A0A077Z8Z8_TRITR Loading...

CAP domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z8Z8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 317 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	20.6	Very low	29.5	Very low	230 Å²	230	89.1 Å²	89.1	100%	1.133	51%	0.505	S	S	*	.				0	115.1	0	-71.1	171.5	-179.8	0	0	106.6	V3	M1-V3 PolarHBondContact O-N 3.21Å
2	P	22.8	Very low	30.3	Very low	130 Å²	130	89.8 Å²	89.8	84%	0.844	50%	0.498	S	S	*	.			trans	-71.7	113.4	175	30.8	-27.3	0	0	0	106.4	N4	P2-N4 PolarHBondContact O-N 2.99Å
3	V	25.2	Very low	31.8	Very low	120 Å²	120	91.5 Å²	91.5	73%	0.727	50%	0.498	S	S	*	.			trans	-62.9	120.7	169.2	-180	0	0	0	0	105.7	M1 A5	M1-V3 PolarHBondContact O-N 3.21Å; V3-A5 PolarHBondContact O-N 3.47Å
4	N	26.9	Very low	34	Very low	121 Å²	121	86.6 Å²	86.6	65%	0.647	47%	0.472	S	S	*	.			trans	-44.7	112.9	178.1	-99.9	-15.4	0	0	0	110	P2 L6	P2-N4 PolarHBondContact O-N 2.99Å; N4-L6 HydrophobicContact CB-CB 4.48Å; N4-L6 HydrophobicContact CB-CD1 4.47Å; N4-L6 PolarHBondContact O-N 3.41Å
5	A	27.4	Very low	36.3	Very low	35 Å²	35	85 Å²	85	29%	0.289	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-65.2	0.7	176.5	0	0	0	0	0	113.2	V3 A7 F8 N62	V3-A5 PolarHBondContact O-N 3.47Å; A5-A7 PolarHBondContact O-N 3.1Å; A5-A7 VanDerWaalsContact O-N 3.15Å; A5-F8 PolarHBondContact O-N 3.36Å; A5-N62 PolarHBondContact O-ND2 3.46Å; A5-N62 PolarHBondContact O-OD1 3.04Å
6	L	31.3	Very low	38.9	Very low	127 Å²	127	87.7 Å²	87.7	67%	0.665	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-60.7	-17	174	-80.8	151.8	0	0	0	113.8	N4	N4-L6 HydrophobicContact CB-CB 4.48Å; N4-L6 HydrophobicContact CB-CD1 4.47Å; N4-L6 PolarHBondContact O-N 3.41Å
7	A	28	Very low	41.4	Very low	44 Å²	44	83.8 Å²	83.8	36%	0.364	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-102.6	7.2	177.5	0	0	0	0	0	114.5	A5 L148	A5-A7 PolarHBondContact O-N 3.1Å; A5-A7 VanDerWaalsContact O-N 3.15Å; A7-L148 VanDerWaalsContact O-CD2 3.27Å; A7-L148 WeakPolarHBondContact O-CD2 3.2Å
8	F	30.2	Very low	43.6	Very low	62 Å²	62	84.1 Å²	84.1	27%	0.272	46%	0.457	S	S	.	.			trans	-112.4	25.8	-160.6	-105.7	-83.8	0	0	0	116.6	A5 Y129	A5-F8 PolarHBondContact O-N 3.36Å; F8-Y129 HydrophobicContact CE1-CD2 4.2Å; F8-Y129 HydrophobicContact CE1-CE2 4.44Å
9	I	37.9	Very low	45.9	Very low	43 Å²	43	87.5 Å²	87.5	22%	0.221	47%	0.47	C	S	.	.	S	Bend	trans	-105.4	100	167.5	-55.3	176	0	0	0	106.5	V58 V61	I9-V58 HydrophobicContact CD1-CB 4.41Å; I9-V58 HydrophobicContact CD1-CG1 3.68Å; I9-V58 HydrophobicContact CD1-CG2 4.35Å; I9-V61 HydrophobicContact CD1-CG1 4.37Å
10	L	34.9	Very low	48.1	Very low	26 Å²	26	83.5 Å²	83.5	14%	0.136	45%	0.448	C	S	.	.			trans	98.2	107	159.1	-51.9	146.9	0	0	0	118	F12 T14 F118 L148	L10-F12 WeakPolarHBondContact CB-O 3.19Å; L10-F12 PolarHBondContact O-N 2.92Å; L10-T14 HydrophobicContact CB-CG2 3.92Å; L10-T14 HydrophobicContact CD1-CG2 3.96Å; L10-T14 WeakPolarHBondContact CD1-OG1 3.31Å; L10-T14 HydrophobicContact CD2-CG2 3.15Å; L10-T14 HydrophobicContact CG-CG2 3.78Å; L10-F118 HydrophobicContact CD2-CE1 4.36Å; L10-L148 WeakPolarHBondContact O-CD2 3.43Å
11	T	39.6	Very low	50	Low	42 Å²	42	83.2 Å²	83.2	26%	0.258	44%	0.444	S	S	.	.	S	Bend	trans	-81.9	12.8	179	-7.2	0	0	0	0	114.4	W91	T11-W91 HydrophobicContact CG2-CB 4.46Å; T11-W91 WeakPolarHBondContact OG1-CA 3.33Å; T11-W91 WeakPolarHBondContact OG1-CB 3.26Å
12	F	38.8	Very low	53.1	Low	97 Å²	97	74.7 Å²	74.7	43%	0.425	41%	0.41	S	S	.	.	S	Bend	trans	-145.9	141.6	164.5	-126.5	-100.7	0	0	0	104.4	L10 T14 L142	L10-F12 WeakPolarHBondContact CB-O 3.19Å; L10-F12 PolarHBondContact O-N 2.92Å; F12-T14 VanDerWaalsContact C-N 3.29Å; F12-T14 WeakPolarHBondContact O-CG2 3.36Å; F12-T14 PolarHBondContact O-N 3.41Å; F12-L142 HydrophobicContact CD2-CD1 4.28Å; F12-L142 HydrophobicContact CE2-CD1 3.52Å; F12-L142 HydrophobicContact CZ-CD1 3.87Å; F12-L142 HydrophobicContact CZ-CD2 4.23Å
13	K	50.2	Low	56.4	Low	113 Å²	113	71.5 Å²	71.5	49%	0.491	38%	0.384	S	S	.	.			trans	-58	97	172.2	-170.1	-178.8	-177.6	-178.7	0	108.1	S15 G159	K13-S15 PolarHBondContact O-N 3.02Å; K13-G159 WeakPolarHBondContact CE-O 3.44Å; K13-G159 PolarHBondContact NZ-O 2.85Å
14	T	61.7	Low	59.7	Low	23 Å²	23	65.8 Å²	65.8	14%	0.141	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-70.8	117.2	175.8	61.3	0	0	0	0	105.8	L10 F12 G94 I96	L10-T14 HydrophobicContact CB-CG2 3.92Å; L10-T14 HydrophobicContact CD1-CG2 3.96Å; L10-T14 WeakPolarHBondContact CD1-OG1 3.31Å; L10-T14 HydrophobicContact CD2-CG2 3.15Å; L10-T14 HydrophobicContact CG-CG2 3.78Å; F12-T14 VanDerWaalsContact C-N 3.29Å; F12-T14 WeakPolarHBondContact O-CG2 3.36Å; F12-T14 PolarHBondContact O-N 3.41Å; T14-G94 WeakPolarHBondContact CB-O 3.44Å; T14-G94 WeakPolarHBondContact CG2-O 3.1Å; T14-I96 WeakPolarHBondContact OG1-CG2 3.39Å
15	S	69.8	Low	62.7	Low	62 Å²	62	63.2 Å²	63.2	43%	0.434	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-75.6	144.4	174.2	54.9	0	0	0	0	108.5	K13 K95 I96	K13-S15 PolarHBondContact O-N 3.02Å; S15-K95 WeakPolarHBondContact O-CA 3.31Å; S15-K95 WeakPolarHBondContact O-CB 3.45Å; S15-K95 WeakPolarHBondContact OG-CG 3.29Å; S15-I96 PolarHBondContact O-N 3.33Å
16	W	77.3	Confident	65.8	Low	128 Å²	128	67.1 Å²	67.1	49%	0.485	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-61.6	137.7	169.9	-168.1	-101.5	0	0	0	110.5	E21 I96 C98	W16-E21 HydrophobicContact CZ2-CB 3.78Å; W16-E21 VanDerWaalsContact CZ2-CD 3.43Å; W16-E21 HydrophobicContact CZ2-CG 3.75Å; W16-E21 WeakPolarHBondContact CZ2-OE2 3.44Å; W16-E21 PolarHBondContact NE1-OE2 3.03Å; W16-I96 CarbonylContact C-O 3.57Å; W16-I96 VanDerWaalsContact CA-O 3.28Å; W16-I96 WeakPolarHBondContact CA-O 3.33Å; W16-I96 HydrophobicContact CE3-CG2 4.32Å; W16-C98 HydrophobicContact CH2-CB 3.79Å; W16-C98 WeakPolarHBondContact CH2-O 3.44Å; W16-C98 HydrophobicContact CZ3-CB 4.06Å
17	D	82.2	Confident	68.7	Low	22 Å²	22	62 Å²	62	12%	0.118	32%	0.317	C	S	.	.			trans	-123.4	113.6	173.2	-165.5	-59.6	0	0	0	110	E19 L20 E21 K95 I96	D17-E19 VanDerWaalsContact C-N 3.26Å; D17-E19 PolarHBondContact O-N 2.77Å; D17-E19 WeakPolarHBondContact OD1-CB 3.43Å; D17-E19 PolarHBondContact OD1-N 2.94Å; D17-L20 HydrophobicContact CB-CB 4.08Å; D17-L20 HydrophobicContact CB-CD1 3.84Å; D17-L20 HydrophobicContact CB-CG 3.84Å; D17-L20 WeakPolarHBondContact O-CB 3.49Å; D17-L20 PolarHBondContact O-N 3.22Å; D17-L20 PolarHBondContact OD1-N 3.2Å; D17-E21 PolarHBondContact O-N 3.29Å; D17-K95 HydrophobicContact CB-CB 3.92Å; D17-K95 HydrophobicContact CB-CD 3.88Å; D17-K95 WeakPolarHBondContact OD2-CD 3.3Å; D17-K95 IonicContact OD2-NZ 2.64Å; D17-K95 PolarHBondContact OD2-NZ 3.46Å; D17-I96 PolarHBondContact N-O 3.15Å
18	P	80	Confident	71.6	Confident	88 Å²	88	59.9 Å²	59.9	57%	0.571	30%	0.299	S	S	*	.	H	α-helix	trans	-63	-27.4	-178.9	-22.5	32.9	0	0	0	114.2	E21 A22	P18-E21 PolarHBondContact O-N 3.47Å; P18-A22 WeakPolarHBondContact O-CB 3.42Å; P18-A22 PolarHBondContact O-N 2.96Å
19	E	87.9	Confident	74.5	Confident	150 Å²	150	61.4 Å²	61.4	70%	0.701	31%	0.31	S	S	*	.	H	α-helix	trans	-72.5	-38.6	177.3	-62.2	-175.6	179.5	0	0	110.5	D17 A22 E23	D17-E19 VanDerWaalsContact C-N 3.26Å; D17-E19 PolarHBondContact O-N 2.77Å; D17-E19 WeakPolarHBondContact OD1-CB 3.43Å; D17-E19 PolarHBondContact OD1-N 2.94Å; E19-A22 PolarHBondContact O-N 3.4Å; E19-E23 PolarHBondContact O-N 3.46Å
20	L	90.4	Very high	76.9	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.037	33%	0.328	C	S	.	.	H	α-helix	trans	-64.1	-40.7	172.1	-65.3	-176.9	0	0	0	111.5	D17 E23 A24 Y40 K95 L117	D17-L20 HydrophobicContact CB-CB 4.08Å; D17-L20 HydrophobicContact CB-CD1 3.84Å; D17-L20 HydrophobicContact CB-CG 3.84Å; D17-L20 WeakPolarHBondContact O-CB 3.49Å; D17-L20 PolarHBondContact O-N 3.22Å; D17-L20 PolarHBondContact OD1-N 3.2Å; L20-E23 PolarHBondContact O-N 3.3Å; L20-A24 VanDerWaalsContact O-CB 3.24Å; L20-A24 WeakPolarHBondContact O-CB 3.45Å; L20-A24 PolarHBondContact O-N 2.89Å; L20-Y40 HydrophobicContact CD2-CD1 3.43Å; L20-Y40 VanDerWaalsContact CD2-CD1 3.43Å; L20-Y40 HydrophobicContact CD2-CD2 4.44Å; L20-Y40 HydrophobicContact CD2-CE1 3.27Å; L20-Y40 HydrophobicContact CD2-CE2 4.32Å; L20-Y40 HydrophobicContact CD2-CG 4.02Å; L20-K95 HydrophobicContact CD1-CB 4.13Å; L20-L117 HydrophobicContact CB-CB 4.24Å; L20-L117 HydrophobicContact CD2-CB 4.21Å
21	E	86.8	Confident	79.4	Confident	78 Å²	78	66.1 Å²	66.1	36%	0.364	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-49.2	175	171.8	-179	-168.3	0	0	111.3	W16 D17 P18 E23 A24 Q25	W16-E21 HydrophobicContact CZ2-CB 3.78Å; W16-E21 VanDerWaalsContact CZ2-CD 3.43Å; W16-E21 HydrophobicContact CZ2-CG 3.75Å; W16-E21 WeakPolarHBondContact CZ2-OE2 3.44Å; W16-E21 PolarHBondContact NE1-OE2 3.03Å; D17-E21 PolarHBondContact O-N 3.29Å; P18-E21 PolarHBondContact O-N 3.47Å; E21-E23 VanDerWaalsContact C-N 3.31Å; E21-E23 PolarHBondContact O-N 3.5Å; E21-A24 WeakPolarHBondContact O-CB 3.41Å; E21-A24 PolarHBondContact O-N 3.11Å; E21-Q25 PolarHBondContact O-N 3.34Å
22	A	85.9	Confident	81.5	Confident	51 Å²	51	69.5 Å²	69.5	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-38.6	-179.8	0	0	0	0	0	112.3	P18 E19 Q25 K26	P18-A22 WeakPolarHBondContact O-CB 3.42Å; P18-A22 PolarHBondContact O-N 2.96Å; E19-A22 PolarHBondContact O-N 3.4Å; A22-Q25 PolarHBondContact O-N 3.33Å; A22-K26 PolarHBondContact O-N 3.05Å
23	E	92.8	Very high	83.5	Confident	62 Å²	62	69.7 Å²	69.7	29%	0.29	36%	0.36	S	S	.	.	H	α-helix	trans	-73	-37	176.3	-165.9	65.9	-168.1	0	0	112	E19 L20 E21 Q25 K26 I27 Y40 L117	E19-E23 PolarHBondContact O-N 3.46Å; L20-E23 PolarHBondContact O-N 3.3Å; E21-E23 VanDerWaalsContact C-N 3.31Å; E21-E23 PolarHBondContact O-N 3.5Å; E23-Q25 VanDerWaalsContact C-N 3.27Å; E23-Q25 PolarHBondContact O-N 3.01Å; E23-K26 PolarHBondContact O-N 3.34Å; E23-K26 WeakPolarHBondContact OE2-CD 3.45Å; E23-K26 WeakPolarHBondContact OE2-CE 3.41Å; E23-K26 IonicContact OE2-NZ 2.64Å; E23-K26 PolarHBondContact OE2-NZ 3.48Å; E23-I27 WeakPolarHBondContact O-CG1 3.34Å; E23-I27 PolarHBondContact O-N 3.46Å; E23-Y40 HydrophobicContact CG-CE2 4.26Å; E23-L117 HydrophobicContact CB-CD1 3.7Å; E23-L117 HydrophobicContact CG-CD1 3.79Å
24	A	93.4	Very high	85.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.3	-39.7	173.1	0	0	0	0	0	111.1	L20 E21 I27 S28 A99 T115 L117	L20-A24 VanDerWaalsContact O-CB 3.24Å; L20-A24 WeakPolarHBondContact O-CB 3.45Å; L20-A24 PolarHBondContact O-N 2.89Å; E21-A24 WeakPolarHBondContact O-CB 3.41Å; E21-A24 PolarHBondContact O-N 3.11Å; A24-I27 PolarHBondContact O-N 3.38Å; A24-S28 VanDerWaalsContact O-CB 3.24Å; A24-S28 WeakPolarHBondContact O-CB 3.44Å; A24-S28 PolarHBondContact O-N 3.07Å; A24-A99 HydrophobicContact CB-CB 3.92Å; A24-T115 HydrophobicContact CB-CG2 4.26Å; A24-L117 HydrophobicContact CB-CD1 4.18Å; A24-L117 HydrophobicContact CB-CG 3.94Å
25	Q	89.5	Confident	85.6	Confident	67 Å²	67	71.4 Å²	71.4	31%	0.313	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-46.4	177.1	-171.5	66.9	61	0	0	111.3	E21 A22 E23 I27 S28 D29 A99 S101	E21-Q25 PolarHBondContact O-N 3.34Å; A22-Q25 PolarHBondContact O-N 3.33Å; E23-Q25 VanDerWaalsContact C-N 3.27Å; E23-Q25 PolarHBondContact O-N 3.01Å; Q25-I27 VanDerWaalsContact C-N 3.27Å; Q25-I27 PolarHBondContact O-N 3.41Å; Q25-S28 WeakPolarHBondContact O-CB 3.3Å; Q25-S28 PolarHBondContact O-N 3.21Å; Q25-S28 VanDerWaalsContact O-N 3.14Å; Q25-D29 PolarHBondContact NE2-OD1 2.9Å; Q25-D29 WeakPolarHBondContact O-CB 3.36Å; Q25-D29 PolarHBondContact O-N 2.76Å; Q25-A99 HydrophobicContact CB-CB 3.7Å; Q25-A99 HydrophobicContact CG-CB 4.41Å; Q25-S101 PolarHBondContact NE2-OG 2.82Å
26	K	92.3	Very high	86.1	Confident	118 Å²	118	75 Å²	75	51%	0.513	38%	0.379	S	S	.	.	H	α-helix	trans	-58.5	-39.2	177.4	-64.7	174.6	-161.3	161.2	0	112.7	A22 E23 N30	A22-K26 PolarHBondContact O-N 3.05Å; E23-K26 PolarHBondContact O-N 3.34Å; E23-K26 WeakPolarHBondContact OE2-CD 3.45Å; E23-K26 WeakPolarHBondContact OE2-CE 3.41Å; E23-K26 IonicContact OE2-NZ 2.64Å; E23-K26 PolarHBondContact OE2-NZ 3.48Å; K26-N30 PolarHBondContact O-ND2 3.1Å; K26-N30 VanDerWaalsContact O-ND2 3.13Å
27	I	92.9	Very high	86.5	Confident	18 Å²	18	70.2 Å²	70.2	9%	0.092	36%	0.363	C	S	.	.	H	α-helix	trans	-69.8	-45.2	177.8	-64.8	170.3	0	0	0	110.1	E23 A24 Q25 D29 N30 V34 I42 M44 T115 L117	E23-I27 WeakPolarHBondContact O-CG1 3.34Å; E23-I27 PolarHBondContact O-N 3.46Å; A24-I27 PolarHBondContact O-N 3.38Å; Q25-I27 VanDerWaalsContact C-N 3.27Å; Q25-I27 PolarHBondContact O-N 3.41Å; I27-D29 VanDerWaalsContact C-N 3.34Å; I27-D29 PolarHBondContact O-N 2.93Å; I27-N30 PolarHBondContact O-N 2.85Å; I27-V34 HydrophobicContact CG2-CB 4.2Å; I27-V34 HydrophobicContact CG2-CG2 3.76Å; I27-I42 HydrophobicContact CD1-CD1 4.14Å; I27-I42 HydrophobicContact CG2-CD1 4.14Å; I27-M44 HydrophobicContact CG2-CE 4.2Å; I27-T115 HydrophobicContact CB-CG2 4.21Å; I27-T115 HydrophobicContact CG2-CG2 4.01Å; I27-L117 HydrophobicContact CD1-CD1 4.09Å; I27-L117 HydrophobicContact CD1-CD2 3.98Å; I27-L117 HydrophobicContact CD1-CG 4.48Å
28	S	89.3	Confident	86.5	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-60.4	-42.3	-179.3	-163.9	0	0	0	0	111.8	A24 Q25 N30 C31 S101 V113 T115	A24-S28 VanDerWaalsContact O-CB 3.24Å; A24-S28 WeakPolarHBondContact O-CB 3.44Å; A24-S28 PolarHBondContact O-N 3.07Å; Q25-S28 WeakPolarHBondContact O-CB 3.3Å; Q25-S28 PolarHBondContact O-N 3.21Å; Q25-S28 VanDerWaalsContact O-N 3.14Å; S28-N30 PolarHBondContact O-N 2.66Å; S28-C31 PolarHBondContact O-N 3.28Å; S28-S101 VanDerWaalsContact C-OG 3.25Å; S28-S101 WeakPolarHBondContact CB-OG 3.42Å; S28-S101 WeakPolarHBondContact O-CB 3.37Å; S28-S101 VanDerWaalsContact OG-CB 3.23Å; S28-S101 WeakPolarHBondContact OG-CB 3.36Å; S28-S101 PolarHBondContact OG-N 3.48Å; S28-S101 PolarHBondContact OG-OG 3.1Å; S28-V113 PolarHBondContact OG-O 3.21Å; S28-T115 WeakPolarHBondContact CB-OG1 3.29Å
29	D	90	Very high	86.9	Confident	95 Å²	95	79.9 Å²	79.9	51%	0.508	40%	0.402	S	S	.	.	H	α-helix	trans	-63.3	-26.4	-179.9	-71.2	-20.1	0	0	0	113.2	Q25 I27 C31 S101	Q25-D29 PolarHBondContact NE2-OD1 2.9Å; Q25-D29 WeakPolarHBondContact O-CB 3.36Å; Q25-D29 PolarHBondContact O-N 2.76Å; I27-D29 VanDerWaalsContact C-N 3.34Å; I27-D29 PolarHBondContact O-N 2.93Å; D29-C31 PolarHBondContact O-N 3.09Å; D29-S101 PolarHBondContact N-OG 2.85Å; D29-S101 PolarHBondContact OD1-OG 2.83Å; D29-S101 VanDerWaalsContact OD1-OG 3.05Å
30	N	89.9	Confident	87.1	Confident	112 Å²	112	74.4 Å²	74.4	60%	0.599	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-14.2	177.2	-69.4	-35.7	0	0	0	112.6	K26 I27 S28 L32	K26-N30 PolarHBondContact O-ND2 3.1Å; K26-N30 VanDerWaalsContact O-ND2 3.13Å; I27-N30 PolarHBondContact O-N 2.85Å; S28-N30 PolarHBondContact O-N 2.66Å; N30-L32 WeakPolarHBondContact O-CG 3.33Å; N30-L32 PolarHBondContact O-N 2.97Å; N30-L32 VanDerWaalsContact O-N 3.08Å
31	C	86.4	Confident	87.1	Confident	55 Å²	55	74 Å²	74	37%	0.372	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	25.7	178.1	-69	0	0	0	0	114.8	S28 D29 C103	S28-C31 PolarHBondContact O-N 3.28Å; D29-C31 PolarHBondContact O-N 3.09Å; C31-C103 WeakPolarHBondContact CA-SG 3.3Å; C31-C103 HydrophobicContact CB-CB 3.63Å; C31-C103 WeakPolarHBondContact CB-SG 3.46Å; C31-C103 WeakPolarHBondContact SG-CA 3.33Å; C31-C103 WeakPolarHBondContact SG-CB 3.19Å; C31-C103 CovalentContact SG-SG 2.03Å; C31-C103 PolarHBondContact SG-SG 3.41Å
32	L	84.3	Confident	87.4	Confident	113 Å²	113	71 Å²	71	59%	0.592	36%	0.36	S	S	*	.			trans	-103	147.9	176.6	-64	176	0	0	0	110.2	N30 V34 M44 Y46	N30-L32 WeakPolarHBondContact O-CG 3.33Å; N30-L32 PolarHBondContact O-N 2.97Å; N30-L32 VanDerWaalsContact O-N 3.08Å; L32-V34 PolarHBondContact O-N 2.98Å; L32-M44 WeakPolarHBondContact O-CE 3.28Å; L32-Y46 PolarHBondContact O-OH 3.39Å
33	I	80.5	Confident	87.7	Confident	101 Å²	101	68.6 Å²	68.6	52%	0.518	34%	0.34	S	S	.	.			trans	-74.6	119.7	168.4	-60.2	173.5	0	0	0	107.7	E35 Y46	I33-E35 HydrophobicContact CG2-CG 4.39Å; I33-Y46 WeakPolarHBondContact CA-OH 3.22Å; I33-Y46 HydrophobicContact CG1-CE2 4.12Å; I33-Y46 WeakPolarHBondContact CG1-OH 3.39Å
34	V	83.2	Confident	87.6	Confident	41 Å²	41	65.7 Å²	65.7	25%	0.248	33%	0.326	C	S	.	.			trans	-112.6	99.2	176	-177.9	0	0	0	0	108.2	I27 L32 K36 I42 M44	I27-V34 HydrophobicContact CG2-CB 4.2Å; I27-V34 HydrophobicContact CG2-CG2 3.76Å; L32-V34 PolarHBondContact O-N 2.98Å; V34-K36 VanDerWaalsContact C-N 3.29Å; V34-K36 VanDerWaalsContact CG1-O 3.26Å; V34-K36 WeakPolarHBondContact CG1-O 3.07Å; V34-K36 PolarHBondContact O-N 3.07Å; V34-I42 HydrophobicContact CB-CD1 3.88Å; V34-I42 HydrophobicContact CG1-CD1 3.84Å; V34-M44 HydrophobicContact CB-SD 4.02Å; V34-M44 PolarHBondContact N-SD 2.92Å; V34-M44 VanDerWaalsContact N-SD 3.36Å
35	E	73.7	Confident	87.4	Confident	131 Å²	131	66.5 Å²	66.5	61%	0.612	33%	0.331	S	S	*	.			trans	-69.4	-29.6	-179.6	-65.1	179.5	-172.7	0	0	112.6	I33	I33-E35 HydrophobicContact CG2-CG 4.39Å
36	K	79.6	Confident	87.3	Confident	137 Å²	137	66.7 Å²	66.7	60%	0.596	33%	0.33	S	S	*	.			trans	-142.5	135.6	-174.6	-70.7	179	170.5	175	0	110.7	V34 R121	V34-K36 VanDerWaalsContact C-N 3.29Å; V34-K36 VanDerWaalsContact CG1-O 3.26Å; V34-K36 WeakPolarHBondContact CG1-O 3.07Å; V34-K36 PolarHBondContact O-N 3.07Å; K36-R121 VanDerWaalsContact CE-NH2 3.35Å
37	N	84.6	Confident	87	Confident	28 Å²	28	61.3 Å²	61.3	15%	0.15	31%	0.306	C	S	.	.			trans	-111.3	138.1	165.8	-172.9	-69	0	0	0	108.4	K39 Y40 I42 R121	N37-K39 VanDerWaalsContact C-N 3.29Å; N37-K39 PolarHBondContact O-N 2.79Å; N37-K39 PolarHBondContact OD1-N 3.41Å; N37-Y40 PolarHBondContact OD1-N 3.13Å; N37-I42 HydrophobicContact CB-CB 4.16Å; N37-I42 HydrophobicContact CB-CG2 4.12Å; N37-R121 PolarHBondContact O-NH1 3.36Å
38	D	82.3	Confident	86.4	Confident	163 Å²	163	65 Å²	65	87%	0.872	33%	0.332	S	S	*	.	S	Bend	trans	-73.1	-24.9	-174.7	-68.4	-26.1	0	0	0	112.8
39	K	88.7	Confident	85.8	Confident	150 Å²	150	69 Å²	69	65%	0.652	35%	0.353	S	S	*	.	S	Bend	trans	-105.2	-38.7	-175.6	-172.6	175.1	176.2	-164.9	0	112.7	N37	N37-K39 VanDerWaalsContact C-N 3.29Å; N37-K39 PolarHBondContact O-N 2.79Å; N37-K39 PolarHBondContact OD1-N 3.41Å
40	Y	91.7	Very high	84.7	Confident	35 Å²	35	70.2 Å²	70.2	14%	0.137	37%	0.366	C	S	.	.	S	Bend	trans	-116.8	158.3	-170.1	-56.6	-64.9	0	0	0	112	L20 E23 N37 L117 F118	L20-Y40 HydrophobicContact CD2-CD1 3.43Å; L20-Y40 VanDerWaalsContact CD2-CD1 3.43Å; L20-Y40 HydrophobicContact CD2-CD2 4.44Å; L20-Y40 HydrophobicContact CD2-CE1 3.27Å; L20-Y40 HydrophobicContact CD2-CE2 4.32Å; L20-Y40 HydrophobicContact CD2-CG 4.02Å; E23-Y40 HydrophobicContact CG-CE2 4.26Å; N37-Y40 PolarHBondContact OD1-N 3.13Å; Y40-L117 HydrophobicContact CD2-CD1 4Å; Y40-L117 HydrophobicContact CG-CD1 4.49Å; Y40-F118 WeakPolarHBondContact CB-O 3.5Å
41	G	92	Very high	83.4	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	140.6	157.2	0	0	0	0	0	108.9	L117 F118	G41-L117 CarbonylContact O-C 3.5Å; G41-L117 VanDerWaalsContact O-CA 3.32Å; G41-L117 WeakPolarHBondContact O-CA 3.41Å; G41-F118 PolarHBondContact N-O 3.33Å; G41-F118 PolarHBondContact O-N 2.92Å
42	I	92.7	Very high	81.9	Confident	14 Å²	14	68.1 Å²	68.1	7%	0.072	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.5	178.4	-173.1	165	0	0	0	110.8	I27 V34 N37 M44 Q87 T115 C116 L117	I27-I42 HydrophobicContact CD1-CD1 4.14Å; I27-I42 HydrophobicContact CG2-CD1 4.14Å; V34-I42 HydrophobicContact CB-CD1 3.88Å; V34-I42 HydrophobicContact CG1-CD1 3.84Å; N37-I42 HydrophobicContact CB-CB 4.16Å; N37-I42 HydrophobicContact CB-CG2 4.12Å; I42-M44 HydrophobicContact CD1-CG 4.25Å; I42-M44 HydrophobicContact CD1-SD 4.23Å; I42-M44 HydrophobicContact CG1-CG 4.08Å; I42-Q87 WeakPolarHBondContact O-CG 3.35Å; I42-T115 HydrophobicContact CD1-CG2 4.16Å; I42-T115 HydrophobicContact CG1-CG2 4.35Å; I42-C116 WeakPolarHBondContact CA-O 3.5Å; I42-L117 HydrophobicContact CB-CD2 3.9Å; I42-L117 HydrophobicContact CD1-CD2 3.97Å; I42-L117 HydrophobicContact CG1-CD2 3.83Å
43	G	91.6	Very high	81	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.1	168.5	0	0	0	0	0	108.9	C116	G43-C116 PolarHBondContact N-O 2.9Å; G43-C116 PolarHBondContact O-N 2.81Å
44	M	91.1	Very high	80.6	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.3	174.4	-39.6	173.5	74.8	0	0	109.5	I27 L32 V34 I42 Y46 M84 V113 M114 T115	I27-M44 HydrophobicContact CG2-CE 4.2Å; L32-M44 WeakPolarHBondContact O-CE 3.28Å; V34-M44 HydrophobicContact CB-SD 4.02Å; V34-M44 PolarHBondContact N-SD 2.92Å; V34-M44 VanDerWaalsContact N-SD 3.36Å; I42-M44 HydrophobicContact CD1-CG 4.25Å; I42-M44 HydrophobicContact CD1-SD 4.23Å; I42-M44 HydrophobicContact CG1-CG 4.08Å; M44-Y46 HydrophobicContact CB-CE2 3.94Å; M44-Y46 WeakPolarHBondContact CE-OH 3.3Å; M44-Y46 PolarHBondContact SD-OH 2.89Å; M44-M84 HydrophobicContact CB-CE 3.45Å; M44-M84 VanDerWaalsContact CB-CE 3.45Å; M44-M84 HydrophobicContact CG-CE 3.96Å; M44-M84 WeakPolarHBondContact O-CE 3.32Å; M44-V113 HydrophobicContact CB-CG2 4.47Å; M44-V113 HydrophobicContact CE-CG2 3.84Å; M44-M114 CarbonylContact C-O 3.38Å; M44-M114 WeakPolarHBondContact CA-O 3.03Å; M44-T115 HydrophobicContact CE-CG2 4.23Å; M44-T115 WeakPolarHBondContact CE-OG1 3.28Å; M44-T115 HydrophobicContact CG-CG2 4.18Å
45	V	89.1	Confident	80.1	Confident	16 Å²	16	64.4 Å²	64.4	10%	0.097	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.9	170.3	-69.1	0	0	0	0	108.9	Y57 L60 V61 F88 V113 M114	V45-Y57 HydrophobicContact CG2-CD1 3.73Å; V45-Y57 HydrophobicContact CG2-CG 4.47Å; V45-L60 HydrophobicContact CB-CB 4.23Å; V45-L60 HydrophobicContact CG1-CB 4.37Å; V45-L60 HydrophobicContact CG2-CB 4.49Å; V45-V61 HydrophobicContact CG1-CG2 3.7Å; V45-F88 HydrophobicContact CG1-CE2 4.17Å; V45-V113 WeakPolarHBondContact O-CA 3.47Å; V45-M114 HydrophobicContact CG2-CB 3.81Å; V45-M114 HydrophobicContact CG2-CE 3.69Å; V45-M114 PolarHBondContact N-O 3.24Å; V45-M114 PolarHBondContact O-N 3.33Å
46	Y	87.5	Confident	80.4	Confident	72 Å²	72	61.5 Å²	61.5	28%	0.282	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.7	-175.9	-61.3	-96.1	0	0	0	109.4	L32 I33 M44 M84 K112 V113	L32-Y46 PolarHBondContact O-OH 3.39Å; I33-Y46 WeakPolarHBondContact CA-OH 3.22Å; I33-Y46 HydrophobicContact CG1-CE2 4.12Å; I33-Y46 WeakPolarHBondContact CG1-OH 3.39Å; M44-Y46 HydrophobicContact CB-CE2 3.94Å; M44-Y46 WeakPolarHBondContact CE-OH 3.3Å; M44-Y46 PolarHBondContact SD-OH 2.89Å; Y46-M84 HydrophobicContact CE2-CE 4.42Å; Y46-K112 WeakPolarHBondContact CA-O 3.26Å; Y46-V113 HydrophobicContact CD1-CB 3.62Å; Y46-V113 HydrophobicContact CD1-CG2 3.69Å; Y46-V113 HydrophobicContact CE1-CB 3.53Å; Y46-V113 HydrophobicContact CE1-CG1 4.47Å; Y46-V113 HydrophobicContact CE1-CG2 3.23Å; Y46-V113 HydrophobicContact CE2-CG2 4.26Å; Y46-V113 HydrophobicContact CG-CG2 4.37Å
