A0AA82N856_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N856, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 320 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	41.5	Very low	55.8	Low	214 Å²	214	129.9 Å²	129.9	100%	1.054	63%	0.634	S	S	*	*				0	109.6	0	-75.6	170.8	178	0	0	108.3	Y3	M1-Y3 HydrophobicContact CB-CD2 4.37Å; M1-Y3 HydrophobicContact CB-CE2 4.3Å; M1-Y3 PolarHBondContact O-N 2.68Å
2	R	46.6	Very low	56.4	Low	240 Å²	240	127.8 Å²	127.8	91%	0.906	63%	0.627	S	S	*	*			trans	-81.2	100.6	170.2	-75.5	-176.3	176.6	-179.3	-0.8	107	N4	R2-N4 PolarHBondContact O-N 3.18Å; R2-N4 VanDerWaalsContact O-N 3.12Å
3	Y	52.6	Low	57	Low	182 Å²	182	122.5 Å²	122.5	71%	0.714	60%	0.602	S	S	*	*			trans	-70.6	101.4	170.7	-88.5	-89.5	0	0	0	108.2	M1 F5	M1-Y3 HydrophobicContact CB-CD2 4.37Å; M1-Y3 HydrophobicContact CB-CE2 4.3Å; M1-Y3 PolarHBondContact O-N 2.68Å; Y3-F5 PolarHBondContact O-N 2.49Å; Y3-F5 VanDerWaalsContact O-N 3.11Å
4	N	51.1	Low	57.3	Low	155 Å²	155	124.2 Å²	124.2	83%	0.829	60%	0.6	S	S	*	*			trans	-73	96.8	168.4	-77.6	-18.1	0	0	0	107.9	R2 S6	R2-N4 PolarHBondContact O-N 3.18Å; R2-N4 VanDerWaalsContact O-N 3.12Å; N4-S6 PolarHBondContact O-N 3.32Å
5	F	51.1	Low	57.4	Low	114 Å²	114	123.2 Å²	123.2	50%	0.5	60%	0.598	S	S	.	*			trans	-64.2	123.5	169.6	-83.2	-88.6	0	0	0	109.3	Y3 L9	Y3-F5 PolarHBondContact O-N 2.49Å; Y3-F5 VanDerWaalsContact O-N 3.11Å; F5-L9 HydrophobicContact CD1-CB 4.11Å; F5-L9 HydrophobicContact CD1-CD1 4.12Å; F5-L9 HydrophobicContact CD1-CD2 4.22Å; F5-L9 HydrophobicContact CD1-CG 4.38Å; F5-L9 HydrophobicContact CE1-CD2 4.37Å
6	S	61.6	Low	57.7	Low	53 Å²	53	120.9 Å²	120.9	37%	0.371	59%	0.588	S	S	.	*			trans	-54.8	142.7	173.5	168.1	0	0	0	0	110.7	N4 S8 L9 W10	N4-S6 PolarHBondContact O-N 3.32Å; S6-S8 PolarHBondContact O-N 3.15Å; S6-S8 PolarHBondContact OG-N 3.04Å; S6-S8 PolarHBondContact OG-OG 3.14Å; S6-L9 WeakPolarHBondContact O-CB 3.12Å; S6-L9 PolarHBondContact O-N 2.94Å; S6-W10 PolarHBondContact O-N 3.26Å
7	P	63.6	Low	57.7	Low	104 Å²	104	122.4 Å²	122.4	68%	0.675	59%	0.591	S	S	*	*	H	α-helix	trans	-51.4	-30.6	172.6	-25.8	33.5	0	0	0	113.6	L9 W10 V11	P7-L9 VanDerWaalsContact C-N 3.34Å; P7-L9 PolarHBondContact O-N 2.73Å; P7-W10 PolarHBondContact O-N 3.32Å; P7-V11 WeakPolarHBondContact O-CG2 3.37Å; P7-V11 PolarHBondContact O-N 2.82Å; P7-V11 VanDerWaalsContact O-N 3.11Å
8	S	60.9	Low	57.7	Low	71 Å²	71	120.2 Å²	120.2	50%	0.497	59%	0.587	S	S	.	*	H	α-helix	trans	-65.8	-34.8	176.3	63.8	0	0	0	0	113.3	S6 V11 L12	S6-S8 PolarHBondContact O-N 3.15Å; S6-S8 PolarHBondContact OG-N 3.04Å; S6-S8 PolarHBondContact OG-OG 3.14Å; S8-V11 PolarHBondContact O-N 2.62Å; S8-L12 PolarHBondContact O-N 2.87Å; S8-L12 VanDerWaalsContact O-N 3.11Å
9	L	60.9	Low	57.6	Low	78 Å²	78	123.5 Å²	123.5	41%	0.408	59%	0.592	S	S	.	*	H	α-helix	trans	-68.5	-38.4	175.5	-98.9	145	0	0	0	110.8	F5 S6 P7 L12 I13	F5-L9 HydrophobicContact CD1-CB 4.11Å; F5-L9 HydrophobicContact CD1-CD1 4.12Å; F5-L9 HydrophobicContact CD1-CD2 4.22Å; F5-L9 HydrophobicContact CD1-CG 4.38Å; F5-L9 HydrophobicContact CE1-CD2 4.37Å; S6-L9 WeakPolarHBondContact O-CB 3.12Å; S6-L9 PolarHBondContact O-N 2.94Å; P7-L9 VanDerWaalsContact C-N 3.34Å; P7-L9 PolarHBondContact O-N 2.73Å; L9-L12 PolarHBondContact O-N 3.21Å; L9-I13 WeakPolarHBondContact O-CB 3.03Å; L9-I13 WeakPolarHBondContact O-CD1 3.45Å; L9-I13 WeakPolarHBondContact O-CG1 3.4Å; L9-I13 PolarHBondContact O-N 2.86Å
10	W	59	Low	57.5	Low	131 Å²	131	122.1 Å²	122.1	50%	0.496	59%	0.585	S	S	.	*	H	α-helix	trans	-62.1	-45	173.3	-78.2	99.9	0	0	0	111.8	S6 P7 L12 I13 Y14	S6-W10 PolarHBondContact O-N 3.26Å; P7-W10 PolarHBondContact O-N 3.32Å; W10-L12 PolarHBondContact O-N 3.28Å; W10-I13 PolarHBondContact O-N 2.86Å; W10-Y14 HydrophobicContact CB-CD2 4.43Å; W10-Y14 HydrophobicContact CE3-CD2 4.28Å; W10-Y14 AromaticContact CE3-CE2 3.7Å; W10-Y14 HydrophobicContact CE3-CE2 3.7Å; W10-Y14 HydrophobicContact CZ3-CE2 4.34Å; W10-Y14 WeakPolarHBondContact O-CB 3.19Å; W10-Y14 WeakPolarHBondContact O-CD2 3.35Å; W10-Y14 PolarHBondContact O-N 3.3Å
11	V	65.2	Low	57.3	Low	87 Å²	87	123.2 Å²	123.2	53%	0.527	58%	0.584	S	S	.	*	H	α-helix	trans	-59.7	-45.3	177.4	175.1	0	0	0	0	111.4	P7 S8 Y14 L15	P7-V11 WeakPolarHBondContact O-CG2 3.37Å; P7-V11 PolarHBondContact O-N 2.82Å; P7-V11 VanDerWaalsContact O-N 3.11Å; S8-V11 PolarHBondContact O-N 2.62Å; V11-Y14 PolarHBondContact O-N 3.33Å; V11-L15 HydrophobicContact CG1-CD1 3.95Å; V11-L15 HydrophobicContact CG1-CG 4.36Å; V11-L15 WeakPolarHBondContact O-CB 3.5Å; V11-L15 VanDerWaalsContact O-CG 3.24Å; V11-L15 WeakPolarHBondContact O-CG 3.15Å; V11-L15 PolarHBondContact O-N 3.41Å
12	L	62.4	Low	57.9	Low	105 Å²	105	119.4 Å²	119.4	55%	0.55	56%	0.562	S	S	.	*	H	α-helix	trans	-60.9	-45.1	175.8	-94.7	151.1	0	0	0	112.3	S8 L9 W10 L15 I16	S8-L12 PolarHBondContact O-N 2.87Å; S8-L12 VanDerWaalsContact O-N 3.11Å; L9-L12 PolarHBondContact O-N 3.21Å; W10-L12 PolarHBondContact O-N 3.28Å; L12-L15 PolarHBondContact O-N 2.73Å; L12-I16 VanDerWaalsContact O-CG1 3.28Å; L12-I16 WeakPolarHBondContact O-CG1 3.41Å; L12-I16 PolarHBondContact O-N 2.71Å
13	I	64.6	Low	58.4	Low	59 Å²	59	112.1 Å²	112.1	30%	0.303	53%	0.534	S	S	.	.	H	α-helix	trans	-62.2	-46.9	177.7	-70.9	167.2	0	0	0	110.5	L9 W10 L15 I16 F17	L9-I13 WeakPolarHBondContact O-CB 3.03Å; L9-I13 WeakPolarHBondContact O-CD1 3.45Å; L9-I13 WeakPolarHBondContact O-CG1 3.4Å; L9-I13 PolarHBondContact O-N 2.86Å; W10-I13 PolarHBondContact O-N 2.86Å; I13-L15 PolarHBondContact O-N 2.9Å; I13-I16 PolarHBondContact O-N 3.4Å; I13-F17 HydrophobicContact CG2-CD2 3.59Å; I13-F17 HydrophobicContact CG2-CE2 3.49Å; I13-F17 VanDerWaalsContact CG2-CE2 3.49Å; I13-F17 WeakPolarHBondContact O-CD2 3.3Å; I13-F17 PolarHBondContact O-N 3.02Å
14	Y	60.8	Low	58.5	Low	146 Å²	146	108.3 Å²	108.3	57%	0.573	52%	0.521	S	S	*	.	H	α-helix	trans	-60.4	-42.7	175.6	-86.8	-72.3	0	0	0	111.8	W10 V11 I16 F17 V18	W10-Y14 HydrophobicContact CB-CD2 4.43Å; W10-Y14 HydrophobicContact CE3-CD2 4.28Å; W10-Y14 AromaticContact CE3-CE2 3.7Å; W10-Y14 HydrophobicContact CE3-CE2 3.7Å; W10-Y14 HydrophobicContact CZ3-CE2 4.34Å; W10-Y14 WeakPolarHBondContact O-CB 3.19Å; W10-Y14 WeakPolarHBondContact O-CD2 3.35Å; W10-Y14 PolarHBondContact O-N 3.3Å; V11-Y14 PolarHBondContact O-N 3.33Å; Y14-I16 PolarHBondContact O-N 3.33Å; Y14-F17 PolarHBondContact O-N 2.82Å; Y14-V18 WeakPolarHBondContact O-CB 3.37Å; Y14-V18 WeakPolarHBondContact O-CG2 3.47Å; Y14-V18 PolarHBondContact O-N 2.8Å
15	L	59.7	Low	58.5	Low	109 Å²	109	102.5 Å²	102.5	57%	0.571	49%	0.491	S	S	*	.	H	α-helix	trans	-62.1	-41.8	177.6	-74	170.9	0	0	0	112	V11 L12 I13 W19	V11-L15 HydrophobicContact CG1-CD1 3.95Å; V11-L15 HydrophobicContact CG1-CG 4.36Å; V11-L15 WeakPolarHBondContact O-CB 3.5Å; V11-L15 VanDerWaalsContact O-CG 3.24Å; V11-L15 WeakPolarHBondContact O-CG 3.15Å; V11-L15 PolarHBondContact O-N 3.41Å; L12-L15 PolarHBondContact O-N 2.73Å; I13-L15 PolarHBondContact O-N 2.9Å; L15-W19 WeakPolarHBondContact O-CB 3.47Å; L15-W19 PolarHBondContact O-N 3.28Å
16	I	61.6	Low	59.2	Low	86 Å²	86	100 Å²	100	44%	0.441	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-48.4	177.9	-66.7	163	0	0	0	110.8	L12 I13 Y14 H20	L12-I16 VanDerWaalsContact O-CG1 3.28Å; L12-I16 WeakPolarHBondContact O-CG1 3.41Å; L12-I16 PolarHBondContact O-N 2.71Å; I13-I16 PolarHBondContact O-N 3.4Å; Y14-I16 PolarHBondContact O-N 3.33Å; I16-H20 PolarHBondContact O-CD2 3.33Å; I16-H20 PolarHBondContact O-N 2.78Å; I16-H20 VanDerWaalsContact O-N 3.15Å
17	F	58.3	Low	60	Low	146 Å²	146	98.9 Å²	98.9	64%	0.64	48%	0.476	S	S	*	.	H	α-helix	trans	-66.9	-44.8	179.6	-77.1	-65.2	0	0	0	112.5	I13 Y14 W19 Y21	I13-F17 HydrophobicContact CG2-CD2 3.59Å; I13-F17 HydrophobicContact CG2-CE2 3.49Å; I13-F17 VanDerWaalsContact CG2-CE2 3.49Å; I13-F17 WeakPolarHBondContact O-CD2 3.3Å; I13-F17 PolarHBondContact O-N 3.02Å; Y14-F17 PolarHBondContact O-N 2.82Å; F17-W19 VanDerWaalsContact C-N 3.34Å; F17-W19 PolarHBondContact O-N 2.83Å; F17-Y21 VanDerWaalsContact O-CB 3.27Å; F17-Y21 WeakPolarHBondContact O-CB 3.29Å; F17-Y21 PolarHBondContact O-N 2.96Å
18	V	58.2	Low	60.9	Low	84 Å²	84	97.9 Å²	97.9	51%	0.509	47%	0.465	S	S	.	.	H	α-helix	trans	-65.6	-39	178.7	172.2	0	0	0	0	110.7	Y14 Y21 K22	Y14-V18 WeakPolarHBondContact O-CB 3.37Å; Y14-V18 WeakPolarHBondContact O-CG2 3.47Å; Y14-V18 PolarHBondContact O-N 2.8Å; V18-Y21 PolarHBondContact O-N 3.38Å; V18-K22 WeakPolarHBondContact O-CB 3.5Å; V18-K22 PolarHBondContact O-N 3.36Å
19	W	55.1	Low	62.1	Low	182 Å²	182	94.5 Å²	94.5	69%	0.689	44%	0.442	S	S	*	.	H	α-helix	trans	-66.8	-46.3	-179.6	-174.3	20.9	0	0	0	112	L15 F17 K22 R23	L15-W19 WeakPolarHBondContact O-CB 3.47Å; L15-W19 PolarHBondContact O-N 3.28Å; F17-W19 VanDerWaalsContact C-N 3.34Å; F17-W19 PolarHBondContact O-N 2.83Å; W19-K22 PolarHBondContact O-N 3.47Å; W19-R23 WeakPolarHBondContact O-CB 3.42Å; W19-R23 PolarHBondContact O-N 3Å
20	H	55.8	Low	63.3	Low	96 Å²	96	92.1 Å²	92.1	44%	0.444	43%	0.431	S	S	.	.	H	α-helix	trans	-62.7	-46.2	174.8	-73.2	-37.7	0	0	0	111.6	I16 K22 R23 F24	I16-H20 PolarHBondContact O-CD2 3.33Å; I16-H20 PolarHBondContact O-N 2.78Å; I16-H20 VanDerWaalsContact O-N 3.15Å; H20-K22 VanDerWaalsContact C-N 3.32Å; H20-K22 PolarHBondContact O-N 2.87Å; H20-R23 PolarHBondContact O-N 3.46Å; H20-F24 WeakPolarHBondContact O-CD2 3.33Å; H20-F24 PolarHBondContact O-N 3.47Å; H20-F24 VanDerWaalsContact O-N 3.1Å
21	Y	52.4	Low	64.6	Low	146 Å²	146	93.8 Å²	93.8	57%	0.573	44%	0.442	S	S	*	.	H	α-helix	trans	-58.6	-44.2	177.1	-173.2	-100.3	0	0	0	111.9	F17 V18 F24 N25	F17-Y21 VanDerWaalsContact O-CB 3.27Å; F17-Y21 WeakPolarHBondContact O-CB 3.29Å; F17-Y21 PolarHBondContact O-N 2.96Å; V18-Y21 PolarHBondContact O-N 3.38Å; Y21-F24 PolarHBondContact O-N 3.5Å; Y21-N25 WeakPolarHBondContact CE1-ND2 3.39Å; Y21-N25 WeakPolarHBondContact CE2-ND2 3.38Å; Y21-N25 WeakPolarHBondContact O-CB 3.42Å; Y21-N25 PolarHBondContact O-N 3.25Å; Y21-N25 PolarHBondContact OH-ND2 3.23Å; Y21-N25 VanDerWaalsContact OH-ND2 3.15Å
22	K	55.5	Low	65.5	Low	133 Å²	133	92.9 Å²	92.9	58%	0.578	43%	0.434	S	S	*	.	H	α-helix	trans	-65.3	-40.5	177.4	-165.1	174.2	-177.5	-179.4	0	111.5	V18 W19 H20 F24 N25 C26	V18-K22 WeakPolarHBondContact O-CB 3.5Å; V18-K22 PolarHBondContact O-N 3.36Å; W19-K22 PolarHBondContact O-N 3.47Å; H20-K22 VanDerWaalsContact C-N 3.32Å; H20-K22 PolarHBondContact O-N 2.87Å; K22-F24 VanDerWaalsContact C-N 3.34Å; K22-F24 PolarHBondContact O-N 3.28Å; K22-N25 PolarHBondContact O-N 3.45Å; K22-C26 WeakPolarHBondContact CG-SG 3.33Å; K22-C26 WeakPolarHBondContact O-CB 3.37Å; K22-C26 PolarHBondContact O-N 3.17Å; K22-C26 PolarHBondContact O-SG 2.81Å
23	R	57.1	Low	66.6	Low	87 Å²	87	91.4 Å²	91.4	33%	0.328	43%	0.433	S	S	.	.	H	α-helix	trans	-60.7	-41.4	177.1	-171.2	174.6	177.1	-175.4	-7.7	111.8	W19 H20 S94 E114	W19-R23 WeakPolarHBondContact O-CB 3.42Å; W19-R23 PolarHBondContact O-N 3Å; H20-R23 PolarHBondContact O-N 3.46Å; R23-S94 VanDerWaalsContact NH2-CB 3.25Å; R23-S94 PolarHBondContact NH2-OG 3.26Å; R23-E114 IonicContact CZ-OE2 3.51Å; R23-E114 IonicContact NH1-OE1 3.3Å; R23-E114 IonicContact NH1-OE2 3.25Å; R23-E114 PolarHBondContact NH1-OE2 2.77Å; R23-E114 IonicContact NH2-OE1 3.65Å; R23-E114 IonicContact NH2-OE2 3.51Å; R23-E114 PolarHBondContact NH2-OE2 3.28Å
24	F	53.8	Low	67.6	Low	102 Å²	102	94.2 Å²	94.2	45%	0.447	45%	0.448	S	S	.	.	H	α-helix	trans	-76	-30.6	179.2	-70.2	-65.7	0	0	0	114	H20 Y21 K22	H20-F24 WeakPolarHBondContact O-CD2 3.33Å; H20-F24 PolarHBondContact O-N 3.47Å; H20-F24 VanDerWaalsContact O-N 3.1Å; Y21-F24 PolarHBondContact O-N 3.5Å; K22-F24 VanDerWaalsContact C-N 3.34Å; K22-F24 PolarHBondContact O-N 3.28Å
