S384 E385 E386 V391 A392	M380-K388 WeakPolarHBondContact O-CE 3.34Å; L383-K388 HydrophobicContact CB-CG 3.82Å; L383-K388 VanDerWaalsContact O-CE 3.24Å; L383-K388 WeakPolarHBondContact O-CE 3.45Å; S384-K388 WeakPolarHBondContact O-CG 3.38Å; S384-K388 PolarHBondContact O-N 2.75Å; E385-K388 IonicContact OE1-NZ 3.11Å; E385-K388 PolarHBondContact OE1-NZ 3.31Å; E386-K388 PolarHBondContact O-N 3.46Å; K388-V391 PolarHBondContact O-N 2.9Å; K388-A392 WeakPolarHBondContact O-CB 3.48Å; K388-A392 PolarHBondContact O-N 3.48Å
389	L	92.4	Very high	92.3	Very high	73 Å²	73	58.7 Å²	58.7	38%	0.382	30%	0.295	S	S	.	.	H	α-helix	trans	-65.1	-43.8	176.6	-173.9	65.5	0	0	0	111.6	E385 E386 D387 V391 A392 R393	E385-L389 WeakPolarHBondContact O-CB 3.3Å; E385-L389 PolarHBondContact O-N 3.36Å; E386-L389 WeakPolarHBondContact O-CB 3.28Å; E386-L389 PolarHBondContact O-N 3.4Å; D387-L389 VanDerWaalsContact C-N 3.29Å; D387-L389 PolarHBondContact O-N 3.24Å; L389-V391 VanDerWaalsContact C-N 3.34Å; L389-V391 PolarHBondContact O-N 2.98Å; L389-A392 PolarHBondContact O-N 3.34Å; L389-R393 WeakPolarHBondContact O-CG 3.17Å; L389-R393 PolarHBondContact O-N 3.07Å
390	V	93.1	Very high	92.6	Very high	38 Å²	38	57.5 Å²	57.5	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-59.3	-45.2	175.5	172.8	0	0	0	0	110.9	I364 R367 E386 D387 A392 R393 A394	I364-V390 HydrophobicContact CG2-CG1 4.33Å; R367-V390 HydrophobicContact CB-CG1 3.96Å; R367-V390 HydrophobicContact CG-CG1 3.7Å; E386-V390 WeakPolarHBondContact O-CG2 3.38Å; E386-V390 PolarHBondContact O-N 2.96Å; D387-V390 PolarHBondContact O-N 2.76Å; V390-A392 PolarHBondContact O-N 3.11Å; V390-R393 PolarHBondContact O-N 3.22Å; V390-A394 VanDerWaalsContact O-CB 3.22Å; V390-A394 WeakPolarHBondContact O-CB 3.44Å; V390-A394 PolarHBondContact O-N 3.17Å
391	V	93.5	Very high	92.9	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-45.3	176.6	171.6	0	0	0	0	111.1	Y368 L371 I375 L383 D387 K388 L389 A394 R395	Y368-V391 HydrophobicContact CD2-CB 4.3Å; Y368-V391 HydrophobicContact CD2-CG1 4.09Å; Y368-V391 HydrophobicContact CD2-CG2 4.03Å; Y368-V391 HydrophobicContact CE2-CG1 3.89Å; Y368-V391 HydrophobicContact CE2-CG2 4.48Å; L371-V391 HydrophobicContact CB-CG2 4.28Å; L371-V391 HydrophobicContact CD1-CG2 3.79Å; I375-V391 HydrophobicContact CD1-CG1 4.17Å; I375-V391 HydrophobicContact CD1-CG2 3.76Å; L383-V391 HydrophobicContact CD1-CG2 3.96Å; D387-V391 WeakPolarHBondContact O-CG2 3.37Å; D387-V391 PolarHBondContact O-N 3.43Å; K388-V391 PolarHBondContact O-N 2.9Å; L389-V391 VanDerWaalsContact C-N 3.34Å; L389-V391 PolarHBondContact O-N 2.98Å; V391-A394 PolarHBondContact O-N 3.06Å; V391-R395 WeakPolarHBondContact O-CG 3.22Å; V391-R395 PolarHBondContact O-N 2.75Å
392	A	92.4	Very high	93	Very high	33 Å²	33	47.3 Å²	47.3	27%	0.273	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-45	178.9	0	0	0	0	0	111.9	K388 L389 V390 K396	K388-A392 WeakPolarHBondContact O-CB 3.48Å; K388-A392 PolarHBondContact O-N 3.48Å; L389-A392 PolarHBondContact O-N 3.34Å; V390-A392 PolarHBondContact O-N 3.11Å; A392-K396 WeakPolarHBondContact O-CG 3.49Å; A392-K396 PolarHBondContact O-N 2.99Å
393	R	94.9	Very high	93.2	Very high	49 Å²	49	40.7 Å²	40.7	19%	0.185	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-42.4	176	-71.5	-176.2	-177.5	170.4	7.2	111.8	I364 L389 V390 R395 K396 I397 M432 G434 D437	I364-R393 HydrophobicContact CG2-CB 4.45Å; L389-R393 WeakPolarHBondContact O-CG 3.17Å; L389-R393 PolarHBondContact O-N 3.07Å; V390-R393 PolarHBondContact O-N 3.22Å; R393-R395 PolarHBondContact O-N 3.33Å; R393-K396 WeakPolarHBondContact O-CB 3.13Å; R393-K396 PolarHBondContact O-N 2.91Å; R393-K396 VanDerWaalsContact O-N 3.16Å; R393-I397 WeakPolarHBondContact O-CG1 3.45Å; R393-I397 PolarHBondContact O-N 2.97Å; R393-M432 PolarHBondContact NH1-O 2.84Å; R393-G434 VanDerWaalsContact NH2-CA 3.26Å; R393-D437 WeakPolarHBondContact CG-OD1 3.42Å; R393-D437 IonicContact CZ-OD1 2.79Å; R393-D437 IonicContact CZ-OD2 3.91Å; R393-D437 IonicContact NE-OD1 2.69Å; R393-D437 PolarHBondContact NE-OD1 3.37Å; R393-D437 IonicContact NE-OD2 3Å; R393-D437 PolarHBondContact NE-OD2 3.42Å; R393-D437 VanDerWaalsContact NE-OD2 3.13Å; R393-D437 IonicContact NH2-OD1 3.32Å; R393-D437 IonicContact NH2-OD2 3.98Å; R393-D437 PolarHBondContact NH2-OD2 2.73Å
394	A	94.5	Very high	93.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-43.4	177.7	0	0	0	0	0	112.3	I364 L365 Y368 V390 V391 K396 I397 Q398	I364-A394 HydrophobicContact CG2-CB 3.77Å; L365-A394 HydrophobicContact CD2-CB 4.38Å; Y368-A394 HydrophobicContact CD1-CB 3.92Å; Y368-A394 HydrophobicContact CD2-CB 4.22Å; Y368-A394 HydrophobicContact CG-CB 3.55Å; V390-A394 VanDerWaalsContact O-CB 3.22Å; V390-A394 WeakPolarHBondContact O-CB 3.44Å; V390-A394 PolarHBondContact O-N 3.17Å; V391-A394 PolarHBondContact O-N 3.06Å; A394-K396 VanDerWaalsContact C-N 3.32Å; A394-K396 PolarHBondContact O-N 3.3Å; A394-I397 PolarHBondContact O-N 2.91Å; A394-Q398 WeakPolarHBondContact O-CB 3.09Å; A394-Q398 WeakPolarHBondContact O-CG 3.39Å; A394-Q398 PolarHBondContact O-N 2.87Å
395	R	93.7	Very high	93.2	Very high	69 Å²	69	38 Å²	38	26%	0.26	18%	0.18	S	C	.	.	H	α-helix	trans	-62.6	-38.2	175.1	-73.3	177.2	177.3	176.8	3.2	112.5	V391 R393 R399 E441	V391-R395 WeakPolarHBondContact O-CG 3.22Å; V391-R395 PolarHBondContact O-N 2.75Å; R393-R395 PolarHBondContact O-N 3.33Å; R395-R399 WeakPolarHBondContact O-CG 3.33Å; R395-R399 PolarHBondContact O-N 2.91Å; R395-R399 VanDerWaalsContact O-N 3.11Å; R395-E441 HydrophobicContact CB-CG 4.34Å; R395-E441 WeakPolarHBondContact CD-OE1 3.43Å; R395-E441 IonicContact NH1-OE1 3.42Å
396	K	95	Very high	92.9	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.035	16%	0.16	C	C	.	.	H	α-helix	trans	-65	-46.2	173.8	-70.4	173.4	179.5	-174.8	0	111.7	A392 R393 A394 R399 F400 I431 Y436 D437 L439 E441 F444	A392-K396 WeakPolarHBondContact O-CG 3.49Å; A392-K396 PolarHBondContact O-N 2.99Å; R393-K396 WeakPolarHBondContact O-CB 3.13Å; R393-K396 PolarHBondContact O-N 2.91Å; R393-K396 VanDerWaalsContact O-N 3.16Å; A394-K396 VanDerWaalsContact C-N 3.32Å; A394-K396 PolarHBondContact O-N 3.3Å; K396-R399 PolarHBondContact O-N 2.92Å; K396-F400 VanDerWaalsContact O-CB 3.27Å; K396-F400 WeakPolarHBondContact O-CB 3.42Å; K396-F400 PolarHBondContact O-N 2.79Å; K396-I431 HydrophobicContact CB-CG2 4.33Å; K396-Y436 PolarHBondContact NZ-O 2.85Å; K396-D437 PolarHBondContact NZ-O 3.48Å; K396-L439 WeakPolarHBondContact CE-O 3.36Å; K396-L439 PolarHBondContact NZ-O 3.14Å; K396-E441 HydrophobicContact CG-CB 4.45Å; K396-E441 HydrophobicContact CG-CG 4.13Å; K396-F444 HydrophobicContact CB-CD2 4.02Å; K396-F444 HydrophobicContact CB-CE2 4.12Å; K396-F444 HydrophobicContact CB-CG 4.25Å; K396-F444 HydrophobicContact CB-CZ 4.43Å; K396-F444 HydrophobicContact CD-CD2 4.27Å; K396-F444 HydrophobicContact CD-CE2 3.66Å; K396-F444 HydrophobicContact CD-CZ 4.06Å; K396-F444 HydrophobicContact CG-CD2 3.8Å; K396-F444 HydrophobicContact CG-CE2 3.72Å; K396-F444 HydrophobicContact CG-CZ 4.37Å