47	T	85.8	Confident	80.6	Confident	4 Å²	4	55.4 Å²	55.4	3%	0.025	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	137.9	169.9	179.2	0	0	0	0	111.5	D49 V51 Y57 L60 T111 K112	T47-D49 WeakPolarHBondContact OG1-CB 3.46Å; T47-D49 PolarHBondContact OG1-N 3.05Å; T47-V51 HydrophobicContact CG2-CG2 3.25Å; T47-Y57 HydrophobicContact CG2-CE1 4.15Å; T47-L60 HydrophobicContact CG2-CD1 3.74Å; T47-T111 CarbonylContact O-C 3.58Å; T47-T111 WeakPolarHBondContact O-CA 3.19Å; T47-K112 HydrophobicContact CG2-CB 4.49Å; T47-K112 PolarHBondContact N-O 3.47Å; T47-K112 PolarHBondContact O-N 3.47Å
48	P	81.3	Confident	80.6	Confident	96 Å²	96	56.8 Å²	56.8	62%	0.623	33%	0.325	S	S	*	.	S	Bend	trans	-77.2	-13.2	168.8	33.8	-35	0	0	0	112.4	T111	P48-T111 HydrophobicContact CB-CG2 4.46Å
49	D	76.5	Confident	80.6	Confident	83 Å²	83	51.9 Å²	51.9	44%	0.444	30%	0.299	S	S	.	.	S	Bend	trans	-74.4	149	-174.7	-64.9	-28.7	0	0	0	111.5	T47 V51	T47-D49 WeakPolarHBondContact OG1-CB 3.46Å; T47-D49 PolarHBondContact OG1-N 3.05Å; D49-V51 WeakPolarHBondContact O-CG2 3.3Å; D49-V51 PolarHBondContact O-N 2.84Å
50	P	66.9	Low	80.6	Confident	122 Å²	122	46.4 Å²	46.4	79%	0.792	28%	0.277	S	S	*	.			trans	-58.1	108.7	166.9	-16.8	29	0	0	0	109.3	A52	P50-A52 PolarHBondContact O-N 2.76Å
51	V	62	Low	80.5	Confident	20 Å²	20	44.9 Å²	44.9	12%	0.121	27%	0.271	C	S	.	.			trans	-79.9	110.1	179.8	-165	0	0	0	0	108.9	T47 D49 S53 K56 Y57 K112	T47-V51 HydrophobicContact CG2-CG2 3.25Å; D49-V51 WeakPolarHBondContact O-CG2 3.3Å; D49-V51 PolarHBondContact O-N 2.84Å; V51-S53 WeakPolarHBondContact CG1-O 3.39Å; V51-K56 HydrophobicContact CG1-CB 3.95Å; V51-K56 HydrophobicContact CG1-CG 4.2Å; V51-Y57 HydrophobicContact CB-CE2 4.19Å; V51-Y57 HydrophobicContact CG1-CD2 3.89Å; V51-Y57 HydrophobicContact CG1-CE1 4.27Å; V51-Y57 HydrophobicContact CG1-CE2 3.46Å; V51-Y57 VanDerWaalsContact CG1-CE2 3.46Å; V51-Y57 HydrophobicContact CG1-CG 4.46Å; V51-Y57 HydrophobicContact CG2-CE1 4.07Å; V51-Y57 HydrophobicContact CG2-CE2 4.42Å; V51-Y57 WeakPolarHBondContact CG2-OH 3.46Å; V51-K112 HydrophobicContact CB-CD 4.1Å; V51-K112 HydrophobicContact CG2-CB 3.99Å; V51-K112 HydrophobicContact CG2-CD 3.85Å; V51-K112 HydrophobicContact CG2-CG 4.23Å
52	A	53.8	Low	80.2	Confident	102 Å²	102	46 Å²	46	84%	0.843	28%	0.277	S	S	*	.			trans	-87.6	-18.8	-175.5	0	0	0	0	0	113.8	P50	P50-A52 PolarHBondContact O-N 2.76Å
53	S	67.1	Low	80	Confident	40 Å²	40	50.4 Å²	50.4	28%	0.28	30%	0.301	S	S	.	.	S	Bend	trans	-161.3	162.7	-176.2	57.9	0	0	0	0	111.7	V51 S55 K56	V51-S53 WeakPolarHBondContact CG1-O 3.39Å; S53-S55 PolarHBondContact O-N 3.07Å; S53-S55 PolarHBondContact OG-OG 2.81Å; S53-K56 PolarHBondContact O-N 2.87Å
54	T	72.1	Confident	79.8	Confident	79 Å²	79	51.1 Å²	51.1	49%	0.485	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-29.5	173.1	25.1	0	0	0	0	112.6	K56 Y57 V58 E263	T54-K56 PolarHBondContact O-N 3.5Å; T54-Y57 PolarHBondContact O-N 2.99Å; T54-Y57 VanDerWaalsContact O-N 3.09Å; T54-V58 PolarHBondContact O-N 2.79Å; T54-E263 PolarHBondContact N-OE1 2.94Å; T54-E263 PolarHBondContact OG1-OE1 3.03Å; T54-E263 PolarHBondContact OG1-OE2 3.19Å
55	S	71.5	Confident	79.7	Confident	59 Å²	59	52.5 Å²	52.5	41%	0.413	32%	0.318	S	S	.	.	H	α-helix	trans	-58.3	-34.3	177.4	70.8	0	0	0	0	113.2	S53 Y57 V58 D59	S53-S55 PolarHBondContact O-N 3.07Å; S53-S55 PolarHBondContact OG-OG 2.81Å; S55-Y57 VanDerWaalsContact C-N 3.27Å; S55-Y57 PolarHBondContact O-N 2.73Å; S55-V58 WeakPolarHBondContact O-CB 3.43Å; S55-V58 PolarHBondContact O-N 3.37Å; S55-V58 VanDerWaalsContact O-N 3.12Å; S55-D59 PolarHBondContact O-N 3.46Å
56	K	80.4	Confident	79.8	Confident	70 Å²	70	55.5 Å²	55.5	30%	0.304	34%	0.34	S	S	.	.	H	α-helix	trans	-65	-33	179.1	-178.5	61.8	178.9	177.7	0	112.1	V51 S53 T54 D59 L60	V51-K56 HydrophobicContact CG1-CB 3.95Å; V51-K56 HydrophobicContact CG1-CG 4.2Å; S53-K56 PolarHBondContact O-N 2.87Å; T54-K56 PolarHBondContact O-N 3.5Å; K56-D59 PolarHBondContact O-N 3.02Å; K56-L60 WeakPolarHBondContact O-CG 3.38Å; K56-L60 PolarHBondContact O-N 3.29Å; K56-L60 VanDerWaalsContact O-N 3.11Å
57	Y	84.4	Confident	79.9	Confident	8 Å²	8	52 Å²	52	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-70.8	-35.7	174.3	-70.3	-63	0	0	0	112.3	V45 T47 V51 T54 S55 D59 L60 V61 V100 K112 M114	V45-Y57 HydrophobicContact CG2-CD1 3.73Å; V45-Y57 HydrophobicContact CG2-CG 4.47Å; T47-Y57 HydrophobicContact CG2-CE1 4.15Å; V51-Y57 HydrophobicContact CB-CE2 4.19Å; V51-Y57 HydrophobicContact CG1-CD2 3.89Å; V51-Y57 HydrophobicContact CG1-CE1 4.27Å; V51-Y57 HydrophobicContact CG1-CE2 3.46Å; V51-Y57 VanDerWaalsContact CG1-CE2 3.46Å; V51-Y57 HydrophobicContact CG1-CG 4.46Å; V51-Y57 HydrophobicContact CG2-CE1 4.07Å; V51-Y57 HydrophobicContact CG2-CE2 4.42Å; V51-Y57 WeakPolarHBondContact CG2-OH 3.46Å; T54-Y57 PolarHBondContact O-N 2.99Å; T54-Y57 VanDerWaalsContact O-N 3.09Å; S55-Y57 VanDerWaalsContact C-N 3.27Å; S55-Y57 PolarHBondContact O-N 2.73Å; Y57-D59 VanDerWaalsContact C-N 3.29Å; Y57-D59 PolarHBondContact O-N 3.25Å; Y57-L60 HydrophobicContact CD1-CD1 4.01Å; Y57-L60 PolarHBondContact O-N 2.85Å; Y57-V61 WeakPolarHBondContact O-CG2 3.32Å; Y57-V61 PolarHBondContact O-N 3.07Å; Y57-V100 HydrophobicContact CD2-CG2 4.32Å; Y57-V100 HydrophobicContact CE2-CG1 4.18Å; Y57-V100 HydrophobicContact CE2-CG2 3.58Å; Y57-V100 WeakPolarHBondContact OH-CG1 3.47Å; Y57-K112 VanDerWaalsContact OH-CB 3.29Å; Y57-K112 WeakPolarHBondContact OH-CB 3.37Å; Y57-M114 VanDerWaalsContact CB-SD 3.52Å; Y57-M114 HydrophobicContact CD1-CB 3.59Å; Y57-M114 HydrophobicContact CD1-SD 4.32Å; Y57-M114 HydrophobicContact CD2-CB 4.27Å; Y57-M114 HydrophobicContact CD2-SD 3.94Å; Y57-M114 HydrophobicContact CE1-CB 3.69Å; Y57-M114 HydrophobicContact CE2-CB 4.34Å; Y57-M114 HydrophobicContact CG-CB 3.9Å; Y57-M114 HydrophobicContact CG-CE 4.26Å; Y57-M114 HydrophobicContact CG-CG 4.36Å; Y57-M114 HydrophobicContact CG-SD 3.69Å
58	V	83.4	Confident	80.1	Confident	57 Å²	57	53.1 Å²	53.1	35%	0.345	33%	0.333	S	S	.	.	H	α-helix	trans	-60.9	-41.9	172.1	169.1	0	0	0	0	110.6	I9 T54 S55 L60 V61 N62	I9-V58 HydrophobicContact CD1-CB 4.41Å; I9-V58 HydrophobicContact CD1-CG1 3.68Å; I9-V58 HydrophobicContact CD1-CG2 4.35Å; T54-V58 PolarHBondContact O-N 2.79Å; S55-V58 WeakPolarHBondContact O-CB 3.43Å; S55-V58 PolarHBondContact O-N 3.37Å; S55-V58 VanDerWaalsContact O-N 3.12Å; V58-L60 PolarHBondContact O-N 3.09Å; V58-V61 WeakPolarHBondContact O-CB 3.44Å; V58-V61 PolarHBondContact O-N 3.03Å; V58-N62 PolarHBondContact O-N 3.21Å
59	D	84	Confident	80.4	Confident	61 Å²	61	50.3 Å²	50.3	33%	0.326	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-43.9	175	-62.4	-28.6	0	0	0	111.7	S55 K56 Y57 V61 N62 D63	S55-D59 PolarHBondContact O-N 3.46Å; K56-D59 PolarHBondContact O-N 3.02Å; Y57-D59 VanDerWaalsContact C-N 3.29Å; Y57-D59 PolarHBondContact O-N 3.25Å; D59-V61 VanDerWaalsContact C-N 3.3Å; D59-V61 PolarHBondContact O-N 3.34Å; D59-N62 CarbonylContact O-C 3.55Å; D59-N62 WeakPolarHBondContact O-CA 3.5Å; D59-N62 WeakPolarHBondContact O-CB 3.33Å; D59-N62 PolarHBondContact O-N 3Å; D59-D63 PolarHBondContact O-N 3.49Å
60	L	87.1	Confident	80.6	Confident	34 Å²	34	50 Å²	50	18%	0.178	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-38.2	177.1	-69	168.1	0	0	0	112.4	V45 T47 K56 Y57 V58 A64	V45-L60 HydrophobicContact CB-CB 4.23Å; V45-L60 HydrophobicContact CG1-CB 4.37Å; V45-L60 HydrophobicContact CG2-CB 4.49Å; T47-L60 HydrophobicContact CG2-CD1 3.74Å; K56-L60 WeakPolarHBondContact O-CG 3.38Å; K56-L60 PolarHBondContact O-N 3.29Å; K56-L60 VanDerWaalsContact O-N 3.11Å; Y57-L60 HydrophobicContact CD1-CD1 4.01Å; Y57-L60 PolarHBondContact O-N 2.85Å; V58-L60 PolarHBondContact O-N 3.09Å; L60-A64 PolarHBondContact O-N 3Å
61	V	89.5	Confident	81.5	Confident	4 Å²	4	49 Å²	49	2%	0.024	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-45.8	171.9	173.2	0	0	0	0	109.6	I9 V45 Y57 V58 D59 D63 A64 Y85 F88 M114	I9-V61 HydrophobicContact CD1-CG1 4.37Å; V45-V61 HydrophobicContact CG1-CG2 3.7Å; Y57-V61 WeakPolarHBondContact O-CG2 3.32Å; Y57-V61 PolarHBondContact O-N 3.07Å; V58-V61 WeakPolarHBondContact O-CB 3.44Å; V58-V61 PolarHBondContact O-N 3.03Å; D59-V61 VanDerWaalsContact C-N 3.3Å; D59-V61 PolarHBondContact O-N 3.34Å; V61-D63 PolarHBondContact O-N 3.23Å; V61-A64 WeakPolarHBondContact O-CB 3.4Å; V61-A64 PolarHBondContact O-N 3.22Å; V61-A64 VanDerWaalsContact O-N 3.15Å; V61-Y85 HydrophobicContact CG1-CD2 4.28Å; V61-Y85 WeakPolarHBondContact O-CD2 3.41Å; V61-F88 HydrophobicContact CG1-CB 3.63Å; V61-F88 HydrophobicContact CG1-CD1 4.18Å; V61-F88 HydrophobicContact CG1-CD2 3.89Å; V61-F88 HydrophobicContact CG1-CG 3.65Å; V61-F88 HydrophobicContact CG2-CD1 3.97Å; V61-F88 HydrophobicContact CG2-CD2 3.83Å; V61-F88 HydrophobicContact CG2-CE1 3.92Å; V61-F88 HydrophobicContact CG2-CE2 3.77Å; V61-F88 HydrophobicContact CG2-CG 3.96Å; V61-F88 HydrophobicContact CG2-CZ 3.83Å; V61-M114 HydrophobicContact CG2-CE 4.46Å
62	N	86.1	Confident	82.5	Confident	23 Å²	23	48.2 Å²	48.2	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-36.7	179	-92.3	-12.7	0	0	0	113.5	A5 V58 D59 A64 A65	A5-N62 PolarHBondContact O-ND2 3.46Å; A5-N62 PolarHBondContact O-OD1 3.04Å; V58-N62 PolarHBondContact O-N 3.21Å; D59-N62 CarbonylContact O-C 3.55Å; D59-N62 WeakPolarHBondContact O-CA 3.5Å; D59-N62 WeakPolarHBondContact O-CB 3.33Å; D59-N62 PolarHBondContact O-N 3Å; N62-A64 PolarHBondContact O-N 2.9Å; N62-A65 WeakPolarHBondContact O-CB 3.38Å; N62-A65 PolarHBondContact O-N 3.01Å
63	D	87.8	Confident	84.1	Confident	107 Å²	107	46.3 Å²	46.3	57%	0.572	29%	0.293	S	S	*	.	H	α-helix	trans	-61.4	-30.9	176.1	-72.8	-21.1	0	0	0	111.8	D59 V61 A65 S66	D59-D63 PolarHBondContact O-N 3.49Å; V61-D63 PolarHBondContact O-N 3.23Å; D63-A65 PolarHBondContact O-N 3.11Å; D63-S66 PolarHBondContact O-N 3.26Å; D63-S66 PolarHBondContact O-OG 3.28Å
64	A	88.9	Confident	85.2	Confident	14 Å²	14	45.4 Å²	45.4	12%	0.116	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-69.5	-11.3	175	0	0	0	0	0	113.5	L60 V61 N62 S66 A67 Y85	L60-A64 PolarHBondContact O-N 3Å; V61-A64 WeakPolarHBondContact O-CB 3.4Å; V61-A64 PolarHBondContact O-N 3.22Å; V61-A64 VanDerWaalsContact O-N 3.15Å; N62-A64 PolarHBondContact O-N 2.9Å; A64-S66 PolarHBondContact O-N 3.45Å; A64-S66 VanDerWaalsContact O-N 3.16Å; A64-A67 WeakPolarHBondContact O-CB 3.47Å; A64-A67 PolarHBondContact O-N 3.5Å; A64-Y85 HydrophobicContact CB-CD2 4.22Å; A64-Y85 HydrophobicContact CB-CG 4.45Å
65	A	88.7	Confident	86.1	Confident	31 Å²	31	43.1 Å²	43.1	26%	0.256	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-57.3	-30.6	173	0	0	0	0	0	112.3	N62 D63 A67 V68 Y85	N62-A65 WeakPolarHBondContact O-CB 3.38Å; N62-A65 PolarHBondContact O-N 3.01Å; D63-A65 PolarHBondContact O-N 3.11Å; A65-A67 PolarHBondContact O-N 3.37Å; A65-A67 VanDerWaalsContact O-N 3.13Å; A65-V68 PolarHBondContact O-N 3.03Å; A65-Y85 HydrophobicContact CB-CD2 4.3Å; A65-Y85 HydrophobicContact CB-CE1 4.12Å; A65-Y85 HydrophobicContact CB-CE2 3.58Å; A65-Y85 VanDerWaalsContact CB-CZ 3.46Å; A65-Y85 WeakPolarHBondContact CB-OH 3.38Å
66	S	90	Very high	86.9	Confident	79 Å²	79	45.2 Å²	45.2	55%	0.552	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-64.4	-11.9	175.5	71	0	0	0	0	114.2	D63 A64	D63-S66 PolarHBondContact O-N 3.26Å; D63-S66 PolarHBondContact O-OG 3.28Å; A64-S66 PolarHBondContact O-N 3.45Å; A64-S66 VanDerWaalsContact O-N 3.16Å
67	A	91.2	Very high	87.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-83.2	-11.2	173.3	0	0	0	0	0	113.1	A64 A65 A75 K78 Q81 C82	A64-A67 WeakPolarHBondContact O-CB 3.47Å; A64-A67 PolarHBondContact O-N 3.5Å; A65-A67 PolarHBondContact O-N 3.37Å; A65-A67 VanDerWaalsContact O-N 3.13Å; A67-A75 PolarHBondContact O-N 2.88Å; A67-K78 HydrophobicContact CB-CB 3.8Å; A67-K78 HydrophobicContact CB-CD 3.98Å; A67-Q81 HydrophobicContact CB-CB 3.81Å; A67-C82 HydrophobicContact CB-CB 3.94Å
68	V	89.4	Confident	87.7	Confident	26 Å²	26	49 Å²	49	16%	0.158	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-101.4	123.1	177.2	-174.6	0	0	0	0	110.1	A65 Y85 K86	A65-V68 PolarHBondContact O-N 3.03Å; V68-Y85 HydrophobicContact CG2-CD1 3.46Å; V68-Y85 VanDerWaalsContact CG2-CD1 3.46Å; V68-Y85 HydrophobicContact CG2-CE1 3.98Å; V68-Y85 HydrophobicContact CG2-CG 4.4Å; V68-K86 HydrophobicContact CG2-CG 4.41Å
69	S	86.7	Confident	87.9	Confident	38 Å²	38	51.3 Å²	51.3	27%	0.266	34%	0.344	S	S	.	.			trans	-78.8	167.7	177.9	48.5	0	0	0	0	112.6	D71 C72 T73	S69-D71 WeakPolarHBondContact CB-OD1 3.46Å; S69-D71 PolarHBondContact O-N 2.91Å; S69-D71 PolarHBondContact OG-OD1 2.86Å; S69-C72 WeakPolarHBondContact O-CA 3.34Å; S69-C72 PolarHBondContact O-N 2.96Å; S69-T73 PolarHBondContact N-O 3.39Å; S69-T73 PolarHBondContact OG-N 3.45Å; S69-T73 PolarHBondContact OG-O 3.03Å; S69-T73 PolarHBondContact OG-OG1 3.02Å
70	G	81.9	Confident	88	Confident	76 Å²	76	53.4 Å²	53.4	78%	0.784	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.1	-177.8	0	0	0	0	0	115.4	K131	G70-K131 PolarHBondContact O-NZ 3.5Å
71	D	84.5	Confident	88	Confident	101 Å²	101	56.7 Å²	56.7	54%	0.54	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	7.8	173.2	66.4	-18.7	0	0	0	113.1	S69 T73	S69-D71 WeakPolarHBondContact CB-OD1 3.46Å; S69-D71 PolarHBondContact O-N 2.91Å; S69-D71 PolarHBondContact OG-OD1 2.86Å; D71-T73 VanDerWaalsContact CG-OG1 3.27Å; D71-T73 PolarHBondContact O-N 3.46Å; D71-T73 PolarHBondContact OD1-N 2.8Å; D71-T73 VanDerWaalsContact OD1-N 3.11Å; D71-T73 PolarHBondContact OD1-OG1 3.19Å; D71-T73 VanDerWaalsContact OD2-CG2 3.31Å; D71-T73 WeakPolarHBondContact OD2-CG2 3.31Å; D71-T73 PolarHBondContact OD2-OG1 2.78Å
72	C	83.9	Confident	88	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.02	37%	0.365	C	S	.	.	S	Bend	trans	67.1	12.7	-173.8	-58.3	0	0	0	0	115.9	S69 K86 C127 K131	S69-C72 WeakPolarHBondContact O-CA 3.34Å; S69-C72 PolarHBondContact O-N 2.96Å; C72-K86 WeakPolarHBondContact O-CE 3.28Å; C72-K86 PolarHBondContact O-NZ 3.11Å; C72-C127 HydrophobicContact CB-CB 3.73Å; C72-C127 WeakPolarHBondContact CB-SG 3.47Å; C72-C127 WeakPolarHBondContact SG-CB 3.32Å; C72-C127 CovalentContact SG-SG 2.02Å; C72-C127 PolarHBondContact SG-SG 3.38Å; C72-K131 WeakPolarHBondContact SG-CE 3.42Å; C72-K131 PolarHBondContact SG-NZ 3.06Å
73	T	88.4	Confident	88.2	Confident	63 Å²	63	59.3 Å²	59.3	39%	0.387	38%	0.38	S	S	.	.			trans	-80.1	174	168.3	65.2	0	0	0	0	110.2	S69 D71	S69-T73 PolarHBondContact N-O 3.39Å; S69-T73 PolarHBondContact OG-N 3.45Å; S69-T73 PolarHBondContact OG-O 3.03Å; S69-T73 PolarHBondContact OG-OG1 3.02Å; D71-T73 VanDerWaalsContact CG-OG1 3.27Å; D71-T73 PolarHBondContact O-N 3.46Å; D71-T73 PolarHBondContact OD1-N 2.8Å; D71-T73 VanDerWaalsContact OD1-N 3.11Å; D71-T73 PolarHBondContact OD1-OG1 3.19Å; D71-T73 VanDerWaalsContact OD2-CG2 3.31Å; D71-T73 WeakPolarHBondContact OD2-CG2 3.31Å; D71-T73 PolarHBondContact OD2-OG1 2.78Å
74	C	89.7	Confident	88.2	Confident	20 Å²	20	55.8 Å²	55.8	14%	0.135	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-90	134	177.1	-60.2	0	0	0	0	109	A76 C82	C74-A76 PolarHBondContact O-N 3.18Å; C74-C82 WeakPolarHBondContact CA-SG 3.38Å; C74-C82 HydrophobicContact CB-CB 3.46Å; C74-C82 VanDerWaalsContact CB-CB 3.46Å; C74-C82 WeakPolarHBondContact CB-SG 3.24Å; C74-C82 WeakPolarHBondContact SG-CB 3.48Å; C74-C82 CovalentContact SG-SG 2.04Å; C74-C82 PolarHBondContact SG-SG 3.24Å
75	A	90.7	Very high	88.3	Confident	31 Å²	31	55.5 Å²	55.5	26%	0.256	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-58.5	139.3	171.9	0	0	0	0	0	109.5	A67 G77 K78	A67-A75 PolarHBondContact O-N 2.88Å; A75-G77 PolarHBondContact O-N 2.59Å; A75-K78 HydrophobicContact CB-CB 4.41Å; A75-K78 HydrophobicContact CB-CD 4.27Å; A75-K78 HydrophobicContact CB-CG 4.5Å; A75-K78 PolarHBondContact O-N 2.68Å
76	A	88.9	Confident	88.3	Confident	103 Å²	103	54.4 Å²	54.4	85%	0.851	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	129.1	-177.9	0	0	0	0	0	111	C74 K78	C74-A76 PolarHBondContact O-N 3.18Å; A76-K78 VanDerWaalsContact C-N 3.32Å; A76-K78 PolarHBondContact O-N 1.96Å
77	G	89.9	Confident	88.3	Confident	82 Å²	82	51.1 Å²	51.1	85%	0.845	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	3.5	-178.5	0	0	0	0	0	115.6	A75	A75-G77 PolarHBondContact O-N 2.59Å
78	K	90.4	Very high	88.3	Confident	75 Å²	75	51.5 Å²	51.5	33%	0.326	32%	0.323	S	S	.	.			trans	-119.9	31.5	179.4	-59.5	-168.9	174.9	-174.5	0	113.6	A67 A75 A76 E80 Q81 C82	A67-K78 HydrophobicContact CB-CB 3.8Å; A67-K78 HydrophobicContact CB-CD 3.98Å; A75-K78 HydrophobicContact CB-CB 4.41Å; A75-K78 HydrophobicContact CB-CD 4.27Å; A75-K78 HydrophobicContact CB-CG 4.5Å; A75-K78 PolarHBondContact O-N 2.68Å; A76-K78 VanDerWaalsContact C-N 3.32Å; A76-K78 PolarHBondContact O-N 1.96Å; K78-E80 PolarHBondContact O-N 2.97Å; K78-Q81 PolarHBondContact O-N 3.22Å; K78-C82 VanDerWaalsContact O-CB 3.23Å; K78-C82 WeakPolarHBondContact O-CB 3.39Å; K78-C82 PolarHBondContact O-N 2.87Å
79	Q	88.2	Confident	88.1	Confident	107 Å²	107	50.4 Å²	50.4	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-59.2	-48.6	-171.6	-141.7	73.6	17.4	0	0	112.6	C82 D83	Q79-C82 WeakPolarHBondContact O-CB 3.35Å; Q79-C82 PolarHBondContact O-N 2.8Å; Q79-D83 WeakPolarHBondContact O-CB 3.03Å; Q79-D83 PolarHBondContact O-N 2.82Å
80	E	85.3	Confident	88	Confident	105 Å²	105	50.2 Å²	50.2	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-61	-49.8	-179.4	-69.5	170.3	-154.7	0	0	112.3	K78 C82 D83 M84	K78-E80 PolarHBondContact O-N 2.97Å; E80-C82 VanDerWaalsContact C-N 3.29Å; E80-C82 PolarHBondContact O-N 2.99Å; E80-D83 PolarHBondContact O-N 3.42Å; E80-M84 WeakPolarHBondContact O-CB 2.94Å; E80-M84 VanDerWaalsContact O-CG 3.3Å; E80-M84 WeakPolarHBondContact O-CG 3.43Å; E80-M84 PolarHBondContact O-N 2.59Å
81	Q	88.3	Confident	87.7	Confident	102 Å²	102	51.6 Å²	51.6	48%	0.477	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-40.9	177.5	-74.8	173.2	-15.5	0	0	111.8	A67 K78 Y85	A67-Q81 HydrophobicContact CB-CB 3.81Å; K78-Q81 PolarHBondContact O-N 3.22Å; Q81-Y85 VanDerWaalsContact O-CB 3.27Å; Q81-Y85 WeakPolarHBondContact O-CB 3.44Å; Q81-Y85 PolarHBondContact O-N 2.81Å
82	C	90.2	Very high	87.3	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-47.6	176.9	173.5	0	0	0	0	111.8	A67 C74 K78 Q79 E80 Y85 K86	A67-C82 HydrophobicContact CB-CB 3.94Å; C74-C82 WeakPolarHBondContact CA-SG 3.38Å; C74-C82 HydrophobicContact CB-CB 3.46Å; C74-C82 VanDerWaalsContact CB-CB 3.46Å; C74-C82 WeakPolarHBondContact CB-SG 3.24Å; C74-C82 WeakPolarHBondContact SG-CB 3.48Å; C74-C82 CovalentContact SG-SG 2.04Å; C74-C82 PolarHBondContact SG-SG 3.24Å; K78-C82 VanDerWaalsContact O-CB 3.23Å; K78-C82 WeakPolarHBondContact O-CB 3.39Å; K78-C82 PolarHBondContact O-N 2.87Å; Q79-C82 WeakPolarHBondContact O-CB 3.35Å; Q79-C82 PolarHBondContact O-N 2.8Å; E80-C82 VanDerWaalsContact C-N 3.29Å; E80-C82 PolarHBondContact O-N 2.99Å; C82-Y85 PolarHBondContact O-N 2.68Å; C82-K86 WeakPolarHBondContact O-CB 3.39Å; C82-K86 VanDerWaalsContact O-CG 3.26Å; C82-K86 WeakPolarHBondContact O-CG 3.29Å; C82-K86 PolarHBondContact O-N 3.01Å; C82-K86 VanDerWaalsContact SG-CE 3.52Å
83	D	88.6	Confident	87	Confident	82 Å²	82	50 Å²	50	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-66.2	-41.4	-178.2	-74	-16.9	0	0	0	111.2	Q79 E80 K86 Q87	Q79-D83 WeakPolarHBondContact O-CB 3.03Å; Q79-D83 PolarHBondContact O-N 2.82Å; E80-D83 PolarHBondContact O-N 3.42Å; D83-K86 PolarHBondContact O-N 2.94Å; D83-Q87 PolarHBondContact O-N 2.84Å
84	M	88.2	Confident	86.7	Confident	33 Å²	33	47.9 Å²	47.9	16%	0.163	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-50.9	172.6	-73	174.5	147	0	0	111.6	M44 Y46 E80 K86 Q87 F88	M44-M84 HydrophobicContact CB-CE 3.45Å; M44-M84 VanDerWaalsContact CB-CE 3.45Å; M44-M84 HydrophobicContact CG-CE 3.96Å; M44-M84 WeakPolarHBondContact O-CE 3.32Å; Y46-M84 HydrophobicContact CE2-CE 4.42Å; E80-M84 WeakPolarHBondContact O-CB 2.94Å; E80-M84 VanDerWaalsContact O-CG 3.3Å; E80-M84 WeakPolarHBondContact O-CG 3.43Å; E80-M84 PolarHBondContact O-N 2.59Å; M84-K86 VanDerWaalsContact C-N 3.29Å; M84-K86 PolarHBondContact O-N 3.13Å; M84-Q87 WeakPolarHBondContact O-CB 3.31Å; M84-Q87 PolarHBondContact O-N 2.86Å; M84-Q87 VanDerWaalsContact O-N 3.09Å; M84-F88 WeakPolarHBondContact O-CD2 3.4Å; M84-F88 PolarHBondContact O-N 3.4Å
85	Y	90.4	Very high	86.4	Confident	8 Å²	8	50.6 Å²	50.6	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-41.7	178.3	178.9	-98.2	0	0	0	111.9	V61 A64 A65 V68 Q81 C82 Q87 F88 T89 Y129	V61-Y85 HydrophobicContact CG1-CD2 4.28Å; V61-Y85 WeakPolarHBondContact O-CD2 3.41Å; A64-Y85 HydrophobicContact CB-CD2 4.22Å; A64-Y85 HydrophobicContact CB-CG 4.45Å; A65-Y85 HydrophobicContact CB-CD2 4.3Å; A65-Y85 HydrophobicContact CB-CE1 4.12Å; A65-Y85 HydrophobicContact CB-CE2 3.58Å; A65-Y85 VanDerWaalsContact CB-CZ 3.46Å; A65-Y85 WeakPolarHBondContact CB-OH 3.38Å; V68-Y85 HydrophobicContact CG2-CD1 3.46Å; V68-Y85 VanDerWaalsContact CG2-CD1 3.46Å; V68-Y85 HydrophobicContact CG2-CE1 3.98Å; V68-Y85 HydrophobicContact CG2-CG 4.4Å; Q81-Y85 VanDerWaalsContact O-CB 3.27Å; Q81-Y85 WeakPolarHBondContact O-CB 3.44Å; Q81-Y85 PolarHBondContact O-N 2.81Å; C82-Y85 PolarHBondContact O-N 2.68Å; Y85-Q87 VanDerWaalsContact C-N 3.28Å; Y85-Q87 PolarHBondContact O-N 2.9Å; Y85-F88 PolarHBondContact O-N 2.8Å; Y85-T89 HydrophobicContact CD1-CG2 4.26Å; Y85-T89 HydrophobicContact CD2-CG2 4.2Å; Y85-T89 HydrophobicContact CE1-CG2 3.8Å; Y85-T89 HydrophobicContact CE2-CG2 3.72Å; Y85-T89 HydrophobicContact CG-CG2 4.48Å; Y85-T89 WeakPolarHBondContact O-CB 3.26Å; Y85-T89 WeakPolarHBondContact O-CG2 3.36Å; Y85-T89 PolarHBondContact O-N 2.83Å; Y85-T89 PolarHBondContact O-OG1 2.84Å; Y85-Y129 HydrophobicContact CE1-CE1 4.4Å
86	K	89.9	Confident	86.4	Confident	9 Å²	9	50 Å²	50	4%	0.039	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-36.6	175.9	-78.7	175.6	173.6	-178.3	0	112.2	V68 C72 C82 D83 M84 T89 Y90 F122 S128	V68-K86 HydrophobicContact CG2-CG 4.41Å; C72-K86 WeakPolarHBondContact O-CE 3.28Å; C72-K86 PolarHBondContact O-NZ 3.11Å; C82-K86 WeakPolarHBondContact O-CB 3.39Å; C82-K86 VanDerWaalsContact O-CG 3.26Å; C82-K86 WeakPolarHBondContact O-CG 3.29Å; C82-K86 PolarHBondContact O-N 3.01Å; C82-K86 VanDerWaalsContact SG-CE 3.52Å; D83-K86 PolarHBondContact O-N 2.94Å; M84-K86 VanDerWaalsContact C-N 3.29Å; M84-K86 PolarHBondContact O-N 3.13Å; K86-T89 CarbonylContact O-C 3.59Å; K86-Y90 WeakPolarHBondContact O-CB 3.4Å; K86-Y90 PolarHBondContact O-N 2.64Å; K86-F122 HydrophobicContact CB-CD1 3.96Å; K86-F122 HydrophobicContact CB-CE1 3.97Å; K86-F122 HydrophobicContact CD-CE1 3.81Å; K86-F122 HydrophobicContact CD-CZ 4.35Å; K86-F122 HydrophobicContact CG-CE1 4.38Å; K86-S128 WeakPolarHBondContact O-CB 3.38Å