25	N	50.4	Low	68.8	Low	34 Å²	34	88.6 Å²	88.6	18%	0.182	43%	0.428	C	S	.	.	H	α-helix	trans	-96	-8	-176.9	-86.2	-21.7	0	0	0	116	Y21 K22 K31 E198	Y21-N25 WeakPolarHBondContact CE1-ND2 3.39Å; Y21-N25 WeakPolarHBondContact CE2-ND2 3.38Å; Y21-N25 WeakPolarHBondContact O-CB 3.42Å; Y21-N25 PolarHBondContact O-N 3.25Å; Y21-N25 PolarHBondContact OH-ND2 3.23Å; Y21-N25 VanDerWaalsContact OH-ND2 3.15Å; K22-N25 PolarHBondContact O-N 3.45Å; N25-K31 WeakPolarHBondContact O-CE 3.28Å; N25-E198 PolarHBondContact OD1-OE2 3.25Å
26	C	65.8	Low	70	Confident	62 Å²	62	87.5 Å²	87.5	42%	0.419	42%	0.416	S	S	.	.			trans	-95.5	-0.2	-176.4	-75.1	0	0	0	0	115.3	K22 D28	K22-C26 WeakPolarHBondContact CG-SG 3.33Å; K22-C26 WeakPolarHBondContact O-CB 3.37Å; K22-C26 PolarHBondContact O-N 3.17Å; K22-C26 PolarHBondContact O-SG 2.81Å; C26-D28 PolarHBondContact O-N 3.04Å
27	N	78.2	Confident	71.1	Confident	29 Å²	29	91.3 Å²	91.3	16%	0.155	43%	0.432	C	S	.	.			trans	-81.1	114.2	175.4	-76.2	-34.2	0	0	0	110.1	I29 C30 I195 G196 K226	N27-I29 HydrophobicContact CB-CG2 4.28Å; N27-I29 PolarHBondContact O-N 3.16Å; N27-C30 WeakPolarHBondContact O-CB 3.45Å; N27-C30 PolarHBondContact O-N 2.99Å; N27-I195 HydrophobicContact CB-CG2 3.91Å; N27-I195 VanDerWaalsContact ND2-CG2 3.28Å; N27-I195 WeakPolarHBondContact ND2-CG2 3.42Å; N27-G196 PolarHBondContact ND2-O 2.98Å; N27-K226 PolarHBondContact OD1-NZ 3.44Å
28	D	82.6	Confident	72.5	Confident	82 Å²	82	88.1 Å²	88.1	44%	0.439	42%	0.416	S	S	.	.	H	α-helix	trans	-59.6	-32.4	-174.8	-58.5	-49.5	0	0	0	112.5	C26 C30 K31 N32 L35 Y54	C26-D28 PolarHBondContact O-N 3.04Å; D28-C30 PolarHBondContact O-N 3.3Å; D28-K31 PolarHBondContact O-N 2.58Å; D28-N32 PolarHBondContact O-N 3.06Å; D28-L35 HydrophobicContact CB-CD1 3.66Å; D28-Y54 HydrophobicContact CB-CE2 4.43Å
29	I	86	Confident	74.2	Confident	1 Å²	1	88.1 Å²	88.1	1%	0.005	41%	0.41	C	S	.	.	H	α-helix	trans	-61.4	-22.5	174	-163.1	167.3	0	0	0	113.7	N27 K31 L35 R36 Y54 I195 R202 H204	N27-I29 HydrophobicContact CB-CG2 4.28Å; N27-I29 PolarHBondContact O-N 3.16Å; I29-K31 VanDerWaalsContact C-N 3.27Å; I29-L35 HydrophobicContact CB-CB 4.21Å; I29-L35 HydrophobicContact CG1-CB 4.04Å; I29-R36 HydrophobicContact CD1-CG 4.03Å; I29-R36 HydrophobicContact CG1-CG 4.13Å; I29-Y54 HydrophobicContact CB-CD1 4.48Å; I29-Y54 HydrophobicContact CB-CE1 3.97Å; I29-Y54 HydrophobicContact CB-CE2 4.06Å; I29-Y54 HydrophobicContact CD1-CD1 4.06Å; I29-Y54 HydrophobicContact CD1-CE1 4.22Å; I29-Y54 HydrophobicContact CD1-CG 4.46Å; I29-Y54 HydrophobicContact CG2-CE1 3.85Å; I29-I195 HydrophobicContact CD1-CD1 4.01Å; I29-I195 HydrophobicContact CG2-CB 4.36Å; I29-I195 HydrophobicContact CG2-CD1 4.03Å; I29-I195 HydrophobicContact CG2-CG2 3.85Å; I29-R202 HydrophobicContact CG1-CB 4.39Å; I29-R202 HydrophobicContact CG2-CB 4.29Å; I29-H204 HydrophobicContact CD1-CB 3.96Å
30	C	86.4	Confident	75.9	Confident	28 Å²	28	81.4 Å²	81.4	19%	0.189	39%	0.388	C	S	.	.	H	α-helix	trans	-70.3	-27.9	173.9	-58.6	0	0	0	0	111.7	N27 D28 C197	N27-C30 WeakPolarHBondContact O-CB 3.45Å; N27-C30 PolarHBondContact O-N 2.99Å; D28-C30 PolarHBondContact O-N 3.3Å; C30-C197 VanDerWaalsContact CA-SG 3.59Å; C30-C197 HydrophobicContact CB-CB 3.76Å; C30-C197 WeakPolarHBondContact CB-SG 3.38Å; C30-C197 VanDerWaalsContact SG-CA 3.53Å; C30-C197 WeakPolarHBondContact SG-CB 3.39Å; C30-C197 CovalentContact SG-SG 2.03Å; C30-C197 PolarHBondContact SG-SG 2.93Å
31	K	85.9	Confident	77.7	Confident	166 Å²	166	78.9 Å²	78.9	72%	0.722	38%	0.379	S	S	*	.	H	α-helix	trans	-100	-29.5	-178.1	-62.6	178.6	-175.9	172.2	0	112.8	N25 D28 I29	N25-K31 WeakPolarHBondContact O-CE 3.28Å; D28-K31 PolarHBondContact O-N 2.58Å; I29-K31 VanDerWaalsContact C-N 3.27Å
32	N	85.5	Confident	79.6	Confident	68 Å²	68	72 Å²	72	36%	0.364	35%	0.352	S	S	.	.			trans	-122.2	105.4	-178.9	-175.1	-3.2	0	0	0	110.1	D28 D34 L35	D28-N32 PolarHBondContact O-N 3.06Å; N32-D34 PolarHBondContact O-N 3.05Å; N32-D34 VanDerWaalsContact OD1-CB 3.3Å; N32-D34 WeakPolarHBondContact OD1-CB 3.5Å; N32-D34 PolarHBondContact OD1-N 3.14Å; N32-L35 HydrophobicContact CB-CD1 4Å; N32-L35 HydrophobicContact CB-CG 4.08Å; N32-L35 WeakPolarHBondContact O-CB 3.37Å; N32-L35 PolarHBondContact O-N 3.44Å
33	S	84.3	Confident	81.3	Confident	74 Å²	74	67.6 Å²	67.6	52%	0.517	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-65.9	-23.5	178.2	48.9	0	0	0	0	113.5	L35 R36	S33-L35 PolarHBondContact O-N 3.35Å; S33-R36 VanDerWaalsContact O-CB 3.28Å; S33-R36 WeakPolarHBondContact O-CB 3.43Å; S33-R36 WeakPolarHBondContact O-CG 3.01Å; S33-R36 PolarHBondContact O-N 3.5Å
34	D	85.9	Confident	83.1	Confident	117 Å²	117	66.8 Å²	66.8	63%	0.626	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-67.4	-23.4	-178.2	-58	-18.8	0	0	0	111.2	N32 R36 H37 Y38	N32-D34 PolarHBondContact O-N 3.05Å; N32-D34 VanDerWaalsContact OD1-CB 3.3Å; N32-D34 WeakPolarHBondContact OD1-CB 3.5Å; N32-D34 PolarHBondContact OD1-N 3.14Å; D34-R36 PolarHBondContact O-N 2.84Å; D34-R36 VanDerWaalsContact O-N 3.12Å; D34-H37 PolarHBondContact O-N 2.76Å; D34-Y38 PolarHBondContact O-N 2.94Å
35	L	86.4	Confident	84.9	Confident	29 Å²	29	65.4 Å²	65.4	15%	0.152	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-64.8	-11.7	173.5	-64.1	177.8	0	0	0	113.7	D28 I29 N32 S33 H37 Y38 Y54 H204	D28-L35 HydrophobicContact CB-CD1 3.66Å; I29-L35 HydrophobicContact CB-CB 4.21Å; I29-L35 HydrophobicContact CG1-CB 4.04Å; N32-L35 HydrophobicContact CB-CD1 4Å; N32-L35 HydrophobicContact CB-CG 4.08Å; N32-L35 WeakPolarHBondContact O-CB 3.37Å; N32-L35 PolarHBondContact O-N 3.44Å; S33-L35 PolarHBondContact O-N 3.35Å; L35-H37 VanDerWaalsContact C-N 3.3Å; L35-Y38 HydrophobicContact CD2-CD2 4.22Å; L35-Y38 HydrophobicContact CD2-CG 4.2Å; L35-Y54 HydrophobicContact CB-CD2 4.14Å; L35-Y54 HydrophobicContact CD1-CD2 4.11Å; L35-Y54 HydrophobicContact CD1-CE2 4.03Å; L35-H204 PolarHBondContact O-CD2 2.89Å
36	R	84.1	Confident	87	Confident	85 Å²	85	71.2 Å²	71.2	32%	0.321	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-67.3	-29.8	173.3	-70.2	-175.9	-178.2	-145.3	11.6	113.6	I29 S33 D34	I29-R36 HydrophobicContact CD1-CG 4.03Å; I29-R36 HydrophobicContact CG1-CG 4.13Å; S33-R36 VanDerWaalsContact O-CB 3.28Å; S33-R36 WeakPolarHBondContact O-CB 3.43Å; S33-R36 WeakPolarHBondContact O-CG 3.01Å; S33-R36 PolarHBondContact O-N 3.5Å; D34-R36 PolarHBondContact O-N 2.84Å; D34-R36 VanDerWaalsContact O-N 3.12Å
37	H	84.9	Confident	88.5	Confident	166 Å²	166	71.3 Å²	71.3	77%	0.769	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-119.6	20.4	-178.7	-51.8	104.2	0	0	0	111	D34 L35 E39	D34-H37 PolarHBondContact O-N 2.76Å; L35-H37 VanDerWaalsContact C-N 3.3Å; H37-E39 PolarHBondContact O-N 2.85Å; H37-E39 VanDerWaalsContact O-N 3.09Å
38	Y	88.4	Confident	89.3	Confident	80 Å²	80	71.5 Å²	71.5	31%	0.314	36%	0.36	S	S	.	.			trans	-69.2	110.3	-178.8	174.1	-93.9	0	0	0	109.4	D34 L35 I40 H53	D34-Y38 PolarHBondContact O-N 2.94Å; L35-Y38 HydrophobicContact CD2-CD2 4.22Å; L35-Y38 HydrophobicContact CD2-CG 4.2Å; Y38-I40 HydrophobicContact CE1-CG1 4.43Å; Y38-I40 HydrophobicContact CE2-CD1 3.73Å; Y38-I40 HydrophobicContact CE2-CG1 3.9Å; Y38-I40 WeakPolarHBondContact OH-CD1 3.37Å; Y38-H53 WeakPolarHBondContact O-CA 3.5Å
39	E	93.4	Very high	89.9	Confident	83 Å²	83	68.5 Å²	68.5	39%	0.388	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.3	169.2	176	171	-141.9	0	0	109.3	H37 V41 R49 S51 L52 H53	H37-E39 PolarHBondContact O-N 2.85Å; H37-E39 VanDerWaalsContact O-N 3.09Å; E39-V41 HydrophobicContact CG-CG2 4.15Å; E39-R49 IonicContact OE1-CZ 3.86Å; E39-R49 IonicContact OE1-NE 2.62Å; E39-R49 IonicContact OE1-NH2 3.56Å; E39-R49 PolarHBondContact OE1-NH2 2.96Å; E39-R49 IonicContact OE2-NH2 2.68Å; E39-R49 PolarHBondContact OE2-NH2 3.17Å; E39-R49 VanDerWaalsContact OE2-NH2 3.13Å; E39-S51 WeakPolarHBondContact OE1-CB 3.48Å; E39-S51 PolarHBondContact OE1-OG 3.31Å; E39-L52 CarbonylContact C-O 3.59Å; E39-L52 VanDerWaalsContact CA-O 3.32Å; E39-L52 WeakPolarHBondContact CA-O 3.33Å; E39-H53 VanDerWaalsContact CD-CE1 3.47Å; E39-H53 IonicContact OE1-CE1 2.71Å; E39-H53 PolarHBondContact OE1-CE1 3.47Å; E39-H53 VanDerWaalsContact OE1-CE1 3.25Å; E39-H53 IonicContact OE1-NE2 3.41Å
40	I	91.7	Very high	90.4	Very high	42 Å²	42	68.5 Å²	68.5	22%	0.215	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	110.4	167.8	-57.4	-172.5	0	0	0	108.7	Y38 I42 S51 L52	Y38-I40 HydrophobicContact CE1-CG1 4.43Å; Y38-I40 HydrophobicContact CE2-CD1 3.73Å; Y38-I40 HydrophobicContact CE2-CG1 3.9Å; Y38-I40 WeakPolarHBondContact OH-CD1 3.37Å; I40-I42 HydrophobicContact CG2-CD1 3.79Å; I40-I42 PolarHBondContact O-N 3.44Å; I40-S51 CarbonylContact O-C 3.58Å; I40-S51 WeakPolarHBondContact O-CA 3.3Å; I40-S51 WeakPolarHBondContact O-CB 3.02Å; I40-L52 HydrophobicContact CB-CB 4.43Å; I40-L52 PolarHBondContact N-O 2.96Å; I40-L52 PolarHBondContact O-N 3.2Å
41	V	93.2	Very high	90.8	Very high	43 Å²	43	67.1 Å²	67.1	26%	0.261	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	108.4	173.9	-175.6	0	0	0	0	109.8	E39 E44 R49 K252	E39-V41 HydrophobicContact CG-CG2 4.15Å; V41-E44 HydrophobicContact CG1-CB 3.91Å; V41-R49 HydrophobicContact CG1-CG 4.42Å; V41-R49 VanDerWaalsContact CG2-NH2 3.3Å; V41-K252 WeakPolarHBondContact O-CE 3.27Å
42	I	92.2	Very high	91.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-52.5	-179.7	-54.8	-59.9	0	0	0	109.8	I40 Y50 L52 C250 K252 D271 V274	I40-I42 HydrophobicContact CG2-CD1 3.79Å; I40-I42 PolarHBondContact O-N 3.44Å; I42-Y50 HydrophobicContact CB-CD1 3.95Å; I42-Y50 HydrophobicContact CG1-CD1 3.96Å; I42-Y50 HydrophobicContact CG1-CE1 4.3Å; I42-Y50 HydrophobicContact CG2-CD1 4.41Å; I42-Y50 PolarHBondContact N-O 3.26Å; I42-L52 HydrophobicContact CD1-CD1 3.9Å; I42-L52 HydrophobicContact CD1-CG 4.09Å; I42-L52 HydrophobicContact CG1-CD1 4.24Å; I42-L52 HydrophobicContact CG1-CG 3.94Å; I42-C250 HydrophobicContact CD1-CB 4.01Å; I42-K252 WeakPolarHBondContact O-CD 3.26Å; I42-K252 WeakPolarHBondContact O-CE 3.48Å; I42-K252 PolarHBondContact O-NZ 2.86Å; I42-D271 WeakPolarHBondContact CG2-O 3.39Å; I42-V274 HydrophobicContact CG2-CG2 4.45Å
43	I	91.4	Very high	91.5	Very high	41 Å²	41	56.7 Å²	56.7	21%	0.21	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.9	178.6	-177.7	166.7	0	0	0	109.7	Y48 R49 Y50 V274	I43-Y48 HydrophobicContact CG2-CD1 3.9Å; I43-Y48 HydrophobicContact CG2-CE1 3.68Å; I43-R49 CarbonylContact O-C 3.56Å; I43-R49 VanDerWaalsContact O-CA 3.31Å; I43-R49 WeakPolarHBondContact O-CA 2.9Å; I43-Y50 PolarHBondContact N-O 2.9Å; I43-Y50 PolarHBondContact O-N 2.93Å; I43-V274 HydrophobicContact CB-CG2 4.1Å; I43-V274 HydrophobicContact CD1-CG1 4.43Å; I43-V274 HydrophobicContact CD1-CG2 4.22Å
44	E	93.6	Very high	91.8	Very high	70 Å²	70	53.8 Å²	53.8	33%	0.327	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	131.5	174.6	-177.8	169	155.4	0	0	109.7	V41 Y48 R49 K211 W212	V41-E44 HydrophobicContact CG1-CB 3.91Å; E44-Y48 CarbonylContact C-O 3.54Å; E44-Y48 WeakPolarHBondContact CA-O 3.3Å; E44-R49 HydrophobicContact CB-CG 4.41Å; E44-R49 HydrophobicContact CG-CB 4.36Å; E44-R49 HydrophobicContact CG-CG 4.41Å; E44-R49 IonicContact OE1-NH1 2.94Å; E44-R49 WeakPolarHBondContact OE2-CD 3.45Å; E44-R49 IonicContact OE2-CZ 3.45Å; E44-R49 IonicContact OE2-NE 3.75Å; E44-R49 IonicContact OE2-NH1 3.14Å; E44-R49 PolarHBondContact OE2-NH1 2.87Å; E44-K211 IonicContact OE1-NZ 3.81Å; E44-K211 PolarHBondContact OE1-NZ 2.82Å; E44-W212 HydrophobicContact CG-CZ2 4.12Å
