A0A077Z971_TRITR Loading...

Cadherin domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z971, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 330 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	33	Very low	36.9	Very low	239 Å²	239	140.5 Å²	140.5	100%	1.177	73%	0.729	S	S	*	*				0	101.6	0	-75.7	171.2	141.3	0	0	108.5	S3	M1-S3 PolarHBondContact O-N 3.42Å
2	P	33.7	Very low	37	Very low	130 Å²	130	137.5 Å²	137.5	84%	0.844	71%	0.714	S	S	*	*			trans	-80.9	121.4	175.3	30.6	-24.8	0	0	0	108.6
3	S	33.1	Very low	37.1	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	70%	0.697	S	S	*	*			trans	-64.5	136.7	179.2	53.2	0	0	0	0	111	M1 R5	M1-S3 PolarHBondContact O-N 3.42Å; S3-R5 PolarHBondContact O-N 3.04Å
4	I	32.5	Very low	37.1	Very low	144 Å²	144	131.9 Å²	131.9	74%	0.738	69%	0.685	S	S	*	*			trans	-67.5	109.8	-175.7	-60.5	168.9	0	0	0	109.1	S6	I4-S6 WeakPolarHBondContact CG2-OG 3.48Å; I4-S6 PolarHBondContact O-N 3.02Å
5	R	33.5	Very low	37	Very low	233 Å²	233	133.7 Å²	133.7	88%	0.879	68%	0.68	S	S	*	*			trans	-72.9	66.5	160.6	-80.6	-176.4	170.1	179.7	-2.3	109.6	S3	S3-R5 PolarHBondContact O-N 3.04Å
6	S	46.3	Very low	36.8	Very low	62 Å²	62	129.9 Å²	129.9	43%	0.434	66%	0.662	S	S	.	*			trans	-92.5	-15.7	-174.6	43.9	0	0	0	0	115.6	I4 M10	I4-S6 WeakPolarHBondContact CG2-OG 3.48Å; I4-S6 PolarHBondContact O-N 3.02Å; S6-M10 WeakPolarHBondContact O-CB 3.09Å; S6-M10 WeakPolarHBondContact O-CG 3.5Å; S6-M10 PolarHBondContact O-N 3.09Å
7	G	35.5	Very low	36.8	Very low	50 Å²	50	128.9 Å²	128.9	52%	0.515	66%	0.657	S	S	.	*	H	α-helix	trans	-68.7	-39.3	-174.5	0	0	0	0	0	114.4	T11	G7-T11 PolarHBondContact O-N 3.09Å; G7-T11 PolarHBondContact O-OG1 3.04Å
8	W	41.6	Very low	36.5	Very low	225 Å²	225	127.2 Å²	127.2	85%	0.852	65%	0.649	S	S	*	*	H	α-helix	trans	-85.4	-29.7	-175.6	-85.4	59.6	0	0	0	113.5	T11 L12	W8-T11 WeakPolarHBondContact CA-OG1 3.47Å; W8-T11 PolarHBondContact O-OG1 3.39Å; W8-T11 VanDerWaalsContact O-OG1 3.09Å; W8-L12 WeakPolarHBondContact O-CB 3.27Å; W8-L12 PolarHBondContact O-N 3.01Å
9	Q	38.3	Very low	36.4	Very low	144 Å²	144	126.8 Å²	126.8	67%	0.673	64%	0.639	S	S	*	*	H	α-helix	trans	-76.9	-35.2	175.1	-79.6	-176.5	-39.4	0	0	112.1	L12 L13	Q9-L12 PolarHBondContact O-N 3.3Å; Q9-L13 WeakPolarHBondContact O-CB 3.26Å; Q9-L13 PolarHBondContact O-N 3.06Å
10	M	35.2	Very low	36.1	Very low	116 Å²	116	125.7 Å²	125.7	57%	0.571	63%	0.632	S	S	*	*	H	α-helix	trans	-68.4	-38.7	176.2	-76.6	-123	85.3	0	0	112.6	S6 L13 L14	S6-M10 WeakPolarHBondContact O-CB 3.09Å; S6-M10 WeakPolarHBondContact O-CG 3.5Å; S6-M10 PolarHBondContact O-N 3.09Å; M10-L13 PolarHBondContact O-N 3.48Å; M10-L14 WeakPolarHBondContact O-CB 3.26Å; M10-L14 PolarHBondContact O-N 3.15Å
11	T	43	Very low	35.9	Very low	89 Å²	89	122.9 Å²	122.9	55%	0.546	63%	0.628	S	S	.	*	H	α-helix	trans	-65.7	-38.5	174.9	39.7	0	0	0	0	111.8	G7 W8 W15	G7-T11 PolarHBondContact O-N 3.09Å; G7-T11 PolarHBondContact O-OG1 3.04Å; W8-T11 WeakPolarHBondContact CA-OG1 3.47Å; W8-T11 PolarHBondContact O-OG1 3.39Å; W8-T11 VanDerWaalsContact O-OG1 3.09Å; T11-W15 WeakPolarHBondContact O-CB 3.47Å; T11-W15 PolarHBondContact O-N 3.49Å
12	L	38.6	Very low	36.1	Very low	105 Å²	105	114.5 Å²	114.5	55%	0.55	59%	0.59	S	S	.	*	H	α-helix	trans	-72.9	-31.9	177.1	-146.9	129	0	0	0	113	W8 Q9 W15 L16	W8-L12 WeakPolarHBondContact O-CB 3.27Å; W8-L12 PolarHBondContact O-N 3.01Å; Q9-L12 PolarHBondContact O-N 3.3Å; L12-W15 WeakPolarHBondContact O-CB 3.14Å; L12-W15 PolarHBondContact O-N 3.18Å; L12-L16 HydrophobicContact CD2-CD1 4.17Å; L12-L16 WeakPolarHBondContact O-CB 3.32Å; L12-L16 WeakPolarHBondContact O-CG 3.37Å; L12-L16 PolarHBondContact O-N 2.93Å
13	L	37.7	Very low	36.3	Very low	94 Å²	94	114.1 Å²	114.1	49%	0.492	58%	0.577	S	S	.	*	H	α-helix	trans	-72	-43.3	172	-100	147.8	0	0	0	112.2	Q9 M10 W15 L16 I17	Q9-L13 WeakPolarHBondContact O-CB 3.26Å; Q9-L13 PolarHBondContact O-N 3.06Å; M10-L13 PolarHBondContact O-N 3.48Å; L13-W15 VanDerWaalsContact C-N 3.26Å; L13-W15 PolarHBondContact O-N 2.73Å; L13-L16 PolarHBondContact O-N 3.26Å; L13-I17 HydrophobicContact CD2-CD1 4.49Å; L13-I17 WeakPolarHBondContact O-CB 3.08Å; L13-I17 WeakPolarHBondContact O-CD1 3.47Å; L13-I17 WeakPolarHBondContact O-CG1 3.16Å; L13-I17 PolarHBondContact O-N 2.77Å
14	L	37.8	Very low	36.6	Very low	102 Å²	102	111.8 Å²	111.8	53%	0.534	56%	0.564	S	S	.	*	H	α-helix	trans	-61.9	-38.1	170.3	-110.2	128.4	0	0	0	110.9	M10 I17 L18	M10-L14 WeakPolarHBondContact O-CB 3.26Å; M10-L14 PolarHBondContact O-N 3.15Å; L14-I17 PolarHBondContact O-N 3.26Å; L14-L18 HydrophobicContact CD2-CD1 4.06Å; L14-L18 WeakPolarHBondContact O-CB 3.25Å; L14-L18 PolarHBondContact O-N 3.38Å
15	W	36.1	Very low	37.3	Very low	159 Å²	159	111.6 Å²	111.6	60%	0.602	56%	0.558	S	S	*	*	H	α-helix	trans	-61.4	-43.8	173.8	-164.3	84	0	0	0	111.5	T11 L12 L13 Y19	T11-W15 WeakPolarHBondContact O-CB 3.47Å; T11-W15 PolarHBondContact O-N 3.49Å; L12-W15 WeakPolarHBondContact O-CB 3.14Å; L12-W15 PolarHBondContact O-N 3.18Å; L13-W15 VanDerWaalsContact C-N 3.26Å; L13-W15 PolarHBondContact O-N 2.73Å; W15-Y19 HydrophobicContact CH2-CD2 4.33Å; W15-Y19 HydrophobicContact CH2-CE2 4.48Å; W15-Y19 HydrophobicContact CZ3-CD2 4.38Å; W15-Y19 WeakPolarHBondContact O-CB 3.21Å; W15-Y19 PolarHBondContact O-N 2.86Å
16	L	33.6	Very low	38.2	Very low	74 Å²	74	104 Å²	104	39%	0.387	53%	0.533	S	S	.	.	H	α-helix	trans	-69.3	-37	174.9	-81.9	160	0	0	0	113.5	L12 L13 Y19 H20	L12-L16 HydrophobicContact CD2-CD1 4.17Å; L12-L16 WeakPolarHBondContact O-CB 3.32Å; L12-L16 WeakPolarHBondContact O-CG 3.37Å; L12-L16 PolarHBondContact O-N 2.93Å; L13-L16 PolarHBondContact O-N 3.26Å; L16-Y19 WeakPolarHBondContact O-CB 3.37Å; L16-Y19 PolarHBondContact O-N 3.29Å; L16-H20 PolarHBondContact O-CD2 3.26Å; L16-H20 VanDerWaalsContact O-CD2 3.25Å; L16-H20 PolarHBondContact O-N 2.79Å
17	I	36.3	Very low	38.4	Very low	113 Å²	113	102.6 Å²	102.6	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-70.6	-37.1	178	-67	163.4	0	0	0	110.6	L13 L14 H20 A21	L13-I17 HydrophobicContact CD2-CD1 4.49Å; L13-I17 WeakPolarHBondContact O-CB 3.08Å; L13-I17 WeakPolarHBondContact O-CD1 3.47Å; L13-I17 WeakPolarHBondContact O-CG1 3.16Å; L13-I17 PolarHBondContact O-N 2.77Å; L14-I17 PolarHBondContact O-N 3.26Å; I17-H20 PolarHBondContact O-N 2.95Å; I17-A21 PolarHBondContact O-N 3.29Å; I17-A21 VanDerWaalsContact O-N 3.15Å
18	L	30.9	Very low	39.4	Very low	97 Å²	97	101.2 Å²	101.2	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-74.5	-32.7	170.4	-91.3	143.4	0	0	0	112.8	L14 H20 A21 V22	L14-L18 HydrophobicContact CD2-CD1 4.06Å; L14-L18 WeakPolarHBondContact O-CB 3.25Å; L14-L18 PolarHBondContact O-N 3.38Å; L18-H20 PolarHBondContact O-N 3.33Å; L18-A21 WeakPolarHBondContact O-CA 3.38Å; L18-A21 WeakPolarHBondContact O-CB 3.26Å; L18-A21 PolarHBondContact O-N 3.2Å; L18-V22 PolarHBondContact O-N 3.19Å
19	Y	34.4	Very low	40	Very low	121 Å²	121	93.8 Å²	93.8	48%	0.475	48%	0.479	S	S	.	.	H	α-helix	trans	-60.5	-33.5	171.1	-167.9	-94.9	0	0	0	111.2	W15 L16	W15-Y19 HydrophobicContact CH2-CD2 4.33Å; W15-Y19 HydrophobicContact CH2-CE2 4.48Å; W15-Y19 HydrophobicContact CZ3-CD2 4.38Å; W15-Y19 WeakPolarHBondContact O-CB 3.21Å; W15-Y19 PolarHBondContact O-N 2.86Å; L16-Y19 WeakPolarHBondContact O-CB 3.37Å; L16-Y19 PolarHBondContact O-N 3.29Å
20	H	31.8	Very low	41.1	Very low	104 Å²	104	87.5 Å²	87.5	48%	0.481	45%	0.45	S	S	.	.	H	α-helix	trans	-79.3	-19.2	169.6	-79.9	-63.8	0	0	0	114.1	L16 I17 L18 V22 E23	L16-H20 PolarHBondContact O-CD2 3.26Å; L16-H20 VanDerWaalsContact O-CD2 3.25Å; L16-H20 PolarHBondContact O-N 2.79Å; I17-H20 PolarHBondContact O-N 2.95Å; L18-H20 PolarHBondContact O-N 3.33Å; H20-V22 VanDerWaalsContact C-N 3.25Å; H20-V22 PolarHBondContact O-N 3.37Å; H20-E23 IonicContact CE1-OE1 2.71Å; H20-E23 PolarHBondContact CE1-OE1 3.48Å; H20-E23 IonicContact ND1-OE1 2.68Å; H20-E23 PolarHBondContact ND1-OE1 2.87Å; H20-E23 VanDerWaalsContact O-CB 3.28Å; H20-E23 WeakPolarHBondContact O-CB 3.41Å; H20-E23 WeakPolarHBondContact O-CG 3.26Å; H20-E23 PolarHBondContact O-N 2.9Å; H20-E23 VanDerWaalsContact O-N 3.09Å
21	A	30.8	Very low	42.2	Very low	67 Å²	67	83.9 Å²	83.9	55%	0.554	44%	0.435	S	S	*	.	H	α-helix	trans	-74	-16.8	177.7	0	0	0	0	0	113.2	I17 L18	I17-A21 PolarHBondContact O-N 3.29Å; I17-A21 VanDerWaalsContact O-N 3.15Å; L18-A21 WeakPolarHBondContact O-CA 3.38Å; L18-A21 WeakPolarHBondContact O-CB 3.26Å; L18-A21 PolarHBondContact O-N 3.2Å
22	V	37.1	Very low	43.1	Very low	62 Å²	62	79.9 Å²	79.9	38%	0.376	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	35.4	166.3	-166.2	0	0	0	0	110.6	L18 H20 A24 L89 W91	L18-V22 PolarHBondContact O-N 3.19Å; H20-V22 VanDerWaalsContact C-N 3.25Å; H20-V22 PolarHBondContact O-N 3.37Å; V22-A24 PolarHBondContact O-N 3.22Å; V22-L89 HydrophobicContact CG1-CD1 4.49Å; V22-W91 HydrophobicContact CG2-CH2 3.84Å; V22-W91 HydrophobicContact CG2-CZ3 4.31Å
23	E	37.9	Very low	44.2	Very low	123 Å²	123	79.9 Å²	79.9	58%	0.575	41%	0.411	S	S	*	.			trans	-75.4	0.2	160.9	-85.4	-170.3	169.9	0	0	113.1	H20 F25	H20-E23 IonicContact CE1-OE1 2.71Å; H20-E23 PolarHBondContact CE1-OE1 3.48Å; H20-E23 IonicContact ND1-OE1 2.68Å; H20-E23 PolarHBondContact ND1-OE1 2.87Å; H20-E23 VanDerWaalsContact O-CB 3.28Å; H20-E23 WeakPolarHBondContact O-CB 3.41Å; H20-E23 WeakPolarHBondContact O-CG 3.26Å; H20-E23 PolarHBondContact O-N 2.9Å; H20-E23 VanDerWaalsContact O-N 3.09Å; E23-F25 PolarHBondContact O-N 3.49Å
24	A	39.9	Very low	45	Very low	63 Å²	63	76 Å²	76	52%	0.521	39%	0.392	S	S	.	.	S	Bend	trans	-98.1	96.6	-165.7	0	0	0	0	0	111.3	V22	V22-A24 PolarHBondContact O-N 3.22Å
25	F	47.9	Very low	45.4	Very low	141 Å²	141	79.4 Å²	79.4	62%	0.618	40%	0.402	S	S	*	.			trans	85.8	79.1	161.4	-49.5	-78.5	0	0	0	116.9	E23 R27 V28 L105	E23-F25 PolarHBondContact O-N 3.49Å; F25-R27 PolarHBondContact O-N 3.4Å; F25-V28 HydrophobicContact CB-CG2 3.85Å; F25-V28 HydrophobicContact CD1-CG2 4.39Å; F25-V28 HydrophobicContact CG-CG2 4.24Å; F25-L105 WeakPolarHBondContact O-CD1 3.5Å
26	E	51.1	Low	45.8	Very low	74 Å²	74	74.8 Å²	74.8	35%	0.346	40%	0.398	S	S	.	.	S	Bend	trans	-64.8	-22.9	159	-73.6	166	-149.8	0	0	111.9	I106 T163 K205	E26-I106 PolarHBondContact O-N 3.47Å; E26-T163 HydrophobicContact CG-CG2 4.48Å; E26-T163 WeakPolarHBondContact OE2-CB 3.35Å; E26-T163 WeakPolarHBondContact OE2-CG2 3.46Å; E26-T163 PolarHBondContact OE2-OG1 2.77Å; E26-K205 IonicContact OE1-NZ 3.99Å; E26-K205 PolarHBondContact OE1-NZ 3.4Å; E26-K205 IonicContact OE2-NZ 2.81Å
27	R	50.6	Low	45.9	Very low	31 Å²	31	73.3 Å²	73.3	12%	0.117	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	133.5	177.6	-169.3	150.3	176.7	-133.1	8.9	112.2	F25 I106 E108 M207	F25-R27 PolarHBondContact O-N 3.4Å; R27-I106 CarbonylContact C-O 3.5Å; R27-I106 WeakPolarHBondContact CA-O 3.43Å; R27-I106 HydrophobicContact CB-CB 3.94Å; R27-I106 VanDerWaalsContact CD-CB 3.47Å; R27-I106 HydrophobicContact CG-CB 3.62Å; R27-I106 HydrophobicContact CG-CG2 3.85Å; R27-I106 WeakPolarHBondContact CG-O 3.42Å; R27-I106 VanDerWaalsContact NE-CG2 3.32Å; R27-E108 IonicContact CZ-OE1 2.99Å; R27-E108 IonicContact CZ-OE2 3.37Å; R27-E108 IonicContact NE-OE2 3.27Å; R27-E108 IonicContact NH1-OE2 2.65Å; R27-E108 PolarHBondContact NH1-OE2 3.45Å; R27-E108 IonicContact NH2-OE1 3.77Å; R27-E108 PolarHBondContact NH2-OE1 3.03Å; R27-E108 IonicContact NH2-OE2 3.68Å; R27-E108 PolarHBondContact NH2-OE2 2.89Å; R27-M207 HydrophobicContact CB-CE 3.63Å; R27-M207 HydrophobicContact CB-CG 4.1Å; R27-M207 HydrophobicContact CB-SD 4.34Å; R27-M207 WeakPolarHBondContact CD-SD 3.46Å; R27-M207 HydrophobicContact CG-CE 3.22Å; R27-M207 HydrophobicContact CG-CG 4.49Å; R27-M207 HydrophobicContact CG-SD 4.09Å; R27-M207 PolarHBondContact NH1-SD 3.45Å
28	V	56	Low	46.1	Very low	21 Å²	21	72.3 Å²	72.3	13%	0.127	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.2	178.4	177	0	0	0	0	109.1	F25 I30 L105 I106 V107 E108	F25-V28 HydrophobicContact CB-CG2 3.85Å; F25-V28 HydrophobicContact CD1-CG2 4.39Å; F25-V28 HydrophobicContact CG-CG2 4.24Å; V28-I30 HydrophobicContact CG1-CD1 4.06Å; V28-I30 HydrophobicContact CG1-CG1 3.65Å; V28-L105 HydrophobicContact CB-CD1 4.46Å; V28-L105 HydrophobicContact CG2-CD1 3.81Å; V28-I106 PolarHBondContact N-O 3.18Å; V28-V107 CarbonylContact O-C 3.59Å; V28-V107 WeakPolarHBondContact O-CA 3.37Å; V28-E108 PolarHBondContact O-N 3.46Å
29	V	54.8	Low	46.5	Very low	69 Å²	69	69.5 Å²	69.5	42%	0.418	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.3	176.3	-176.4	0	0	0	0	108.6	E108 V110	V29-E108 CarbonylContact C-O 3.39Å; V29-E108 VanDerWaalsContact CA-O 3.3Å; V29-E108 WeakPolarHBondContact CA-O 3.29Å; V29-E108 HydrophobicContact CG2-CB 4.32Å; V29-V110 HydrophobicContact CG1-CG2 3.26Å
30	I	60.8	Low	47	Very low	12 Å²	12	65.5 Å²	65.5	6%	0.062	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.1	-172.1	-47.6	174.8	0	0	0	110.4	V28 S34 F40 L74 V107 E108 I109 V110	V28-I30 HydrophobicContact CG1-CD1 4.06Å; V28-I30 HydrophobicContact CG1-CG1 3.65Å; I30-S34 WeakPolarHBondContact CG2-OG 3.27Å; I30-F40 HydrophobicContact CD1-CB 4.31Å; I30-F40 HydrophobicContact CD1-CD1 3.55Å; I30-F40 HydrophobicContact CD1-CE1 4.14Å; I30-F40 HydrophobicContact CD1-CG 4.13Å; I30-F40 HydrophobicContact CG2-CD1 4.33Å; I30-F40 HydrophobicContact CG2-CE1 4.23Å; I30-L74 HydrophobicContact CB-CD1 4.11Å; I30-L74 HydrophobicContact CD1-CD1 4.33Å; I30-L74 HydrophobicContact CG2-CD1 3.36Å; I30-V107 HydrophobicContact CD1-CG1 3.38Å; I30-V107 HydrophobicContact CG1-CG1 3.98Å; I30-E108 PolarHBondContact N-O 2.77Å; I30-I109 WeakPolarHBondContact O-CA 3.28Å; I30-V110 PolarHBondContact O-N 3.38Å
31	P	58.6	Low	47.7	Very low	40 Å²	40	62 Å²	62	26%	0.26	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	135.2	170.5	-8.5	14.8	0	0	0	111.5	D33 S34 S112 L115	P31-D33 VanDerWaalsContact CB-OD1 3.25Å; P31-D33 WeakPolarHBondContact CB-OD1 3.47Å; P31-D33 PolarHBondContact O-N 3.13Å; P31-S34 WeakPolarHBondContact CB-OG 3.18Å; P31-S34 VanDerWaalsContact CD-OG 3.25Å; P31-S34 WeakPolarHBondContact CD-OG 3.32Å; P31-S34 WeakPolarHBondContact CG-OG 3.37Å; P31-S34 VanDerWaalsContact O-CB 3.26Å; P31-S34 WeakPolarHBondContact O-CB 3.25Å; P31-S34 PolarHBondContact O-N 2.49Å; P31-S34 VanDerWaalsContact O-N 3.13Å; P31-S34 PolarHBondContact O-OG 2.61Å; P31-S112 WeakPolarHBondContact CB-OG 3.41Å; P31-L115 HydrophobicContact CB-CD1 3.4Å; P31-L115 VanDerWaalsContact CB-CD1 3.4Å; P31-L115 HydrophobicContact CG-CD1 3.54Å
32	A	62.7	Low	48.2	Very low	5 Å²	5	65.7 Å²	65.7	4%	0.041	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-35.2	175.5	0	0	0	0	0	113.3	S34 S75 I78 I109 V110	A32-S34 PolarHBondContact O-N 3.14Å; A32-S75 PolarHBondContact O-N 2.92Å; A32-S75 PolarHBondContact O-OG 2.8Å; A32-I78 HydrophobicContact CB-CD1 3.26Å; A32-I78 HydrophobicContact CB-CG1 3.63Å; A32-I109 HydrophobicContact CB-CG2 4.26Å; A32-V110 PolarHBondContact N-O 3.33Å
33	D	62.2	Low	48.6	Very low	106 Å²	106	63.5 Å²	63.5	57%	0.567	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	10.7	179.2	65.9	-6.1	0	0	0	113.6	P31 K35 S112	P31-D33 VanDerWaalsContact CB-OD1 3.25Å; P31-D33 WeakPolarHBondContact CB-OD1 3.47Å; P31-D33 PolarHBondContact O-N 3.13Å; D33-K35 PolarHBondContact O-N 3.03Å; D33-K35 VanDerWaalsContact O-N 3.14Å; D33-S112 WeakPolarHBondContact OD1-CB 3.27Å; D33-S112 PolarHBondContact OD1-OG 3.47Å; D33-S112 VanDerWaalsContact OD2-CB 3.26Å; D33-S112 WeakPolarHBondContact OD2-CB 3.44Å; D33-S112 PolarHBondContact OD2-OG 2.86Å
34	S	54.4	Low	48.8	Very low	11 Å²	11	67.2 Å²	67.2	8%	0.077	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-55.2	122.7	175.3	-60.7	0	0	0	0	109.6	I30 P31 A32	I30-S34 WeakPolarHBondContact CG2-OG 3.27Å; P31-S34 WeakPolarHBondContact CB-OG 3.18Å; P31-S34 VanDerWaalsContact CD-OG 3.25Å; P31-S34 WeakPolarHBondContact CD-OG 3.32Å; P31-S34 WeakPolarHBondContact CG-OG 3.37Å; P31-S34 VanDerWaalsContact O-CB 3.26Å; P31-S34 WeakPolarHBondContact O-CB 3.25Å; P31-S34 PolarHBondContact O-N 2.49Å; P31-S34 VanDerWaalsContact O-N 3.13Å; P31-S34 PolarHBondContact O-OG 2.61Å; A32-S34 PolarHBondContact O-N 3.14Å
35	K	46.5	Very low	49	Very low	175 Å²	175	65.5 Å²	65.5	76%	0.761	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-59.1	144.6	178.5	-68.6	-174.4	177.6	-178.2	0	110.4	D33 G37 L38	D33-K35 PolarHBondContact O-N 3.03Å; D33-K35 VanDerWaalsContact O-N 3.14Å; K35-G37 PolarHBondContact O-N 2.79Å; K35-L38 PolarHBondContact O-N 3.4Å
36	A	43.1	Very low	48.5	Very low	61 Å²	61	58.9 Å²	58.9	50%	0.504	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	136.1	165.9	0	0	0	0	0	109.3	G70 S71	A36-G70 CarbonylContact C-O 3.45Å; A36-G70 VanDerWaalsContact CA-O 3.27Å; A36-G70 WeakPolarHBondContact CA-O 3.3Å; A36-S71 WeakPolarHBondContact CB-O 3.4Å
37	G	36.8	Very low	48	Very low	44 Å²	44	55.8 Å²	55.8	45%	0.454	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.3	5.2	-175.9	0	0	0	0	0	116	K35 L69 G70	K35-G37 PolarHBondContact O-N 2.79Å; G37-L69 WeakPolarHBondContact O-CD2 3.13Å; G37-G70 PolarHBondContact N-O 3.23Å
38	L	39.6	Very low	47.7	Very low	92 Å²	92	54.7 Å²	54.7	48%	0.482	30%	0.299	S	S	.	.			trans	-83.1	132.2	172.9	-118.4	116.1	0	0	0	111.5	K35 F40	K35-L38 PolarHBondContact O-N 3.4Å; L38-F40 PolarHBondContact O-N 3.41Å
39	A	39.7	Very low	46.9	Very low	38 Å²	38	56 Å²	56	31%	0.314	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	116.7	175.4	0	0	0	0	0	110.5	L67 V68 L69	A39-L67 HydrophobicContact CB-CB 3.66Å; A39-L67 HydrophobicContact CB-CD1 4.05Å; A39-L67 HydrophobicContact CB-CD2 3.44Å; A39-L67 VanDerWaalsContact CB-CD2 3.44Å; A39-L67 HydrophobicContact CB-CG 3.88Å; A39-V68 WeakPolarHBondContact CA-O 3.46Å; A39-L69 HydrophobicContact CB-CD2 3.87Å
40	F	44.9	Very low	46	Very low	37 Å²	37	56.3 Å²	56.3	16%	0.162	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-27.2	-177.3	-58.5	-53.2	0	0	0	113.1	I30 L38 V68 L74	I30-F40 HydrophobicContact CD1-CB 4.31Å; I30-F40 HydrophobicContact CD1-CD1 3.55Å; I30-F40 HydrophobicContact CD1-CE1 4.14Å; I30-F40 HydrophobicContact CD1-CG 4.13Å; I30-F40 HydrophobicContact CG2-CD1 4.33Å; I30-F40 HydrophobicContact CG2-CE1 4.23Å; L38-F40 PolarHBondContact O-N 3.41Å; F40-V68 PolarHBondContact N-O 2.85Å; F40-V68 VanDerWaalsContact N-O 3.11Å; F40-L74 HydrophobicContact CD1-CD1 4.46Å; F40-L74 HydrophobicContact CE1-CD1 3.52Å; F40-L74 HydrophobicContact CE1-CD2 4.48Å; F40-L74 HydrophobicContact CE1-CG 4.32Å; F40-L74 HydrophobicContact CZ-CD1 3.87Å; F40-L74 HydrophobicContact CZ-CD2 4.02Å; F40-L74 HydrophobicContact CZ-CG 4.19Å
41	F	46.5	Very low	44.8	Very low	31 Å²	31	57.3 Å²	57.3	14%	0.136	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	162.3	171.6	55.1	-85.9	0	0	0	110.5	A43 I48 L87 L105	F41-A43 HydrophobicContact CD2-CB 3.98Å; F41-A43 HydrophobicContact CE2-CB 4.05Å; F41-I48 HydrophobicContact CE1-CD1 3.4Å; F41-I48 VanDerWaalsContact CE1-CD1 3.4Å; F41-I48 HydrophobicContact CE1-CG1 4.28Å; F41-I48 HydrophobicContact CE2-CD1 3.74Å; F41-I48 HydrophobicContact CE2-CG1 3.9Å; F41-I48 HydrophobicContact CZ-CD1 2.94Å; F41-I48 HydrophobicContact CZ-CG1 3.36Å; F41-L87 HydrophobicContact CE2-CD2 4.07Å; F41-L87 HydrophobicContact CZ-CD2 3.56Å; F41-L105 HydrophobicContact CD1-CD2 3.76Å; F41-L105 HydrophobicContact CE1-CD2 3.49Å; F41-L105 VanDerWaalsContact CE1-CD2 3.49Å; F41-L105 HydrophobicContact CG-CD2 4.42Å; F41-L105 HydrophobicContact CZ-CD2 3.9Å
42	K	42.2	Very low	44	Very low	143 Å²	143	56.4 Å²	56.4	62%	0.622	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	119	172.3	-176.6	177.6	-175.5	173.5	0	107.7	L67	K42-L67 HydrophobicContact CB-CD2 4.12Å; K42-L67 HydrophobicContact CG-CD2 4.44Å
43	A	43.9	Very low	42.7	Very low	17 Å²	17	57.9 Å²	57.9	14%	0.14	31%	0.314	C	S	.	.			trans	-121	135.9	177.7	0	0	0	0	0	110.6	F41 A46	F41-A43 HydrophobicContact CD2-CB 3.98Å; F41-A43 HydrophobicContact CE2-CB 4.05Å; A43-A46 HydrophobicContact CB-CB 3.36Å
44	R	43.6	Very low	41.3	Very low	201 Å²	201	56.8 Å²	56.8	76%	0.758	31%	0.308	S	S	*	.	S	Bend	trans	-92.2	107.8	173.9	-87.9	179.6	172.8	-179.9	-1.2	108.5	N65	R44-N65 WeakPolarHBondContact CG-OD1 3.43Å; R44-N65 PolarHBondContact NE-OD1 3.11Å