87	Q	90.6	Very high	86.3	Confident	10 Å²	10	45.1 Å²	45.1	5%	0.047	23%	0.233	C	C	.	.	H	α-helix	trans	-68.4	-44.4	174.5	-175.8	60.5	66.1	0	0	111.8	I42 D83 M84 Y85 T89 Y90 F118 K120	I42-Q87 WeakPolarHBondContact O-CG 3.35Å; D83-Q87 PolarHBondContact O-N 2.84Å; M84-Q87 WeakPolarHBondContact O-CB 3.31Å; M84-Q87 PolarHBondContact O-N 2.86Å; M84-Q87 VanDerWaalsContact O-N 3.09Å; Y85-Q87 VanDerWaalsContact C-N 3.28Å; Y85-Q87 PolarHBondContact O-N 2.9Å; Q87-T89 PolarHBondContact O-N 2.86Å; Q87-Y90 PolarHBondContact O-N 3.03Å; Q87-F118 HydrophobicContact CG-CD2 3.69Å; Q87-F118 HydrophobicContact CG-CE2 3.95Å; Q87-F118 HydrophobicContact CG-CG 4.4Å; Q87-K120 PolarHBondContact NE2-O 2.85Å
88	F	89.8	Confident	86.4	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.035	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-34.6	175.5	-81.8	-72.7	0	0	0	112.9	V45 V61 M84 Y85 M114 C116 F118	V45-F88 HydrophobicContact CG1-CE2 4.17Å; V61-F88 HydrophobicContact CG1-CB 3.63Å; V61-F88 HydrophobicContact CG1-CD1 4.18Å; V61-F88 HydrophobicContact CG1-CD2 3.89Å; V61-F88 HydrophobicContact CG1-CG 3.65Å; V61-F88 HydrophobicContact CG2-CD1 3.97Å; V61-F88 HydrophobicContact CG2-CD2 3.83Å; V61-F88 HydrophobicContact CG2-CE1 3.92Å; V61-F88 HydrophobicContact CG2-CE2 3.77Å; V61-F88 HydrophobicContact CG2-CG 3.96Å; V61-F88 HydrophobicContact CG2-CZ 3.83Å; M84-F88 WeakPolarHBondContact O-CD2 3.4Å; M84-F88 PolarHBondContact O-N 3.4Å; Y85-F88 PolarHBondContact O-N 2.8Å; F88-M114 HydrophobicContact CE1-CE 4.13Å; F88-M114 HydrophobicContact CZ-CE 4.12Å; F88-C116 HydrophobicContact CE1-CB 3.76Å; F88-C116 HydrophobicContact CZ-CB 4.12Å; F88-F118 HydrophobicContact CD1-CE2 4.23Å; F88-F118 AromaticContact CD1-CZ 3.57Å; F88-F118 HydrophobicContact CD1-CZ 3.57Å; F88-F118 HydrophobicContact CE1-CE2 4.32Å; F88-F118 AromaticContact CE1-CZ 3.93Å; F88-F118 HydrophobicContact CE1-CZ 3.93Å; F88-F118 HydrophobicContact CG-CZ 4.22Å
89	T	86.3	Confident	86.3	Confident	3 Å²	3	39 Å²	39	2%	0.018	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	9.8	-177.9	57.8	0	0	0	0	113.6	Y85 K86 Q87 W91 S128	Y85-T89 HydrophobicContact CD1-CG2 4.26Å; Y85-T89 HydrophobicContact CD2-CG2 4.2Å; Y85-T89 HydrophobicContact CE1-CG2 3.8Å; Y85-T89 HydrophobicContact CE2-CG2 3.72Å; Y85-T89 HydrophobicContact CG-CG2 4.48Å; Y85-T89 WeakPolarHBondContact O-CB 3.26Å; Y85-T89 WeakPolarHBondContact O-CG2 3.36Å; Y85-T89 PolarHBondContact O-N 2.83Å; Y85-T89 PolarHBondContact O-OG1 2.84Å; K86-T89 CarbonylContact O-C 3.59Å; Q87-T89 PolarHBondContact O-N 2.86Å; T89-W91 PolarHBondContact O-N 3.26Å; T89-S128 VanDerWaalsContact O-O 3.13Å; T89-S128 PolarHBondContact OG1-OG 3.45Å
90	Y	84.9	Confident	86.3	Confident	33 Å²	33	36.8 Å²	36.8	13%	0.129	18%	0.181	C	C	.	.			trans	-70.2	115.9	-177.6	-177.8	-148.8	0	0	0	111.1	K86 Q87 E92 G93 K120 F122 S128	K86-Y90 WeakPolarHBondContact O-CB 3.4Å; K86-Y90 PolarHBondContact O-N 2.64Å; Q87-Y90 PolarHBondContact O-N 3.03Å; Y90-E92 HydrophobicContact CE1-CB 4.17Å; Y90-E92 HydrophobicContact CE2-CB 4.03Å; Y90-E92 HydrophobicContact CE2-CG 4.4Å; Y90-E92 PolarHBondContact O-N 3.39Å; Y90-E92 VanDerWaalsContact O-N 3.14Å; Y90-E92 PolarHBondContact OH-OE2 3.34Å; Y90-G93 PolarHBondContact O-N 2.9Å; Y90-K120 HydrophobicContact CE1-CB 4.14Å; Y90-F122 HydrophobicContact CD1-CB 3.9Å; Y90-F122 HydrophobicContact CD1-CD2 4.35Å; Y90-F122 AromaticContact CD2-CD2 3.61Å; Y90-F122 HydrophobicContact CD2-CD2 3.61Å; Y90-F122 HydrophobicContact CD2-CE2 4.35Å; Y90-F122 HydrophobicContact CE1-CB 4.44Å; Y90-F122 AromaticContact CE2-CD2 3.99Å; Y90-F122 HydrophobicContact CE2-CD2 3.99Å; Y90-F122 HydrophobicContact CG-CB 3.98Å; Y90-F122 AromaticContact CG-CD2 3.84Å; Y90-F122 HydrophobicContact CG-CD2 3.84Å; Y90-F122 HydrophobicContact CG-CG 4.36Å; Y90-S128 WeakPolarHBondContact CA-O 3.42Å
91	W	74.6	Confident	86.5	Confident	106 Å²	106	32.2 Å²	32.2	40%	0.402	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.7	-172.2	75.8	-87.9	0	0	0	114.9	T11 T89 S128	T11-W91 HydrophobicContact CG2-CB 4.46Å; T11-W91 WeakPolarHBondContact OG1-CA 3.33Å; T11-W91 WeakPolarHBondContact OG1-CB 3.26Å; T89-W91 PolarHBondContact O-N 3.26Å; W91-S128 VanDerWaalsContact CD1-O 3.23Å; W91-S128 PolarHBondContact N-O 3.06Å
92	E	76.6	Confident	86.5	Confident	68 Å²	68	31.9 Å²	31.9	32%	0.318	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	20.5	174.5	-56.7	179.4	115.2	0	0	113.1	Y90 G94 K120	Y90-E92 HydrophobicContact CE1-CB 4.17Å; Y90-E92 HydrophobicContact CE2-CB 4.03Å; Y90-E92 HydrophobicContact CE2-CG 4.4Å; Y90-E92 PolarHBondContact O-N 3.39Å; Y90-E92 VanDerWaalsContact O-N 3.14Å; Y90-E92 PolarHBondContact OH-OE2 3.34Å; E92-G94 PolarHBondContact O-N 3.4Å; E92-K120 HydrophobicContact CB-CD 4.45Å; E92-K120 WeakPolarHBondContact O-CB 3.47Å; E92-K120 VanDerWaalsContact O-CD 3.24Å; E92-K120 WeakPolarHBondContact O-CD 3.39Å; E92-K120 WeakPolarHBondContact O-CG 3.33Å
93	G	76.6	Confident	86.4	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.01	16%	0.161	C	C	.	.			trans	-54	-20.5	-175.2	0	0	0	0	0	115.2	Y90 E119 K120	Y90-G93 PolarHBondContact O-N 2.9Å; G93-E119 PolarHBondContact O-N 3.43Å; G93-K120 PolarHBondContact O-N 2.77Å
94	G	82	Confident	86.3	Confident	19 Å²	19	32.5 Å²	32.5	20%	0.196	17%	0.17	C	C	.	.			trans	73.6	-144.9	176	0	0	0	0	0	111.3	T14 E92 E119	T14-G94 WeakPolarHBondContact CB-O 3.44Å; T14-G94 WeakPolarHBondContact CG2-O 3.1Å; E92-G94 PolarHBondContact O-N 3.4Å; G94-E119 WeakPolarHBondContact CA-OE2 3.35Å
95	K	84.5	Confident	85.7	Confident	77 Å²	77	33.3 Å²	33.3	34%	0.335	18%	0.182	S	C	.	.	S	Bend	trans	-67	159.3	176.8	-50.6	-172.8	-171.4	173.9	0	113.1	S15 D17 L20 F118 E119	S15-K95 WeakPolarHBondContact O-CA 3.31Å; S15-K95 WeakPolarHBondContact O-CB 3.45Å; S15-K95 WeakPolarHBondContact OG-CG 3.29Å; D17-K95 HydrophobicContact CB-CB 3.92Å; D17-K95 HydrophobicContact CB-CD 3.88Å; D17-K95 WeakPolarHBondContact OD2-CD 3.3Å; D17-K95 IonicContact OD2-NZ 2.64Å; D17-K95 PolarHBondContact OD2-NZ 3.46Å; L20-K95 HydrophobicContact CD1-CB 4.13Å; K95-F118 CarbonylContact O-C 3.59Å; K95-F118 WeakPolarHBondContact O-CA 3.44Å; K95-E119 HydrophobicContact CB-CB 4.19Å; K95-E119 PolarHBondContact N-OE2 3.03Å; K95-E119 PolarHBondContact O-N 3.05Å
96	I	89.9	Confident	85	Confident	20 Å²	20	39 Å²	39	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.3	178.5	-168	178.6	0	0	0	111.5	T14 S15 W16 D17 C116 L117 F118	T14-I96 WeakPolarHBondContact OG1-CG2 3.39Å; S15-I96 PolarHBondContact O-N 3.33Å; W16-I96 CarbonylContact C-O 3.57Å; W16-I96 VanDerWaalsContact CA-O 3.28Å; W16-I96 WeakPolarHBondContact CA-O 3.33Å; W16-I96 HydrophobicContact CE3-CG2 4.32Å; D17-I96 PolarHBondContact N-O 3.15Å; I96-C116 HydrophobicContact CD1-CB 4.27Å; I96-C116 HydrophobicContact CG1-CB 4.41Å; I96-L117 VanDerWaalsContact CA-O 3.32Å; I96-L117 WeakPolarHBondContact CA-O 3.25Å; I96-F118 HydrophobicContact CB-CD1 4.3Å; I96-F118 HydrophobicContact CB-CE1 4.39Å; I96-F118 HydrophobicContact CD1-CD1 4.12Å; I96-F118 HydrophobicContact CD1-CE1 3.38Å; I96-F118 HydrophobicContact CD1-CZ 3.67Å; I96-F118 HydrophobicContact CG1-CD1 3.99Å; I96-F118 HydrophobicContact CG1-CE1 3.76Å; I96-F118 HydrophobicContact CG1-CZ 4.17Å
97	G	87.5	Confident	84	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	134.4	164.1	0	0	0	0	0	110.1	C116 L117	G97-C116 CarbonylContact O-C 3.5Å; G97-C116 WeakPolarHBondContact O-CA 3.44Å; G97-L117 PolarHBondContact N-O 2.81Å; G97-L117 PolarHBondContact O-N 2.75Å
98	C	91.5	Very high	83.4	Confident	22 Å²	22	51.2 Å²	51.2	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.3	-175.1	-56.5	0	0	0	0	112	W16 T115 C116	W16-C98 HydrophobicContact CH2-CB 3.79Å; W16-C98 WeakPolarHBondContact CH2-O 3.44Å; W16-C98 HydrophobicContact CZ3-CB 4.06Å; C98-T115 CarbonylContact C-O 3.53Å; C98-T115 WeakPolarHBondContact CA-O 3.15Å; C98-C116 HydrophobicContact CB-CB 4.09Å; C98-C116 WeakPolarHBondContact CB-SG 3.5Å; C98-C116 WeakPolarHBondContact SG-CB 3.43Å; C98-C116 CovalentContact SG-SG 2.03Å; C98-C116 PolarHBondContact SG-SG 2.92Å
99	A	89.3	Confident	82.8	Confident	6 Å²	6	54.4 Å²	54.4	5%	0.05	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	154.6	179	0	0	0	0	0	110.6	A24 Q25 M114 T115	A24-A99 HydrophobicContact CB-CB 3.92Å; Q25-A99 HydrophobicContact CB-CB 3.7Å; Q25-A99 HydrophobicContact CG-CB 4.41Å; A99-M114 CarbonylContact O-C 3.48Å; A99-M114 WeakPolarHBondContact O-CA 3.38Å; A99-T115 PolarHBondContact N-O 2.99Å; A99-T115 PolarHBondContact O-N 2.64Å
100	V	88.5	Confident	82.7	Confident	61 Å²	61	61.9 Å²	61.9	37%	0.37	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.6	-179.6	174.2	0	0	0	0	109.7	Y57 V113 M114	Y57-V100 HydrophobicContact CD2-CG2 4.32Å; Y57-V100 HydrophobicContact CE2-CG1 4.18Å; Y57-V100 HydrophobicContact CE2-CG2 3.58Å; Y57-V100 WeakPolarHBondContact OH-CG1 3.47Å; V100-V113 CarbonylContact C-O 3.56Å; V100-V113 VanDerWaalsContact CA-O 3.28Å; V100-V113 WeakPolarHBondContact CA-O 3.29Å; V100-M114 HydrophobicContact CG2-CB 4.01Å; V100-M114 HydrophobicContact CG2-CG 3.97Å
101	S	88.5	Confident	82.8	Confident	9 Å²	9	62 Å²	62	6%	0.063	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.6	174.4	-53.8	0	0	0	0	111.5	Q25 S28 D29 K112 V113	Q25-S101 PolarHBondContact NE2-OG 2.82Å; S28-S101 VanDerWaalsContact C-OG 3.25Å; S28-S101 WeakPolarHBondContact CB-OG 3.42Å; S28-S101 WeakPolarHBondContact O-CB 3.37Å; S28-S101 VanDerWaalsContact OG-CB 3.23Å; S28-S101 WeakPolarHBondContact OG-CB 3.36Å; S28-S101 PolarHBondContact OG-N 3.48Å; S28-S101 PolarHBondContact OG-OG 3.1Å; D29-S101 PolarHBondContact N-OG 2.85Å; D29-S101 PolarHBondContact OD1-OG 2.83Å; D29-S101 VanDerWaalsContact OD1-OG 3.05Å; S101-K112 WeakPolarHBondContact O-CA 3.41Å; S101-V113 PolarHBondContact N-O 3.32Å; S101-V113 PolarHBondContact O-N 3.37Å
102	E	88.5	Confident	83.4	Confident	94 Å²	94	59.7 Å²	59.7	44%	0.439	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.3	174	-168.7	170	150.7	0	0	109.2	R110 K112	E102-R110 VanDerWaalsContact OE1-CD 3.27Å; E102-R110 WeakPolarHBondContact OE1-CD 3.49Å; E102-R110 IonicContact OE1-CZ 3.48Å; E102-R110 IonicContact OE1-NE 3.71Å; E102-R110 IonicContact OE1-NH1 2.72Å; E102-R110 PolarHBondContact OE1-NH1 2.86Å; E102-K112 HydrophobicContact CG-CG 4.4Å
103	C	87.9	Confident	84	Confident	8 Å²	8	56.5 Å²	56.5	5%	0.054	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	130.3	-176.3	-63.6	0	0	0	0	110.1	C31 R110 T111 V113	C31-C103 WeakPolarHBondContact CA-SG 3.3Å; C31-C103 HydrophobicContact CB-CB 3.63Å; C31-C103 WeakPolarHBondContact CB-SG 3.46Å; C31-C103 WeakPolarHBondContact SG-CA 3.33Å; C31-C103 WeakPolarHBondContact SG-CB 3.19Å; C31-C103 CovalentContact SG-SG 2.03Å; C31-C103 PolarHBondContact SG-SG 3.41Å; C103-R110 CarbonylContact O-C 3.48Å; C103-R110 WeakPolarHBondContact O-CA 3.34Å; C103-T111 PolarHBondContact N-O 3.4Å; C103-T111 PolarHBondContact O-N 2.71Å; C103-V113 WeakPolarHBondContact SG-CG1 3.35Å
104	S	86.3	Confident	84.6	Confident	88 Å²	88	57.3 Å²	57.3	62%	0.615	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	121.7	178	-62.5	0	0	0	0	109.7	V109	S104-V109 CarbonylContact C-O 3.59Å; S104-V109 WeakPolarHBondContact CA-O 3.22Å
105	A	76.3	Confident	85.1	Confident	50 Å²	50	56.4 Å²	56.4	41%	0.413	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	133.6	173.4	0	0	0	0	0	110.2	N108 V109	A105-N108 PolarHBondContact O-N 3.14Å; A105-V109 HydrophobicContact CB-CB 4.39Å; A105-V109 PolarHBondContact N-O 3.13Å; A105-V109 PolarHBondContact O-N 2.95Å
106	P	74.9	Confident	85.5	Confident	127 Å²	127	52.9 Å²	52.9	83%	0.825	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	142.8	172.2	-22.9	32.8	0	0	0	111.5
107	P	69.8	Low	85.6	Confident	114 Å²	114	51.9 Å²	51.9	74%	0.74	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	cis	-92.1	-13.6	11.5	33.9	-32.7	0	0	0	115.2
108	N	76.6	Confident	85.8	Confident	161 Å²	161	52 Å²	52	86%	0.861	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-174.6	30.9	176.2	-89.2	-37.4	0	0	0	111.8	A105	A105-N108 PolarHBondContact O-N 3.14Å
109	V	78.3	Confident	85.7	Confident	75 Å²	75	55.5 Å²	55.5	46%	0.455	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.7	179.7	-179	0	0	0	0	107.9	S104 A105 T111	S104-V109 CarbonylContact C-O 3.59Å; S104-V109 WeakPolarHBondContact CA-O 3.22Å; A105-V109 HydrophobicContact CB-CB 4.39Å; A105-V109 PolarHBondContact N-O 3.13Å; A105-V109 PolarHBondContact O-N 2.95Å; V109-T111 HydrophobicContact CG1-CG2 4.07Å
110	R	83.7	Confident	85.5	Confident	161 Å²	161	59.9 Å²	59.9	61%	0.608	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	127	167.9	-67.8	-169.4	178.9	-159.9	5.9	108.8	E102 C103	E102-R110 VanDerWaalsContact OE1-CD 3.27Å; E102-R110 WeakPolarHBondContact OE1-CD 3.49Å; E102-R110 IonicContact OE1-CZ 3.48Å; E102-R110 IonicContact OE1-NE 3.71Å; E102-R110 IonicContact OE1-NH1 2.72Å; E102-R110 PolarHBondContact OE1-NH1 2.86Å; C103-R110 CarbonylContact O-C 3.48Å; C103-R110 WeakPolarHBondContact O-CA 3.34Å
111	T	87.1	Confident	85.5	Confident	36 Å²	36	59.8 Å²	59.8	22%	0.221	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.1	173.2	47.3	0	0	0	0	108.6	T47 P48 C103 V109	T47-T111 CarbonylContact O-C 3.58Å; T47-T111 WeakPolarHBondContact O-CA 3.19Å; P48-T111 HydrophobicContact CB-CG2 4.46Å; C103-T111 PolarHBondContact N-O 3.4Å; C103-T111 PolarHBondContact O-N 2.71Å; V109-T111 HydrophobicContact CG1-CG2 4.07Å
112	K	87.3	Confident	85.2	Confident	57 Å²	57	60.8 Å²	60.8	25%	0.248	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136.1	165.3	-59.2	-156.3	-178.4	-175.9	0	109.1	Y46 T47 V51 Y57 S101 E102	Y46-K112 WeakPolarHBondContact CA-O 3.26Å; T47-K112 HydrophobicContact CG2-CB 4.49Å; T47-K112 PolarHBondContact N-O 3.47Å; T47-K112 PolarHBondContact O-N 3.47Å; V51-K112 HydrophobicContact CB-CD 4.1Å; V51-K112 HydrophobicContact CG2-CB 3.99Å; V51-K112 HydrophobicContact CG2-CD 3.85Å; V51-K112 HydrophobicContact CG2-CG 4.23Å; Y57-K112 VanDerWaalsContact OH-CB 3.29Å; Y57-K112 WeakPolarHBondContact OH-CB 3.37Å; S101-K112 WeakPolarHBondContact O-CA 3.41Å; E102-K112 HydrophobicContact CG-CG 4.4Å
113	V	88.4	Confident	84.4	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.3	175.7	56.7	0	0	0	0	108.7	S28 M44 V45 Y46 V100 S101 C103	S28-V113 PolarHBondContact OG-O 3.21Å; M44-V113 HydrophobicContact CB-CG2 4.47Å; M44-V113 HydrophobicContact CE-CG2 3.84Å; V45-V113 WeakPolarHBondContact O-CA 3.47Å; Y46-V113 HydrophobicContact CD1-CB 3.62Å; Y46-V113 HydrophobicContact CD1-CG2 3.69Å; Y46-V113 HydrophobicContact CE1-CB 3.53Å; Y46-V113 HydrophobicContact CE1-CG1 4.47Å; Y46-V113 HydrophobicContact CE1-CG2 3.23Å; Y46-V113 HydrophobicContact CE2-CG2 4.26Å; Y46-V113 HydrophobicContact CG-CG2 4.37Å; V100-V113 CarbonylContact C-O 3.56Å; V100-V113 VanDerWaalsContact CA-O 3.28Å; V100-V113 WeakPolarHBondContact CA-O 3.29Å; S101-V113 PolarHBondContact N-O 3.32Å; S101-V113 PolarHBondContact O-N 3.37Å; C103-V113 WeakPolarHBondContact SG-CG1 3.35Å
114	M	90.4	Very high	83.3	Confident	19 Å²	19	64.7 Å²	64.7	9%	0.094	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130	162.7	-175.7	-177.8	73.6	0	0	108.1	M44 V45 Y57 V61 F88 A99 V100	M44-M114 CarbonylContact C-O 3.38Å; M44-M114 WeakPolarHBondContact CA-O 3.03Å; V45-M114 HydrophobicContact CG2-CB 3.81Å; V45-M114 HydrophobicContact CG2-CE 3.69Å; V45-M114 PolarHBondContact N-O 3.24Å; V45-M114 PolarHBondContact O-N 3.33Å; Y57-M114 VanDerWaalsContact CB-SD 3.52Å; Y57-M114 HydrophobicContact CD1-CB 3.59Å; Y57-M114 HydrophobicContact CD1-SD 4.32Å; Y57-M114 HydrophobicContact CD2-CB 4.27Å; Y57-M114 HydrophobicContact CD2-SD 3.94Å; Y57-M114 HydrophobicContact CE1-CB 3.69Å; Y57-M114 HydrophobicContact CE2-CB 4.34Å; Y57-M114 HydrophobicContact CG-CB 3.9Å; Y57-M114 HydrophobicContact CG-CE 4.26Å; Y57-M114 HydrophobicContact CG-CG 4.36Å; Y57-M114 HydrophobicContact CG-SD 3.69Å; V61-M114 HydrophobicContact CG2-CE 4.46Å; F88-M114 HydrophobicContact CE1-CE 4.13Å; F88-M114 HydrophobicContact CZ-CE 4.12Å; A99-M114 CarbonylContact O-C 3.48Å; A99-M114 WeakPolarHBondContact O-CA 3.38Å; V100-M114 HydrophobicContact CG2-CB 4.01Å; V100-M114 HydrophobicContact CG2-CG 3.97Å
115	T	91.4	Very high	82	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.3	173.5	-56.3	0	0	0	0	108.1	A24 I27 S28 I42 M44 C98 A99	A24-T115 HydrophobicContact CB-CG2 4.26Å; I27-T115 HydrophobicContact CB-CG2 4.21Å; I27-T115 HydrophobicContact CG2-CG2 4.01Å; S28-T115 WeakPolarHBondContact CB-OG1 3.29Å; I42-T115 HydrophobicContact CD1-CG2 4.16Å; I42-T115 HydrophobicContact CG1-CG2 4.35Å; M44-T115 HydrophobicContact CE-CG2 4.23Å; M44-T115 WeakPolarHBondContact CE-OG1 3.28Å; M44-T115 HydrophobicContact CG-CG2 4.18Å; C98-T115 CarbonylContact C-O 3.53Å; C98-T115 WeakPolarHBondContact CA-O 3.15Å; A99-T115 PolarHBondContact N-O 2.99Å; A99-T115 PolarHBondContact O-N 2.64Å
116	C	92.6	Very high	81.5	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.014	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.5	174	-68.5	0	0	0	0	109.5	I42 G43 F88 I96 G97 C98 F118	I42-C116 WeakPolarHBondContact CA-O 3.5Å; G43-C116 PolarHBondContact N-O 2.9Å; G43-C116 PolarHBondContact O-N 2.81Å; F88-C116 HydrophobicContact CE1-CB 3.76Å; F88-C116 HydrophobicContact CZ-CB 4.12Å; I96-C116 HydrophobicContact CD1-CB 4.27Å; I96-C116 HydrophobicContact CG1-CB 4.41Å; G97-C116 CarbonylContact O-C 3.5Å; G97-C116 WeakPolarHBondContact O-CA 3.44Å; C98-C116 HydrophobicContact CB-CB 4.09Å; C98-C116 WeakPolarHBondContact CB-SG 3.5Å; C98-C116 WeakPolarHBondContact SG-CB 3.43Å; C98-C116 CovalentContact SG-SG 2.03Å; C98-C116 PolarHBondContact SG-SG 2.92Å; C116-F118 HydrophobicContact CB-CE2 3.8Å; C116-F118 HydrophobicContact CB-CZ 4.02Å
117	L	93.3	Very high	81.6	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	141.7	170.6	-64	-177.4	0	0	0	110.2	L20 E23 A24 I27 Y40 G41 I42 I96 G97	L20-L117 HydrophobicContact CB-CB 4.24Å; L20-L117 HydrophobicContact CD2-CB 4.21Å; E23-L117 HydrophobicContact CB-CD1 3.7Å; E23-L117 HydrophobicContact CG-CD1 3.79Å; A24-L117 HydrophobicContact CB-CD1 4.18Å; A24-L117 HydrophobicContact CB-CG 3.94Å; I27-L117 HydrophobicContact CD1-CD1 4.09Å; I27-L117 HydrophobicContact CD1-CD2 3.98Å; I27-L117 HydrophobicContact CD1-CG 4.48Å; Y40-L117 HydrophobicContact CD2-CD1 4Å; Y40-L117 HydrophobicContact CG-CD1 4.49Å; G41-L117 CarbonylContact O-C 3.5Å; G41-L117 VanDerWaalsContact O-CA 3.32Å; G41-L117 WeakPolarHBondContact O-CA 3.41Å; I42-L117 HydrophobicContact CB-CD2 3.9Å; I42-L117 HydrophobicContact CD1-CD2 3.97Å; I42-L117 HydrophobicContact CG1-CD2 3.83Å; I96-L117 VanDerWaalsContact CA-O 3.32Å; I96-L117 WeakPolarHBondContact CA-O 3.25Å; G97-L117 PolarHBondContact N-O 2.81Å; G97-L117 PolarHBondContact O-N 2.75Å
118	F	92.2	Very high	82.3	Confident	1 Å²	1	61.8 Å²	61.8	0%	0.004	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.1	-178.7	-59.1	-95.8	0	0	0	109.2	L10 Y40 G41 Q87 F88 K95 I96 C116 K120	L10-F118 HydrophobicContact CD2-CE1 4.36Å; Y40-F118 WeakPolarHBondContact CB-O 3.5Å; G41-F118 PolarHBondContact N-O 3.33Å; G41-F118 PolarHBondContact O-N 2.92Å; Q87-F118 HydrophobicContact CG-CD2 3.69Å; Q87-F118 HydrophobicContact CG-CE2 3.95Å; Q87-F118 HydrophobicContact CG-CG 4.4Å; F88-F118 HydrophobicContact CD1-CE2 4.23Å; F88-F118 AromaticContact CD1-CZ 3.57Å; F88-F118 HydrophobicContact CD1-CZ 3.57Å; F88-F118 HydrophobicContact CE1-CE2 4.32Å; F88-F118 AromaticContact CE1-CZ 3.93Å; F88-F118 HydrophobicContact CE1-CZ 3.93Å; F88-F118 HydrophobicContact CG-CZ 4.22Å; K95-F118 CarbonylContact O-C 3.59Å; K95-F118 WeakPolarHBondContact O-CA 3.44Å; I96-F118 HydrophobicContact CB-CD1 4.3Å; I96-F118 HydrophobicContact CB-CE1 4.39Å; I96-F118 HydrophobicContact CD1-CD1 4.12Å; I96-F118 HydrophobicContact CD1-CE1 3.38Å; I96-F118 HydrophobicContact CD1-CZ 3.67Å; I96-F118 HydrophobicContact CG1-CD1 3.99Å; I96-F118 HydrophobicContact CG1-CE1 3.76Å; I96-F118 HydrophobicContact CG1-CZ 4.17Å; C116-F118 HydrophobicContact CB-CE2 3.8Å; C116-F118 HydrophobicContact CB-CZ 4.02Å; F118-K120 PolarHBondContact O-N 3.14Å
119	E	88.5	Confident	82.4	Confident	96 Å²	96	56.6 Å²	56.6	45%	0.449	28%	0.284	S	S	.	.	S	Bend	trans	-55.2	-41	177.7	179.6	179.8	-146.4	0	0	111.8	G93 G94 K95	G93-E119 PolarHBondContact O-N 3.43Å; G94-E119 WeakPolarHBondContact CA-OE2 3.35Å; K95-E119 HydrophobicContact CB-CB 4.19Å; K95-E119 PolarHBondContact N-OE2 3.03Å; K95-E119 PolarHBondContact O-N 3.05Å
120	K	85.4	Confident	82.2	Confident	98 Å²	98	55.5 Å²	55.5	43%	0.426	28%	0.283	S	S	.	.	S	Bend	trans	-112.6	136.1	177	-56.5	-162.5	-161.6	161.1	0	112.4	Q87 Y90 E92 G93 F118	Q87-K120 PolarHBondContact NE2-O 2.85Å; Y90-K120 HydrophobicContact CE1-CB 4.14Å; E92-K120 HydrophobicContact CB-CD 4.45Å; E92-K120 WeakPolarHBondContact O-CB 3.47Å; E92-K120 VanDerWaalsContact O-CD 3.24Å; E92-K120 WeakPolarHBondContact O-CD 3.39Å; E92-K120 WeakPolarHBondContact O-CG 3.33Å; G93-K120 PolarHBondContact O-N 2.77Å; F118-K120 PolarHBondContact O-N 3.14Å
121	R	87.3	Confident	81.6	Confident	59 Å²	59	52.9 Å²	52.9	22%	0.223	28%	0.276	C	S	.	.			trans	-87.2	137.4	175.5	-179.1	169.5	172.4	179.3	-3.2	111.2	K36 N37 H123	K36-R121 VanDerWaalsContact CE-NH2 3.35Å; N37-R121 PolarHBondContact O-NH1 3.36Å; R121-H123 VanDerWaalsContact CD-CE1 3.48Å; R121-H123 WeakPolarHBondContact CD-CE1 3.21Å; R121-H123 PolarHBondContact O-CD2 2.72Å
122	F	83	Confident	81	Confident	30 Å²	30	53.9 Å²	53.9	13%	0.132	29%	0.293	C	S	.	.			trans	-75.3	124	170.3	179.9	-104.6	0	0	0	110.3	K86 Y90 G124 K126	K86-F122 HydrophobicContact CB-CD1 3.96Å; K86-F122 HydrophobicContact CB-CE1 3.97Å; K86-F122 HydrophobicContact CD-CE1 3.81Å; K86-F122 HydrophobicContact CD-CZ 4.35Å; K86-F122 HydrophobicContact CG-CE1 4.38Å; Y90-F122 HydrophobicContact CD1-CB 3.9Å; Y90-F122 HydrophobicContact CD1-CD2 4.35Å; Y90-F122 AromaticContact CD2-CD2 3.61Å; Y90-F122 HydrophobicContact CD2-CD2 3.61Å; Y90-F122 HydrophobicContact CD2-CE2 4.35Å; Y90-F122 HydrophobicContact CE1-CB 4.44Å; Y90-F122 AromaticContact CE2-CD2 3.99Å; Y90-F122 HydrophobicContact CE2-CD2 3.99Å; Y90-F122 HydrophobicContact CG-CB 3.98Å; Y90-F122 AromaticContact CG-CD2 3.84Å; Y90-F122 HydrophobicContact CG-CD2 3.84Å; Y90-F122 HydrophobicContact CG-CG 4.36Å; F122-G124 WeakPolarHBondContact CE1-O 3.48Å; F122-G124 WeakPolarHBondContact CZ-O 3.32Å; F122-K126 VanDerWaalsContact CZ-O 3.32Å; F122-K126 WeakPolarHBondContact CZ-O 3.28Å