45	N	93.7	Very high	92.1	Very high	73 Å²	73	49.1 Å²	49.1	39%	0.39	24%	0.238	S	C	.	.			trans	-139.3	-168.7	166.3	65.5	45.9	0	0	0	108.7	T47 Y48 W212	N45-T47 PolarHBondContact O-N 2.79Å; N45-T47 WeakPolarHBondContact OD1-CA 3.19Å; N45-T47 PolarHBondContact OD1-N 2.79Å; N45-T47 PolarHBondContact OD1-OG1 3.49Å; N45-T47 VanDerWaalsContact OD1-OG1 3.05Å; N45-Y48 PolarHBondContact N-O 3.01Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.47Å; N45-Y48 PolarHBondContact OD1-N 2.79Å; N45-W212 WeakPolarHBondContact O-CH2 3.34Å
46	D	94.1	Very high	92.4	Very high	157 Å²	157	47.8 Å²	47.8	84%	0.84	23%	0.231	S	C	*	.	S	Bend	trans	-67.8	-18.8	-176.9	-65.4	-26.1	0	0	0	114.6
47	T	96.1	Very high	92.9	Very high	64 Å²	64	43.8 Å²	43.8	39%	0.393	22%	0.216	S	C	.	.	S	Bend	trans	-120.4	-12.1	-172.6	64.2	0	0	0	0	114.8	N45 R62 Y63	N45-T47 PolarHBondContact O-N 2.79Å; N45-T47 WeakPolarHBondContact OD1-CA 3.19Å; N45-T47 PolarHBondContact OD1-N 2.79Å; N45-T47 PolarHBondContact OD1-OG1 3.49Å; N45-T47 VanDerWaalsContact OD1-OG1 3.05Å; T47-R62 HydrophobicContact CG2-CB 4.37Å; T47-R62 WeakPolarHBondContact O-CB 3.45Å; T47-R62 WeakPolarHBondContact O-CG 3.33Å; T47-R62 PolarHBondContact O-N 3.09Å; T47-Y63 HydrophobicContact CG2-CD2 4.29Å; T47-Y63 HydrophobicContact CG2-CE2 3.84Å
48	Y	95.7	Very high	93.5	Very high	32 Å²	32	35.9 Å²	35.9	13%	0.125	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	138	-171.4	-167.6	-103.2	0	0	0	111.7	I43 E44 N45 R59 I60 Q61 D271	I43-Y48 HydrophobicContact CG2-CD1 3.9Å; I43-Y48 HydrophobicContact CG2-CE1 3.68Å; E44-Y48 CarbonylContact C-O 3.54Å; E44-Y48 WeakPolarHBondContact CA-O 3.3Å; N45-Y48 PolarHBondContact N-O 3.01Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.47Å; N45-Y48 PolarHBondContact OD1-N 2.79Å; Y48-R59 HydrophobicContact CE2-CG 3.82Å; Y48-R59 VanDerWaalsContact OH-CD 3.24Å; Y48-R59 WeakPolarHBondContact OH-CD 3.31Å; Y48-R59 WeakPolarHBondContact OH-CG 3.5Å; Y48-R59 PolarHBondContact OH-NE 3.46Å; Y48-R59 VanDerWaalsContact OH-NE 3.12Å; Y48-I60 CarbonylContact C-O 3.56Å; Y48-I60 VanDerWaalsContact CA-O 3.32Å; Y48-I60 WeakPolarHBondContact CA-O 3.22Å; Y48-Q61 HydrophobicContact CD2-CG 3.54Å; Y48-Q61 HydrophobicContact CE2-CG 3.5Å; Y48-D271 WeakPolarHBondContact CE1-OD1 3.06Å; Y48-D271 VanDerWaalsContact CZ-OD1 3.29Å; Y48-D271 PolarHBondContact OH-OD1 3.18Å; Y48-D271 PolarHBondContact OH-OD2 3.46Å; Y48-D271 VanDerWaalsContact OH-OD2 3.06Å
49	R	96	Very high	93.8	Very high	20 Å²	20	32.1 Å²	32.1	8%	0.075	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	136.1	167.7	178.1	176	173.8	137.3	-10.2	110	E39 V41 I43 E44 R59 I60 W212	E39-R49 IonicContact OE1-CZ 3.86Å; E39-R49 IonicContact OE1-NE 2.62Å; E39-R49 IonicContact OE1-NH2 3.56Å; E39-R49 PolarHBondContact OE1-NH2 2.96Å; E39-R49 IonicContact OE2-NH2 2.68Å; E39-R49 PolarHBondContact OE2-NH2 3.17Å; E39-R49 VanDerWaalsContact OE2-NH2 3.13Å; V41-R49 HydrophobicContact CG1-CG 4.42Å; V41-R49 VanDerWaalsContact CG2-NH2 3.3Å; I43-R49 CarbonylContact O-C 3.56Å; I43-R49 VanDerWaalsContact O-CA 3.31Å; I43-R49 WeakPolarHBondContact O-CA 2.9Å; E44-R49 HydrophobicContact CB-CG 4.41Å; E44-R49 HydrophobicContact CG-CB 4.36Å; E44-R49 HydrophobicContact CG-CG 4.41Å; E44-R49 IonicContact OE1-NH1 2.94Å; E44-R49 WeakPolarHBondContact OE2-CD 3.45Å; E44-R49 IonicContact OE2-CZ 3.45Å; E44-R49 IonicContact OE2-NE 3.75Å; E44-R49 IonicContact OE2-NH1 3.14Å; E44-R49 PolarHBondContact OE2-NH1 2.87Å; R49-R59 CarbonylContact O-C 3.54Å; R49-R59 WeakPolarHBondContact O-CA 3.46Å; R49-I60 HydrophobicContact CB-CB 4.17Å; R49-I60 HydrophobicContact CB-CD1 4.45Å; R49-I60 HydrophobicContact CB-CG1 4.44Å; R49-I60 PolarHBondContact N-O 2.91Å; R49-I60 PolarHBondContact O-N 2.83Å; R49-W212 HydrophobicContact CB-CH2 4.1Å; R49-W212 HydrophobicContact CB-CZ2 3.66Å
50	Y	95.1	Very high	94.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.7	168.6	-176	-110.2	0	0	0	109.2	I42 I43 L52 S57 M58 R59 I257 D271	I42-Y50 HydrophobicContact CB-CD1 3.95Å; I42-Y50 HydrophobicContact CG1-CD1 3.96Å; I42-Y50 HydrophobicContact CG1-CE1 4.3Å; I42-Y50 HydrophobicContact CG2-CD1 4.41Å; I42-Y50 PolarHBondContact N-O 3.26Å; I43-Y50 PolarHBondContact N-O 2.9Å; I43-Y50 PolarHBondContact O-N 2.93Å; Y50-L52 HydrophobicContact CE1-CD2 3.8Å; Y50-S57 WeakPolarHBondContact OH-CB 3.32Å; Y50-M58 CarbonylContact C-O 3.6Å; Y50-M58 WeakPolarHBondContact CA-O 3.33Å; Y50-R59 HydrophobicContact CD2-CB 4.01Å; Y50-R59 HydrophobicContact CD2-CG 4.39Å; Y50-I257 WeakPolarHBondContact OH-CD1 3.13Å; Y50-D271 HydrophobicContact CD1-CB 3.66Å; Y50-D271 HydrophobicContact CE1-CB 3.98Å; Y50-D271 HydrophobicContact CG-CB 3.98Å
51	S	94.9	Very high	94.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151.1	177.1	59.9	0	0	0	0	112.8	E39 I40 H53 S57 M58	E39-S51 WeakPolarHBondContact OE1-CB 3.48Å; E39-S51 PolarHBondContact OE1-OG 3.31Å; I40-S51 CarbonylContact O-C 3.58Å; I40-S51 WeakPolarHBondContact O-CA 3.3Å; I40-S51 WeakPolarHBondContact O-CB 3.02Å; S51-H53 PolarHBondContact OG-NE2 2.97Å; S51-S57 CarbonylContact O-C 3.54Å; S51-S57 WeakPolarHBondContact O-CA 3.33Å; S51-M58 PolarHBondContact N-O 2.68Å; S51-M58 PolarHBondContact O-N 3.4Å; S51-M58 WeakPolarHBondContact OG-CE 3.46Å
52	L	93.4	Very high	94.6	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.4	176.3	-51.3	-180	0	0	0	109.1	E39 I40 I42 Y50 I224 A255 I257	E39-L52 CarbonylContact C-O 3.59Å; E39-L52 VanDerWaalsContact CA-O 3.32Å; E39-L52 WeakPolarHBondContact CA-O 3.33Å; I40-L52 HydrophobicContact CB-CB 4.43Å; I40-L52 PolarHBondContact N-O 2.96Å; I40-L52 PolarHBondContact O-N 3.2Å; I42-L52 HydrophobicContact CD1-CD1 3.9Å; I42-L52 HydrophobicContact CD1-CG 4.09Å; I42-L52 HydrophobicContact CG1-CD1 4.24Å; I42-L52 HydrophobicContact CG1-CG 3.94Å; Y50-L52 HydrophobicContact CE1-CD2 3.8Å; L52-I224 HydrophobicContact CB-CD1 4.26Å; L52-I224 HydrophobicContact CD2-CD1 3.75Å; L52-A255 HydrophobicContact CD1-CB 4Å; L52-I257 HydrophobicContact CD1-CG2 3.69Å; L52-I257 HydrophobicContact CD2-CD1 4.47Å; L52-I257 HydrophobicContact CD2-CG2 4.06Å
53	H	93.7	Very high	94.8	Very high	11 Å²	11	35.2 Å²	35.2	5%	0.051	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	176	179.3	-58.9	-95.4	0	0	0	109.6	Y38 E39 S51 N55 Y56 I206	Y38-H53 WeakPolarHBondContact O-CA 3.5Å; E39-H53 VanDerWaalsContact CD-CE1 3.47Å; E39-H53 IonicContact OE1-CE1 2.71Å; E39-H53 PolarHBondContact OE1-CE1 3.47Å; E39-H53 VanDerWaalsContact OE1-CE1 3.25Å; E39-H53 IonicContact OE1-NE2 3.41Å; S51-H53 PolarHBondContact OG-NE2 2.97Å; H53-N55 PolarHBondContact O-N 3.26Å; H53-N55 VanDerWaalsContact O-N 3.15Å; H53-Y56 CarbonylContact C-O 3.56Å; H53-Y56 WeakPolarHBondContact CA-O 3.29Å; H53-Y56 WeakPolarHBondContact CB-O 3.34Å; H53-Y56 PolarHBondContact N-O 2.93Å; H53-Y56 PolarHBondContact O-N 2.89Å; H53-Y56 VanDerWaalsContact O-O 3.12Å; H53-I206 HydrophobicContact CB-CD1 3.56Å; H53-I206 HydrophobicContact CB-CG1 3.82Å; H53-I206 HydrophobicContact CB-CG2 4.44Å
54	Y	90.9	Very high	95.1	Very high	13 Å²	13	36 Å²	36	5%	0.051	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	120.1	175.3	-178.7	-103.6	0	0	0	110.6	D28 I29 L35 Y56 Y92 I195 H204	D28-Y54 HydrophobicContact CB-CE2 4.43Å; I29-Y54 HydrophobicContact CB-CD1 4.48Å; I29-Y54 HydrophobicContact CB-CE1 3.97Å; I29-Y54 HydrophobicContact CB-CE2 4.06Å; I29-Y54 HydrophobicContact CD1-CD1 4.06Å; I29-Y54 HydrophobicContact CD1-CE1 4.22Å; I29-Y54 HydrophobicContact CD1-CG 4.46Å; I29-Y54 HydrophobicContact CG2-CE1 3.85Å; L35-Y54 HydrophobicContact CB-CD2 4.14Å; L35-Y54 HydrophobicContact CD1-CD2 4.11Å; L35-Y54 HydrophobicContact CD1-CE2 4.03Å; Y54-Y56 PolarHBondContact O-N 3.44Å; Y54-Y56 VanDerWaalsContact O-N 3.11Å; Y54-Y92 HydrophobicContact CD1-CE1 4.49Å; Y54-I195 HydrophobicContact CD1-CD1 4.22Å; Y54-I195 HydrophobicContact CE1-CD1 3.84Å; Y54-H204 WeakPolarHBondContact CB-NE2 3.48Å
55	N	90.8	Very high	95.2	Very high	19 Å²	19	37.4 Å²	37.4	10%	0.102	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	-1.7	-175.6	-65.4	-16.4	0	0	0	117.1	H53 V223 I224 K226	H53-N55 PolarHBondContact O-N 3.26Å; H53-N55 VanDerWaalsContact O-N 3.15Å; N55-V223 CarbonylContact O-C 3.49Å; N55-V223 WeakPolarHBondContact O-CA 3.28Å; N55-I224 PolarHBondContact O-N 3.38Å; N55-K226 WeakPolarHBondContact OD1-CE 3.07Å
56	Y	93.9	Very high	95.3	Very high	1 Å²	1	38 Å²	38	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144.7	-173.5	-72.6	-88.5	0	0	0	112.5	H53 Y54 Y91 Y92 M171 I191 I206 F221 E222 V223 I224	H53-Y56 CarbonylContact C-O 3.56Å; H53-Y56 WeakPolarHBondContact CA-O 3.29Å; H53-Y56 WeakPolarHBondContact CB-O 3.34Å; H53-Y56 PolarHBondContact N-O 2.93Å; H53-Y56 PolarHBondContact O-N 2.89Å; H53-Y56 VanDerWaalsContact O-O 3.12Å; Y54-Y56 PolarHBondContact O-N 3.44Å; Y54-Y56 VanDerWaalsContact O-N 3.11Å; Y56-Y91 WeakPolarHBondContact OH-CA 3.48Å; Y56-Y92 HydrophobicContact CD2-CE1 4.11Å; Y56-Y92 HydrophobicContact CD2-CE2 4.33Å; Y56-Y92 AromaticContact CE2-CD1 3.96Å; Y56-Y92 HydrophobicContact CE2-CD1 3.96Å; Y56-Y92 AromaticContact CE2-CD2 3.68Å; Y56-Y92 HydrophobicContact CE2-CD2 3.68Å; Y56-Y92 AromaticContact CE2-CE1 3.88Å; Y56-Y92 HydrophobicContact CE2-CE1 3.88Å; Y56-Y92 AromaticContact CE2-CE2 3.62Å; Y56-Y92 HydrophobicContact CE2-CE2 3.62Å; Y56-Y92 AromaticContact CE2-CG 3.88Å; Y56-Y92 HydrophobicContact CE2-CG 3.88Å; Y56-Y92 AromaticContact CE2-CZ 3.73Å; Y56-Y92 PolarHBondContact OH-N 3.23Å; Y56-M171 HydrophobicContact CD1-CE 4.15Å; Y56-M171 HydrophobicContact CE1-CE 3.5Å; Y56-M171 VanDerWaalsContact CE1-CE 3.5Å; Y56-I191 HydrophobicContact CD1-CD1 4.03Å; Y56-I191 HydrophobicContact CD2-CD1 4.1Å; Y56-I191 HydrophobicContact CE1-CD1 4.28Å; Y56-I191 HydrophobicContact CE2-CD1 4.36Å; Y56-I191 HydrophobicContact CG-CD1 3.94Å; Y56-I206 HydrophobicContact CD2-CD1 4.12Å; Y56-I206 HydrophobicContact CG-CD1 4.16Å; Y56-F221 HydrophobicContact CD1-CB 4.27Å; Y56-E222 CarbonylContact C-O 3.48Å; Y56-E222 VanDerWaalsContact CA-O 3.24Å; Y56-E222 WeakPolarHBondContact CA-O 3.21Å; Y56-V223 HydrophobicContact CD1-CG2 4.25Å; Y56-V223 HydrophobicContact CE1-CG2 3.6Å; Y56-I224 WeakPolarHBondContact O-CD1 3.27Å
57	S	94.1	Very high	95.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	142.1	161.9	58.7	0	0	0	0	109	Y50 S51 F221 E222	Y50-S57 WeakPolarHBondContact OH-CB 3.32Å; S51-S57 CarbonylContact O-C 3.54Å; S51-S57 WeakPolarHBondContact O-CA 3.33Å; S57-F221 WeakPolarHBondContact O-CA 3.5Å; S57-E222 PolarHBondContact N-O 2.92Å; S57-E222 PolarHBondContact O-N 3.29Å; S57-E222 PolarHBondContact OG-O 2.88Å
58	M	96.7	Very high	95.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.9	172.4	-178.3	179	62	0	0	109.4	Y50 S51 I60 I206 V208 V219 E220 F221	Y50-M58 CarbonylContact C-O 3.6Å; Y50-M58 WeakPolarHBondContact CA-O 3.33Å; S51-M58 PolarHBondContact N-O 2.68Å; S51-M58 PolarHBondContact O-N 3.4Å; S51-M58 WeakPolarHBondContact OG-CE 3.46Å; M58-I60 HydrophobicContact CE-CD1 3.92Å; M58-I60 HydrophobicContact CE-CG1 4.41Å; M58-I60 HydrophobicContact CG-CG1 4.13Å; M58-I60 HydrophobicContact SD-CD1 4.06Å; M58-I60 HydrophobicContact SD-CG1 4.26Å; M58-I206 HydrophobicContact SD-CG2 4.38Å; M58-V208 HydrophobicContact SD-CG2 4.42Å; M58-V219 HydrophobicContact CG-CG1 3.91Å; M58-V219 HydrophobicContact SD-CG1 4.16Å; M58-E220 CarbonylContact C-O 3.4Å; M58-E220 WeakPolarHBondContact CA-O 3.35Å; M58-F221 HydrophobicContact CB-CD1 4.08Å; M58-F221 HydrophobicContact CB-CE1 4.01Å; M58-F221 HydrophobicContact CG-CD1 4.14Å; M58-F221 HydrophobicContact CG-CE1 3.72Å; M58-F221 HydrophobicContact CG-CZ 4.3Å; M58-F221 HydrophobicContact SD-CE1 3.73Å; M58-F221 HydrophobicContact SD-CZ 4.06Å