45	G	43	Very low	40.2	Very low	26 Å²	26	66.9 Å²	66.9	27%	0.268	34%	0.344	S	S	.	.	S	Bend	trans	76.3	18.6	176	0	0	0	0	0	115.4	H90	G45-H90 PolarHBondContact O-N 3.19Å; G45-H90 VanDerWaalsContact O-O 3.04Å
46	A	38.5	Very low	39.4	Very low	2 Å²	2	63.9 Å²	63.9	2%	0.017	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141.9	179.6	0	0	0	0	0	111.8	A43 P62 L89	A43-A46 HydrophobicContact CB-CB 3.36Å; A46-P62 WeakPolarHBondContact O-CD 3.38Å; A46-P62 VanDerWaalsContact O-CG 3.3Å; A46-P62 WeakPolarHBondContact O-CG 3.41Å; A46-L89 HydrophobicContact CB-CD2 3.15Å
47	T	39.7	Very low	38.5	Very low	10 Å²	10	68.9 Å²	68.9	6%	0.061	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124	170.9	-62	0	0	0	0	110.4	A49 L61 I88	T47-A49 PolarHBondContact O-N 2.77Å; T47-L61 HydrophobicContact CG2-CB 3.8Å; T47-L61 HydrophobicContact CG2-CD2 3.35Å; T47-L61 HydrophobicContact CG2-CG 3.24Å; T47-L61 VanDerWaalsContact OG1-CD2 3.3Å; T47-L61 WeakPolarHBondContact OG1-CD2 3.47Å; T47-I88 WeakPolarHBondContact CA-O 3.32Å; T47-I88 WeakPolarHBondContact CB-O 3.35Å; T47-I88 PolarHBondContact N-O 2.99Å; T47-I88 CarbonylContact O-C 3.54Å; T47-I88 PolarHBondContact O-N 3.31Å; T47-I88 VanDerWaalsContact O-O 3.06Å
48	I	45.3	Very low	38	Very low	8 Å²	8	73.8 Å²	73.8	4%	0.041	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	113	169.9	-42.8	-177.8	0	0	0	107.7	F41 V68 L87	F41-I48 HydrophobicContact CE1-CD1 3.4Å; F41-I48 VanDerWaalsContact CE1-CD1 3.4Å; F41-I48 HydrophobicContact CE1-CG1 4.28Å; F41-I48 HydrophobicContact CE2-CD1 3.74Å; F41-I48 HydrophobicContact CE2-CG1 3.9Å; F41-I48 HydrophobicContact CZ-CD1 2.94Å; F41-I48 HydrophobicContact CZ-CG1 3.36Å; I48-V68 HydrophobicContact CD1-CB 3.74Å; I48-V68 HydrophobicContact CD1-CG1 3.76Å; I48-V68 HydrophobicContact CD1-CG2 3.43Å; I48-V68 VanDerWaalsContact CD1-CG2 3.43Å; I48-V68 HydrophobicContact CG1-CG2 4.16Å; I48-L87 HydrophobicContact CB-CD2 4.2Å; I48-L87 HydrophobicContact CG1-CD2 3.86Å; I48-L87 HydrophobicContact CG2-CD2 4.02Å
49	A	37.5	Very low	37.7	Very low	49 Å²	49	73.2 Å²	73.2	41%	0.405	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-20.8	-173.9	0	0	0	0	0	113.6	T47 D86 I88	T47-A49 PolarHBondContact O-N 2.77Å; A49-D86 PolarHBondContact N-O 3.41Å; A49-I88 HydrophobicContact CB-CB 4.36Å; A49-I88 HydrophobicContact CB-CD1 3.38Å; A49-I88 HydrophobicContact CB-CG1 3.62Å
50	R	35.9	Very low	37.3	Very low	75 Å²	75	79 Å²	79	28%	0.283	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	125.9	-174.7	-141.4	164.6	82.5	176.2	13.3	115.2	L52 L85 D86 A284	R50-L52 HydrophobicContact CG-CD2 4.31Å; R50-L85 WeakPolarHBondContact O-CA 3.31Å; R50-D86 PolarHBondContact N-O 3.37Å; R50-D86 PolarHBondContact O-N 3.42Å; R50-D86 VanDerWaalsContact O-N 3.15Å; R50-A284 PolarHBondContact NH2-O 2.84Å
51	V	36.8	Very low	36.7	Very low	33 Å²	33	82 Å²	82	20%	0.2	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.5	162.5	-176.8	0	0	0	0	108	Y59 L83 L85	V51-Y59 HydrophobicContact CG2-CD2 4.08Å; V51-Y59 HydrophobicContact CG2-CE2 4.42Å; V51-L83 HydrophobicContact CG1-CD2 4.5Å; V51-L85 HydrophobicContact CB-CD2 3.62Å; V51-L85 HydrophobicContact CG1-CD2 3.65Å; V51-L85 HydrophobicContact CG2-CD2 3.28Å
52	L	40.8	Very low	36.1	Very low	21 Å²	21	80.7 Å²	80.7	11%	0.11	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.2	170.9	-65.4	172.8	0	0	0	108.1	R50 A84 A284 P285	R50-L52 HydrophobicContact CG-CD2 4.31Å; L52-A84 PolarHBondContact N-O 3.4Å; L52-A284 WeakPolarHBondContact CD2-O 3.11Å; L52-P285 HydrophobicContact CB-CG 3.99Å; L52-P285 HydrophobicContact CD1-CG 4.27Å; L52-P285 VanDerWaalsContact CD2-CD 3.47Å; L52-P285 HydrophobicContact CG-CG 4.47Å
53	P	36.1	Very low	35.7	Very low	36 Å²	36	81.4 Å²	81.4	23%	0.234	38%	0.376	C	S	.	.	S	Bend	cis	-105.2	162.2	12.8	35.3	-24.5	0	0	0	115.9	R55 L80	P53-R55 PolarHBondContact O-N 2.75Å; P53-L80 HydrophobicContact CG-CD1 4.03Å; P53-L80 HydrophobicContact CG-CD2 3.85Å; P53-L80 HydrophobicContact CG-CG 4.41Å
54	L	31.7	Very low	35.4	Very low	82 Å²	82	82.1 Å²	82.1	43%	0.429	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	4.8	-166.3	-71.3	151.5	0	0	0	120.3	F57 S283	L54-F57 HydrophobicContact CB-CZ 4.47Å; L54-F57 HydrophobicContact CD2-CE1 4.28Å; L54-F57 HydrophobicContact CD2-CZ 3.74Å; L54-F57 WeakPolarHBondContact O-CE2 3.41Å; L54-S283 WeakPolarHBondContact CD1-O 3.35Å
55	R	31.3	Very low	35.1	Very low	223 Å²	223	77 Å²	77	84%	0.842	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-3.2	-174.6	-74.8	-166.4	-179.5	-156.8	1.3	115.6	P53	P53-R55 PolarHBondContact O-N 2.75Å
56	Y	31.2	Very low	34.8	Very low	112 Å²	112	81.4 Å²	81.4	44%	0.439	39%	0.386	S	S	.	.	S	Bend	trans	-136.9	102.7	177.1	-66.3	-85.6	0	0	0	109.8	P76 L77 L80	Y56-P76 WeakPolarHBondContact OH-CB 3.27Å; Y56-L77 HydrophobicContact CD2-CD2 3.33Å; Y56-L77 HydrophobicContact CE2-CD2 3.66Å; Y56-L77 HydrophobicContact CG-CD2 3.84Å; Y56-L80 HydrophobicContact CD2-CD1 4.48Å; Y56-L80 HydrophobicContact CE2-CD1 4.42Å
57	F	24.2	Very low	34.7	Very low	166 Å²	166	86 Å²	86	73%	0.728	41%	0.41	S	S	*	.			trans	-105.1	124.2	174.9	-64	-78.7	0	0	0	111	L54	L54-F57 HydrophobicContact CB-CZ 4.47Å; L54-F57 HydrophobicContact CD2-CE1 4.28Å; L54-F57 HydrophobicContact CD2-CZ 3.74Å; L54-F57 WeakPolarHBondContact O-CE2 3.41Å
58	K	26.1	Very low	34.8	Very low	148 Å²	148	86.1 Å²	86.1	64%	0.643	41%	0.411	S	S	*	.				172	108.5	126.8	-106.2	-174.9	176.7	178.3	0	107.8
59	Y	33	Very low	34.5	Very low	79 Å²	79	89.9 Å²	89.9	31%	0.31	43%	0.43	S	S	.	.			trans	-146.7	132.3	154.4	-61.7	-69.3	0	0	0	109.7	V51 V68 L69	V51-Y59 HydrophobicContact CG2-CD2 4.08Å; V51-Y59 HydrophobicContact CG2-CE2 4.42Å; Y59-V68 HydrophobicContact CD1-CG1 3.67Å; Y59-V68 HydrophobicContact CE1-CG1 4.44Å; Y59-V68 HydrophobicContact CG-CG1 4.16Å; Y59-L69 WeakPolarHBondContact CE1-O 3.11Å
60	F	31.2	Very low	34.9	Very low	161 Å²	161	87.7 Å²	87.7	71%	0.706	41%	0.412	S	S	*	.			trans	-107	159	-178.9	-78	-95.8	0	0	0	110
61	L	31.9	Very low	35.3	Very low	98 Å²	98	87.8 Å²	87.8	51%	0.513	42%	0.424	S	S	.	.			trans	-53.4	129.5	-177	-52.2	96.5	0	0	0	112.8	T47 H63	T47-L61 HydrophobicContact CG2-CB 3.8Å; T47-L61 HydrophobicContact CG2-CD2 3.35Å; T47-L61 HydrophobicContact CG2-CG 3.24Å; T47-L61 VanDerWaalsContact OG1-CD2 3.3Å; T47-L61 WeakPolarHBondContact OG1-CD2 3.47Å; L61-H63 PolarHBondContact O-N 3.5Å
62	P	34.3	Very low	36	Very low	5 Å²	5	92 Å²	92	3%	0.032	44%	0.442	C	S	.	.			trans	-83.9	104.6	152.7	29.2	-24.7	0	0	0	108.6	A46 G64 E66 V68	A46-P62 WeakPolarHBondContact O-CD 3.38Å; A46-P62 VanDerWaalsContact O-CG 3.3Å; A46-P62 WeakPolarHBondContact O-CG 3.41Å; P62-G64 PolarHBondContact O-N 2.85Å; P62-E66 HydrophobicContact CB-CB 3.65Å; P62-V68 HydrophobicContact CB-CG2 4.47Å; P62-V68 HydrophobicContact CG-CG2 3.79Å
63	H	34.2	Very low	36.9	Very low	158 Å²	158	94.4 Å²	94.4	73%	0.731	46%	0.459	S	S	*	.			trans	-87.8	87.9	166.2	-145.8	40.9	0	0	0	108.2	L61	L61-H63 PolarHBondContact O-N 3.5Å
64	G	36.9	Very low	38.2	Very low	32 Å²	32	93.1 Å²	93.1	33%	0.33	45%	0.45	S	S	.	.	S	Bend	trans	133.3	-161.8	-177.3	0	0	0	0	0	113.2	P62 E66	P62-G64 PolarHBondContact O-N 2.85Å; G64-E66 PolarHBondContact O-N 2.82Å
65	N	38.2	Very low	39.7	Very low	94 Å²	94	92 Å²	92	50%	0.503	45%	0.449	S	S	.	.	S	Bend	trans	-78.5	40.7	174.9	-77.2	-45.8	0	0	0	112.1	R44	R44-N65 WeakPolarHBondContact CG-OD1 3.43Å; R44-N65 PolarHBondContact NE-OD1 3.11Å
66	E	36.1	Very low	41.4	Very low	117 Å²	117	84.2 Å²	84.2	55%	0.547	43%	0.427	S	S	.	.			trans	-91	146.2	-175	-68.3	-173.3	159.9	0	0	112.3	P62 G64	P62-E66 HydrophobicContact CB-CB 3.65Å; G64-E66 PolarHBondContact O-N 2.82Å
67	L	36.7	Very low	42.9	Very low	100 Å²	100	80 Å²	80	52%	0.524	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.8	-177.4	-68.5	165.9	0	0	0	109.5	A39 K42 L69	A39-L67 HydrophobicContact CB-CB 3.66Å; A39-L67 HydrophobicContact CB-CD1 4.05Å; A39-L67 HydrophobicContact CB-CD2 3.44Å; A39-L67 VanDerWaalsContact CB-CD2 3.44Å; A39-L67 HydrophobicContact CB-CG 3.88Å; K42-L67 HydrophobicContact CB-CD2 4.12Å; K42-L67 HydrophobicContact CG-CD2 4.44Å; L67-L69 HydrophobicContact CB-CD2 4.2Å; L67-L69 PolarHBondContact O-N 2.89Å
68	V	40.9	Very low	45	Very low	12 Å²	12	74.8 Å²	74.8	7%	0.073	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	115.2	173.4	-176.8	0	0	0	0	109.8	A39 F40 I48 Y59 P62	A39-V68 WeakPolarHBondContact CA-O 3.46Å; F40-V68 PolarHBondContact N-O 2.85Å; F40-V68 VanDerWaalsContact N-O 3.11Å; I48-V68 HydrophobicContact CD1-CB 3.74Å; I48-V68 HydrophobicContact CD1-CG1 3.76Å; I48-V68 HydrophobicContact CD1-CG2 3.43Å; I48-V68 VanDerWaalsContact CD1-CG2 3.43Å; I48-V68 HydrophobicContact CG1-CG2 4.16Å; Y59-V68 HydrophobicContact CD1-CG1 3.67Å; Y59-V68 HydrophobicContact CE1-CG1 4.44Å; Y59-V68 HydrophobicContact CG-CG1 4.16Å; P62-V68 HydrophobicContact CB-CG2 4.47Å; P62-V68 HydrophobicContact CG-CG2 3.79Å
69	L	40	Very low	46.8	Very low	87 Å²	87	76.4 Å²	76.4	46%	0.455	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.6	-177.4	-57.3	-173.1	0	0	0	110.7	G37 A39 Y59 L67	G37-L69 WeakPolarHBondContact O-CD2 3.13Å; A39-L69 HydrophobicContact CB-CD2 3.87Å; Y59-L69 WeakPolarHBondContact CE1-O 3.11Å; L67-L69 HydrophobicContact CB-CD2 4.2Å; L67-L69 PolarHBondContact O-N 2.89Å
70	G	44.9	Very low	48	Very low	2 Å²	2	75.7 Å²	75.7	2%	0.021	40%	0.402	C	S	.	.			trans	-72.1	127.8	170.7	0	0	0	0	0	111.5	A36 G37	A36-G70 CarbonylContact C-O 3.45Å; A36-G70 VanDerWaalsContact CA-O 3.27Å; A36-G70 WeakPolarHBondContact CA-O 3.3Å; G37-G70 PolarHBondContact N-O 3.23Å
71	S	45.4	Very low	49.3	Very low	77 Å²	77	69.6 Å²	69.6	54%	0.538	38%	0.38	S	S	.	.	S	Bend	trans	-85.1	-16.8	177.4	59.8	0	0	0	0	113.4	A36	A36-S71 WeakPolarHBondContact CB-O 3.4Å
72	E	51.5	Low	50.6	Low	121 Å²	121	68.3 Å²	68.3	57%	0.565	38%	0.377	S	S	*	.	S	Bend	trans	-120.6	150.5	-174.6	-66.5	-63.1	157.8	0	0	111	L74	E72-L74 PolarHBondContact O-N 3.17Å
73	P	58.7	Low	51.8	Low	72 Å²	72	68.5 Å²	68.5	47%	0.468	38%	0.378	S	S	.	.			trans	-60.3	136.7	173.5	24.5	-31.5	0	0	0	110.7	S75 P76	P73-S75 VanDerWaalsContact C-N 3.33Å; P73-S75 PolarHBondContact O-N 3.35Å; P73-P76 WeakPolarHBondContact O-CD 3.43Å
74	L	63.7	Low	52.8	Low	10 Å²	10	62 Å²	62	5%	0.052	35%	0.352	C	S	.	.	S	Bend	trans	-80.4	-11.1	-176.3	-68.5	178.7	0	0	0	113.9	I30 F40 E72 P76 L77 I109	I30-L74 HydrophobicContact CB-CD1 4.11Å; I30-L74 HydrophobicContact CD1-CD1 4.33Å; I30-L74 HydrophobicContact CG2-CD1 3.36Å; F40-L74 HydrophobicContact CD1-CD1 4.46Å; F40-L74 HydrophobicContact CE1-CD1 3.52Å; F40-L74 HydrophobicContact CE1-CD2 4.48Å; F40-L74 HydrophobicContact CE1-CG 4.32Å; F40-L74 HydrophobicContact CZ-CD1 3.87Å; F40-L74 HydrophobicContact CZ-CD2 4.02Å; F40-L74 HydrophobicContact CZ-CG 4.19Å; E72-L74 PolarHBondContact O-N 3.17Å; L74-P76 VanDerWaalsContact C-N 3.32Å; L74-L77 HydrophobicContact CD2-CD1 3.74Å; L74-L77 WeakPolarHBondContact O-CB 3.36Å; L74-L77 PolarHBondContact O-N 3.27Å; L74-I109 HydrophobicContact CB-CD1 4.33Å; L74-I109 HydrophobicContact CB-CG2 4.21Å; L74-I109 HydrophobicContact CD2-CD1 4.24Å
75	S	64.4	Low	53.9	Low	58 Å²	58	61.2 Å²	61.2	41%	0.406	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-47.3	-42.3	179.6	-49.6	0	0	0	0	114.9	A32 P73 L77 I78	A32-S75 PolarHBondContact O-N 2.92Å; A32-S75 PolarHBondContact O-OG 2.8Å; P73-S75 VanDerWaalsContact C-N 3.33Å; P73-S75 PolarHBondContact O-N 3.35Å; S75-L77 PolarHBondContact O-N 3.35Å; S75-I78 WeakPolarHBondContact O-CD1 3.43Å; S75-I78 VanDerWaalsContact O-CG1 3.25Å; S75-I78 WeakPolarHBondContact O-CG1 3.37Å; S75-I78 PolarHBondContact O-N 2.88Å
76	P	66	Low	54.6	Low	60 Å²	60	57 Å²	57	39%	0.39	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-66.7	-24.2	178.3	-19.7	34.2	0	0	0	113.5	Y56 P73 L74 I78	Y56-P76 WeakPolarHBondContact OH-CB 3.27Å; P73-P76 WeakPolarHBondContact O-CD 3.43Å; L74-P76 VanDerWaalsContact C-N 3.32Å; P76-I78 VanDerWaalsContact C-N 3.34Å
77	L	63.4	Low	55.6	Low	23 Å²	23	52.3 Å²	52.3	12%	0.12	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-83.9	-6.9	-177	-60.9	177.4	0	0	0	113.2	Y56 L74 S75 Q79 L80 S81 L83 I109	Y56-L77 HydrophobicContact CD2-CD2 3.33Å; Y56-L77 HydrophobicContact CE2-CD2 3.66Å; Y56-L77 HydrophobicContact CG-CD2 3.84Å; L74-L77 HydrophobicContact CD2-CD1 3.74Å; L74-L77 WeakPolarHBondContact O-CB 3.36Å; L74-L77 PolarHBondContact O-N 3.27Å; S75-L77 PolarHBondContact O-N 3.35Å; L77-Q79 PolarHBondContact O-N 2.97Å; L77-L80 HydrophobicContact CD2-CD1 3.93Å; L77-L80 PolarHBondContact O-N 2.81Å; L77-S81 PolarHBondContact O-N 3.06Å; L77-L83 HydrophobicContact CB-CD1 4.3Å; L77-L83 HydrophobicContact CD1-CD1 4.17Å; L77-I109 HydrophobicContact CB-CD1 3.36Å; L77-I109 HydrophobicContact CD1-CD1 4Å; L77-I109 HydrophobicContact CG-CD1 4.33Å
78	I	66.7	Low	56.3	Low	56 Å²	56	49.8 Å²	49.8	29%	0.287	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-53.1	-39.6	174.6	-63.6	168.7	0	0	0	110.8	A32 S75 P76 L80 S81 I109 P111	A32-I78 HydrophobicContact CB-CD1 3.26Å; A32-I78 HydrophobicContact CB-CG1 3.63Å; S75-I78 WeakPolarHBondContact O-CD1 3.43Å; S75-I78 VanDerWaalsContact O-CG1 3.25Å; S75-I78 WeakPolarHBondContact O-CG1 3.37Å; S75-I78 PolarHBondContact O-N 2.88Å; P76-I78 VanDerWaalsContact C-N 3.34Å; I78-L80 PolarHBondContact O-N 3.14Å; I78-S81 WeakPolarHBondContact O-CB 3.25Å; I78-S81 PolarHBondContact O-N 3.47Å; I78-I109 HydrophobicContact CG1-CG2 3.78Å; I78-P111 HydrophobicContact CD1-CG 4.24Å
79	Q	65.3	Low	56.8	Low	182 Å²	182	49.7 Å²	49.7	85%	0.85	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-68.1	-18.7	-179.1	-62.3	-176.5	1	0	0	113.4	L77	L77-Q79 PolarHBondContact O-N 2.97Å
80	L	57	Low	57.3	Low	64 Å²	64	48.8 Å²	48.8	34%	0.335	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-102.5	3.4	-179.6	-59.5	173.8	0	0	0	111.9	P53 Y56 L77 I78 P82 L83	P53-L80 HydrophobicContact CG-CD1 4.03Å; P53-L80 HydrophobicContact CG-CD2 3.85Å; P53-L80 HydrophobicContact CG-CG 4.41Å; Y56-L80 HydrophobicContact CD2-CD1 4.48Å; Y56-L80 HydrophobicContact CE2-CD1 4.42Å; L77-L80 HydrophobicContact CD2-CD1 3.93Å; L77-L80 PolarHBondContact O-N 2.81Å; I78-L80 PolarHBondContact O-N 3.14Å; L80-P82 CarbonylContact O-C 3.57Å; L80-P82 VanDerWaalsContact O-C 3.29Å; L80-L83 HydrophobicContact CB-CD2 3.67Å; L80-L83 WeakPolarHBondContact O-CD2 3.24Å
81	S	60.1	Low	57.5	Low	34 Å²	34	52.3 Å²	52.3	24%	0.238	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-73.8	136.6	177.8	-172.5	0	0	0	0	111	L77 I78 E108 I109	L77-S81 PolarHBondContact O-N 3.06Å; I78-S81 WeakPolarHBondContact O-CB 3.25Å; I78-S81 PolarHBondContact O-N 3.47Å; S81-E108 WeakPolarHBondContact OG-CA 3.39Å; S81-I109 PolarHBondContact OG-N 3.04Å; S81-I109 PolarHBondContact OG-O 3.48Å
82	P	58.4	Low	57.4	Low	71 Å²	71	58.7 Å²	58.7	46%	0.461	30%	0.3	S	S	.	.	S	Bend	cis	-77.6	137	-2.5	29.8	-32.1	0	0	0	113.1	L80 I106 V107	L80-P82 CarbonylContact O-C 3.57Å; L80-P82 VanDerWaalsContact O-C 3.29Å; P82-I106 HydrophobicContact CB-CG2 3.74Å; P82-V107 CarbonylContact C-O 3.56Å; P82-V107 WeakPolarHBondContact CA-O 3.4Å
83	L	59	Low	57.3	Low	8 Å²	8	57 Å²	57	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	135.5	171.9	-63.9	169	0	0	0	109.9	V51 L77 L80 I106 V107 I109	V51-L83 HydrophobicContact CG1-CD2 4.5Å; L77-L83 HydrophobicContact CB-CD1 4.3Å; L77-L83 HydrophobicContact CD1-CD1 4.17Å; L80-L83 HydrophobicContact CB-CD2 3.67Å; L80-L83 WeakPolarHBondContact O-CD2 3.24Å; L83-I106 CarbonylContact O-C 3.54Å; L83-I106 WeakPolarHBondContact O-CA 3.38Å; L83-V107 HydrophobicContact CB-CB 4.25Å; L83-V107 PolarHBondContact N-O 3.25Å; L83-V107 PolarHBondContact O-N 3.43Å; L83-I109 HydrophobicContact CD1-CD1 3.52Å; L83-I109 HydrophobicContact CD1-CG1 4.36Å
84	A	56.6	Low	56.5	Low	22 Å²	22	62.3 Å²	62.3	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.8	169.3	0	0	0	0	0	109.6	L52 R104	L52-A84 PolarHBondContact N-O 3.4Å; A84-R104 HydrophobicContact CB-CG 4.3Å
85	L	59.7	Low	55.8	Low	16 Å²	16	65 Å²	65	8%	0.084	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119	173.8	-57	-176	0	0	0	108.8	R50 V51 L87 R104 L105 V107	R50-L85 WeakPolarHBondContact O-CA 3.31Å; V51-L85 HydrophobicContact CB-CD2 3.62Å; V51-L85 HydrophobicContact CG1-CD2 3.65Å; V51-L85 HydrophobicContact CG2-CD2 3.28Å; L85-L87 PolarHBondContact O-N 3.11Å; L85-R104 CarbonylContact O-C 3.46Å; L85-R104 WeakPolarHBondContact O-CA 3.45Å; L85-L105 WeakPolarHBondContact CA-O 3.4Å; L85-L105 HydrophobicContact CB-CB 4.19Å; L85-L105 WeakPolarHBondContact CB-O 3.43Å; L85-L105 HydrophobicContact CD1-CD2 3.98Å; L85-L105 HydrophobicContact CD1-CG 4.4Å; L85-L105 PolarHBondContact N-O 2.94Å; L85-L105 PolarHBondContact O-N 3.33Å; L85-V107 HydrophobicContact CD1-CG2 3.46Å; L85-V107 VanDerWaalsContact CD1-CG2 3.46Å; L85-V107 HydrophobicContact CG-CG2 3.98Å
86	D	52.4	Low	55	Low	6 Å²	6	64.7 Å²	64.7	3%	0.032	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	112.2	169	-74	-12.7	0	0	0	107.5	A49 R50 V102 R104 R295	A49-D86 PolarHBondContact N-O 3.41Å; R50-D86 PolarHBondContact N-O 3.37Å; R50-D86 PolarHBondContact O-N 3.42Å; R50-D86 VanDerWaalsContact O-N 3.15Å; D86-V102 HydrophobicContact CB-CG1 4.01Å; D86-R104 IonicContact OD1-CZ 3.42Å; D86-R104 IonicContact OD1-NE 3.2Å; D86-R104 PolarHBondContact OD1-NE 3.41Å; D86-R104 IonicContact OD1-NH2 3.46Å; D86-R104 PolarHBondContact OD1-NH2 3.38Å; D86-R295 IonicContact OD2-NH1 2.75Å; D86-R295 PolarHBondContact OD2-NH1 2.82Å
87	L	56.1	Low	53.9	Low	17 Å²	17	65.9 Å²	65.9	9%	0.089	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	124.5	173.7	-56.6	174.6	0	0	0	108.9	F41 I48 L85 L89 V102 E103 L105	F41-L87 HydrophobicContact CE2-CD2 4.07Å; F41-L87 HydrophobicContact CZ-CD2 3.56Å; I48-L87 HydrophobicContact CB-CD2 4.2Å; I48-L87 HydrophobicContact CG1-CD2 3.86Å; I48-L87 HydrophobicContact CG2-CD2 4.02Å; L85-L87 PolarHBondContact O-N 3.11Å; L87-L89 HydrophobicContact CB-CD2 4.32Å; L87-V102 CarbonylContact O-C 3.53Å; L87-V102 WeakPolarHBondContact O-CA 3.38Å; L87-E103 WeakPolarHBondContact CA-O 3.43Å; L87-E103 HydrophobicContact CB-CB 4.48Å; L87-E103 VanDerWaalsContact CB-O 3.29Å; L87-E103 WeakPolarHBondContact CB-O 3.42Å; L87-E103 PolarHBondContact N-O 2.79Å; L87-E103 PolarHBondContact O-N 2.98Å; L87-L105 HydrophobicContact CD1-CB 3.58Å; L87-L105 HydrophobicContact CD1-CD2 4.33Å; L87-L105 HydrophobicContact CD2-CB 4.46Å; L87-L105 HydrophobicContact CG-CB 3.93Å
88	I	52.5	Low	53.3	Low	48 Å²	48	68.3 Å²	68.3	25%	0.246	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	105.4	170	-56.7	-179.3	0	0	0	107.3	T47 A49 H90 D100 V102	T47-I88 WeakPolarHBondContact CA-O 3.32Å; T47-I88 WeakPolarHBondContact CB-O 3.35Å; T47-I88 PolarHBondContact N-O 2.99Å; T47-I88 CarbonylContact O-C 3.54Å; T47-I88 PolarHBondContact O-N 3.31Å; T47-I88 VanDerWaalsContact O-O 3.06Å; A49-I88 HydrophobicContact CB-CB 4.36Å; A49-I88 HydrophobicContact CB-CD1 3.38Å; A49-I88 HydrophobicContact CB-CG1 3.62Å; I88-H90 PolarHBondContact O-N 2.8Å; I88-D100 HydrophobicContact CG2-CB 4.49Å; I88-V102 HydrophobicContact CG1-CG2 4.36Å
89	L	52.2	Low	52.4	Low	10 Å²	10	70.5 Å²	70.5	5%	0.052	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	112.9	175.5	-53.2	-175.5	0	0	0	108.4	V22 A46 L87 W91 D100 R101 E103	V22-L89 HydrophobicContact CG1-CD1 4.49Å; A46-L89 HydrophobicContact CB-CD2 3.15Å; L87-L89 HydrophobicContact CB-CD2 4.32Å; L89-W91 HydrophobicContact CB-CD2 4.49Å; L89-W91 HydrophobicContact CB-CH2 4.48Å; L89-W91 HydrophobicContact CB-CZ2 3.6Å; L89-W91 HydrophobicContact CD1-CH2 3.92Å; L89-W91 HydrophobicContact CD1-CZ2 3.38Å; L89-W91 HydrophobicContact CG-CZ2 4.11Å; L89-W91 PolarHBondContact O-NE1 3.05Å; L89-D100 WeakPolarHBondContact O-CA 3.19Å; L89-R101 HydrophobicContact CB-CB 4.34Å; L89-R101 WeakPolarHBondContact CB-O 3.35Å; L89-R101 PolarHBondContact N-O 2.76Å; L89-R101 PolarHBondContact O-N 2.86Å; L89-E103 HydrophobicContact CD1-CB 4.15Å; L89-E103 HydrophobicContact CD1-CG 3.63Å; L89-E103 HydrophobicContact CG-CG 4.35Å
90	H	49.6	Very low	51.7	Low	67 Å²	67	66.6 Å²	66.6	31%	0.31	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	107.2	177	-76.6	-60.5	0	0	0	109	G45 I88 D100	G45-H90 PolarHBondContact O-N 3.19Å; G45-H90 VanDerWaalsContact O-O 3.04Å; I88-H90 PolarHBondContact O-N 2.8Å; H90-D100 IonicContact CE1-OD1 3.03Å; H90-D100 PolarHBondContact CE1-OD1 3.2Å; H90-D100 VanDerWaalsContact CE1-OD1 3.29Å; H90-D100 IonicContact CE1-OD2 2.71Å; H90-D100 PolarHBondContact CE1-OD2 2.86Å; H90-D100 IonicContact CG-OD1 3.43Å; H90-D100 IonicContact ND1-OD1 3.78Å; H90-D100 PolarHBondContact ND1-OD1 2.77Å; H90-D100 IonicContact ND1-OD2 3.57Å; H90-D100 PolarHBondContact ND1-OD2 3.42Å