123	H	71.8	Confident	80.4	Confident	154 Å²	154	55.7 Å²	55.7	71%	0.713	31%	0.309	S	S	*	.			trans	-118.9	14.4	-176.5	-72.6	-74.4	0	0	0	114	R121	R121-H123 VanDerWaalsContact CD-CE1 3.48Å; R121-H123 WeakPolarHBondContact CD-CE1 3.21Å; R121-H123 PolarHBondContact O-CD2 2.72Å
124	G	65.5	Low	79.7	Confident	30 Å²	30	57.8 Å²	57.8	31%	0.309	33%	0.327	S	S	.	.			trans	-105.4	142.2	-165	0	0	0	0	0	116.1	F122 K126	F122-G124 WeakPolarHBondContact CE1-O 3.48Å; F122-G124 WeakPolarHBondContact CZ-O 3.32Å; G124-K126 PolarHBondContact O-N 3.42Å
125	A	59	Low	78.8	Confident	96 Å²	96	58.1 Å²	58.1	79%	0.793	33%	0.331	S	S	*	.	S	Bend	trans	-73.5	-8.7	155	0	0	0	0	0	112.5
126	K	64.2	Low	78.2	Confident	178 Å²	178	63.8 Å²	63.8	77%	0.774	36%	0.361	S	S	*	.	S	Bend	trans	-84.4	179	-178.7	-64.5	-174.4	179.7	179.7	0	111.3	F122 G124	F122-K126 VanDerWaalsContact CZ-O 3.32Å; F122-K126 WeakPolarHBondContact CZ-O 3.28Å; G124-K126 PolarHBondContact O-N 3.42Å
127	C	77.8	Confident	77.4	Confident	41 Å²	41	69.2 Å²	69.2	28%	0.277	38%	0.384	S	S	.	.			trans	-63.8	142.4	173.5	-53.3	0	0	0	0	111.3	C72 Y129	C72-C127 HydrophobicContact CB-CB 3.73Å; C72-C127 WeakPolarHBondContact CB-SG 3.47Å; C72-C127 WeakPolarHBondContact SG-CB 3.32Å; C72-C127 CovalentContact SG-SG 2.02Å; C72-C127 PolarHBondContact SG-SG 3.38Å; C127-Y129 WeakPolarHBondContact CB-O 3.45Å; C127-Y129 PolarHBondContact O-N 3.35Å
128	S	84.1	Confident	76.5	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.021	39%	0.394	C	S	.	.	S	Bend	trans	-68.9	-13.5	170.8	47.5	0	0	0	0	113	K86 T89 Y90 W91	K86-S128 WeakPolarHBondContact O-CB 3.38Å; T89-S128 VanDerWaalsContact O-O 3.13Å; T89-S128 PolarHBondContact OG1-OG 3.45Å; Y90-S128 WeakPolarHBondContact CA-O 3.42Å; W91-S128 VanDerWaalsContact CD1-O 3.23Å; W91-S128 PolarHBondContact N-O 3.06Å
129	Y	78.4	Confident	75.5	Confident	52 Å²	52	74.1 Å²	74.1	20%	0.204	42%	0.418	C	S	.	.	S	Bend	trans	-147.9	160.5	176.7	53.4	-89.2	0	0	0	111	F8 Y85 C127	F8-Y129 HydrophobicContact CE1-CD2 4.2Å; F8-Y129 HydrophobicContact CE1-CE2 4.44Å; Y85-Y129 HydrophobicContact CE1-CE1 4.4Å; C127-Y129 WeakPolarHBondContact CB-O 3.45Å; C127-Y129 PolarHBondContact O-N 3.35Å
130	A	73.9	Confident	74.7	Confident	52 Å²	52	74.8 Å²	74.8	43%	0.43	44%	0.44	S	S	.	.			trans	-72.9	134.7	174.6	0	0	0	0	0	111	F137	A130-F137 HydrophobicContact CB-CD1 4Å; A130-F137 HydrophobicContact CB-CD2 3.76Å; A130-F137 HydrophobicContact CB-CE1 4.06Å; A130-F137 HydrophobicContact CB-CE2 3.82Å; A130-F137 HydrophobicContact CB-CG 3.85Å; A130-F137 HydrophobicContact CB-CZ 3.97Å
131	K	73.2	Confident	73.8	Confident	107 Å²	107	73 Å²	73	47%	0.465	45%	0.45	S	S	.	.			trans	-82.2	130.5	172.2	-71.6	-179.1	177.8	152.1	0	110.1	G70 C72 F137	G70-K131 PolarHBondContact O-NZ 3.5Å; C72-K131 WeakPolarHBondContact SG-CE 3.42Å; C72-K131 PolarHBondContact SG-NZ 3.06Å; K131-F137 WeakPolarHBondContact O-CZ 3.1Å
132	G	73.5	Confident	73.1	Confident	56 Å²	56	71.4 Å²	71.4	58%	0.577	45%	0.445	S	S	*	.	S	Bend	trans	157.5	-165.1	174.4	0	0	0	0	0	111.6
133	T	74.9	Confident	72.7	Confident	95 Å²	95	74.2 Å²	74.2	58%	0.583	46%	0.462	S	S	*	.	S	Bend	trans	-67	136.1	173	-45.7	0	0	0	0	109.7	N136	T133-N136 WeakPolarHBondContact CB-ND2 3.46Å; T133-N136 WeakPolarHBondContact O-CB 3.47Å; T133-N136 PolarHBondContact O-N 3.37Å
134	A	73.4	Confident	72.9	Confident	45 Å²	45	70.4 Å²	70.4	37%	0.372	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	143.4	174.9	0	0	0	0	0	110.7	N136	A134-N136 PolarHBondContact O-N 3.46Å
135	C	71.8	Confident	73.2	Confident	26 Å²	26	72.5 Å²	72.5	18%	0.176	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	-7.3	179.1	-56.4	0	0	0	0	118.7	F137 C138 C144 G147	C135-F137 PolarHBondContact O-N 3.21Å; C135-F137 VanDerWaalsContact O-N 3.08Å; C135-C138 VanDerWaalsContact CA-SG 3.53Å; C135-C138 PolarHBondContact O-N 2.94Å; C135-C138 VanDerWaalsContact O-N 3.15Å; C135-C138 PolarHBondContact O-SG 3.31Å; C135-C138 VanDerWaalsContact O-SG 3.34Å; C135-C144 HydrophobicContact CB-CB 3.41Å; C135-C144 VanDerWaalsContact CB-CB 3.41Å; C135-C144 WeakPolarHBondContact CB-SG 3.35Å; C135-C144 VanDerWaalsContact SG-CA 3.56Å; C135-C144 WeakPolarHBondContact SG-CB 3.24Å; C135-C144 CovalentContact SG-SG 2.01Å; C135-C144 PolarHBondContact SG-SG 2.75Å; C135-G147 VanDerWaalsContact SG-CA 3.58Å
136	N	78.2	Confident	73.6	Confident	118 Å²	118	74.7 Å²	74.7	63%	0.631	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.9	174.3	-81.6	3.6	0	0	0	113.4	T133 A134	T133-N136 WeakPolarHBondContact CB-ND2 3.46Å; T133-N136 WeakPolarHBondContact O-CB 3.47Å; T133-N136 PolarHBondContact O-N 3.37Å; A134-N136 PolarHBondContact O-N 3.46Å
137	F	76.1	Confident	73.7	Confident	117 Å²	117	67.3 Å²	67.3	51%	0.513	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	7.9	-178.1	-54.5	-80.2	0	0	0	113.1	A130 K131 C135 S139	A130-F137 HydrophobicContact CB-CD1 4Å; A130-F137 HydrophobicContact CB-CD2 3.76Å; A130-F137 HydrophobicContact CB-CE1 4.06Å; A130-F137 HydrophobicContact CB-CE2 3.82Å; A130-F137 HydrophobicContact CB-CG 3.85Å; A130-F137 HydrophobicContact CB-CZ 3.97Å; K131-F137 WeakPolarHBondContact O-CZ 3.1Å; C135-F137 PolarHBondContact O-N 3.21Å; C135-F137 VanDerWaalsContact O-N 3.08Å; F137-S139 PolarHBondContact O-N 3Å
138	C	73.5	Confident	73.2	Confident	31 Å²	31	67.5 Å²	67.5	21%	0.209	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-63.3	127.8	177.4	-63.5	0	0	0	0	110.3	C135 L142 C149	C135-C138 VanDerWaalsContact CA-SG 3.53Å; C135-C138 PolarHBondContact O-N 2.94Å; C135-C138 VanDerWaalsContact O-N 3.15Å; C135-C138 PolarHBondContact O-SG 3.31Å; C135-C138 VanDerWaalsContact O-SG 3.34Å; C138-L142 HydrophobicContact CB-CB 4.29Å; C138-C149 WeakPolarHBondContact CA-SG 3.46Å; C138-C149 HydrophobicContact CB-CB 3.8Å; C138-C149 WeakPolarHBondContact CB-SG 3.38Å; C138-C149 WeakPolarHBondContact SG-CA 3.3Å; C138-C149 WeakPolarHBondContact SG-CB 3.5Å; C138-C149 CovalentContact SG-SG 2.04Å; C138-C149 PolarHBondContact SG-SG 3.17Å
139	S	72.3	Confident	72.5	Confident	72 Å²	72	67.7 Å²	67.7	50%	0.503	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-63.1	153.7	173.6	-59.2	0	0	0	0	110.9	F137 G141 L142	F137-S139 PolarHBondContact O-N 3Å; S139-G141 PolarHBondContact O-N 3.47Å; S139-L142 WeakPolarHBondContact O-CB 3.46Å; S139-L142 PolarHBondContact O-N 3.04Å; S139-L142 VanDerWaalsContact O-N 3.1Å
140	A	71.3	Confident	71.9	Confident	110 Å²	110	66.3 Å²	66.3	91%	0.909	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	131.1	175.9	0	0	0	0	0	111.1
141	G	67.5	Low	71.4	Confident	61 Å²	61	71.1 Å²	71.1	63%	0.629	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	5.4	-175.9	0	0	0	0	0	115.3	S139	S139-G141 PolarHBondContact O-N 3.47Å
142	L	72.6	Confident	70.3	Confident	25 Å²	25	69.3 Å²	69.3	13%	0.131	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.1	170.1	-53.5	177.1	0	0	0	110	F12 C138 S139 C149 C150 K151	F12-L142 HydrophobicContact CD2-CD1 4.28Å; F12-L142 HydrophobicContact CE2-CD1 3.52Å; F12-L142 HydrophobicContact CZ-CD1 3.87Å; F12-L142 HydrophobicContact CZ-CD2 4.23Å; C138-L142 HydrophobicContact CB-CB 4.29Å; S139-L142 WeakPolarHBondContact O-CB 3.46Å; S139-L142 PolarHBondContact O-N 3.04Å; S139-L142 VanDerWaalsContact O-N 3.1Å; L142-C149 HydrophobicContact CB-CB 4.36Å; L142-C149 HydrophobicContact CD1-CB 4.02Å; L142-C150 CarbonylContact C-O 3.53Å; L142-C150 VanDerWaalsContact CA-O 3.22Å; L142-C150 WeakPolarHBondContact CA-O 3.46Å; L142-K151 VanDerWaalsContact CD2-CA 3.47Å; L142-K151 HydrophobicContact CD2-CB 3.84Å; L142-K151 HydrophobicContact CD2-CG 3.75Å
143	N	75	Confident	69	Low	89 Å²	89	69.9 Å²	69.9	48%	0.476	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	148.7	169.6	-75.3	-16	0	0	0	111.1	C150 S152	N143-C150 PolarHBondContact N-O 2.92Å; N143-C150 PolarHBondContact O-N 3.18Å; N143-S152 PolarHBondContact ND2-OG 2.8Å; N143-S152 PolarHBondContact OD1-OG 3.42Å
144	C	75.1	Confident	67.1	Low	75 Å²	75	73.7 Å²	73.7	51%	0.507	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	118.9	166.3	-174.4	0	0	0	0	109.9	C135 L148	C135-C144 HydrophobicContact CB-CB 3.41Å; C135-C144 VanDerWaalsContact CB-CB 3.41Å; C135-C144 WeakPolarHBondContact CB-SG 3.35Å; C135-C144 VanDerWaalsContact SG-CA 3.56Å; C135-C144 WeakPolarHBondContact SG-CB 3.24Å; C135-C144 CovalentContact SG-SG 2.01Å; C135-C144 PolarHBondContact SG-SG 2.75Å; C144-L148 CarbonylContact C-O 3.48Å; C144-L148 WeakPolarHBondContact CA-O 3.5Å
145	V	70.7	Confident	65.5	Low	73 Å²	73	76.8 Å²	76.8	44%	0.442	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	116.4	171.8	-177	0	0	0	0	107.1	G147 L148 C150	V145-G147 PolarHBondContact O-N 2.93Å; V145-G147 VanDerWaalsContact O-N 3.14Å; V145-L148 PolarHBondContact N-O 3.25Å; V145-L148 WeakPolarHBondContact O-CB 3.44Å; V145-L148 PolarHBondContact O-N 2.83Å; V145-C150 HydrophobicContact CB-CB 4.36Å; V145-C150 HydrophobicContact CG2-CB 4Å
146	D	67.6	Low	63.6	Low	143 Å²	143	78 Å²	78	77%	0.765	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	38.9	-179.2	-58	-38.3	0	0	0	114.5	L148	D146-L148 VanDerWaalsContact C-N 3.31Å; D146-L148 PolarHBondContact O-N 2.86Å
147	G	67.6	Low	61.7	Low	23 Å²	23	80.7 Å²	80.7	24%	0.237	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	-0	-179.7	0	0	0	0	0	115	C135 V145	C135-G147 VanDerWaalsContact SG-CA 3.58Å; V145-G147 PolarHBondContact O-N 2.93Å; V145-G147 VanDerWaalsContact O-N 3.14Å
148	L	66.5	Low	59.7	Low	45 Å²	45	82.8 Å²	82.8	24%	0.236	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	146	179.3	-56.5	-177.3	0	0	0	112.1	A7 L10 C144 V145 D146 C150	A7-L148 VanDerWaalsContact O-CD2 3.27Å; A7-L148 WeakPolarHBondContact O-CD2 3.2Å; L10-L148 WeakPolarHBondContact O-CD2 3.43Å; C144-L148 CarbonylContact C-O 3.48Å; C144-L148 WeakPolarHBondContact CA-O 3.5Å; V145-L148 PolarHBondContact N-O 3.25Å; V145-L148 WeakPolarHBondContact O-CB 3.44Å; V145-L148 PolarHBondContact O-N 2.83Å; D146-L148 VanDerWaalsContact C-N 3.31Å; D146-L148 PolarHBondContact O-N 2.86Å; L148-C150 PolarHBondContact O-N 2.94Å
149	C	69.7	Low	58.1	Low	7 Å²	7	83 Å²	83	5%	0.047	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	105.9	174.9	-59.1	0	0	0	0	110.3	C138 L142	C138-C149 WeakPolarHBondContact CA-SG 3.46Å; C138-C149 HydrophobicContact CB-CB 3.8Å; C138-C149 WeakPolarHBondContact CB-SG 3.38Å; C138-C149 WeakPolarHBondContact SG-CA 3.3Å; C138-C149 WeakPolarHBondContact SG-CB 3.5Å; C138-C149 CovalentContact SG-SG 2.04Å; C138-C149 PolarHBondContact SG-SG 3.17Å; L142-C149 HydrophobicContact CB-CB 4.36Å; L142-C149 HydrophobicContact CD1-CB 4.02Å
150	C	66.7	Low	57	Low	22 Å²	22	81.8 Å²	81.8	15%	0.149	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.1	-175.5	-70.2	0	0	0	0	110	L142 N143 V145 L148 S152	L142-C150 CarbonylContact C-O 3.53Å; L142-C150 VanDerWaalsContact CA-O 3.22Å; L142-C150 WeakPolarHBondContact CA-O 3.46Å; N143-C150 PolarHBondContact N-O 2.92Å; N143-C150 PolarHBondContact O-N 3.18Å; V145-C150 HydrophobicContact CB-CB 4.36Å; V145-C150 HydrophobicContact CG2-CB 4Å; L148-C150 PolarHBondContact O-N 2.94Å; C150-S152 PolarHBondContact O-N 2.82Å
151	K	63.1	Low	56.7	Low	153 Å²	153	79.7 Å²	79.7	67%	0.665	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59	136.6	167.2	-134.8	169.3	-170.9	178.9	0	107.4	L142 V153	L142-K151 VanDerWaalsContact CD2-CA 3.47Å; L142-K151 HydrophobicContact CD2-CB 3.84Å; L142-K151 HydrophobicContact CD2-CG 3.75Å; K151-V153 HydrophobicContact CB-CG2 4.13Å; K151-V153 WeakPolarHBondContact O-CG2 3.34Å; K151-V153 PolarHBondContact O-N 2.84Å
152	S	49.5	Very low	56.7	Low	69 Å²	69	77.5 Å²	77.5	48%	0.483	45%	0.445	S	S	.	.			trans	-63.7	85.2	171	-51.8	0	0	0	0	107.8	N143 C150 E154	N143-S152 PolarHBondContact ND2-OG 2.8Å; N143-S152 PolarHBondContact OD1-OG 3.42Å; C150-S152 PolarHBondContact O-N 2.82Å; S152-E154 PolarHBondContact O-N 2.86Å
153	V	45.6	Very low	57.2	Low	68 Å²	68	78.5 Å²	78.5	41%	0.412	45%	0.451	S	S	.	.			trans	-86.6	100.4	174.9	172.6	0	0	0	0	104	K151 S156	K151-V153 HydrophobicContact CB-CG2 4.13Å; K151-V153 WeakPolarHBondContact O-CG2 3.34Å; K151-V153 PolarHBondContact O-N 2.84Å; V153-S156 VanDerWaalsContact CG1-CB 3.41Å; V153-S156 WeakPolarHBondContact CG1-OG 3.07Å
154	E	35.9	Very low	57.8	Low	175 Å²	175	77.1 Å²	77.1	82%	0.818	44%	0.44	S	S	*	.	S	Bend	trans	-41.8	126.7	144.2	-78.5	-170.8	161.2	0	0	105.6	S152 S156	S152-E154 PolarHBondContact O-N 2.86Å; E154-S156 VanDerWaalsContact C-N 3.26Å; E154-S156 WeakPolarHBondContact O-CA 3.39Å; E154-S156 PolarHBondContact O-N 2.73Å
155	P	38.5	Very low	58.6	Low	111 Å²	111	73.7 Å²	73.7	72%	0.721	42%	0.417	S	S	*	.			trans	-45.3	92.5	-165.1	17.1	-31.1	0	0	0	110.6	K157 L163	P155-K157 PolarHBondContact O-N 2.74Å; P155-L163 HydrophobicContact CB-CD2 4.24Å
156	S	33.8	Very low	59.5	Low	51 Å²	51	77 Å²	77	36%	0.357	43%	0.427	S	S	.	.			trans	-77.5	122.5	-175.1	61.6	0	0	0	0	103.4	V153 E154 D158 G159	V153-S156 VanDerWaalsContact CG1-CB 3.41Å; V153-S156 WeakPolarHBondContact CG1-OG 3.07Å; E154-S156 VanDerWaalsContact C-N 3.26Å; E154-S156 WeakPolarHBondContact O-CA 3.39Å; E154-S156 PolarHBondContact O-N 2.73Å; S156-D158 PolarHBondContact O-N 2.97Å; S156-G159 PolarHBondContact O-N 2.9Å
157	K	36.8	Very low	60.7	Low	174 Å²	174	77.4 Å²	77.4	76%	0.757	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	-13.3	-179.4	-74.1	177.9	170.6	179.4	0	115	P155 L163	P155-K157 PolarHBondContact O-N 2.74Å; K157-L163 HydrophobicContact CG-CD1 4.22Å
158	D	34.3	Very low	62	Low	162 Å²	162	78.1 Å²	78.1	87%	0.866	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	8.3	-172.5	-64.6	-36.3	0	0	0	115.8	S156	S156-D158 PolarHBondContact O-N 2.97Å
159	G	40.9	Very low	63.5	Low	34 Å²	34	77.9 Å²	77.9	35%	0.351	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-7.6	-171	0	0	0	0	0	118.2	K13 S156	K13-G159 WeakPolarHBondContact CE-O 3.44Å; K13-G159 PolarHBondContact NZ-O 2.85Å; S156-G159 PolarHBondContact O-N 2.9Å
160	S	49.5	Very low	64.8	Low	48 Å²	48	79 Å²	79	34%	0.336	43%	0.431	S	S	.	.	S	Bend	trans	-91.4	160	167.3	60.6	0	0	0	0	109.1	G162	S160-G162 VanDerWaalsContact CB-O 3.29Å; S160-G162 WeakPolarHBondContact CB-O 3.28Å; S160-G162 PolarHBondContact O-N 2.76Å; S160-G162 PolarHBondContact OG-O 2.98Å
161	C	63.8	Low	66.3	Low	65 Å²	65	78 Å²	78	44%	0.439	42%	0.424	S	S	.	.	S	Bend	trans	-66.9	48.4	171.3	-68.5	0	0	0	0	111.4	K218 F266 C267	C161-K218 HydrophobicContact CB-CG 4.49Å; C161-K218 VanDerWaalsContact O-CG 3.3Å; C161-K218 WeakPolarHBondContact O-CG 3.43Å; C161-F266 HydrophobicContact CB-CD1 3.6Å; C161-F266 HydrophobicContact CB-CE1 4.18Å; C161-F266 HydrophobicContact CB-CG 4.26Å; C161-C267 PolarHBondContact O-N 3.34Å; C161-C267 VanDerWaalsContact O-N 3.13Å; C161-C267 PolarHBondContact O-SG 3.43Å
162	G	68	Low	67.9	Low	15 Å²	15	72.5 Å²	72.5	16%	0.155	40%	0.399	C	S	.	.	S	Bend	trans	90.8	156.7	-163.7	0	0	0	0	0	113.5	S160 C267	S160-G162 VanDerWaalsContact CB-O 3.29Å; S160-G162 WeakPolarHBondContact CB-O 3.28Å; S160-G162 PolarHBondContact O-N 2.76Å; S160-G162 PolarHBondContact OG-O 2.98Å; G162-C267 VanDerWaalsContact CA-SG 3.54Å; G162-C267 WeakPolarHBondContact O-CA 3.47Å
163	L	82.3	Confident	70.1	Confident	47 Å²	47	70 Å²	70	25%	0.246	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-82.2	156.3	172	-68.3	172.5	0	0	0	110.6	P155 K157 P165 S215 C216 C267	P155-L163 HydrophobicContact CB-CD2 4.24Å; K157-L163 HydrophobicContact CG-CD1 4.22Å; L163-P165 WeakPolarHBondContact O-CD 3.38Å; L163-S215 PolarHBondContact N-O 3.33Å; L163-C216 WeakPolarHBondContact O-CB 3.41Å; L163-C267 WeakPolarHBondContact O-CB 3.14Å
164	K	88.8	Confident	72.4	Confident	60 Å²	60	66.8 Å²	66.8	26%	0.261	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-55	127.1	169.1	-174	173.6	176.4	179.4	0	109.5	C267 E317	K164-C267 WeakPolarHBondContact CA-O 3.47Å; K164-E317 VanDerWaalsContact NZ-CD 3.3Å; K164-E317 IonicContact NZ-OE1 3.61Å; K164-E317 PolarHBondContact NZ-OE1 2.55Å
165	P	90.3	Very high	75	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.019	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-63	143.2	174.4	-18.1	29.8	0	0	0	111	L163 L168 C216 L219 W314	L163-P165 WeakPolarHBondContact O-CD 3.38Å; P165-L168 HydrophobicContact CB-CD2 3.93Å; P165-L168 HydrophobicContact CG-CD2 4.34Å; P165-C216 HydrophobicContact CG-CB 4.45Å; P165-L219 HydrophobicContact CG-CD1 4.22Å; P165-L219 HydrophobicContact CG-CD2 3.98Å; P165-L219 HydrophobicContact CG-CG 4.44Å; P165-W314 HydrophobicContact CG-CH2 3.75Å; P165-W314 HydrophobicContact CG-CZ2 3.59Å; P165-W314 HydrophobicContact CG-CZ3 4.48Å
166	E	91.1	Very high	77.4	Confident	141 Å²	141	56.4 Å²	56.4	66%	0.659	30%	0.301	S	S	*	.	S	Bend	trans	-78.9	162	175.5	-62.6	-179.2	-173.4	0	0	110.8	L168 Q213	E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 2.7Å; E166-Q213 PolarHBondContact O-NE2 2.77Å
167	Q	92.1	Very high	79.6	Confident	153 Å²	153	61.4 Å²	61.4	72%	0.715	31%	0.312	S	S	*	.	S	Bend	trans	55.3	44.1	170.6	-55.9	178.4	-8.9	0	0	114.2	P210	Q167-P210 VanDerWaalsContact O-CD 3.31Å; Q167-P210 WeakPolarHBondContact O-CD 3.43Å
168	L	95.5	Very high	81.6	Confident	37 Å²	37	57.8 Å²	57.8	19%	0.194	31%	0.309	C	S	.	.			trans	-61.8	142.7	176.9	-57.8	173.5	0	0	0	111	P165 E166 I208 W314	P165-L168 HydrophobicContact CB-CD2 3.93Å; P165-L168 HydrophobicContact CG-CD2 4.34Å; E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 2.7Å; L168-I208 WeakPolarHBondContact CA-O 3.27Å; L168-W314 HydrophobicContact CD1-CB 3.56Å; L168-W314 HydrophobicContact CD1-CD2 3.98Å; L168-W314 HydrophobicContact CD1-CE3 4.32Å; L168-W314 HydrophobicContact CD1-CG 3.62Å; L168-W314 HydrophobicContact CD2-CD2 4.1Å; L168-W314 HydrophobicContact CD2-CE3 3.81Å; L168-W314 HydrophobicContact CD2-CZ3 4.26Å
169	V	96.7	Very high	83.5	Confident	40 Å²	40	54.2 Å²	54.2	24%	0.242	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	147.8	179	-65	0	0	0	0	110.5	L171 T186 Y207 I208 P210	V169-L171 PolarHBondContact O-N 2.95Å; V169-T186 HydrophobicContact CG2-CG2 3.73Å; V169-Y207 CarbonylContact O-C 3.56Å; V169-Y207 VanDerWaalsContact O-CA 3.3Å; V169-Y207 WeakPolarHBondContact O-CA 3.37Å; V169-I208 HydrophobicContact CG2-CG1 4.18Å; V169-I208 PolarHBondContact N-O 3.08Å; V169-I208 PolarHBondContact O-N 2.83Å; V169-P210 HydrophobicContact CG1-CB 4.19Å; V169-P210 HydrophobicContact CG1-CG 4.06Å; V169-P210 HydrophobicContact CG2-CB 4.04Å; V169-P210 HydrophobicContact CG2-CG 4.46Å
170	P	97.3	Very high	85.3	Confident	31 Å²	31	57.1 Å²	57.1	20%	0.201	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	136.3	178.5	27.2	-35	0	0	0	110.9	Y172 T186 T204 Y207	P170-Y172 HydrophobicContact CB-CE1 3.96Å; P170-Y172 HydrophobicContact CG-CE1 4.05Å; P170-Y172 HydrophobicContact CG-CE2 4.18Å; P170-Y172 VanDerWaalsContact CG-OH 3.3Å; P170-Y172 WeakPolarHBondContact CG-OH 3.37Å; P170-T186 WeakPolarHBondContact O-CA 3.24Å; P170-T204 HydrophobicContact CB-CG2 3.81Å; P170-Y207 HydrophobicContact CB-CD1 4.32Å; P170-Y207 HydrophobicContact CB-CE1 3.9Å
171	L	97.6	Very high	86.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	105.9	168.2	-175.4	60.8	0	0	0	108.3	V169 L184 T186 T204 I205 G206 I208 L222 I257	V169-L171 PolarHBondContact O-N 2.95Å; L171-L184 HydrophobicContact CD1-CB 4.01Å; L171-L184 HydrophobicContact CD2-CD1 4.34Å; L171-L184 HydrophobicContact CG-CB 4.38Å; L171-T186 HydrophobicContact CD1-CG2 4.1Å; L171-T204 WeakPolarHBondContact O-CA 3.39Å; L171-I205 HydrophobicContact CB-CG2 3.96Å; L171-I205 HydrophobicContact CD2-CG2 3.71Å; L171-I205 HydrophobicContact CG-CG2 3.76Å; L171-I205 WeakPolarHBondContact O-CG2 3.41Å; L171-I205 PolarHBondContact O-N 3.41Å; L171-G206 WeakPolarHBondContact CB-O 3.43Å; L171-G206 PolarHBondContact N-O 3.05Å; L171-I208 HydrophobicContact CB-CG2 4.23Å; L171-I208 HydrophobicContact CD1-CD1 4.15Å; L171-I208 HydrophobicContact CD2-CG2 3.95Å; L171-L222 HydrophobicContact CD2-CD2 4.27Å; L171-I257 HydrophobicContact CD1-CG2 3.76Å
172	Y	96.9	Very high	88.2	Confident	38 Å²	38	52.1 Å²	52.1	15%	0.149	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	140.2	178.3	-55.7	-63.6	0	0	0	110.6	P170 L184 T185 N188 K191	P170-Y172 HydrophobicContact CB-CE1 3.96Å; P170-Y172 HydrophobicContact CG-CE1 4.05Å; P170-Y172 HydrophobicContact CG-CE2 4.18Å; P170-Y172 VanDerWaalsContact CG-OH 3.3Å; P170-Y172 WeakPolarHBondContact CG-OH 3.37Å; Y172-L184 VanDerWaalsContact O-CA 3.28Å; Y172-L184 WeakPolarHBondContact O-CA 3.13Å; Y172-T185 WeakPolarHBondContact CB-O 3.23Å; Y172-T185 HydrophobicContact CD2-CG2 4.42Å; Y172-T185 VanDerWaalsContact CD2-O 3.3Å; Y172-T185 WeakPolarHBondContact CD2-O 3.41Å; Y172-T185 PolarHBondContact N-O 3.23Å; Y172-T185 PolarHBondContact O-N 2.84Å; Y172-N188 HydrophobicContact CE2-CB 4.36Å; Y172-K191 HydrophobicContact CD1-CD 3.75Å; Y172-K191 HydrophobicContact CD2-CB 4.3Å; Y172-K191 HydrophobicContact CD2-CD 4.01Å; Y172-K191 HydrophobicContact CE1-CD 4.2Å; Y172-K191 HydrophobicContact CE2-CD 4.42Å; Y172-K191 HydrophobicContact CG-CD 3.65Å; Y172-K191 HydrophobicContact CG-CG 4.38Å
173	K	95.6	Very high	89.3	Confident	18 Å²	18	51.6 Å²	51.6	8%	0.078	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.1	174.6	-176.2	175.1	72.8	180	0	109.3	T182 L184 N202 G203 I205 Y285	K173-T182 HydrophobicContact CD-CG2 4.05Å; K173-T182 HydrophobicContact CG-CG2 3.51Å; K173-L184 HydrophobicContact CB-CD2 4Å; K173-L184 HydrophobicContact CG-CD2 3.97Å; K173-N202 HydrophobicContact CB-CB 4.23Å; K173-N202 HydrophobicContact CD-CB 4.37Å; K173-N202 VanDerWaalsContact CE-CB 3.47Å; K173-N202 HydrophobicContact CG-CB 4.11Å; K173-N202 WeakPolarHBondContact O-CA 3.34Å; K173-N202 WeakPolarHBondContact O-CB 3.33Å; K173-N202 PolarHBondContact O-N 3.35Å; K173-G203 PolarHBondContact N-O 2.72Å; K173-I205 HydrophobicContact CB-CB 4.16Å; K173-I205 HydrophobicContact CD-CD1 4.15Å; K173-I205 HydrophobicContact CD-CG1 4.49Å; K173-Y285 WeakPolarHBondContact CD-O 3.44Å; K173-Y285 PolarHBondContact NZ-O 2.88Å; K173-Y285 VanDerWaalsContact NZ-O 3.14Å