59	R	96.4	Very high	95.2	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.1	169.6	-172	178.1	-64	108.6	-0.3	109.6	Y48 R49 Y50 Q61 V219 E220 E222 M267 D271	Y48-R59 HydrophobicContact CE2-CG 3.82Å; Y48-R59 VanDerWaalsContact OH-CD 3.24Å; Y48-R59 WeakPolarHBondContact OH-CD 3.31Å; Y48-R59 WeakPolarHBondContact OH-CG 3.5Å; Y48-R59 PolarHBondContact OH-NE 3.46Å; Y48-R59 VanDerWaalsContact OH-NE 3.12Å; R49-R59 CarbonylContact O-C 3.54Å; R49-R59 WeakPolarHBondContact O-CA 3.46Å; Y50-R59 HydrophobicContact CD2-CB 4.01Å; Y50-R59 HydrophobicContact CD2-CG 4.39Å; R59-Q61 HydrophobicContact CG-CG 4.44Å; R59-V219 CarbonylContact O-C 3.6Å; R59-V219 VanDerWaalsContact O-CA 3.29Å; R59-V219 WeakPolarHBondContact O-CA 3.46Å; R59-E220 HydrophobicContact CB-CB 4.43Å; R59-E220 PolarHBondContact N-O 3.37Å; R59-E220 IonicContact NH1-OE2 3.61Å; R59-E220 PolarHBondContact NH1-OE2 3.05Å; R59-E220 PolarHBondContact O-N 3.09Å; R59-E222 IonicContact CZ-OE1 3.73Å; R59-E222 IonicContact NH1-OE1 2.65Å; R59-E222 PolarHBondContact NH1-OE1 2.65Å; R59-M267 VanDerWaalsContact NE-CE 3.29Å; R59-D271 IonicContact CZ-OD2 3.57Å; R59-D271 IonicContact NE-OD2 3.44Å; R59-D271 PolarHBondContact NE-OD2 2.97Å; R59-D271 IonicContact NH2-OD2 2.77Å; R59-D271 PolarHBondContact NH2-OD2 3.13Å
60	I	98	Very high	95	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.2	175.6	-51	-177.2	0	0	0	108.5	Y48 R49 M58 V208 W212 T217 L218 V219	Y48-I60 CarbonylContact C-O 3.56Å; Y48-I60 VanDerWaalsContact CA-O 3.32Å; Y48-I60 WeakPolarHBondContact CA-O 3.22Å; R49-I60 HydrophobicContact CB-CB 4.17Å; R49-I60 HydrophobicContact CB-CD1 4.45Å; R49-I60 HydrophobicContact CB-CG1 4.44Å; R49-I60 PolarHBondContact N-O 2.91Å; R49-I60 PolarHBondContact O-N 2.83Å; M58-I60 HydrophobicContact CE-CD1 3.92Å; M58-I60 HydrophobicContact CE-CG1 4.41Å; M58-I60 HydrophobicContact CG-CG1 4.13Å; M58-I60 HydrophobicContact SD-CD1 4.06Å; M58-I60 HydrophobicContact SD-CG1 4.26Å; I60-V208 HydrophobicContact CD1-CG1 4.24Å; I60-W212 HydrophobicContact CB-CD2 4.37Å; I60-W212 HydrophobicContact CB-CE3 4.28Å; I60-W212 HydrophobicContact CD1-CB 4.05Å; I60-W212 HydrophobicContact CD1-CD2 4.16Å; I60-W212 HydrophobicContact CD1-CG 3.74Å; I60-W212 HydrophobicContact CG2-CB 3.94Å; I60-W212 HydrophobicContact CG2-CD2 3.67Å; I60-W212 HydrophobicContact CG2-CE3 3.38Å; I60-W212 HydrophobicContact CG2-CG 3.92Å; I60-W212 HydrophobicContact CG2-CZ3 4.06Å; I60-T217 HydrophobicContact CG2-CG2 3.41Å; I60-T217 VanDerWaalsContact CG2-CG2 3.41Å; I60-L218 WeakPolarHBondContact CA-O 3.35Å; I60-V219 HydrophobicContact CG1-CG1 4.26Å; I60-V219 HydrophobicContact CG1-CG2 4.21Å; I60-V219 HydrophobicContact CG2-CG2 4.24Å
61	Q	97.7	Very high	94.9	Very high	34 Å²	34	38.7 Å²	38.7	16%	0.159	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.1	179.3	-79.4	169.7	-135.8	0	0	110.9	Y48 R59 Q64 T217 L218	Y48-Q61 HydrophobicContact CD2-CG 3.54Å; Y48-Q61 HydrophobicContact CE2-CG 3.5Å; R59-Q61 HydrophobicContact CG-CG 4.44Å; Q61-Q64 HydrophobicContact CB-CG 3.56Å; Q61-Q64 VanDerWaalsContact NE2-CD 3.33Å; Q61-Q64 VanDerWaalsContact NE2-OE1 3.07Å; Q61-Q64 WeakPolarHBondContact O-CG 3.4Å; Q61-T217 CarbonylContact O-C 3.52Å; Q61-T217 VanDerWaalsContact O-CA 3.31Å; Q61-T217 WeakPolarHBondContact O-CA 3.33Å; Q61-L218 PolarHBondContact N-O 3.13Å; Q61-L218 PolarHBondContact O-N 2.87Å
62	R	97.7	Very high	95	Very high	32 Å²	32	42.8 Å²	42.8	12%	0.121	22%	0.218	C	C	.	.	S	Bend	trans	-83.3	159.7	173	-65.8	-67.5	-61.9	-164.8	3.2	112.1	T47 Q64 W212 K214 G216 T217	T47-R62 HydrophobicContact CG2-CB 4.37Å; T47-R62 WeakPolarHBondContact O-CB 3.45Å; T47-R62 WeakPolarHBondContact O-CG 3.33Å; T47-R62 PolarHBondContact O-N 3.09Å; R62-Q64 PolarHBondContact O-N 3.06Å; R62-Q64 PolarHBondContact O-NE2 2.85Å; R62-W212 HydrophobicContact CG-CE3 4.13Å; R62-W212 HydrophobicContact CG-CZ3 3.78Å; R62-K214 VanDerWaalsContact NH1-CD 3.3Å; R62-G216 CarbonylContact C-O 3.47Å; R62-T217 VanDerWaalsContact CD-OG1 3.25Å; R62-T217 WeakPolarHBondContact CD-OG1 3.01Å; R62-T217 PolarHBondContact NH1-OG1 2.91Å
63	Y	97	Very high	95.1	Very high	168 Å²	168	43.1 Å²	43.1	66%	0.659	22%	0.22	S	C	*	.	S	Bend	trans	56.4	36.3	172	-46.8	-63.3	0	0	0	113.3	T47 G216	T47-Y63 HydrophobicContact CG2-CD2 4.29Å; T47-Y63 HydrophobicContact CG2-CE2 3.84Å; Y63-G216 WeakPolarHBondContact CA-O 3.2Å; Y63-G216 PolarHBondContact N-O 2.77Å
64	Q	97.5	Very high	94.7	Very high	57 Å²	57	49 Å²	49	27%	0.266	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-85.8	141.8	177.6	-60.5	-55.9	-66.1	0	0	110.4	Q61 R62 Y174 G216 L218	Q61-Q64 HydrophobicContact CB-CG 3.56Å; Q61-Q64 VanDerWaalsContact NE2-CD 3.33Å; Q61-Q64 VanDerWaalsContact NE2-OE1 3.07Å; Q61-Q64 WeakPolarHBondContact O-CG 3.4Å; R62-Q64 PolarHBondContact O-N 3.06Å; R62-Q64 PolarHBondContact O-NE2 2.85Å; Q64-Y174 HydrophobicContact CB-CE2 4.29Å; Q64-Y174 WeakPolarHBondContact O-CE2 3.34Å; Q64-Y174 PolarHBondContact O-OH 3.14Å; Q64-G216 PolarHBondContact N-O 2.83Å; Q64-L218 HydrophobicContact CB-CB 3.97Å; Q64-L218 HydrophobicContact CG-CB 3.85Å
65	P	96.3	Very high	94.4	Very high	99 Å²	99	54 Å²	54	64%	0.643	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-63.8	164.5	168.8	31	-35.4	0	0	0	110.3	Y174	P65-Y174 WeakPolarHBondContact O-CE2 3.42Å
66	Q	94.9	Very high	94.4	Very high	87 Å²	87	60 Å²	60	41%	0.407	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-55.1	127	170.4	-83.5	177.3	-15.8	0	0	109.6	V68 Y174 D176	Q66-V68 PolarHBondContact O-N 2.98Å; Q66-Y174 HydrophobicContact CB-CE1 4.23Å; Q66-Y174 HydrophobicContact CG-CD1 4.27Å; Q66-Y174 HydrophobicContact CG-CE1 3.47Å; Q66-Y174 VanDerWaalsContact CG-CE1 3.47Å; Q66-Y174 PolarHBondContact N-OH 3.36Å; Q66-D176 WeakPolarHBondContact CG-OD1 3.2Å; Q66-D176 PolarHBondContact NE2-OD1 3.17Å
67	P	94.4	Very high	94.1	Very high	56 Å²	56	60.3 Å²	60.3	36%	0.364	30%	0.3	S	S	.	.	S	Bend	trans	-67.2	-23.2	180	26.5	-34.4	0	0	0	111.9	L164 Y174 L218	P67-L164 HydrophobicContact CB-CD1 4.02Å; P67-L164 HydrophobicContact CG-CD1 3.71Å; P67-Y174 VanDerWaalsContact CD-CG 3.5Å; P67-Y174 HydrophobicContact CG-CD2 4.47Å; P67-Y174 HydrophobicContact CG-CG 4.11Å; P67-L218 HydrophobicContact CG-CD1 4.36Å
68	V	95.1	Very high	93.6	Very high	13 Å²	13	65.4 Å²	65.4	8%	0.079	34%	0.336	C	S	.	.	S	Bend	trans	-145.1	139.8	-177.9	-177	0	0	0	0	109	Q66 R72 F73 L136 L141 L164	Q66-V68 PolarHBondContact O-N 2.98Å; V68-R72 HydrophobicContact CG1-CB 4.16Å; V68-R72 HydrophobicContact CG1-CG 4.46Å; V68-F73 HydrophobicContact CB-CE2 4.38Å; V68-F73 HydrophobicContact CG1-CE2 4.18Å; V68-L136 HydrophobicContact CG1-CD1 3.64Å; V68-L141 HydrophobicContact CG1-CD2 4.44Å; V68-L141 HydrophobicContact CG2-CD2 3.61Å; V68-L164 HydrophobicContact CB-CD1 4.43Å; V68-L164 HydrophobicContact CG2-CD1 3.49Å; V68-L164 VanDerWaalsContact CG2-CD1 3.49Å; V68-L164 HydrophobicContact CG2-CD2 4.13Å; V68-L164 HydrophobicContact CG2-CG 4.48Å
69	S	94.5	Very high	93.2	Very high	66 Å²	66	72.1 Å²	72.1	46%	0.462	36%	0.362	S	S	.	.			trans	-65.5	138	177.2	-171.7	0	0	0	0	112	D71 R72	S69-D71 VanDerWaalsContact C-N 3.26Å; S69-D71 WeakPolarHBondContact CB-OD1 3.43Å; S69-D71 PolarHBondContact O-N 3.35Å; S69-D71 PolarHBondContact OG-OD1 2.98Å; S69-R72 WeakPolarHBondContact O-CB 3.41Å; S69-R72 PolarHBondContact O-N 3.35Å
70	S	92	Very high	93	Very high	37 Å²	37	75.2 Å²	75.2	26%	0.259	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-64.2	-25.9	-173.5	-71.6	0	0	0	0	114.2	R72 F73 K145	S70-R72 PolarHBondContact O-N 2.98Å; S70-F73 PolarHBondContact O-N 3.33Å; S70-K145 PolarHBondContact OG-NZ 2.88Å
71	D	93.6	Very high	92.8	Very high	115 Å²	115	78.4 Å²	78.4	62%	0.615	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-69.5	-14.2	177.7	67.1	-44.7	0	0	0	113.9	S69 F73	S69-D71 VanDerWaalsContact C-N 3.26Å; S69-D71 WeakPolarHBondContact CB-OD1 3.43Å; S69-D71 PolarHBondContact O-N 3.35Å; S69-D71 PolarHBondContact OG-OD1 2.98Å; D71-F73 VanDerWaalsContact C-N 3.34Å
72	R	95.6	Very high	92.6	Very high	85 Å²	85	78.9 Å²	78.9	32%	0.321	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-77	-21.1	175.1	-68.3	-178.7	61.6	-170.5	1.9	113.1	V68 S69 S70 K74 L136 E138	V68-R72 HydrophobicContact CG1-CB 4.16Å; V68-R72 HydrophobicContact CG1-CG 4.46Å; S69-R72 WeakPolarHBondContact O-CB 3.41Å; S69-R72 PolarHBondContact O-N 3.35Å; S70-R72 PolarHBondContact O-N 2.98Å; R72-K74 PolarHBondContact O-N 2.99Å; R72-L136 HydrophobicContact CB-CD1 3.72Å; R72-E138 IonicContact CZ-OE1 3.13Å; R72-E138 IonicContact CZ-OE2 2.94Å; R72-E138 IonicContact NE-OE1 3.84Å; R72-E138 PolarHBondContact NE-OE1 3.23Å; R72-E138 IonicContact NE-OE2 3.23Å; R72-E138 IonicContact NH2-OE1 2.67Å; R72-E138 PolarHBondContact NH2-OE1 3.41Å; R72-E138 VanDerWaalsContact NH2-OE1 3.14Å; R72-E138 IonicContact NH2-OE2 3.56Å; R72-E138 PolarHBondContact NH2-OE2 2.71Å
73	F	96.1	Very high	92.4	Very high	11 Å²	11	77.3 Å²	77.3	5%	0.048	39%	0.394	C	S	.	.			trans	-77.5	112.3	175.5	-65.6	-93.8	0	0	0	109.2	V68 S70 D71 E134 I135 L136 K145 T162 L164	V68-F73 HydrophobicContact CB-CE2 4.38Å; V68-F73 HydrophobicContact CG1-CE2 4.18Å; S70-F73 PolarHBondContact O-N 3.33Å; D71-F73 VanDerWaalsContact C-N 3.34Å; F73-E134 HydrophobicContact CB-CB 3.8Å; F73-E134 WeakPolarHBondContact CD1-O 3.05Å; F73-I135 CarbonylContact C-O 3.42Å; F73-I135 VanDerWaalsContact CA-O 3.3Å; F73-I135 WeakPolarHBondContact CA-O 3.46Å; F73-L136 HydrophobicContact CD1-CB 3.64Å; F73-L136 HydrophobicContact CE1-CB 3.65Å; F73-L136 HydrophobicContact CE1-CD1 4.36Å; F73-L136 HydrophobicContact CE2-CD1 4.21Å; F73-L136 HydrophobicContact CG-CB 4.24Å; F73-L136 HydrophobicContact CZ-CB 4.25Å; F73-L136 HydrophobicContact CZ-CD1 4.13Å; F73-K145 HydrophobicContact CB-CB 4.41Å; F73-K145 HydrophobicContact CD1-CB 3.61Å; F73-K145 HydrophobicContact CD2-CB 4.24Å; F73-K145 HydrophobicContact CD2-CD 4.33Å; F73-K145 HydrophobicContact CE1-CB 3.86Å; F73-K145 HydrophobicContact CE2-CB 4.45Å; F73-K145 HydrophobicContact CG-CB 3.81Å; F73-K145 HydrophobicContact CG-CD 4.49Å; F73-K145 HydrophobicContact CZ-CB 4.27Å; F73-T162 HydrophobicContact CE1-CG2 4.08Å; F73-T162 HydrophobicContact CE2-CG2 4.22Å; F73-T162 HydrophobicContact CZ-CG2 3.44Å; F73-T162 VanDerWaalsContact CZ-CG2 3.44Å; F73-L164 HydrophobicContact CE1-CD2 4.39Å; F73-L164 HydrophobicContact CZ-CD2 3.92Å
74	K	86.4	Confident	92.3	Very high	135 Å²	135	75.1 Å²	75.1	59%	0.587	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	148.3	-174.3	-64.2	175.3	-175.6	175.5	0	108.8	R72 I135	R72-K74 PolarHBondContact O-N 2.99Å; K74-I135 CarbonylContact C-O 3.54Å; K74-I135 PolarHBondContact N-O 2.89Å; K74-I135 CarbonylContact O-C 3.56Å; K74-I135 PolarHBondContact O-N 2.9Å
75	N	84.8	Confident	92	Very high	118 Å²	118	73.5 Å²	73.5	63%	0.631	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	72.8	128.6	-177.7	-43.2	-46.8	0	0	0	113.8	E134 I135	N75-E134 WeakPolarHBondContact O-CA 3.34Å; N75-I135 PolarHBondContact O-N 3.38Å; N75-I135 VanDerWaalsContact O-N 3.15Å
76	K	89.6	Confident	91.9	Very high	145 Å²	145	77.1 Å²	77.1	63%	0.63	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	139.8	174	-65.2	-172.8	176.9	-168	0	110.1	S133	K76-S133 WeakPolarHBondContact CA-O 3.45Å