91	W	48	Very low	51.4	Low	76 Å²	76	68.6 Å²	68.6	29%	0.288	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.4	179	-36.7	87.6	0	0	0	109.1	V22 L89 A98 L99	V22-W91 HydrophobicContact CG2-CH2 3.84Å; V22-W91 HydrophobicContact CG2-CZ3 4.31Å; L89-W91 HydrophobicContact CB-CD2 4.49Å; L89-W91 HydrophobicContact CB-CH2 4.48Å; L89-W91 HydrophobicContact CB-CZ2 3.6Å; L89-W91 HydrophobicContact CD1-CH2 3.92Å; L89-W91 HydrophobicContact CD1-CZ2 3.38Å; L89-W91 HydrophobicContact CG-CZ2 4.11Å; L89-W91 PolarHBondContact O-NE1 3.05Å; W91-A98 CarbonylContact O-C 3.57Å; W91-A98 VanDerWaalsContact O-CA 3.23Å; W91-A98 WeakPolarHBondContact O-CA 3.4Å; W91-L99 HydrophobicContact CB-CB 4.42Å; W91-L99 PolarHBondContact N-O 2.78Å; W91-L99 PolarHBondContact O-N 3.4Å
92	R	44	Very low	51	Low	211 Å²	211	70.9 Å²	70.9	80%	0.796	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	115.1	168.5	-164.7	173	-175.3	156	0.5	108.4
93	L	49	Very low	50.9	Low	85 Å²	85	69.7 Å²	69.7	45%	0.445	39%	0.385	S	S	.	.			trans	-82.9	157.2	175.2	-63.1	165.5	0	0	0	109.7	G95 G96 T97	L93-G95 PolarHBondContact O-N 2.75Å; L93-G96 PolarHBondContact O-N 2.91Å; L93-T97 PolarHBondContact N-O 2.79Å
94	D	42.5	Very low	50.7	Low	184 Å²	184	73 Å²	73	98%	0.984	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	2.9	-176.4	-66.2	-28.6	0	0	0	115
95	G	48.4	Very low	51	Low	68 Å²	68	72.1 Å²	72.1	70%	0.701	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	9.5	171.8	0	0	0	0	0	114.9	L93 T97	L93-G95 PolarHBondContact O-N 2.75Å; G95-T97 VanDerWaalsContact C-N 3.25Å; G95-T97 PolarHBondContact O-N 3.25Å
96	G	48.8	Very low	50.9	Low	51 Å²	51	72 Å²	72	53%	0.526	39%	0.389	S	S	.	.	S	Bend	trans	80.2	-3.2	-178.4	0	0	0	0	0	115.1	L93	L93-G96 PolarHBondContact O-N 2.91Å
97	T	42.1	Very low	51.5	Low	85 Å²	85	72.1 Å²	72.1	52%	0.521	39%	0.389	S	S	.	.			trans	-73.8	124.8	171	50	0	0	0	0	110.4	L93 G95	L93-T97 PolarHBondContact N-O 2.79Å; G95-T97 VanDerWaalsContact C-N 3.25Å; G95-T97 PolarHBondContact O-N 3.25Å
98	A	51	Low	51.8	Low	74 Å²	74	74.1 Å²	74.1	61%	0.612	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	137.5	169.7	0	0	0	0	0	110.1	W91	W91-A98 CarbonylContact O-C 3.57Å; W91-A98 VanDerWaalsContact O-CA 3.23Å; W91-A98 WeakPolarHBondContact O-CA 3.4Å
99	L	46.7	Very low	52.5	Low	101 Å²	101	72 Å²	72	53%	0.529	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.2	173.3	-153	131.9	0	0	0	108.1	W91	W91-L99 HydrophobicContact CB-CB 4.42Å; W91-L99 PolarHBondContact N-O 2.78Å; W91-L99 PolarHBondContact O-N 3.4Å
100	D	51.4	Low	52.8	Low	100 Å²	100	73 Å²	73	54%	0.535	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.1	-179.6	-66.2	3.5	0	0	0	108.2	I88 L89 H90	I88-D100 HydrophobicContact CG2-CB 4.49Å; L89-D100 WeakPolarHBondContact O-CA 3.19Å; H90-D100 IonicContact CE1-OD1 3.03Å; H90-D100 PolarHBondContact CE1-OD1 3.2Å; H90-D100 VanDerWaalsContact CE1-OD1 3.29Å; H90-D100 IonicContact CE1-OD2 2.71Å; H90-D100 PolarHBondContact CE1-OD2 2.86Å; H90-D100 IonicContact CG-OD1 3.43Å; H90-D100 IonicContact ND1-OD1 3.78Å; H90-D100 PolarHBondContact ND1-OD1 2.77Å; H90-D100 IonicContact ND1-OD2 3.57Å; H90-D100 PolarHBondContact ND1-OD2 3.42Å
101	R	50.6	Low	53.6	Low	106 Å²	106	71.8 Å²	71.8	40%	0.4	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.7	174.9	-171.1	-174.4	-172.1	-173.9	10.1	109.4	L89 E103	L89-R101 HydrophobicContact CB-CB 4.34Å; L89-R101 WeakPolarHBondContact CB-O 3.35Å; L89-R101 PolarHBondContact N-O 2.76Å; L89-R101 PolarHBondContact O-N 2.86Å; R101-E103 WeakPolarHBondContact CD-OE1 3.01Å; R101-E103 HydrophobicContact CG-CG 4.25Å; R101-E103 IonicContact CZ-OE1 2.71Å; R101-E103 VanDerWaalsContact CZ-OE1 3.22Å; R101-E103 IonicContact NE-OE1 2.82Å; R101-E103 PolarHBondContact NE-OE1 3.12Å; R101-E103 IonicContact NH1-OE1 2.83Å; R101-E103 PolarHBondContact NH1-OE1 2.96Å
102	V	52.5	Low	54.3	Low	83 Å²	83	70.1 Å²	70.1	50%	0.503	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	116.8	169.8	-173.3	0	0	0	0	108.6	D86 L87 I88	D86-V102 HydrophobicContact CB-CG1 4.01Å; L87-V102 CarbonylContact O-C 3.53Å; L87-V102 WeakPolarHBondContact O-CA 3.38Å; I88-V102 HydrophobicContact CG1-CG2 4.36Å
103	E	56.6	Low	55.1	Low	45 Å²	45	65.6 Å²	65.6	21%	0.21	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.8	168.5	-71	-166.7	-178	0	0	109.5	L87 L89 R101	L87-E103 WeakPolarHBondContact CA-O 3.43Å; L87-E103 HydrophobicContact CB-CB 4.48Å; L87-E103 VanDerWaalsContact CB-O 3.29Å; L87-E103 WeakPolarHBondContact CB-O 3.42Å; L87-E103 PolarHBondContact N-O 2.79Å; L87-E103 PolarHBondContact O-N 2.98Å; L89-E103 HydrophobicContact CD1-CB 4.15Å; L89-E103 HydrophobicContact CD1-CG 3.63Å; L89-E103 HydrophobicContact CG-CG 4.35Å; R101-E103 WeakPolarHBondContact CD-OE1 3.01Å; R101-E103 HydrophobicContact CG-CG 4.25Å; R101-E103 IonicContact CZ-OE1 2.71Å; R101-E103 VanDerWaalsContact CZ-OE1 3.22Å; R101-E103 IonicContact NE-OE1 2.82Å; R101-E103 PolarHBondContact NE-OE1 3.12Å; R101-E103 IonicContact NH1-OE1 2.83Å; R101-E103 PolarHBondContact NH1-OE1 2.96Å
104	R	55	Low	55.6	Low	77 Å²	77	68.9 Å²	68.9	29%	0.291	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113.1	179.8	-170	170.8	-75.4	156.2	1.4	109.3	A84 L85 D86 D180 P181	A84-R104 HydrophobicContact CB-CG 4.3Å; L85-R104 CarbonylContact O-C 3.46Å; L85-R104 WeakPolarHBondContact O-CA 3.45Å; D86-R104 IonicContact OD1-CZ 3.42Å; D86-R104 IonicContact OD1-NE 3.2Å; D86-R104 PolarHBondContact OD1-NE 3.41Å; D86-R104 IonicContact OD1-NH2 3.46Å; D86-R104 PolarHBondContact OD1-NH2 3.38Å; R104-D180 IonicContact CZ-OD2 3.81Å; R104-D180 IonicContact NH1-OD2 3.97Å; R104-D180 PolarHBondContact NH1-OD2 3.37Å; R104-P181 HydrophobicContact CB-CG 4.48Å
105	L	61.2	Low	56.2	Low	5 Å²	5	63.6 Å²	63.6	3%	0.026	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.6	171.5	167.1	65.8	0	0	0	109.1	F25 V28 F41 L85 L87 V107	F25-L105 WeakPolarHBondContact O-CD1 3.5Å; V28-L105 HydrophobicContact CB-CD1 4.46Å; V28-L105 HydrophobicContact CG2-CD1 3.81Å; F41-L105 HydrophobicContact CD1-CD2 3.76Å; F41-L105 HydrophobicContact CE1-CD2 3.49Å; F41-L105 VanDerWaalsContact CE1-CD2 3.49Å; F41-L105 HydrophobicContact CG-CD2 4.42Å; F41-L105 HydrophobicContact CZ-CD2 3.9Å; L85-L105 WeakPolarHBondContact CA-O 3.4Å; L85-L105 HydrophobicContact CB-CB 4.19Å; L85-L105 WeakPolarHBondContact CB-O 3.43Å; L85-L105 HydrophobicContact CD1-CD2 3.98Å; L85-L105 HydrophobicContact CD1-CG 4.4Å; L85-L105 PolarHBondContact N-O 2.94Å; L85-L105 PolarHBondContact O-N 3.33Å; L87-L105 HydrophobicContact CD1-CB 3.58Å; L87-L105 HydrophobicContact CD1-CD2 4.33Å; L87-L105 HydrophobicContact CD2-CB 4.46Å; L87-L105 HydrophobicContact CG-CB 3.93Å; L105-V107 HydrophobicContact CD2-CG2 4.23Å; L105-V107 HydrophobicContact CG-CG2 4.1Å
106	I	58.6	Low	56.2	Low	13 Å²	13	64.5 Å²	64.5	7%	0.067	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.2	175.7	-48.6	169.4	0	0	0	108.7	E26 R27 V28 P82 L83 L182	E26-I106 PolarHBondContact O-N 3.47Å; R27-I106 CarbonylContact C-O 3.5Å; R27-I106 WeakPolarHBondContact CA-O 3.43Å; R27-I106 HydrophobicContact CB-CB 3.94Å; R27-I106 VanDerWaalsContact CD-CB 3.47Å; R27-I106 HydrophobicContact CG-CB 3.62Å; R27-I106 HydrophobicContact CG-CG2 3.85Å; R27-I106 WeakPolarHBondContact CG-O 3.42Å; R27-I106 VanDerWaalsContact NE-CG2 3.32Å; V28-I106 PolarHBondContact N-O 3.18Å; P82-I106 HydrophobicContact CB-CG2 3.74Å; L83-I106 CarbonylContact O-C 3.54Å; L83-I106 WeakPolarHBondContact O-CA 3.38Å; I106-L182 HydrophobicContact CD1-CD1 3.37Å; I106-L182 HydrophobicContact CD1-CG 4.47Å; I106-L182 HydrophobicContact CG1-CD1 3.53Å
107	V	65.2	Low	56.3	Low	8 Å²	8	74 Å²	74	5%	0.048	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.4	177.3	179.8	0	0	0	0	109.3	V28 I30 P82 L83 L85 L105 I109	V28-V107 CarbonylContact O-C 3.59Å; V28-V107 WeakPolarHBondContact O-CA 3.37Å; I30-V107 HydrophobicContact CD1-CG1 3.38Å; I30-V107 HydrophobicContact CG1-CG1 3.98Å; P82-V107 CarbonylContact C-O 3.56Å; P82-V107 WeakPolarHBondContact CA-O 3.4Å; L83-V107 HydrophobicContact CB-CB 4.25Å; L83-V107 PolarHBondContact N-O 3.25Å; L83-V107 PolarHBondContact O-N 3.43Å; L85-V107 HydrophobicContact CD1-CG2 3.46Å; L85-V107 VanDerWaalsContact CD1-CG2 3.46Å; L85-V107 HydrophobicContact CG-CG2 3.98Å; L105-V107 HydrophobicContact CD2-CG2 4.23Å; L105-V107 HydrophobicContact CG-CG2 4.1Å; V107-I109 HydrophobicContact CG1-CG1 4.09Å
108	E	62.7	Low	56.3	Low	59 Å²	59	75.7 Å²	75.7	28%	0.276	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112	176.1	-173.4	164.2	-138.2	0	0	109.2	R27 V28 V29 I30 S81 V110	R27-E108 IonicContact CZ-OE1 2.99Å; R27-E108 IonicContact CZ-OE2 3.37Å; R27-E108 IonicContact NE-OE2 3.27Å; R27-E108 IonicContact NH1-OE2 2.65Å; R27-E108 PolarHBondContact NH1-OE2 3.45Å; R27-E108 IonicContact NH2-OE1 3.77Å; R27-E108 PolarHBondContact NH2-OE1 3.03Å; R27-E108 IonicContact NH2-OE2 3.68Å; R27-E108 PolarHBondContact NH2-OE2 2.89Å; V28-E108 PolarHBondContact O-N 3.46Å; V29-E108 CarbonylContact C-O 3.39Å; V29-E108 VanDerWaalsContact CA-O 3.3Å; V29-E108 WeakPolarHBondContact CA-O 3.29Å; V29-E108 HydrophobicContact CG2-CB 4.32Å; I30-E108 PolarHBondContact N-O 2.77Å; S81-E108 WeakPolarHBondContact OG-CA 3.39Å; E108-V110 HydrophobicContact CG-CG2 4.49Å
109	I	65.8	Low	55.9	Low	4 Å²	4	76.8 Å²	76.8	2%	0.021	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.8	177.2	-55.8	175	0	0	0	107.5	I30 A32 L74 L77 I78 S81 L83 V107	I30-I109 WeakPolarHBondContact O-CA 3.28Å; A32-I109 HydrophobicContact CB-CG2 4.26Å; L74-I109 HydrophobicContact CB-CD1 4.33Å; L74-I109 HydrophobicContact CB-CG2 4.21Å; L74-I109 HydrophobicContact CD2-CD1 4.24Å; L77-I109 HydrophobicContact CB-CD1 3.36Å; L77-I109 HydrophobicContact CD1-CD1 4Å; L77-I109 HydrophobicContact CG-CD1 4.33Å; I78-I109 HydrophobicContact CG1-CG2 3.78Å; S81-I109 PolarHBondContact OG-N 3.04Å; S81-I109 PolarHBondContact OG-O 3.48Å; L83-I109 HydrophobicContact CD1-CD1 3.52Å; L83-I109 HydrophobicContact CD1-CG1 4.36Å; V107-I109 HydrophobicContact CG1-CG1 4.09Å
110	V	59.5	Low	55.8	Low	32 Å²	32	79.1 Å²	79.1	19%	0.194	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.3	-174.7	-114.5	0	0	0	0	110.5	V29 I30 A32 E108 S112 K114	V29-V110 HydrophobicContact CG1-CG2 3.26Å; I30-V110 PolarHBondContact O-N 3.38Å; A32-V110 PolarHBondContact N-O 3.33Å; E108-V110 HydrophobicContact CG-CG2 4.49Å; V110-S112 PolarHBondContact O-N 2.8Å; V110-K114 HydrophobicContact CG1-CB 4.48Å
111	P	65.1	Low	55.6	Low	41 Å²	41	81.5 Å²	81.5	27%	0.266	40%	0.404	S	S	.	.			trans	-54.4	140.3	169.5	-22.3	31.9	0	0	0	110.8	I78 S113 K114 L115	I78-P111 HydrophobicContact CD1-CG 4.24Å; P111-S113 PolarHBondContact O-N 2.84Å; P111-K114 HydrophobicContact CG-CD 4.45Å; P111-K114 WeakPolarHBondContact O-CA 3.25Å; P111-K114 WeakPolarHBondContact O-CB 3.45Å; P111-K114 PolarHBondContact O-N 3.15Å; P111-L115 PolarHBondContact O-N 2.77Å
112	S	64.4	Low	55.5	Low	40 Å²	40	79 Å²	79	28%	0.28	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-67.9	-24.7	-171.7	-50.6	0	0	0	0	113.1	P31 D33 V110 K114 L115	P31-S112 WeakPolarHBondContact CB-OG 3.41Å; D33-S112 WeakPolarHBondContact OD1-CB 3.27Å; D33-S112 PolarHBondContact OD1-OG 3.47Å; D33-S112 VanDerWaalsContact OD2-CB 3.26Å; D33-S112 WeakPolarHBondContact OD2-CB 3.44Å; D33-S112 PolarHBondContact OD2-OG 2.86Å; V110-S112 PolarHBondContact O-N 2.8Å; S112-K114 PolarHBondContact O-N 2.83Å; S112-L115 WeakPolarHBondContact O-CB 3.4Å; S112-L115 PolarHBondContact O-N 2.79Å; S112-L115 VanDerWaalsContact O-N 3.14Å
113	S	60.6	Low	55.6	Low	117 Å²	117	79.4 Å²	79.4	82%	0.818	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-63.4	-20.4	167.9	56.8	0	0	0	0	114	P111	P111-S113 PolarHBondContact O-N 2.84Å
114	K	59.4	Low	55.8	Low	154 Å²	154	83 Å²	83	67%	0.67	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-98.7	-2.3	176.5	-62.6	-170.3	177.7	-179.4	0	113	V110 P111 S112 S116	V110-K114 HydrophobicContact CG1-CB 4.48Å; P111-K114 HydrophobicContact CG-CD 4.45Å; P111-K114 WeakPolarHBondContact O-CA 3.25Å; P111-K114 WeakPolarHBondContact O-CB 3.45Å; P111-K114 PolarHBondContact O-N 3.15Å; S112-K114 PolarHBondContact O-N 2.83Å; K114-S116 PolarHBondContact O-N 3.38Å
115	L	54.1	Low	56.2	Low	73 Å²	73	82.1 Å²	82.1	38%	0.382	42%	0.422	S	S	.	.			trans	-77.7	90.6	174	-100.2	144.5	0	0	0	109.7	P31 P111 S112	P31-L115 HydrophobicContact CB-CD1 3.4Å; P31-L115 VanDerWaalsContact CB-CD1 3.4Å; P31-L115 HydrophobicContact CG-CD1 3.54Å; P111-L115 PolarHBondContact O-N 2.77Å; S112-L115 WeakPolarHBondContact O-CB 3.4Å; S112-L115 PolarHBondContact O-N 2.79Å; S112-L115 VanDerWaalsContact O-N 3.14Å
116	S	49.8	Very low	56.7	Low	87 Å²	87	82.4 Å²	82.4	61%	0.608	43%	0.425	S	S	*	.			trans	-90.5	113.8	164.6	-177.1	0	0	0	0	108.4	K114 K118	K114-S116 PolarHBondContact O-N 3.38Å; S116-K118 PolarHBondContact O-N 3.48Å
117	R	49.6	Very low	57.5	Low	251 Å²	251	84 Å²	84	95%	0.947	45%	0.445	S	S	*	.			trans	-70	84.6	172.1	-163.9	-178	-163.7	-168	5.2	108.4
118	K	42.4	Very low	58.3	Low	119 Å²	119	87.7 Å²	87.7	52%	0.517	46%	0.464	S	S	.	.			trans	-78.5	127.4	172	-71	-168.3	176	-172.5	0	108.8	S116 A122 F123	S116-K118 PolarHBondContact O-N 3.48Å; K118-A122 HydrophobicContact CB-CB 4.31Å; K118-F123 HydrophobicContact CB-CD2 4.23Å; K118-F123 HydrophobicContact CB-CE2 3.77Å; K118-F123 HydrophobicContact CD-CE2 4.07Å; K118-F123 HydrophobicContact CD-CZ 4.2Å; K118-F123 HydrophobicContact CG-CE2 4.5Å
119	T	43	Very low	59.5	Low	97 Å²	97	85.2 Å²	85.2	60%	0.595	45%	0.453	S	S	*	.			trans	-58	148.3	168.2	49.3	0	0	0	0	108.7	D121 A122	T119-D121 PolarHBondContact O-N 3.05Å; T119-A122 WeakPolarHBondContact O-CB 3.48Å; T119-A122 PolarHBondContact O-N 3.32Å
120	R	44.8	Very low	60.7	Low	151 Å²	151	85.5 Å²	85.5	57%	0.57	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-54.9	-30.7	-174.7	-153.8	179.7	-169.3	173.8	7.4	112.3	G208	R120-G208 WeakPolarHBondContact CG-O 3.19Å; R120-G208 PolarHBondContact NE-O 3.09Å
121	D	47.7	Very low	62	Low	149 Å²	149	88.6 Å²	88.6	80%	0.797	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-82	-14.3	-179.1	-50.7	-43.2	0	0	0	113.7	T119 F123	T119-D121 PolarHBondContact O-N 3.05Å; D121-F123 PolarHBondContact O-N 3.15Å
122	A	48	Very low	63.1	Low	53 Å²	53	91.2 Å²	91.2	44%	0.438	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-76.9	-10.7	177	0	0	0	0	0	113.3	K118 T119 E124	K118-A122 HydrophobicContact CB-CB 4.31Å; T119-A122 WeakPolarHBondContact O-CB 3.48Å; T119-A122 PolarHBondContact O-N 3.32Å; A122-E124 PolarHBondContact O-N 3.01Å
123	F	53.9	Low	64.4	Low	92 Å²	92	97.2 Å²	97.2	40%	0.404	51%	0.507	S	S	.	.	S	Bend	trans	-86.1	89.4	170.9	-83.5	-86.9	0	0	0	109.2	K118 D121 P125 I209	K118-F123 HydrophobicContact CB-CD2 4.23Å; K118-F123 HydrophobicContact CB-CE2 3.77Å; K118-F123 HydrophobicContact CD-CE2 4.07Å; K118-F123 HydrophobicContact CD-CZ 4.2Å; K118-F123 HydrophobicContact CG-CE2 4.5Å; D121-F123 PolarHBondContact O-N 3.15Å; F123-P125 WeakPolarHBondContact O-CD 3.36Å; F123-P125 VanDerWaalsContact O-N 3.16Å; F123-I209 HydrophobicContact CB-CD1 3.74Å; F123-I209 HydrophobicContact CB-CG1 3.99Å; F123-I209 HydrophobicContact CG-CD1 4.49Å
124	E	60.6	Low	66	Low	121 Å²	121	99.3 Å²	99.3	57%	0.565	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-62.4	128.4	172.2	-33.8	165.7	117	0	0	108	A122 R158	A122-E124 PolarHBondContact O-N 3.01Å; E124-R158 PolarHBondContact O-NH1 3.17Å; E124-R158 IonicContact OE2-CZ 3.45Å; E124-R158 VanDerWaalsContact OE2-CZ 3.27Å; E124-R158 IonicContact OE2-NH1 2.89Å; E124-R158 PolarHBondContact OE2-NH1 2.99Å; E124-R158 IonicContact OE2-NH2 3.78Å; E124-R158 PolarHBondContact OE2-NH2 2.7Å
125	P	64.5	Low	67.7	Low	58 Å²	58	92.6 Å²	92.6	38%	0.377	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-70.7	138.1	-170.8	24.3	-31.8	0	0	0	110.7	F123 I209 K211	F123-P125 WeakPolarHBondContact O-CD 3.36Å; F123-P125 VanDerWaalsContact O-N 3.16Å; P125-I209 HydrophobicContact CB-CG2 4.31Å; P125-K211 HydrophobicContact CB-CB 4.24Å; P125-K211 HydrophobicContact CB-CD 3.33Å; P125-K211 HydrophobicContact CB-CG 4.44Å; P125-K211 HydrophobicContact CG-CD 3.82Å
126	C	70.4	Confident	69.5	Low	12 Å²	12	93.8 Å²	93.8	8%	0.081	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-54.4	148.8	164.5	-46.8	0	0	0	0	109.6	V129 C156 K211	C126-V129 HydrophobicContact CB-CG1 3.55Å; C126-C156 HydrophobicContact CB-CB 3.77Å; C126-C156 WeakPolarHBondContact CB-SG 3.27Å; C126-C156 WeakPolarHBondContact SG-CB 3.4Å; C126-C156 CovalentContact SG-SG 2.02Å; C126-C156 PolarHBondContact SG-SG 2.76Å; C126-K211 PolarHBondContact O-NZ 2.97Å
127	G	76.5	Confident	71.5	Confident	47 Å²	47	90.9 Å²	90.9	49%	0.485	46%	0.457	S	S	.	.	S	Bend	trans	-65.4	-145	174.7	0	0	0	0	0	111.8	V129 S213	G127-V129 PolarHBondContact O-N 3.45Å; G127-S213 PolarHBondContact O-OG 3.19Å
128	N	80.9	Confident	73.5	Confident	85 Å²	85	86.1 Å²	86.1	46%	0.455	44%	0.443	S	S	.	.			trans	-66.3	119.4	166.5	-170.8	10	0	0	0	108.6	F130	N128-F130 PolarHBondContact OD1-N 2.74Å
129	V	88.5	Confident	75.6	Confident	6 Å²	6	80.8 Å²	80.8	4%	0.036	42%	0.421	C	S	.	.			trans	-91.6	-12.3	-175.5	-60.7	0	0	0	0	112.9	C126 G127 A154 V155 C156 F162 A204	C126-V129 HydrophobicContact CB-CG1 3.55Å; G127-V129 PolarHBondContact O-N 3.45Å; V129-A154 HydrophobicContact CB-CB 3.95Å; V129-A154 HydrophobicContact CG2-CB 3.46Å; V129-A154 VanDerWaalsContact CG2-CB 3.46Å; V129-A154 CarbonylContact O-C 3.46Å; V129-A154 WeakPolarHBondContact O-CA 3.32Å; V129-V155 PolarHBondContact O-N 3.29Å; V129-C156 HydrophobicContact CG1-CB 4.37Å; V129-F162 HydrophobicContact CB-CE1 4.14Å; V129-F162 HydrophobicContact CB-CZ 4.07Å; V129-F162 HydrophobicContact CG1-CE1 3.74Å; V129-F162 HydrophobicContact CG1-CZ 3.64Å; V129-F162 HydrophobicContact CG2-CD1 4.31Å; V129-F162 HydrophobicContact CG2-CE1 3.94Å; V129-F162 HydrophobicContact CG2-CZ 4.34Å; V129-A204 HydrophobicContact CG2-CB 3.84Å
130	F	90.3	Very high	77.6	Confident	10 Å²	10	77.1 Å²	77.1	4%	0.044	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-83.4	138.3	175	-65.5	-60.7	0	0	0	110.8	N128 Q132 F135 I152 A154 Y164 I202 A204 S213 A215	N128-F130 PolarHBondContact OD1-N 2.74Å; F130-Q132 WeakPolarHBondContact CB-O 3.41Å; F130-Q132 PolarHBondContact O-N 3.14Å; F130-F135 HydrophobicContact CB-CE2 4.41Å; F130-I152 HydrophobicContact CD1-CG2 3.86Å; F130-I152 HydrophobicContact CE1-CG2 3.77Å; F130-A154 HydrophobicContact CD1-CB 4.42Å; F130-A154 HydrophobicContact CE1-CB 4.23Å; F130-Y164 HydrophobicContact CE1-CD1 4.43Å; F130-Y164 HydrophobicContact CE1-CE1 4.11Å; F130-I202 HydrophobicContact CE1-CG2 4.25Å; F130-I202 HydrophobicContact CE2-CG2 4.35Å; F130-I202 WeakPolarHBondContact CE2-O 3.34Å; F130-I202 HydrophobicContact CZ-CG1 4.36Å; F130-I202 HydrophobicContact CZ-CG2 3.91Å; F130-A204 HydrophobicContact CE1-CB 3.79Å; F130-A204 HydrophobicContact CE2-CB 3.87Å; F130-A204 HydrophobicContact CZ-CB 3.3Å; F130-S213 WeakPolarHBondContact CE2-O 3.09Å; F130-A215 HydrophobicContact CB-CB 4.11Å; F130-A215 HydrophobicContact CD2-CB 3.54Å; F130-A215 HydrophobicContact CE2-CB 4Å; F130-A215 HydrophobicContact CG-CB 3.84Å
131	S	87.4	Confident	79.6	Confident	97 Å²	97	71 Å²	71	68%	0.678	38%	0.379	S	S	*	.	S	Bend	trans	-60.5	-25.2	175.5	59.9	0	0	0	0	113.1
132	Q	88.9	Confident	81.1	Confident	96 Å²	96	67.3 Å²	67.3	45%	0.449	36%	0.359	S	S	.	.			trans	-138.9	147.5	-177.2	-59.6	176.7	33.9	0	0	110.1	F130 R134 F135	F130-Q132 WeakPolarHBondContact CB-O 3.41Å; F130-Q132 PolarHBondContact O-N 3.14Å; Q132-R134 VanDerWaalsContact C-N 3.34Å; Q132-R134 WeakPolarHBondContact CB-O 3.39Å; Q132-R134 PolarHBondContact OE1-O 2.76Å; Q132-F135 HydrophobicContact CB-CD1 4.5Å; Q132-F135 HydrophobicContact CB-CE1 4.05Å; Q132-F135 HydrophobicContact CB-CE2 4.33Å; Q132-F135 HydrophobicContact CB-CZ 3.96Å; Q132-F135 HydrophobicContact CG-CE1 4.32Å