174	L	94.8	Very high	90	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.2	175.1	-61	97.1	0	0	0	110.2	T182 A183 T185 K191 L194 K195 Y199 F200	L174-T182 CarbonylContact O-C 3.6Å; L174-T182 VanDerWaalsContact O-CA 3.32Å; L174-T182 WeakPolarHBondContact O-CA 3.24Å; L174-A183 HydrophobicContact CB-CB 4.48Å; L174-A183 PolarHBondContact N-O 3.28Å; L174-A183 PolarHBondContact O-N 3.29Å; L174-T185 HydrophobicContact CD1-CG2 4.07Å; L174-K191 HydrophobicContact CD1-CB 4.35Å; L174-K191 HydrophobicContact CD1-CG 4.05Å; L174-K191 HydrophobicContact CD2-CG 3.92Å; L174-K191 HydrophobicContact CG-CG 4.33Å; L174-L194 HydrophobicContact CD1-CD1 4.14Å; L174-L194 HydrophobicContact CD2-CB 3.74Å; L174-L194 HydrophobicContact CD2-CD1 4.35Å; L174-K195 HydrophobicContact CD2-CG 3.99Å; L174-Y199 HydrophobicContact CB-CD1 4.11Å; L174-F200 CarbonylContact C-O 3.58Å; L174-F200 VanDerWaalsContact CA-O 3.3Å; L174-F200 WeakPolarHBondContact CA-O 3.46Å
175	Y	91.2	Very high	90.3	Very high	47 Å²	47	47 Å²	47	18%	0.184	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.7	-174.6	-176.2	-108.8	0	0	0	112.2	R177 K180 Y181 F200 N202 F284	Y175-R177 HydrophobicContact CD1-CG 3.89Å; Y175-R177 HydrophobicContact CE1-CB 4.46Å; Y175-R177 HydrophobicContact CE1-CG 4Å; Y175-R177 PolarHBondContact O-N 2.87Å; Y175-K180 WeakPolarHBondContact OH-CA 3.22Å; Y175-K180 WeakPolarHBondContact OH-CD 3.37Å; Y175-Y181 WeakPolarHBondContact CD2-O 3.47Å; Y175-F200 PolarHBondContact N-O 2.69Å; Y175-F200 PolarHBondContact O-N 2.82Å; Y175-N202 VanDerWaalsContact CB-OD1 3.29Å; Y175-N202 WeakPolarHBondContact CB-OD1 3.03Å; Y175-F284 HydrophobicContact CD2-CD2 4.06Å; Y175-F284 HydrophobicContact CD2-CE2 4.24Å; Y175-F284 AromaticContact CE2-CD2 3.97Å; Y175-F284 HydrophobicContact CE2-CD2 3.97Å; Y175-F284 HydrophobicContact CE2-CE2 4.35Å
176	D	87.8	Confident	90.6	Very high	21 Å²	21	48.4 Å²	48.4	11%	0.112	24%	0.236	C	C	.	.			trans	-85	108.4	170.6	-173.3	-32.5	0	0	0	109.5	S178 Q179 K180 Y181 Y199	D176-S178 VanDerWaalsContact C-N 3.3Å; D176-S178 PolarHBondContact O-N 3.01Å; D176-S178 WeakPolarHBondContact OD1-CA 3.45Å; D176-S178 VanDerWaalsContact OD1-CB 3.31Å; D176-S178 WeakPolarHBondContact OD1-CB 3.46Å; D176-S178 PolarHBondContact OD1-N 3.46Å; D176-Q179 HydrophobicContact CB-CB 4.39Å; D176-Q179 PolarHBondContact OD1-N 3.33Å; D176-K180 VanDerWaalsContact O-CA 3.28Å; D176-K180 WeakPolarHBondContact O-CA 3.46Å; D176-K180 PolarHBondContact O-N 2.88Å; D176-Y181 HydrophobicContact CB-CD2 3.76Å; D176-Y181 HydrophobicContact CB-CE2 3.28Å; D176-Y181 PolarHBondContact N-O 2.8Å; D176-Y181 WeakPolarHBondContact OD2-CE2 3.27Å; D176-Y181 VanDerWaalsContact OD2-CZ 3.29Å; D176-Y181 PolarHBondContact OD2-OH 2.8Å; D176-Y199 HydrophobicContact CB-CD1 4.04Å; D176-Y199 HydrophobicContact CB-CE1 3.78Å; D176-Y199 HydrophobicContact CB-CE2 4.32Å; D176-Y199 HydrophobicContact CB-CG 4.44Å
177	R	80.1	Confident	90.7	Very high	155 Å²	155	46.1 Å²	46.1	59%	0.585	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-29	-180	-74.2	-172.3	179.6	-167.4	2.1	113.5	Y175 K180	Y175-R177 HydrophobicContact CD1-CG 3.89Å; Y175-R177 HydrophobicContact CE1-CB 4.46Å; Y175-R177 HydrophobicContact CE1-CG 4Å; Y175-R177 PolarHBondContact O-N 2.87Å; R177-K180 WeakPolarHBondContact O-CD 3.48Å; R177-K180 VanDerWaalsContact O-CE 3.24Å; R177-K180 WeakPolarHBondContact O-CE 3.44Å; R177-K180 PolarHBondContact O-NZ 3.13Å
178	S	78.3	Confident	90.8	Very high	99 Å²	99	42.7 Å²	42.7	69%	0.692	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-47.3	-178.7	-178.9	0	0	0	0	109.7	D176	D176-S178 VanDerWaalsContact C-N 3.3Å; D176-S178 PolarHBondContact O-N 3.01Å; D176-S178 WeakPolarHBondContact OD1-CA 3.45Å; D176-S178 VanDerWaalsContact OD1-CB 3.31Å; D176-S178 WeakPolarHBondContact OD1-CB 3.46Å; D176-S178 PolarHBondContact OD1-N 3.46Å
179	Q	74.5	Confident	90.8	Very high	87 Å²	87	47.6 Å²	47.6	41%	0.407	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-7.7	-170.2	-59	-76.5	-14	0	0	114.1	D176 Y181	D176-Q179 HydrophobicContact CB-CB 4.39Å; D176-Q179 PolarHBondContact OD1-N 3.33Å; Q179-Y181 HydrophobicContact CB-CD1 3.62Å; Q179-Y181 HydrophobicContact CB-CE1 3.04Å; Q179-Y181 HydrophobicContact CB-CE2 4.13Å; Q179-Y181 HydrophobicContact CB-CG 4.41Å; Q179-Y181 WeakPolarHBondContact CB-OH 3.5Å; Q179-Y181 HydrophobicContact CG-CE1 3.78Å; Q179-Y181 VanDerWaalsContact CG-OH 3.26Å; Q179-Y181 WeakPolarHBondContact CG-OH 3.45Å; Q179-Y181 PolarHBondContact O-N 3.05Å
180	K	78	Confident	90.6	Very high	94 Å²	94	47.9 Å²	47.9	41%	0.409	24%	0.24	S	C	.	.			trans	65.4	27.4	173.2	-50.4	-64.7	-177.1	-162.3	0	115.2	Y175 D176 R177 L278 S282	Y175-K180 WeakPolarHBondContact OH-CA 3.22Å; Y175-K180 WeakPolarHBondContact OH-CD 3.37Å; D176-K180 VanDerWaalsContact O-CA 3.28Å; D176-K180 WeakPolarHBondContact O-CA 3.46Å; D176-K180 PolarHBondContact O-N 2.88Å; R177-K180 WeakPolarHBondContact O-CD 3.48Å; R177-K180 VanDerWaalsContact O-CE 3.24Å; R177-K180 WeakPolarHBondContact O-CE 3.44Å; R177-K180 PolarHBondContact O-NZ 3.13Å; K180-L278 HydrophobicContact CB-CD1 4.34Å; K180-L278 HydrophobicContact CG-CD1 4.38Å; K180-S282 WeakPolarHBondContact O-CB 3.42Å
181	Y	83.8	Confident	90.5	Very high	8 Å²	8	47.8 Å²	47.8	3%	0.031	24%	0.236	C	C	.	.			trans	-115.5	162.4	174	51.5	-119.1	0	0	0	112.3	Y175 D176 Q179 Y199 E232 L233	Y175-Y181 WeakPolarHBondContact CD2-O 3.47Å; D176-Y181 HydrophobicContact CB-CD2 3.76Å; D176-Y181 HydrophobicContact CB-CE2 3.28Å; D176-Y181 PolarHBondContact N-O 2.8Å; D176-Y181 WeakPolarHBondContact OD2-CE2 3.27Å; D176-Y181 VanDerWaalsContact OD2-CZ 3.29Å; D176-Y181 PolarHBondContact OD2-OH 2.8Å; Q179-Y181 HydrophobicContact CB-CD1 3.62Å; Q179-Y181 HydrophobicContact CB-CE1 3.04Å; Q179-Y181 HydrophobicContact CB-CE2 4.13Å; Q179-Y181 HydrophobicContact CB-CG 4.41Å; Q179-Y181 WeakPolarHBondContact CB-OH 3.5Å; Q179-Y181 HydrophobicContact CG-CE1 3.78Å; Q179-Y181 VanDerWaalsContact CG-OH 3.26Å; Q179-Y181 WeakPolarHBondContact CG-OH 3.45Å; Q179-Y181 PolarHBondContact O-N 3.05Å; Y181-Y199 HydrophobicContact CD2-CE1 4.37Å; Y181-Y199 AromaticContact CE2-CE1 3.89Å; Y181-Y199 HydrophobicContact CE2-CE1 3.89Å; Y181-Y199 AromaticContact CE2-CZ 3.77Å; Y181-Y199 WeakPolarHBondContact CE2-OH 3.49Å; Y181-E232 HydrophobicContact CE1-CB 3.68Å; Y181-E232 HydrophobicContact CE2-CB 4.02Å; Y181-E232 WeakPolarHBondContact OH-CB 2.96Å; Y181-L233 HydrophobicContact CD1-CB 4.4Å; Y181-L233 HydrophobicContact CD1-CD1 4.34Å
182	T	90.5	Very high	90.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.8	179.6	-56	0	0	0	0	111	K173 L174 L184 N283 F284 Y285	K173-T182 HydrophobicContact CD-CG2 4.05Å; K173-T182 HydrophobicContact CG-CG2 3.51Å; L174-T182 CarbonylContact O-C 3.6Å; L174-T182 VanDerWaalsContact O-CA 3.32Å; L174-T182 WeakPolarHBondContact O-CA 3.24Å; T182-L184 HydrophobicContact CG2-CD2 3.88Å; T182-L184 HydrophobicContact CG2-CG 4.41Å; T182-N283 PolarHBondContact N-O 3.21Å; T182-N283 PolarHBondContact OG1-O 3.37Å; T182-F284 WeakPolarHBondContact OG1-CA 3.44Å; T182-F284 WeakPolarHBondContact OG1-CD2 3.5Å; T182-Y285 HydrophobicContact CG2-CD2 4.09Å
183	A	92.6	Very high	90.2	Very high	5 Å²	5	54.9 Å²	54.9	4%	0.041	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	135.7	166.5	0	0	0	0	0	110	L174 L194 Y199 L234 Y236	L174-A183 HydrophobicContact CB-CB 4.48Å; L174-A183 PolarHBondContact N-O 3.28Å; L174-A183 PolarHBondContact O-N 3.29Å; A183-L194 HydrophobicContact CB-CD1 3.77Å; A183-Y199 HydrophobicContact CB-CD1 4.32Å; A183-Y199 HydrophobicContact CB-CE1 4Å; A183-L234 HydrophobicContact CB-CD1 4.44Å; A183-Y236 WeakPolarHBondContact CA-OH 2.93Å
184	L	95.7	Very high	90.1	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.8	176	-58.3	-178.7	0	0	0	108.8	L171 Y172 K173 T182 I205 Y236 Y285 F311	L171-L184 HydrophobicContact CD1-CB 4.01Å; L171-L184 HydrophobicContact CD2-CD1 4.34Å; L171-L184 HydrophobicContact CG-CB 4.38Å; Y172-L184 VanDerWaalsContact O-CA 3.28Å; Y172-L184 WeakPolarHBondContact O-CA 3.13Å; K173-L184 HydrophobicContact CB-CD2 4Å; K173-L184 HydrophobicContact CG-CD2 3.97Å; T182-L184 HydrophobicContact CG2-CD2 3.88Å; T182-L184 HydrophobicContact CG2-CG 4.41Å; L184-I205 HydrophobicContact CD2-CG2 4.43Å; L184-Y236 HydrophobicContact CB-CD1 4.17Å; L184-Y236 HydrophobicContact CB-CD2 4.34Å; L184-Y236 HydrophobicContact CB-CE1 3.74Å; L184-Y236 HydrophobicContact CB-CE2 3.98Å; L184-Y236 HydrophobicContact CB-CG 4.46Å; L184-Y236 HydrophobicContact CD1-CD1 4.32Å; L184-Y236 HydrophobicContact CD1-CD2 3.68Å; L184-Y236 HydrophobicContact CD1-CE2 4.04Å; L184-Y236 HydrophobicContact CD1-CG 3.86Å; L184-Y236 HydrophobicContact CG-CD2 3.95Å; L184-Y236 HydrophobicContact CG-CE1 4.38Å; L184-Y236 HydrophobicContact CG-CE2 3.76Å; L184-Y236 HydrophobicContact CG-CG 4.38Å; L184-Y236 VanDerWaalsContact N-CZ 3.33Å; L184-Y236 PolarHBondContact N-OH 2.92Å; L184-Y285 HydrophobicContact CD1-CD2 4.25Å; L184-Y285 HydrophobicContact CD1-CG 4.18Å; L184-F311 HydrophobicContact CD1-CZ 4.07Å
185	T	95	Very high	90.1	Very high	9 Å²	9	59 Å²	59	6%	0.055	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	147.4	179.2	-171	0	0	0	0	111.9	Y172 L174 L187 V190 K191	Y172-T185 WeakPolarHBondContact CB-O 3.23Å; Y172-T185 HydrophobicContact CD2-CG2 4.42Å; Y172-T185 VanDerWaalsContact CD2-O 3.3Å; Y172-T185 WeakPolarHBondContact CD2-O 3.41Å; Y172-T185 PolarHBondContact N-O 3.23Å; Y172-T185 PolarHBondContact O-N 2.84Å; L174-T185 HydrophobicContact CD1-CG2 4.07Å; T185-L187 PolarHBondContact OG1-N 3.21Å; T185-V190 HydrophobicContact CG2-CB 4.18Å; T185-V190 HydrophobicContact CG2-CG1 4.13Å; T185-K191 HydrophobicContact CG2-CB 4.33Å
186	T	96.4	Very high	90.2	Very high	32 Å²	32	64.2 Å²	64.2	20%	0.196	32%	0.32	C	S	.	.	S	Bend	trans	-92.8	-9.5	170.6	48.4	0	0	0	0	112.5	V169 P170 L171 I208 I257	V169-T186 HydrophobicContact CG2-CG2 3.73Å; P170-T186 WeakPolarHBondContact O-CA 3.24Å; L171-T186 HydrophobicContact CD1-CG2 4.1Å; T186-I208 HydrophobicContact CG2-CD1 3.53Å; T186-I208 HydrophobicContact CG2-CG1 3.74Å; T186-I257 HydrophobicContact CG2-CG2 4.03Å; T186-I257 PolarHBondContact OG1-O 2.87Å
187	L	95	Very high	90.3	Very high	93 Å²	93	69 Å²	69	49%	0.487	35%	0.345	S	S	.	.			trans	-95.4	114.9	-173.9	-63.3	179.2	0	0	0	110.8	T185 M189 V190 K191	T185-L187 PolarHBondContact OG1-N 3.21Å; L187-M189 HydrophobicContact CB-CG 4.21Å; L187-M189 PolarHBondContact O-N 2.91Å; L187-V190 HydrophobicContact CB-CB 4.11Å; L187-V190 HydrophobicContact CB-CG2 3.77Å; L187-V190 HydrophobicContact CD1-CG2 3.97Å; L187-V190 PolarHBondContact O-N 3.04Å; L187-K191 PolarHBondContact O-N 3.28Å
188	N	93.8	Very high	90.8	Very high	80 Å²	80	64.5 Å²	64.5	43%	0.428	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-32.4	178.4	-166.8	62.2	0	0	0	112.3	Y172 V190 K191 E192	Y172-N188 HydrophobicContact CE2-CB 4.36Å; N188-V190 PolarHBondContact O-N 3.2Å; N188-K191 WeakPolarHBondContact O-CB 3.18Å; N188-K191 PolarHBondContact O-N 3.4Å; N188-K191 WeakPolarHBondContact OD1-CE 3.34Å; N188-K191 PolarHBondContact OD1-NZ 2.82Å; N188-E192 WeakPolarHBondContact O-CG 3.5Å; N188-E192 PolarHBondContact O-N 3.14Å
189	M	94.1	Very high	91.5	Very high	141 Å²	141	61 Å²	61	70%	0.695	32%	0.319	S	S	*	.	H	α-helix	trans	-63.4	-38.7	174.7	66.2	-175.2	-66.7	0	0	112.9	L187 E192 Q193	L187-M189 HydrophobicContact CB-CG 4.21Å; L187-M189 PolarHBondContact O-N 2.91Å; M189-E192 PolarHBondContact O-N 2.89Å; M189-Q193 WeakPolarHBondContact O-CB 3.04Å; M189-Q193 PolarHBondContact O-N 2.79Å
190	V	93	Very high	92.4	Very high	45 Å²	45	61.7 Å²	61.7	27%	0.273	32%	0.32	S	S	.	.	H	α-helix	trans	-70.8	-39.8	177.5	177.8	0	0	0	0	109.7	T185 L187 N188 E192 Q193 L194	T185-V190 HydrophobicContact CG2-CB 4.18Å; T185-V190 HydrophobicContact CG2-CG1 4.13Å; L187-V190 HydrophobicContact CB-CB 4.11Å; L187-V190 HydrophobicContact CB-CG2 3.77Å; L187-V190 HydrophobicContact CD1-CG2 3.97Å; L187-V190 PolarHBondContact O-N 3.04Å; N188-V190 PolarHBondContact O-N 3.2Å; V190-E192 PolarHBondContact O-N 2.83Å; V190-Q193 PolarHBondContact O-N 2.89Å; V190-L194 HydrophobicContact CG1-CD1 3.96Å; V190-L194 HydrophobicContact CG1-CG 4.3Å; V190-L194 WeakPolarHBondContact O-CB 3.04Å; V190-L194 VanDerWaalsContact O-CG 3.31Å; V190-L194 WeakPolarHBondContact O-CG 3.38Å; V190-L194 PolarHBondContact O-N 2.93Å
191	K	94.7	Very high	93.2	Very high	29 Å²	29	59.5 Å²	59.5	13%	0.126	31%	0.313	C	S	.	.	H	α-helix	trans	-55	-51.8	172	-175.8	-173.2	101.8	-175.9	0	111.6	Y172 L174 T185 L187 N188 Q193 L194 K195 D201	Y172-K191 HydrophobicContact CD1-CD 3.75Å; Y172-K191 HydrophobicContact CD2-CB 4.3Å; Y172-K191 HydrophobicContact CD2-CD 4.01Å; Y172-K191 HydrophobicContact CE1-CD 4.2Å; Y172-K191 HydrophobicContact CE2-CD 4.42Å; Y172-K191 HydrophobicContact CG-CD 3.65Å; Y172-K191 HydrophobicContact CG-CG 4.38Å; L174-K191 HydrophobicContact CD1-CB 4.35Å; L174-K191 HydrophobicContact CD1-CG 4.05Å; L174-K191 HydrophobicContact CD2-CG 3.92Å; L174-K191 HydrophobicContact CG-CG 4.33Å; T185-K191 HydrophobicContact CG2-CB 4.33Å; L187-K191 PolarHBondContact O-N 3.28Å; N188-K191 WeakPolarHBondContact O-CB 3.18Å; N188-K191 PolarHBondContact O-N 3.4Å; N188-K191 WeakPolarHBondContact OD1-CE 3.34Å; N188-K191 PolarHBondContact OD1-NZ 2.82Å; K191-Q193 VanDerWaalsContact C-N 3.35Å; K191-Q193 PolarHBondContact O-N 3.26Å; K191-L194 PolarHBondContact O-N 3.32Å; K191-K195 HydrophobicContact CG-CD 4.26Å; K191-K195 WeakPolarHBondContact O-CG 3.1Å; K191-K195 PolarHBondContact O-N 2.82Å; K191-D201 VanDerWaalsContact CE-OD2 3.29Å; K191-D201 WeakPolarHBondContact CE-OD2 3.37Å; K191-D201 IonicContact NZ-OD2 3.78Å
192	E	95.9	Very high	93.7	Very high	73 Å²	73	62.2 Å²	62.2	34%	0.341	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-37.6	179.7	-66.1	-51.6	132.9	0	0	112.4	N188 M189 V190 K195 L196	N188-E192 WeakPolarHBondContact O-CG 3.5Å; N188-E192 PolarHBondContact O-N 3.14Å; M189-E192 PolarHBondContact O-N 2.89Å; V190-E192 PolarHBondContact O-N 2.83Å; E192-K195 PolarHBondContact O-N 3.06Å; E192-K195 IonicContact OE1-NZ 2.93Å; E192-K195 PolarHBondContact OE1-NZ 3.5Å; E192-K195 IonicContact OE2-NZ 2.76Å; E192-K195 PolarHBondContact OE2-NZ 3.31Å; E192-L196 WeakPolarHBondContact O-CG 3.32Å; E192-L196 PolarHBondContact O-N 3.35Å; E192-L196 VanDerWaalsContact O-N 3.1Å
193	Q	93.8	Very high	93.9	Very high	115 Å²	115	63.6 Å²	63.6	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-45.1	174.8	-173.7	177.2	7.8	0	0	112.3	M189 V190 K191 K195 L196 L197	M189-Q193 WeakPolarHBondContact O-CB 3.04Å; M189-Q193 PolarHBondContact O-N 2.79Å; V190-Q193 PolarHBondContact O-N 2.89Å; K191-Q193 VanDerWaalsContact C-N 3.35Å; K191-Q193 PolarHBondContact O-N 3.26Å; Q193-K195 VanDerWaalsContact C-N 3.32Å; Q193-K195 PolarHBondContact O-N 2.03Å; Q193-L196 WeakPolarHBondContact O-CB 3.34Å; Q193-L196 PolarHBondContact O-N 3.04Å; Q193-L197 WeakPolarHBondContact O-CG 3.42Å; Q193-L197 PolarHBondContact O-N 3.24Å; Q193-L197 VanDerWaalsContact O-N 3.11Å
194	L	92.5	Very high	94	Very high	25 Å²	25	66.2 Å²	66.2	13%	0.131	36%	0.358	C	S	.	.	H	α-helix	trans	-64.4	-36.8	177.7	-74.2	172.2	0	0	0	111.9	L174 A183 V190 K191 L196 L197 G198 Y199	L174-L194 HydrophobicContact CD1-CD1 4.14Å; L174-L194 HydrophobicContact CD2-CB 3.74Å; L174-L194 HydrophobicContact CD2-CD1 4.35Å; A183-L194 HydrophobicContact CB-CD1 3.77Å; V190-L194 HydrophobicContact CG1-CD1 3.96Å; V190-L194 HydrophobicContact CG1-CG 4.3Å; V190-L194 WeakPolarHBondContact O-CB 3.04Å; V190-L194 VanDerWaalsContact O-CG 3.31Å; V190-L194 WeakPolarHBondContact O-CG 3.38Å; V190-L194 PolarHBondContact O-N 2.93Å; K191-L194 PolarHBondContact O-N 3.32Å; L194-L196 VanDerWaalsContact C-N 3.34Å; L194-L196 PolarHBondContact O-N 2.91Å; L194-L197 CarbonylContact O-C 3.53Å; L194-L197 WeakPolarHBondContact O-CA 2.78Å; L194-L197 WeakPolarHBondContact O-CB 2.98Å; L194-L197 PolarHBondContact O-N 3.37Å; L194-L197 VanDerWaalsContact O-N 3.07Å; L194-G198 PolarHBondContact O-N 2.98Å; L194-Y199 HydrophobicContact CB-CD1 4.49Å; L194-Y199 HydrophobicContact CB-CD2 4.32Å; L194-Y199 HydrophobicContact CB-CG 4.09Å; L194-Y199 HydrophobicContact CD2-CD1 4.27Å; L194-Y199 HydrophobicContact CD2-CD2 4.09Å; L194-Y199 HydrophobicContact CD2-CE1 4.04Å; L194-Y199 HydrophobicContact CD2-CE2 3.89Å; L194-Y199 HydrophobicContact CD2-CG 4.29Å; L194-Y199 WeakPolarHBondContact O-CB 2.95Å; L194-Y199 WeakPolarHBondContact O-CD2 3.48Å; L194-Y199 PolarHBondContact O-N 2.71Å
195	K	94.5	Very high	94	Very high	80 Å²	80	66.4 Å²	66.4	35%	0.348	36%	0.359	S	S	.	.	H	α-helix	trans	-60.4	-42.5	172.6	-73.4	166.1	64.3	-163.7	0	111.9	L174 K191 E192 Q193 L197 G198 D201	L174-K195 HydrophobicContact CD2-CG 3.99Å; K191-K195 HydrophobicContact CG-CD 4.26Å; K191-K195 WeakPolarHBondContact O-CG 3.1Å; K191-K195 PolarHBondContact O-N 2.82Å; E192-K195 PolarHBondContact O-N 3.06Å; E192-K195 IonicContact OE1-NZ 2.93Å; E192-K195 PolarHBondContact OE1-NZ 3.5Å; E192-K195 IonicContact OE2-NZ 2.76Å; E192-K195 PolarHBondContact OE2-NZ 3.31Å; Q193-K195 VanDerWaalsContact C-N 3.32Å; Q193-K195 PolarHBondContact O-N 2.03Å; K195-L197 PolarHBondContact O-N 3.36Å; K195-G198 PolarHBondContact O-N 3.2Å; K195-D201 HydrophobicContact CD-CB 4.08Å; K195-D201 HydrophobicContact CG-CB 4.19Å
196	L	93.3	Very high	94.1	Very high	156 Å²	156	66.2 Å²	66.2	82%	0.817	36%	0.358	S	S	*	.	H	α-helix	trans	-63.6	-28.3	174.3	-68	171.2	0	0	0	112.6	E192 Q193 L194 G198	E192-L196 WeakPolarHBondContact O-CG 3.32Å; E192-L196 PolarHBondContact O-N 3.35Å; E192-L196 VanDerWaalsContact O-N 3.1Å; Q193-L196 WeakPolarHBondContact O-CB 3.34Å; Q193-L196 PolarHBondContact O-N 3.04Å; L194-L196 VanDerWaalsContact C-N 3.34Å; L194-L196 PolarHBondContact O-N 2.91Å; L196-G198 PolarHBondContact O-N 2.74Å
197	L	90.2	Very high	94.2	Very high	121 Å²	121	66.3 Å²	66.3	63%	0.634	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	5.8	173	-63.9	173.5	0	0	0	113.4	Q193 L194 K195 Y199	Q193-L197 WeakPolarHBondContact O-CG 3.42Å; Q193-L197 PolarHBondContact O-N 3.24Å; Q193-L197 VanDerWaalsContact O-N 3.11Å; L194-L197 CarbonylContact O-C 3.53Å; L194-L197 WeakPolarHBondContact O-CA 2.78Å; L194-L197 WeakPolarHBondContact O-CB 2.98Å; L194-L197 PolarHBondContact O-N 3.37Å; L194-L197 VanDerWaalsContact O-N 3.07Å; K195-L197 PolarHBondContact O-N 3.36Å; L197-Y199 HydrophobicContact CB-CD2 4.24Å; L197-Y199 HydrophobicContact CB-CE2 4.41Å
198	G	91.5	Very high	94.3	Very high	60 Å²	60	61.9 Å²	61.9	62%	0.619	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	9.2	175.3	0	0	0	0	0	115.1	L194 K195 L196	L194-G198 PolarHBondContact O-N 2.98Å; K195-G198 PolarHBondContact O-N 3.2Å; L196-G198 PolarHBondContact O-N 2.74Å
199	Y	92.8	Very high	94.4	Very high	27 Å²	27	58.1 Å²	58.1	11%	0.106	31%	0.312	C	S	.	.			trans	-69.5	139	172.6	-73.4	-124.4	0	0	0	109.9	L174 D176 Y181 A183 L194 L197	L174-Y199 HydrophobicContact CB-CD1 4.11Å; D176-Y199 HydrophobicContact CB-CD1 4.04Å; D176-Y199 HydrophobicContact CB-CE1 3.78Å; D176-Y199 HydrophobicContact CB-CE2 4.32Å; D176-Y199 HydrophobicContact CB-CG 4.44Å; Y181-Y199 HydrophobicContact CD2-CE1 4.37Å; Y181-Y199 AromaticContact CE2-CE1 3.89Å; Y181-Y199 HydrophobicContact CE2-CE1 3.89Å; Y181-Y199 AromaticContact CE2-CZ 3.77Å; Y181-Y199 WeakPolarHBondContact CE2-OH 3.49Å; A183-Y199 HydrophobicContact CB-CD1 4.32Å; A183-Y199 HydrophobicContact CB-CE1 4Å; L194-Y199 HydrophobicContact CB-CD1 4.49Å; L194-Y199 HydrophobicContact CB-CD2 4.32Å; L194-Y199 HydrophobicContact CB-CG 4.09Å; L194-Y199 HydrophobicContact CD2-CD1 4.27Å; L194-Y199 HydrophobicContact CD2-CD2 4.09Å; L194-Y199 HydrophobicContact CD2-CE1 4.04Å; L194-Y199 HydrophobicContact CD2-CE2 3.89Å; L194-Y199 HydrophobicContact CD2-CG 4.29Å; L194-Y199 WeakPolarHBondContact O-CB 2.95Å; L194-Y199 WeakPolarHBondContact O-CD2 3.48Å; L194-Y199 PolarHBondContact O-N 2.71Å; L197-Y199 HydrophobicContact CB-CD2 4.24Å; L197-Y199 HydrophobicContact CB-CE2 4.41Å
200	F	94	Very high	94.4	Very high	100 Å²	100	54 Å²	54	44%	0.439	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.6	172.9	-168	-98.9	0	0	0	109.4	L174 Y175 N202	L174-F200 CarbonylContact C-O 3.58Å; L174-F200 VanDerWaalsContact CA-O 3.3Å; L174-F200 WeakPolarHBondContact CA-O 3.46Å; Y175-F200 PolarHBondContact N-O 2.69Å; Y175-F200 PolarHBondContact O-N 2.82Å; F200-N202 WeakPolarHBondContact CD1-OD1 3.46Å; F200-N202 PolarHBondContact O-N 3.39Å; F200-N202 PolarHBondContact O-OD1 2.79Å
201	D	94.8	Very high	94.5	Very high	48 Å²	48	56.2 Å²	56.2	26%	0.257	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	111.6	175	-170.3	-12.2	0	0	0	109.1	K191 K195 G203	K191-D201 VanDerWaalsContact CE-OD2 3.29Å; K191-D201 WeakPolarHBondContact CE-OD2 3.37Å; K191-D201 IonicContact NZ-OD2 3.78Å; K195-D201 HydrophobicContact CD-CB 4.08Å; K195-D201 HydrophobicContact CG-CB 4.19Å; D201-G203 VanDerWaalsContact C-N 3.3Å; D201-G203 WeakPolarHBondContact OD1-CA 3.23Å; D201-G203 PolarHBondContact OD1-N 2.95Å
202	N	93.2	Very high	94.4	Very high	66 Å²	66	61 Å²	61	35%	0.353	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	10.5	176.4	-78.8	76.6	0	0	0	112.1	K173 Y175 F200	K173-N202 HydrophobicContact CB-CB 4.23Å; K173-N202 HydrophobicContact CD-CB 4.37Å; K173-N202 VanDerWaalsContact CE-CB 3.47Å; K173-N202 HydrophobicContact CG-CB 4.11Å; K173-N202 WeakPolarHBondContact O-CA 3.34Å; K173-N202 WeakPolarHBondContact O-CB 3.33Å; K173-N202 PolarHBondContact O-N 3.35Å; Y175-N202 VanDerWaalsContact CB-OD1 3.29Å; Y175-N202 WeakPolarHBondContact CB-OD1 3.03Å; F200-N202 WeakPolarHBondContact CD1-OD1 3.46Å; F200-N202 PolarHBondContact O-N 3.39Å; F200-N202 PolarHBondContact O-OD1 2.79Å
203	G	94.3	Very high	94	Very high	29 Å²	29	58.6 Å²	58.6	30%	0.299	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77	-156.3	179.2	0	0	0	0	0	113.3	K173 D201	K173-G203 PolarHBondContact N-O 2.72Å; D201-G203 VanDerWaalsContact C-N 3.3Å; D201-G203 WeakPolarHBondContact OD1-CA 3.23Å; D201-G203 PolarHBondContact OD1-N 2.95Å
204	T	95.9	Very high	93.5	Very high	59 Å²	59	59.3 Å²	59.3	36%	0.362	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.3	-178.4	-56.9	0	0	0	0	109.9	P170 L171 G206 Y207	P170-T204 HydrophobicContact CB-CG2 3.81Å; L171-T204 WeakPolarHBondContact O-CA 3.39Å; T204-G206 VanDerWaalsContact C-N 3.34Å; T204-G206 WeakPolarHBondContact CG2-O 3.48Å; T204-Y207 HydrophobicContact CG2-CD2 4.46Å; T204-Y207 HydrophobicContact CG2-CE2 3.98Å