77	I	87.2	Confident	91.8	Very high	6 Å²	6	74.1 Å²	74.1	3%	0.031	37%	0.369	C	S	.	.			trans	-82.2	132.3	171.7	-47.8	176.3	0	0	0	108.9	F101 K103 S133 I135 V144	I77-F101 HydrophobicContact CD1-CB 3.76Å; I77-K103 HydrophobicContact CB-CB 4.21Å; I77-K103 HydrophobicContact CB-CD 4.27Å; I77-K103 HydrophobicContact CG2-CB 3.83Å; I77-K103 WeakPolarHBondContact O-CD 3.23Å; I77-K103 PolarHBondContact O-NZ 3.48Å; I77-S133 PolarHBondContact N-O 3.36Å; I77-I135 HydrophobicContact CD1-CD1 3.44Å; I77-I135 VanDerWaalsContact CD1-CD1 3.44Å; I77-I135 HydrophobicContact CD1-CG1 3.72Å; I77-I135 HydrophobicContact CG1-CD1 3.95Å; I77-I135 HydrophobicContact CG1-CG1 3.6Å; I77-V144 HydrophobicContact CD1-CG2 4.06Å
78	S	84.3	Confident	91.6	Very high	109 Å²	109	76.3 Å²	76.3	76%	0.762	39%	0.385	S	S	*	.	S	Bend	trans	-89.2	-49.9	171.3	57.1	0	0	0	0	111.7
79	Y	88.7	Confident	91.5	Very high	141 Å²	141	76.3 Å²	76.3	55%	0.553	38%	0.384	S	S	*	.	S	Bend	trans	-136.7	-57.8	179	-177.8	-110.7	0	0	0	111.8	K103 V104	Y79-K103 PolarHBondContact O-N 3.48Å; Y79-V104 HydrophobicContact CD2-CG2 3.93Å; Y79-V104 HydrophobicContact CE2-CG2 3.45Å; Y79-V104 VanDerWaalsContact CE2-CG2 3.45Å
80	I	92.3	Very high	91.4	Very high	66 Å²	66	75.3 Å²	75.3	34%	0.338	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.3	179	-168.5	176.7	0	0	0	109.4	D100 F101 Y102	I80-D100 HydrophobicContact CD1-CB 3.87Å; I80-D100 HydrophobicContact CG1-CB 4.09Å; I80-F101 WeakPolarHBondContact CA-O 3.34Å; I80-Y102 HydrophobicContact CD1-CD1 4.31Å; I80-Y102 HydrophobicContact CD1-CE1 3.67Å; I80-Y102 HydrophobicContact CD1-CE2 3.89Å; I80-Y102 VanDerWaalsContact CD1-CZ 3.44Å; I80-Y102 HydrophobicContact CG1-CD1 4.33Å; I80-Y102 HydrophobicContact CG1-CD2 4.49Å; I80-Y102 HydrophobicContact CG1-CE1 4.18Å; I80-Y102 HydrophobicContact CG1-CE2 4.34Å
81	Y	94	Very high	91.5	Very high	67 Å²	67	73.6 Å²	73.6	26%	0.263	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.5	164.6	-179.9	-86.2	0	0	0	108.5	D100 F101 I135 D137	Y81-D100 WeakPolarHBondContact O-CA 3.25Å; Y81-F101 AromaticContact CD1-CD2 3.89Å; Y81-F101 HydrophobicContact CD1-CD2 3.89Å; Y81-F101 HydrophobicContact CD1-CE2 4.45Å; Y81-F101 PolarHBondContact N-O 3.03Å; Y81-F101 PolarHBondContact O-N 3.23Å; Y81-I135 HydrophobicContact CD1-CD1 4.06Å; Y81-I135 HydrophobicContact CD1-CG1 4.06Å; Y81-I135 HydrophobicContact CD1-CG2 4.05Å; Y81-I135 HydrophobicContact CD2-CG1 4.25Å; Y81-I135 HydrophobicContact CE1-CG2 3.78Å; Y81-I135 HydrophobicContact CE2-CG2 4.41Å; Y81-I135 HydrophobicContact CG-CD1 4.19Å; Y81-I135 HydrophobicContact CG-CG1 3.87Å; Y81-I135 HydrophobicContact CG-CG2 4.49Å; Y81-D137 HydrophobicContact CE1-CB 4.3Å; Y81-D137 WeakPolarHBondContact CE1-OD2 3.35Å; Y81-D137 PolarHBondContact OH-OD2 2.92Å
82	A	93.6	Very high	91.4	Very high	43 Å²	43	68.6 Å²	68.6	36%	0.355	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	107.8	175.4	0	0	0	0	0	109.5	F84 D100	A82-F84 HydrophobicContact CB-CE2 4.09Å; A82-F84 HydrophobicContact CB-CZ 4.41Å; A82-D100 WeakPolarHBondContact CA-OD1 3.5Å; A82-D100 WeakPolarHBondContact CB-OD1 3.4Å
83	G	92.4	Very high	91.1	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.3	175.2	0	0	0	0	0	111.5	Q98 I99	G83-Q98 WeakPolarHBondContact O-CA 3.43Å; G83-I99 WeakPolarHBondContact CA-O 3.45Å; G83-I99 PolarHBondContact N-O 3.07Å; G83-I99 PolarHBondContact O-N 3.31Å
84	F	94.2	Very high	90.8	Very high	121 Å²	121	68 Å²	68	53%	0.531	36%	0.357	S	S	.	.			trans	-117.9	95.7	174.9	-63.2	-85.3	0	0	0	108	A82 R86 R97 Q98	A82-F84 HydrophobicContact CB-CE2 4.09Å; A82-F84 HydrophobicContact CB-CZ 4.41Å; F84-R86 PolarHBondContact O-N 3.29Å; F84-R97 WeakPolarHBondContact CD1-O 3.49Å; F84-Q98 HydrophobicContact CD1-CB 4.17Å; F84-Q98 HydrophobicContact CD1-CG 4.37Å; F84-Q98 HydrophobicContact CE1-CB 3.92Å; F84-Q98 HydrophobicContact CE1-CG 3.87Å; F84-Q98 HydrophobicContact CZ-CG 4.19Å
85	P	92.8	Very high	91.1	Very high	23 Å²	23	64.9 Å²	64.9	15%	0.149	35%	0.347	C	S	.	.			trans	-51.7	129.7	-177.5	-25.3	32.2	0	0	0	111.5	F87 F89 I99 L142	P85-F87 HydrophobicContact CB-CD2 4.15Å; P85-F87 HydrophobicContact CB-CE1 4.35Å; P85-F87 HydrophobicContact CB-CE2 4Å; P85-F87 HydrophobicContact CB-CG 4.45Å; P85-F87 HydrophobicContact CB-CZ 4.11Å; P85-F87 PolarHBondContact O-N 2.94Å; P85-F89 HydrophobicContact CB-CE1 4.14Å; P85-F89 HydrophobicContact CG-CE1 3.87Å; P85-I99 HydrophobicContact CG-CD1 3.8Å; P85-I99 HydrophobicContact CG-CG1 4.01Å; P85-L142 HydrophobicContact CG-CD2 4Å
86	R	92.8	Very high	91.6	Very high	175 Å²	175	59.6 Å²	59.6	66%	0.66	32%	0.319	S	S	*	.	S	Bend	trans	-81.5	1.7	176.5	-57.6	-176.2	-167.8	171.6	6.1	112.9	F84	F84-R86 PolarHBondContact O-N 3.29Å
87	F	92.8	Very high	91.9	Very high	24 Å²	24	60 Å²	60	11%	0.105	32%	0.317	C	S	.	.	S	Bend	trans	-119.8	151.7	175.5	51.2	-97.4	0	0	0	110	P85 F89 E139 L142 I165 P167	P85-F87 HydrophobicContact CB-CD2 4.15Å; P85-F87 HydrophobicContact CB-CE1 4.35Å; P85-F87 HydrophobicContact CB-CE2 4Å; P85-F87 HydrophobicContact CB-CG 4.45Å; P85-F87 HydrophobicContact CB-CZ 4.11Å; P85-F87 PolarHBondContact O-N 2.94Å; F87-F89 HydrophobicContact CD2-CB 4.42Å; F87-F89 AromaticContact CD2-CD1 3.64Å; F87-F89 HydrophobicContact CD2-CD1 3.64Å; F87-F89 HydrophobicContact CD2-CE1 4.35Å; F87-F89 HydrophobicContact CD2-CG 4.38Å; F87-F89 AromaticContact CE2-CD1 3.42Å; F87-F89 HydrophobicContact CE2-CD1 3.42Å; F87-F89 VanDerWaalsContact CE2-CD1 3.42Å; F87-F89 AromaticContact CE2-CE1 3.76Å; F87-F89 HydrophobicContact CE2-CE1 3.76Å; F87-F89 HydrophobicContact CE2-CG 4.21Å; F87-E139 WeakPolarHBondContact CD1-O 3.4Å; F87-L142 HydrophobicContact CE1-CB 4.44Å; F87-L142 HydrophobicContact CZ-CB 4.24Å; F87-I165 HydrophobicContact CE2-CG2 4.21Å; F87-I165 HydrophobicContact CZ-CG2 4.28Å; F87-P167 HydrophobicContact CB-CB 3.92Å; F87-P167 HydrophobicContact CB-CG 4.37Å; F87-P167 HydrophobicContact CD1-CB 4.42Å; F87-P167 HydrophobicContact CD1-CG 4.06Å; F87-P167 VanDerWaalsContact CD2-CA 3.46Å; F87-P167 HydrophobicContact CD2-CB 4.24Å; F87-P167 HydrophobicContact CE1-CG 4.47Å; F87-P167 HydrophobicContact CG-CB 3.96Å; F87-P167 HydrophobicContact CG-CG 4.11Å
88	S	91.3	Very high	92.3	Very high	102 Å²	102	62.4 Å²	62.4	71%	0.713	33%	0.328	S	S	*	.			trans	-93.1	126.1	176	-63.8	0	0	0	0	110.6
89	F	92.9	Very high	92.8	Very high	13 Å²	13	57.2 Å²	57.2	6%	0.057	29%	0.292	C	S	.	.			trans	-147.1	162.9	173.7	78.6	-79.6	0	0	0	111.1	P85 F87 N95 V96 I99 I165	P85-F89 HydrophobicContact CB-CE1 4.14Å; P85-F89 HydrophobicContact CG-CE1 3.87Å; F87-F89 HydrophobicContact CD2-CB 4.42Å; F87-F89 AromaticContact CD2-CD1 3.64Å; F87-F89 HydrophobicContact CD2-CD1 3.64Å; F87-F89 HydrophobicContact CD2-CE1 4.35Å; F87-F89 HydrophobicContact CD2-CG 4.38Å; F87-F89 AromaticContact CE2-CD1 3.42Å; F87-F89 HydrophobicContact CE2-CD1 3.42Å; F87-F89 VanDerWaalsContact CE2-CD1 3.42Å; F87-F89 AromaticContact CE2-CE1 3.76Å; F87-F89 HydrophobicContact CE2-CE1 3.76Å; F87-F89 HydrophobicContact CE2-CG 4.21Å; F89-N95 PolarHBondContact O-OD1 2.9Å; F89-V96 HydrophobicContact CD1-CB 4.23Å; F89-V96 HydrophobicContact CD2-CG2 4.18Å; F89-V96 HydrophobicContact CE1-CB 3.69Å; F89-V96 HydrophobicContact CE1-CG1 3.81Å; F89-V96 HydrophobicContact CE1-CG2 4.17Å; F89-V96 HydrophobicContact CE2-CB 4.06Å; F89-V96 HydrophobicContact CE2-CG1 4.49Å; F89-V96 HydrophobicContact CE2-CG2 3.59Å; F89-V96 HydrophobicContact CZ-CB 3.59Å; F89-V96 HydrophobicContact CZ-CG1 3.64Å; F89-V96 HydrophobicContact CZ-CG2 3.58Å; F89-V96 PolarHBondContact O-N 3.25Å; F89-I99 HydrophobicContact CE1-CD1 3.96Å; F89-I99 HydrophobicContact CZ-CD1 3.61Å; F89-I165 HydrophobicContact CE1-CG2 4.01Å; F89-I165 HydrophobicContact CE2-CG2 3.95Å; F89-I165 HydrophobicContact CZ-CG2 3.65Å
90	S	92	Very high	93.1	Very high	45 Å²	45	51 Å²	51	32%	0.315	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	141.9	179.9	66.4	0	0	0	0	113	S94	S90-S94 CarbonylContact C-O 3.57Å; S90-S94 WeakPolarHBondContact CA-O 3.38Å
91	Y	94.2	Very high	93.2	Very high	1 Å²	1	47.9 Å²	47.9	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.2	169.9	-169.6	-100.4	0	0	0	109.4	Y56 G93 S94 V112 L118 D120 I121 M171 Y192	Y56-Y91 WeakPolarHBondContact OH-CA 3.48Å; Y91-G93 PolarHBondContact O-N 3.46Å; Y91-G93 VanDerWaalsContact O-N 3.1Å; Y91-S94 PolarHBondContact N-O 2.97Å; Y91-S94 PolarHBondContact O-N 3.13Å; Y91-V112 HydrophobicContact CD1-CB 4.29Å; Y91-V112 HydrophobicContact CD1-CG1 4.17Å; Y91-V112 HydrophobicContact CD2-CG1 4.49Å; Y91-V112 HydrophobicContact CG-CB 4.45Å; Y91-V112 HydrophobicContact CG-CG1 3.97Å; Y91-L118 HydrophobicContact CD1-CB 4.02Å; Y91-D120 PolarHBondContact OH-O 2.82Å; Y91-D120 VanDerWaalsContact OH-O 3.14Å; Y91-I121 HydrophobicContact CE2-CG1 4.15Å; Y91-M171 HydrophobicContact CD2-CE 4.23Å; Y91-M171 HydrophobicContact CD2-SD 3.84Å; Y91-M171 HydrophobicContact CE2-CE 3.88Å; Y91-M171 HydrophobicContact CE2-SD 3.52Å; Y91-M171 VanDerWaalsContact CE2-SD 3.52Å; Y91-Y192 WeakPolarHBondContact CE1-O 3.48Å; Y91-Y192 PolarHBondContact OH-N 3.09Å; Y91-Y192 PolarHBondContact OH-O 2.85Å
92	Y	91.7	Very high	93.1	Very high	11 Å²	11	47.4 Å²	47.4	4%	0.043	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	38.4	-170.7	-75.8	-92.9	0	0	0	113.7	Y54 Y56 S94 G193 I195 H204	Y54-Y92 HydrophobicContact CD1-CE1 4.49Å; Y56-Y92 HydrophobicContact CD2-CE1 4.11Å; Y56-Y92 HydrophobicContact CD2-CE2 4.33Å; Y56-Y92 AromaticContact CE2-CD1 3.96Å; Y56-Y92 HydrophobicContact CE2-CD1 3.96Å; Y56-Y92 AromaticContact CE2-CD2 3.68Å; Y56-Y92 HydrophobicContact CE2-CD2 3.68Å; Y56-Y92 AromaticContact CE2-CE1 3.88Å; Y56-Y92 HydrophobicContact CE2-CE1 3.88Å; Y56-Y92 AromaticContact CE2-CE2 3.62Å; Y56-Y92 HydrophobicContact CE2-CE2 3.62Å; Y56-Y92 AromaticContact CE2-CG 3.88Å; Y56-Y92 HydrophobicContact CE2-CG 3.88Å; Y56-Y92 AromaticContact CE2-CZ 3.73Å; Y56-Y92 PolarHBondContact OH-N 3.23Å; Y92-S94 VanDerWaalsContact C-N 3.31Å; Y92-S94 PolarHBondContact O-N 3.08Å; Y92-G193 VanDerWaalsContact CE2-CA 3.42Å; Y92-I195 HydrophobicContact CD1-CD1 3.78Å; Y92-I195 HydrophobicContact CD1-CG1 4.01Å; Y92-I195 HydrophobicContact CE1-CD1 4.12Å; Y92-I195 HydrophobicContact CG-CG1 4.43Å; Y92-H204 HydrophobicContact CE1-CB 4Å; Y92-H204 AromaticContact CE1-CG 3.99Å; Y92-H204 AromaticContact CE1-ND1 3.46Å; Y92-H204 WeakPolarHBondContact CE1-ND1 3.43Å; Y92-H204 AromaticContact CZ-ND1 3.62Å; Y92-H204 PolarHBondContact OH-ND1 3.43Å
93	G	88.5	Confident	92.8	Very high	61 Å²	61	48.2 Å²	48.2	63%	0.629	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	3.3	179.4	0	0	0	0	0	115.7	Y91	Y91-G93 PolarHBondContact O-N 3.46Å; Y91-G93 VanDerWaalsContact O-N 3.1Å
94	S	90.6	Very high	92.2	Very high	21 Å²	21	50.2 Å²	50.2	15%	0.147	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	140.1	174.8	-59.4	0	0	0	0	110.6	R23 S90 Y91 Y92 V96	R23-S94 VanDerWaalsContact NH2-CB 3.25Å; R23-S94 PolarHBondContact NH2-OG 3.26Å; S90-S94 CarbonylContact C-O 3.57Å; S90-S94 WeakPolarHBondContact CA-O 3.38Å; Y91-S94 PolarHBondContact N-O 2.97Å; Y91-S94 PolarHBondContact O-N 3.13Å; Y92-S94 VanDerWaalsContact C-N 3.31Å; Y92-S94 PolarHBondContact O-N 3.08Å; S94-V96 PolarHBondContact O-N 2.83Å
95	N	93.1	Very high	90.8	Very high	70 Å²	70	49.1 Å²	49.1	37%	0.374	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	125.5	-178.6	-173.1	39	0	0	0	110.7	F89 E114	F89-N95 PolarHBondContact O-OD1 2.9Å; N95-E114 WeakPolarHBondContact O-CA 3.27Å; N95-E114 WeakPolarHBondContact O-CB 3.4Å; N95-E114 VanDerWaalsContact O-CG 3.23Å; N95-E114 WeakPolarHBondContact O-CG 3.44Å