133	K	91.6	Very high	82.5	Confident	166 Å²	166	66.4 Å²	66.4	72%	0.722	35%	0.348	S	S	*	.	S	Bend	trans	-77.2	-22.9	172.9	-69	-175.1	179.8	179.4	0	112.7	A215 L216	K133-A215 WeakPolarHBondContact O-CA 3.37Å; K133-L216 PolarHBondContact O-N 3.19Å
134	R	94.7	Very high	83.4	Confident	162 Å²	162	64.7 Å²	64.7	61%	0.611	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	140	179.9	-58.5	-165.7	174.6	170.6	-1.4	110.1	Q132 L216	Q132-R134 VanDerWaalsContact C-N 3.34Å; Q132-R134 WeakPolarHBondContact CB-O 3.39Å; Q132-R134 PolarHBondContact OE1-O 2.76Å; R134-L216 CarbonylContact C-O 3.45Å; R134-L216 VanDerWaalsContact CA-O 3.24Å; R134-L216 WeakPolarHBondContact CA-O 3.3Å; R134-L216 HydrophobicContact CG-CB 4.13Å; R134-L216 HydrophobicContact CG-CD2 4.34Å
135	F	93.8	Very high	83.9	Confident	12 Å²	12	60.3 Å²	60.3	5%	0.053	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	94.1	175.9	-69.9	-82.1	0	0	0	109.6	F130 Q132 I152 A215 L216 D218	F130-F135 HydrophobicContact CB-CE2 4.41Å; Q132-F135 HydrophobicContact CB-CD1 4.5Å; Q132-F135 HydrophobicContact CB-CE1 4.05Å; Q132-F135 HydrophobicContact CB-CE2 4.33Å; Q132-F135 HydrophobicContact CB-CZ 3.96Å; Q132-F135 HydrophobicContact CG-CE1 4.32Å; F135-I152 HydrophobicContact CB-CD1 4.49Å; F135-I152 HydrophobicContact CD2-CD1 4.21Å; F135-I152 HydrophobicContact CD2-CG2 4.14Å; F135-I152 HydrophobicContact CE1-CG2 4.43Å; F135-I152 HydrophobicContact CE2-CG2 3.6Å; F135-I152 HydrophobicContact CG-CD1 4.3Å; F135-I152 HydrophobicContact CG-CG1 4.47Å; F135-I152 HydrophobicContact CZ-CG2 3.76Å; F135-A215 HydrophobicContact CD2-CB 3.91Å; F135-A215 HydrophobicContact CE2-CB 3.67Å; F135-L216 PolarHBondContact N-O 2.92Å; F135-D218 PolarHBondContact O-N 2.71Å
136	P	93.5	Very high	84	Confident	99 Å²	99	59.3 Å²	59.3	64%	0.643	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.3	173.4	29.8	-32.3	0	0	0	110	D218	P136-D218 CarbonylContact C-O 3.6Å; P136-D218 WeakPolarHBondContact CA-O 3.3Å
137	L	91.6	Very high	83.9	Confident	26 Å²	26	59.5 Å²	59.5	14%	0.136	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	139	-178.4	-58.8	176.9	0	0	0	110.4	V149 R150 L186 V217 D218 I219 Q220	L137-V149 HydrophobicContact CD1-CG1 4.21Å; L137-R150 HydrophobicContact CD1-CB 3.85Å; L137-R150 HydrophobicContact CD1-CG 4.3Å; L137-R150 HydrophobicContact CD2-CB 4.01Å; L137-R150 HydrophobicContact CD2-CG 3.84Å; L137-L186 HydrophobicContact CD1-CD2 3.9Å; L137-V217 HydrophobicContact CD1-CG1 3.78Å; L137-V217 HydrophobicContact CG-CG1 4.48Å; L137-D218 PolarHBondContact N-O 3.31Å; L137-I219 HydrophobicContact CB-CG1 4.29Å; L137-I219 HydrophobicContact CD1-CG1 4.38Å; L137-I219 WeakPolarHBondContact O-CA 3.27Å; L137-Q220 PolarHBondContact O-N 2.79Å
138	K	89.7	Confident	84	Confident	151 Å²	151	58.7 Å²	58.7	66%	0.657	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.4	168.8	-67	-177.5	178.9	-179.2	0	108.6	Q220 I222	K138-Q220 WeakPolarHBondContact CA-O 3.42Å; K138-Q220 HydrophobicContact CG-CB 4.46Å; K138-I222 HydrophobicContact CB-CD1 4.02Å; K138-I222 HydrophobicContact CB-CG1 4.36Å; K138-I222 HydrophobicContact CB-CG2 4.43Å; K138-I222 HydrophobicContact CD-CG2 4.42Å; K138-I222 HydrophobicContact CG-CG2 4.48Å
139	V	87.9	Confident	84.1	Confident	7 Å²	7	56.5 Å²	56.5	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.7	-175.5	-173.6	0	0	0	0	108.9	T143 V149 L192 I219 Q220 I221 I222	V139-T143 HydrophobicContact CG1-CG2 4.3Å; V139-T143 WeakPolarHBondContact CG1-OG1 3.14Å; V139-V149 HydrophobicContact CG1-CG2 4.25Å; V139-V149 HydrophobicContact CG2-CG1 3.39Å; V139-V149 HydrophobicContact CG2-CG2 4.37Å; V139-L192 HydrophobicContact CB-CD1 4.33Å; V139-L192 HydrophobicContact CG1-CD1 3.47Å; V139-L192 VanDerWaalsContact CG1-CD1 3.47Å; V139-I219 HydrophobicContact CB-CG2 4.21Å; V139-I219 HydrophobicContact CG2-CG2 3.69Å; V139-Q220 PolarHBondContact N-O 3.39Å; V139-I221 HydrophobicContact CB-CD1 3.99Å; V139-I221 CarbonylContact O-C 3.42Å; V139-I221 VanDerWaalsContact O-CA 3.27Å; V139-I221 WeakPolarHBondContact O-CA 3.4Å; V139-I222 PolarHBondContact O-N 3.04Å
140	S	84.6	Confident	84.1	Confident	19 Å²	19	62.5 Å²	62.5	13%	0.133	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	141.6	179.2	-176.1	0	0	0	0	111.7	D142 T143 I222 D224	S140-D142 WeakPolarHBondContact CB-OD1 3.25Å; S140-D142 PolarHBondContact O-N 3.49Å; S140-D142 PolarHBondContact OG-N 2.87Å; S140-D142 PolarHBondContact OG-OD1 2.81Å; S140-T143 PolarHBondContact N-OG1 3.49Å; S140-T143 WeakPolarHBondContact O-CB 3.47Å; S140-T143 PolarHBondContact O-N 3.01Å; S140-T143 VanDerWaalsContact O-N 3.09Å; S140-T143 PolarHBondContact O-OG1 2.82Å; S140-I222 CarbonylContact C-O 3.58Å; S140-I222 VanDerWaalsContact CA-O 3.23Å; S140-I222 WeakPolarHBondContact CA-O 3.44Å; S140-D224 WeakPolarHBondContact OG-CB 3.37Å
141	S	85.8	Confident	83.8	Confident	22 Å²	22	65.5 Å²	65.5	15%	0.154	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.1	172.5	60.8	0	0	0	0	113.1	T143 E194 I222	S141-T143 VanDerWaalsContact C-N 3.28Å; S141-T143 PolarHBondContact O-N 3.44Å; S141-E194 WeakPolarHBondContact OG-CG 3.44Å; S141-E194 PolarHBondContact OG-OE1 3.06Å; S141-I222 PolarHBondContact N-O 2.95Å
142	D	80.2	Confident	83.7	Confident	72 Å²	72	61 Å²	61	39%	0.385	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	3.6	178	82	-28.8	0	0	0	113.8	S140 A144 R227	S140-D142 WeakPolarHBondContact CB-OD1 3.25Å; S140-D142 PolarHBondContact O-N 3.49Å; S140-D142 PolarHBondContact OG-N 2.87Å; S140-D142 PolarHBondContact OG-OD1 2.81Å; D142-A144 PolarHBondContact O-N 3.33Å; D142-R227 IonicContact OD2-CZ 3.96Å; D142-R227 IonicContact OD2-NE 2.92Å; D142-R227 IonicContact OD2-NH1 2.76Å; D142-R227 PolarHBondContact OD2-NH1 2.9Å
143	T	77.3	Confident	83.4	Confident	34 Å²	34	62 Å²	62	21%	0.209	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-58.6	123.8	176.4	-56.7	0	0	0	0	110.1	V139 S140 S141 T188	V139-T143 HydrophobicContact CG1-CG2 4.3Å; V139-T143 WeakPolarHBondContact CG1-OG1 3.14Å; S140-T143 PolarHBondContact N-OG1 3.49Å; S140-T143 WeakPolarHBondContact O-CB 3.47Å; S140-T143 PolarHBondContact O-N 3.01Å; S140-T143 VanDerWaalsContact O-N 3.09Å; S140-T143 PolarHBondContact O-OG1 2.82Å; S141-T143 VanDerWaalsContact C-N 3.28Å; S141-T143 PolarHBondContact O-N 3.44Å; T143-T188 HydrophobicContact CG2-CG2 4.05Å
144	A	72.2	Confident	83	Confident	57 Å²	57	54.5 Å²	54.5	47%	0.471	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-64.6	145.2	179.6	0	0	0	0	0	111	D142 S147 T188	D142-A144 PolarHBondContact O-N 3.33Å; A144-S147 VanDerWaalsContact O-CB 3.23Å; A144-S147 WeakPolarHBondContact O-CB 3.13Å; A144-S147 PolarHBondContact O-N 3.23Å; A144-S147 PolarHBondContact O-OG 3.43Å; A144-T188 PolarHBondContact O-OG1 2.68Å
145	V	71.7	Confident	82.4	Confident	29 Å²	29	51.3 Å²	51.3	18%	0.176	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	136.5	172.4	-177.8	0	0	0	0	109.8	S147 T188 T189 R191	V145-S147 VanDerWaalsContact C-N 3.35Å; V145-T188 WeakPolarHBondContact CA-OG1 3.43Å; V145-T189 VanDerWaalsContact CG1-O 3.27Å; V145-T189 WeakPolarHBondContact CG1-O 3.23Å; V145-R191 HydrophobicContact CG2-CG 4Å
146	G	66.7	Low	81.6	Confident	36 Å²	36	51.6 Å²	51.6	37%	0.371	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	-0.1	-175.4	0	0	0	0	0	113.9	T188	G146-T188 VanDerWaalsContact CA-O 3.31Å; G146-T188 WeakPolarHBondContact CA-O 3.39Å; G146-T188 PolarHBondContact N-O 2.82Å; G146-T188 PolarHBondContact N-OG1 2.87Å
147	S	68.3	Low	80.5	Confident	16 Å²	16	53.9 Å²	53.9	11%	0.112	29%	0.293	C	S	.	.			trans	-77.9	132.2	178.5	-53.7	0	0	0	0	110.4	A144 V145 V149 F187 T188	A144-S147 VanDerWaalsContact O-CB 3.23Å; A144-S147 WeakPolarHBondContact O-CB 3.13Å; A144-S147 PolarHBondContact O-N 3.23Å; A144-S147 PolarHBondContact O-OG 3.43Å; V145-S147 VanDerWaalsContact C-N 3.35Å; S147-V149 PolarHBondContact O-N 2.98Å; S147-F187 VanDerWaalsContact O-CA 3.27Å; S147-F187 WeakPolarHBondContact O-CA 3.35Å; S147-F187 WeakPolarHBondContact O-CB 3.36Å; S147-T188 PolarHBondContact N-OG1 3.49Å; S147-T188 PolarHBondContact O-N 3.13Å
148	T	77.9	Confident	79.3	Confident	31 Å²	31	58.4 Å²	58.4	19%	0.19	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	124.9	169.4	-54.8	0	0	0	0	109.8	D185 L186	T148-D185 HydrophobicContact CG2-CB 3.94Å; T148-L186 CarbonylContact C-O 3.59Å; T148-L186 WeakPolarHBondContact CA-O 3.29Å
149	V	84.1	Confident	78	Confident	38 Å²	38	62.9 Å²	62.9	23%	0.23	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-50.2	179.2	176.2	0	0	0	0	110.4	L137 V139 S147 F177 L186 T188	L137-V149 HydrophobicContact CD1-CG1 4.21Å; V139-V149 HydrophobicContact CG1-CG2 4.25Å; V139-V149 HydrophobicContact CG2-CG1 3.39Å; V139-V149 HydrophobicContact CG2-CG2 4.37Å; S147-V149 PolarHBondContact O-N 2.98Å; V149-F177 HydrophobicContact CG2-CD1 4.22Å; V149-F177 HydrophobicContact CG2-CE1 3.98Å; V149-L186 PolarHBondContact N-O 2.96Å; V149-T188 HydrophobicContact CG2-CG2 3.84Å
150	R	87.7	Confident	76.9	Confident	133 Å²	133	63.8 Å²	63.8	50%	0.502	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	143.7	-175.1	-174.6	65.3	-175.4	-174.2	-1.2	110	L137 I152 L186	L137-R150 HydrophobicContact CD1-CB 3.85Å; L137-R150 HydrophobicContact CD1-CG 4.3Å; L137-R150 HydrophobicContact CD2-CB 4.01Å; L137-R150 HydrophobicContact CD2-CG 3.84Å; R150-I152 HydrophobicContact CG-CG1 4.34Å; R150-L186 PolarHBondContact N-O 2.94Å; R150-L186 WeakPolarHBondContact O-CB 3.42Å; R150-L186 PolarHBondContact O-N 2.73Å
151	R	83.5	Confident	76	Confident	73 Å²	73	64.6 Å²	64.6	28%	0.275	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	132	161.1	-179.7	165.8	-62	157.5	13.4	110.6	T183 D185	R151-T183 WeakPolarHBondContact CD-O 3.12Å; R151-T183 PolarHBondContact NE-O 2.81Å; R151-D185 WeakPolarHBondContact CB-OD1 3.21Å; R151-D185 IonicContact CZ-OD1 3.04Å; R151-D185 IonicContact CZ-OD2 3.61Å; R151-D185 IonicContact NE-OD1 2.78Å; R151-D185 PolarHBondContact NE-OD1 2.97Å; R151-D185 IonicContact NH2-OD1 3.97Å; R151-D185 PolarHBondContact NH2-OD1 3.4Å; R151-D185 IonicContact NH2-OD2 3.98Å; R151-D185 PolarHBondContact NH2-OD2 3.11Å
152	I	85.8	Confident	75.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.328	C	S	.	.			trans	-115.7	117	170.3	-58.5	173.2	0	0	0	107.9	F130 F135 R150 Y164 G184 I202 V217	F130-I152 HydrophobicContact CD1-CG2 3.86Å; F130-I152 HydrophobicContact CE1-CG2 3.77Å; F135-I152 HydrophobicContact CB-CD1 4.49Å; F135-I152 HydrophobicContact CD2-CD1 4.21Å; F135-I152 HydrophobicContact CD2-CG2 4.14Å; F135-I152 HydrophobicContact CE1-CG2 4.43Å; F135-I152 HydrophobicContact CE2-CG2 3.6Å; F135-I152 HydrophobicContact CG-CD1 4.3Å; F135-I152 HydrophobicContact CG-CG1 4.47Å; F135-I152 HydrophobicContact CZ-CG2 3.76Å; R150-I152 HydrophobicContact CG-CG1 4.34Å; I152-Y164 WeakPolarHBondContact O-CE1 3.31Å; I152-G184 PolarHBondContact N-O 3.4Å; I152-I202 HydrophobicContact CB-CD1 3.63Å; I152-I202 HydrophobicContact CD1-CB 4.46Å; I152-I202 HydrophobicContact CD1-CD1 3.93Å; I152-I202 HydrophobicContact CD1-CG2 4Å; I152-I202 HydrophobicContact CG1-CD1 4.32Å; I152-I202 HydrophobicContact CG2-CD1 3.85Å; I152-I202 HydrophobicContact CG2-CG2 3.98Å; I152-V217 HydrophobicContact CD1-CG2 3.54Å
153	E	83	Confident	74.9	Confident	118 Å²	118	61.6 Å²	61.6	55%	0.551	32%	0.315	S	S	*	.			trans	-109	136.2	-173.4	-170.4	174.2	-175.8	0	0	111	V155	E153-V155 HydrophobicContact CG-CG2 4.16Å
154	A	84.2	Confident	74.9	Confident	8 Å²	8	60.8 Å²	60.8	7%	0.066	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-95.2	122.3	167	0	0	0	0	0	109.1	V129 F130 F162 Y164 A204	V129-A154 HydrophobicContact CB-CB 3.95Å; V129-A154 HydrophobicContact CG2-CB 3.46Å; V129-A154 VanDerWaalsContact CG2-CB 3.46Å; V129-A154 CarbonylContact O-C 3.46Å; V129-A154 WeakPolarHBondContact O-CA 3.32Å; F130-A154 HydrophobicContact CD1-CB 4.42Å; F130-A154 HydrophobicContact CE1-CB 4.23Å; A154-F162 HydrophobicContact CB-CB 4.08Å; A154-F162 HydrophobicContact CB-CD1 4.02Å; A154-F162 HydrophobicContact CB-CD2 3.67Å; A154-F162 HydrophobicContact CB-CE1 4.45Å; A154-F162 HydrophobicContact CB-CE2 4.13Å; A154-F162 HydrophobicContact CB-CG 3.63Å; A154-Y164 HydrophobicContact CB-CE1 3.85Å; A154-Y164 PolarHBondContact N-OH 3.2Å; A154-A204 HydrophobicContact CB-CB 3.59Å
155	V	81.2	Confident	75.3	Confident	95 Å²	95	60.9 Å²	60.9	58%	0.576	31%	0.306	S	S	*	.			trans	-111.2	130.4	179.6	-177	0	0	0	0	109	V129 E153	V129-V155 PolarHBondContact O-N 3.29Å; E153-V155 HydrophobicContact CG-CG2 4.16Å
156	C	76.3	Confident	76	Confident	18 Å²	18	61.5 Å²	61.5	12%	0.122	31%	0.308	C	S	.	.			trans	-135.3	134.4	167.1	-178.6	0	0	0	0	111.2	C126 V129 R158 R159 F162	C126-C156 HydrophobicContact CB-CB 3.77Å; C126-C156 WeakPolarHBondContact CB-SG 3.27Å; C126-C156 WeakPolarHBondContact SG-CB 3.4Å; C126-C156 CovalentContact SG-SG 2.02Å; C126-C156 PolarHBondContact SG-SG 2.76Å; V129-C156 HydrophobicContact CG1-CB 4.37Å; C156-R158 PolarHBondContact O-N 2.8Å; C156-R158 PolarHBondContact SG-N 3.32Å; C156-R158 VanDerWaalsContact SG-N 3.44Å; C156-R159 PolarHBondContact O-N 2.64Å; C156-F162 HydrophobicContact CB-CE2 3.9Å; C156-F162 HydrophobicContact CB-CZ 3.65Å
157	N	71.2	Confident	77	Confident	147 Å²	147	62.7 Å²	62.7	79%	0.786	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.4	176.3	59	-9.6	0	0	0	114	R159	N157-R159 VanDerWaalsContact C-N 3.33Å; N157-R159 PolarHBondContact O-N 3.48Å
158	R	66.8	Low	77.8	Confident	122 Å²	122	65 Å²	65	46%	0.46	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	10.5	179.4	-57.8	-176.9	-177.8	-147.7	-10.8	114.4	E124 C156 Q160	E124-R158 PolarHBondContact O-NH1 3.17Å; E124-R158 IonicContact OE2-CZ 3.45Å; E124-R158 VanDerWaalsContact OE2-CZ 3.27Å; E124-R158 IonicContact OE2-NH1 2.89Å; E124-R158 PolarHBondContact OE2-NH1 2.99Å; E124-R158 IonicContact OE2-NH2 3.78Å; E124-R158 PolarHBondContact OE2-NH2 2.7Å; C156-R158 PolarHBondContact O-N 2.8Å; C156-R158 PolarHBondContact SG-N 3.32Å; C156-R158 VanDerWaalsContact SG-N 3.44Å; R158-Q160 PolarHBondContact O-N 3.05Å; R158-Q160 VanDerWaalsContact O-N 3.13Å
159	R	62.2	Low	78.2	Confident	244 Å²	244	65.4 Å²	65.4	92%	0.921	32%	0.32	S	S	*	.			trans	51.3	34.4	-177.1	-59.1	-174.8	179.9	-173.1	-0.2	113	C156 N157	C156-R159 PolarHBondContact O-N 2.64Å; N157-R159 VanDerWaalsContact C-N 3.33Å; N157-R159 PolarHBondContact O-N 3.48Å
160	Q	64.4	Low	77.9	Confident	26 Å²	26	66.7 Å²	66.7	12%	0.121	34%	0.341	C	S	.	.			trans	-81.8	137.1	178.3	-168.6	163.3	25.9	0	0	109.3	R158 F162 P206 M207	R158-Q160 PolarHBondContact O-N 3.05Å; R158-Q160 VanDerWaalsContact O-N 3.13Å; Q160-F162 HydrophobicContact CB-CE2 4.48Å; Q160-F162 HydrophobicContact CB-CZ 4.37Å; Q160-F162 WeakPolarHBondContact O-CD2 3.5Å; Q160-F162 WeakPolarHBondContact O-CE2 3.23Å; Q160-P206 HydrophobicContact CG-CB 3.94Å; Q160-M207 PolarHBondContact NE2-O 2.94Å
161	A	65.3	Low	76.9	Confident	37 Å²	37	68.5 Å²	68.5	31%	0.306	36%	0.361	S	S	.	.			trans	-84.8	151.4	171.3	0	0	0	0	0	110.9	M207	A161-M207 HydrophobicContact CB-SD 3.75Å; A161-M207 PolarHBondContact O-N 3.29Å
162	F	73.1	Confident	75.7	Confident	14 Å²	14	69.1 Å²	69.1	6%	0.061	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.6	-176.5	-64.8	-84.8	0	0	0	109.9	V129 A154 C156 Q160 Y164 A204 K205 P206	V129-F162 HydrophobicContact CB-CE1 4.14Å; V129-F162 HydrophobicContact CB-CZ 4.07Å; V129-F162 HydrophobicContact CG1-CE1 3.74Å; V129-F162 HydrophobicContact CG1-CZ 3.64Å; V129-F162 HydrophobicContact CG2-CD1 4.31Å; V129-F162 HydrophobicContact CG2-CE1 3.94Å; V129-F162 HydrophobicContact CG2-CZ 4.34Å; A154-F162 HydrophobicContact CB-CB 4.08Å; A154-F162 HydrophobicContact CB-CD1 4.02Å; A154-F162 HydrophobicContact CB-CD2 3.67Å; A154-F162 HydrophobicContact CB-CE1 4.45Å; A154-F162 HydrophobicContact CB-CE2 4.13Å; A154-F162 HydrophobicContact CB-CG 3.63Å; C156-F162 HydrophobicContact CB-CE2 3.9Å; C156-F162 HydrophobicContact CB-CZ 3.65Å; Q160-F162 HydrophobicContact CB-CE2 4.48Å; Q160-F162 HydrophobicContact CB-CZ 4.37Å; Q160-F162 WeakPolarHBondContact O-CD2 3.5Å; Q160-F162 WeakPolarHBondContact O-CE2 3.23Å; F162-Y164 HydrophobicContact CB-CE2 4.39Å; F162-A204 HydrophobicContact CB-CB 4.41Å; F162-A204 HydrophobicContact CD1-CB 4.12Å; F162-A204 HydrophobicContact CG-CB 4.49Å; F162-K205 WeakPolarHBondContact CA-O 3.47Å; F162-P206 HydrophobicContact CD1-CB 3.99Å; F162-P206 HydrophobicContact CD1-CG 4.34Å; F162-P206 HydrophobicContact CE1-CB 3.58Å; F162-P206 HydrophobicContact CE1-CG 3.88Å; F162-P206 HydrophobicContact CZ-CB 4.4Å
163	T	69.7	Low	74.5	Confident	17 Å²	17	74 Å²	74	10%	0.104	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.3	162.9	-36.6	0	0	0	0	108.7	E26 P181 K205	E26-T163 HydrophobicContact CG-CG2 4.48Å; E26-T163 WeakPolarHBondContact OE2-CB 3.35Å; E26-T163 WeakPolarHBondContact OE2-CG2 3.46Å; E26-T163 PolarHBondContact OE2-OG1 2.77Å; T163-P181 WeakPolarHBondContact CA-O 3.34Å; T163-P181 HydrophobicContact CG2-CB 3.8Å; T163-K205 PolarHBondContact N-O 3.4Å; T163-K205 PolarHBondContact O-N 3.05Å
164	Y	77.6	Confident	74.1	Confident	16 Å²	16	75.9 Å²	75.9	6%	0.063	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	142.4	176.2	-56.9	-88.4	0	0	0	111.6	F130 I152 A154 F162 P181 G184 I202 V203 A204	F130-Y164 HydrophobicContact CE1-CD1 4.43Å; F130-Y164 HydrophobicContact CE1-CE1 4.11Å; I152-Y164 WeakPolarHBondContact O-CE1 3.31Å; A154-Y164 HydrophobicContact CB-CE1 3.85Å; A154-Y164 PolarHBondContact N-OH 3.2Å; F162-Y164 HydrophobicContact CB-CE2 4.39Å; Y164-P181 WeakPolarHBondContact CD2-O 3.37Å; Y164-P181 PolarHBondContact N-O 3.13Å; Y164-P181 WeakPolarHBondContact O-CA 3.48Å; Y164-G184 VanDerWaalsContact CD2-CA 3.49Å; Y164-G184 VanDerWaalsContact CD2-N 3.33Å; Y164-I202 HydrophobicContact CD1-CD1 4Å; Y164-I202 HydrophobicContact CD1-CG1 4.43Å; Y164-V203 VanDerWaalsContact CA-O 3.3Å; Y164-V203 WeakPolarHBondContact CA-O 3.12Å; Y164-A204 HydrophobicContact CD1-CB 4.26Å; Y164-A204 HydrophobicContact CE1-CB 4.15Å
165	S	81.3	Confident	74.1	Confident	60 Å²	60	76.5 Å²	76.5	42%	0.42	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	160.5	171.2	61.1	0	0	0	0	111.4	V203	S165-V203 PolarHBondContact N-O 2.87Å; S165-V203 PolarHBondContact O-N 3.44Å
166	L	86	Confident	74.2	Confident	41 Å²	41	72.4 Å²	72.4	22%	0.215	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	139.6	173.3	-59.8	-168.9	0	0	0	110.8	F177 V179 L186 F200 Y201 I202	L166-F177 WeakPolarHBondContact CD1-O 3.39Å; L166-V179 HydrophobicContact CD2-CB 3.9Å; L166-V179 HydrophobicContact CD2-CG1 3.81Å; L166-V179 HydrophobicContact CG-CB 4.17Å; L166-V179 HydrophobicContact CG-CG1 3.85Å; L166-L186 HydrophobicContact CD1-CD1 4.3Å; L166-L186 HydrophobicContact CD2-CD1 4.12Å; L166-F200 HydrophobicContact CD1-CD2 4.23Å; L166-F200 HydrophobicContact CD1-CE2 4.11Å; L166-F200 HydrophobicContact CD2-CD2 3.73Å; L166-F200 HydrophobicContact CD2-CE2 3.71Å; L166-F200 HydrophobicContact CG-CD2 4.45Å; L166-Y201 WeakPolarHBondContact CA-O 3.48Å; L166-I202 HydrophobicContact CD2-CB 4.43Å; L166-I202 HydrophobicContact CD2-CG1 4.44Å
167	E	86.8	Confident	74.6	Confident	62 Å²	62	71.8 Å²	71.8	29%	0.29	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.2	171.6	-174.3	179.9	152.6	0	0	108.8	Y201 V203 K214	E167-Y201 PolarHBondContact N-O 3.36Å; E167-Y201 PolarHBondContact O-N 2.86Å; E167-V203 HydrophobicContact CB-CG2 3.85Å; E167-K214 IonicContact OE1-NZ 3.43Å; E167-K214 PolarHBondContact OE1-NZ 3.46Å; E167-K214 WeakPolarHBondContact OE2-CE 3.27Å; E167-K214 IonicContact OE2-NZ 3.67Å; E167-K214 PolarHBondContact OE2-NZ 2.49Å
168	P	85.4	Confident	75.2	Confident	64 Å²	64	68.5 Å²	68.5	42%	0.416	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	149.2	-177	23.9	-30.7	0	0	0	112.2	N172	P168-N172 WeakPolarHBondContact CB-O 3.39Å
169	V	86.7	Confident	75.8	Confident	39 Å²	39	63 Å²	63	24%	0.236	35%	0.349	C	S	.	.	S	Bend	trans	-90.5	113.6	171.4	173.6	0	0	0	0	108.5	Q199 Y201 L216	V169-Q199 HydrophobicContact CB-CB 4.43Å; V169-Q199 HydrophobicContact CG2-CB 4.38Å; V169-Y201 HydrophobicContact CG2-CD2 3.74Å; V169-Y201 HydrophobicContact CG2-CE2 3.6Å; V169-Y201 HydrophobicContact CG2-CG 4.44Å; V169-L216 HydrophobicContact CG2-CD1 3.78Å
170	G	79	Confident	76.2	Confident	65 Å²	65	52.1 Å²	52.1	67%	0.67	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	-142.3	179.2	0	0	0	0	0	113.2	N172	G170-N172 PolarHBondContact O-N 3.28Å