397	I	95.4	Very high	92.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.9	-49.8	175.2	-71.3	172	0	0	0	110.2	V361 I364 L365 R393 A394 R399 F400 L401 F428 I431	V361-I397 HydrophobicContact CG1-CG2 3.73Å; V361-I397 HydrophobicContact CG2-CD1 4.4Å; I364-I397 HydrophobicContact CB-CD1 4.13Å; I364-I397 HydrophobicContact CD1-CD1 3.91Å; I364-I397 HydrophobicContact CG2-CD1 3.79Å; L365-I397 HydrophobicContact CD1-CG2 3.98Å; L365-I397 HydrophobicContact CD2-CB 4.35Å; L365-I397 HydrophobicContact CD2-CG2 3.85Å; L365-I397 HydrophobicContact CG-CG2 4Å; R393-I397 WeakPolarHBondContact O-CG1 3.45Å; R393-I397 PolarHBondContact O-N 2.97Å; A394-I397 PolarHBondContact O-N 2.91Å; I397-R399 VanDerWaalsContact C-N 3.3Å; I397-R399 PolarHBondContact O-N 3.22Å; I397-F400 CarbonylContact O-C 3.6Å; I397-F400 PolarHBondContact O-N 2.96Å; I397-L401 HydrophobicContact CG2-CD1 4.18Å; I397-L401 HydrophobicContact CG2-CG 4.47Å; I397-L401 WeakPolarHBondContact O-CG 3.49Å; I397-L401 PolarHBondContact O-N 2.84Å; I397-F428 HydrophobicContact CG2-CD1 4.3Å; I397-F428 HydrophobicContact CG2-CE1 3.97Å; I397-I431 HydrophobicContact CD1-CG2 4.31Å; I397-I431 HydrophobicContact CG1-CG2 3.65Å
398	Q	93.5	Very high	91.9	Very high	45 Å²	45	26.2 Å²	26.2	21%	0.21	13%	0.126	C	C	.	.	H	α-helix	trans	-56.4	-43.3	178.6	-78	-173	-26.3	0	0	112.4	I331 L365 A394	I331-Q398 HydrophobicContact CD1-CB 4.05Å; L365-Q398 HydrophobicContact CD2-CG 3.62Å; A394-Q398 WeakPolarHBondContact O-CB 3.09Å; A394-Q398 WeakPolarHBondContact O-CG 3.39Å; A394-Q398 PolarHBondContact O-N 2.87Å
399	R	93.6	Very high	91.4	Very high	77 Å²	77	27.9 Å²	27.9	29%	0.291	14%	0.135	S	C	.	.	H	α-helix	trans	-70.8	-38.5	175.2	-69.8	-178	-172.8	163	21.7	111.6	R395 K396 I397 L401 S402 E441 Q442 F444	R395-R399 WeakPolarHBondContact O-CG 3.33Å; R395-R399 PolarHBondContact O-N 2.91Å; R395-R399 VanDerWaalsContact O-N 3.11Å; K396-R399 PolarHBondContact O-N 2.92Å; I397-R399 VanDerWaalsContact C-N 3.3Å; I397-R399 PolarHBondContact O-N 3.22Å; R399-L401 VanDerWaalsContact C-N 3.25Å; R399-L401 PolarHBondContact O-N 2.69Å; R399-S402 VanDerWaalsContact O-CB 3.28Å; R399-S402 WeakPolarHBondContact O-CB 3.48Å; R399-S402 PolarHBondContact O-N 3.37Å; R399-S402 PolarHBondContact O-OG 3.11Å; R399-E441 WeakPolarHBondContact CD-O 3.21Å; R399-E441 IonicContact CZ-OE2 2.77Å; R399-E441 VanDerWaalsContact CZ-OE2 3.25Å; R399-E441 IonicContact NH1-OE2 3.62Å; R399-E441 PolarHBondContact NH1-OE2 2.79Å; R399-E441 IonicContact NH2-OE2 3.51Å; R399-E441 PolarHBondContact NH2-OE2 2.94Å; R399-Q442 VanDerWaalsContact NH1-N 3.18Å; R399-F444 CarbonylContact C-O 3.53Å; R399-F444 HydrophobicContact CB-CB 4Å
400	F	95.5	Very high	90.4	Very high	1 Å²	1	30.8 Å²	30.8	0%	0.004	16%	0.155	C	C	.	.	H	α-helix	trans	-69.6	-22	179	-166	-121.5	0	0	0	113.4	K132 K396 I397 S402 F428 I431 F444 V447 I450	K132-F400 HydrophobicContact CD-CE1 4.28Å; K132-F400 HydrophobicContact CD-CZ 4.22Å; K132-F400 WeakPolarHBondContact CE-O 3.37Å; K132-F400 PolarHBondContact NZ-O 3.2Å; K396-F400 VanDerWaalsContact O-CB 3.27Å; K396-F400 WeakPolarHBondContact O-CB 3.42Å; K396-F400 PolarHBondContact O-N 2.79Å; I397-F400 CarbonylContact O-C 3.6Å; I397-F400 PolarHBondContact O-N 2.96Å; F400-S402 PolarHBondContact O-N 3.44Å; F400-F428 HydrophobicContact CB-CE1 4.41Å; F400-F428 HydrophobicContact CD1-CD1 4.03Å; F400-F428 HydrophobicContact CD1-CD2 4.1Å; F400-F428 AromaticContact CD1-CE1 3.66Å; F400-F428 HydrophobicContact CD1-CE1 3.66Å; F400-F428 AromaticContact CD1-CE2 3.74Å; F400-F428 HydrophobicContact CD1-CE2 3.74Å; F400-F428 HydrophobicContact CD1-CG 4.23Å; F400-F428 AromaticContact CD1-CZ 3.49Å; F400-F428 HydrophobicContact CD1-CZ 3.49Å; F400-F428 VanDerWaalsContact CD1-CZ 3.49Å; F400-F428 AromaticContact CE1-CD2 4Å; F400-F428 HydrophobicContact CE1-CD2 4Å; F400-F428 HydrophobicContact CE1-CE1 4.49Å; F400-F428 AromaticContact CE1-CE2 3.85Å; F400-F428 HydrophobicContact CE1-CE2 3.85Å; F400-F428 HydrophobicContact CE1-CG 4.38Å; F400-F428 HydrophobicContact CE1-CZ 4.1Å; F400-F428 HydrophobicContact CG-CZ 4.36Å; F400-I431 HydrophobicContact CB-CD1 3.94Å; F400-I431 HydrophobicContact CD1-CD1 3.47Å; F400-I431 VanDerWaalsContact CD1-CD1 3.47Å; F400-I431 HydrophobicContact CE1-CD1 4.11Å; F400-I431 HydrophobicContact CG-CD1 3.73Å; F400-F444 WeakPolarHBondContact CA-O 3.47Å; F400-F444 HydrophobicContact CB-CB 4.07Å; F400-F444 HydrophobicContact CB-CD1 3.97Å; F400-F444 HydrophobicContact CB-CG 4.46Å; F400-F444 HydrophobicContact CD2-CB 4.49Å; F400-F444 AromaticContact CD2-CD1 3.9Å; F400-F444 HydrophobicContact CD2-CD1 3.9Å; F400-F444 HydrophobicContact CG-CD1 4.08Å; F400-F444 PolarHBondContact N-O 3.16Å; F400-V447 HydrophobicContact CD2-CG2 3.85Å; F400-V447 HydrophobicContact CE2-CG2 3.92Å; F400-I450 HydrophobicContact CE2-CD1 4.23Å; F400-I450 HydrophobicContact CZ-CB 4.24Å; F400-I450 HydrophobicContact CZ-CD1 4.19Å
401	L	94	Very high	89.4	Confident	10 Å²	10	35.9 Å²	35.9	5%	0.052	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.6	169.1	-72.8	166.6	0	0	0	112.3	V133 P337 L365 I397 R399 F428	V133-L401 HydrophobicContact CB-CD2 3.79Å; V133-L401 HydrophobicContact CG2-CD2 3.86Å; P337-L401 HydrophobicContact CB-CD1 4.36Å; P337-L401 HydrophobicContact CG-CD1 3.98Å; L365-L401 HydrophobicContact CD1-CD1 4.16Å; I397-L401 HydrophobicContact CG2-CD1 4.18Å; I397-L401 HydrophobicContact CG2-CG 4.47Å; I397-L401 WeakPolarHBondContact O-CG 3.49Å; I397-L401 PolarHBondContact O-N 2.84Å; R399-L401 VanDerWaalsContact C-N 3.25Å; R399-L401 PolarHBondContact O-N 2.69Å; L401-F428 HydrophobicContact CD2-CE1 3.84Å; L401-F428 HydrophobicContact CD2-CE2 4.34Å; L401-F428 HydrophobicContact CD2-CZ 3.43Å; L401-F428 VanDerWaalsContact CD2-CZ 3.43Å; L401-F428 HydrophobicContact CG-CE1 3.95Å; L401-F428 HydrophobicContact CG-CZ 3.84Å