96	V	95.2	Very high	89.5	Confident	8 Å²	8	53 Å²	53	5%	0.048	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-82.3	137	-179.6	-179.1	0	0	0	0	110	F89 S94 I99 V112 L118	F89-V96 HydrophobicContact CD1-CB 4.23Å; F89-V96 HydrophobicContact CD2-CG2 4.18Å; F89-V96 HydrophobicContact CE1-CB 3.69Å; F89-V96 HydrophobicContact CE1-CG1 3.81Å; F89-V96 HydrophobicContact CE1-CG2 4.17Å; F89-V96 HydrophobicContact CE2-CB 4.06Å; F89-V96 HydrophobicContact CE2-CG1 4.49Å; F89-V96 HydrophobicContact CE2-CG2 3.59Å; F89-V96 HydrophobicContact CZ-CB 3.59Å; F89-V96 HydrophobicContact CZ-CG1 3.64Å; F89-V96 HydrophobicContact CZ-CG2 3.58Å; F89-V96 PolarHBondContact O-N 3.25Å; S94-V96 PolarHBondContact O-N 2.83Å; V96-I99 HydrophobicContact CG1-CD1 4.06Å; V96-I99 HydrophobicContact CG1-CG1 3.71Å; V96-V112 HydrophobicContact CB-CG1 4.23Å; V96-V112 HydrophobicContact CG1-CG1 3.68Å; V96-V112 HydrophobicContact CG2-CG1 3.47Å; V96-V112 VanDerWaalsContact CG2-CG1 3.47Å; V96-L118 HydrophobicContact CG2-CD1 4.2Å
97	R	95.4	Very high	88.5	Confident	153 Å²	153	46.7 Å²	46.7	58%	0.577	27%	0.266	S	S	*	.			trans	-120.1	-28.7	175.4	-57.2	-173.4	176.2	-172.4	-2.4	113.3	F84 F113 E114	F84-R97 WeakPolarHBondContact CD1-O 3.49Å; R97-F113 PolarHBondContact N-O 3.49Å; R97-E114 WeakPolarHBondContact CB-O 3.44Å; R97-E114 WeakPolarHBondContact CD-O 3.27Å
98	Q	95.1	Very high	87.9	Confident	56 Å²	56	45.5 Å²	45.5	26%	0.262	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144.5	-177.8	177.9	-179.8	-27.8	0	0	109.7	G83 F84 D100 F113	G83-Q98 WeakPolarHBondContact O-CA 3.43Å; F84-Q98 HydrophobicContact CD1-CB 4.17Å; F84-Q98 HydrophobicContact CD1-CG 4.37Å; F84-Q98 HydrophobicContact CE1-CB 3.92Å; F84-Q98 HydrophobicContact CE1-CG 3.87Å; F84-Q98 HydrophobicContact CZ-CG 4.19Å; Q98-D100 WeakPolarHBondContact CG-OD1 3.48Å; Q98-D100 VanDerWaalsContact NE2-CG 3.3Å; Q98-D100 PolarHBondContact NE2-OD1 3.44Å; Q98-D100 PolarHBondContact NE2-OD2 3.45Å; Q98-D100 VanDerWaalsContact NE2-OD2 3.11Å; Q98-F113 HydrophobicContact CB-CB 4.23Å; Q98-F113 HydrophobicContact CG-CD2 4.49Å; Q98-F113 PolarHBondContact N-O 3.17Å; Q98-F113 PolarHBondContact O-N 2.92Å
99	I	95	Very high	87.7	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	120.3	176	-56.7	-174.2	0	0	0	108	G83 P85 F89 V96 F101 I110 V111 L142 I165	G83-I99 WeakPolarHBondContact CA-O 3.45Å; G83-I99 PolarHBondContact N-O 3.07Å; G83-I99 PolarHBondContact O-N 3.31Å; P85-I99 HydrophobicContact CG-CD1 3.8Å; P85-I99 HydrophobicContact CG-CG1 4.01Å; F89-I99 HydrophobicContact CE1-CD1 3.96Å; F89-I99 HydrophobicContact CZ-CD1 3.61Å; V96-I99 HydrophobicContact CG1-CD1 4.06Å; V96-I99 HydrophobicContact CG1-CG1 3.71Å; I99-F101 HydrophobicContact CB-CE2 4.27Å; I99-F101 HydrophobicContact CG2-CD2 4.43Å; I99-F101 HydrophobicContact CG2-CE1 4.4Å; I99-F101 HydrophobicContact CG2-CE2 3.79Å; I99-F101 HydrophobicContact CG2-CZ 3.75Å; I99-I110 HydrophobicContact CG2-CG2 3.26Å; I99-V111 CarbonylContact C-O 3.5Å; I99-V111 WeakPolarHBondContact CA-O 3.45Å; I99-L142 HydrophobicContact CB-CD2 4.17Å; I99-L142 HydrophobicContact CD1-CD2 3.83Å; I99-L142 HydrophobicContact CG1-CD2 4.38Å; I99-I165 HydrophobicContact CD1-CD1 3.39Å; I99-I165 HydrophobicContact CD1-CG2 4.44Å; I99-I165 HydrophobicContact CG2-CD1 4.2Å
100	D	94.7	Very high	87.5	Confident	11 Å²	11	41.4 Å²	41.4	6%	0.059	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.1	-179.9	-70.3	-12.9	0	0	0	110.6	I80 Y81 A82 Q98 Y102 I110 V111 F113	I80-D100 HydrophobicContact CD1-CB 3.87Å; I80-D100 HydrophobicContact CG1-CB 4.09Å; Y81-D100 WeakPolarHBondContact O-CA 3.25Å; A82-D100 WeakPolarHBondContact CA-OD1 3.5Å; A82-D100 WeakPolarHBondContact CB-OD1 3.4Å; Q98-D100 WeakPolarHBondContact CG-OD1 3.48Å; Q98-D100 VanDerWaalsContact NE2-CG 3.3Å; Q98-D100 PolarHBondContact NE2-OD1 3.44Å; Q98-D100 PolarHBondContact NE2-OD2 3.45Å; Q98-D100 VanDerWaalsContact NE2-OD2 3.11Å; D100-Y102 HydrophobicContact CB-CD2 4.05Å; D100-Y102 HydrophobicContact CB-CE2 3.52Å; D100-I110 CarbonylContact O-C 3.48Å; D100-I110 WeakPolarHBondContact O-CA 3.29Å; D100-V111 HydrophobicContact CB-CB 4.4Å; D100-V111 PolarHBondContact N-O 3.43Å; D100-V111 PolarHBondContact O-N 3.49Å; D100-F113 HydrophobicContact CB-CE2 4.03Å; D100-F113 WeakPolarHBondContact OD2-CE2 3.36Å
101	F	94.4	Very high	87.6	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	103.2	175.8	-60.7	-91.9	0	0	0	108.8	I77 I80 Y81 I99 I110 I135 L142 V144	I77-F101 HydrophobicContact CD1-CB 3.76Å; I80-F101 WeakPolarHBondContact CA-O 3.34Å; Y81-F101 AromaticContact CD1-CD2 3.89Å; Y81-F101 HydrophobicContact CD1-CD2 3.89Å; Y81-F101 HydrophobicContact CD1-CE2 4.45Å; Y81-F101 PolarHBondContact N-O 3.03Å; Y81-F101 PolarHBondContact O-N 3.23Å; I99-F101 HydrophobicContact CB-CE2 4.27Å; I99-F101 HydrophobicContact CG2-CD2 4.43Å; I99-F101 HydrophobicContact CG2-CE1 4.4Å; I99-F101 HydrophobicContact CG2-CE2 3.79Å; I99-F101 HydrophobicContact CG2-CZ 3.75Å; F101-I110 HydrophobicContact CD1-CB 4.49Å; F101-I110 HydrophobicContact CD1-CD1 4.13Å; F101-I110 HydrophobicContact CD1-CG1 3.76Å; F101-I110 HydrophobicContact CD1-CG2 4.14Å; F101-I110 HydrophobicContact CE1-CD1 3.91Å; F101-I110 HydrophobicContact CE1-CG1 3.96Å; F101-I110 HydrophobicContact CE1-CG2 3.86Å; F101-I110 HydrophobicContact CZ-CG2 4.31Å; F101-I135 HydrophobicContact CB-CD1 3.73Å; F101-I135 HydrophobicContact CD1-CD1 3.95Å; F101-I135 HydrophobicContact CD2-CD1 3.84Å; F101-I135 HydrophobicContact CE2-CD1 4.47Å; F101-I135 HydrophobicContact CG-CD1 3.55Å; F101-L142 HydrophobicContact CE2-CD1 4.06Å; F101-L142 HydrophobicContact CE2-CD2 3.95Å; F101-L142 HydrophobicContact CE2-CG 3.97Å; F101-L142 HydrophobicContact CZ-CD1 4.22Å; F101-L142 HydrophobicContact CZ-CD2 3.92Å; F101-L142 HydrophobicContact CZ-CG 3.71Å; F101-V144 HydrophobicContact CD1-CB 3.58Å; F101-V144 HydrophobicContact CD1-CG1 3.6Å; F101-V144 HydrophobicContact CD1-CG2 4.39Å; F101-V144 HydrophobicContact CE1-CB 3.96Å; F101-V144 HydrophobicContact CE1-CG1 3.91Å
102	Y	91.9	Very high	87.4	Confident	57 Å²	57	40 Å²	40	22%	0.224	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	146.1	178.5	-74.6	-97.4	0	0	0	111.5	I80 D100 V104 A107 D108 D109 V111 R146	I80-Y102 HydrophobicContact CD1-CD1 4.31Å; I80-Y102 HydrophobicContact CD1-CE1 3.67Å; I80-Y102 HydrophobicContact CD1-CE2 3.89Å; I80-Y102 VanDerWaalsContact CD1-CZ 3.44Å; I80-Y102 HydrophobicContact CG1-CD1 4.33Å; I80-Y102 HydrophobicContact CG1-CD2 4.49Å; I80-Y102 HydrophobicContact CG1-CE1 4.18Å; I80-Y102 HydrophobicContact CG1-CE2 4.34Å; D100-Y102 HydrophobicContact CB-CD2 4.05Å; D100-Y102 HydrophobicContact CB-CE2 3.52Å; Y102-V104 HydrophobicContact CD1-CG2 4.15Å; Y102-A107 VanDerWaalsContact CB-O 3.3Å; Y102-A107 WeakPolarHBondContact CB-O 3.44Å; Y102-D108 WeakPolarHBondContact O-CA 3.3Å; Y102-D109 PolarHBondContact N-O 3.25Å; Y102-D109 VanDerWaalsContact N-O 3.09Å; Y102-V111 HydrophobicContact CD2-CB 4.3Å; Y102-V111 HydrophobicContact CD2-CG2 3.52Å; Y102-V111 HydrophobicContact CE2-CB 3.92Å; Y102-V111 HydrophobicContact CE2-CG2 3.41Å; Y102-V111 VanDerWaalsContact CE2-CG2 3.41Å; Y102-R146 PolarHBondContact O-NH2 2.84Å
103	K	88	Confident	87.5	Confident	61 Å²	61	41.5 Å²	41.5	27%	0.265	23%	0.228	S	C	.	.			trans	-128.5	71.8	168.3	-172.1	-167.2	177.4	-170.7	0	108.3	I77 Y79 L131	I77-K103 HydrophobicContact CB-CB 4.21Å; I77-K103 HydrophobicContact CB-CD 4.27Å; I77-K103 HydrophobicContact CG2-CB 3.83Å; I77-K103 WeakPolarHBondContact O-CD 3.23Å; I77-K103 PolarHBondContact O-NZ 3.48Å; Y79-K103 PolarHBondContact O-N 3.48Å; K103-L131 WeakPolarHBondContact CE-O 3.46Å; K103-L131 HydrophobicContact CG-CD2 3.75Å; K103-L131 HydrophobicContact CG-CG 4.07Å; K103-L131 PolarHBondContact NZ-O 3.47Å
104	V	78.7	Confident	87.5	Confident	41 Å²	41	40.3 Å²	40.3	25%	0.248	21%	0.206	C	C	.	.			trans	-123.6	135.5	177.9	-178	0	0	0	0	107.8	Y79 Y102 N106 A107 D108 Y128	Y79-V104 HydrophobicContact CD2-CG2 3.93Å; Y79-V104 HydrophobicContact CE2-CG2 3.45Å; Y79-V104 VanDerWaalsContact CE2-CG2 3.45Å; Y102-V104 HydrophobicContact CD1-CG2 4.15Å; V104-N106 PolarHBondContact O-N 3.36Å; V104-N106 VanDerWaalsContact O-N 3.11Å; V104-A107 HydrophobicContact CB-CB 4.12Å; V104-A107 HydrophobicContact CG1-CB 4.21Å; V104-A107 CarbonylContact O-C 3.4Å; V104-A107 PolarHBondContact O-N 3.29Å; V104-D108 PolarHBondContact O-N 2.76Å; V104-D108 VanDerWaalsContact O-N 3.17Å; V104-Y128 PolarHBondContact O-OH 2.74Å; V104-Y128 VanDerWaalsContact O-OH 3.11Å
105	V	66	Low	87.4	Confident	99 Å²	99	44 Å²	44	60%	0.6	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	119.7	178.1	-178.5	0	0	0	0	109.1	A107 Y128	V105-A107 VanDerWaalsContact C-N 3.28Å; V105-A107 PolarHBondContact O-N 2.84Å; V105-Y128 VanDerWaalsContact CA-OH 3.29Å; V105-Y128 WeakPolarHBondContact CA-OH 3.25Å; V105-Y128 HydrophobicContact CG1-CE2 4.34Å; V105-Y128 HydrophobicContact CG2-CE2 4.28Å
106	N	66.2	Low	87.3	Confident	103 Å²	103	45.9 Å²	45.9	55%	0.551	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	13.1	-176.6	-51.3	-47.1	0	0	0	116.6	V104 Y128	V104-N106 PolarHBondContact O-N 3.36Å; V104-N106 VanDerWaalsContact O-N 3.11Å; N106-Y128 PolarHBondContact N-OH 2.97Å
107	A	71	Confident	87.3	Confident	43 Å²	43	48.8 Å²	48.8	36%	0.355	25%	0.251	S	S	.	.			trans	-145.5	35.7	175.5	0	0	0	0	0	111.3	Y102 V104 V105 D109	Y102-A107 VanDerWaalsContact CB-O 3.3Å; Y102-A107 WeakPolarHBondContact CB-O 3.44Å; V104-A107 HydrophobicContact CB-CB 4.12Å; V104-A107 HydrophobicContact CG1-CB 4.21Å; V104-A107 CarbonylContact O-C 3.4Å; V104-A107 PolarHBondContact O-N 3.29Å; V105-A107 VanDerWaalsContact C-N 3.28Å; V105-A107 PolarHBondContact O-N 2.84Å; A107-D109 PolarHBondContact O-N 3.01Å
108	D	79.3	Confident	87.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.			trans	-80.3	43.7	179	53.4	-77.4	0	0	0	112.6	Y102 V104 N124 Y128 L131 R146 F148	Y102-D108 WeakPolarHBondContact O-CA 3.3Å; V104-D108 PolarHBondContact O-N 2.76Å; V104-D108 VanDerWaalsContact O-N 3.17Å; D108-N124 VanDerWaalsContact CG-CG 3.44Å; D108-N124 VanDerWaalsContact CG-ND2 3.25Å; D108-N124 PolarHBondContact OD1-ND2 2.84Å; D108-N124 PolarHBondContact OD1-OD1 3.23Å; D108-N124 PolarHBondContact OD2-ND2 2.82Å; D108-N124 PolarHBondContact OD2-OD1 3.28Å; D108-N124 VanDerWaalsContact OD2-OD1 3.07Å; D108-Y128 WeakPolarHBondContact OD1-CE1 3.31Å; D108-Y128 PolarHBondContact OD1-OH 3.39Å; D108-L131 HydrophobicContact CB-CD2 3.55Å; D108-R146 PolarHBondContact O-NE 2.86Å; D108-R146 PolarHBondContact O-NH1 3.04Å; D108-R146 PolarHBondContact O-NH2 3.05Å; D108-F148 WeakPolarHBondContact OD2-CE1 3.34Å
109	D	86.9	Confident	87.2	Confident	27 Å²	27	39.2 Å²	39.2	14%	0.144	21%	0.213	C	C	.	.			trans	-81	163.7	-178.9	-60.4	-30.6	0	0	0	111	Y102 A107 D120 I122 R146	Y102-D109 PolarHBondContact N-O 3.25Å; Y102-D109 VanDerWaalsContact N-O 3.09Å; A107-D109 PolarHBondContact O-N 3.01Å; D109-D120 HydrophobicContact CB-CB 4.37Å; D109-I122 HydrophobicContact CB-CG1 4.43Å; D109-I122 WeakPolarHBondContact OD1-CG1 3.41Å; D109-R146 PolarHBondContact O-NH2 3.23Å