171	N	66.6	Low	76.4	Confident	171 Å²	171	52.8 Å²	52.8	91%	0.914	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	10.7	-178.3	-71.6	-7.7	0	0	0	113.8	S173	N171-S173 PolarHBondContact O-N 2.95Å
172	N	57.1	Low	76.3	Confident	86 Å²	86	54.2 Å²	54.2	46%	0.46	32%	0.318	S	S	.	.			trans	-67.9	98.3	176.4	-90.9	-6	0	0	0	110	P168 G170 H174	P168-N172 WeakPolarHBondContact CB-O 3.39Å; G170-N172 PolarHBondContact O-N 3.28Å; N172-H174 PolarHBondContact O-N 2.85Å
173	S	61.4	Low	76	Confident	104 Å²	104	54.7 Å²	54.7	73%	0.727	32%	0.322	S	S	*	.			trans	-59.7	124.5	172.7	60	0	0	0	0	109.9	N171	N171-S173 PolarHBondContact O-N 2.95Å
174	H	73	Confident	76.2	Confident	157 Å²	157	53.9 Å²	53.9	73%	0.727	32%	0.317	S	S	*	.			trans	24.5	90.3	168	-61.1	82.6	0	0	0	115.2	N172	N172-H174 PolarHBondContact O-N 2.85Å
175	P	84.3	Confident	76	Confident	21 Å²	21	53.3 Å²	53.3	14%	0.136	32%	0.315	C	S	.	.			trans	-57.3	157.2	178.5	26.9	-35.3	0	0	0	110.8	F177 Y198 F200	P175-F177 HydrophobicContact CB-CD2 4.28Å; P175-F177 PolarHBondContact O-N 3.21Å; P175-Y198 HydrophobicContact CB-CD1 4.36Å; P175-F200 HydrophobicContact CB-CD1 3.74Å; P175-F200 HydrophobicContact CB-CE1 4.05Å; P175-F200 HydrophobicContact CG-CB 4.19Å; P175-F200 HydrophobicContact CG-CD1 3.57Å; P175-F200 HydrophobicContact CG-CE1 4.12Å; P175-F200 HydrophobicContact CG-CG 4Å
176	P	85.1	Confident	76.1	Confident	9 Å²	9	50.5 Å²	50.5	6%	0.058	30%	0.295	C	S	.	.	S	Bend	trans	-74.6	33.9	-179.1	34.8	-38.1	0	0	0	112.7	T189 R190 L192 Y198	P176-T189 WeakPolarHBondContact CA-OG1 3.46Å; P176-T189 PolarHBondContact O-N 3.01Å; P176-T189 PolarHBondContact O-OG1 2.83Å; P176-R190 HydrophobicContact CB-CB 3.81Å; P176-R190 HydrophobicContact CB-CG 4.44Å; P176-L192 HydrophobicContact CB-CD2 4.14Å; P176-L192 HydrophobicContact CG-CD2 3.78Å; P176-Y198 HydrophobicContact CG-CD1 4.24Å; P176-Y198 HydrophobicContact CG-CD2 4.2Å; P176-Y198 HydrophobicContact CG-CE1 3.74Å; P176-Y198 HydrophobicContact CG-CE2 3.67Å; P176-Y198 HydrophobicContact CG-CG 4.43Å; P176-Y198 VanDerWaalsContact CG-CZ 3.4Å
177	F	84.7	Confident	75.7	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	153.8	179.8	-57.5	-85.3	0	0	0	109.3	V149 L166 P175 L186 F187 T188 T189 L192 Y198 F200 I219 I221	V149-F177 HydrophobicContact CG2-CD1 4.22Å; V149-F177 HydrophobicContact CG2-CE1 3.98Å; L166-F177 WeakPolarHBondContact CD1-O 3.39Å; P175-F177 HydrophobicContact CB-CD2 4.28Å; P175-F177 PolarHBondContact O-N 3.21Å; F177-L186 HydrophobicContact CB-CD1 4.02Å; F177-F187 CarbonylContact C-O 3.43Å; F177-F187 WeakPolarHBondContact CA-O 3.07Å; F177-T188 HydrophobicContact CD1-CG2 4.11Å; F177-T188 HydrophobicContact CE1-CG2 3.78Å; F177-T189 PolarHBondContact N-OG1 3.3Å; F177-L192 HydrophobicContact CE1-CD1 4.42Å; F177-L192 HydrophobicContact CE1-CD2 4.09Å; F177-L192 HydrophobicContact CE2-CD2 4.09Å; F177-L192 HydrophobicContact CZ-CD1 4.25Å; F177-L192 HydrophobicContact CZ-CD2 3.55Å; F177-Y198 AromaticContact CE2-CD2 3.6Å; F177-Y198 HydrophobicContact CE2-CD2 3.6Å; F177-Y198 HydrophobicContact CE2-CE2 4.16Å; F177-Y198 AromaticContact CE2-CG 3.97Å; F177-Y198 HydrophobicContact CE2-CG 3.97Å; F177-Y198 HydrophobicContact CZ-CD2 4.36Å; F177-F200 HydrophobicContact CB-CE1 4.15Å; F177-F200 HydrophobicContact CB-CZ 3.91Å; F177-F200 AromaticContact CD2-CE1 3.75Å; F177-F200 HydrophobicContact CD2-CE1 3.75Å; F177-F200 HydrophobicContact CD2-CZ 4.19Å; F177-F200 HydrophobicContact CG-CE1 4.16Å; F177-F200 HydrophobicContact CG-CZ 4.13Å; F177-I219 HydrophobicContact CD1-CD1 3.89Å; F177-I219 HydrophobicContact CD2-CD1 3.74Å; F177-I219 HydrophobicContact CE1-CD1 3.71Å; F177-I219 HydrophobicContact CE2-CB 4.49Å; F177-I219 HydrophobicContact CE2-CD1 3.55Å; F177-I219 HydrophobicContact CE2-CG2 4.21Å; F177-I219 HydrophobicContact CG-CD1 3.91Å; F177-I219 HydrophobicContact CZ-CD1 3.55Å; F177-I219 HydrophobicContact CZ-CG2 3.81Å; F177-I221 HydrophobicContact CZ-CD1 4.31Å
178	D	83.3	Confident	75.3	Confident	77 Å²	77	47.8 Å²	47.8	41%	0.412	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	164	170.1	-166.1	12.3	0	0	0	109	L186 F187 T189	D178-L186 CarbonylContact O-C 3.54Å; D178-L186 WeakPolarHBondContact O-CA 3.42Å; D178-F187 HydrophobicContact CB-CE1 4.2Å; D178-F187 HydrophobicContact CB-CE2 3.86Å; D178-F187 HydrophobicContact CB-CZ 3.63Å; D178-F187 PolarHBondContact N-O 3.22Å; D178-F187 WeakPolarHBondContact O-CD1 3.49Å; D178-F187 PolarHBondContact O-N 3.45Å; D178-T189 HydrophobicContact CB-CG2 3.46Å; D178-T189 VanDerWaalsContact CB-CG2 3.46Å
179	V	78.5	Confident	74.7	Confident	6 Å²	6	47.2 Å²	47.2	4%	0.036	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.2	-178.4	69.3	0	0	0	0	110.4	L166 P181 D185 I202	L166-V179 HydrophobicContact CD2-CB 3.9Å; L166-V179 HydrophobicContact CD2-CG1 3.81Å; L166-V179 HydrophobicContact CG-CB 4.17Å; L166-V179 HydrophobicContact CG-CG1 3.85Å; V179-P181 WeakPolarHBondContact O-CD 3.34Å; V179-D185 CarbonylContact C-O 3.53Å; V179-D185 WeakPolarHBondContact CA-O 3.4Å; V179-I202 HydrophobicContact CG2-CD1 3.97Å
180	D	71.4	Confident	74.3	Confident	17 Å²	17	52.5 Å²	52.5	9%	0.091	29%	0.292	C	S	.	.			trans	-69.1	122.7	170	177.7	-81.9	0	0	0	109.1	R104 L182 T183 G184 D185 F187	R104-D180 IonicContact CZ-OD2 3.81Å; R104-D180 IonicContact NH1-OD2 3.97Å; R104-D180 PolarHBondContact NH1-OD2 3.37Å; D180-L182 PolarHBondContact O-N 2.95Å; D180-L182 VanDerWaalsContact O-N 3.13Å; D180-L182 WeakPolarHBondContact OD1-CB 3.07Å; D180-L182 PolarHBondContact OD1-N 2.75Å; D180-T183 VanDerWaalsContact CB-OG1 3.25Å; D180-T183 WeakPolarHBondContact CB-OG1 3.46Å; D180-T183 VanDerWaalsContact CG-OG1 3.24Å; D180-T183 PolarHBondContact O-N 2.02Å; D180-T183 PolarHBondContact OD1-N 2.65Å; D180-T183 PolarHBondContact OD1-OG1 2.99Å; D180-G184 WeakPolarHBondContact O-CA 3.47Å; D180-G184 PolarHBondContact O-N 2.66Å; D180-D185 HydrophobicContact CB-CB 4.2Å; D180-D185 PolarHBondContact N-O 3.39Å; D180-F187 HydrophobicContact CB-CE1 4.48Å
181	P	68.6	Low	74.2	Confident	39 Å²	39	59.3 Å²	59.3	25%	0.253	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.7	-170	26.2	-35	0	0	0	113.5	R104 T163 Y164 V179	R104-P181 HydrophobicContact CB-CG 4.48Å; T163-P181 WeakPolarHBondContact CA-O 3.34Å; T163-P181 HydrophobicContact CG2-CB 3.8Å; Y164-P181 WeakPolarHBondContact CD2-O 3.37Å; Y164-P181 PolarHBondContact N-O 3.13Å; Y164-P181 WeakPolarHBondContact O-CA 3.48Å; V179-P181 WeakPolarHBondContact O-CD 3.34Å
182	L	63.4	Low	75	Confident	68 Å²	68	51.8 Å²	51.8	36%	0.356	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-42.8	-177.5	-146.1	100.1	0	0	0	111.5	I106 D180	I106-L182 HydrophobicContact CD1-CD1 3.37Å; I106-L182 HydrophobicContact CD1-CG 4.47Å; I106-L182 HydrophobicContact CG1-CD1 3.53Å; D180-L182 PolarHBondContact O-N 2.95Å; D180-L182 VanDerWaalsContact O-N 3.13Å; D180-L182 WeakPolarHBondContact OD1-CB 3.07Å; D180-L182 PolarHBondContact OD1-N 2.75Å
183	T	67.2	Low	76.1	Confident	24 Å²	24	50.2 Å²	50.2	15%	0.147	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-18.8	-168.9	59.5	0	0	0	0	113	R151 D180 D185 L265	R151-T183 WeakPolarHBondContact CD-O 3.12Å; R151-T183 PolarHBondContact NE-O 2.81Å; D180-T183 VanDerWaalsContact CB-OG1 3.25Å; D180-T183 WeakPolarHBondContact CB-OG1 3.46Å; D180-T183 VanDerWaalsContact CG-OG1 3.24Å; D180-T183 PolarHBondContact O-N 2.02Å; D180-T183 PolarHBondContact OD1-N 2.65Å; D180-T183 PolarHBondContact OD1-OG1 2.99Å; T183-D185 PolarHBondContact O-N 3.48Å; T183-D185 WeakPolarHBondContact OG1-CB 3.32Å; T183-D185 PolarHBondContact OG1-N 2.88Å; T183-L265 HydrophobicContact CG2-CD1 3.53Å
184	G	72.8	Confident	76.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.239	C	C	.	.			trans	70.7	18.3	-171.8	0	0	0	0	0	112.9	I152 Y164 D180 L186	I152-G184 PolarHBondContact N-O 3.4Å; Y164-G184 VanDerWaalsContact CD2-CA 3.49Å; Y164-G184 VanDerWaalsContact CD2-N 3.33Å; D180-G184 WeakPolarHBondContact O-CA 3.47Å; D180-G184 PolarHBondContact O-N 2.66Å; G184-L186 PolarHBondContact O-N 2.96Å
185	D	74.4	Confident	76.2	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	111.6	175.8	-78.1	-13.4	0	0	0	110.2	T148 R151 V179 D180 T183 F187	T148-D185 HydrophobicContact CG2-CB 3.94Å; R151-D185 WeakPolarHBondContact CB-OD1 3.21Å; R151-D185 IonicContact CZ-OD1 3.04Å; R151-D185 IonicContact CZ-OD2 3.61Å; R151-D185 IonicContact NE-OD1 2.78Å; R151-D185 PolarHBondContact NE-OD1 2.97Å; R151-D185 IonicContact NH2-OD1 3.97Å; R151-D185 PolarHBondContact NH2-OD1 3.4Å; R151-D185 IonicContact NH2-OD2 3.98Å; R151-D185 PolarHBondContact NH2-OD2 3.11Å; V179-D185 CarbonylContact C-O 3.53Å; V179-D185 WeakPolarHBondContact CA-O 3.4Å; D180-D185 HydrophobicContact CB-CB 4.2Å; D180-D185 PolarHBondContact N-O 3.39Å; T183-D185 PolarHBondContact O-N 3.48Å; T183-D185 WeakPolarHBondContact OG1-CB 3.32Å; T183-D185 PolarHBondContact OG1-N 2.88Å; D185-F187 WeakPolarHBondContact O-CD1 3.11Å
186	L	83	Confident	76.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.8	172.2	-173.9	71.3	0	0	0	109.2	L137 T148 V149 R150 L166 F177 D178 G184 F200 V217 I219	L137-L186 HydrophobicContact CD1-CD2 3.9Å; T148-L186 CarbonylContact C-O 3.59Å; T148-L186 WeakPolarHBondContact CA-O 3.29Å; V149-L186 PolarHBondContact N-O 2.96Å; R150-L186 PolarHBondContact N-O 2.94Å; R150-L186 WeakPolarHBondContact O-CB 3.42Å; R150-L186 PolarHBondContact O-N 2.73Å; L166-L186 HydrophobicContact CD1-CD1 4.3Å; L166-L186 HydrophobicContact CD2-CD1 4.12Å; F177-L186 HydrophobicContact CB-CD1 4.02Å; D178-L186 CarbonylContact O-C 3.54Å; D178-L186 WeakPolarHBondContact O-CA 3.42Å; G184-L186 PolarHBondContact O-N 2.96Å; L186-F200 HydrophobicContact CD1-CE2 3.71Å; L186-F200 HydrophobicContact CD1-CZ 3.8Å; L186-F200 HydrophobicContact CD2-CE2 4.29Å; L186-F200 HydrophobicContact CD2-CZ 4.03Å; L186-F200 HydrophobicContact CG-CZ 4.48Å; L186-V217 HydrophobicContact CD2-CG1 4.09Å; L186-I219 HydrophobicContact CD2-CD1 4.12Å
187	F	77.8	Confident	76.2	Confident	46 Å²	46	56.6 Å²	56.6	20%	0.202	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	158.2	-178	61.8	-90.4	0	0	0	112.5	S147 F177 D178 D180 D185 T189	S147-F187 VanDerWaalsContact O-CA 3.27Å; S147-F187 WeakPolarHBondContact O-CA 3.35Å; S147-F187 WeakPolarHBondContact O-CB 3.36Å; F177-F187 CarbonylContact C-O 3.43Å; F177-F187 WeakPolarHBondContact CA-O 3.07Å; D178-F187 HydrophobicContact CB-CE1 4.2Å; D178-F187 HydrophobicContact CB-CE2 3.86Å; D178-F187 HydrophobicContact CB-CZ 3.63Å; D178-F187 PolarHBondContact N-O 3.22Å; D178-F187 WeakPolarHBondContact O-CD1 3.49Å; D178-F187 PolarHBondContact O-N 3.45Å; D180-F187 HydrophobicContact CB-CE1 4.48Å; D185-F187 WeakPolarHBondContact O-CD1 3.11Å; F187-T189 HydrophobicContact CD2-CG2 4.28Å; F187-T189 HydrophobicContact CE2-CG2 3.87Å
188	T	77.1	Confident	76.4	Confident	1 Å²	1	58 Å²	58	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	132.4	178.9	54.2	0	0	0	0	111.4	T143 A144 V145 G146 S147 V149 F177 L192	T143-T188 HydrophobicContact CG2-CG2 4.05Å; A144-T188 PolarHBondContact O-OG1 2.68Å; V145-T188 WeakPolarHBondContact CA-OG1 3.43Å; G146-T188 VanDerWaalsContact CA-O 3.31Å; G146-T188 WeakPolarHBondContact CA-O 3.39Å; G146-T188 PolarHBondContact N-O 2.82Å; G146-T188 PolarHBondContact N-OG1 2.87Å; S147-T188 PolarHBondContact N-OG1 3.49Å; S147-T188 PolarHBondContact O-N 3.13Å; V149-T188 HydrophobicContact CG2-CG2 3.84Å; F177-T188 HydrophobicContact CD1-CG2 4.11Å; F177-T188 HydrophobicContact CE1-CG2 3.78Å; T188-L192 HydrophobicContact CG2-CD1 3.91Å; T188-L192 HydrophobicContact CG2-CD2 4.4Å; T188-L192 HydrophobicContact CG2-CG 4.38Å
189	T	74	Confident	76.9	Confident	51 Å²	51	58.9 Å²	58.9	31%	0.313	29%	0.291	S	S	.	.			trans	-103.7	-21.4	175.8	57.2	0	0	0	0	113.1	V145 P176 F177 D178 F187	V145-T189 VanDerWaalsContact CG1-O 3.27Å; V145-T189 WeakPolarHBondContact CG1-O 3.23Å; P176-T189 WeakPolarHBondContact CA-OG1 3.46Å; P176-T189 PolarHBondContact O-N 3.01Å; P176-T189 PolarHBondContact O-OG1 2.83Å; F177-T189 PolarHBondContact N-OG1 3.3Å; D178-T189 HydrophobicContact CB-CG2 3.46Å; D178-T189 VanDerWaalsContact CB-CG2 3.46Å; F187-T189 HydrophobicContact CD2-CG2 4.28Å; F187-T189 HydrophobicContact CE2-CG2 3.87Å
190	R	77.4	Confident	77.5	Confident	151 Å²	151	58.7 Å²	58.7	57%	0.57	29%	0.289	S	S	*	.	S	Bend	trans	-137.9	169.3	-179.7	-56.3	179.9	-175	-177.8	1.5	110.5	P176	P176-R190 HydrophobicContact CB-CB 3.81Å; P176-R190 HydrophobicContact CB-CG 4.44Å
191	R	76.9	Confident	78.6	Confident	207 Å²	207	62 Å²	62	78%	0.781	30%	0.301	S	S	*	.			trans	-66.2	139.6	173.4	-79.1	-166.1	173.5	-175.2	-1.4	109.4	V145	V145-R191 HydrophobicContact CG2-CG 4Å
192	L	84.4	Confident	79.7	Confident	14 Å²	14	60.1 Å²	60.1	7%	0.073	29%	0.289	C	S	.	.			trans	-89.3	139.1	178.1	-53.1	176.4	0	0	0	108.2	V139 P176 F177 T188 I221	V139-L192 HydrophobicContact CB-CD1 4.33Å; V139-L192 HydrophobicContact CG1-CD1 3.47Å; V139-L192 VanDerWaalsContact CG1-CD1 3.47Å; P176-L192 HydrophobicContact CB-CD2 4.14Å; P176-L192 HydrophobicContact CG-CD2 3.78Å; F177-L192 HydrophobicContact CE1-CD1 4.42Å; F177-L192 HydrophobicContact CE1-CD2 4.09Å; F177-L192 HydrophobicContact CE2-CD2 4.09Å; F177-L192 HydrophobicContact CZ-CD1 4.25Å; F177-L192 HydrophobicContact CZ-CD2 3.55Å; T188-L192 HydrophobicContact CG2-CD1 3.91Å; T188-L192 HydrophobicContact CG2-CD2 4.4Å; T188-L192 HydrophobicContact CG2-CG 4.38Å; L192-I221 HydrophobicContact CB-CD1 4.07Å; L192-I221 HydrophobicContact CB-CG1 4.42Å; L192-I221 HydrophobicContact CB-CG2 4.36Å; L192-I221 HydrophobicContact CD1-CD1 3.77Å; L192-I221 HydrophobicContact CD2-CD1 4.23Å; L192-I221 HydrophobicContact CG-CD1 4.23Å
193	S	79.9	Confident	81	Confident	53 Å²	53	57.2 Å²	57.2	37%	0.371	27%	0.274	S	S	.	.			trans	-107.2	143.8	169.5	64	0	0	0	0	109.4	E195 N196	S193-E195 PolarHBondContact O-N 2.96Å; S193-N196 PolarHBondContact O-N 3.4Å; S193-N196 VanDerWaalsContact OG-CG 3.28Å; S193-N196 PolarHBondContact OG-ND2 2.9Å
194	E	68.5	Low	81.9	Confident	94 Å²	94	56 Å²	56	44%	0.439	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.4	-173.1	-70.5	173.2	-179	0	0	113.4	S141 N196 Q223	S141-E194 WeakPolarHBondContact OG-CG 3.44Å; S141-E194 PolarHBondContact OG-OE1 3.06Å; E194-N196 VanDerWaalsContact C-N 3.25Å; E194-N196 PolarHBondContact O-N 3.04Å; E194-Q223 WeakPolarHBondContact OE1-CG 3.28Å; E194-Q223 PolarHBondContact OE1-NE2 2.85Å; E194-Q223 PolarHBondContact OE2-NE2 3.42Å
195	E	68.3	Low	82.2	Confident	189 Å²	189	59.2 Å²	59.2	88%	0.883	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.3	-174.7	-64.6	174.5	-178.8	0	0	113.8	S193	S193-E195 PolarHBondContact O-N 2.96Å
196	N	81	Confident	82	Confident	67 Å²	67	59.3 Å²	59.3	36%	0.358	28%	0.281	S	S	.	.			trans	-102.7	139.3	-172.2	-71.1	-16.2	0	0	0	112.9	S193 E194 Y198 I221	S193-N196 PolarHBondContact O-N 3.4Å; S193-N196 VanDerWaalsContact OG-CG 3.28Å; S193-N196 PolarHBondContact OG-ND2 2.9Å; E194-N196 VanDerWaalsContact C-N 3.25Å; E194-N196 PolarHBondContact O-N 3.04Å; N196-Y198 HydrophobicContact CB-CD2 4.45Å; N196-Y198 HydrophobicContact CB-CE1 4.2Å; N196-Y198 HydrophobicContact CB-CE2 3.6Å; N196-Y198 VanDerWaalsContact CB-CZ 3.45Å; N196-Y198 WeakPolarHBondContact CB-OH 3.43Å; N196-Y198 PolarHBondContact ND2-OH 2.92Å; N196-I221 WeakPolarHBondContact O-CB 3.28Å; N196-I221 WeakPolarHBondContact O-CG1 3.47Å
197	A	87.5	Confident	80.9	Confident	75 Å²	75	61 Å²	61	62%	0.62	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	143.8	161.3	0	0	0	0	0	108.7	I219	A197-I219 WeakPolarHBondContact CA-O 3.3Å
198	Y	89.9	Confident	79.6	Confident	36 Å²	36	61.2 Å²	61.2	14%	0.141	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.1	-177.5	-58.5	-79.6	0	0	0	110.9	P175 P176 F177 N196 I219 I221	P175-Y198 HydrophobicContact CB-CD1 4.36Å; P176-Y198 HydrophobicContact CG-CD1 4.24Å; P176-Y198 HydrophobicContact CG-CD2 4.2Å; P176-Y198 HydrophobicContact CG-CE1 3.74Å; P176-Y198 HydrophobicContact CG-CE2 3.67Å; P176-Y198 HydrophobicContact CG-CG 4.43Å; P176-Y198 VanDerWaalsContact CG-CZ 3.4Å; F177-Y198 AromaticContact CE2-CD2 3.6Å; F177-Y198 HydrophobicContact CE2-CD2 3.6Å; F177-Y198 HydrophobicContact CE2-CE2 4.16Å; F177-Y198 AromaticContact CE2-CG 3.97Å; F177-Y198 HydrophobicContact CE2-CG 3.97Å; F177-Y198 HydrophobicContact CZ-CD2 4.36Å; N196-Y198 HydrophobicContact CB-CD2 4.45Å; N196-Y198 HydrophobicContact CB-CE1 4.2Å; N196-Y198 HydrophobicContact CB-CE2 3.6Å; N196-Y198 VanDerWaalsContact CB-CZ 3.45Å; N196-Y198 WeakPolarHBondContact CB-OH 3.43Å; N196-Y198 PolarHBondContact ND2-OH 2.92Å; Y198-I219 PolarHBondContact N-O 2.87Å; Y198-I219 PolarHBondContact O-N 2.83Å; Y198-I221 HydrophobicContact CD2-CD1 4.47Å; Y198-I221 HydrophobicContact CD2-CG1 4.36Å; Y198-I221 HydrophobicContact CE2-CD1 4.39Å; Y198-I221 HydrophobicContact CE2-CG1 4.08Å
199	Q	92.1	Very high	78.9	Confident	95 Å²	95	62 Å²	62	44%	0.444	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.5	174	-60.9	-170.8	-44.8	0	0	109.9	V169 V217 D218	V169-Q199 HydrophobicContact CB-CB 4.43Å; V169-Q199 HydrophobicContact CG2-CB 4.38Å; Q199-V217 WeakPolarHBondContact CA-O 3.35Å; Q199-D218 VanDerWaalsContact CG-OD1 3.26Å; Q199-D218 WeakPolarHBondContact CG-OD1 3.42Å; Q199-D218 PolarHBondContact NE2-OD1 2.94Å
200	F	92.6	Very high	78.6	Confident	1 Å²	1	69 Å²	69	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	157.6	174.1	48.4	-92.8	0	0	0	109.9	L166 P175 F177 L186 V217 I219	L166-F200 HydrophobicContact CD1-CD2 4.23Å; L166-F200 HydrophobicContact CD1-CE2 4.11Å; L166-F200 HydrophobicContact CD2-CD2 3.73Å; L166-F200 HydrophobicContact CD2-CE2 3.71Å; L166-F200 HydrophobicContact CG-CD2 4.45Å; P175-F200 HydrophobicContact CB-CD1 3.74Å; P175-F200 HydrophobicContact CB-CE1 4.05Å; P175-F200 HydrophobicContact CG-CB 4.19Å; P175-F200 HydrophobicContact CG-CD1 3.57Å; P175-F200 HydrophobicContact CG-CE1 4.12Å; P175-F200 HydrophobicContact CG-CG 4Å; F177-F200 HydrophobicContact CB-CE1 4.15Å; F177-F200 HydrophobicContact CB-CZ 3.91Å; F177-F200 AromaticContact CD2-CE1 3.75Å; F177-F200 HydrophobicContact CD2-CE1 3.75Å; F177-F200 HydrophobicContact CD2-CZ 4.19Å; F177-F200 HydrophobicContact CG-CE1 4.16Å; F177-F200 HydrophobicContact CG-CZ 4.13Å; L186-F200 HydrophobicContact CD1-CE2 3.71Å; L186-F200 HydrophobicContact CD1-CZ 3.8Å; L186-F200 HydrophobicContact CD2-CE2 4.29Å; L186-F200 HydrophobicContact CD2-CZ 4.03Å; L186-F200 HydrophobicContact CG-CZ 4.48Å; F200-V217 HydrophobicContact CD2-CB 3.97Å; F200-V217 HydrophobicContact CD2-CG2 4.25Å; F200-V217 HydrophobicContact CE2-CB 3.69Å; F200-V217 HydrophobicContact CE2-CG1 3.91Å; F200-V217 HydrophobicContact CE2-CG2 3.97Å; F200-V217 HydrophobicContact CZ-CB 4.15Å; F200-V217 HydrophobicContact CZ-CG1 3.94Å; F200-V217 PolarHBondContact N-O 2.75Å; F200-V217 PolarHBondContact O-N 3.44Å; F200-I219 HydrophobicContact CE1-CD1 3.71Å; F200-I219 HydrophobicContact CE1-CG1 4.32Å; F200-I219 HydrophobicContact CZ-CD1 3.62Å; F200-I219 HydrophobicContact CZ-CG1 4.4Å
201	Y	93.3	Very high	78.5	Confident	86 Å²	86	66.1 Å²	66.1	34%	0.337	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.7	169.4	-66.8	-70.1	0	0	0	109.7	L166 E167 V169 K214 A215 L216	L166-Y201 WeakPolarHBondContact CA-O 3.48Å; E167-Y201 PolarHBondContact N-O 3.36Å; E167-Y201 PolarHBondContact O-N 2.86Å; V169-Y201 HydrophobicContact CG2-CD2 3.74Å; V169-Y201 HydrophobicContact CG2-CE2 3.6Å; V169-Y201 HydrophobicContact CG2-CG 4.44Å; Y201-K214 HydrophobicContact CD1-CB 4.28Å; Y201-A215 CarbonylContact C-O 3.47Å; Y201-A215 WeakPolarHBondContact CA-O 3.21Å; Y201-L216 HydrophobicContact CD1-CB 4.32Å; Y201-L216 HydrophobicContact CD1-CD1 4.17Å; Y201-L216 HydrophobicContact CE1-CB 4.12Å; Y201-L216 HydrophobicContact CE1-CD1 3.86Å