402	S	93.1	Very high	88.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.19	C	C	.	.			trans	-67.9	146	170.7	71.6	0	0	0	0	111.5	K132 Y332 R399 F400 M446	K132-S402 WeakPolarHBondContact CE-O 3.15Å; K132-S402 PolarHBondContact NZ-O 3.22Å; Y332-S402 CarbonylContact O-C 3.6Å; Y332-S402 WeakPolarHBondContact O-CA 3.47Å; Y332-S402 VanDerWaalsContact O-CB 3.3Å; Y332-S402 WeakPolarHBondContact O-CB 3.42Å; R399-S402 VanDerWaalsContact O-CB 3.28Å; R399-S402 WeakPolarHBondContact O-CB 3.48Å; R399-S402 PolarHBondContact O-N 3.37Å; R399-S402 PolarHBondContact O-OG 3.11Å; F400-S402 PolarHBondContact O-N 3.44Å; S402-M446 PolarHBondContact OG-N 2.85Å
403	Q	93.5	Very high	87.8	Confident	2 Å²	2	40 Å²	40	1%	0.009	21%	0.21	C	C	.	.			trans	-146.1	131.5	-178.7	-176.9	173.6	-38.1	0	0	109.6	G130 Y332 F405 K417 V419	G130-Q403 PolarHBondContact O-NE2 3.28Å; G130-Q403 PolarHBondContact O-OE1 3.26Å; Y332-Q403 PolarHBondContact O-N 3.48Å; Q403-F405 HydrophobicContact CB-CE1 4.3Å; Q403-F405 HydrophobicContact CG-CD1 4.44Å; Q403-F405 HydrophobicContact CG-CE1 4.48Å; Q403-F405 PolarHBondContact O-N 2.83Å; Q403-K417 PolarHBondContact NE2-O 3.01Å; Q403-V419 HydrophobicContact CG-CG2 4.49Å
404	P	91.2	Very high	87.2	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.013	21%	0.214	C	C	.	.			trans	-69.1	119.8	173	29.5	-33.3	0	0	0	109.6	G416 K417 M446	P404-G416 WeakPolarHBondContact O-CA 3.38Å; P404-K417 HydrophobicContact CG-CB 4.07Å; P404-K417 HydrophobicContact CG-CD 4.06Å; P404-K417 HydrophobicContact CG-CG 3.86Å; P404-K417 PolarHBondContact O-N 3.18Å; P404-M446 HydrophobicContact CB-CE 4.07Å
405	F	90.6	Very high	86.7	Confident	9 Å²	9	43.3 Å²	43.3	4%	0.039	24%	0.238	C	C	.	.			trans	-87	144.2	176.3	-75.5	0.8	0	0	0	110.9	I131 V158 E162 P333 Q403 A408 E409	I131-F405 HydrophobicContact CD1-CE1 4.13Å; I131-F405 HydrophobicContact CD1-CZ 3.82Å; I131-F405 HydrophobicContact CG1-CE1 4.04Å; I131-F405 HydrophobicContact CG1-CZ 4.22Å; I131-F405 HydrophobicContact CG2-CE1 4.16Å; I131-F405 HydrophobicContact CG2-CZ 4.18Å; V158-F405 HydrophobicContact CG1-CD2 4.04Å; E162-F405 HydrophobicContact CB-CD2 3.76Å; E162-F405 HydrophobicContact CB-CE2 3.96Å; E162-F405 HydrophobicContact CB-CG 4.1Å; E162-F405 HydrophobicContact CB-CZ 4.45Å; E162-F405 HydrophobicContact CG-CB 4.11Å; E162-F405 HydrophobicContact CG-CD1 3.79Å; E162-F405 HydrophobicContact CG-CD2 3.82Å; E162-F405 HydrophobicContact CG-CE1 4.05Å; E162-F405 HydrophobicContact CG-CE2 4.09Å; E162-F405 HydrophobicContact CG-CG 3.66Å; E162-F405 HydrophobicContact CG-CZ 4.18Å; E162-F405 WeakPolarHBondContact OE1-CA 3.38Å; E162-F405 WeakPolarHBondContact OE2-CB 3.46Å; P333-F405 HydrophobicContact CB-CE1 4.39Å; P333-F405 HydrophobicContact CB-CE2 3.97Å; P333-F405 HydrophobicContact CB-CZ 3.54Å; P333-F405 HydrophobicContact CG-CE1 4.03Å; P333-F405 HydrophobicContact CG-CE2 4.48Å; P333-F405 HydrophobicContact CG-CZ 3.59Å; Q403-F405 HydrophobicContact CB-CE1 4.3Å; Q403-F405 HydrophobicContact CG-CD1 4.44Å; Q403-F405 HydrophobicContact CG-CE1 4.48Å; Q403-F405 PolarHBondContact O-N 2.83Å; F405-A408 HydrophobicContact CB-CB 3.87Å; F405-A408 CarbonylContact O-C 3.56Å; F405-A408 PolarHBondContact O-N 3.07Å; F405-E409 PolarHBondContact O-N 3.49Å
406	F	85.7	Confident	86.4	Confident	50 Å²	50	40.4 Å²	40.4	22%	0.219	23%	0.23	C	C	.	.	S	Bend	trans	-65.4	-43.4	176.9	-66.6	-84.2	0	0	0	111.4	E162 R165 A408 E409 G416	E162-F406 VanDerWaalsContact OE1-CD2 3.28Å; E162-F406 WeakPolarHBondContact OE1-CD2 3.38Å; E162-F406 PolarHBondContact OE1-N 3.09Å; E162-F406 VanDerWaalsContact OE1-N 3.1Å; E162-F406 PolarHBondContact OE2-N 2.81Å; R165-F406 VanDerWaalsContact CZ-CB 3.47Å; R165-F406 VanDerWaalsContact NE-CB 3.27Å; R165-F406 VanDerWaalsContact NH1-CE2 3.28Å; R165-F406 VanDerWaalsContact NH2-CD1 3.31Å; F406-A408 PolarHBondContact O-N 3.25Å; F406-E409 WeakPolarHBondContact O-CB 3.35Å; F406-E409 PolarHBondContact O-N 3.15Å; F406-G416 WeakPolarHBondContact CE1-O 3.42Å; F406-G416 WeakPolarHBondContact CZ-O 3.42Å
407	V	81.5	Confident	86.2	Confident	13 Å²	13	42.9 Å²	42.9	8%	0.079	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-27.1	178.6	-176.4	0	0	0	0	111	M161 E162 R165 E193	M161-V407 HydrophobicContact CB-CB 4.43Å; M161-V407 HydrophobicContact CB-CG1 3.95Å; M161-V407 HydrophobicContact CB-CG2 4.06Å; M161-V407 HydrophobicContact CE-CG1 3.99Å; M161-V407 HydrophobicContact SD-CG1 4.35Å; E162-V407 PolarHBondContact OE2-N 3.44Å; E162-V407 VanDerWaalsContact OE2-N 3.15Å; R165-V407 HydrophobicContact CB-CG2 4.45Å; E193-V407 WeakPolarHBondContact OE2-CG1 3.32Å
408	A	81.6	Confident	86	Confident	12 Å²	12	45.8 Å²	45.8	10%	0.099	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	7	-179.9	0	0	0	0	0	114.4	V158 F405 F406 V410 F411 T412	V158-A408 HydrophobicContact CG1-CB 4.21Å; F405-A408 HydrophobicContact CB-CB 3.87Å; F405-A408 CarbonylContact O-C 3.56Å; F405-A408 PolarHBondContact O-N 3.07Å; F406-A408 PolarHBondContact O-N 3.25Å; A408-V410 PolarHBondContact O-N 3.47Å; A408-F411 HydrophobicContact CB-CD2 4.44Å; A408-F411 PolarHBondContact O-N 3.3Å; A408-T412 HydrophobicContact CB-CG2 4.18Å; A408-T412 WeakPolarHBondContact O-CB 3.38Å; A408-T412 WeakPolarHBondContact O-CG2 3.41Å; A408-T412 PolarHBondContact O-N 3.43Å; A408-T412 PolarHBondContact O-OG1 3.02Å
409	E	80.6	Confident	86	Confident	92 Å²	92	43.9 Å²	43.9	43%	0.43	24%	0.244	S	C	.	.	H	α-helix	trans	-58.2	-37.8	-179.8	-179	167.9	172.7	0	0	111.4	F405 F406 F411 G413	F405-E409 PolarHBondContact O-N 3.49Å; F406-E409 WeakPolarHBondContact O-CB 3.35Å; F406-E409 PolarHBondContact O-N 3.15Å; E409-F411 VanDerWaalsContact C-N 3.28Å; E409-F411 PolarHBondContact O-N 3.29Å; E409-G413 VanDerWaalsContact O-CA 3.29Å; E409-G413 WeakPolarHBondContact O-CA 3.37Å; E409-G413 PolarHBondContact O-N 3.44Å
410	V	71.3	Confident	85.9	Confident	133 Å²	133	41.6 Å²	41.6	81%	0.806	24%	0.24	S	C	*	.	H	α-helix	trans	-62	-35.3	177.2	-175.3	0	0	0	0	112.1	A408	A408-V410 PolarHBondContact O-N 3.47Å
411	F	71.5	Confident	85.8	Confident	146 Å²	146	43.4 Å²	43.4	64%	0.64	25%	0.249	S	C	*	.	H	α-helix	trans	-88.3	-35.5	-177.6	-56.2	-68.7	0	0	0	112.9	A408 E409	A408-F411 HydrophobicContact CB-CD2 4.44Å; A408-F411 PolarHBondContact O-N 3.3Å; E409-F411 VanDerWaalsContact C-N 3.28Å; E409-F411 PolarHBondContact O-N 3.29Å