205	I	95.9	Very high	93	Very high	7 Å²	7	60.2 Å²	60.2	4%	0.036	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-26.9	174.3	-164.6	176.9	0	0	0	111.8	L171 K173 L184 V273 S287 I313	L171-I205 HydrophobicContact CB-CG2 3.96Å; L171-I205 HydrophobicContact CD2-CG2 3.71Å; L171-I205 HydrophobicContact CG-CG2 3.76Å; L171-I205 WeakPolarHBondContact O-CG2 3.41Å; L171-I205 PolarHBondContact O-N 3.41Å; K173-I205 HydrophobicContact CB-CB 4.16Å; K173-I205 HydrophobicContact CD-CD1 4.15Å; K173-I205 HydrophobicContact CD-CG1 4.49Å; L184-I205 HydrophobicContact CD2-CG2 4.43Å; I205-V273 HydrophobicContact CD1-CG1 3.92Å; I205-V273 HydrophobicContact CD1-CG2 4.4Å; I205-S287 WeakPolarHBondContact CG1-OG 3.49Å; I205-S287 WeakPolarHBondContact O-CB 3.45Å; I205-S287 PolarHBondContact O-OG 2.85Å; I205-I313 HydrophobicContact CG2-CD1 4.05Å
206	G	96.6	Very high	92.5	Very high	4 Å²	4	56.5 Å²	56.5	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.6	-160	175.6	0	0	0	0	0	109.7	L171 T204	L171-G206 WeakPolarHBondContact CB-O 3.43Å; L171-G206 PolarHBondContact N-O 3.05Å; T204-G206 VanDerWaalsContact C-N 3.34Å; T204-G206 WeakPolarHBondContact CG2-O 3.48Å
207	Y	97.7	Very high	91.9	Very high	35 Å²	35	52.9 Å²	52.9	14%	0.137	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.9	-173.8	-68.4	-99.2	0	0	0	110.4	V169 P170 T204 I313 W314 E316	V169-Y207 CarbonylContact O-C 3.56Å; V169-Y207 VanDerWaalsContact O-CA 3.3Å; V169-Y207 WeakPolarHBondContact O-CA 3.37Å; P170-Y207 HydrophobicContact CB-CD1 4.32Å; P170-Y207 HydrophobicContact CB-CE1 3.9Å; T204-Y207 HydrophobicContact CG2-CD2 4.46Å; T204-Y207 HydrophobicContact CG2-CE2 3.98Å; Y207-I313 WeakPolarHBondContact O-CB 3.31Å; Y207-W314 PolarHBondContact N-O 3.04Å; Y207-W314 VanDerWaalsContact O-CE3 3.32Å; Y207-W314 PolarHBondContact O-N 3.48Å; Y207-W314 VanDerWaalsContact O-N 3.11Å; Y207-E316 HydrophobicContact CD2-CB 4.17Å; Y207-E316 HydrophobicContact CE1-CG 4.5Å; Y207-E316 HydrophobicContact CE2-CB 3.42Å; Y207-E316 VanDerWaalsContact CE2-CB 3.42Å; Y207-E316 HydrophobicContact CE2-CG 3.77Å; Y207-E316 WeakPolarHBondContact OH-CG 3.02Å; Y207-E316 PolarHBondContact OH-OE1 2.91Å; Y207-E316 PolarHBondContact OH-OE2 3.34Å
208	I	97.5	Very high	91.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	161.8	179.4	69.4	172.3	0	0	0	110.8	L168 V169 L171 T186 I257 V260 I313	L168-I208 WeakPolarHBondContact CA-O 3.27Å; V169-I208 HydrophobicContact CG2-CG1 4.18Å; V169-I208 PolarHBondContact N-O 3.08Å; V169-I208 PolarHBondContact O-N 2.83Å; L171-I208 HydrophobicContact CB-CG2 4.23Å; L171-I208 HydrophobicContact CD1-CD1 4.15Å; L171-I208 HydrophobicContact CD2-CG2 3.95Å; T186-I208 HydrophobicContact CG2-CD1 3.53Å; T186-I208 HydrophobicContact CG2-CG1 3.74Å; I208-I257 HydrophobicContact CD1-CG2 4.11Å; I208-V260 HydrophobicContact CB-CG1 4.11Å; I208-V260 HydrophobicContact CG2-CG1 3.58Å; I208-I313 HydrophobicContact CG2-CB 4.24Å; I208-I313 HydrophobicContact CG2-CG2 3.64Å
209	S	96	Very high	91.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-80.4	130.6	174.8	-165.9	0	0	0	0	110	I211 Q213 G258 Y259	S209-I211 PolarHBondContact O-N 3.04Å; S209-I211 PolarHBondContact OG-O 3.37Å; S209-Q213 PolarHBondContact OG-NE2 3.03Å; S209-G258 CarbonylContact O-C 3.48Å; S209-G258 WeakPolarHBondContact O-CA 3.24Å; S209-Y259 PolarHBondContact N-O 3.18Å; S209-Y259 PolarHBondContact O-N 3.46Å
210	P	95.5	Very high	91.6	Very high	54 Å²	54	51.2 Å²	51.2	35%	0.351	30%	0.299	S	S	.	.	S	Bend	trans	-73.2	-17.9	178.6	29.7	-34.6	0	0	0	112.7	Q167 V169	Q167-P210 VanDerWaalsContact O-CD 3.31Å; Q167-P210 WeakPolarHBondContact O-CD 3.43Å; V169-P210 HydrophobicContact CG1-CB 4.19Å; V169-P210 HydrophobicContact CG1-CG 4.06Å; V169-P210 HydrophobicContact CG2-CB 4.04Å; V169-P210 HydrophobicContact CG2-CG 4.46Å
211	I	93.8	Very high	91.6	Very high	93 Å²	93	48.8 Å²	48.8	48%	0.477	29%	0.293	S	S	.	.	S	Bend	trans	-135.9	158.1	-175.1	59.7	172.2	0	0	0	110.7	S209 Q213	S209-I211 PolarHBondContact O-N 3.04Å; S209-I211 PolarHBondContact OG-O 3.37Å; I211-Q213 HydrophobicContact CD1-CG 4.34Å; I211-Q213 HydrophobicContact CG1-CG 3.98Å; I211-Q213 PolarHBondContact O-N 3Å
212	E	92.7	Very high	91.7	Very high	128 Å²	128	46.5 Å²	46.5	60%	0.598	28%	0.281	S	S	*	.			trans	-72.3	122.4	170.3	-157.2	169	168.3	0	0	109.6	Y259	E212-Y259 HydrophobicContact CB-CD1 3.95Å; E212-Y259 HydrophobicContact CB-CE1 3.47Å; E212-Y259 VanDerWaalsContact CB-CE1 3.47Å; E212-Y259 HydrophobicContact CB-CE2 4.22Å; E212-Y259 HydrophobicContact CB-CG 4.48Å; E212-Y259 HydrophobicContact CG-CD1 3.98Å; E212-Y259 HydrophobicContact CG-CE1 3.69Å; E212-Y259 VanDerWaalsContact N-CE2 3.3Å
213	Q	86.7	Confident	91.6	Very high	23 Å²	23	44.2 Å²	44.2	11%	0.107	27%	0.268	C	S	.	.			trans	-112.6	126.1	179.6	-61.7	-174.9	26.6	0	0	110.8	E166 S209 I211 S215 C216 L219	E166-Q213 PolarHBondContact O-NE2 2.77Å; S209-Q213 PolarHBondContact OG-NE2 3.03Å; I211-Q213 HydrophobicContact CD1-CG 4.34Å; I211-Q213 HydrophobicContact CG1-CG 3.98Å; I211-Q213 PolarHBondContact O-N 3Å; Q213-S215 PolarHBondContact O-N 3.48Å; Q213-S215 VanDerWaalsContact O-N 3.13Å; Q213-C216 PolarHBondContact O-N 3.43Å; Q213-L219 HydrophobicContact CB-CD1 4.02Å; Q213-L219 VanDerWaalsContact N-CD1 3.34Å
214	S	84.1	Confident	91.5	Very high	130 Å²	130	44.4 Å²	44.4	91%	0.909	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.5	179.6	59.6	0	0	0	0	113.7	C216	S214-C216 PolarHBondContact O-N 3.1Å
215	S	81.6	Confident	91.2	Very high	44 Å²	44	41.7 Å²	41.7	31%	0.308	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.3	173.6	57.7	0	0	0	0	112.9	L163 Q213	L163-S215 PolarHBondContact N-O 3.33Å; Q213-S215 PolarHBondContact O-N 3.48Å; Q213-S215 VanDerWaalsContact O-N 3.13Å
216	C	83.8	Confident	90.9	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.02	24%	0.244	C	C	.	.			trans	-131.5	91	178.3	170.5	0	0	0	0	110.9	L163 P165 Q213 S214 K218 L219 C267	L163-C216 WeakPolarHBondContact O-CB 3.41Å; P165-C216 HydrophobicContact CG-CB 4.45Å; Q213-C216 PolarHBondContact O-N 3.43Å; S214-C216 PolarHBondContact O-N 3.1Å; C216-K218 PolarHBondContact O-N 2.89Å; C216-L219 HydrophobicContact CB-CD1 4.25Å; C216-L219 HydrophobicContact CB-CG 3.93Å; C216-L219 PolarHBondContact O-N 2.01Å; C216-L219 VanDerWaalsContact O-N 3.09Å; C216-L219 VanDerWaalsContact SG-CG 3.52Å; C216-L219 PolarHBondContact SG-N 3.14Å; C216-C267 HydrophobicContact CB-CB 3.8Å; C216-C267 WeakPolarHBondContact CB-SG 3.47Å; C216-C267 WeakPolarHBondContact SG-CB 3.27Å; C216-C267 CovalentContact SG-SG 1.96Å; C216-C267 PolarHBondContact SG-SG 2.83Å
217	G	82.4	Confident	90.3	Very high	79 Å²	79	41.5 Å²	41.5	81%	0.814	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	1.8	175.1	0	0	0	0	0	115.2
218	K	85	Confident	89.4	Confident	99 Å²	99	43.3 Å²	43.3	43%	0.43	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-3.6	174.4	-57.8	-61.2	-174.4	177.5	0	112.8	C161 C216 K220 V261 F266	C161-K218 HydrophobicContact CB-CG 4.49Å; C161-K218 VanDerWaalsContact O-CG 3.3Å; C161-K218 WeakPolarHBondContact O-CG 3.43Å; C216-K218 PolarHBondContact O-N 2.89Å; K218-K220 PolarHBondContact O-N 2.89Å; K218-V261 HydrophobicContact CB-CG1 4.27Å; K218-F266 HydrophobicContact CB-CB 4.24Å; K218-F266 HydrophobicContact CB-CD2 4.26Å; K218-F266 HydrophobicContact CB-CG 4.46Å; K218-F266 HydrophobicContact CD-CD2 4.45Å; K218-F266 HydrophobicContact CG-CB 4.46Å; K218-F266 HydrophobicContact CG-CD2 4.27Å; K218-F266 HydrophobicContact CG-CG 4.33Å
219	L	90.3	Very high	88.4	Confident	13 Å²	13	48.2 Å²	48.2	7%	0.068	29%	0.294	C	S	.	.			trans	-60.3	132.4	173.3	-77.7	178.5	0	0	0	109.9	P165 Q213 C216 Y259 V260 V261 W314	P165-L219 HydrophobicContact CG-CD1 4.22Å; P165-L219 HydrophobicContact CG-CD2 3.98Å; P165-L219 HydrophobicContact CG-CG 4.44Å; Q213-L219 HydrophobicContact CB-CD1 4.02Å; Q213-L219 VanDerWaalsContact N-CD1 3.34Å; C216-L219 HydrophobicContact CB-CD1 4.25Å; C216-L219 HydrophobicContact CB-CG 3.93Å; C216-L219 PolarHBondContact O-N 2.01Å; C216-L219 VanDerWaalsContact O-N 3.09Å; C216-L219 VanDerWaalsContact SG-CG 3.52Å; C216-L219 PolarHBondContact SG-N 3.14Å; L219-Y259 HydrophobicContact CB-CD1 4.48Å; L219-V260 CarbonylContact C-O 3.46Å; L219-V260 WeakPolarHBondContact CA-O 3.37Å; L219-V261 HydrophobicContact CD2-CG1 4.33Å; L219-W314 HydrophobicContact CD2-CH2 3.7Å
220	K	91.9	Very high	87.5	Confident	61 Å²	61	52.5 Å²	52.5	27%	0.265	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	145.1	170.3	-64.4	-170.5	-171.8	176.5	0	108.7	K218 L222 A238 Y259 V260 E262	K218-K220 PolarHBondContact O-N 2.89Å; K220-L222 PolarHBondContact O-N 3.03Å; K220-A238 HydrophobicContact CB-CB 4.26Å; K220-A238 WeakPolarHBondContact CD-O 3.42Å; K220-Y259 WeakPolarHBondContact O-CA 3.46Å; K220-V260 PolarHBondContact N-O 3.44Å; K220-V260 PolarHBondContact O-N 2.62Å; K220-E262 WeakPolarHBondContact CE-OE2 3.5Å; K220-E262 IonicContact NZ-OE1 3.72Å; K220-E262 PolarHBondContact NZ-OE1 3.4Å; K220-E262 IonicContact NZ-OE2 2.77Å; K220-E262 PolarHBondContact NZ-OE2 2.85Å
221	P	93.9	Very high	86.2	Confident	49 Å²	49	57 Å²	57	32%	0.318	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	131	176.6	31	-36.2	0	0	0	109.7	I223 T256 Y259	P221-I223 HydrophobicContact CB-CD1 3.68Å; P221-I223 HydrophobicContact CG-CD1 3.99Å; P221-I223 PolarHBondContact O-N 3.37Å; P221-T256 HydrophobicContact CB-CG2 3.76Å; P221-Y259 HydrophobicContact CB-CD1 4.2Å; P221-Y259 HydrophobicContact CB-CE1 3.97Å
222	L	96.5	Very high	85.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	104.1	171.1	-177.7	62	0	0	0	108.7	L171 K220 I257 G258 V260 F311	L171-L222 HydrophobicContact CD2-CD2 4.27Å; K220-L222 PolarHBondContact O-N 3.03Å; L222-I257 HydrophobicContact CD2-CB 4.48Å; L222-I257 PolarHBondContact O-N 3.38Å; L222-G258 PolarHBondContact N-O 2.83Å; L222-V260 HydrophobicContact CB-CG1 4.04Å; L222-V260 HydrophobicContact CB-CG2 3.98Å; L222-V260 HydrophobicContact CD1-CG2 4.25Å; L222-V260 HydrophobicContact CD2-CG1 4.03Å; L222-F311 HydrophobicContact CD1-CD1 3.51Å; L222-F311 HydrophobicContact CD1-CD2 4.4Å; L222-F311 HydrophobicContact CD1-CE1 3.55Å; L222-F311 HydrophobicContact CD1-CE2 4.39Å; L222-F311 HydrophobicContact CD1-CG 3.99Å; L222-F311 HydrophobicContact CD1-CZ 4Å; L222-F311 HydrophobicContact CD2-CE2 4.18Å; L222-F311 HydrophobicContact CD2-CZ 4.13Å
223	I	91.4	Very high	84.7	Confident	18 Å²	18	51.3 Å²	51.3	9%	0.092	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.6	-174.3	-54.8	-48.1	0	0	0	110.5	P221 L225 Y236 V237 Y253 T256	P221-I223 HydrophobicContact CB-CD1 3.68Å; P221-I223 HydrophobicContact CG-CD1 3.99Å; P221-I223 PolarHBondContact O-N 3.37Å; I223-L225 HydrophobicContact CG2-CD2 3.78Å; I223-L225 HydrophobicContact CG2-CG 4.12Å; I223-Y236 VanDerWaalsContact O-CA 3.31Å; I223-Y236 WeakPolarHBondContact O-CA 3.42Å; I223-V237 HydrophobicContact CB-CG2 4.31Å; I223-V237 PolarHBondContact N-O 2.93Å; I223-V237 PolarHBondContact O-N 3.08Å; I223-Y253 HydrophobicContact CD1-CE2 4.06Å; I223-Y253 HydrophobicContact CG2-CD2 3.49Å; I223-Y253 VanDerWaalsContact CG2-CD2 3.49Å; I223-Y253 HydrophobicContact CG2-CE2 3.55Å; I223-T256 HydrophobicContact CD1-CG2 4.29Å; I223-T256 VanDerWaalsContact CD1-OG1 3.26Å; I223-T256 WeakPolarHBondContact CD1-OG1 3.36Å
224	E	92.6	Very high	84.8	Confident	33 Å²	33	50.9 Å²	50.9	15%	0.154	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125.1	167.6	-176.6	-175.3	-97.7	0	0	110	L234 Y236 R254 G255 I257	E224-L234 HydrophobicContact CG-CD2 3.96Å; E224-Y236 HydrophobicContact CB-CD1 4.14Å; E224-Y236 HydrophobicContact CB-CE1 3.97Å; E224-Y236 HydrophobicContact CG-CD1 4.29Å; E224-Y236 HydrophobicContact CG-CE1 3.74Å; E224-Y236 PolarHBondContact OE1-OH 3.26Å; E224-R254 HydrophobicContact CB-CB 4.31Å; E224-R254 HydrophobicContact CG-CB 4.1Å; E224-R254 PolarHBondContact O-N 3.34Å; E224-R254 WeakPolarHBondContact OE2-CB 3.47Å; E224-R254 WeakPolarHBondContact OE2-CD 3.35Å; E224-G255 PolarHBondContact N-O 3.49Å; E224-I257 HydrophobicContact CB-CD1 4Å; E224-I257 HydrophobicContact CB-CG1 3.98Å
225	L	90.3	Very high	85.1	Confident	3 Å²	3	45 Å²	45	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.6	175.6	-61.2	178.9	0	0	0	110	I223 L234 V235 V237 M243 L246 Y251 L252 Y253	I223-L225 HydrophobicContact CG2-CD2 3.78Å; I223-L225 HydrophobicContact CG2-CG 4.12Å; L225-L234 CarbonylContact O-C 3.59Å; L225-L234 WeakPolarHBondContact O-CA 3.47Å; L225-V235 HydrophobicContact CB-CB 4.43Å; L225-V235 PolarHBondContact N-O 3.25Å; L225-V235 PolarHBondContact O-N 2.03Å; L225-V237 HydrophobicContact CD1-CG2 3.71Å; L225-V237 HydrophobicContact CG-CG2 4.24Å; L225-M243 HydrophobicContact CD1-CG 4.29Å; L225-L246 HydrophobicContact CD1-CB 3.78Å; L225-L246 HydrophobicContact CD1-CD1 3.66Å; L225-L246 HydrophobicContact CD1-CG 4.39Å; L225-Y251 HydrophobicContact CB-CD1 4.26Å; L225-L252 CarbonylContact C-O 3.59Å; L225-L252 WeakPolarHBondContact CA-O 3.29Å; L225-Y253 HydrophobicContact CD2-CD2 4.49Å
226	G	88.1	Confident	85.6	Confident	1 Å²	1	43 Å²	43	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	137.5	173.4	0	0	0	0	0	112.1	Y251 L252	G226-Y251 CarbonylContact O-C 3.6Å; G226-Y251 WeakPolarHBondContact O-CA 3.43Å; G226-L252 PolarHBondContact N-O 3.29Å; G226-L252 PolarHBondContact O-N 3.19Å
227	S	85	Confident	85.9	Confident	5 Å²	5	43 Å²	43	4%	0.035	24%	0.24	C	C	.	.			trans	-65.2	142.6	175.1	167.4	0	0	0	0	112	S229 K230 L233	S227-S229 VanDerWaalsContact C-N 3.29Å; S227-S229 PolarHBondContact O-N 2.86Å; S227-S229 PolarHBondContact OG-N 2.73Å; S227-S229 PolarHBondContact OG-OG 3.47Å; S227-S229 VanDerWaalsContact OG-OG 3.11Å; S227-K230 WeakPolarHBondContact CB-O 3.37Å; S227-K230 PolarHBondContact OG-N 2.96Å; S227-L233 WeakPolarHBondContact CB-O 3.48Å; S227-L233 PolarHBondContact N-O 2.83Å
228	P	78.7	Confident	86.2	Confident	73 Å²	73	39.7 Å²	39.7	47%	0.474	21%	0.206	S	C	.	.	S	Bend	trans	-67.9	-29.4	176.3	26.2	-32.7	0	0	0	112.8	G250	P228-G250 WeakPolarHBondContact CB-O 3.48Å; P228-G250 WeakPolarHBondContact CD-O 3.37Å; P228-G250 WeakPolarHBondContact CG-O 3.2Å
229	S	77	Confident	86	Confident	103 Å²	103	37.4 Å²	37.4	72%	0.72	20%	0.198	S	C	*	.	S	Bend	trans	-94	-24.1	-173.8	56.5	0	0	0	0	113.5	S227	S227-S229 VanDerWaalsContact C-N 3.29Å; S227-S229 PolarHBondContact O-N 2.86Å; S227-S229 PolarHBondContact OG-N 2.73Å; S227-S229 PolarHBondContact OG-OG 3.47Å; S227-S229 VanDerWaalsContact OG-OG 3.11Å
230	K	76.7	Confident	85.3	Confident	91 Å²	91	43.8 Å²	43.8	40%	0.396	23%	0.225	S	C	.	.			trans	-140.7	103.2	178	-68.7	-173.1	178.7	-172.6	0	108.8	S227 E232 L233	S227-K230 WeakPolarHBondContact CB-O 3.37Å; S227-K230 PolarHBondContact OG-N 2.96Å; K230-E232 PolarHBondContact O-N 2.98Å; K230-L233 HydrophobicContact CB-CB 3.86Å; K230-L233 WeakPolarHBondContact O-CB 3.41Å; K230-L233 PolarHBondContact O-N 2.89Å
231	K	67.6	Low	84.5	Confident	148 Å²	148	47 Å²	47	64%	0.643	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.6	-173.4	-72.3	-175.3	-179.7	180	0	112.5	R254	K231-R254 PolarHBondContact O-NH1 2.8Å; K231-R254 PolarHBondContact O-NH2 3.08Å
232	E	74.1	Confident	83.7	Confident	97 Å²	97	48.2 Å²	48.2	45%	0.453	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-12.9	-178.2	-54	73.2	-158.9	0	0	112.3	Y181 K230 L234	Y181-E232 HydrophobicContact CE1-CB 3.68Å; Y181-E232 HydrophobicContact CE2-CB 4.02Å; Y181-E232 WeakPolarHBondContact OH-CB 2.96Å; K230-E232 PolarHBondContact O-N 2.98Å; E232-L234 PolarHBondContact O-N 2.93Å
233	L	81.3	Confident	82.9	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	26%	0.259	C	S	.	.			trans	-78	105.1	173.5	177.5	64	0	0	0	109.7	Y181 S227 K230 A281	Y181-L233 HydrophobicContact CD1-CB 4.4Å; Y181-L233 HydrophobicContact CD1-CD1 4.34Å; S227-L233 WeakPolarHBondContact CB-O 3.48Å; S227-L233 PolarHBondContact N-O 2.83Å; K230-L233 HydrophobicContact CB-CB 3.86Å; K230-L233 WeakPolarHBondContact O-CB 3.41Å; K230-L233 PolarHBondContact O-N 2.89Å; L233-A281 VanDerWaalsContact CD1-O 3.29Å; L233-A281 WeakPolarHBondContact CD1-O 3.48Å; L233-A281 WeakPolarHBondContact CD2-O 3.42Å
234	L	88.6	Confident	82.2	Confident	14 Å²	14	53.9 Å²	53.9	7%	0.073	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	147.1	-179	-60.6	173.3	0	0	0	111.8	A183 E224 L225 E232 Y236 N283	A183-L234 HydrophobicContact CB-CD1 4.44Å; E224-L234 HydrophobicContact CG-CD2 3.96Å; L225-L234 CarbonylContact O-C 3.59Å; L225-L234 WeakPolarHBondContact O-CA 3.47Å; E232-L234 PolarHBondContact O-N 2.93Å; L234-Y236 HydrophobicContact CB-CE2 3.99Å; L234-Y236 WeakPolarHBondContact CD1-OH 3.26Å; L234-N283 PolarHBondContact O-ND2 2.81Å
235	V	90.1	Very high	81.6	Confident	8 Å²	8	58.4 Å²	58.4	5%	0.048	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.9	171.9	179.4	0	0	0	0	108.1	L225 V237 L246 Y251 N283	L225-V235 HydrophobicContact CB-CB 4.43Å; L225-V235 PolarHBondContact N-O 3.25Å; L225-V235 PolarHBondContact O-N 2.03Å; V235-V237 HydrophobicContact CG1-CG1 3.95Å; V235-L246 HydrophobicContact CB-CD1 4.38Å; V235-L246 HydrophobicContact CG1-CD1 3.63Å; V235-Y251 HydrophobicContact CB-CE1 4.39Å; V235-Y251 HydrophobicContact CG2-CD1 4.13Å; V235-Y251 HydrophobicContact CG2-CE1 3.5Å; V235-N283 WeakPolarHBondContact CG2-ND2 3.49Å
236	Y	93.1	Very high	81.4	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.5	178.6	-55.1	-89.3	0	0	0	109.5	A183 L184 I223 E224 L234 I257 Y285	A183-Y236 WeakPolarHBondContact CA-OH 2.93Å; L184-Y236 HydrophobicContact CB-CD1 4.17Å; L184-Y236 HydrophobicContact CB-CD2 4.34Å; L184-Y236 HydrophobicContact CB-CE1 3.74Å; L184-Y236 HydrophobicContact CB-CE2 3.98Å; L184-Y236 HydrophobicContact CB-CG 4.46Å; L184-Y236 HydrophobicContact CD1-CD1 4.32Å; L184-Y236 HydrophobicContact CD1-CD2 3.68Å; L184-Y236 HydrophobicContact CD1-CE2 4.04Å; L184-Y236 HydrophobicContact CD1-CG 3.86Å; L184-Y236 HydrophobicContact CG-CD2 3.95Å; L184-Y236 HydrophobicContact CG-CE1 4.38Å; L184-Y236 HydrophobicContact CG-CE2 3.76Å; L184-Y236 HydrophobicContact CG-CG 4.38Å; L184-Y236 VanDerWaalsContact N-CZ 3.33Å; L184-Y236 PolarHBondContact N-OH 2.92Å; I223-Y236 VanDerWaalsContact O-CA 3.31Å; I223-Y236 WeakPolarHBondContact O-CA 3.42Å; E224-Y236 HydrophobicContact CB-CD1 4.14Å; E224-Y236 HydrophobicContact CB-CE1 3.97Å; E224-Y236 HydrophobicContact CG-CD1 4.29Å; E224-Y236 HydrophobicContact CG-CE1 3.74Å; E224-Y236 PolarHBondContact OE1-OH 3.26Å; L234-Y236 HydrophobicContact CB-CE2 3.99Å; L234-Y236 WeakPolarHBondContact CD1-OH 3.26Å; Y236-I257 HydrophobicContact CD1-CG1 4.25Å; Y236-I257 HydrophobicContact CE1-CG1 4.2Å; Y236-Y285 HydrophobicContact CD2-CD2 4.27Å; Y236-Y285 HydrophobicContact CD2-CE1 4.38Å; Y236-Y285 AromaticContact CD2-CE2 3.54Å; Y236-Y285 HydrophobicContact CD2-CE2 3.54Å; Y236-Y285 AromaticContact CD2-CZ 3.6Å; Y236-Y285 HydrophobicContact CE2-CE2 4Å; Y236-Y285 PolarHBondContact N-OH 2.96Å
237	V	89.3	Confident	81.1	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.012	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136.8	-175	-73.9	0	0	0	0	111.2	I223 L225 V235 M243 L246	I223-V237 HydrophobicContact CB-CG2 4.31Å; I223-V237 PolarHBondContact N-O 2.93Å; I223-V237 PolarHBondContact O-N 3.08Å; L225-V237 HydrophobicContact CD1-CG2 3.71Å; L225-V237 HydrophobicContact CG-CG2 4.24Å; V235-V237 HydrophobicContact CG1-CG1 3.95Å; V237-M243 HydrophobicContact CG2-CB 3.94Å; V237-M243 HydrophobicContact CG2-CG 4.4Å; V237-L246 HydrophobicContact CG1-CD1 3.87Å
238	A	88.3	Confident	81.1	Confident	10 Å²	10	70.5 Å²	70.5	8%	0.083	36%	0.358	C	S	.	.			trans	-104.9	-19.7	169.1	0	0	0	0	0	112.1	K220 V260 F311	K220-A238 HydrophobicContact CB-CB 4.26Å; K220-A238 WeakPolarHBondContact CD-O 3.42Å; A238-V260 HydrophobicContact CB-CG2 3.61Å; A238-F311 HydrophobicContact CB-CB 4.08Å
239	D	81	Confident	81.4	Confident	51 Å²	51	70.8 Å²	70.8	27%	0.273	36%	0.361	S	S	.	.			trans	-79.6	129.9	176.9	177.3	50.6	0	0	0	112.2	L241 H242 M243	D239-L241 WeakPolarHBondContact OD2-CB 2.96Å; D239-L241 PolarHBondContact OD2-N 2.89Å; D239-L241 VanDerWaalsContact OD2-N 3.15Å; D239-H242 HydrophobicContact CB-CB 4.11Å; D239-H242 WeakPolarHBondContact OD2-CB 3.48Å; D239-H242 PolarHBondContact OD2-N 3.23Å; D239-M243 WeakPolarHBondContact O-CB 3.42Å; D239-M243 PolarHBondContact O-N 2.93Å
240	K	75.5	Confident	81.8	Confident	148 Å²	148	67.3 Å²	67.3	64%	0.643	34%	0.342	S	S	*	.	H	α-helix	trans	-70.4	-38	-176.8	-175.3	178.7	178.7	-179.5	0	111.9	M243 L244	K240-M243 HydrophobicContact CG-CE 4.28Å; K240-M243 PolarHBondContact O-N 3.01Å; K240-L244 HydrophobicContact CG-CD1 4.48Å; K240-L244 WeakPolarHBondContact O-CG 3.47Å; K240-L244 PolarHBondContact O-N 3.28Å
241	L	74.7	Confident	82.4	Confident	127 Å²	127	64.9 Å²	64.9	67%	0.665	33%	0.331	S	S	*	.	H	α-helix	trans	-70.3	-42	-178.7	-67.6	178.6	0	0	0	110.9	D239 M243 L244 Q245	D239-L241 WeakPolarHBondContact OD2-CB 2.96Å; D239-L241 PolarHBondContact OD2-N 2.89Å; D239-L241 VanDerWaalsContact OD2-N 3.15Å; L241-M243 VanDerWaalsContact C-N 3.34Å; L241-M243 PolarHBondContact O-N 3.01Å; L241-L244 PolarHBondContact O-N 3.33Å; L241-Q245 PolarHBondContact O-N 3.41Å
242	H	77.6	Confident	83.4	Confident	76 Å²	76	63.3 Å²	63.3	35%	0.352	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-41.1	174.4	-169.3	-173.6	0	0	0	111.4	D239 L244 Q245 L246	D239-H242 HydrophobicContact CB-CB 4.11Å; D239-H242 WeakPolarHBondContact OD2-CB 3.48Å; D239-H242 PolarHBondContact OD2-N 3.23Å; H242-L244 PolarHBondContact O-N 3.09Å; H242-Q245 WeakPolarHBondContact O-CB 3.4Å; H242-Q245 PolarHBondContact O-N 2.94Å; H242-L246 WeakPolarHBondContact O-CG 3.34Å; H242-L246 PolarHBondContact O-N 2.9Å
243	M	78.9	Confident	84	Confident	53 Å²	53	65.5 Å²	65.5	26%	0.261	33%	0.334	S	S	.	.	H	α-helix	trans	-58.8	-47.1	172.4	179.5	-85.5	-68.7	0	0	111.9	L225 V237 D239 K240 L241 Q245 L246 A247	L225-M243 HydrophobicContact CD1-CG 4.29Å; V237-M243 HydrophobicContact CG2-CB 3.94Å; V237-M243 HydrophobicContact CG2-CG 4.4Å; D239-M243 WeakPolarHBondContact O-CB 3.42Å; D239-M243 PolarHBondContact O-N 2.93Å; K240-M243 HydrophobicContact CG-CE 4.28Å; K240-M243 PolarHBondContact O-N 3.01Å; L241-M243 VanDerWaalsContact C-N 3.34Å; L241-M243 PolarHBondContact O-N 3.01Å; M243-Q245 VanDerWaalsContact C-N 3.3Å; M243-Q245 PolarHBondContact O-N 3.14Å; M243-L246 PolarHBondContact O-N 3.26Å; M243-A247 WeakPolarHBondContact O-CB 3.28Å; M243-A247 PolarHBondContact O-N 3.5Å