202	I	91.9	Very high	78.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.5	156.1	-170.9	174.5	0	0	0	108.5	F130 I152 Y164 L166 V179 K214 A215 V217	F130-I202 HydrophobicContact CE1-CG2 4.25Å; F130-I202 HydrophobicContact CE2-CG2 4.35Å; F130-I202 WeakPolarHBondContact CE2-O 3.34Å; F130-I202 HydrophobicContact CZ-CG1 4.36Å; F130-I202 HydrophobicContact CZ-CG2 3.91Å; I152-I202 HydrophobicContact CB-CD1 3.63Å; I152-I202 HydrophobicContact CD1-CB 4.46Å; I152-I202 HydrophobicContact CD1-CD1 3.93Å; I152-I202 HydrophobicContact CD1-CG2 4Å; I152-I202 HydrophobicContact CG1-CD1 4.32Å; I152-I202 HydrophobicContact CG2-CD1 3.85Å; I152-I202 HydrophobicContact CG2-CG2 3.98Å; Y164-I202 HydrophobicContact CD1-CD1 4Å; Y164-I202 HydrophobicContact CD1-CG1 4.43Å; L166-I202 HydrophobicContact CD2-CB 4.43Å; L166-I202 HydrophobicContact CD2-CG1 4.44Å; V179-I202 HydrophobicContact CG2-CD1 3.97Å; I202-K214 WeakPolarHBondContact O-CA 3.37Å; I202-A215 HydrophobicContact CG2-CB 4Å; I202-A215 PolarHBondContact N-O 2.82Å; I202-A215 PolarHBondContact O-N 3.25Å; I202-V217 HydrophobicContact CB-CG2 4.13Å; I202-V217 HydrophobicContact CG2-CG2 3.87Å
203	V	90.5	Very high	79.2	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.9	-178.6	-172.1	0	0	0	0	108.4	Y164 S165 E167 R212 S213 K214	Y164-V203 VanDerWaalsContact CA-O 3.3Å; Y164-V203 WeakPolarHBondContact CA-O 3.12Å; S165-V203 PolarHBondContact N-O 2.87Å; S165-V203 PolarHBondContact O-N 3.44Å; E167-V203 HydrophobicContact CB-CG2 3.85Å; V203-R212 HydrophobicContact CG1-CB 3.8Å; V203-S213 CarbonylContact C-O 3.59Å; V203-S213 WeakPolarHBondContact CA-O 3.23Å; V203-K214 HydrophobicContact CG1-CG 4.45Å; V203-K214 HydrophobicContact CG2-CG 4.16Å
204	A	87.2	Confident	79.9	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.5	168.5	0	0	0	0	0	109	V129 F130 A154 F162 Y164 S213	V129-A204 HydrophobicContact CG2-CB 3.84Å; F130-A204 HydrophobicContact CE1-CB 3.79Å; F130-A204 HydrophobicContact CE2-CB 3.87Å; F130-A204 HydrophobicContact CZ-CB 3.3Å; A154-A204 HydrophobicContact CB-CB 3.59Å; F162-A204 HydrophobicContact CB-CB 4.41Å; F162-A204 HydrophobicContact CD1-CB 4.12Å; F162-A204 HydrophobicContact CG-CB 4.49Å; Y164-A204 HydrophobicContact CD1-CB 4.26Å; Y164-A204 HydrophobicContact CE1-CB 4.15Å; A204-S213 PolarHBondContact N-O 2.71Å; A204-S213 PolarHBondContact O-N 3.38Å
205	K	78.1	Confident	81.1	Confident	67 Å²	67	59.8 Å²	59.8	29%	0.291	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	108.5	179.3	-173.9	177.4	167.5	-166.8	0	109.7	E26 F162 T163 M207	E26-K205 IonicContact OE1-NZ 3.99Å; E26-K205 PolarHBondContact OE1-NZ 3.4Å; E26-K205 IonicContact OE2-NZ 2.81Å; F162-K205 WeakPolarHBondContact CA-O 3.47Å; T163-K205 PolarHBondContact N-O 3.4Å; T163-K205 PolarHBondContact O-N 3.05Å; K205-M207 PolarHBondContact O-N 3.33Å
206	P	69.9	Low	82.4	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.032	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	133.6	167.9	16.6	-25.1	0	0	0	109.9	Q160 F162 I209 K211	Q160-P206 HydrophobicContact CG-CB 3.94Å; F162-P206 HydrophobicContact CD1-CB 3.99Å; F162-P206 HydrophobicContact CD1-CG 4.34Å; F162-P206 HydrophobicContact CE1-CB 3.58Å; F162-P206 HydrophobicContact CE1-CG 3.88Å; F162-P206 HydrophobicContact CZ-CB 4.4Å; P206-I209 HydrophobicContact CB-CB 4.5Å; P206-I209 HydrophobicContact CB-CD1 4.19Å; P206-I209 HydrophobicContact CG-CB 4.3Å; P206-I209 HydrophobicContact CG-CD1 4.4Å; P206-I209 PolarHBondContact O-N 2.83Å; P206-K211 VanDerWaalsContact CD-O 3.28Å; P206-K211 WeakPolarHBondContact CD-O 3.2Å
207	M	60.6	Low	83	Confident	36 Å²	36	48.5 Å²	48.5	18%	0.177	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	146.8	-176.4	-53.6	141.5	57.4	0	0	112.6	R27 Q160 A161 K205 I209	R27-M207 HydrophobicContact CB-CE 3.63Å; R27-M207 HydrophobicContact CB-CG 4.1Å; R27-M207 HydrophobicContact CB-SD 4.34Å; R27-M207 WeakPolarHBondContact CD-SD 3.46Å; R27-M207 HydrophobicContact CG-CE 3.22Å; R27-M207 HydrophobicContact CG-CG 4.49Å; R27-M207 HydrophobicContact CG-SD 4.09Å; R27-M207 PolarHBondContact NH1-SD 3.45Å; Q160-M207 PolarHBondContact NE2-O 2.94Å; A161-M207 HydrophobicContact CB-SD 3.75Å; A161-M207 PolarHBondContact O-N 3.29Å; K205-M207 PolarHBondContact O-N 3.33Å; M207-I209 PolarHBondContact O-N 2.66Å
208	G	51.2	Low	83.3	Confident	51 Å²	51	46.6 Å²	46.6	53%	0.526	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	-19.2	176	0	0	0	0	0	114.2	R120	R120-G208 WeakPolarHBondContact CG-O 3.19Å; R120-G208 PolarHBondContact NE-O 3.09Å
209	I	62.9	Low	83.4	Confident	18 Å²	18	45.1 Å²	45.1	9%	0.092	21%	0.208	C	C	.	.			trans	-99.3	138.9	178.9	-46.3	-178.1	0	0	0	109.2	F123 P125 P206 M207 K211	F123-I209 HydrophobicContact CB-CD1 3.74Å; F123-I209 HydrophobicContact CB-CG1 3.99Å; F123-I209 HydrophobicContact CG-CD1 4.49Å; P125-I209 HydrophobicContact CB-CG2 4.31Å; P206-I209 HydrophobicContact CB-CB 4.5Å; P206-I209 HydrophobicContact CB-CD1 4.19Å; P206-I209 HydrophobicContact CG-CB 4.3Å; P206-I209 HydrophobicContact CG-CD1 4.4Å; P206-I209 PolarHBondContact O-N 2.83Å; M207-I209 PolarHBondContact O-N 2.66Å; I209-K211 VanDerWaalsContact C-N 3.28Å; I209-K211 HydrophobicContact CG2-CB 3.88Å
210	R	67	Low	83.3	Confident	197 Å²	197	45.7 Å²	45.7	74%	0.743	21%	0.211	S	C	*	.			trans	-75.4	-16.1	175.2	-74.3	-176.1	167.7	173.5	-3	113.7
211	K	75.7	Confident	83.2	Confident	91 Å²	91	46.2 Å²	46.2	40%	0.396	21%	0.213	S	C	.	.			trans	-69.3	136.7	-178.6	-162.4	-174.1	-174.8	-175.1	0	109.3	P125 C126 P206 I209	P125-K211 HydrophobicContact CB-CB 4.24Å; P125-K211 HydrophobicContact CB-CD 3.33Å; P125-K211 HydrophobicContact CB-CG 4.44Å; P125-K211 HydrophobicContact CG-CD 3.82Å; C126-K211 PolarHBondContact O-NZ 2.97Å; P206-K211 VanDerWaalsContact CD-O 3.28Å; P206-K211 WeakPolarHBondContact CD-O 3.2Å; I209-K211 VanDerWaalsContact C-N 3.28Å; I209-K211 HydrophobicContact CG2-CB 3.88Å
212	R	85.7	Confident	82.8	Confident	150 Å²	150	45.5 Å²	45.5	57%	0.566	21%	0.214	S	C	*	.			trans	-125.3	138.9	178.5	51.2	-177.4	175.6	-178.2	-3.3	108.9	V203	V203-R212 HydrophobicContact CG1-CB 3.8Å
213	S	90.4	Very high	82.1	Confident	11 Å²	11	50.5 Å²	50.5	8%	0.077	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	145.7	168.8	-67	0	0	0	0	109.1	G127 F130 V203 A204	G127-S213 PolarHBondContact O-OG 3.19Å; F130-S213 WeakPolarHBondContact CE2-O 3.09Å; V203-S213 CarbonylContact C-O 3.59Å; V203-S213 WeakPolarHBondContact CA-O 3.23Å; A204-S213 PolarHBondContact N-O 2.71Å; A204-S213 PolarHBondContact O-N 3.38Å
214	K	93	Very high	80.7	Confident	72 Å²	72	53.2 Å²	53.2	31%	0.313	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.6	-179.7	-59.3	-171.8	173.4	-174.5	0	110.1	E167 Y201 I202 V203	E167-K214 IonicContact OE1-NZ 3.43Å; E167-K214 PolarHBondContact OE1-NZ 3.46Å; E167-K214 WeakPolarHBondContact OE2-CE 3.27Å; E167-K214 IonicContact OE2-NZ 3.67Å; E167-K214 PolarHBondContact OE2-NZ 2.49Å; Y201-K214 HydrophobicContact CD1-CB 4.28Å; I202-K214 WeakPolarHBondContact O-CA 3.37Å; V203-K214 HydrophobicContact CG1-CG 4.45Å; V203-K214 HydrophobicContact CG2-CG 4.16Å
215	A	94.3	Very high	78.9	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.008	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	142	167.4	0	0	0	0	0	109.4	F130 K133 F135 Y201 I202	F130-A215 HydrophobicContact CB-CB 4.11Å; F130-A215 HydrophobicContact CD2-CB 3.54Å; F130-A215 HydrophobicContact CE2-CB 4Å; F130-A215 HydrophobicContact CG-CB 3.84Å; K133-A215 WeakPolarHBondContact O-CA 3.37Å; F135-A215 HydrophobicContact CD2-CB 3.91Å; F135-A215 HydrophobicContact CE2-CB 3.67Å; Y201-A215 CarbonylContact C-O 3.47Å; Y201-A215 WeakPolarHBondContact CA-O 3.21Å; I202-A215 HydrophobicContact CG2-CB 4Å; I202-A215 PolarHBondContact N-O 2.82Å; I202-A215 PolarHBondContact O-N 3.25Å
216	L	94.9	Very high	77.4	Confident	19 Å²	19	61.6 Å²	61.6	10%	0.099	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	134.7	176.9	-174.1	70.3	0	0	0	109.3	K133 R134 F135 V169 Y201 D218	K133-L216 PolarHBondContact O-N 3.19Å; R134-L216 CarbonylContact C-O 3.45Å; R134-L216 VanDerWaalsContact CA-O 3.24Å; R134-L216 WeakPolarHBondContact CA-O 3.3Å; R134-L216 HydrophobicContact CG-CB 4.13Å; R134-L216 HydrophobicContact CG-CD2 4.34Å; F135-L216 PolarHBondContact N-O 2.92Å; V169-L216 HydrophobicContact CG2-CD1 3.78Å; Y201-L216 HydrophobicContact CD1-CB 4.32Å; Y201-L216 HydrophobicContact CD1-CD1 4.17Å; Y201-L216 HydrophobicContact CE1-CB 4.12Å; Y201-L216 HydrophobicContact CE1-CD1 3.86Å; L216-D218 WeakPolarHBondContact CD2-OD1 3.48Å
217	V	94.8	Very high	76.3	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.3	171.6	-174.3	0	0	0	0	107.6	L137 I152 L186 Q199 F200 I202 I219	L137-V217 HydrophobicContact CD1-CG1 3.78Å; L137-V217 HydrophobicContact CG-CG1 4.48Å; I152-V217 HydrophobicContact CD1-CG2 3.54Å; L186-V217 HydrophobicContact CD2-CG1 4.09Å; Q199-V217 WeakPolarHBondContact CA-O 3.35Å; F200-V217 HydrophobicContact CD2-CB 3.97Å; F200-V217 HydrophobicContact CD2-CG2 4.25Å; F200-V217 HydrophobicContact CE2-CB 3.69Å; F200-V217 HydrophobicContact CE2-CG1 3.91Å; F200-V217 HydrophobicContact CE2-CG2 3.97Å; F200-V217 HydrophobicContact CZ-CB 4.15Å; F200-V217 HydrophobicContact CZ-CG1 3.94Å; F200-V217 PolarHBondContact N-O 2.75Å; F200-V217 PolarHBondContact O-N 3.44Å; I202-V217 HydrophobicContact CB-CG2 4.13Å; I202-V217 HydrophobicContact CG2-CG2 3.87Å; V217-I219 HydrophobicContact CG1-CD1 4.2Å; V217-I219 HydrophobicContact CG1-CG1 3.88Å
218	D	92.9	Very high	75.4	Confident	36 Å²	36	75.2 Å²	75.2	19%	0.193	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	108.8	179.6	-71.2	-37.1	0	0	0	108.3	F135 P136 L137 Q199 L216	F135-D218 PolarHBondContact O-N 2.71Å; P136-D218 CarbonylContact C-O 3.6Å; P136-D218 WeakPolarHBondContact CA-O 3.3Å; L137-D218 PolarHBondContact N-O 3.31Å; Q199-D218 VanDerWaalsContact CG-OD1 3.26Å; Q199-D218 WeakPolarHBondContact CG-OD1 3.42Å; Q199-D218 PolarHBondContact NE2-OD1 2.94Å; L216-D218 WeakPolarHBondContact CD2-OD1 3.48Å
219	I	92.1	Very high	74.7	Confident	4 Å²	4	84.8 Å²	84.8	2%	0.021	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.8	-178.2	-56.9	-172.8	0	0	0	110.3	L137 V139 F177 L186 A197 Y198 F200 V217 I221	L137-I219 HydrophobicContact CB-CG1 4.29Å; L137-I219 HydrophobicContact CD1-CG1 4.38Å; L137-I219 WeakPolarHBondContact O-CA 3.27Å; V139-I219 HydrophobicContact CB-CG2 4.21Å; V139-I219 HydrophobicContact CG2-CG2 3.69Å; F177-I219 HydrophobicContact CD1-CD1 3.89Å; F177-I219 HydrophobicContact CD2-CD1 3.74Å; F177-I219 HydrophobicContact CE1-CD1 3.71Å; F177-I219 HydrophobicContact CE2-CB 4.49Å; F177-I219 HydrophobicContact CE2-CD1 3.55Å; F177-I219 HydrophobicContact CE2-CG2 4.21Å; F177-I219 HydrophobicContact CG-CD1 3.91Å; F177-I219 HydrophobicContact CZ-CD1 3.55Å; F177-I219 HydrophobicContact CZ-CG2 3.81Å; L186-I219 HydrophobicContact CD2-CD1 4.12Å; A197-I219 WeakPolarHBondContact CA-O 3.3Å; Y198-I219 PolarHBondContact N-O 2.87Å; Y198-I219 PolarHBondContact O-N 2.83Å; F200-I219 HydrophobicContact CE1-CD1 3.71Å; F200-I219 HydrophobicContact CE1-CG1 4.32Å; F200-I219 HydrophobicContact CZ-CD1 3.62Å; F200-I219 HydrophobicContact CZ-CG1 4.4Å; V217-I219 HydrophobicContact CG1-CD1 4.2Å; V217-I219 HydrophobicContact CG1-CG1 3.88Å; I219-I221 HydrophobicContact CG2-CD1 3.86Å
220	Q	90.5	Very high	73.1	Confident	108 Å²	108	86.8 Å²	86.8	51%	0.505	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.9	168.4	-172	175.9	22.5	0	0	109.8	L137 K138 V139 I222	L137-Q220 PolarHBondContact O-N 2.79Å; K138-Q220 WeakPolarHBondContact CA-O 3.42Å; K138-Q220 HydrophobicContact CG-CB 4.46Å; V139-Q220 PolarHBondContact N-O 3.39Å; Q220-I222 HydrophobicContact CG-CG2 4.36Å
221	I	90.4	Very high	71.7	Confident	12 Å²	12	85.5 Å²	85.5	6%	0.062	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	129.3	171.9	-53.9	-53.9	0	0	0	109	V139 F177 L192 N196 Y198 I219	V139-I221 HydrophobicContact CB-CD1 3.99Å; V139-I221 CarbonylContact O-C 3.42Å; V139-I221 VanDerWaalsContact O-CA 3.27Å; V139-I221 WeakPolarHBondContact O-CA 3.4Å; F177-I221 HydrophobicContact CZ-CD1 4.31Å; L192-I221 HydrophobicContact CB-CD1 4.07Å; L192-I221 HydrophobicContact CB-CG1 4.42Å; L192-I221 HydrophobicContact CB-CG2 4.36Å; L192-I221 HydrophobicContact CD1-CD1 3.77Å; L192-I221 HydrophobicContact CD2-CD1 4.23Å; L192-I221 HydrophobicContact CG-CD1 4.23Å; N196-I221 WeakPolarHBondContact O-CB 3.28Å; N196-I221 WeakPolarHBondContact O-CG1 3.47Å; Y198-I221 HydrophobicContact CD2-CD1 4.47Å; Y198-I221 HydrophobicContact CD2-CG1 4.36Å; Y198-I221 HydrophobicContact CE2-CD1 4.39Å; Y198-I221 HydrophobicContact CE2-CG1 4.08Å; I219-I221 HydrophobicContact CG2-CD1 3.86Å
222	I	85.7	Confident	69.5	Low	70 Å²	70	91 Å²	91	36%	0.359	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	153.7	178.2	57.8	166.3	0	0	0	110.2	K138 V139 S140 S141 Q220	K138-I222 HydrophobicContact CB-CD1 4.02Å; K138-I222 HydrophobicContact CB-CG1 4.36Å; K138-I222 HydrophobicContact CB-CG2 4.43Å; K138-I222 HydrophobicContact CD-CG2 4.42Å; K138-I222 HydrophobicContact CG-CG2 4.48Å; V139-I222 PolarHBondContact O-N 3.04Å; S140-I222 CarbonylContact C-O 3.58Å; S140-I222 VanDerWaalsContact CA-O 3.23Å; S140-I222 WeakPolarHBondContact CA-O 3.44Å; S141-I222 PolarHBondContact N-O 2.95Å; Q220-I222 HydrophobicContact CG-CG2 4.36Å
223	Q	75.3	Confident	66.8	Low	105 Å²	105	93.4 Å²	93.4	49%	0.491	45%	0.448	S	S	.	.			trans	-88.3	127.4	173.3	-163.2	171.3	51	0	0	109.3	E194 S225	E194-Q223 WeakPolarHBondContact OE1-CG 3.28Å; E194-Q223 PolarHBondContact OE1-NE2 2.85Å; E194-Q223 PolarHBondContact OE2-NE2 3.42Å; Q223-S225 VanDerWaalsContact C-N 3.26Å; Q223-S225 PolarHBondContact O-N 3.2Å
224	D	61.6	Low	64.1	Low	65 Å²	65	102.9 Å²	102.9	35%	0.348	49%	0.488	S	S	.	.			trans	-73.9	84.5	174.6	-163.3	9	0	0	0	109.8	S140 Q226 R227	S140-D224 WeakPolarHBondContact OG-CB 3.37Å; D224-Q226 PolarHBondContact O-N 3.43Å; D224-R227 PolarHBondContact O-N 2.83Å
225	S	49.8	Very low	61.1	Low	83 Å²	83	109 Å²	109	58%	0.58	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-10.4	-178.6	48.9	0	0	0	0	113.6	Q223	Q223-S225 VanDerWaalsContact C-N 3.26Å; Q223-S225 PolarHBondContact O-N 3.2Å
226	Q	46.8	Very low	57.9	Low	160 Å²	160	119.2 Å²	119.2	75%	0.748	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-13.7	-179.7	-63.8	-61.5	-42.4	0	0	114.3	D224	D224-Q226 PolarHBondContact O-N 3.43Å
227	R	46.2	Very low	54.9	Low	173 Å²	173	126.7 Å²	126.7	65%	0.653	60%	0.595	S	S	*	*	S	Bend	trans	-87.7	-16.5	177.9	-77.3	-172.9	170.7	-177.7	-3.9	115.1	D142 D224 R229	D142-R227 IonicContact OD2-CZ 3.96Å; D142-R227 IonicContact OD2-NE 2.92Å; D142-R227 IonicContact OD2-NH1 2.76Å; D142-R227 PolarHBondContact OD2-NH1 2.9Å; D224-R227 PolarHBondContact O-N 2.83Å; R227-R229 VanDerWaalsContact C-N 3.32Å; R227-R229 PolarHBondContact O-N 3.02Å
228	H	42.9	Very low	51.7	Low	154 Å²	154	133.2 Å²	133.2	71%	0.713	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	0.2	-174.5	-81.6	-71.7	0	0	0	115.7
229	R	35.3	Very low	48.8	Very low	251 Å²	251	140.6 Å²	140.6	95%	0.947	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	4	174.9	-85.4	-174.2	174.5	177.2	-0.6	115.9	R227	R227-R229 VanDerWaalsContact C-N 3.32Å; R227-R229 PolarHBondContact O-N 3.02Å
230	G	30.5	Very low	45.7	Very low	61 Å²	61	148.9 Å²	148.9	63%	0.629	71%	0.711	S	S	*	*	S	Bend	trans	-133.1	-15.2	-165.2	0	0	0	0	0	121.5
231	L	36.6	Very low	43	Very low	169 Å²	169	148.9 Å²	148.9	89%	0.885	73%	0.73	S	S	*	*			trans	-118.4	88.6	-174.6	-94.6	84.4	0	0	0	113.6
232	K	29.4	Very low	40.4	Very low	206 Å²	206	152.2 Å²	152.2	90%	0.896	75%	0.754	S	S	*	*			trans	-67.3	126.4	159.3	-73.3	-174.8	177.5	178.4	0	109.8
233	K	29.2	Very low	38.3	Very low	202 Å²	202	161.3 Å²	161.3	88%	0.878	78%	0.784	S	S	*	*			trans	47.7	104.8	156.4	-67.1	-179.9	177.2	177.8	0	117.3
234	K	34.1	Very low	36.5	Very low	210 Å²	210	166.3 Å²	166.3	91%	0.913	80%	0.798	S	S	*	*			trans	-124.6	123.6	144.3	-88.5	-174	176.3	175.1	0	111.3
235	K	29.8	Very low	35.8	Very low	201 Å²	201	172.4 Å²	172.4	87%	0.874	82%	0.822	S	S	*	*			trans	-52.9	143.4	-176.7	-77.8	174.2	168.5	177.6	0	112.4	M237	K235-M237 PolarHBondContact O-N 2.94Å
236	K	27.3	Very low	35.9	Very low	214 Å²	214	172.9 Å²	172.9	93%	0.93	81%	0.811	S	S	*	*			trans	-46.4	115.3	156.5	-91	177.9	168.4	176.6	0	108.6
237	M	31	Very low	36.2	Very low	176 Å²	176	172.7 Å²	172.7	87%	0.867	81%	0.81	S	S	*	*			trans	-125.9	130.7	160.9	-93.9	179.8	64.4	0	0	109.1	K235	K235-M237 PolarHBondContact O-N 2.94Å
238	T	29.4	Very low	36.6	Very low	138 Å²	138	167.4 Å²	167.4	85%	0.847	79%	0.794	S	S	*	*			trans	-54.5	139.1	-173.7	-18.9	0	0	0	0	112.1	M240	T238-M240 PolarHBondContact O-N 3.37Å
239	M	30.2	Very low	37	Very low	190 Å²	190	172.1 Å²	172.1	94%	0.936	81%	0.806	S	S	*	*			trans	-66.8	94.1	173.9	-78	-106.3	-73.8	0	0	110.3
240	M	27.4	Very low	38.4	Very low	179 Å²	179	168.8 Å²	168.8	88%	0.882	80%	0.798	S	S	*	*			trans	-98.8	121.7	149.6	-78.4	-160.7	-174.4	0	0	107.9	T238 S242	T238-M240 PolarHBondContact O-N 3.37Å; M240-S242 PolarHBondContact O-N 2.94Å
241	A	34	Very low	40.4	Very low	108 Å²	108	172.9 Å²	172.9	89%	0.893	80%	0.801	S	S	*	*			trans	-64.4	82.2	176.4	0	0	0	0	0	110.1	R243	A241-R243 PolarHBondContact O-N 2.9Å
242	S	36.8	Very low	42.4	Very low	81 Å²	81	168 Å²	168	57%	0.566	78%	0.776	S	S	*	*			trans	-76.6	118.3	171.2	-168.8	0	0	0	0	108.2	M240 R244	M240-S242 PolarHBondContact O-N 2.94Å; S242-R244 PolarHBondContact O-N 3.46Å; S242-R244 WeakPolarHBondContact OG-CG 3.48Å
243	R	40	Very low	44.8	Very low	261 Å²	261	163.4 Å²	163.4	99%	0.985	77%	0.769	S	S	*	*			trans	-63.2	54.5	162.8	-76.6	179.7	167	173.9	-4.1	110.5	A241 K245	A241-R243 PolarHBondContact O-N 2.9Å; R243-K245 PolarHBondContact O-N 3.09Å
244	R	39.1	Very low	47.3	Very low	210 Å²	210	156.7 Å²	156.7	79%	0.792	74%	0.74	S	S	*	*			trans	-85.7	114.5	174.5	-94	177.6	-178.6	-144.7	2.3	108.3	S242 R246	S242-R244 PolarHBondContact O-N 3.46Å; S242-R244 WeakPolarHBondContact OG-CG 3.48Å; R244-R246 PolarHBondContact O-N 2.81Å
245	K	46.6	Very low	49.7	Very low	194 Å²	194	158 Å²	158	84%	0.843	74%	0.739	S	S	*	*			trans	-41.5	114.2	164	-165.1	179.1	-176.3	-175.6	0	107.7	R243 E247	R243-K245 PolarHBondContact O-N 3.09Å; K245-E247 PolarHBondContact O-N 3.44Å
246	R	51	Low	52.4	Low	92 Å²	92	150.7 Å²	150.7	35%	0.347	71%	0.71	S	S	.	*			trans	-71.9	97.7	-178	179.6	-170.3	155.4	-174.8	-5.5	107.8	R244 P274 Q276	R244-R246 PolarHBondContact O-N 2.81Å; R246-P274 PolarHBondContact NH2-O 2.97Å; R246-Q276 VanDerWaalsContact NH1-CB 3.34Å; R246-Q276 VanDerWaalsContact NH1-CD 3.32Å; R246-Q276 VanDerWaalsContact NH1-N 3.12Å
247	E	53.1	Low	55.1	Low	157 Å²	157	144 Å²	144	73%	0.734	69%	0.688	S	S	*	*			trans	-72	124.6	162.6	-73.2	-179.7	172.4	0	0	108.2	K245 R249	K245-E247 PolarHBondContact O-N 3.44Å; E247-R249 PolarHBondContact O-N 3.4Å
248	L	55.4	Low	57.8	Low	62 Å²	62	139.9 Å²	139.9	33%	0.325	67%	0.667	S	S	.	*			trans	-59.1	108.7	166.8	-75	165.6	0	0	0	106.2	K250 L252 V273 P274	L248-K250 PolarHBondContact O-N 2.93Å; L248-L252 HydrophobicContact CD1-CD1 4.3Å; L248-V273 HydrophobicContact CD1-CG1 4.2Å; L248-P274 HydrophobicContact CD2-CB 4.23Å; L248-P274 HydrophobicContact CD2-CG 4.01Å
249	R	51.7	Low	60.4	Low	253 Å²	253	140.2 Å²	140.2	96%	0.955	66%	0.663	S	S	*	*	S	Bend	trans	-63	2	-165.8	-69.5	-174.3	172.3	-165.6	-1.8	115.6	E247	E247-R249 PolarHBondContact O-N 3.4Å
250	K	64.2	Low	62.9	Low	180 Å²	180	131.6 Å²	131.6	78%	0.783	62%	0.621	S	S	*	*	S	Bend	trans	-153.7	134.4	177.4	-127	176.5	178.8	-175.5	0	108.9	L248 L252	L248-K250 PolarHBondContact O-N 2.93Å; K250-L252 PolarHBondContact O-N 3.15Å
251	E	72.8	Confident	65.3	Low	147 Å²	147	125.8 Å²	125.8	69%	0.687	60%	0.601	S	S	*	*			trans	-54.4	129.9	168.9	-169.2	171.9	-166.3	0	0	108.8	S253	E251-S253 PolarHBondContact O-N 3.36Å
252	L	77.1	Confident	67.5	Low	68 Å²	68	124.5 Å²	124.5	36%	0.356	58%	0.582	S	S	.	*			trans	-86.7	105.7	179.6	-69.2	164	0	0	0	108	L248 K250 F254 P274	L248-L252 HydrophobicContact CD1-CD1 4.3Å; K250-L252 PolarHBondContact O-N 3.15Å; L252-F254 HydrophobicContact CB-CE1 4.22Å; L252-F254 HydrophobicContact CB-CE2 4.3Å; L252-F254 HydrophobicContact CB-CZ 3.76Å; L252-F254 HydrophobicContact CG-CZ 4.5Å; L252-P274 VanDerWaalsContact CD1-CD 3.45Å; L252-P274 HydrophobicContact CD1-CG 4.28Å; L252-P274 HydrophobicContact CD2-CG 4.16Å
253	S	80.7	Confident	69	Low	109 Å²	109	122.8 Å²	122.8	76%	0.762	58%	0.577	S	S	*	*			trans	-104.5	120.8	179.1	56.3	0	0	0	0	110.6	E251	E251-S253 PolarHBondContact O-N 3.36Å