412	T	76.2	Confident	85.7	Confident	55 Å²	55	50.5 Å²	50.5	34%	0.337	28%	0.28	S	S	.	.	H	α-helix	trans	-95.9	-19	-173.1	62.7	0	0	0	0	113.1	A408 S414 M446	A408-T412 HydrophobicContact CB-CG2 4.18Å; A408-T412 WeakPolarHBondContact O-CB 3.38Å; A408-T412 WeakPolarHBondContact O-CG2 3.41Å; A408-T412 PolarHBondContact O-N 3.43Å; A408-T412 PolarHBondContact O-OG1 3.02Å; T412-S414 PolarHBondContact O-N 2.97Å; T412-S414 VanDerWaalsContact O-N 3.14Å; T412-S414 PolarHBondContact OG1-N 2.78Å; T412-M446 HydrophobicContact CG2-CE 3.79Å
413	G	77	Confident	85.7	Confident	67 Å²	67	52.7 Å²	52.7	69%	0.691	29%	0.291	S	S	*	.			trans	63.3	9.7	-171.9	0	0	0	0	0	113.9	E409	E409-G413 VanDerWaalsContact O-CA 3.29Å; E409-G413 WeakPolarHBondContact O-CA 3.37Å; E409-G413 PolarHBondContact O-N 3.44Å
414	S	81.4	Confident	85.8	Confident	40 Å²	40	52.6 Å²	52.6	28%	0.28	29%	0.291	S	S	.	.	S	Bend	trans	-109	130.4	-178.9	-61.5	0	0	0	0	109.1	T412 G416	T412-S414 PolarHBondContact O-N 2.97Å; T412-S414 VanDerWaalsContact O-N 3.14Å; T412-S414 PolarHBondContact OG1-N 2.78Å; S414-G416 PolarHBondContact O-N 2.85Å
415	P	85.6	Confident	86	Confident	78 Å²	78	53.4 Å²	53.4	51%	0.506	30%	0.295	S	S	.	.			trans	-62.7	133.1	179.9	26	-33.7	0	0	0	110
416	G	87.3	Confident	86.1	Confident	9 Å²	9	57.5 Å²	57.5	9%	0.093	31%	0.31	C	S	.	.			trans	-60.8	152.6	179.3	0	0	0	0	0	112.9	P404 F406 S414	P404-G416 WeakPolarHBondContact O-CA 3.38Å; F406-G416 WeakPolarHBondContact CE1-O 3.42Å; F406-G416 WeakPolarHBondContact CZ-O 3.42Å; S414-G416 PolarHBondContact O-N 2.85Å
417	K	89.5	Confident	86.4	Confident	59 Å²	59	55.1 Å²	55.1	26%	0.257	30%	0.3	S	S	.	.			trans	-138.3	134	-178.6	-62.5	-170.9	-178.5	-165.4	0	111.7	Q403 P404 E452	Q403-K417 PolarHBondContact NE2-O 3.01Å; P404-K417 HydrophobicContact CG-CB 4.07Å; P404-K417 HydrophobicContact CG-CD 4.06Å; P404-K417 HydrophobicContact CG-CG 3.86Å; P404-K417 PolarHBondContact O-N 3.18Å; K417-E452 WeakPolarHBondContact CD-OE1 3.34Å; K417-E452 WeakPolarHBondContact CD-OE2 3.44Å; K417-E452 IonicContact NZ-OE1 2.73Å; K417-E452 PolarHBondContact NZ-OE1 3.46Å; K417-E452 IonicContact NZ-OE2 2.85Å; K417-E452 PolarHBondContact NZ-OE2 2.75Å
418	Y	91.6	Very high	87.1	Confident	61 Å²	61	54.5 Å²	54.5	24%	0.239	30%	0.296	C	S	.	.			trans	-90.6	128.8	164.9	-174	-85.3	0	0	0	108.3	E128 N166 E170	E128-Y418 WeakPolarHBondContact CG-OH 3.2Å; N166-Y418 HydrophobicContact CB-CD2 4.12Å; N166-Y418 HydrophobicContact CB-CE2 4.17Å; E170-Y418 HydrophobicContact CG-CD2 4Å; E170-Y418 HydrophobicContact CG-CE2 3.73Å
419	V	92.7	Very high	87.7	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.03	30%	0.304	C	S	.	.			trans	-117.7	123.2	178.8	-173.1	0	0	0	0	108.7	G130 K132 Q403 D423	G130-V419 CarbonylContact C-O 3.19Å; G130-V419 WeakPolarHBondContact CA-O 3.19Å; G130-V419 PolarHBondContact O-N 3.11Å; G130-V419 VanDerWaalsContact O-N 3.14Å; K132-V419 HydrophobicContact CD-CB 4.41Å; K132-V419 HydrophobicContact CD-CG1 4.11Å; K132-V419 HydrophobicContact CD-CG2 4.25Å; K132-V419 HydrophobicContact CG-CB 3.83Å; K132-V419 HydrophobicContact CG-CG1 3.8Å; K132-V419 HydrophobicContact CG-CG2 4.06Å; Q403-V419 HydrophobicContact CG-CG2 4.49Å; V419-D423 HydrophobicContact CG1-CB 4.14Å
420	S	93.5	Very high	88.3	Confident	30 Å²	30	52.6 Å²	52.6	21%	0.21	29%	0.285	C	S	.	.			trans	-66	152.2	179.8	75.5	0	0	0	0	111.8	E128 K422 D423 T424	E128-S420 WeakPolarHBondContact OE1-CA 3.47Å; E128-S420 WeakPolarHBondContact OE1-CB 3.18Å; S420-K422 PolarHBondContact O-N 3.12Å; S420-D423 PolarHBondContact O-N 3.18Å; S420-D423 VanDerWaalsContact O-N 3.15Å; S420-D423 WeakPolarHBondContact OG-CB 3.34Å; S420-D423 PolarHBondContact OG-N 2.99Å; S420-D423 VanDerWaalsContact OG-N 3.13Å; S420-D423 PolarHBondContact OG-OD2 2.99Å; S420-T424 WeakPolarHBondContact O-CB 3.25Å; S420-T424 PolarHBondContact O-N 3.45Å; S420-T424 PolarHBondContact O-OG1 3.15Å
421	L	91.9	Very high	89.3	Confident	38 Å²	38	46.3 Å²	46.3	20%	0.199	25%	0.247	C	C	.	.	H	α-helix	trans	-55.9	-40.2	174.8	173.9	61.1	0	0	0	110.9	E128 D135 H354 D423 T424 I425	E128-L421 HydrophobicContact CG-CB 4.22Å; E128-L421 PolarHBondContact OE1-N 2.92Å; D135-L421 HydrophobicContact CB-CD1 3.99Å; H354-L421 VanDerWaalsContact CE1-CD1 3.47Å; H354-L421 WeakPolarHBondContact CE1-CD1 3.36Å; L421-D423 PolarHBondContact O-N 2.89Å; L421-T424 WeakPolarHBondContact O-CB 3.29Å; L421-T424 PolarHBondContact O-N 2.91Å; L421-I425 HydrophobicContact CD1-CD1 3.92Å; L421-I425 HydrophobicContact CD1-CG1 4.12Å; L421-I425 HydrophobicContact CG-CD1 3.97Å; L421-I425 WeakPolarHBondContact O-CG1 3.29Å; L421-I425 PolarHBondContact O-N 3.16Å
422	K	92.8	Very high	90.3	Very high	160 Å²	160	41 Å²	41	70%	0.696	22%	0.224	S	C	*	.	H	α-helix	trans	-62.6	-44.4	178.3	-174.9	179.9	179.4	-179	0	112.3	S420 T424 R426	S420-K422 PolarHBondContact O-N 3.12Å; K422-T424 VanDerWaalsContact C-N 3.32Å; K422-R426 WeakPolarHBondContact O-CB 3.35Å; K422-R426 PolarHBondContact O-N 3.15Å
423	D	93.4	Very high	91.1	Very high	45 Å²	45	43.7 Å²	43.7	24%	0.241	23%	0.233	C	C	.	.	H	α-helix	trans	-70.8	-33.3	178.2	-64.4	-42	0	0	0	111.5	V419 S420 L421 R426 G427	V419-D423 HydrophobicContact CG1-CB 4.14Å; S420-D423 PolarHBondContact O-N 3.18Å; S420-D423 VanDerWaalsContact O-N 3.15Å; S420-D423 WeakPolarHBondContact OG-CB 3.34Å; S420-D423 PolarHBondContact OG-N 2.99Å; S420-D423 VanDerWaalsContact OG-N 3.13Å; S420-D423 PolarHBondContact OG-OD2 2.99Å; L421-D423 PolarHBondContact O-N 2.89Å; D423-R426 IonicContact OD1-CZ 2.72Å; D423-R426 IonicContact OD1-NH1 2.76Å; D423-R426 PolarHBondContact OD1-NH1 2.91Å; D423-R426 IonicContact OD1-NH2 3.3Å; D423-R426 PolarHBondContact OD1-NH2 2.77Å; D423-G427 PolarHBondContact O-N 3.46Å
424	T	94.4	Very high	91.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.8	-56.7	172.7	-58.6	0	0	0	0	110.3	K132 L136 S420 L421 K422 R426 G427 F428	K132-T424 HydrophobicContact CB-CG2 3.97Å; K132-T424 HydrophobicContact CG-CG2 4.01Å; L136-T424 HydrophobicContact CB-CG2 3.93Å; S420-T424 WeakPolarHBondContact O-CB 3.25Å; S420-T424 PolarHBondContact O-N 3.45Å; S420-T424 PolarHBondContact O-OG1 3.15Å; L421-T424 WeakPolarHBondContact O-CB 3.29Å; L421-T424 PolarHBondContact O-N 2.91Å; K422-T424 VanDerWaalsContact C-N 3.32Å; T424-R426 PolarHBondContact O-N 3.4Å; T424-G427 PolarHBondContact O-N 2.88Å; T424-F428 HydrophobicContact CG2-CD2 3.82Å; T424-F428 HydrophobicContact CG2-CE2 3.84Å; T424-F428 VanDerWaalsContact O-CD2 3.25Å; T424-F428 WeakPolarHBondContact O-CD2 3.14Å; T424-F428 PolarHBondContact O-N 2.76Å