110	I	90.1	Very high	87.3	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	109.1	167.8	-58.6	169.1	0	0	0	106.2	I99 D100 F101 D120 I121 V144 S163 I165	I99-I110 HydrophobicContact CG2-CG2 3.26Å; D100-I110 CarbonylContact O-C 3.48Å; D100-I110 WeakPolarHBondContact O-CA 3.29Å; F101-I110 HydrophobicContact CD1-CB 4.49Å; F101-I110 HydrophobicContact CD1-CD1 4.13Å; F101-I110 HydrophobicContact CD1-CG1 3.76Å; F101-I110 HydrophobicContact CD1-CG2 4.14Å; F101-I110 HydrophobicContact CE1-CD1 3.91Å; F101-I110 HydrophobicContact CE1-CG1 3.96Å; F101-I110 HydrophobicContact CE1-CG2 3.86Å; F101-I110 HydrophobicContact CZ-CG2 4.31Å; I110-D120 CarbonylContact O-C 3.52Å; I110-D120 WeakPolarHBondContact O-CA 3.46Å; I110-I121 HydrophobicContact CB-CB 4.07Å; I110-I121 WeakPolarHBondContact CB-O 3.26Å; I110-I121 HydrophobicContact CD1-CB 4.43Å; I110-I121 HydrophobicContact CD1-CG2 4.4Å; I110-I121 HydrophobicContact CG2-CD1 4.37Å; I110-I121 PolarHBondContact N-O 3.5Å; I110-I121 PolarHBondContact O-N 3.07Å; I110-V144 HydrophobicContact CD1-CG1 3.67Å; I110-V144 HydrophobicContact CG1-CG1 4.09Å; I110-S163 VanDerWaalsContact CD1-CB 3.46Å; I110-I165 HydrophobicContact CG2-CD1 4.4Å
111	V	92.8	Very high	87.3	Confident	16 Å²	16	39.8 Å²	39.8	10%	0.097	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	129	-172.9	-172.7	0	0	0	0	109.6	I99 D100 Y102 F113 Y117 D120	I99-V111 CarbonylContact C-O 3.5Å; I99-V111 WeakPolarHBondContact CA-O 3.45Å; D100-V111 HydrophobicContact CB-CB 4.4Å; D100-V111 PolarHBondContact N-O 3.43Å; D100-V111 PolarHBondContact O-N 3.49Å; Y102-V111 HydrophobicContact CD2-CB 4.3Å; Y102-V111 HydrophobicContact CD2-CG2 3.52Å; Y102-V111 HydrophobicContact CE2-CB 3.92Å; Y102-V111 HydrophobicContact CE2-CG2 3.41Å; Y102-V111 VanDerWaalsContact CE2-CG2 3.41Å; V111-F113 HydrophobicContact CB-CE2 3.72Å; V111-F113 HydrophobicContact CB-CZ 4.08Å; V111-F113 HydrophobicContact CG1-CD2 4.14Å; V111-F113 HydrophobicContact CG1-CE1 4.06Å; V111-F113 HydrophobicContact CG1-CE2 3.31Å; V111-F113 HydrophobicContact CG1-CZ 3.26Å; V111-Y117 HydrophobicContact CG1-CD2 3.47Å; V111-Y117 VanDerWaalsContact CG1-CD2 3.47Å; V111-Y117 HydrophobicContact CG1-CE2 3.59Å; V111-D120 WeakPolarHBondContact CG2-OD1 3.49Å
112	V	91.1	Very high	87.4	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	132.1	-171.9	-171.6	0	0	0	0	110.6	Y91 V96 L118 G119 I121	Y91-V112 HydrophobicContact CD1-CB 4.29Å; Y91-V112 HydrophobicContact CD1-CG1 4.17Å; Y91-V112 HydrophobicContact CD2-CG1 4.49Å; Y91-V112 HydrophobicContact CG-CB 4.45Å; Y91-V112 HydrophobicContact CG-CG1 3.97Å; V96-V112 HydrophobicContact CB-CG1 4.23Å; V96-V112 HydrophobicContact CG1-CG1 3.68Å; V96-V112 HydrophobicContact CG2-CG1 3.47Å; V96-V112 VanDerWaalsContact CG2-CG1 3.47Å; V112-L118 HydrophobicContact CG1-CD1 4.3Å; V112-L118 WeakPolarHBondContact O-CB 3.15Å; V112-L118 PolarHBondContact O-N 3.09Å; V112-G119 PolarHBondContact N-O 3.11Å; V112-I121 HydrophobicContact CG2-CD1 4.12Å; V112-I121 HydrophobicContact CG2-CG1 4.29Å
113	F	92.5	Very high	87.6	Confident	43 Å²	43	37.4 Å²	37.4	19%	0.189	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.8	-175.8	-60.1	-89.7	0	0	0	113.4	R97 Q98 D100 V111 I116 Y117	R97-F113 PolarHBondContact N-O 3.49Å; Q98-F113 HydrophobicContact CB-CB 4.23Å; Q98-F113 HydrophobicContact CG-CD2 4.49Å; Q98-F113 PolarHBondContact N-O 3.17Å; Q98-F113 PolarHBondContact O-N 2.92Å; D100-F113 HydrophobicContact CB-CE2 4.03Å; D100-F113 WeakPolarHBondContact OD2-CE2 3.36Å; V111-F113 HydrophobicContact CB-CE2 3.72Å; V111-F113 HydrophobicContact CB-CZ 4.08Å; V111-F113 HydrophobicContact CG1-CD2 4.14Å; V111-F113 HydrophobicContact CG1-CE1 4.06Å; V111-F113 HydrophobicContact CG1-CE2 3.31Å; V111-F113 HydrophobicContact CG1-CZ 3.26Å; F113-I116 WeakPolarHBondContact CA-O 3.44Å; F113-Y117 HydrophobicContact CE1-CD2 4.32Å
114	E	89.3	Confident	87.8	Confident	35 Å²	35	35.1 Å²	35.1	16%	0.164	20%	0.198	C	C	.	.	S	Bend	trans	-90.4	-90.6	157.5	178.6	173	-157.6	0	0	108.3	R23 N95 R97 I116 L118	R23-E114 IonicContact CZ-OE2 3.51Å; R23-E114 IonicContact NH1-OE1 3.3Å; R23-E114 IonicContact NH1-OE2 3.25Å; R23-E114 PolarHBondContact NH1-OE2 2.77Å; R23-E114 IonicContact NH2-OE1 3.65Å; R23-E114 IonicContact NH2-OE2 3.51Å; R23-E114 PolarHBondContact NH2-OE2 3.28Å; N95-E114 WeakPolarHBondContact O-CA 3.27Å; N95-E114 WeakPolarHBondContact O-CB 3.4Å; N95-E114 VanDerWaalsContact O-CG 3.23Å; N95-E114 WeakPolarHBondContact O-CG 3.44Å; R97-E114 WeakPolarHBondContact CB-O 3.44Å; R97-E114 WeakPolarHBondContact CD-O 3.27Å; E114-I116 PolarHBondContact N-O 3.11Å; E114-I116 VanDerWaalsContact N-O 3.08Å; E114-L118 HydrophobicContact CB-CD1 4.03Å; E114-L118 HydrophobicContact CB-CD2 4.15Å; E114-L118 HydrophobicContact CB-CG 4.29Å
115	S	88.1	Confident	88.4	Confident	99 Å²	99	33.1 Å²	33.1	69%	0.692	19%	0.186	S	C	*	.	S	Bend	trans	-114.6	-4.1	158.2	61.2	0	0	0	0	111.3
116	I	91.7	Very high	89.6	Confident	110 Å²	110	32.6 Å²	32.6	56%	0.564	18%	0.177	S	C	*	.	S	Bend	trans	-133	160.3	179	61.2	172.2	0	0	0	107.6	F113 E114 L118	F113-I116 WeakPolarHBondContact CA-O 3.44Å; E114-I116 PolarHBondContact N-O 3.11Å; E114-I116 VanDerWaalsContact N-O 3.08Å; I116-L118 HydrophobicContact CG1-CD2 4.39Å; I116-L118 PolarHBondContact O-N 3.17Å
117	Y	94.1	Very high	90.5	Very high	69 Å²	69	32.7 Å²	32.7	27%	0.271	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	126.4	173.2	170.3	-96	0	0	0	111.2	V111 F113 D120 Y192 K194	V111-Y117 HydrophobicContact CG1-CD2 3.47Å; V111-Y117 VanDerWaalsContact CG1-CD2 3.47Å; V111-Y117 HydrophobicContact CG1-CE2 3.59Å; F113-Y117 HydrophobicContact CE1-CD2 4.32Å; Y117-D120 VanDerWaalsContact CE2-OD1 3.31Å; Y117-D120 WeakPolarHBondContact CE2-OD1 3.29Å; Y117-D120 VanDerWaalsContact OH-CG 3.27Å; Y117-D120 PolarHBondContact OH-OD2 2.75Å; Y117-Y192 AromaticContact CE1-CE1 3.86Å; Y117-Y192 HydrophobicContact CE1-CE1 3.86Å; Y117-Y192 AromaticContact CZ-CE1 3.84Å; Y117-Y192 WeakPolarHBondContact OH-CD1 3.47Å; Y117-Y192 WeakPolarHBondContact OH-CE1 3.26Å; Y117-K194 HydrophobicContact CD1-CB 4.19Å; Y117-K194 HydrophobicContact CD1-CD 3.62Å; Y117-K194 HydrophobicContact CE1-CB 3.92Å; Y117-K194 HydrophobicContact CE1-CD 3.78Å
118	L	94	Very high	91.5	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.042	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-26.3	178.8	-60	-179.9	0	0	0	113	Y91 V96 V112 E114 I116 K194	Y91-L118 HydrophobicContact CD1-CB 4.02Å; V96-L118 HydrophobicContact CG2-CD1 4.2Å; V112-L118 HydrophobicContact CG1-CD1 4.3Å; V112-L118 WeakPolarHBondContact O-CB 3.15Å; V112-L118 PolarHBondContact O-N 3.09Å; E114-L118 HydrophobicContact CB-CD1 4.03Å; E114-L118 HydrophobicContact CB-CD2 4.15Å; E114-L118 HydrophobicContact CB-CG 4.29Å; I116-L118 HydrophobicContact CG1-CD2 4.39Å; I116-L118 PolarHBondContact O-N 3.17Å; L118-K194 PolarHBondContact O-N 2.93Å
119	G	95.6	Very high	92	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.6	-167.7	-178.2	0	0	0	0	0	112.9	V112 Y192	V112-G119 PolarHBondContact N-O 3.11Å; G119-Y192 CarbonylContact C-O 3.55Å; G119-Y192 VanDerWaalsContact CA-O 3.24Å; G119-Y192 WeakPolarHBondContact CA-O 3.32Å
120	D	95.8	Very high	92.3	Very high	21 Å²	21	38.9 Å²	38.9	11%	0.112	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.1	-169.1	-59.5	-44.1	0	0	0	112	Y91 D109 I110 V111 Y117 I122 Y192	Y91-D120 PolarHBondContact OH-O 2.82Å; Y91-D120 VanDerWaalsContact OH-O 3.14Å; D109-D120 HydrophobicContact CB-CB 4.37Å; I110-D120 CarbonylContact O-C 3.52Å; I110-D120 WeakPolarHBondContact O-CA 3.46Å; V111-D120 WeakPolarHBondContact CG2-OD1 3.49Å; Y117-D120 VanDerWaalsContact CE2-OD1 3.31Å; Y117-D120 WeakPolarHBondContact CE2-OD1 3.29Å; Y117-D120 VanDerWaalsContact OH-CG 3.27Å; Y117-D120 PolarHBondContact OH-OD2 2.75Å; D120-I122 HydrophobicContact CB-CD1 4.44Å; D120-I122 HydrophobicContact CB-CG1 4.02Å; D120-Y192 HydrophobicContact CB-CD1 4.45Å; D120-Y192 PolarHBondContact N-O 2.9Å; D120-Y192 PolarHBondContact O-N 3.2Å
121	I	96.7	Very high	92.4	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111.6	164.1	-54.7	160.6	0	0	0	106.7	Y91 I110 V112 I165 M171 L173 I191	Y91-I121 HydrophobicContact CE2-CG1 4.15Å; I110-I121 HydrophobicContact CB-CB 4.07Å; I110-I121 WeakPolarHBondContact CB-O 3.26Å; I110-I121 HydrophobicContact CD1-CB 4.43Å; I110-I121 HydrophobicContact CD1-CG2 4.4Å; I110-I121 HydrophobicContact CG2-CD1 4.37Å; I110-I121 PolarHBondContact N-O 3.5Å; I110-I121 PolarHBondContact O-N 3.07Å; V112-I121 HydrophobicContact CG2-CD1 4.12Å; V112-I121 HydrophobicContact CG2-CG1 4.29Å; I121-I165 HydrophobicContact CD1-CD1 3.72Å; I121-I165 HydrophobicContact CD1-CG1 4.14Å; I121-M171 HydrophobicContact CD1-CG 3.99Å; I121-M171 HydrophobicContact CD1-SD 3.38Å; I121-M171 WeakPolarHBondContact CD1-SD 3.31Å; I121-M171 HydrophobicContact CG1-SD 3.69Å; I121-L173 HydrophobicContact CG2-CD2 3.84Å; I121-I191 HydrophobicContact CG1-CG2 4.23Å; I121-I191 HydrophobicContact CG2-CG2 4.21Å
122	I	95.3	Very high	92.4	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.9	-174.3	-53.1	-172	0	0	0	108.5	D109 D120 N124 R188 S189 L190	D109-I122 HydrophobicContact CB-CG1 4.43Å; D109-I122 WeakPolarHBondContact OD1-CG1 3.41Å; D120-I122 HydrophobicContact CB-CD1 4.44Å; D120-I122 HydrophobicContact CB-CG1 4.02Å; I122-N124 HydrophobicContact CG2-CB 4.12Å; I122-R188 HydrophobicContact CG2-CG 4.32Å; I122-S189 CarbonylContact O-C 3.55Å; I122-S189 WeakPolarHBondContact O-CA 3.39Å; I122-L190 HydrophobicContact CB-CD1 4.23Å; I122-L190 HydrophobicContact CB-CG 4.02Å; I122-L190 HydrophobicContact CD1-CD1 3.72Å; I122-L190 HydrophobicContact CD1-CD2 4.4Å; I122-L190 HydrophobicContact CD1-CG 4.03Å; I122-L190 HydrophobicContact CG1-CD1 3.93Å; I122-L190 HydrophobicContact CG1-CG 4.23Å; I122-L190 PolarHBondContact N-O 2.85Å; I122-L190 PolarHBondContact O-N 3.48Å
123	N	95.7	Very high	92.6	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	82.1	173.8	-167.4	14	0	0	0	108.6	M161 T162 S163 L173 Y175 S189	N123-M161 PolarHBondContact OD1-SD 2.74Å; N123-M161 VanDerWaalsContact OD1-SD 3.37Å; N123-T162 PolarHBondContact ND2-O 2.97Å; N123-S163 VanDerWaalsContact CB-OG 3.3Å; N123-S163 WeakPolarHBondContact CB-OG 3.24Å; N123-S163 PolarHBondContact ND2-OG 2.96Å; N123-L173 HydrophobicContact CB-CD1 4.42Å; N123-L173 HydrophobicContact CB-CD2 4.14Å; N123-Y175 WeakPolarHBondContact OD1-CE1 3.29Å; N123-S189 PolarHBondContact OD1-OG 2.82Å
124	N	92.3	Very high	92.7	Very high	12 Å²	12	42 Å²	42	6%	0.064	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	161.9	-161.3	-168.4	0.9	0	0	0	111.3	D108 I122 F148 R188	D108-N124 VanDerWaalsContact CG-CG 3.44Å; D108-N124 VanDerWaalsContact CG-ND2 3.25Å; D108-N124 PolarHBondContact OD1-ND2 2.84Å; D108-N124 PolarHBondContact OD1-OD1 3.23Å; D108-N124 PolarHBondContact OD2-ND2 2.82Å; D108-N124 PolarHBondContact OD2-OD1 3.28Å; D108-N124 VanDerWaalsContact OD2-OD1 3.07Å; I122-N124 HydrophobicContact CG2-CB 4.12Å; N124-F148 VanDerWaalsContact OD1-CE1 3.26Å; N124-F148 WeakPolarHBondContact OD1-CE1 3.41Å; N124-R188 PolarHBondContact N-O 3.17Å; N124-R188 CarbonylContact O-C 3.54Å; N124-R188 PolarHBondContact O-N 3.07Å
125	I	92.3	Very high	93	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.5	170.9	-51.3	176	0	0	0	108.3	Y128 F148 I150 A159 M161 I182 K186 L187	I125-Y128 WeakPolarHBondContact O-CD1 3.41Å; I125-F148 HydrophobicContact CD1-CB 4.27Å; I125-F148 HydrophobicContact CD1-CD2 4.08Å; I125-F148 HydrophobicContact CD1-CG 4.24Å; I125-F148 HydrophobicContact CG1-CD2 4.35Å; I125-F148 HydrophobicContact CG1-CG 4.46Å; I125-I150 HydrophobicContact CB-CD1 3.92Å; I125-I150 HydrophobicContact CD1-CD1 3.59Å; I125-I150 HydrophobicContact CG1-CD1 4.36Å; I125-I150 HydrophobicContact CG2-CD1 3.46Å; I125-I150 VanDerWaalsContact CG2-CD1 3.46Å; I125-I150 HydrophobicContact CG2-CG1 4.43Å; I125-A159 HydrophobicContact CD1-CB 3.25Å; I125-M161 HydrophobicContact CD1-CE 3.67Å; I125-M161 HydrophobicContact CD1-SD 4.25Å; I125-M161 HydrophobicContact CG1-CE 3.42Å; I125-M161 VanDerWaalsContact CG1-CE 3.42Å; I125-M161 HydrophobicContact CG1-SD 3.92Å; I125-I182 HydrophobicContact CD1-CD1 4.23Å; I125-I182 HydrophobicContact CG2-CG2 4.05Å; I125-K186 CarbonylContact C-O 3.6Å; I125-K186 VanDerWaalsContact CA-O 3.29Å; I125-K186 WeakPolarHBondContact CA-O 3.46Å; I125-K186 HydrophobicContact CG2-CB 4Å; I125-L187 HydrophobicContact CD1-CD2 4.03Å; I125-L187 HydrophobicContact CG1-CD2 3.86Å; I125-L187 HydrophobicContact CG2-CD2 4.21Å