254	F	82.4	Confident	70.3	Confident	60 Å²	60	116.4 Å²	116.4	26%	0.263	55%	0.553	S	S	.	*			trans	-111.8	141.9	175.6	-48.6	-50.5	0	0	0	110	L252 L266 G270 Q271 I299	L252-F254 HydrophobicContact CB-CE1 4.22Å; L252-F254 HydrophobicContact CB-CE2 4.3Å; L252-F254 HydrophobicContact CB-CZ 3.76Å; L252-F254 HydrophobicContact CG-CZ 4.5Å; F254-L266 HydrophobicContact CD2-CD1 3.99Å; F254-L266 HydrophobicContact CG-CD1 4.42Å; F254-G270 VanDerWaalsContact CE1-O 3.24Å; F254-G270 WeakPolarHBondContact CE1-O 3.43Å; F254-Q271 HydrophobicContact CD1-CB 4.17Å; F254-Q271 HydrophobicContact CD1-CG 3.88Å; F254-Q271 VanDerWaalsContact CE1-CA 3.49Å; F254-Q271 HydrophobicContact CE1-CB 4.26Å; F254-Q271 HydrophobicContact CE1-CG 4.34Å; F254-Q271 HydrophobicContact CG-CG 4.49Å; F254-I299 HydrophobicContact CD2-CD1 4.35Å; F254-I299 HydrophobicContact CE2-CD1 3.51Å; F254-I299 HydrophobicContact CZ-CD1 4.17Å
255	R	83.6	Confident	71.6	Confident	238 Å²	238	106.8 Å²	106.8	90%	0.898	52%	0.517	S	S	*	.			trans	-107	122	170.3	-70.6	-176	178.7	169.8	-1.3	108.1
256	L	85.9	Confident	73	Confident	48 Å²	48	98.3 Å²	98.3	25%	0.251	48%	0.481	S	S	.	.			trans	-124.5	140.6	-175.7	-58.7	176.8	0	0	0	109.5	I260 L266 F291 L305	L256-I260 HydrophobicContact CD2-CD1 4.29Å; L256-L266 HydrophobicContact CD1-CD1 4.08Å; L256-L266 HydrophobicContact CD1-CD2 3.53Å; L256-L266 HydrophobicContact CD1-CG 4.47Å; L256-L266 HydrophobicContact CD2-CD1 4.31Å; L256-L266 HydrophobicContact CD2-CD2 3.58Å; L256-L266 HydrophobicContact CD2-CG 4.43Å; L256-L266 HydrophobicContact CG-CD2 4.21Å; L256-F291 HydrophobicContact CD1-CE1 3.62Å; L256-F291 HydrophobicContact CD1-CZ 3.92Å; L256-L305 HydrophobicContact CB-CD1 4.16Å; L256-L305 HydrophobicContact CD1-CD1 4.32Å
257	P	84.9	Confident	72.9	Confident	72 Å²	72	97.5 Å²	97.5	47%	0.468	49%	0.488	S	S	.	.			trans	-75.4	145.5	170.8	34.3	-34.7	0	0	0	109.8	N259 I260	P257-N259 VanDerWaalsContact C-N 3.25Å; P257-N259 WeakPolarHBondContact CB-OD1 3.21Å; P257-N259 PolarHBondContact O-N 3.33Å; P257-I260 HydrophobicContact CG-CB 4.39Å; P257-I260 WeakPolarHBondContact O-CB 3.23Å; P257-I260 VanDerWaalsContact O-CG2 3.32Å; P257-I260 WeakPolarHBondContact O-CG2 3.36Å; P257-I260 PolarHBondContact O-N 2.82Å
258	E	86.9	Confident	72.9	Confident	91 Å²	91	92.1 Å²	92.1	43%	0.425	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-35.1	-178.8	-174	177.4	178.6	0	0	112.7	I260 L305 N306 F307	E258-I260 PolarHBondContact O-N 3.32Å; E258-I260 VanDerWaalsContact O-N 3.11Å; E258-L305 VanDerWaalsContact CG-O 3.26Å; E258-L305 WeakPolarHBondContact CG-O 3.44Å; E258-N306 VanDerWaalsContact OE1-CA 3.32Å; E258-N306 WeakPolarHBondContact OE1-CA 3.41Å; E258-F307 VanDerWaalsContact CD-N 3.3Å; E258-F307 HydrophobicContact CG-CB 4.46Å; E258-F307 PolarHBondContact OE1-N 2.79Å; E258-F307 VanDerWaalsContact OE1-N 3.15Å; E258-F307 VanDerWaalsContact OE2-CB 3.27Å; E258-F307 WeakPolarHBondContact OE2-CB 3.16Å
259	N	84.8	Confident	72.5	Confident	144 Å²	144	94.1 Å²	94.1	77%	0.77	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	16.2	179.5	69	-9.9	0	0	0	114.3	P257 A261	P257-N259 VanDerWaalsContact C-N 3.25Å; P257-N259 WeakPolarHBondContact CB-OD1 3.21Å; P257-N259 PolarHBondContact O-N 3.33Å; N259-A261 PolarHBondContact O-N 2.95Å
260	I	83.5	Confident	72.7	Confident	10 Å²	10	83.9 Å²	83.9	5%	0.051	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-62.9	131.7	173.5	-166.3	163	0	0	0	109.9	L256 P257 E258 L266 V301 L305	L256-I260 HydrophobicContact CD2-CD1 4.29Å; P257-I260 HydrophobicContact CG-CB 4.39Å; P257-I260 WeakPolarHBondContact O-CB 3.23Å; P257-I260 VanDerWaalsContact O-CG2 3.32Å; P257-I260 WeakPolarHBondContact O-CG2 3.36Å; P257-I260 PolarHBondContact O-N 2.82Å; E258-I260 PolarHBondContact O-N 3.32Å; E258-I260 VanDerWaalsContact O-N 3.11Å; I260-L266 HydrophobicContact CD1-CD2 4.02Å; I260-V301 HydrophobicContact CD1-CG2 3.93Å; I260-V301 HydrophobicContact CG1-CG2 4.15Å; I260-V301 HydrophobicContact CG2-CG1 4.14Å; I260-V301 HydrophobicContact CG2-CG2 3.91Å; I260-L305 HydrophobicContact CG2-CD1 3.65Å; I260-L305 HydrophobicContact CG2-CG 4.18Å
261	A	76	Confident	73.1	Confident	57 Å²	57	77.5 Å²	77.5	47%	0.471	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-65.4	137.4	-177.7	0	0	0	0	0	111.9	N259 R264	N259-A261 PolarHBondContact O-N 2.95Å; A261-R264 HydrophobicContact CB-CB 4.28Å; A261-R264 WeakPolarHBondContact O-CB 3.34Å; A261-R264 PolarHBondContact O-N 3Å
262	V	80.6	Confident	73.3	Confident	81 Å²	81	72 Å²	72	49%	0.491	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	141.9	169.9	-175.4	0	0	0	0	109.7	R264 A302 A304	V262-R264 VanDerWaalsContact C-N 3.25Å; V262-A302 VanDerWaalsContact CG1-O 3.26Å; V262-A302 WeakPolarHBondContact CG1-O 3.01Å; V262-A304 HydrophobicContact CG2-CB 4.01Å; V262-A304 VanDerWaalsContact CG2-N 3.3Å
263	G	69.6	Low	73.4	Confident	45 Å²	45	68.9 Å²	68.9	46%	0.464	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	-1.7	-170.7	0	0	0	0	0	113.6	E300 V301	G263-E300 WeakPolarHBondContact CA-OE1 3.27Å; G263-V301 PolarHBondContact N-O 2.79Å
264	R	66.7	Low	73.3	Confident	127 Å²	127	65.8 Å²	65.8	48%	0.479	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-89.2	128.6	-179.5	-160.7	-176.7	-173.2	-169.2	2.8	110.7	A261 V262 V301	A261-R264 HydrophobicContact CB-CB 4.28Å; A261-R264 WeakPolarHBondContact O-CB 3.34Å; A261-R264 PolarHBondContact O-N 3Å; V262-R264 VanDerWaalsContact C-N 3.25Å; R264-V301 PolarHBondContact O-N 2.9Å
265	L	66.3	Low	72.9	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.042	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-73.9	144.7	166.9	-68	141.1	0	0	0	112.1	T183 H294 S298 I299 E300	T183-L265 HydrophobicContact CG2-CD1 3.53Å; L265-H294 VanDerWaalsContact CD2-CD2 3.43Å; L265-H294 WeakPolarHBondContact CD2-CD2 3.48Å; L265-S298 WeakPolarHBondContact CD2-OG 3.45Å; L265-I299 CarbonylContact C-O 3.58Å; L265-I299 WeakPolarHBondContact CA-O 3.39Å; L265-I299 WeakPolarHBondContact CD2-O 3.18Å; L265-E300 HydrophobicContact CD2-CB 3.72Å; L265-E300 HydrophobicContact CG-CB 3.88Å; L265-E300 HydrophobicContact CG-CG 4.25Å
266	L	75.8	Confident	72.2	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.084	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-61.4	121.2	-177.8	-61	-167.4	0	0	0	110.5	F254 L256 I260 G268 Q271 I299 V301	F254-L266 HydrophobicContact CD2-CD1 3.99Å; F254-L266 HydrophobicContact CG-CD1 4.42Å; L256-L266 HydrophobicContact CD1-CD1 4.08Å; L256-L266 HydrophobicContact CD1-CD2 3.53Å; L256-L266 HydrophobicContact CD1-CG 4.47Å; L256-L266 HydrophobicContact CD2-CD1 4.31Å; L256-L266 HydrophobicContact CD2-CD2 3.58Å; L256-L266 HydrophobicContact CD2-CG 4.43Å; L256-L266 HydrophobicContact CG-CD2 4.21Å; I260-L266 HydrophobicContact CD1-CD2 4.02Å; L266-G268 PolarHBondContact O-N 2.85Å; L266-Q271 HydrophobicContact CB-CB 3.96Å; L266-I299 HydrophobicContact CD1-CB 3.83Å; L266-I299 HydrophobicContact CD1-CD1 4.41Å; L266-I299 HydrophobicContact CD1-CG2 3.74Å; L266-I299 HydrophobicContact CG-CB 4Å; L266-I299 HydrophobicContact CG-CG2 4.04Å; L266-I299 WeakPolarHBondContact CG-O 3.43Å; L266-I299 PolarHBondContact N-O 3.24Å; L266-V301 HydrophobicContact CD2-CG2 3.76Å
267	P	50	Low	70.7	Confident	74 Å²	74	63.7 Å²	63.7	48%	0.481	38%	0.375	S	S	.	.			trans	-87	111.2	-173.2	32.3	-30.7	0	0	0	110.8	Q271	P267-Q271 PolarHBondContact O-OE1 3.26Å
268	G	51.6	Low	69.8	Low	44 Å²	44	63 Å²	63	45%	0.454	37%	0.367	S	S	.	.	S	Bend	trans	155.9	148.4	163.1	0	0	0	0	0	116.1	L266 G270 Q271	L266-G268 PolarHBondContact O-N 2.85Å; G268-G270 PolarHBondContact O-N 2.85Å; G268-Q271 PolarHBondContact O-N 3.35Å
269	A	46.8	Very low	69.1	Low	104 Å²	104	60.1 Å²	60.1	86%	0.86	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	104.4	167.3	0	0	0	0	0	109
270	G	56.3	Low	68.6	Low	39 Å²	39	53.9 Å²	53.9	40%	0.402	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	111.2	-9.2	-178.5	0	0	0	0	0	115.2	F254 G268 F272	F254-G270 VanDerWaalsContact CE1-O 3.24Å; F254-G270 WeakPolarHBondContact CE1-O 3.43Å; G268-G270 PolarHBondContact O-N 2.85Å; G270-F272 PolarHBondContact O-N 2.9Å; G270-F272 VanDerWaalsContact O-N 3.15Å
271	Q	73	Confident	68.3	Low	45 Å²	45	53.4 Å²	53.4	21%	0.21	32%	0.319	C	S	.	.	S	Bend	trans	-87	42.4	175	-63.6	-170.2	0.9	0	0	113.1	F254 L266 P267 G268	F254-Q271 HydrophobicContact CD1-CB 4.17Å; F254-Q271 HydrophobicContact CD1-CG 3.88Å; F254-Q271 VanDerWaalsContact CE1-CA 3.49Å; F254-Q271 HydrophobicContact CE1-CB 4.26Å; F254-Q271 HydrophobicContact CE1-CG 4.34Å; F254-Q271 HydrophobicContact CG-CG 4.49Å; L266-Q271 HydrophobicContact CB-CB 3.96Å; P267-Q271 PolarHBondContact O-OE1 3.26Å; G268-Q271 PolarHBondContact O-N 3.35Å
272	F	76.2	Confident	68.3	Low	31 Å²	31	55.2 Å²	55.2	14%	0.136	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-145.7	161	-178.4	60	-93.7	0	0	0	109.4	G270 P274 G297	G270-F272 PolarHBondContact O-N 2.9Å; G270-F272 VanDerWaalsContact O-N 3.15Å; F272-P274 VanDerWaalsContact O-CD 3.27Å; F272-P274 WeakPolarHBondContact O-CD 3.33Å; F272-G297 CarbonylContact C-O 3.29Å; F272-G297 WeakPolarHBondContact CA-O 3.35Å; F272-G297 WeakPolarHBondContact CB-O 3.26Å
273	V	80.2	Confident	68.2	Low	4 Å²	4	54.2 Å²	54.2	2%	0.024	31%	0.313	C	S	.	.			trans	-70.6	117.1	173.1	-177.3	0	0	0	0	108.5	L248 L275 V281 V293 G297 I299 V317 V319	L248-V273 HydrophobicContact CD1-CG1 4.2Å; V273-L275 HydrophobicContact CG1-CD2 4.15Å; V273-L275 PolarHBondContact O-N 2.86Å; V273-L275 VanDerWaalsContact O-N 3.14Å; V273-V281 HydrophobicContact CB-CG2 4.42Å; V273-V281 HydrophobicContact CG1-CG2 4.47Å; V273-V293 HydrophobicContact CG2-CG1 3.79Å; V273-G297 PolarHBondContact N-O 2.95Å; V273-I299 HydrophobicContact CG2-CD1 4.35Å; V273-V317 HydrophobicContact CG2-CB 4.48Å; V273-V317 HydrophobicContact CG2-CG2 4.07Å; V273-V319 HydrophobicContact CG1-CG2 4.02Å
274	P	77.5	Confident	68.3	Low	44 Å²	44	52.1 Å²	52.1	29%	0.286	29%	0.291	S	S	.	.			trans	-70	112.4	-177.6	-10.7	22.9	0	0	0	110.6	R246 L248 L252 F272	R246-P274 PolarHBondContact NH2-O 2.97Å; L248-P274 HydrophobicContact CD2-CB 4.23Å; L248-P274 HydrophobicContact CD2-CG 4.01Å; L252-P274 VanDerWaalsContact CD1-CD 3.45Å; L252-P274 HydrophobicContact CD1-CG 4.28Å; L252-P274 HydrophobicContact CD2-CG 4.16Å; F272-P274 VanDerWaalsContact O-CD 3.27Å; F272-P274 WeakPolarHBondContact O-CD 3.33Å
275	L	74.5	Confident	68.7	Low	29 Å²	29	47.3 Å²	47.3	15%	0.152	28%	0.276	C	S	.	.			trans	-99.5	148.3	178	-58.4	177.9	0	0	0	111	V273 Q279 V281 N296 V319	V273-L275 HydrophobicContact CG1-CD2 4.15Å; V273-L275 PolarHBondContact O-N 2.86Å; V273-L275 VanDerWaalsContact O-N 3.14Å; L275-Q279 HydrophobicContact CB-CB 4.26Å; L275-Q279 HydrophobicContact CD2-CB 4.38Å; L275-V281 HydrophobicContact CD1-CG2 4.5Å; L275-V281 HydrophobicContact CD2-CG2 4.31Å; L275-N296 WeakPolarHBondContact CD1-O 3.5Å; L275-V319 HydrophobicContact CD2-CB 4.31Å; L275-V319 HydrophobicContact CD2-CG1 3.54Å; L275-V319 HydrophobicContact CD2-CG2 3.75Å
276	Q	70.3	Confident	69.3	Low	114 Å²	114	47.5 Å²	47.5	53%	0.533	28%	0.279	S	S	.	.			trans	-91.6	174.5	167.3	-91.6	165.2	10.4	0	0	110.1	R246 D278 Q279	R246-Q276 VanDerWaalsContact NH1-CB 3.34Å; R246-Q276 VanDerWaalsContact NH1-CD 3.32Å; R246-Q276 VanDerWaalsContact NH1-N 3.12Å; Q276-D278 PolarHBondContact O-N 2.94Å; Q276-Q279 HydrophobicContact CB-CG 4.23Å; Q276-Q279 WeakPolarHBondContact O-CB 3.38Å; Q276-Q279 PolarHBondContact O-N 2.79Å
277	R	53	Low	69.8	Low	159 Å²	159	51.1 Å²	51.1	60%	0.6	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	137	167.2	-89.9	-174.6	-179.5	170.6	-1.2	110	Q279	R277-Q279 PolarHBondContact O-N 3.18Å
278	D	66.5	Low	71.5	Confident	56 Å²	56	50.8 Å²	50.8	30%	0.299	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	10	-179.5	-47	-35.5	0	0	0	114	Q276 N321 I322 R323	Q276-D278 PolarHBondContact O-N 2.94Å; D278-N321 VanDerWaalsContact C-OD1 3.3Å; D278-N321 WeakPolarHBondContact CB-OD1 3.33Å; D278-N321 CarbonylContact O-C 3.6Å; D278-N321 VanDerWaalsContact O-CA 3.28Å; D278-N321 WeakPolarHBondContact O-CA 3.38Å; D278-N321 PolarHBondContact O-OD1 2.86Å; D278-I322 WeakPolarHBondContact O-CB 3.49Å; D278-I322 VanDerWaalsContact O-CG1 3.23Å; D278-I322 WeakPolarHBondContact O-CG1 3.42Å; D278-I322 PolarHBondContact O-N 3.22Å; D278-R323 IonicContact OD1-NH2 3.18Å; D278-R323 IonicContact OD2-CZ 2.94Å; D278-R323 IonicContact OD2-NE 3.46Å; D278-R323 IonicContact OD2-NH1 3.22Å; D278-R323 PolarHBondContact OD2-NH1 3.03Å; D278-R323 IonicContact OD2-NH2 3.81Å; D278-R323 PolarHBondContact OD2-NH2 2.79Å
279	Q	71.8	Confident	73.2	Confident	32 Å²	32	52.5 Å²	52.5	15%	0.15	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	139.6	176.5	-70.9	-175.8	-14.1	0	0	112.2	L275 Q276 R277 V319 E320	L275-Q279 HydrophobicContact CB-CB 4.26Å; L275-Q279 HydrophobicContact CD2-CB 4.38Å; Q276-Q279 HydrophobicContact CB-CG 4.23Å; Q276-Q279 WeakPolarHBondContact O-CB 3.38Å; Q276-Q279 PolarHBondContact O-N 2.79Å; R277-Q279 PolarHBondContact O-N 3.18Å; Q279-V319 HydrophobicContact CB-CG1 3.62Å; Q279-V319 HydrophobicContact CG-CG1 4.03Å; Q279-E320 CarbonylContact C-O 3.55Å; Q279-E320 VanDerWaalsContact CA-O 3.25Å; Q279-E320 WeakPolarHBondContact CA-O 3.36Å
280	V	75.2	Confident	75.2	Confident	12 Å²	12	49.2 Å²	49.2	7%	0.073	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	154.4	173.1	-70	0	0	0	0	109.8	K282 R295 V319 E320 I322	V280-K282 PolarHBondContact O-N 2.9Å; V280-R295 HydrophobicContact CB-CG 3.79Å; V280-R295 HydrophobicContact CG1-CG 3.82Å; V280-V319 CarbonylContact O-C 3.56Å; V280-V319 WeakPolarHBondContact O-CA 3.41Å; V280-E320 HydrophobicContact CG2-CG 3.67Å; V280-E320 PolarHBondContact N-O 3.43Å; V280-E320 PolarHBondContact O-N 2.86Å; V280-I322 HydrophobicContact CB-CG1 4.33Å; V280-I322 HydrophobicContact CG1-CD1 3.62Å; V280-I322 HydrophobicContact CG1-CG1 3.59Å; V280-I322 HydrophobicContact CG2-CG1 3.9Å
281	V	76	Confident	76.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	119.6	167.8	171.8	0	0	0	0	108.5	V273 L275 A284 A286 V293 H294 R295 V317	V273-V281 HydrophobicContact CB-CG2 4.42Å; V273-V281 HydrophobicContact CG1-CG2 4.47Å; L275-V281 HydrophobicContact CD1-CG2 4.5Å; L275-V281 HydrophobicContact CD2-CG2 4.31Å; V281-A284 HydrophobicContact CB-CB 4.05Å; V281-A284 HydrophobicContact CG1-CB 4.02Å; V281-A284 VanDerWaalsContact O-CB 3.27Å; V281-A284 WeakPolarHBondContact O-CB 3.47Å; V281-A284 PolarHBondContact O-N 2.77Å; V281-A286 HydrophobicContact CG1-CB 4.29Å; V281-V293 HydrophobicContact CG1-CB 4.46Å; V281-V293 HydrophobicContact CG1-CG1 4.12Å; V281-V293 HydrophobicContact CG2-CG1 3.91Å; V281-H294 WeakPolarHBondContact CB-O 3.47Å; V281-H294 WeakPolarHBondContact CG2-O 3.22Å; V281-R295 PolarHBondContact N-O 3.29Å; V281-R295 VanDerWaalsContact N-O 3.12Å; V281-V317 HydrophobicContact CB-CG1 4.42Å; V281-V317 HydrophobicContact CG1-CG1 3.39Å; V281-V317 HydrophobicContact CG2-CG1 4.22Å
282	K	77.8	Confident	77.2	Confident	94 Å²	94	47.3 Å²	47.3	41%	0.409	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	138.6	177.6	-177.9	165.9	-167	176.2	0	109.3	V280 A284 I318 E320	V280-K282 PolarHBondContact O-N 2.9Å; K282-A284 PolarHBondContact O-N 2.99Å; K282-I318 HydrophobicContact CB-CB 4.02Å; K282-I318 HydrophobicContact CB-CG2 3.88Å; K282-I318 WeakPolarHBondContact CB-O 3.42Å; K282-I318 HydrophobicContact CD-CG2 3.82Å; K282-I318 HydrophobicContact CG-CG2 4.38Å; K282-I318 PolarHBondContact N-O 2.87Å; K282-E320 HydrophobicContact CB-CB 4.02Å; K282-E320 HydrophobicContact CB-CG 3.88Å; K282-E320 HydrophobicContact CD-CB 4.27Å; K282-E320 WeakPolarHBondContact CD-OE2 3.36Å; K282-E320 WeakPolarHBondContact CE-OE2 3.45Å; K282-E320 HydrophobicContact CG-CB 4.39Å; K282-E320 HydrophobicContact CG-CG 4.28Å; K282-E320 VanDerWaalsContact CG-OE2 3.27Å; K282-E320 WeakPolarHBondContact CG-OE2 3.33Å
283	S	78.2	Confident	77.5	Confident	61 Å²	61	45.9 Å²	45.9	43%	0.427	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	26.1	-178.6	-54.5	0	0	0	0	113.5	L54 P285	L54-S283 WeakPolarHBondContact CD1-O 3.35Å; S283-P285 CarbonylContact O-C 3.55Å
284	A	70.8	Confident	77.4	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.008	24%	0.241	C	C	.	.	S	Bend	trans	-66.3	138.7	174.7	0	0	0	0	0	112.3	R50 L52 V281 K282 R295	R50-A284 PolarHBondContact NH2-O 2.84Å; L52-A284 WeakPolarHBondContact CD2-O 3.11Å; V281-A284 HydrophobicContact CB-CB 4.05Å; V281-A284 HydrophobicContact CG1-CB 4.02Å; V281-A284 VanDerWaalsContact O-CB 3.27Å; V281-A284 WeakPolarHBondContact O-CB 3.47Å; V281-A284 PolarHBondContact O-N 2.77Å; K282-A284 PolarHBondContact O-N 2.99Å; A284-R295 VanDerWaalsContact CB-CA 3.41Å; A284-R295 HydrophobicContact CB-CB 3.77Å; A284-R295 HydrophobicContact CB-CG 4.23Å
285	P	75.1	Confident	77.2	Confident	26 Å²	26	49 Å²	49	17%	0.169	24%	0.24	C	C	.	.	S	Bend	cis	-77.1	121.4	3.6	-1.8	19.8	0	0	0	109.7	L52 S283 V287 I292 V293	L52-P285 HydrophobicContact CB-CG 3.99Å; L52-P285 HydrophobicContact CD1-CG 4.27Å; L52-P285 VanDerWaalsContact CD2-CD 3.47Å; L52-P285 HydrophobicContact CG-CG 4.47Å; S283-P285 CarbonylContact O-C 3.55Å; P285-V287 PolarHBondContact O-N 3.43Å; P285-I292 HydrophobicContact CB-CG2 3.54Å; P285-V293 CarbonylContact C-O 3.4Å; P285-V293 VanDerWaalsContact CA-O 3.31Å; P285-V293 WeakPolarHBondContact CA-O 3.17Å
286	A	78.5	Confident	77	Confident	11 Å²	11	49.7 Å²	49.7	9%	0.091	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	103.5	-178.8	0	0	0	0	0	107.6	V281 K288 V293	V281-A286 HydrophobicContact CG1-CB 4.29Å; A286-K288 PolarHBondContact O-N 2.83Å; A286-V293 HydrophobicContact CB-CB 4.3Å; A286-V293 PolarHBondContact N-O 3.47Å; A286-V293 PolarHBondContact O-N 3.37Å
287	V	85.7	Confident	77.3	Confident	93 Å²	93	44.3 Å²	44.3	56%	0.564	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	119.1	173.4	-172.3	0	0	0	0	108.2	P285 I292	P285-V287 PolarHBondContact O-N 3.43Å; V287-I292 HydrophobicContact CG2-CG1 4.19Å
288	K	86.5	Confident	78.5	Confident	66 Å²	66	37.1 Å²	37.1	29%	0.287	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	79.7	-177.6	-65.1	-59.4	-178.6	177.6	0	108.8	A286 H290 F291 V293 F315 T316	A286-K288 PolarHBondContact O-N 2.83Å; K288-H290 PolarHBondContact O-N 3.25Å; K288-F291 CarbonylContact C-O 3.43Å; K288-F291 WeakPolarHBondContact CA-O 3.45Å; K288-F291 PolarHBondContact N-O 3.46Å; K288-F291 PolarHBondContact O-N 2.84Å; K288-V293 HydrophobicContact CG-CG2 4.31Å; K288-F315 HydrophobicContact CB-CB 3.97Å; K288-F315 HydrophobicContact CB-CD1 4.12Å; K288-F315 HydrophobicContact CB-CD2 3.76Å; K288-F315 HydrophobicContact CB-CE2 4.26Å; K288-F315 HydrophobicContact CB-CG 3.68Å; K288-F315 HydrophobicContact CD-CB 4.16Å; K288-F315 HydrophobicContact CD-CD2 4.36Å; K288-F315 HydrophobicContact CG-CB 4.21Å; K288-F315 HydrophobicContact CG-CD2 3.68Å; K288-F315 HydrophobicContact CG-CE2 4.27Å; K288-F315 HydrophobicContact CG-CG 4.04Å; K288-T316 WeakPolarHBondContact CE-O 3.4Å; K288-T316 PolarHBondContact NZ-O 3.31Å
289	D	88	Confident	79.2	Confident	80 Å²	80	34.7 Å²	34.7	43%	0.428	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	-93.7	175.2	-167	35.2	0	0	0	113.9	K303 H313	D289-K303 WeakPolarHBondContact O-CE 3.5Å; D289-H313 IonicContact OD2-ND1 3.29Å
290	H	89.1	Confident	79.6	Confident	35 Å²	35	35.1 Å²	35.1	16%	0.162	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-6.6	175.2	-68.5	79.7	0	0	0	113.8	K288 A302 K303 A304 L305 H313	K288-H290 PolarHBondContact O-N 3.25Å; H290-A302 PolarHBondContact O-N 2.78Å; H290-K303 PolarHBondContact O-N 2.81Å; H290-A304 PolarHBondContact CD2-O 3.49Å; H290-L305 HydrophobicContact CB-CD2 3.85Å; H290-H313 AromaticContact CE1-CE1 3.53Å; H290-H313 AromaticContact CG-CE1 3.78Å; H290-H313 AromaticContact CG-NE2 3.86Å; H290-H313 AromaticContact ND1-CE1 3.26Å; H290-H313 PolarHBondContact ND1-CE1 3.44Å; H290-H313 VanDerWaalsContact ND1-CE1 3.26Å; H290-H313 AromaticContact ND1-ND1 3.63Å; H290-H313 AromaticContact ND1-NE2 3.82Å