425	I	95.2	Very high	92.1	Very high	19 Å²	19	44.5 Å²	44.5	10%	0.097	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-48.4	179.7	-66.8	167	0	0	0	110.6	L136 E353 H354 T357 L421 G427 F428 K429	L136-I425 HydrophobicContact CD1-CG1 4.38Å; E353-I425 HydrophobicContact CG-CG2 3.91Å; H354-I425 HydrophobicContact CB-CD1 3.7Å; H354-I425 HydrophobicContact CB-CG1 4.43Å; T357-I425 HydrophobicContact CG2-CG2 4.41Å; L421-I425 HydrophobicContact CD1-CD1 3.92Å; L421-I425 HydrophobicContact CD1-CG1 4.12Å; L421-I425 HydrophobicContact CG-CD1 3.97Å; L421-I425 WeakPolarHBondContact O-CG1 3.29Å; L421-I425 PolarHBondContact O-N 3.16Å; I425-G427 VanDerWaalsContact C-N 3.33Å; I425-G427 PolarHBondContact O-N 3.08Å; I425-F428 PolarHBondContact O-N 2.87Å; I425-K429 WeakPolarHBondContact O-CB 3.24Å; I425-K429 PolarHBondContact O-N 2.85Å
426	R	93.7	Very high	92.4	Very high	96 Å²	96	42.5 Å²	42.5	36%	0.362	20%	0.201	S	C	.	.	H	α-helix	trans	-56.1	-47.7	178	-177.1	175.8	73.6	-116.3	0.7	111.6	K422 D423 T424 G430 E451	K422-R426 WeakPolarHBondContact O-CB 3.35Å; K422-R426 PolarHBondContact O-N 3.15Å; D423-R426 IonicContact OD1-CZ 2.72Å; D423-R426 IonicContact OD1-NH1 2.76Å; D423-R426 PolarHBondContact OD1-NH1 2.91Å; D423-R426 IonicContact OD1-NH2 3.3Å; D423-R426 PolarHBondContact OD1-NH2 2.77Å; T424-R426 PolarHBondContact O-N 3.4Å; R426-G430 PolarHBondContact O-N 2.96Å; R426-E451 IonicContact CZ-OE1 3.16Å; R426-E451 IonicContact NE-OE1 3.36Å; R426-E451 PolarHBondContact NE-OE1 2.86Å; R426-E451 IonicContact NH2-OE1 2.75Å; R426-E451 PolarHBondContact NH2-OE1 3.16Å; R426-E451 IonicContact NH2-OE2 2.71Å; R426-E451 PolarHBondContact NH2-OE2 3.05Å
427	G	92.5	Very high	92.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-47.8	-178	0	0	0	0	0	112.7	D423 T424 I425 I431	D423-G427 PolarHBondContact O-N 3.46Å; T424-G427 PolarHBondContact O-N 2.88Å; I425-G427 VanDerWaalsContact C-N 3.33Å; I425-G427 PolarHBondContact O-N 3.08Å; G427-I431 VanDerWaalsContact O-CG1 3.29Å; G427-I431 WeakPolarHBondContact O-CG1 3.21Å; G427-I431 PolarHBondContact O-N 2.9Å
428	F	95.3	Very high	92.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.1	-42.5	178.9	-78.6	-77.1	0	0	0	112.2	K132 L136 T357 V361 I397 F400 L401 T424 I425 G430 I431 M432	K132-F428 HydrophobicContact CB-CE2 4.26Å; K132-F428 HydrophobicContact CD-CE2 4.37Å; L136-F428 HydrophobicContact CD2-CB 4.09Å; L136-F428 HydrophobicContact CD2-CD1 4.12Å; L136-F428 HydrophobicContact CD2-CD2 3.49Å; L136-F428 VanDerWaalsContact CD2-CD2 3.49Å; L136-F428 HydrophobicContact CD2-CE1 4.48Å; L136-F428 HydrophobicContact CD2-CE2 3.9Å; L136-F428 HydrophobicContact CD2-CG 3.62Å; L136-F428 HydrophobicContact CD2-CZ 4.39Å; T357-F428 HydrophobicContact CG2-CB 3.73Å; V361-F428 HydrophobicContact CG2-CB 3.95Å; V361-F428 HydrophobicContact CG2-CD1 3.72Å; V361-F428 HydrophobicContact CG2-CG 4.11Å; I397-F428 HydrophobicContact CG2-CD1 4.3Å; I397-F428 HydrophobicContact CG2-CE1 3.97Å; F400-F428 HydrophobicContact CB-CE1 4.41Å; F400-F428 HydrophobicContact CD1-CD1 4.03Å; F400-F428 HydrophobicContact CD1-CD2 4.1Å; F400-F428 AromaticContact CD1-CE1 3.66Å; F400-F428 HydrophobicContact CD1-CE1 3.66Å; F400-F428 AromaticContact CD1-CE2 3.74Å; F400-F428 HydrophobicContact CD1-CE2 3.74Å; F400-F428 HydrophobicContact CD1-CG 4.23Å; F400-F428 AromaticContact CD1-CZ 3.49Å; F400-F428 HydrophobicContact CD1-CZ 3.49Å; F400-F428 VanDerWaalsContact CD1-CZ 3.49Å; F400-F428 AromaticContact CE1-CD2 4Å; F400-F428 HydrophobicContact CE1-CD2 4Å; F400-F428 HydrophobicContact CE1-CE1 4.49Å; F400-F428 AromaticContact CE1-CE2 3.85Å; F400-F428 HydrophobicContact CE1-CE2 3.85Å; F400-F428 HydrophobicContact CE1-CG 4.38Å; F400-F428 HydrophobicContact CE1-CZ 4.1Å; F400-F428 HydrophobicContact CG-CZ 4.36Å; L401-F428 HydrophobicContact CD2-CE1 3.84Å; L401-F428 HydrophobicContact CD2-CE2 4.34Å; L401-F428 HydrophobicContact CD2-CZ 3.43Å; L401-F428 VanDerWaalsContact CD2-CZ 3.43Å; L401-F428 HydrophobicContact CG-CE1 3.95Å; L401-F428 HydrophobicContact CG-CZ 3.84Å; T424-F428 HydrophobicContact CG2-CD2 3.82Å; T424-F428 HydrophobicContact CG2-CE2 3.84Å; T424-F428 VanDerWaalsContact O-CD2 3.25Å; T424-F428 WeakPolarHBondContact O-CD2 3.14Å; T424-F428 PolarHBondContact O-N 2.76Å; I425-F428 PolarHBondContact O-N 2.87Å; F428-G430 PolarHBondContact O-N 2.65Å; F428-I431 PolarHBondContact O-N 2.89Å; F428-I431 VanDerWaalsContact O-N 3.14Å; F428-M432 VanDerWaalsContact O-CG 3.31Å; F428-M432 WeakPolarHBondContact O-CG 3.34Å; F428-M432 PolarHBondContact O-N 3.28Å
429	K	94.6	Very high	92.7	Very high	61 Å²	61	46.3 Å²	46.3	27%	0.265	22%	0.221	S	C	.	.	H	α-helix	trans	-57.2	-48.2	177.1	-177.1	170.6	171.6	174.4	0	112.2	E353 T357 I425 I431 M432 E433	E353-K429 IonicContact OE1-NZ 3.35Å; E353-K429 PolarHBondContact OE1-NZ 2.8Å; T357-K429 HydrophobicContact CG2-CB 4.25Å; I425-K429 WeakPolarHBondContact O-CB 3.24Å; I425-K429 PolarHBondContact O-N 2.85Å; K429-I431 VanDerWaalsContact C-N 3.3Å; K429-I431 PolarHBondContact O-N 3.4Å; K429-M432 PolarHBondContact O-N 3.31Å; K429-M432 VanDerWaalsContact O-N 3.13Å; K429-E433 WeakPolarHBondContact CE-OE1 3.26Å; K429-E433 HydrophobicContact CG-CG 4.4Å; K429-E433 WeakPolarHBondContact CG-OE1 3.33Å; K429-E433 WeakPolarHBondContact O-CB 3.42Å; K429-E433 WeakPolarHBondContact O-CG 3.49Å; K429-E433 PolarHBondContact O-N 2.84Å
430	G	92.9	Very high	92.6	Very high	3 Å²	3	48.8 Å²	48.8	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-64.2	-31.6	177.3	0	0	0	0	0	113.6	R426 F428 G434 E435	R426-G430 PolarHBondContact O-N 2.96Å; F428-G430 PolarHBondContact O-N 2.65Å; G430-G434 PolarHBondContact O-N 3.04Å; G430-E435 WeakPolarHBondContact O-CB 3.44Å; G430-E435 PolarHBondContact O-N 3.25Å
431	I	92.9	Very high	92.5	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-67.9	-43	172.6	-64.1	165.1	0	0	0	110.9	K396 I397 F400 G427 F428 K429 G434 Y436 F444 I450	K396-I431 HydrophobicContact CB-CG2 4.33Å; I397-I431 HydrophobicContact CD1-CG2 4.31Å; I397-I431 HydrophobicContact CG1-CG2 3.65Å; F400-I431 HydrophobicContact CB-CD1 3.94Å; F400-I431 HydrophobicContact CD1-CD1 3.47Å; F400-I431 VanDerWaalsContact CD1-CD1 3.47Å; F400-I431 HydrophobicContact CE1-CD1 4.11Å; F400-I431 HydrophobicContact CG-CD1 3.73Å; G427-I431 VanDerWaalsContact O-CG1 3.29Å; G427-I431 WeakPolarHBondContact O-CG1 3.21Å; G427-I431 PolarHBondContact O-N 2.9Å; F428-I431 PolarHBondContact O-N 2.89Å; F428-I431 VanDerWaalsContact O-N 3.14Å; K429-I431 VanDerWaalsContact C-N 3.3Å; K429-I431 PolarHBondContact O-N 3.4Å; I431-G434 PolarHBondContact O-N 2.81Å; I431-Y436 HydrophobicContact CG1-CD2 3.95Å; I431-F444 HydrophobicContact CD1-CD1 3.86Å; I431-F444 HydrophobicContact CD1-CE1 3.62Å; I431-F444 HydrophobicContact CG1-CD1 4.49Å; I431-F444 HydrophobicContact CG1-CE1 3.76Å; I431-F444 HydrophobicContact CG1-CZ 4.46Å; I431-I450 HydrophobicContact CD1-CD1 4.1Å; I431-I450 HydrophobicContact CG1-CD1 4.09Å