244	L	77.1	Confident	84.4	Confident	83 Å²	83	70.7 Å²	70.7	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-36.5	177.2	-71.8	172.5	0	0	0	112.4	K240 L241 H242 K248	K240-L244 HydrophobicContact CG-CD1 4.48Å; K240-L244 WeakPolarHBondContact O-CG 3.47Å; K240-L244 PolarHBondContact O-N 3.28Å; L241-L244 PolarHBondContact O-N 3.33Å; H242-L244 PolarHBondContact O-N 3.09Å; L244-K248 WeakPolarHBondContact O-CG 3.36Å; L244-K248 PolarHBondContact O-N 3.11Å; L244-K248 VanDerWaalsContact O-N 3.07Å
245	Q	80.5	Confident	84.4	Confident	129 Å²	129	70.9 Å²	70.9	60%	0.603	36%	0.358	S	S	*	.	H	α-helix	trans	-64.9	-47.5	174.6	-178.6	-179.8	-8.2	0	0	111.5	L241 H242 M243 A247 K248 S249	L241-Q245 PolarHBondContact O-N 3.41Å; H242-Q245 WeakPolarHBondContact O-CB 3.4Å; H242-Q245 PolarHBondContact O-N 2.94Å; M243-Q245 VanDerWaalsContact C-N 3.3Å; M243-Q245 PolarHBondContact O-N 3.14Å; Q245-A247 VanDerWaalsContact C-N 3.33Å; Q245-A247 PolarHBondContact O-N 2.94Å; Q245-K248 WeakPolarHBondContact O-CB 3.39Å; Q245-K248 PolarHBondContact O-N 2.97Å; Q245-S249 PolarHBondContact O-N 3.02Å; Q245-S249 VanDerWaalsContact O-N 3.09Å; Q245-S249 PolarHBondContact O-OG 3.26Å
246	L	85.4	Confident	84.6	Confident	20 Å²	20	73.2 Å²	73.2	11%	0.105	37%	0.373	C	S	.	.	H	α-helix	trans	-63.4	-39.7	177.7	-72.1	168.8	0	0	0	111.7	L225 V235 V237 H242 M243 K248 S249 G250 Y251	L225-L246 HydrophobicContact CD1-CB 3.78Å; L225-L246 HydrophobicContact CD1-CD1 3.66Å; L225-L246 HydrophobicContact CD1-CG 4.39Å; V235-L246 HydrophobicContact CB-CD1 4.38Å; V235-L246 HydrophobicContact CG1-CD1 3.63Å; V237-L246 HydrophobicContact CG1-CD1 3.87Å; H242-L246 WeakPolarHBondContact O-CG 3.34Å; H242-L246 PolarHBondContact O-N 2.9Å; M243-L246 PolarHBondContact O-N 3.26Å; L246-K248 VanDerWaalsContact C-N 3.33Å; L246-K248 PolarHBondContact O-N 3.32Å; L246-S249 CarbonylContact O-C 3.56Å; L246-S249 WeakPolarHBondContact O-CA 3.32Å; L246-S249 WeakPolarHBondContact O-CB 3.47Å; L246-S249 PolarHBondContact O-N 3.35Å; L246-G250 PolarHBondContact O-N 3.27Å; L246-Y251 HydrophobicContact CB-CD2 4.21Å; L246-Y251 HydrophobicContact CB-CG 4.17Å; L246-Y251 HydrophobicContact CD2-CD2 3.91Å; L246-Y251 HydrophobicContact CD2-CE2 3.92Å; L246-Y251 HydrophobicContact CD2-CG 4.3Å; L246-Y251 WeakPolarHBondContact O-CB 3.37Å; L246-Y251 WeakPolarHBondContact O-CD2 3.2Å; L246-Y251 PolarHBondContact O-N 3.48Å
247	A	82	Confident	84.7	Confident	49 Å²	49	74.4 Å²	74.4	41%	0.405	38%	0.379	S	S	.	.	H	α-helix	trans	-60.6	-41.4	174.7	0	0	0	0	0	111.8	M243 Q245 S249 G250	M243-A247 WeakPolarHBondContact O-CB 3.28Å; M243-A247 PolarHBondContact O-N 3.5Å; Q245-A247 VanDerWaalsContact C-N 3.33Å; Q245-A247 PolarHBondContact O-N 2.94Å; A247-S249 PolarHBondContact O-N 3.43Å; A247-G250 PolarHBondContact O-N 3.12Å
248	K	85.7	Confident	85	Confident	194 Å²	194	74.4 Å²	74.4	84%	0.843	38%	0.38	S	S	*	.	H	α-helix	trans	-61.9	-32.8	172	-76	-180	178	-178.2	0	112.6	L244 Q245 L246 G250	L244-K248 WeakPolarHBondContact O-CG 3.36Å; L244-K248 PolarHBondContact O-N 3.11Å; L244-K248 VanDerWaalsContact O-N 3.07Å; Q245-K248 WeakPolarHBondContact O-CB 3.39Å; Q245-K248 PolarHBondContact O-N 2.97Å; L246-K248 VanDerWaalsContact C-N 3.33Å; L246-K248 PolarHBondContact O-N 3.32Å; K248-G250 PolarHBondContact O-N 3.04Å
249	S	84.6	Confident	85.4	Confident	78 Å²	78	76.2 Å²	76.2	55%	0.545	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	8.2	173.4	-57.9	0	0	0	0	113.8	Q245 L246 A247	Q245-S249 PolarHBondContact O-N 3.02Å; Q245-S249 VanDerWaalsContact O-N 3.09Å; Q245-S249 PolarHBondContact O-OG 3.26Å; L246-S249 CarbonylContact O-C 3.56Å; L246-S249 WeakPolarHBondContact O-CA 3.32Å; L246-S249 WeakPolarHBondContact O-CB 3.47Å; L246-S249 PolarHBondContact O-N 3.35Å; A247-S249 PolarHBondContact O-N 3.43Å
250	G	85.7	Confident	86.1	Confident	31 Å²	31	73.8 Å²	73.8	32%	0.32	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	6.6	174.3	0	0	0	0	0	115.4	P228 L246 A247 K248	P228-G250 WeakPolarHBondContact CB-O 3.48Å; P228-G250 WeakPolarHBondContact CD-O 3.37Å; P228-G250 WeakPolarHBondContact CG-O 3.2Å; L246-G250 PolarHBondContact O-N 3.27Å; A247-G250 PolarHBondContact O-N 3.12Å; K248-G250 PolarHBondContact O-N 3.04Å
251	Y	89.2	Confident	86.7	Confident	39 Å²	39	66.7 Å²	66.7	15%	0.153	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-65.7	137.6	173.1	-78.4	-105.3	0	0	0	111	L225 G226 V235 L246	L225-Y251 HydrophobicContact CB-CD1 4.26Å; G226-Y251 CarbonylContact O-C 3.6Å; G226-Y251 WeakPolarHBondContact O-CA 3.43Å; V235-Y251 HydrophobicContact CB-CE1 4.39Å; V235-Y251 HydrophobicContact CG2-CD1 4.13Å; V235-Y251 HydrophobicContact CG2-CE1 3.5Å; L246-Y251 HydrophobicContact CB-CD2 4.21Å; L246-Y251 HydrophobicContact CB-CG 4.17Å; L246-Y251 HydrophobicContact CD2-CD2 3.91Å; L246-Y251 HydrophobicContact CD2-CE2 3.92Å; L246-Y251 HydrophobicContact CD2-CG 4.3Å; L246-Y251 WeakPolarHBondContact O-CB 3.37Å; L246-Y251 WeakPolarHBondContact O-CD2 3.2Å; L246-Y251 PolarHBondContact O-N 3.48Å
252	L	87.9	Confident	87.2	Confident	115 Å²	115	64.5 Å²	64.5	60%	0.602	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	130.4	-175.5	-63.3	175.5	0	0	0	110.8	L225 G226 R254	L225-L252 CarbonylContact C-O 3.59Å; L225-L252 WeakPolarHBondContact CA-O 3.29Å; G226-L252 PolarHBondContact N-O 3.29Å; G226-L252 PolarHBondContact O-N 3.19Å; L252-R254 PolarHBondContact O-N 3.15Å
253	Y	87.6	Confident	87.3	Confident	143 Å²	143	63.4 Å²	63.4	56%	0.561	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	128.2	170.9	178.7	-92.7	0	0	0	111.3	I223 L225 T256	I223-Y253 HydrophobicContact CD1-CE2 4.06Å; I223-Y253 HydrophobicContact CG2-CD2 3.49Å; I223-Y253 VanDerWaalsContact CG2-CD2 3.49Å; I223-Y253 HydrophobicContact CG2-CE2 3.55Å; L225-Y253 HydrophobicContact CD2-CD2 4.49Å; Y253-T256 PolarHBondContact OH-N 2.04Å; Y253-T256 PolarHBondContact OH-OG1 3.06Å; Y253-T256 VanDerWaalsContact OH-OG1 3.1Å
254	R	88.8	Confident	87.4	Confident	113 Å²	113	65.5 Å²	65.5	43%	0.426	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-34.4	176.2	-68.6	-160.7	162.5	-179.4	2.2	113.8	E224 K231 L252	E224-R254 HydrophobicContact CB-CB 4.31Å; E224-R254 HydrophobicContact CG-CB 4.1Å; E224-R254 PolarHBondContact O-N 3.34Å; E224-R254 WeakPolarHBondContact OE2-CB 3.47Å; E224-R254 WeakPolarHBondContact OE2-CD 3.35Å; K231-R254 PolarHBondContact O-NH1 2.8Å; K231-R254 PolarHBondContact O-NH2 3.08Å; L252-R254 PolarHBondContact O-N 3.15Å
255	G	89.4	Confident	87.4	Confident	18 Å²	18	63.8 Å²	63.8	19%	0.186	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.8	176.7	-178.5	0	0	0	0	0	112.7	E224	E224-G255 PolarHBondContact N-O 3.49Å
256	T	93.8	Very high	87.4	Confident	58 Å²	58	60 Å²	60	36%	0.356	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.6	169.6	-60.5	0	0	0	0	107.7	P221 I223 Y253 G258	P221-T256 HydrophobicContact CB-CG2 3.76Å; I223-T256 HydrophobicContact CD1-CG2 4.29Å; I223-T256 VanDerWaalsContact CD1-OG1 3.26Å; I223-T256 WeakPolarHBondContact CD1-OG1 3.36Å; Y253-T256 PolarHBondContact OH-N 2.04Å; Y253-T256 PolarHBondContact OH-OG1 3.06Å; Y253-T256 VanDerWaalsContact OH-OG1 3.1Å; T256-G258 WeakPolarHBondContact CG2-O 3.42Å
257	I	95.4	Very high	87.4	Confident	26 Å²	26	59 Å²	59	13%	0.133	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-27.5	-178.1	-57.3	-61.8	0	0	0	111.4	L171 T186 I208 L222 E224 Y236	L171-I257 HydrophobicContact CD1-CG2 3.76Å; T186-I257 HydrophobicContact CG2-CG2 4.03Å; T186-I257 PolarHBondContact OG1-O 2.87Å; I208-I257 HydrophobicContact CD1-CG2 4.11Å; L222-I257 HydrophobicContact CD2-CB 4.48Å; L222-I257 PolarHBondContact O-N 3.38Å; E224-I257 HydrophobicContact CB-CD1 4Å; E224-I257 HydrophobicContact CB-CG1 3.98Å; Y236-I257 HydrophobicContact CD1-CG1 4.25Å; Y236-I257 HydrophobicContact CE1-CG1 4.2Å
258	G	96.2	Very high	87.5	Confident	2 Å²	2	59.6 Å²	59.6	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.1	-155.7	179.3	0	0	0	0	0	109.5	S209 L222 T256	S209-G258 CarbonylContact O-C 3.48Å; S209-G258 WeakPolarHBondContact O-CA 3.24Å; L222-G258 PolarHBondContact N-O 2.83Å; T256-G258 WeakPolarHBondContact CG2-O 3.42Å
259	Y	96.2	Very high	87.5	Confident	47 Å²	47	50.6 Å²	50.6	18%	0.184	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.5	-176.9	-63.9	-102.6	0	0	0	110.8	S209 E212 L219 K220 P221	S209-Y259 PolarHBondContact N-O 3.18Å; S209-Y259 PolarHBondContact O-N 3.46Å; E212-Y259 HydrophobicContact CB-CD1 3.95Å; E212-Y259 HydrophobicContact CB-CE1 3.47Å; E212-Y259 VanDerWaalsContact CB-CE1 3.47Å; E212-Y259 HydrophobicContact CB-CE2 4.22Å; E212-Y259 HydrophobicContact CB-CG 4.48Å; E212-Y259 HydrophobicContact CG-CD1 3.98Å; E212-Y259 HydrophobicContact CG-CE1 3.69Å; E212-Y259 VanDerWaalsContact N-CE2 3.3Å; L219-Y259 HydrophobicContact CB-CD1 4.48Å; K220-Y259 WeakPolarHBondContact O-CA 3.46Å; P221-Y259 HydrophobicContact CB-CD1 4.2Å; P221-Y259 HydrophobicContact CB-CE1 3.97Å
260	V	95.8	Very high	87.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	177.7	-175.6	-62.9	0	0	0	0	109.4	I208 L219 K220 L222 A238 F311 I313	I208-V260 HydrophobicContact CB-CG1 4.11Å; I208-V260 HydrophobicContact CG2-CG1 3.58Å; L219-V260 CarbonylContact C-O 3.46Å; L219-V260 WeakPolarHBondContact CA-O 3.37Å; K220-V260 PolarHBondContact N-O 3.44Å; K220-V260 PolarHBondContact O-N 2.62Å; L222-V260 HydrophobicContact CB-CG1 4.04Å; L222-V260 HydrophobicContact CB-CG2 3.98Å; L222-V260 HydrophobicContact CD1-CG2 4.25Å; L222-V260 HydrophobicContact CD2-CG1 4.03Å; A238-V260 HydrophobicContact CB-CG2 3.61Å; V260-F311 HydrophobicContact CB-CB 4.22Å; V260-F311 HydrophobicContact CB-CD2 4.4Å; V260-F311 HydrophobicContact CG1-CD2 4.18Å; V260-F311 HydrophobicContact CG2-CB 3.64Å; V260-F311 HydrophobicContact CG2-CD2 4.39Å; V260-F311 HydrophobicContact CG2-CG 4.14Å; V260-I313 HydrophobicContact CB-CG2 4.44Å; V260-I313 HydrophobicContact CG1-CG2 3.81Å
261	V	89	Confident	87.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-113.2	163.2	169.6	-63.6	0	0	0	0	110.2	K218 L219 E263 F266 C267 S269 F311 A312 W314	K218-V261 HydrophobicContact CB-CG1 4.27Å; L219-V261 HydrophobicContact CD2-CG1 4.33Å; V261-E263 WeakPolarHBondContact CG2-O 3.35Å; V261-F266 HydrophobicContact CB-CB 3.86Å; V261-F266 HydrophobicContact CG1-CB 4.06Å; V261-F266 HydrophobicContact CG2-CB 4.03Å; V261-C267 HydrophobicContact CG1-CB 4.07Å; V261-S269 VanDerWaalsContact CG2-OG 3.25Å; V261-S269 WeakPolarHBondContact CG2-OG 3.21Å; V261-F311 WeakPolarHBondContact O-CA 3.32Å; V261-A312 HydrophobicContact CG2-CB 4.07Å; V261-A312 PolarHBondContact N-O 3.35Å; V261-A312 PolarHBondContact O-N 3.36Å; V261-W314 HydrophobicContact CG1-CH2 4.13Å; V261-W314 HydrophobicContact CG1-CZ2 4.21Å
262	E	84.5	Confident	87.8	Confident	81 Å²	81	48.5 Å²	48.5	38%	0.379	25%	0.253	S	S	.	.	S	Bend	trans	-72.6	-44	-177.2	-173.9	165.3	-155.4	0	0	112.3	K220	K220-E262 WeakPolarHBondContact CE-OE2 3.5Å; K220-E262 IonicContact NZ-OE1 3.72Å; K220-E262 PolarHBondContact NZ-OE1 3.4Å; K220-E262 IonicContact NZ-OE2 2.77Å; K220-E262 PolarHBondContact NZ-OE2 2.85Å
263	E	78.9	Confident	88.1	Confident	52 Å²	52	43 Å²	43	24%	0.243	23%	0.225	C	C	.	.	S	Bend	trans	-129.8	152.7	-177.3	-61.7	-167.1	168	0	0	111.3	T54 V261 F266 S269 A312	T54-E263 PolarHBondContact N-OE1 2.94Å; T54-E263 PolarHBondContact OG1-OE1 3.03Å; T54-E263 PolarHBondContact OG1-OE2 3.19Å; V261-E263 WeakPolarHBondContact CG2-O 3.35Å; E263-F266 HydrophobicContact CB-CE2 4.48Å; E263-F266 WeakPolarHBondContact O-CB 2.97Å; E263-F266 PolarHBondContact O-N 3.41Å; E263-S269 PolarHBondContact O-OG 3.04Å; E263-A312 VanDerWaalsContact C-CB 3.46Å
264	E	82.4	Confident	88.2	Confident	98 Å²	98	37 Å²	37	46%	0.458	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	143.4	174.4	-170.2	174	151.9	0	0	111.2	F266 S269 S272 A312	E264-F266 VanDerWaalsContact C-N 3.31Å; E264-F266 PolarHBondContact O-N 2.89Å; E264-S269 WeakPolarHBondContact CA-OG 2.98Å; E264-S272 PolarHBondContact OE2-N 3.37Å; E264-S272 PolarHBondContact OE2-OG 3.38Å; E264-A312 HydrophobicContact CB-CB 4.2Å; E264-A312 VanDerWaalsContact N-CB 3.33Å
265	G	75.4	Confident	88.3	Confident	47 Å²	47	32.2 Å²	32.2	49%	0.485	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-23.9	-175.1	0	0	0	0	0	113.9	C267 S268 S269	G265-C267 PolarHBondContact O-N 2.92Å; G265-S268 PolarHBondContact O-N 3.09Å; G265-S269 WeakPolarHBondContact CA-O 3.17Å; G265-S269 PolarHBondContact N-O 2.98Å; G265-S269 PolarHBondContact N-OG 3.15Å
266	F	81.2	Confident	88.3	Confident	49 Å²	49	31.4 Å²	31.4	22%	0.215	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-67.4	131.4	169.9	-72.3	-5.5	0	0	0	110.2	C161 K218 V261 E263 E264 S268 S269	C161-F266 HydrophobicContact CB-CD1 3.6Å; C161-F266 HydrophobicContact CB-CE1 4.18Å; C161-F266 HydrophobicContact CB-CG 4.26Å; K218-F266 HydrophobicContact CB-CB 4.24Å; K218-F266 HydrophobicContact CB-CD2 4.26Å; K218-F266 HydrophobicContact CB-CG 4.46Å; K218-F266 HydrophobicContact CD-CD2 4.45Å; K218-F266 HydrophobicContact CG-CB 4.46Å; K218-F266 HydrophobicContact CG-CD2 4.27Å; K218-F266 HydrophobicContact CG-CG 4.33Å; V261-F266 HydrophobicContact CB-CB 3.86Å; V261-F266 HydrophobicContact CG1-CB 4.06Å; V261-F266 HydrophobicContact CG2-CB 4.03Å; E263-F266 HydrophobicContact CB-CE2 4.48Å; E263-F266 WeakPolarHBondContact O-CB 2.97Å; E263-F266 PolarHBondContact O-N 3.41Å; E264-F266 VanDerWaalsContact C-N 3.31Å; E264-F266 PolarHBondContact O-N 2.89Å; F266-S268 PolarHBondContact O-N 3.04Å; F266-S268 VanDerWaalsContact O-N 3.14Å; F266-S269 PolarHBondContact N-OG 3.28Å; F266-S269 VanDerWaalsContact O-CB 3.28Å; F266-S269 WeakPolarHBondContact O-CB 3.21Å; F266-S269 PolarHBondContact O-N 2.74Å; F266-S269 PolarHBondContact O-OG 2.78Å
267	C	85.7	Confident	87.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	50.2	37.9	-175.4	-54.8	0	0	0	0	113.7	C161 G162 L163 K164 C216 V261 G265 S269 W314	C161-C267 PolarHBondContact O-N 3.34Å; C161-C267 VanDerWaalsContact O-N 3.13Å; C161-C267 PolarHBondContact O-SG 3.43Å; G162-C267 VanDerWaalsContact CA-SG 3.54Å; G162-C267 WeakPolarHBondContact O-CA 3.47Å; L163-C267 WeakPolarHBondContact O-CB 3.14Å; K164-C267 WeakPolarHBondContact CA-O 3.47Å; C216-C267 HydrophobicContact CB-CB 3.8Å; C216-C267 WeakPolarHBondContact CB-SG 3.47Å; C216-C267 WeakPolarHBondContact SG-CB 3.27Å; C216-C267 CovalentContact SG-SG 1.96Å; C216-C267 PolarHBondContact SG-SG 2.83Å; V261-C267 HydrophobicContact CG1-CB 4.07Å; G265-C267 PolarHBondContact O-N 2.92Å; C267-S269 PolarHBondContact O-N 3.26Å; C267-S269 VanDerWaalsContact O-N 3.13Å; C267-W314 HydrophobicContact CB-CZ2 4.04Å; C267-W314 PolarHBondContact O-NE1 3.4Å
268	S	84.4	Confident	86.9	Confident	61 Å²	61	29.6 Å²	29.6	43%	0.427	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	55.9	29.7	-178.4	-50.9	0	0	0	0	113.1	G265 F266 W314	G265-S268 PolarHBondContact O-N 3.09Å; F266-S268 PolarHBondContact O-N 3.04Å; F266-S268 VanDerWaalsContact O-N 3.14Å; S268-W314 PolarHBondContact O-NE1 2.79Å
269	S	85.3	Confident	85.5	Confident	5 Å²	5	37.8 Å²	37.8	4%	0.035	20%	0.195	C	C	.	.			trans	-65.3	149.5	167.8	59.9	0	0	0	0	109.9	V261 E263 E264 G265 F266 C267 I313	V261-S269 VanDerWaalsContact CG2-OG 3.25Å; V261-S269 WeakPolarHBondContact CG2-OG 3.21Å; E263-S269 PolarHBondContact O-OG 3.04Å; E264-S269 WeakPolarHBondContact CA-OG 2.98Å; G265-S269 WeakPolarHBondContact CA-O 3.17Å; G265-S269 PolarHBondContact N-O 2.98Å; G265-S269 PolarHBondContact N-OG 3.15Å; F266-S269 PolarHBondContact N-OG 3.28Å; F266-S269 VanDerWaalsContact O-CB 3.28Å; F266-S269 WeakPolarHBondContact O-CB 3.21Å; F266-S269 PolarHBondContact O-N 2.74Å; F266-S269 PolarHBondContact O-OG 2.78Å; C267-S269 PolarHBondContact O-N 3.26Å; C267-S269 VanDerWaalsContact O-N 3.13Å; S269-I313 WeakPolarHBondContact CB-O 3.07Å
270	T	85.8	Confident	83.8	Confident	49 Å²	49	44.1 Å²	44.1	30%	0.301	23%	0.226	S	C	.	.			trans	-133.7	1.8	-167.4	62.6	0	0	0	0	113.3	I313 K315	T270-I313 PolarHBondContact N-O 2.98Å; T270-K315 VanDerWaalsContact OG1-CG 3.3Å; T270-K315 WeakPolarHBondContact OG1-CG 3.34Å; T270-K315 PolarHBondContact OG1-N 2.85Å
271	L	89.5	Confident	82.3	Confident	42 Å²	42	46.4 Å²	46.4	22%	0.22	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	112.4	-176.1	-68.1	174.6	0	0	0	110	A312 I313 K315	L271-A312 CarbonylContact O-C 3.59Å; L271-A312 WeakPolarHBondContact O-CA 3.25Å; L271-A312 WeakPolarHBondContact O-CB 3.43Å; L271-I313 HydrophobicContact CB-CG1 3.89Å; L271-I313 HydrophobicContact CD1-CG1 4.45Å; L271-I313 PolarHBondContact N-O 3.27Å; L271-I313 PolarHBondContact O-N 3.49Å; L271-K315 HydrophobicContact CD1-CB 3.89Å; L271-K315 HydrophobicContact CG-CB 4.26Å
272	S	90.3	Very high	81.8	Confident	13 Å²	13	46.7 Å²	46.7	9%	0.091	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.4	162.4	-62.4	0	0	0	0	110.9	E264 Y274 S287	E264-S272 PolarHBondContact OE2-N 3.37Å; E264-S272 PolarHBondContact OE2-OG 3.38Å; S272-Y274 WeakPolarHBondContact O-CE2 3.26Å; S272-S287 WeakPolarHBondContact O-CA 3.18Å
273	V	93.8	Very high	81.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.6	169.4	-179.7	0	0	0	0	109.3	I205 Y285 L286 K309 P310 F311 I313	I205-V273 HydrophobicContact CD1-CG1 3.92Å; I205-V273 HydrophobicContact CD1-CG2 4.4Å; V273-Y285 HydrophobicContact CG1-CD1 3.93Å; V273-Y285 HydrophobicContact CG1-CG 4.43Å; V273-L286 CarbonylContact C-O 3.55Å; V273-L286 WeakPolarHBondContact CA-O 3.14Å; V273-K309 VanDerWaalsContact O-CA 3.27Å; V273-K309 WeakPolarHBondContact O-CA 3.02Å; V273-P310 WeakPolarHBondContact O-CD 3.23Å; V273-F311 HydrophobicContact CB-CD2 3.94Å; V273-F311 HydrophobicContact CB-CE2 3.68Å; V273-F311 HydrophobicContact CB-CZ 4.07Å; V273-F311 WeakPolarHBondContact CB-O 2.98Å; V273-F311 HydrophobicContact CG1-CE1 4.46Å; V273-F311 HydrophobicContact CG1-CE2 3.89Å; V273-F311 HydrophobicContact CG1-CZ 3.8Å; V273-F311 HydrophobicContact CG2-CD2 3.86Å; V273-F311 HydrophobicContact CG2-CE2 3.52Å; V273-F311 HydrophobicContact CG2-CZ 4.3Å; V273-F311 PolarHBondContact N-O 2.6Å; V273-I313 HydrophobicContact CG2-CD1 3.58Å; V273-I313 HydrophobicContact CG2-CG1 3.86Å; V273-I313 HydrophobicContact CG2-CG2 4.24Å
274	Y	91	Very high	82.3	Confident	17 Å²	17	42.5 Å²	42.5	7%	0.067	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.4	-180	-54.5	-104.6	0	0	0	109.7	S272 Y285 L286 E289 A292 Y306 K309	S272-Y274 WeakPolarHBondContact O-CE2 3.26Å; Y274-Y285 VanDerWaalsContact O-CA 3.28Å; Y274-Y285 WeakPolarHBondContact O-CA 3.1Å; Y274-L286 WeakPolarHBondContact CD2-O 3.46Å; Y274-L286 PolarHBondContact N-O 2.93Å; Y274-L286 PolarHBondContact O-N 3.2Å; Y274-E289 HydrophobicContact CE2-CB 4.42Å; Y274-E289 VanDerWaalsContact OH-CD 3.3Å; Y274-E289 WeakPolarHBondContact OH-CG 3.38Å; Y274-E289 PolarHBondContact OH-OE1 3.39Å; Y274-A292 HydrophobicContact CD1-CB 3.89Å; Y274-A292 HydrophobicContact CD2-CB 4.08Å; Y274-A292 HydrophobicContact CE1-CB 4.2Å; Y274-A292 HydrophobicContact CE2-CB 4.46Å; Y274-A292 HydrophobicContact CG-CB 3.82Å; Y274-Y306 HydrophobicContact CD1-CE2 4.02Å; Y274-K309 HydrophobicContact CD1-CG 4.02Å; Y274-K309 HydrophobicContact CE1-CD 4.28Å; Y274-K309 HydrophobicContact CE1-CG 4.25Å
275	N	90.1	Very high	82.8	Confident	11 Å²	11	37.9 Å²	37.9	6%	0.059	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.8	173.3	-178	-51.6	0	0	0	110.6	N283 F284 Y285 K307 G308 P310	N275-N283 PolarHBondContact ND2-OD1 3.23Å; N275-F284 CarbonylContact C-O 3.37Å; N275-F284 WeakPolarHBondContact CA-O 3.36Å; N275-Y285 HydrophobicContact CB-CD1 4.18Å; N275-Y285 HydrophobicContact CB-CE1 4Å; N275-Y285 WeakPolarHBondContact ND2-CE1 3.45Å; N275-Y285 PolarHBondContact ND2-OH 3.27Å; N275-Y285 VanDerWaalsContact ND2-OH 3.1Å; N275-K307 HydrophobicContact CB-CB 4.28Å; N275-K307 PolarHBondContact O-N 3.45Å; N275-K307 WeakPolarHBondContact OD1-CB 3.42Å; N275-K307 WeakPolarHBondContact OD1-CD 3.47Å; N275-G308 PolarHBondContact N-O 2.84Å; N275-P310 HydrophobicContact CB-CG 4.08Å
276	F	89.1	Confident	83.6	Confident	1 Å²	1	35.6 Å²	35.6	0%	0.004	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.3	171.8	-68.8	-97.3	0	0	0	111.1	N283 F284 L286 A292 L295 V296 P304 A305 Y306	F276-N283 CarbonylContact O-C 3.53Å; F276-N283 WeakPolarHBondContact O-CA 3.2Å; F276-F284 HydrophobicContact CB-CB 4.31Å; F276-F284 HydrophobicContact CB-CD1 4.37Å; F276-F284 PolarHBondContact N-O 2.98Å; F276-F284 PolarHBondContact O-N 3.15Å; F276-L286 HydrophobicContact CD2-CD1 4.32Å; F276-L286 HydrophobicContact CE2-CD1 4.13Å; F276-A292 HydrophobicContact CE2-CB 3.89Å; F276-A292 HydrophobicContact CZ-CB 3.93Å; F276-A292 WeakPolarHBondContact CZ-O 3.42Å; F276-L295 HydrophobicContact CD1-CB 4.37Å; F276-L295 HydrophobicContact CE1-CB 3.89Å; F276-L295 HydrophobicContact CZ-CB 4.11Å; F276-V296 HydrophobicContact CE1-CG2 3.68Å; F276-V296 HydrophobicContact CZ-CG2 3.89Å; F276-P304 HydrophobicContact CB-CB 3.78Å; F276-P304 HydrophobicContact CD1-CB 4.37Å; F276-P304 HydrophobicContact CG-CB 4.5Å; F276-A305 CarbonylContact C-O 3.58Å; F276-A305 VanDerWaalsContact CA-O 3.23Å; F276-A305 WeakPolarHBondContact CA-O 3.01Å; F276-Y306 HydrophobicContact CE1-CD2 4.05Å; F276-Y306 HydrophobicContact CE1-CG 4.42Å; F276-Y306 HydrophobicContact CE2-CD2 4.22Å; F276-Y306 AromaticContact CZ-CD2 3.88Å; F276-Y306 HydrophobicContact CZ-CD2 3.88Å
277	G	83.9	Confident	84.1	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	141.1	172.9	0	0	0	0	0	114	Y279 S282 P304 A305	G277-Y279 PolarHBondContact O-N 2.99Å; G277-S282 VanDerWaalsContact CA-O 3.26Å; G277-S282 WeakPolarHBondContact CA-O 3.21Å; G277-P304 CarbonylContact O-C 3.57Å; G277-A305 PolarHBondContact N-O 3.17Å; G277-A305 PolarHBondContact O-N 3.03Å
278	L	77.1	Confident	84.4	Confident	46 Å²	46	38.4 Å²	38.4	24%	0.241	20%	0.202	C	C	.	.	S	Bend	trans	-75.7	109.1	160.1	-60.2	169.7	0	0	0	108.2	K180 S282 L302 P304	K180-L278 HydrophobicContact CB-CD1 4.34Å; K180-L278 HydrophobicContact CG-CD1 4.38Å; L278-S282 WeakPolarHBondContact CA-OG 3.43Å; L278-S282 WeakPolarHBondContact CB-OG 3.48Å; L278-S282 PolarHBondContact N-OG 3.32Å; L278-S282 PolarHBondContact O-OG 2.95Å; L278-L302 WeakPolarHBondContact CD2-O 3.43Å; L278-P304 HydrophobicContact CD2-CB 4.4Å; L278-P304 HydrophobicContact CD2-CG 4.03Å; L278-P304 HydrophobicContact CG-CG 4.36Å
279	Y	66.4	Low	84.4	Confident	174 Å²	174	40.5 Å²	40.5	68%	0.682	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	54.6	-166.8	-175.7	-54	-82.6	0	0	0	112.3	G277 A281 K307	G277-Y279 PolarHBondContact O-N 2.99Å; Y279-A281 PolarHBondContact O-N 3.26Å; Y279-K307 PolarHBondContact O-NZ 3.32Å