291	F	89.4	Confident	80	Confident	12 Å²	12	34.5 Å²	34.5	5%	0.053	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	156.3	-173.1	-55.2	-79.9	0	0	0	113	L256 K288 I299 E300 V301 L305 H313 F315	L256-F291 HydrophobicContact CD1-CE1 3.62Å; L256-F291 HydrophobicContact CD1-CZ 3.92Å; K288-F291 CarbonylContact C-O 3.43Å; K288-F291 WeakPolarHBondContact CA-O 3.45Å; K288-F291 PolarHBondContact N-O 3.46Å; K288-F291 PolarHBondContact O-N 2.84Å; F291-I299 HydrophobicContact CB-CG2 3.97Å; F291-I299 HydrophobicContact CD1-CG2 4.07Å; F291-I299 HydrophobicContact CG-CG2 4.27Å; F291-E300 CarbonylContact C-O 3.56Å; F291-E300 WeakPolarHBondContact CA-O 3.33Å; F291-V301 HydrophobicContact CD1-CG2 4.36Å; F291-V301 HydrophobicContact CE1-CG2 4.17Å; F291-L305 HydrophobicContact CE1-CD2 4.38Å; F291-L305 HydrophobicContact CE2-CD2 4.5Å; F291-L305 HydrophobicContact CZ-CD1 4.5Å; F291-L305 HydrophobicContact CZ-CD2 3.87Å; F291-H313 HydrophobicContact CE2-CB 3.75Å; F291-H313 AromaticContact CE2-CD2 3.74Å; F291-H313 AromaticContact CE2-CG 3.94Å; F291-F315 HydrophobicContact CB-CE1 4.21Å; F291-F315 HydrophobicContact CB-CZ 4.31Å; F291-F315 HydrophobicContact CD2-CD1 4.14Å; F291-F315 AromaticContact CD2-CE1 3.52Å; F291-F315 HydrophobicContact CD2-CE1 3.52Å; F291-F315 HydrophobicContact CD2-CZ 4.36Å; F291-F315 HydrophobicContact CE2-CE1 4.18Å; F291-F315 HydrophobicContact CG-CE1 4.02Å; F291-F315 HydrophobicContact CG-CZ 4.45Å
292	I	81.8	Confident	80.2	Confident	33 Å²	33	35.9 Å²	35.9	17%	0.169	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.3	167	-73.4	158.4	0	0	0	108	P285 V287 I299 E300 A302	P285-I292 HydrophobicContact CB-CG2 3.54Å; V287-I292 HydrophobicContact CG2-CG1 4.19Å; I292-I299 CarbonylContact O-C 3.48Å; I292-I299 WeakPolarHBondContact O-CA 3.34Å; I292-E300 HydrophobicContact CB-CB 4.19Å; I292-E300 PolarHBondContact N-O 2.85Å; I292-E300 PolarHBondContact O-N 2.94Å; I292-A302 HydrophobicContact CD1-CB 3.6Å; I292-A302 HydrophobicContact CG1-CB 3.73Å
293	V	82.3	Confident	80.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	118.6	174	-167.9	0	0	0	0	109.8	V273 V281 P285 A286 K288 I299 F315 V317	V273-V293 HydrophobicContact CG2-CG1 3.79Å; V281-V293 HydrophobicContact CG1-CB 4.46Å; V281-V293 HydrophobicContact CG1-CG1 4.12Å; V281-V293 HydrophobicContact CG2-CG1 3.91Å; P285-V293 CarbonylContact C-O 3.4Å; P285-V293 VanDerWaalsContact CA-O 3.31Å; P285-V293 WeakPolarHBondContact CA-O 3.17Å; A286-V293 HydrophobicContact CB-CB 4.3Å; A286-V293 PolarHBondContact N-O 3.47Å; A286-V293 PolarHBondContact O-N 3.37Å; K288-V293 HydrophobicContact CG-CG2 4.31Å; V293-I299 HydrophobicContact CG1-CG1 4.22Å; V293-I299 HydrophobicContact CG2-CG1 4.31Å; V293-F315 HydrophobicContact CG2-CE2 3.76Å; V293-F315 HydrophobicContact CG2-CZ 4.36Å; V293-V317 HydrophobicContact CB-CG1 4.27Å; V293-V317 HydrophobicContact CG1-CG1 4.06Å; V293-V317 HydrophobicContact CG2-CG1 4.42Å; V293-V317 HydrophobicContact CG2-CG2 4.09Å
294	H	77.8	Confident	81	Confident	41 Å²	41	36.9 Å²	36.9	19%	0.19	20%	0.199	C	C	.	.			trans	-80.8	166	-178.3	-71.8	-83.9	0	0	0	112.6	L265 V281 N296 G297 S298 E300	L265-H294 VanDerWaalsContact CD2-CD2 3.43Å; L265-H294 WeakPolarHBondContact CD2-CD2 3.48Å; V281-H294 WeakPolarHBondContact CB-O 3.47Å; V281-H294 WeakPolarHBondContact CG2-O 3.22Å; H294-N296 WeakPolarHBondContact CB-OD1 3.39Å; H294-N296 PolarHBondContact O-N 2.99Å; H294-G297 PolarHBondContact O-N 3.38Å; H294-S298 WeakPolarHBondContact CB-O 3.24Å; H294-S298 WeakPolarHBondContact CB-OG 3.44Å; H294-S298 PolarHBondContact N-O 2.86Å; H294-E300 IonicContact CD2-OE2 3.09Å; H294-E300 IonicContact CE1-OE2 3.04Å; H294-E300 PolarHBondContact CE1-OE2 2.83Å; H294-E300 IonicContact NE2-OE2 2.64Å; H294-E300 PolarHBondContact NE2-OE2 2.74Å
295	R	73.3	Confident	81.8	Confident	73 Å²	73	37.9 Å²	37.9	28%	0.275	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-33.3	-172.8	-165.2	177.5	-177.3	-163.6	-4.3	113	D86 V280 V281 A284 G297	D86-R295 IonicContact OD2-NH1 2.75Å; D86-R295 PolarHBondContact OD2-NH1 2.82Å; V280-R295 HydrophobicContact CB-CG 3.79Å; V280-R295 HydrophobicContact CG1-CG 3.82Å; V281-R295 PolarHBondContact N-O 3.29Å; V281-R295 VanDerWaalsContact N-O 3.12Å; A284-R295 VanDerWaalsContact CB-CA 3.41Å; A284-R295 HydrophobicContact CB-CB 3.77Å; A284-R295 HydrophobicContact CB-CG 4.23Å; R295-G297 VanDerWaalsContact C-N 3.26Å; R295-G297 PolarHBondContact O-N 2.84Å
296	N	69.3	Low	82.5	Confident	44 Å²	44	40 Å²	40	24%	0.235	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	2.4	175.9	64.4	-5.9	0	0	0	113.4	L275 H294 S298	L275-N296 WeakPolarHBondContact CD1-O 3.5Å; H294-N296 WeakPolarHBondContact CB-OD1 3.39Å; H294-N296 PolarHBondContact O-N 2.99Å; N296-S298 WeakPolarHBondContact OD1-CB 3.46Å; N296-S298 PolarHBondContact OD1-N 2.87Å; N296-S298 PolarHBondContact OD1-OG 3.28Å
297	G	78.1	Confident	83	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	87.7	-2.8	-179.4	0	0	0	0	0	114.7	F272 V273 H294 R295	F272-G297 CarbonylContact C-O 3.29Å; F272-G297 WeakPolarHBondContact CA-O 3.35Å; F272-G297 WeakPolarHBondContact CB-O 3.26Å; V273-G297 PolarHBondContact N-O 2.95Å; H294-G297 PolarHBondContact O-N 3.38Å; R295-G297 VanDerWaalsContact C-N 3.26Å; R295-G297 PolarHBondContact O-N 2.84Å
298	S	76.5	Confident	83.1	Confident	9 Å²	9	50.1 Å²	50.1	6%	0.063	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-68.6	149.4	174.1	68.7	0	0	0	0	111	L265 H294 N296	L265-S298 WeakPolarHBondContact CD2-OG 3.45Å; H294-S298 WeakPolarHBondContact CB-O 3.24Å; H294-S298 WeakPolarHBondContact CB-OG 3.44Å; H294-S298 PolarHBondContact N-O 2.86Å; N296-S298 WeakPolarHBondContact OD1-CB 3.46Å; N296-S298 PolarHBondContact OD1-N 2.87Å; N296-S298 PolarHBondContact OD1-OG 3.28Å
299	I	82.4	Confident	83.2	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129.5	-172.3	-56.7	172.6	0	0	0	108.6	F254 L265 L266 V273 F291 I292 V293	F254-I299 HydrophobicContact CD2-CD1 4.35Å; F254-I299 HydrophobicContact CE2-CD1 3.51Å; F254-I299 HydrophobicContact CZ-CD1 4.17Å; L265-I299 CarbonylContact C-O 3.58Å; L265-I299 WeakPolarHBondContact CA-O 3.39Å; L265-I299 WeakPolarHBondContact CD2-O 3.18Å; L266-I299 HydrophobicContact CD1-CB 3.83Å; L266-I299 HydrophobicContact CD1-CD1 4.41Å; L266-I299 HydrophobicContact CD1-CG2 3.74Å; L266-I299 HydrophobicContact CG-CB 4Å; L266-I299 HydrophobicContact CG-CG2 4.04Å; L266-I299 WeakPolarHBondContact CG-O 3.43Å; L266-I299 PolarHBondContact N-O 3.24Å; V273-I299 HydrophobicContact CG2-CD1 4.35Å; F291-I299 HydrophobicContact CB-CG2 3.97Å; F291-I299 HydrophobicContact CD1-CG2 4.07Å; F291-I299 HydrophobicContact CG-CG2 4.27Å; I292-I299 CarbonylContact O-C 3.48Å; I292-I299 WeakPolarHBondContact O-CA 3.34Å; V293-I299 HydrophobicContact CG1-CG1 4.22Å; V293-I299 HydrophobicContact CG2-CG1 4.31Å
300	E	80.6	Confident	83.2	Confident	41 Å²	41	52.6 Å²	52.6	19%	0.192	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.2	-178.3	-176.9	-175.2	152.9	0	0	110.8	G263 L265 F291 I292 H294 A302	G263-E300 WeakPolarHBondContact CA-OE1 3.27Å; L265-E300 HydrophobicContact CD2-CB 3.72Å; L265-E300 HydrophobicContact CG-CB 3.88Å; L265-E300 HydrophobicContact CG-CG 4.25Å; F291-E300 CarbonylContact C-O 3.56Å; F291-E300 WeakPolarHBondContact CA-O 3.33Å; I292-E300 HydrophobicContact CB-CB 4.19Å; I292-E300 PolarHBondContact N-O 2.85Å; I292-E300 PolarHBondContact O-N 2.94Å; H294-E300 IonicContact CD2-OE2 3.09Å; H294-E300 IonicContact CE1-OE2 3.04Å; H294-E300 PolarHBondContact CE1-OE2 2.83Å; H294-E300 IonicContact NE2-OE2 2.64Å; H294-E300 PolarHBondContact NE2-OE2 2.74Å; E300-A302 PolarHBondContact O-N 3.26Å
301	V	83.6	Confident	83.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	108.8	171.3	-178.9	0	0	0	0	108.5	I260 G263 R264 L266 F291 K303	I260-V301 HydrophobicContact CD1-CG2 3.93Å; I260-V301 HydrophobicContact CG1-CG2 4.15Å; I260-V301 HydrophobicContact CG2-CG1 4.14Å; I260-V301 HydrophobicContact CG2-CG2 3.91Å; G263-V301 PolarHBondContact N-O 2.79Å; R264-V301 PolarHBondContact O-N 2.9Å; L266-V301 HydrophobicContact CD2-CG2 3.76Å; F291-V301 HydrophobicContact CD1-CG2 4.36Å; F291-V301 HydrophobicContact CE1-CG2 4.17Å; V301-K303 WeakPolarHBondContact CG1-O 3.48Å
302	A	80.3	Confident	83.2	Confident	30 Å²	30	58.3 Å²	58.3	25%	0.248	31%	0.311	C	S	.	.			trans	-90	-23.2	-177.4	0	0	0	0	0	113.3	V262 H290 I292 E300	V262-A302 VanDerWaalsContact CG1-O 3.26Å; V262-A302 WeakPolarHBondContact CG1-O 3.01Å; H290-A302 PolarHBondContact O-N 2.78Å; I292-A302 HydrophobicContact CD1-CB 3.6Å; I292-A302 HydrophobicContact CG1-CB 3.73Å; E300-A302 PolarHBondContact O-N 3.26Å
303	K	85.5	Confident	83.5	Confident	109 Å²	109	58.7 Å²	58.7	47%	0.474	31%	0.312	S	S	.	.	S	Bend	trans	-138	154.1	178.7	-62.9	179.4	-173.6	168	0	110.2	D289 H290 V301 L305	D289-K303 WeakPolarHBondContact O-CE 3.5Å; H290-K303 PolarHBondContact O-N 2.81Å; V301-K303 WeakPolarHBondContact CG1-O 3.48Å; K303-L305 PolarHBondContact O-N 2.95Å
304	A	86.6	Confident	83.9	Confident	67 Å²	67	68.3 Å²	68.3	55%	0.554	35%	0.348	S	S	*	.			trans	-60.9	137.9	175.3	0	0	0	0	0	109.7	V262 H290	V262-A304 HydrophobicContact CG2-CB 4.01Å; V262-A304 VanDerWaalsContact CG2-N 3.3Å; H290-A304 PolarHBondContact CD2-O 3.49Å
305	L	87.9	Confident	84.5	Confident	21 Å²	21	69.7 Å²	69.7	11%	0.11	35%	0.354	C	S	.	.			trans	-83.9	147.7	175.4	-58.2	179	0	0	0	108.7	L256 E258 I260 H290 F291 K303	L256-L305 HydrophobicContact CB-CD1 4.16Å; L256-L305 HydrophobicContact CD1-CD1 4.32Å; E258-L305 VanDerWaalsContact CG-O 3.26Å; E258-L305 WeakPolarHBondContact CG-O 3.44Å; I260-L305 HydrophobicContact CG2-CD1 3.65Å; I260-L305 HydrophobicContact CG2-CG 4.18Å; H290-L305 HydrophobicContact CB-CD2 3.85Å; F291-L305 HydrophobicContact CE1-CD2 4.38Å; F291-L305 HydrophobicContact CE2-CD2 4.5Å; F291-L305 HydrophobicContact CZ-CD1 4.5Å; F291-L305 HydrophobicContact CZ-CD2 3.87Å; K303-L305 PolarHBondContact O-N 2.95Å
306	N	88.7	Confident	85.2	Confident	72 Å²	72	71.7 Å²	71.7	39%	0.385	37%	0.374	S	S	.	.			trans	-134.4	110.1	173.1	-176.4	-38.4	0	0	0	109.1	E258 E308 V309 E310	E258-N306 VanDerWaalsContact OE1-CA 3.32Å; E258-N306 WeakPolarHBondContact OE1-CA 3.41Å; N306-E308 VanDerWaalsContact C-N 3.31Å; N306-E308 PolarHBondContact O-N 3.31Å; N306-E308 PolarHBondContact OD1-N 2.71Å; N306-V309 HydrophobicContact CB-CB 4.13Å; N306-V309 HydrophobicContact CB-CG2 4.16Å; N306-V309 PolarHBondContact O-N 2.68Å; N306-V309 PolarHBondContact OD1-N 2.91Å; N306-V309 VanDerWaalsContact OD1-N 3.09Å; N306-E310 PolarHBondContact O-N 3.25Å
307	F	89	Confident	85.9	Confident	134 Å²	134	71.4 Å²	71.4	59%	0.588	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-32.3	-172.8	-179.4	-94.5	0	0	0	112.4	E258	E258-F307 VanDerWaalsContact CD-N 3.3Å; E258-F307 HydrophobicContact CG-CB 4.46Å; E258-F307 PolarHBondContact OE1-N 2.79Å; E258-F307 VanDerWaalsContact OE1-N 3.15Å; E258-F307 VanDerWaalsContact OE2-CB 3.27Å; E258-F307 WeakPolarHBondContact OE2-CB 3.16Å
308	E	87.8	Confident	86.2	Confident	182 Å²	182	76.7 Å²	76.7	85%	0.85	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-29.6	-179.6	-60.1	-154.8	174	0	0	112.6	N306	N306-E308 VanDerWaalsContact C-N 3.31Å; N306-E308 PolarHBondContact O-N 3.31Å; N306-E308 PolarHBondContact OD1-N 2.71Å
309	V	89.1	Confident	86.4	Confident	118 Å²	118	78.5 Å²	78.5	72%	0.715	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-52.1	177.1	176.9	0	0	0	0	111	N306	N306-V309 HydrophobicContact CB-CB 4.13Å; N306-V309 HydrophobicContact CB-CG2 4.16Å; N306-V309 PolarHBondContact O-N 2.68Å; N306-V309 PolarHBondContact OD1-N 2.91Å; N306-V309 VanDerWaalsContact OD1-N 3.09Å
310	E	88.3	Confident	86.2	Confident	79 Å²	79	80.1 Å²	80.1	37%	0.369	42%	0.419	S	S	.	.			trans	-147.6	104	-178.5	-165.9	178.9	-172.2	0	0	110.5	N306 H313	N306-E310 PolarHBondContact O-N 3.25Å; E310-H313 IonicContact OE1-ND1 3.4Å; E310-H313 IonicContact OE2-CE1 2.96Å; E310-H313 PolarHBondContact OE2-CE1 3.43Å; E310-H313 IonicContact OE2-ND1 3.11Å; E310-H313 PolarHBondContact OE2-ND1 2.94Å
311	S	87.5	Confident	85.8	Confident	79 Å²	79	81.1 Å²	81.1	55%	0.552	43%	0.425	S	S	*	.	S	Bend	trans	-82.2	-13.8	-176.8	58.5	0	0	0	0	114.2
312	V	90.6	Very high	84.8	Confident	88 Å²	88	84.7 Å²	84.7	53%	0.533	44%	0.444	S	S	.	.			trans	-139.6	110	-176.1	-177.4	0	0	0	0	110.6	R314	V312-R314 HydrophobicContact CG1-CG 4.16Å
313	H	88.9	Confident	83.5	Confident	42 Å²	42	92.2 Å²	92.2	19%	0.194	47%	0.466	C	S	.	.			trans	-95.7	127.6	171.5	-58.7	-62.3	0	0	0	111	D289 H290 F291 E310	D289-H313 IonicContact OD2-ND1 3.29Å; H290-H313 AromaticContact CE1-CE1 3.53Å; H290-H313 AromaticContact CG-CE1 3.78Å; H290-H313 AromaticContact CG-NE2 3.86Å; H290-H313 AromaticContact ND1-CE1 3.26Å; H290-H313 PolarHBondContact ND1-CE1 3.44Å; H290-H313 VanDerWaalsContact ND1-CE1 3.26Å; H290-H313 AromaticContact ND1-ND1 3.63Å; H290-H313 AromaticContact ND1-NE2 3.82Å; F291-H313 HydrophobicContact CE2-CB 3.75Å; F291-H313 AromaticContact CE2-CD2 3.74Å; F291-H313 AromaticContact CE2-CG 3.94Å; E310-H313 IonicContact OE1-ND1 3.4Å; E310-H313 IonicContact OE2-CE1 2.96Å; E310-H313 PolarHBondContact OE2-CE1 3.43Å; E310-H313 IonicContact OE2-ND1 3.11Å; E310-H313 PolarHBondContact OE2-ND1 2.94Å
314	R	90.7	Very high	81.8	Confident	201 Å²	201	91.6 Å²	91.6	76%	0.758	47%	0.471	S	S	*	.			trans	-119.7	130.2	175.4	-65.8	-174.9	-177.4	-158.4	0.3	110.6	V312	V312-R314 HydrophobicContact CG1-CG 4.16Å
315	F	89.5	Confident	79.8	Confident	71 Å²	71	91.6 Å²	91.6	31%	0.311	47%	0.467	S	S	.	.			trans	-148.8	153.3	174.5	60.3	-94.1	0	0	0	111.7	K288 F291 V293 V317	K288-F315 HydrophobicContact CB-CB 3.97Å; K288-F315 HydrophobicContact CB-CD1 4.12Å; K288-F315 HydrophobicContact CB-CD2 3.76Å; K288-F315 HydrophobicContact CB-CE2 4.26Å; K288-F315 HydrophobicContact CB-CG 3.68Å; K288-F315 HydrophobicContact CD-CB 4.16Å; K288-F315 HydrophobicContact CD-CD2 4.36Å; K288-F315 HydrophobicContact CG-CB 4.21Å; K288-F315 HydrophobicContact CG-CD2 3.68Å; K288-F315 HydrophobicContact CG-CE2 4.27Å; K288-F315 HydrophobicContact CG-CG 4.04Å; F291-F315 HydrophobicContact CB-CE1 4.21Å; F291-F315 HydrophobicContact CB-CZ 4.31Å; F291-F315 HydrophobicContact CD2-CD1 4.14Å; F291-F315 AromaticContact CD2-CE1 3.52Å; F291-F315 HydrophobicContact CD2-CE1 3.52Å; F291-F315 HydrophobicContact CD2-CZ 4.36Å; F291-F315 HydrophobicContact CE2-CE1 4.18Å; F291-F315 HydrophobicContact CG-CE1 4.02Å; F291-F315 HydrophobicContact CG-CZ 4.45Å; V293-F315 HydrophobicContact CG2-CE2 3.76Å; V293-F315 HydrophobicContact CG2-CZ 4.36Å; F315-V317 HydrophobicContact CD2-CG2 3.83Å; F315-V317 HydrophobicContact CE2-CG2 3.73Å
316	T	87.8	Confident	77.3	Confident	115 Å²	115	93.5 Å²	93.5	71%	0.706	49%	0.492	S	S	*	.			trans	-105.7	141.2	175.4	57	0	0	0	0	110.8	K288	K288-T316 WeakPolarHBondContact CE-O 3.4Å; K288-T316 PolarHBondContact NZ-O 3.31Å
317	V	85.4	Confident	74.4	Confident	37 Å²	37	96.8 Å²	96.8	22%	0.224	51%	0.51	C	S	.	.			trans	-118.2	136.2	175.8	-152.1	0	0	0	0	109	V273 V281 V293 F315	V273-V317 HydrophobicContact CG2-CB 4.48Å; V273-V317 HydrophobicContact CG2-CG2 4.07Å; V281-V317 HydrophobicContact CB-CG1 4.42Å; V281-V317 HydrophobicContact CG1-CG1 3.39Å; V281-V317 HydrophobicContact CG2-CG1 4.22Å; V293-V317 HydrophobicContact CB-CG1 4.27Å; V293-V317 HydrophobicContact CG1-CG1 4.06Å; V293-V317 HydrophobicContact CG2-CG1 4.42Å; V293-V317 HydrophobicContact CG2-CG2 4.09Å; F315-V317 HydrophobicContact CD2-CG2 3.83Å; F315-V317 HydrophobicContact CE2-CG2 3.73Å
318	I	83.9	Confident	71.5	Confident	112 Å²	112	101 Å²	101	57%	0.574	52%	0.523	S	S	*	.			trans	-94.3	136.1	175.4	-58	173.9	0	0	0	107.8	K282	K282-I318 HydrophobicContact CB-CB 4.02Å; K282-I318 HydrophobicContact CB-CG2 3.88Å; K282-I318 WeakPolarHBondContact CB-O 3.42Å; K282-I318 HydrophobicContact CD-CG2 3.82Å; K282-I318 HydrophobicContact CG-CG2 4.38Å; K282-I318 PolarHBondContact N-O 2.87Å
319	V	80.7	Confident	68.6	Low	46 Å²	46	100.3 Å²	100.3	28%	0.279	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.9	175.5	179.7	0	0	0	0	107.9	V273 L275 Q279 V280	V273-V319 HydrophobicContact CG1-CG2 4.02Å; L275-V319 HydrophobicContact CD2-CB 4.31Å; L275-V319 HydrophobicContact CD2-CG1 3.54Å; L275-V319 HydrophobicContact CD2-CG2 3.75Å; Q279-V319 HydrophobicContact CB-CG1 3.62Å; Q279-V319 HydrophobicContact CG-CG1 4.03Å; V280-V319 CarbonylContact O-C 3.56Å; V280-V319 WeakPolarHBondContact O-CA 3.41Å
320	E	77.9	Confident	65.8	Low	38 Å²	38	103.3 Å²	103.3	18%	0.178	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.6	157.6	176.4	67.9	-173.1	171.2	0	0	111.5	Q279 V280 K282	Q279-E320 CarbonylContact C-O 3.55Å; Q279-E320 VanDerWaalsContact CA-O 3.25Å; Q279-E320 WeakPolarHBondContact CA-O 3.36Å; V280-E320 HydrophobicContact CG2-CG 3.67Å; V280-E320 PolarHBondContact N-O 3.43Å; V280-E320 PolarHBondContact O-N 2.86Å; K282-E320 HydrophobicContact CB-CB 4.02Å; K282-E320 HydrophobicContact CB-CG 3.88Å; K282-E320 HydrophobicContact CD-CB 4.27Å; K282-E320 WeakPolarHBondContact CD-OE2 3.36Å; K282-E320 WeakPolarHBondContact CE-OE2 3.45Å; K282-E320 HydrophobicContact CG-CB 4.39Å; K282-E320 HydrophobicContact CG-CG 4.28Å; K282-E320 VanDerWaalsContact CG-OE2 3.27Å; K282-E320 WeakPolarHBondContact CG-OE2 3.33Å
321	N	72.8	Confident	64.7	Low	62 Å²	62	104.5 Å²	104.5	33%	0.332	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88	129.9	173.1	-134.1	-28.2	0	0	0	108.5	D278 R323 T324 S325	D278-N321 VanDerWaalsContact C-OD1 3.3Å; D278-N321 WeakPolarHBondContact CB-OD1 3.33Å; D278-N321 CarbonylContact O-C 3.6Å; D278-N321 VanDerWaalsContact O-CA 3.28Å; D278-N321 WeakPolarHBondContact O-CA 3.38Å; D278-N321 PolarHBondContact O-OD1 2.86Å; N321-R323 PolarHBondContact O-N 3.33Å; N321-T324 VanDerWaalsContact CB-OG1 3.29Å; N321-T324 WeakPolarHBondContact CB-OG1 3.36Å; N321-T324 PolarHBondContact O-N 3.28Å; N321-T324 PolarHBondContact O-OG1 3.01Å; N321-S325 PolarHBondContact O-N 3.17Å
322	I	62.6	Low	63.5	Low	76 Å²	76	105.8 Å²	105.8	39%	0.39	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-56.8	-31.7	178.1	-64	162.3	0	0	0	110.4	D278 V280 T324 S325	D278-I322 WeakPolarHBondContact O-CB 3.49Å; D278-I322 VanDerWaalsContact O-CG1 3.23Å; D278-I322 WeakPolarHBondContact O-CG1 3.42Å; D278-I322 PolarHBondContact O-N 3.22Å; V280-I322 HydrophobicContact CB-CG1 4.33Å; V280-I322 HydrophobicContact CG1-CD1 3.62Å; V280-I322 HydrophobicContact CG1-CG1 3.59Å; V280-I322 HydrophobicContact CG2-CG1 3.9Å; I322-T324 VanDerWaalsContact C-N 3.32Å; I322-T324 PolarHBondContact O-N 3.09Å; I322-S325 PolarHBondContact O-OG 3.47Å
323	R	53	Low	62	Low	188 Å²	188	106.8 Å²	106.8	71%	0.709	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-73.2	-20.3	176.9	-65.4	-169.8	-176.6	134.3	17.9	114.3	D278 N321	D278-R323 IonicContact OD1-NH2 3.18Å; D278-R323 IonicContact OD2-CZ 2.94Å; D278-R323 IonicContact OD2-NE 3.46Å; D278-R323 IonicContact OD2-NH1 3.22Å; D278-R323 PolarHBondContact OD2-NH1 3.03Å; D278-R323 IonicContact OD2-NH2 3.81Å; D278-R323 PolarHBondContact OD2-NH2 2.79Å; N321-R323 PolarHBondContact O-N 3.33Å
324	T	50	Low	60.4	Low	96 Å²	96	110.6 Å²	110.6	59%	0.589	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-98.8	-5.1	-179.3	44.7	0	0	0	0	113.5	N321 I322 G326	N321-T324 VanDerWaalsContact CB-OG1 3.29Å; N321-T324 WeakPolarHBondContact CB-OG1 3.36Å; N321-T324 PolarHBondContact O-N 3.28Å; N321-T324 PolarHBondContact O-OG1 3.01Å; I322-T324 VanDerWaalsContact C-N 3.32Å; I322-T324 PolarHBondContact O-N 3.09Å; T324-G326 PolarHBondContact O-N 3.22Å
325	S	42.9	Very low	58.5	Low	67 Å²	67	105 Å²	105	47%	0.469	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	7.2	177.8	54	0	0	0	0	114	N321 I322	N321-S325 PolarHBondContact O-N 3.17Å; I322-S325 PolarHBondContact O-OG 3.47Å
326	G	35.5	Very low	56.5	Low	61 Å²	61	107.3 Å²	107.3	63%	0.629	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-19.3	-179.5	0	0	0	0	0	116.1	T324	T324-G326 PolarHBondContact O-N 3.22Å
327	D	29.5	Very low	54.2	Low	141 Å²	141	106.7 Å²	106.7	75%	0.754	60%	0.599	S	S	*	*			trans	-118.3	77.4	-170.2	-71.2	-23.8	0	0	0	111.8
328	Y	27.6	Very low	51.9	Low	222 Å²	222	112.1 Å²	112.1	87%	0.871	63%	0.628	S	S	*	*	S	Bend	trans	-157.4	81.2	155.4	-95.8	-80.5	0	0	0	107.5
329	N	27.5	Very low	49.2	Very low	168 Å²	168	112.1 Å²	112.1	90%	0.898	63%	0.632	S	S	*	*			trans	161	81	150	-81.3	-16.3	0	0	0	110
330	A	30.3	Very low	46.3	Very low	180 Å²	180	118.1 Å²	118.1	100%	1.488	66%	0.664	S	S	*	*			trans	175.7	0	144.1	0	0	0	0	0	108.2

Retrieved 330 of 330 residues in 246.2 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).