432	M	91.9	Very high	92.4	Very high	33 Å²	33	53.3 Å²	53.3	16%	0.163	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-39.8	178.9	-64.7	-165.9	-48.3	0	0	112.5	T357 G360 V361 I364 R393 F428 K429 G434	T357-M432 HydrophobicContact CG2-CE 4.1Å; G360-M432 VanDerWaalsContact CA-SD 3.52Å; V361-M432 HydrophobicContact CG2-CG 4.15Å; V361-M432 HydrophobicContact CG2-SD 3.81Å; V361-M432 PolarHBondContact N-SD 2.85Å; I364-M432 HydrophobicContact CD1-CB 4.1Å; I364-M432 HydrophobicContact CD1-CG 3.74Å; I364-M432 HydrophobicContact CD1-SD 4.33Å; R393-M432 PolarHBondContact NH1-O 2.84Å; F428-M432 VanDerWaalsContact O-CG 3.31Å; F428-M432 WeakPolarHBondContact O-CG 3.34Å; F428-M432 PolarHBondContact O-N 3.28Å; K429-M432 PolarHBondContact O-N 3.31Å; K429-M432 VanDerWaalsContact O-N 3.13Å; M432-G434 PolarHBondContact O-N 3.39Å
433	E	92.3	Very high	92.4	Very high	113 Å²	113	45.7 Å²	45.7	53%	0.528	22%	0.221	S	C	.	.	H	α-helix	trans	-75.8	-12.5	-180	-69.3	175.7	178.8	0	0	112.5	K429	K429-E433 WeakPolarHBondContact CE-OE1 3.26Å; K429-E433 HydrophobicContact CG-CG 4.4Å; K429-E433 WeakPolarHBondContact CG-OE1 3.33Å; K429-E433 WeakPolarHBondContact O-CB 3.42Å; K429-E433 WeakPolarHBondContact O-CG 3.49Å; K429-E433 PolarHBondContact O-N 2.84Å
434	G	89.4	Confident	92.3	Very high	16 Å²	16	43.6 Å²	43.6	17%	0.165	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	9.8	173.9	0	0	0	0	0	115.3	R393 G430 I431 M432 Y436 D437	R393-G434 VanDerWaalsContact NH2-CA 3.26Å; G430-G434 PolarHBondContact O-N 3.04Å; I431-G434 PolarHBondContact O-N 2.81Å; M432-G434 PolarHBondContact O-N 3.39Å; G434-Y436 PolarHBondContact O-N 2.97Å; G434-Y436 VanDerWaalsContact O-N 3.1Å; G434-D437 WeakPolarHBondContact CA-OD2 3.41Å; G434-D437 PolarHBondContact O-N 3.01Å
435	E	91.8	Very high	92.2	Very high	108 Å²	108	47.6 Å²	47.6	51%	0.505	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-29	-179.8	-59.8	-169.8	166.2	0	0	112.2	G430 H438	G430-E435 WeakPolarHBondContact O-CB 3.44Å; G430-E435 PolarHBondContact O-N 3.25Å; E435-H438 PolarHBondContact O-CE1 2.66Å; E435-H438 PolarHBondContact O-ND1 2.63Å
436	Y	91.9	Very high	91.9	Very high	35 Å²	35	47.8 Å²	47.8	14%	0.137	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	20.2	-175.4	-48.8	-66.1	0	0	0	113.9	K396 I431 G434 H438 L439 I450 V454	K396-Y436 PolarHBondContact NZ-O 2.85Å; I431-Y436 HydrophobicContact CG1-CD2 3.95Å; G434-Y436 PolarHBondContact O-N 2.97Å; G434-Y436 VanDerWaalsContact O-N 3.1Å; Y436-H438 PolarHBondContact O-N 3.08Å; Y436-L439 HydrophobicContact CD1-CD1 3.95Å; Y436-L439 HydrophobicContact CG-CD1 4.27Å; Y436-L439 PolarHBondContact O-N 2.86Å; Y436-L439 VanDerWaalsContact O-N 3.09Å; Y436-I450 HydrophobicContact CD1-CG1 4.46Å; Y436-I450 HydrophobicContact CD2-CD1 3.76Å; Y436-I450 HydrophobicContact CD2-CG1 3.85Å; Y436-I450 HydrophobicContact CE1-CG1 3.99Å; Y436-I450 HydrophobicContact CE2-CD1 3.74Å; Y436-I450 HydrophobicContact CE2-CG1 3.29Å; Y436-I450 HydrophobicContact CG-CD1 4.24Å; Y436-I450 HydrophobicContact CG-CG1 4.39Å; Y436-V454 HydrophobicContact CD1-CG2 4.1Å; Y436-V454 HydrophobicContact CE1-CG2 3.92Å
437	D	91.2	Very high	91.8	Very high	51 Å²	51	43.5 Å²	43.5	27%	0.273	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-29.3	-179.6	-78.5	-17.3	0	0	0	113.1	R393 K396 G434 L439	R393-D437 WeakPolarHBondContact CG-OD1 3.42Å; R393-D437 IonicContact CZ-OD1 2.79Å; R393-D437 IonicContact CZ-OD2 3.91Å; R393-D437 IonicContact NE-OD1 2.69Å; R393-D437 PolarHBondContact NE-OD1 3.37Å; R393-D437 IonicContact NE-OD2 3Å; R393-D437 PolarHBondContact NE-OD2 3.42Å; R393-D437 VanDerWaalsContact NE-OD2 3.13Å; R393-D437 IonicContact NH2-OD1 3.32Å; R393-D437 IonicContact NH2-OD2 3.98Å; R393-D437 PolarHBondContact NH2-OD2 2.73Å; K396-D437 PolarHBondContact NZ-O 3.48Å; G434-D437 WeakPolarHBondContact CA-OD2 3.41Å; G434-D437 PolarHBondContact O-N 3.01Å; D437-L439 VanDerWaalsContact C-N 3.3Å; D437-L439 PolarHBondContact O-N 3.41Å
438	H	90.6	Very high	91.6	Very high	145 Å²	145	43.5 Å²	43.5	67%	0.671	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.9	177.3	64	-78.8	0	0	0	114.1	E435 Y436	E435-H438 PolarHBondContact O-CE1 2.66Å; E435-H438 PolarHBondContact O-ND1 2.63Å; Y436-H438 PolarHBondContact O-N 3.08Å
439	L	91.7	Very high	91.3	Very high	14 Å²	14	44.6 Å²	44.6	7%	0.073	22%	0.219	C	C	.	.	S	Bend	trans	-79.4	143.7	-178.2	-57.4	-173.9	0	0	0	111.7	K396 Y436 D437 F444 V454 A457	K396-L439 WeakPolarHBondContact CE-O 3.36Å; K396-L439 PolarHBondContact NZ-O 3.14Å; Y436-L439 HydrophobicContact CD1-CD1 3.95Å; Y436-L439 HydrophobicContact CG-CD1 4.27Å; Y436-L439 PolarHBondContact O-N 2.86Å; Y436-L439 VanDerWaalsContact O-N 3.09Å; D437-L439 VanDerWaalsContact C-N 3.3Å; D437-L439 PolarHBondContact O-N 3.41Å; L439-F444 HydrophobicContact CB-CE2 3.83Å; L439-F444 HydrophobicContact CB-CZ 4.12Å; L439-F444 HydrophobicContact CD1-CE2 4.46Å; L439-F444 HydrophobicContact CD1-CZ 4.07Å; L439-V454 HydrophobicContact CD1-CG2 3.91Å; L439-A457 HydrophobicContact CB-CB 4.33Å; L439-A457 HydrophobicContact CD1-CB 4.45Å; L439-A457 HydrophobicContact CD2-CB 3.65Å; L439-A457 HydrophobicContact CG-CB 4.36Å
440	P	91.8	Very high	91.2	Very high	56 Å²	56	41.8 Å²	41.8	36%	0.364	21%	0.206	S	C	.	.			trans	-67.7	142.4	175.7	27.8	-32.9	0	0	0	111	Q442 A443 A457 L460	P440-Q442 PolarHBondContact O-N 2.96Å; P440-Q442 VanDerWaalsContact O-N 3.08Å; P440-A443 HydrophobicContact CG-CB 4.16Å; P440-A443 VanDerWaalsContact O-CB 3.28Å; P440-A443 WeakPolarHBondContact O-CB 3.34Å; P440-A443 PolarHBondContact O-N 2.83Å; P440-A457 HydrophobicContact CG-CB 4.24Å; P440-L460 HydrophobicContact CG-CB 4.41Å; P440-L460 HydrophobicContact CG-CD1 4.06Å