280	E	59.5	Low	84.6	Confident	179 Å²	179	45.6 Å²	45.6	84%	0.836	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-70.7	-5.9	178.1	-60.8	-151.4	165.8	0	0	113.8
281	A	64.9	Low	84.8	Confident	48 Å²	48	47.4 Å²	47.4	40%	0.397	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-106.6	8.8	-164.9	0	0	0	0	0	115.7	L233 Y279	L233-A281 VanDerWaalsContact CD1-O 3.29Å; L233-A281 WeakPolarHBondContact CD1-O 3.48Å; L233-A281 WeakPolarHBondContact CD2-O 3.42Å; Y279-A281 PolarHBondContact O-N 3.26Å
282	S	78.4	Confident	84.7	Confident	7 Å²	7	45.5 Å²	45.5	5%	0.049	22%	0.224	C	C	.	.			trans	-143.4	153.4	175.7	59.7	0	0	0	0	112.7	K180 G277 L278 K307	K180-S282 WeakPolarHBondContact O-CB 3.42Å; G277-S282 VanDerWaalsContact CA-O 3.26Å; G277-S282 WeakPolarHBondContact CA-O 3.21Å; L278-S282 WeakPolarHBondContact CA-OG 3.43Å; L278-S282 WeakPolarHBondContact CB-OG 3.48Å; L278-S282 PolarHBondContact N-OG 3.32Å; L278-S282 PolarHBondContact O-OG 2.95Å; S282-K307 PolarHBondContact O-NZ 3.11Å
283	N	86.5	Confident	84.5	Confident	8 Å²	8	51 Å²	51	4%	0.043	25%	0.248	C	C	.	.			trans	-134.5	129.5	175.4	-61.1	-68.2	0	0	0	110	T182 L234 V235 N275 F276 Y285	T182-N283 PolarHBondContact N-O 3.21Å; T182-N283 PolarHBondContact OG1-O 3.37Å; L234-N283 PolarHBondContact O-ND2 2.81Å; V235-N283 WeakPolarHBondContact CG2-ND2 3.49Å; N275-N283 PolarHBondContact ND2-OD1 3.23Å; F276-N283 CarbonylContact O-C 3.53Å; F276-N283 WeakPolarHBondContact O-CA 3.2Å; N283-Y285 HydrophobicContact CB-CE2 3.72Å
284	F	88.8	Confident	84.3	Confident	37 Å²	37	57.1 Å²	57.1	16%	0.162	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131.9	179.6	-178.5	-109.7	0	0	0	109.1	Y175 T182 N275 F276 L286 L295	Y175-F284 HydrophobicContact CD2-CD2 4.06Å; Y175-F284 HydrophobicContact CD2-CE2 4.24Å; Y175-F284 AromaticContact CE2-CD2 3.97Å; Y175-F284 HydrophobicContact CE2-CD2 3.97Å; Y175-F284 HydrophobicContact CE2-CE2 4.35Å; T182-F284 WeakPolarHBondContact OG1-CA 3.44Å; T182-F284 WeakPolarHBondContact OG1-CD2 3.5Å; N275-F284 CarbonylContact C-O 3.37Å; N275-F284 WeakPolarHBondContact CA-O 3.36Å; F276-F284 HydrophobicContact CB-CB 4.31Å; F276-F284 HydrophobicContact CB-CD1 4.37Å; F276-F284 PolarHBondContact N-O 2.98Å; F276-F284 PolarHBondContact O-N 3.15Å; F284-L286 HydrophobicContact CD1-CD1 4.25Å; F284-L286 HydrophobicContact CD1-CD2 4.31Å; F284-L286 HydrophobicContact CD1-CG 3.92Å; F284-L286 HydrophobicContact CE1-CD1 3.64Å; F284-L286 HydrophobicContact CE1-CD2 3.34Å; F284-L286 HydrophobicContact CE1-CG 3.35Å; F284-L286 HydrophobicContact CZ-CD2 3.52Å; F284-L286 HydrophobicContact CZ-CG 4.06Å; F284-L295 HydrophobicContact CE1-CD1 4.09Å
285	Y	92.6	Very high	84.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.8	-174.2	-59.9	-94.4	0	0	0	111.6	K173 T182 L184 Y236 V273 Y274 N275 N283 P310 F311	K173-Y285 WeakPolarHBondContact CD-O 3.44Å; K173-Y285 PolarHBondContact NZ-O 2.88Å; K173-Y285 VanDerWaalsContact NZ-O 3.14Å; T182-Y285 HydrophobicContact CG2-CD2 4.09Å; L184-Y285 HydrophobicContact CD1-CD2 4.25Å; L184-Y285 HydrophobicContact CD1-CG 4.18Å; Y236-Y285 HydrophobicContact CD2-CD2 4.27Å; Y236-Y285 HydrophobicContact CD2-CE1 4.38Å; Y236-Y285 AromaticContact CD2-CE2 3.54Å; Y236-Y285 HydrophobicContact CD2-CE2 3.54Å; Y236-Y285 AromaticContact CD2-CZ 3.6Å; Y236-Y285 HydrophobicContact CE2-CE2 4Å; Y236-Y285 PolarHBondContact N-OH 2.96Å; V273-Y285 HydrophobicContact CG1-CD1 3.93Å; V273-Y285 HydrophobicContact CG1-CG 4.43Å; Y274-Y285 VanDerWaalsContact O-CA 3.28Å; Y274-Y285 WeakPolarHBondContact O-CA 3.1Å; N275-Y285 HydrophobicContact CB-CD1 4.18Å; N275-Y285 HydrophobicContact CB-CE1 4Å; N275-Y285 WeakPolarHBondContact ND2-CE1 3.45Å; N275-Y285 PolarHBondContact ND2-OH 3.27Å; N275-Y285 VanDerWaalsContact ND2-OH 3.1Å; N283-Y285 HydrophobicContact CB-CE2 3.72Å; Y285-P310 HydrophobicContact CD1-CG 4.37Å; Y285-P310 HydrophobicContact CE1-CG 4.04Å; Y285-F311 HydrophobicContact CD1-CE1 4.46Å; Y285-F311 HydrophobicContact CD1-CZ 4.47Å; Y285-F311 HydrophobicContact CE1-CE1 4.32Å
286	L	92.3	Very high	83.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.6	178.8	-67.9	178.5	0	0	0	110.3	V273 Y274 F276 F284 E291 A292 L295	V273-L286 CarbonylContact C-O 3.55Å; V273-L286 WeakPolarHBondContact CA-O 3.14Å; Y274-L286 WeakPolarHBondContact CD2-O 3.46Å; Y274-L286 PolarHBondContact N-O 2.93Å; Y274-L286 PolarHBondContact O-N 3.2Å; F276-L286 HydrophobicContact CD2-CD1 4.32Å; F276-L286 HydrophobicContact CE2-CD1 4.13Å; F284-L286 HydrophobicContact CD1-CD1 4.25Å; F284-L286 HydrophobicContact CD1-CD2 4.31Å; F284-L286 HydrophobicContact CD1-CG 3.92Å; F284-L286 HydrophobicContact CE1-CD1 3.64Å; F284-L286 HydrophobicContact CE1-CD2 3.34Å; F284-L286 HydrophobicContact CE1-CG 3.35Å; F284-L286 HydrophobicContact CZ-CD2 3.52Å; F284-L286 HydrophobicContact CZ-CG 4.06Å; L286-E291 HydrophobicContact CD1-CB 4.34Å; L286-E291 HydrophobicContact CD1-CG 3.98Å; L286-E291 HydrophobicContact CD2-CG 4.41Å; L286-E291 WeakPolarHBondContact CD2-OE2 3.32Å; L286-A292 HydrophobicContact CD1-CB 4.46Å; L286-L295 HydrophobicContact CD1-CD1 3.3Å
287	S	91.8	Very high	83.4	Confident	28 Å²	28	64 Å²	64	20%	0.196	33%	0.329	C	S	.	.			trans	-116.6	-4.4	169.5	50.6	0	0	0	0	112.9	I205 S272	I205-S287 WeakPolarHBondContact CG1-OG 3.49Å; I205-S287 WeakPolarHBondContact O-CB 3.45Å; I205-S287 PolarHBondContact O-OG 2.85Å; S272-S287 WeakPolarHBondContact O-CA 3.18Å
288	N	90.9	Very high	83.3	Confident	79 Å²	79	70.4 Å²	70.4	42%	0.422	35%	0.353	S	S	.	.			trans	-90.8	115.2	174.9	-175.5	-61.8	0	0	0	109.4	E290 E291 A292	N288-E290 WeakPolarHBondContact OD1-CA 3.49Å; N288-E290 WeakPolarHBondContact OD1-CB 3.3Å; N288-E290 PolarHBondContact OD1-N 3.37Å; N288-E291 HydrophobicContact CB-CB 4Å; N288-E291 PolarHBondContact O-N 3.36Å; N288-E291 PolarHBondContact OD1-N 2.97Å; N288-A292 PolarHBondContact O-N 2.95Å
289	E	85.2	Confident	83.1	Confident	106 Å²	106	79.8 Å²	79.8	50%	0.495	39%	0.385	S	S	.	.	H	α-helix	trans	-63.5	-43.2	-179	-178.6	157.4	-124.9	0	0	112.5	Y274 E291 A292 E293	Y274-E289 HydrophobicContact CE2-CB 4.42Å; Y274-E289 VanDerWaalsContact OH-CD 3.3Å; Y274-E289 WeakPolarHBondContact OH-CG 3.38Å; Y274-E289 PolarHBondContact OH-OE1 3.39Å; E289-E291 VanDerWaalsContact C-N 3.3Å; E289-E291 PolarHBondContact O-N 3.27Å; E289-A292 WeakPolarHBondContact O-CB 3.35Å; E289-A292 PolarHBondContact O-N 3.47Å; E289-A292 VanDerWaalsContact O-N 3.08Å; E289-E293 HydrophobicContact CG-CG 4.37Å; E289-E293 WeakPolarHBondContact O-CG 3.48Å; E289-E293 PolarHBondContact O-N 3.16Å
290	E	88.8	Confident	83.8	Confident	111 Å²	111	74.5 Å²	74.5	52%	0.519	37%	0.369	S	S	.	.	H	α-helix	trans	-61.5	-38.9	179.1	-164.8	-165.7	151.9	0	0	111.8	N288 K294	N288-E290 WeakPolarHBondContact OD1-CA 3.49Å; N288-E290 WeakPolarHBondContact OD1-CB 3.3Å; N288-E290 PolarHBondContact OD1-N 3.37Å; E290-K294 WeakPolarHBondContact O-CB 3.27Å; E290-K294 WeakPolarHBondContact O-CD 3.32Å; E290-K294 VanDerWaalsContact O-CG 3.26Å; E290-K294 WeakPolarHBondContact O-CG 3.26Å; E290-K294 PolarHBondContact O-N 3.25Å; E290-K294 WeakPolarHBondContact OE1-CE 3.08Å; E290-K294 IonicContact OE1-NZ 3.84Å; E290-K294 PolarHBondContact OE1-NZ 2.95Å
291	E	89.5	Confident	84.4	Confident	87 Å²	87	73.3 Å²	73.3	41%	0.407	37%	0.368	S	S	.	.	H	α-helix	trans	-67.3	-40.6	174.2	-167.4	-178.3	177.4	0	0	111.5	L286 N288 E289 K294 L295	L286-E291 HydrophobicContact CD1-CB 4.34Å; L286-E291 HydrophobicContact CD1-CG 3.98Å; L286-E291 HydrophobicContact CD2-CG 4.41Å; L286-E291 WeakPolarHBondContact CD2-OE2 3.32Å; N288-E291 HydrophobicContact CB-CB 4Å; N288-E291 PolarHBondContact O-N 3.36Å; N288-E291 PolarHBondContact OD1-N 2.97Å; E289-E291 VanDerWaalsContact C-N 3.3Å; E289-E291 PolarHBondContact O-N 3.27Å; E291-K294 PolarHBondContact O-N 3.26Å; E291-L295 HydrophobicContact CG-CD1 4.47Å; E291-L295 PolarHBondContact O-N 3.34Å
292	A	87	Confident	84.8	Confident	3 Å²	3	77 Å²	77	3%	0.025	38%	0.381	C	S	.	.	H	α-helix	trans	-63.1	-45.8	176	0	0	0	0	0	111.6	Y274 F276 L286 N288 E289 K294 L295 V296	Y274-A292 HydrophobicContact CD1-CB 3.89Å; Y274-A292 HydrophobicContact CD2-CB 4.08Å; Y274-A292 HydrophobicContact CE1-CB 4.2Å; Y274-A292 HydrophobicContact CE2-CB 4.46Å; Y274-A292 HydrophobicContact CG-CB 3.82Å; F276-A292 HydrophobicContact CE2-CB 3.89Å; F276-A292 HydrophobicContact CZ-CB 3.93Å; F276-A292 WeakPolarHBondContact CZ-O 3.42Å; L286-A292 HydrophobicContact CD1-CB 4.46Å; N288-A292 PolarHBondContact O-N 2.95Å; E289-A292 WeakPolarHBondContact O-CB 3.35Å; E289-A292 PolarHBondContact O-N 3.47Å; E289-A292 VanDerWaalsContact O-N 3.08Å; A292-K294 PolarHBondContact O-N 2.96Å; A292-L295 WeakPolarHBondContact O-CB 3.44Å; A292-L295 PolarHBondContact O-N 3.18Å; A292-V296 WeakPolarHBondContact O-CG2 2.97Å; A292-V296 PolarHBondContact O-N 2.93Å
293	E	87.6	Confident	84.8	Confident	128 Å²	128	77.8 Å²	77.8	60%	0.598	39%	0.388	S	S	*	.	H	α-helix	trans	-60.9	-43.7	176.2	-72.3	-176.2	159.8	0	0	111.9	E289 L295 V296 G297	E289-E293 HydrophobicContact CG-CG 4.37Å; E289-E293 WeakPolarHBondContact O-CG 3.48Å; E289-E293 PolarHBondContact O-N 3.16Å; E293-L295 VanDerWaalsContact C-N 3.29Å; E293-L295 PolarHBondContact O-N 3.44Å; E293-V296 PolarHBondContact O-N 2.04Å; E293-G297 PolarHBondContact O-N 2.77Å
294	K	88.2	Confident	84.6	Confident	129 Å²	129	78.7 Å²	78.7	56%	0.561	39%	0.394	S	S	*	.	H	α-helix	trans	-58.8	-39.7	174.6	-79.1	168.1	175.4	163.9	0	112.2	E290 E291 A292 G297	E290-K294 WeakPolarHBondContact O-CB 3.27Å; E290-K294 WeakPolarHBondContact O-CD 3.32Å; E290-K294 VanDerWaalsContact O-CG 3.26Å; E290-K294 WeakPolarHBondContact O-CG 3.26Å; E290-K294 PolarHBondContact O-N 3.25Å; E290-K294 WeakPolarHBondContact OE1-CE 3.08Å; E290-K294 IonicContact OE1-NZ 3.84Å; E290-K294 PolarHBondContact OE1-NZ 2.95Å; E291-K294 PolarHBondContact O-N 3.26Å; A292-K294 PolarHBondContact O-N 2.96Å; K294-G297 PolarHBondContact O-N 2.9Å
295	L	86.5	Confident	84.4	Confident	23 Å²	23	79.8 Å²	79.8	12%	0.12	41%	0.41	C	S	.	.	H	α-helix	trans	-67.9	-42.8	177	-91.1	154.3	0	0	0	112.5	F276 F284 L286 E291 A292 E293 G297 R298 P304	F276-L295 HydrophobicContact CD1-CB 4.37Å; F276-L295 HydrophobicContact CE1-CB 3.89Å; F276-L295 HydrophobicContact CZ-CB 4.11Å; F284-L295 HydrophobicContact CE1-CD1 4.09Å; L286-L295 HydrophobicContact CD1-CD1 3.3Å; E291-L295 HydrophobicContact CG-CD1 4.47Å; E291-L295 PolarHBondContact O-N 3.34Å; A292-L295 WeakPolarHBondContact O-CB 3.44Å; A292-L295 PolarHBondContact O-N 3.18Å; E293-L295 VanDerWaalsContact C-N 3.29Å; E293-L295 PolarHBondContact O-N 3.44Å; L295-G297 PolarHBondContact O-N 2.95Å; L295-R298 WeakPolarHBondContact O-CB 3.21Å; L295-R298 PolarHBondContact O-N 3.01Å; L295-P304 HydrophobicContact CD2-CG 3.95Å
296	V	83.2	Confident	84	Confident	91 Å²	91	85.1 Å²	85.1	55%	0.552	43%	0.431	S	S	*	.	H	α-helix	trans	-60.8	-35.4	175.3	174.5	0	0	0	0	111.3	F276 A292 E293 R298	F276-V296 HydrophobicContact CE1-CG2 3.68Å; F276-V296 HydrophobicContact CZ-CG2 3.89Å; A292-V296 WeakPolarHBondContact O-CG2 2.97Å; A292-V296 PolarHBondContact O-N 2.93Å; E293-V296 PolarHBondContact O-N 2.04Å; V296-R298 VanDerWaalsContact C-N 3.26Å; V296-R298 PolarHBondContact O-N 3.48Å
297	G	81.4	Confident	83.5	Confident	58 Å²	58	89.4 Å²	89.4	60%	0.598	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-11.7	178.7	0	0	0	0	0	115.5	E293 K294 L295	E293-G297 PolarHBondContact O-N 2.77Å; K294-G297 PolarHBondContact O-N 2.9Å; L295-G297 PolarHBondContact O-N 2.95Å
298	R	82	Confident	83	Confident	137 Å²	137	89 Å²	89	52%	0.517	45%	0.449	S	S	.	.			trans	-74	135.9	-179.6	-77.1	-176.4	71.7	155.9	3	111.7	L295 V296 D300 A303	L295-R298 WeakPolarHBondContact O-CB 3.21Å; L295-R298 PolarHBondContact O-N 3.01Å; V296-R298 VanDerWaalsContact C-N 3.26Å; V296-R298 PolarHBondContact O-N 3.48Å; R298-D300 WeakPolarHBondContact CB-OD1 3.07Å; R298-D300 IonicContact CZ-OD1 2.93Å; R298-D300 IonicContact CZ-OD2 3.56Å; R298-D300 IonicContact NE-OD1 2.8Å; R298-D300 PolarHBondContact NE-OD1 2.86Å; R298-D300 IonicContact NE-OD2 2.62Å; R298-D300 IonicContact NH2-OD1 3.68Å; R298-D300 IonicContact NH2-OD2 3.03Å; R298-D300 PolarHBondContact NH2-OD2 3.13Å; R298-A303 HydrophobicContact CB-CB 3.9Å
299	R	74.3	Confident	82.8	Confident	242 Å²	242	89.8 Å²	89.8	91%	0.913	45%	0.449	S	S	*	.			trans	-111	7.5	-177.5	-65.2	-167.3	-178.7	-170.9	1.1	114.7
300	D	79.7	Confident	82.9	Confident	64 Å²	64	86 Å²	86	34%	0.342	43%	0.434	S	S	.	.	S	Bend	trans	-74.1	147.3	176.4	51.8	-40	0	0	0	111.7	R298 L302 A303	R298-D300 WeakPolarHBondContact CB-OD1 3.07Å; R298-D300 IonicContact CZ-OD1 2.93Å; R298-D300 IonicContact CZ-OD2 3.56Å; R298-D300 IonicContact NE-OD1 2.8Å; R298-D300 PolarHBondContact NE-OD1 2.86Å; R298-D300 IonicContact NE-OD2 2.62Å; R298-D300 IonicContact NH2-OD1 3.68Å; R298-D300 IonicContact NH2-OD2 3.03Å; R298-D300 PolarHBondContact NH2-OD2 3.13Å; D300-L302 PolarHBondContact O-N 2.02Å; D300-A303 WeakPolarHBondContact O-CB 3.03Å; D300-A303 PolarHBondContact O-N 3.43Å
301	N	71.8	Confident	83.1	Confident	153 Å²	153	80.8 Å²	80.8	82%	0.818	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-8.5	177.5	-69	-11.5	0	0	0	113.7
302	L	74.2	Confident	83.1	Confident	125 Å²	125	76.7 Å²	76.7	65%	0.654	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	13.5	174.8	-62.5	172.2	0	0	0	111.7	L278 D300	L278-L302 WeakPolarHBondContact CD2-O 3.43Å; D300-L302 PolarHBondContact O-N 2.02Å
303	A	77.6	Confident	83.5	Confident	24 Å²	24	76.6 Å²	76.6	20%	0.198	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-72.3	129.5	173.2	0	0	0	0	0	109.8	R298 D300 A305	R298-A303 HydrophobicContact CB-CB 3.9Å; D300-A303 WeakPolarHBondContact O-CB 3.03Å; D300-A303 PolarHBondContact O-N 3.43Å; A303-A305 PolarHBondContact O-N 3.11Å
304	P	83.1	Confident	83.8	Confident	28 Å²	28	70.5 Å²	70.5	18%	0.182	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-60.5	128	170.9	-21.9	33.7	0	0	0	110.8	F276 G277 L278 L295	F276-P304 HydrophobicContact CB-CB 3.78Å; F276-P304 HydrophobicContact CD1-CB 4.37Å; F276-P304 HydrophobicContact CG-CB 4.5Å; G277-P304 CarbonylContact O-C 3.57Å; L278-P304 HydrophobicContact CD2-CB 4.4Å; L278-P304 HydrophobicContact CD2-CG 4.03Å; L278-P304 HydrophobicContact CG-CG 4.36Å; L295-P304 HydrophobicContact CD2-CG 3.95Å
305	A	84	Confident	84	Confident	59 Å²	59	70.4 Å²	70.4	49%	0.488	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	138.6	173.7	0	0	0	0	0	110.2	F276 G277 A303	F276-A305 CarbonylContact C-O 3.58Å; F276-A305 VanDerWaalsContact CA-O 3.23Å; F276-A305 WeakPolarHBondContact CA-O 3.01Å; G277-A305 PolarHBondContact N-O 3.17Å; G277-A305 PolarHBondContact O-N 3.03Å; A303-A305 PolarHBondContact O-N 3.11Å
306	Y	84.3	Confident	83.8	Confident	113 Å²	113	75.7 Å²	75.7	44%	0.443	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	130.9	172.9	176.4	-115.7	0	0	0	110.7	Y274 F276 G308 K309	Y274-Y306 HydrophobicContact CD1-CE2 4.02Å; F276-Y306 HydrophobicContact CE1-CD2 4.05Å; F276-Y306 HydrophobicContact CE1-CG 4.42Å; F276-Y306 HydrophobicContact CE2-CD2 4.22Å; F276-Y306 AromaticContact CZ-CD2 3.88Å; F276-Y306 HydrophobicContact CZ-CD2 3.88Å; Y306-G308 WeakPolarHBondContact CE2-O 2.97Å; Y306-G308 WeakPolarHBondContact OH-CA 3.41Å; Y306-K309 WeakPolarHBondContact OH-CG 3.47Å
307	K	81.6	Confident	82.9	Confident	90 Å²	90	81.9 Å²	81.9	39%	0.391	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-6.3	-179	-65.1	-170.7	174.1	172.4	0	113.8	N275 Y279 S282	N275-K307 HydrophobicContact CB-CB 4.28Å; N275-K307 PolarHBondContact O-N 3.45Å; N275-K307 WeakPolarHBondContact OD1-CB 3.42Å; N275-K307 WeakPolarHBondContact OD1-CD 3.47Å; Y279-K307 PolarHBondContact O-NZ 3.32Å; S282-K307 PolarHBondContact O-NZ 3.11Å
308	G	82.2	Confident	82.9	Confident	18 Å²	18	83.1 Å²	83.1	19%	0.186	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	124.1	-172.8	177.6	0	0	0	0	0	114.4	N275 Y306 P310	N275-G308 PolarHBondContact N-O 2.84Å; Y306-G308 WeakPolarHBondContact CE2-O 2.97Å; Y306-G308 WeakPolarHBondContact OH-CA 3.41Å; G308-P310 WeakPolarHBondContact O-CD 3.15Å
309	K	86.1	Confident	83	Confident	97 Å²	97	80.2 Å²	80.2	42%	0.422	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	87.4	174.9	-73.3	172.2	-179.8	-166.6	0	109.4	V273 Y274 Y306 F311	V273-K309 VanDerWaalsContact O-CA 3.27Å; V273-K309 WeakPolarHBondContact O-CA 3.02Å; Y274-K309 HydrophobicContact CD1-CG 4.02Å; Y274-K309 HydrophobicContact CE1-CD 4.28Å; Y274-K309 HydrophobicContact CE1-CG 4.25Å; Y306-K309 WeakPolarHBondContact OH-CG 3.47Å; K309-F311 VanDerWaalsContact C-N 3.28Å; K309-F311 PolarHBondContact O-N 3.04Å
310	P	88.4	Confident	83.5	Confident	27 Å²	27	71.2 Å²	71.2	18%	0.175	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-20.3	-171.5	26.1	-38.7	0	0	0	115.2	V273 N275 Y285 G308	V273-P310 WeakPolarHBondContact O-CD 3.23Å; N275-P310 HydrophobicContact CB-CG 4.08Å; Y285-P310 HydrophobicContact CD1-CG 4.37Å; Y285-P310 HydrophobicContact CE1-CG 4.04Å; G308-P310 WeakPolarHBondContact O-CD 3.15Å
311	F	92.5	Very high	83.7	Confident	1 Å²	1	71.6 Å²	71.6	0%	0.004	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	168.4	179.2	51.6	-89.3	0	0	0	111.1	L184 L222 A238 V260 V261 V273 Y285 K309 I313	L184-F311 HydrophobicContact CD1-CZ 4.07Å; L222-F311 HydrophobicContact CD1-CD1 3.51Å; L222-F311 HydrophobicContact CD1-CD2 4.4Å; L222-F311 HydrophobicContact CD1-CE1 3.55Å; L222-F311 HydrophobicContact CD1-CE2 4.39Å; L222-F311 HydrophobicContact CD1-CG 3.99Å; L222-F311 HydrophobicContact CD1-CZ 4Å; L222-F311 HydrophobicContact CD2-CE2 4.18Å; L222-F311 HydrophobicContact CD2-CZ 4.13Å; A238-F311 HydrophobicContact CB-CB 4.08Å; V260-F311 HydrophobicContact CB-CB 4.22Å; V260-F311 HydrophobicContact CB-CD2 4.4Å; V260-F311 HydrophobicContact CG1-CD2 4.18Å; V260-F311 HydrophobicContact CG2-CB 3.64Å; V260-F311 HydrophobicContact CG2-CD2 4.39Å; V260-F311 HydrophobicContact CG2-CG 4.14Å; V261-F311 WeakPolarHBondContact O-CA 3.32Å; V273-F311 HydrophobicContact CB-CD2 3.94Å; V273-F311 HydrophobicContact CB-CE2 3.68Å; V273-F311 HydrophobicContact CB-CZ 4.07Å; V273-F311 WeakPolarHBondContact CB-O 2.98Å; V273-F311 HydrophobicContact CG1-CE1 4.46Å; V273-F311 HydrophobicContact CG1-CE2 3.89Å; V273-F311 HydrophobicContact CG1-CZ 3.8Å; V273-F311 HydrophobicContact CG2-CD2 3.86Å; V273-F311 HydrophobicContact CG2-CE2 3.52Å; V273-F311 HydrophobicContact CG2-CZ 4.3Å; V273-F311 PolarHBondContact N-O 2.6Å; Y285-F311 HydrophobicContact CD1-CE1 4.46Å; Y285-F311 HydrophobicContact CD1-CZ 4.47Å; Y285-F311 HydrophobicContact CE1-CE1 4.32Å; K309-F311 VanDerWaalsContact C-N 3.28Å; K309-F311 PolarHBondContact O-N 3.04Å; F311-I313 HydrophobicContact CD2-CG2 3.74Å; F311-I313 HydrophobicContact CE2-CG2 3.96Å
312	A	90.2	Very high	84.4	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.008	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152	171.5	0	0	0	0	0	112	V261 E263 E264 L271	V261-A312 HydrophobicContact CG2-CB 4.07Å; V261-A312 PolarHBondContact N-O 3.35Å; V261-A312 PolarHBondContact O-N 3.36Å; E263-A312 VanDerWaalsContact C-CB 3.46Å; E264-A312 HydrophobicContact CB-CB 4.2Å; E264-A312 VanDerWaalsContact N-CB 3.33Å; L271-A312 CarbonylContact O-C 3.59Å; L271-A312 WeakPolarHBondContact O-CA 3.25Å; L271-A312 WeakPolarHBondContact O-CB 3.43Å
313	I	95.4	Very high	85.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	-179.5	-170.3	65	-178.7	0	0	0	110.9	I205 Y207 I208 V260 S269 T270 L271 V273 F311	I205-I313 HydrophobicContact CG2-CD1 4.05Å; Y207-I313 WeakPolarHBondContact O-CB 3.31Å; I208-I313 HydrophobicContact CG2-CB 4.24Å; I208-I313 HydrophobicContact CG2-CG2 3.64Å; V260-I313 HydrophobicContact CB-CG2 4.44Å; V260-I313 HydrophobicContact CG1-CG2 3.81Å; S269-I313 WeakPolarHBondContact CB-O 3.07Å; T270-I313 PolarHBondContact N-O 2.98Å; L271-I313 HydrophobicContact CB-CG1 3.89Å; L271-I313 HydrophobicContact CD1-CG1 4.45Å; L271-I313 PolarHBondContact N-O 3.27Å; L271-I313 PolarHBondContact O-N 3.49Å; V273-I313 HydrophobicContact CG2-CD1 3.58Å; V273-I313 HydrophobicContact CG2-CG1 3.86Å; V273-I313 HydrophobicContact CG2-CG2 4.24Å; F311-I313 HydrophobicContact CD2-CG2 3.74Å; F311-I313 HydrophobicContact CE2-CG2 3.96Å
314	W	94.3	Very high	85.7	Confident	1 Å²	1	65.4 Å²	65.4	0%	0.004	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-104.5	147.3	-179.5	-61.6	-92.6	0	0	0	111.2	P165 L168 Y207 L219 V261 C267 S268	P165-W314 HydrophobicContact CG-CH2 3.75Å; P165-W314 HydrophobicContact CG-CZ2 3.59Å; P165-W314 HydrophobicContact CG-CZ3 4.48Å; L168-W314 HydrophobicContact CD1-CB 3.56Å; L168-W314 HydrophobicContact CD1-CD2 3.98Å; L168-W314 HydrophobicContact CD1-CE3 4.32Å; L168-W314 HydrophobicContact CD1-CG 3.62Å; L168-W314 HydrophobicContact CD2-CD2 4.1Å; L168-W314 HydrophobicContact CD2-CE3 3.81Å; L168-W314 HydrophobicContact CD2-CZ3 4.26Å; Y207-W314 PolarHBondContact N-O 3.04Å; Y207-W314 VanDerWaalsContact O-CE3 3.32Å; Y207-W314 PolarHBondContact O-N 3.48Å; Y207-W314 VanDerWaalsContact O-N 3.11Å; L219-W314 HydrophobicContact CD2-CH2 3.7Å; V261-W314 HydrophobicContact CG1-CH2 4.13Å; V261-W314 HydrophobicContact CG1-CZ2 4.21Å; C267-W314 HydrophobicContact CB-CZ2 4.04Å; C267-W314 PolarHBondContact O-NE1 3.4Å; S268-W314 PolarHBondContact O-NE1 2.79Å
315	K	91.8	Very high	85.9	Confident	127 Å²	127	68.3 Å²	68.3	55%	0.552	33%	0.333	S	S	*	.			trans	-78.3	160.3	165.1	69.1	-176.6	-177.8	176.4	0	111.1	T270 L271	T270-K315 VanDerWaalsContact OG1-CG 3.3Å; T270-K315 WeakPolarHBondContact OG1-CG 3.34Å; T270-K315 PolarHBondContact OG1-N 2.85Å; L271-K315 HydrophobicContact CD1-CB 3.89Å; L271-K315 HydrophobicContact CG-CB 4.26Å
316	E	81.8	Confident	86	Confident	133 Å²	133	69.1 Å²	69.1	62%	0.621	32%	0.32	S	S	*	.			trans	-60.2	140.1	165.6	-153.1	162.9	177.1	0	0	109.3	Y207	Y207-E316 HydrophobicContact CD2-CB 4.17Å; Y207-E316 HydrophobicContact CE1-CG 4.5Å; Y207-E316 HydrophobicContact CE2-CB 3.42Å; Y207-E316 VanDerWaalsContact CE2-CB 3.42Å; Y207-E316 HydrophobicContact CE2-CG 3.77Å; Y207-E316 WeakPolarHBondContact OH-CG 3.02Å; Y207-E316 PolarHBondContact OH-OE1 2.91Å; Y207-E316 PolarHBondContact OH-OE2 3.34Å
317	E	63.7	Low	86.2	Confident	221 Å²	221	65.1 Å²	65.1	100%	1.033	31%	0.309	S	S	*	.			trans	-77	0	169.7	-76.8	-177.3	179.2	0	0	111.5	K164	K164-E317 VanDerWaalsContact NZ-CD 3.3Å; K164-E317 IonicContact NZ-OE1 3.61Å; K164-E317 PolarHBondContact NZ-OE1 2.55Å

Retrieved 317 of 317 residues in 267.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).