441	E	90	Very high	91.1	Very high	43 Å²	43	45.1 Å²	45.1	20%	0.201	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-54.2	-33.2	-179.8	-62.5	176.2	-175.5	0	0	112.9	R395 K396 R399 A443 F444	R395-E441 HydrophobicContact CB-CG 4.34Å; R395-E441 WeakPolarHBondContact CD-OE1 3.43Å; R395-E441 IonicContact NH1-OE1 3.42Å; K396-E441 HydrophobicContact CG-CB 4.45Å; K396-E441 HydrophobicContact CG-CG 4.13Å; R399-E441 WeakPolarHBondContact CD-O 3.21Å; R399-E441 IonicContact CZ-OE2 2.77Å; R399-E441 VanDerWaalsContact CZ-OE2 3.25Å; R399-E441 IonicContact NH1-OE2 3.62Å; R399-E441 PolarHBondContact NH1-OE2 2.79Å; R399-E441 IonicContact NH2-OE2 3.51Å; R399-E441 PolarHBondContact NH2-OE2 2.94Å; E441-A443 PolarHBondContact O-N 2.94Å; E441-F444 PolarHBondContact O-N 3.03Å
442	Q	90.9	Very high	90.9	Very high	121 Å²	121	47.4 Å²	47.4	57%	0.565	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-68.5	-19.9	-178.1	-167.7	171.4	10	0	0	113.1	R399 P440 F444 Y445 L460	R399-Q442 VanDerWaalsContact NH1-N 3.18Å; P440-Q442 PolarHBondContact O-N 2.96Å; P440-Q442 VanDerWaalsContact O-N 3.08Å; Q442-F444 PolarHBondContact O-N 2.85Å; Q442-Y445 PolarHBondContact O-N 2.9Å; Q442-L460 HydrophobicContact CB-CD1 4.09Å; Q442-L460 HydrophobicContact CG-CD1 4.38Å
443	A	91.5	Very high	90.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-68.4	-24.5	175.8	0	0	0	0	0	112.8	P440 E441 V447 A453 K456 A457 L460	P440-A443 HydrophobicContact CG-CB 4.16Å; P440-A443 VanDerWaalsContact O-CB 3.28Å; P440-A443 WeakPolarHBondContact O-CB 3.34Å; P440-A443 PolarHBondContact O-N 2.83Å; E441-A443 PolarHBondContact O-N 2.94Å; A443-V447 WeakPolarHBondContact O-CG1 3.38Å; A443-A453 WeakPolarHBondContact CB-O 3.32Å; A443-A453 WeakPolarHBondContact O-CA 3.38Å; A443-K456 HydrophobicContact CB-CB 4.48Å; A443-A457 HydrophobicContact CB-CB 3.71Å; A443-L460 HydrophobicContact CB-CD1 4.24Å
444	F	92.7	Very high	90.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-85.4	-7.5	-179.3	-64.8	-91	0	0	0	113.7	K396 R399 F400 I431 L439 E441 Q442 V447 I450 A453	K396-F444 HydrophobicContact CB-CD2 4.02Å; K396-F444 HydrophobicContact CB-CE2 4.12Å; K396-F444 HydrophobicContact CB-CG 4.25Å; K396-F444 HydrophobicContact CB-CZ 4.43Å; K396-F444 HydrophobicContact CD-CD2 4.27Å; K396-F444 HydrophobicContact CD-CE2 3.66Å; K396-F444 HydrophobicContact CD-CZ 4.06Å; K396-F444 HydrophobicContact CG-CD2 3.8Å; K396-F444 HydrophobicContact CG-CE2 3.72Å; K396-F444 HydrophobicContact CG-CZ 4.37Å; R399-F444 CarbonylContact C-O 3.53Å; R399-F444 HydrophobicContact CB-CB 4Å; F400-F444 WeakPolarHBondContact CA-O 3.47Å; F400-F444 HydrophobicContact CB-CB 4.07Å; F400-F444 HydrophobicContact CB-CD1 3.97Å; F400-F444 HydrophobicContact CB-CG 4.46Å; F400-F444 HydrophobicContact CD2-CB 4.49Å; F400-F444 AromaticContact CD2-CD1 3.9Å; F400-F444 HydrophobicContact CD2-CD1 3.9Å; F400-F444 HydrophobicContact CG-CD1 4.08Å; F400-F444 PolarHBondContact N-O 3.16Å; I431-F444 HydrophobicContact CD1-CD1 3.86Å; I431-F444 HydrophobicContact CD1-CE1 3.62Å; I431-F444 HydrophobicContact CG1-CD1 4.49Å; I431-F444 HydrophobicContact CG1-CE1 3.76Å; I431-F444 HydrophobicContact CG1-CZ 4.46Å; L439-F444 HydrophobicContact CB-CE2 3.83Å; L439-F444 HydrophobicContact CB-CZ 4.12Å; L439-F444 HydrophobicContact CD1-CE2 4.46Å; L439-F444 HydrophobicContact CD1-CZ 4.07Å; E441-F444 PolarHBondContact O-N 3.03Å; Q442-F444 PolarHBondContact O-N 2.85Å; F444-V447 WeakPolarHBondContact O-CG2 3.4Å; F444-I450 HydrophobicContact CD1-CD1 4.32Å; F444-I450 HydrophobicContact CE1-CD1 3.7Å; F444-A453 HydrophobicContact CD1-CB 4.03Å; F444-A453 HydrophobicContact CE1-CB 4.2Å; F444-A453 HydrophobicContact CG-CB 4.47Å
445	Y	92.4	Very high	90.8	Very high	85 Å²	85	47.4 Å²	47.4	33%	0.333	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	130.3	-177.3	-179.9	-105.5	0	0	0	111.7	G330 Q442 V447 K456	G330-Y445 WeakPolarHBondContact O-CE2 3.47Å; G330-Y445 PolarHBondContact O-OH 3.26Å; Q442-Y445 PolarHBondContact O-N 2.9Å; Y445-V447 PolarHBondContact O-N 3.11Å; Y445-K456 PolarHBondContact O-NZ 2.78Å
446	M	88.5	Confident	90.7	Very high	23 Å²	23	45.5 Å²	45.5	11%	0.113	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	51.8	177.2	-65.7	-70.5	-81.6	0	0	112.8	S402 P404 T412	S402-M446 PolarHBondContact OG-N 2.85Å; P404-M446 HydrophobicContact CB-CE 4.07Å; T412-M446 HydrophobicContact CG2-CE 3.79Å
447	V	90.3	Very high	90.5	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.03	22%	0.218	C	C	.	.			trans	-122.7	152.2	175	-63.2	0	0	0	0	110.1	K132 F400 A443 F444 Y445 E452 A453 K456	K132-V447 PolarHBondContact NZ-O 3.18Å; F400-V447 HydrophobicContact CD2-CG2 3.85Å; F400-V447 HydrophobicContact CE2-CG2 3.92Å; A443-V447 WeakPolarHBondContact O-CG1 3.38Å; F444-V447 WeakPolarHBondContact O-CG2 3.4Å; Y445-V447 PolarHBondContact O-N 3.11Å; V447-E452 HydrophobicContact CB-CB 4.09Å; V447-E452 HydrophobicContact CG1-CB 4.36Å; V447-A453 HydrophobicContact CG2-CB 4.19Å; V447-K456 HydrophobicContact CG1-CD 3.83Å
448	G	88.3	Confident	90.4	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.01	24%	0.239	C	C	.	.	S	Bend	trans	-78.1	-89.1	175.6	0	0	0	0	0	110.5	K132 E452	K132-G448 WeakPolarHBondContact CD-O 3.26Å; K132-G448 WeakPolarHBondContact CE-O 3.34Å; K132-G448 PolarHBondContact NZ-O 3.35Å; G448-E452 PolarHBondContact N-OE2 2.85Å
449	S	90.9	Very high	90	Very high	23 Å²	23	51.5 Å²	51.5	16%	0.161	24%	0.244	C	C	.	.	S	Bend	trans	-84.1	170.3	-179.4	82.4	0	0	0	0	113	E451 E452	S449-E451 VanDerWaalsContact C-N 3.3Å; S449-E451 WeakPolarHBondContact CB-OE2 3.43Å; S449-E451 PolarHBondContact O-N 3.2Å; S449-E451 PolarHBondContact OG-N 3.36Å; S449-E451 PolarHBondContact OG-OE2 2.79Å; S449-E452 PolarHBondContact O-N 2.83Å
450	I	90.8	Very high	89.5	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-69.2	-29.7	179.4	-165.6	60.2	0	0	0	112.6	F400 I431 Y436 F444 E452 A453 V454	F400-I450 HydrophobicContact CE2-CD1 4.23Å; F400-I450 HydrophobicContact CZ-CB 4.24Å; F400-I450 HydrophobicContact CZ-CD1 4.19Å; I431-I450 HydrophobicContact CD1-CD1 4.1Å; I431-I450 HydrophobicContact CG1-CD1 4.09Å; Y436-I450 HydrophobicContact CD1-CG1 4.46Å; Y436-I450 HydrophobicContact CD2-CD1 3.76Å; Y436-I450 HydrophobicContact CD2-CG1 3.85Å; Y436-I450 HydrophobicContact CE1-CG1 3.99Å; Y436-I450 HydrophobicContact CE2-CD1 3.74Å; Y436-I450 HydrophobicContact CE2-CG1 3.29Å; Y436-I450 HydrophobicContact CG-CD1 4.24Å; Y436-I450 HydrophobicContact CG-CG1 4.39Å; F444-I450 HydrophobicContact CD1-CD1 4.32Å; F444-I450 HydrophobicContact CE1-CD1 3.7Å; I450-E452 PolarHBondContact O-N 2.84Å; I450-A453 HydrophobicContact CD1-CB 4.32Å; I450-A453 WeakPolarHBondContact O-CB 3.01Å; I450-A453 PolarHBondContact O-N 2.91Å; I450-A453 VanDerWaalsContact O-N 3.11Å; I450-V454 WeakPolarHBondContact O-CG2 3.17Å; I450-V454 PolarHBondContact O-N 2.89Å; I450-V454 VanDerWaalsContact O-N 3.08Å
451	E	91.3	Very high	89.4	Confident	74 Å²	74	56.9 Å²	56.9	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-36.1	176.7	-63.1	73	-157.3	0	0	111.2	R426 S449 A453 V454 E455	R426-E451 IonicContact CZ-OE1 3.16Å; R426-E451 IonicContact NE-OE1 3.36Å; R426-E451 PolarHBondContact NE-OE1 2.86Å; R426-E451 IonicContact NH2-OE1 2.75Å; R426-E451 PolarHBondContact NH2-OE1 3.16Å; R426-E451 IonicContact NH2-OE2 2.71Å; R426-E451 PolarHBondContact NH2-OE2 3.05Å; S449-E451 VanDerWaalsContact C-N 3.3Å; S449-E451 WeakPolarHBondContact CB-OE2 3.43Å; S449-E451 PolarHBondContact O-N 3.2Å; S449-E451 PolarHBondContact OG-N 3.36Å; S449-E451 PolarHBondContact OG-OE2 2.79Å; E451-A453 VanDerWaalsContact C-N 3.34Å; E451-V454 WeakPolarHBondContact O-CB 3.42Å; E451-V454 PolarHBondContact O-N 2.99Å; E451-E455 WeakPolarHBondContact O-CG 3.44Å; E451-E455 PolarHBondContact O-N 2.86Å
452	E	89.5	Confident	89.3	Confident	49 Å²	49	57.6 Å²	57.6	23%	0.229	27%	0.271	C	S	.	.	H	α-helix	trans	-68.1	-34.9	175.8	-60.7	-176.1	176.5	0	0	112.5	K417 V447 G448 S449 I450 V454 E455 K456	K417-E452 WeakPolarHBondContact CD-OE1 3.34Å; K417-E452 WeakPolarHBondContact CD-OE2 3.44Å; K417-E452 IonicContact NZ-OE1 2.73Å; K417-E452 PolarHBondContact NZ-OE1 3.46Å; K417-E452 IonicContact NZ-OE2 2.85Å; K417-E452 PolarHBondContact NZ-OE2 2.75Å; V447-E452 HydrophobicContact CB-CB 4.09Å; V447-E452 HydrophobicContact CG1-CB 4.36Å; G448-E452 PolarHBondContact N-OE2 2.85Å; S449-E452 PolarHBondContact O-N 2.83Å; I450-E452 PolarHBondContact O-N 2.84Å; E452-V454 VanDerWaalsContact C-N 3.32Å; E452-E455 PolarHBondContact O-N 3.22Å; E452-K456 WeakPolarHBondContact O-CB 3.4Å; E452-K456 PolarHBondContact O-N 3.47Å
453	A	89.2	Confident	89.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-43.7	172.6	0	0	0	0	0	110	A443 F444 V447 I450 E451 E455 K456 A457	A443-A453 WeakPolarHBondContact CB-O 3.32Å; A443-A453 WeakPolarHBondContact O-CA 3.38Å; F444-A453 HydrophobicContact CD1-CB 4.03Å; F444-A453 HydrophobicContact CE1-CB 4.2Å; F444-A453 HydrophobicContact CG-CB 4.47Å; V447-A453 HydrophobicContact CG2-CB 4.19Å; I450-A453 HydrophobicContact CD1-CB 4.32Å; I450-A453 WeakPolarHBondContact O-CB 3.01Å; I450-A453 PolarHBondContact O-N 2.91Å; I450-A453 VanDerWaalsContact O-N 3.11Å; E451-A453 VanDerWaalsContact C-N 3.34Å; A453-E455 PolarHBondContact O-N 2.99Å; A453-K456 PolarHBondContact O-N 3.16Å; A453-A457 VanDerWaalsContact O-CB 3.3Å; A453-A457 WeakPolarHBondContact O-CB 3.29Å; A453-A457 PolarHBondContact O-N 3.09Å
454	V	91.9	Very high	89.1	Confident	41 Å²	41	57.2 Å²	57.2	25%	0.248	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-42.9	175.2	177.2	0	0	0	0	111.3	Y436 L439 I450 E451 E452 K458	Y436-V454 HydrophobicContact CD1-CG2 4.1Å; Y436-V454 HydrophobicContact CE1-CG2 3.92Å; L439-V454 HydrophobicContact CD1-CG2 3.91Å; I450-V454 WeakPolarHBondContact O-CG2 3.17Å; I450-V454 PolarHBondContact O-N 2.89Å; I450-V454 VanDerWaalsContact O-N 3.08Å; E451-V454 WeakPolarHBondContact O-CB 3.42Å; E451-V454 PolarHBondContact O-N 2.99Å; E452-V454 VanDerWaalsContact C-N 3.32Å; V454-K458 WeakPolarHBondContact O-CG 3.29Å; V454-K458 PolarHBondContact O-N 2.84Å
455	E	90.4	Very high	88.9	Confident	120 Å²	120	60.8 Å²	60.8	56%	0.561	29%	0.287	S	S	*	.	H	α-helix	trans	-67.6	-41.4	177.7	-74.2	-171.9	175	0	0	113	E451 E452 A453 A457 K458	E451-E455 WeakPolarHBondContact O-CG 3.44Å; E451-E455 PolarHBondContact O-N 2.86Å; E452-E455 PolarHBondContact O-N 3.22Å; A453-E455 PolarHBondContact O-N 2.99Å; E455-A457 VanDerWaalsContact C-N 3.32Å; E455-K458 PolarHBondContact O-N 2.93Å
456	K	88.9	Confident	88.6	Confident	68 Å²	68	59.2 Å²	59.2	30%	0.296	28%	0.284	S	S	.	.	H	α-helix	trans	-65.2	-38.6	177.5	-172.1	168.8	178.1	173.6	0	111.1	A443 Y445 V447 E452 A453 K458 K459 L460	A443-K456 HydrophobicContact CB-CB 4.48Å; Y445-K456 PolarHBondContact O-NZ 2.78Å; V447-K456 HydrophobicContact CG1-CD 3.83Å; E452-K456 WeakPolarHBondContact O-CB 3.4Å; E452-K456 PolarHBondContact O-N 3.47Å; A453-K456 PolarHBondContact O-N 3.16Å; K456-K458 VanDerWaalsContact C-N 3.27Å; K456-K458 PolarHBondContact O-N 3.48Å; K456-K459 PolarHBondContact O-N 3.49Å; K456-K459 VanDerWaalsContact O-N 3.09Å; K456-L460 PolarHBondContact O-N 2.77Å
457	A	88.2	Confident	88.7	Confident	11 Å²	11	61.8 Å²	61.8	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-30.9	175.2	0	0	0	0	0	113.5	L439 P440 A443 A453 E455 K459	L439-A457 HydrophobicContact CB-CB 4.33Å; L439-A457 HydrophobicContact CD1-CB 4.45Å; L439-A457 HydrophobicContact CD2-CB 3.65Å; L439-A457 HydrophobicContact CG-CB 4.36Å; P440-A457 HydrophobicContact CG-CB 4.24Å; A443-A457 HydrophobicContact CB-CB 3.71Å; A453-A457 VanDerWaalsContact O-CB 3.3Å; A453-A457 WeakPolarHBondContact O-CB 3.29Å; A453-A457 PolarHBondContact O-N 3.09Å; E455-A457 VanDerWaalsContact C-N 3.32Å; A457-K459 PolarHBondContact O-N 3.21Å
458	K	87.9	Confident	88.5	Confident	165 Å²	165	66.2 Å²	66.2	72%	0.717	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.7	175.7	-68.8	171.3	-176	172.4	0	113.3	V454 E455 K456	V454-K458 WeakPolarHBondContact O-CG 3.29Å; V454-K458 PolarHBondContact O-N 2.84Å; E455-K458 PolarHBondContact O-N 2.93Å; K456-K458 VanDerWaalsContact C-N 3.27Å; K456-K458 PolarHBondContact O-N 3.48Å
459	K	83.1	Confident	88.6	Confident	181 Å²	181	71.6 Å²	71.6	79%	0.787	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-18	-179	-64.5	178.7	-177.6	173.4	0	112.9	K456 A457	K456-K459 PolarHBondContact O-N 3.49Å; K456-K459 VanDerWaalsContact O-N 3.09Å; A457-K459 PolarHBondContact O-N 3.21Å
460	L	80.5	Confident	88.3	Confident	126 Å²	126	76 Å²	76	66%	0.66	36%	0.358	S	S	*	.			trans	-86.4	0	173.1	-68.3	171.3	0	0	0	109.1	P440 Q442 A443 K456	P440-L460 HydrophobicContact CG-CB 4.41Å; P440-L460 HydrophobicContact CG-CD1 4.06Å; Q442-L460 HydrophobicContact CB-CD1 4.09Å; Q442-L460 HydrophobicContact CG-CD1 4.38Å; A443-L460 HydrophobicContact CB-CD1 4.24Å; K456-L460 PolarHBondContact O-N 2.77Å

Retrieved 460 of 460 residues in 127.9 ms (Link to these results)

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