126	Q	90.4	Very high	93.4	Very high	88 Å²	88	35.8 Å²	35.8	41%	0.411	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	151.3	176.5	-63.9	-175.8	-11	0	0	112	K186	Q126-K186 HydrophobicContact CB-CB 4.42Å; Q126-K186 PolarHBondContact N-O 3.31Å
127	N	86.1	Confident	93.5	Very high	105 Å²	105	32.5 Å²	32.5	56%	0.561	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	37.1	173.8	-55.5	-40.4	0	0	0	115.5
128	Y	91	Very high	93.5	Very high	18 Å²	18	32.4 Å²	32.4	7%	0.071	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	152.7	167.3	59.4	-95.9	0	0	0	112.2	V104 V105 N106 D108 I125 L131 F148 S149	V104-Y128 PolarHBondContact O-OH 2.74Å; V104-Y128 VanDerWaalsContact O-OH 3.11Å; V105-Y128 VanDerWaalsContact CA-OH 3.29Å; V105-Y128 WeakPolarHBondContact CA-OH 3.25Å; V105-Y128 HydrophobicContact CG1-CE2 4.34Å; V105-Y128 HydrophobicContact CG2-CE2 4.28Å; N106-Y128 PolarHBondContact N-OH 2.97Å; D108-Y128 WeakPolarHBondContact OD1-CE1 3.31Å; D108-Y128 PolarHBondContact OD1-OH 3.39Å; I125-Y128 WeakPolarHBondContact O-CD1 3.41Å; Y128-L131 HydrophobicContact CD2-CB 4Å; Y128-L131 HydrophobicContact CE2-CB 3.55Å; Y128-L131 HydrophobicContact CE2-CD2 4.34Å; Y128-F148 AromaticContact CD1-CD1 3.6Å; Y128-F148 HydrophobicContact CD1-CD1 3.6Å; Y128-F148 HydrophobicContact CD1-CE1 4.06Å; Y128-F148 AromaticContact CE1-CD1 3.95Å; Y128-F148 HydrophobicContact CE1-CD1 3.95Å; Y128-F148 AromaticContact CE1-CE1 3.96Å; Y128-F148 HydrophobicContact CE1-CE1 3.96Å; Y128-F148 AromaticContact CG-CD1 3.96Å; Y128-F148 HydrophobicContact CG-CD1 3.96Å; Y128-S149 CarbonylContact C-O 3.54Å; Y128-S149 WeakPolarHBondContact CA-O 3.32Å; Y128-S149 VanDerWaalsContact CB-O 3.29Å; Y128-S149 WeakPolarHBondContact CB-O 3.21Å
129	T	90.9	Very high	93.4	Very high	74 Å²	74	38.6 Å²	38.6	45%	0.454	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-34	174.3	54.2	0	0	0	0	112	S149 N151 E156	T129-S149 PolarHBondContact N-O 3.23Å; T129-S149 PolarHBondContact OG1-O 2.88Å; T129-N151 VanDerWaalsContact CG2-ND2 3.33Å; T129-N151 WeakPolarHBondContact CG2-ND2 3.34Å; T129-E156 PolarHBondContact OG1-OE2 2.89Å
130	K	91.7	Very high	93.2	Very high	107 Å²	107	45.9 Å²	45.9	47%	0.465	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	142.4	-177	-172.2	-176	172.8	-162.5	0	110.4	E132 F148 S149	K130-E132 WeakPolarHBondContact CE-OE1 3.49Å; K130-E132 IonicContact NZ-OE1 2.86Å; K130-E132 PolarHBondContact NZ-OE1 2.8Å; K130-F148 WeakPolarHBondContact O-CA 3.31Å; K130-S149 PolarHBondContact N-O 2.84Å; K130-S149 PolarHBondContact O-N 3.11Å
131	L	92.8	Very high	93.2	Very high	15 Å²	15	45.4 Å²	45.4	8%	0.079	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.9	173.4	172.8	62.2	0	0	0	109.5	K103 D108 Y128 R146 N147 F148	K103-L131 WeakPolarHBondContact CE-O 3.46Å; K103-L131 HydrophobicContact CG-CD2 3.75Å; K103-L131 HydrophobicContact CG-CG 4.07Å; K103-L131 PolarHBondContact NZ-O 3.47Å; D108-L131 HydrophobicContact CB-CD2 3.55Å; Y128-L131 HydrophobicContact CD2-CB 4Å; Y128-L131 HydrophobicContact CE2-CB 3.55Å; Y128-L131 HydrophobicContact CE2-CD2 4.34Å; L131-R146 HydrophobicContact CD1-CB 3.88Å; L131-R146 HydrophobicContact CD1-CG 4.13Å; L131-N147 WeakPolarHBondContact CA-O 3.31Å; L131-F148 HydrophobicContact CD1-CD1 3.85Å; L131-F148 HydrophobicContact CD1-CE1 3.7Å; L131-F148 HydrophobicContact CD1-CG 4.37Å; L131-F148 HydrophobicContact CD1-CZ 4.09Å
132	E	92.7	Very high	93.1	Very high	60 Å²	60	45.3 Å²	45.3	28%	0.28	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.3	164.9	-59.1	-171.7	167.4	0	0	109	K130 R146 N147	K130-E132 WeakPolarHBondContact CE-OE1 3.49Å; K130-E132 IonicContact NZ-OE1 2.86Å; K130-E132 PolarHBondContact NZ-OE1 2.8Å; E132-R146 CarbonylContact O-C 3.58Å; E132-R146 WeakPolarHBondContact O-CA 3.13Å; E132-N147 HydrophobicContact CB-CB 4.35Å; E132-N147 PolarHBondContact N-O 2.79Å; E132-N147 PolarHBondContact O-N 2.81Å
133	S	94.7	Very high	93.2	Very high	1 Å²	1	45 Å²	45	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.8	-178	-49.4	0	0	0	0	109.9	K76 I77 K145	K76-S133 WeakPolarHBondContact CA-O 3.45Å; I77-S133 PolarHBondContact N-O 3.36Å; S133-K145 CarbonylContact C-O 3.58Å; S133-K145 VanDerWaalsContact CA-O 3.3Å; S133-K145 WeakPolarHBondContact CA-O 3.45Å
134	E	95.2	Very high	93.2	Very high	50 Å²	50	45 Å²	45	23%	0.234	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136	179	-60.6	177.8	132.4	0	0	109.6	F73 N75 V144 K145	F73-E134 HydrophobicContact CB-CB 3.8Å; F73-E134 WeakPolarHBondContact CD1-O 3.05Å; N75-E134 WeakPolarHBondContact O-CA 3.34Å; E134-V144 CarbonylContact O-C 3.56Å; E134-V144 WeakPolarHBondContact O-CA 3.5Å; E134-K145 PolarHBondContact N-O 3.37Å; E134-K145 PolarHBondContact O-N 3.37Å
135	I	95.8	Very high	93.4	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	146.3	-173.2	-68.8	-66.7	0	0	0	111.4	F73 K74 N75 I77 Y81 F101 D137 V144	F73-I135 CarbonylContact C-O 3.42Å; F73-I135 VanDerWaalsContact CA-O 3.3Å; F73-I135 WeakPolarHBondContact CA-O 3.46Å; K74-I135 CarbonylContact C-O 3.54Å; K74-I135 PolarHBondContact N-O 2.89Å; K74-I135 CarbonylContact O-C 3.56Å; K74-I135 PolarHBondContact O-N 2.9Å; N75-I135 PolarHBondContact O-N 3.38Å; N75-I135 VanDerWaalsContact O-N 3.15Å; I77-I135 HydrophobicContact CD1-CD1 3.44Å; I77-I135 VanDerWaalsContact CD1-CD1 3.44Å; I77-I135 HydrophobicContact CD1-CG1 3.72Å; I77-I135 HydrophobicContact CG1-CD1 3.95Å; I77-I135 HydrophobicContact CG1-CG1 3.6Å; Y81-I135 HydrophobicContact CD1-CD1 4.06Å; Y81-I135 HydrophobicContact CD1-CG1 4.06Å; Y81-I135 HydrophobicContact CD1-CG2 4.05Å; Y81-I135 HydrophobicContact CD2-CG1 4.25Å; Y81-I135 HydrophobicContact CE1-CG2 3.78Å; Y81-I135 HydrophobicContact CE2-CG2 4.41Å; Y81-I135 HydrophobicContact CG-CD1 4.19Å; Y81-I135 HydrophobicContact CG-CG1 3.87Å; Y81-I135 HydrophobicContact CG-CG2 4.49Å; F101-I135 HydrophobicContact CB-CD1 3.73Å; F101-I135 HydrophobicContact CD1-CD1 3.95Å; F101-I135 HydrophobicContact CD2-CD1 3.84Å; F101-I135 HydrophobicContact CE2-CD1 4.47Å; F101-I135 HydrophobicContact CG-CD1 3.55Å; I135-D137 HydrophobicContact CG2-CB 3.88Å; I135-V144 HydrophobicContact CD1-CB 4.03Å; I135-V144 HydrophobicContact CD1-CG2 4.03Å
136	L	95.7	Very high	93.5	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.1	160.7	-175.2	159.3	0	0	0	106.8	V68 R72 F73 E138 L141 L142 G143	V68-L136 HydrophobicContact CG1-CD1 3.64Å; R72-L136 HydrophobicContact CB-CD1 3.72Å; F73-L136 HydrophobicContact CD1-CB 3.64Å; F73-L136 HydrophobicContact CE1-CB 3.65Å; F73-L136 HydrophobicContact CE1-CD1 4.36Å; F73-L136 HydrophobicContact CE2-CD1 4.21Å; F73-L136 HydrophobicContact CG-CB 4.24Å; F73-L136 HydrophobicContact CZ-CB 4.25Å; F73-L136 HydrophobicContact CZ-CD1 4.13Å; L136-E138 HydrophobicContact CD2-CB 4.14Å; L136-E138 HydrophobicContact CD2-CG 3.89Å; L136-E138 HydrophobicContact CG-CG 4.28Å; L136-L141 HydrophobicContact CD1-CD2 4.09Å; L136-L141 HydrophobicContact CD2-CB 3.76Å; L136-L141 HydrophobicContact CD2-CD2 3.86Å; L136-L141 HydrophobicContact CD2-CG 3.75Å; L136-L141 WeakPolarHBondContact CD2-O 3.46Å; L136-L142 CarbonylContact O-C 3.5Å; L136-L142 VanDerWaalsContact O-CA 3.27Å; L136-L142 WeakPolarHBondContact O-CA 3.38Å; L136-L142 WeakPolarHBondContact O-CD1 3.33Å; L136-G143 PolarHBondContact N-O 3.04Å; L136-G143 PolarHBondContact O-N 2.89Å
137	D	94.3	Very high	93.7	Very high	41 Å²	41	43 Å²	43	22%	0.219	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	88.5	179.5	-173.5	-6.6	0	0	0	108.9	Y81 I135 L142	Y81-D137 HydrophobicContact CE1-CB 4.3Å; Y81-D137 WeakPolarHBondContact CE1-OD2 3.35Å; Y81-D137 PolarHBondContact OH-OD2 2.92Å; I135-D137 HydrophobicContact CG2-CB 3.88Å; D137-L142 HydrophobicContact CB-CD1 3.66Å
138	E	93.8	Very high	94.1	Very high	68 Å²	68	38 Å²	38	32%	0.318	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	170.3	-177	-62.4	-174.8	-153.5	0	0	110.6	R72 L136 E140 L141	R72-E138 IonicContact CZ-OE1 3.13Å; R72-E138 IonicContact CZ-OE2 2.94Å; R72-E138 IonicContact NE-OE1 3.84Å; R72-E138 PolarHBondContact NE-OE1 3.23Å; R72-E138 IonicContact NE-OE2 3.23Å; R72-E138 IonicContact NH2-OE1 2.67Å; R72-E138 PolarHBondContact NH2-OE1 3.41Å; R72-E138 VanDerWaalsContact NH2-OE1 3.14Å; R72-E138 IonicContact NH2-OE2 3.56Å; R72-E138 PolarHBondContact NH2-OE2 2.71Å; L136-E138 HydrophobicContact CD2-CB 4.14Å; L136-E138 HydrophobicContact CD2-CG 3.89Å; L136-E138 HydrophobicContact CG-CG 4.28Å; E138-E140 VanDerWaalsContact C-N 3.32Å; E138-E140 PolarHBondContact O-N 2.79Å; E138-L141 CarbonylContact C-O 3.55Å; E138-L141 WeakPolarHBondContact CA-O 3.44Å; E138-L141 PolarHBondContact N-O 3.15Å; E138-L141 PolarHBondContact O-N 3Å; E138-L141 VanDerWaalsContact O-O 3.08Å
139	E	92.4	Very high	94.3	Very high	138 Å²	138	37.8 Å²	37.8	65%	0.645	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-34.9	-174.5	-173.7	171	-175.1	0	0	113.9	F87	F87-E139 WeakPolarHBondContact CD1-O 3.4Å
140	E	92.3	Very high	94.4	Very high	152 Å²	152	34.3 Å²	34.3	71%	0.71	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.4	13.2	-177.7	-60.7	-168.9	141.7	0	0	112.9	E138 P167	E138-E140 VanDerWaalsContact C-N 3.32Å; E138-E140 PolarHBondContact O-N 2.79Å; E140-P167 HydrophobicContact CB-CG 4.08Å; E140-P167 WeakPolarHBondContact O-CD 3.34Å; E140-P167 VanDerWaalsContact O-CG 3.3Å; E140-P167 WeakPolarHBondContact O-CG 3.3Å
141	L	94.8	Very high	94.3	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.063	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	134	-179.1	-165	65	0	0	0	111.4	V68 L136 E138 L164 H166	V68-L141 HydrophobicContact CG1-CD2 4.44Å; V68-L141 HydrophobicContact CG2-CD2 3.61Å; L136-L141 HydrophobicContact CD1-CD2 4.09Å; L136-L141 HydrophobicContact CD2-CB 3.76Å; L136-L141 HydrophobicContact CD2-CD2 3.86Å; L136-L141 HydrophobicContact CD2-CG 3.75Å; L136-L141 WeakPolarHBondContact CD2-O 3.46Å; E138-L141 CarbonylContact C-O 3.55Å; E138-L141 WeakPolarHBondContact CA-O 3.44Å; E138-L141 PolarHBondContact N-O 3.15Å; E138-L141 PolarHBondContact O-N 3Å; E138-L141 VanDerWaalsContact O-O 3.08Å; L141-L164 HydrophobicContact CD1-CB 4.32Å; L141-L164 HydrophobicContact CD1-CD2 4.48Å; L141-L164 HydrophobicContact CD2-CD2 4.19Å; L141-L164 HydrophobicContact CG-CD2 4.33Å; L141-H166 WeakPolarHBondContact CD1-ND1 3.5Å
142	L	95.3	Very high	94.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.4	172.7	-175	69.1	0	0	0	108.9	P85 F87 I99 F101 L136 D137 L164 I165	P85-L142 HydrophobicContact CG-CD2 4Å; F87-L142 HydrophobicContact CE1-CB 4.44Å; F87-L142 HydrophobicContact CZ-CB 4.24Å; I99-L142 HydrophobicContact CB-CD2 4.17Å; I99-L142 HydrophobicContact CD1-CD2 3.83Å; I99-L142 HydrophobicContact CG1-CD2 4.38Å; F101-L142 HydrophobicContact CE2-CD1 4.06Å; F101-L142 HydrophobicContact CE2-CD2 3.95Å; F101-L142 HydrophobicContact CE2-CG 3.97Å; F101-L142 HydrophobicContact CZ-CD1 4.22Å; F101-L142 HydrophobicContact CZ-CD2 3.92Å; F101-L142 HydrophobicContact CZ-CG 3.71Å; L136-L142 CarbonylContact O-C 3.5Å; L136-L142 VanDerWaalsContact O-CA 3.27Å; L136-L142 WeakPolarHBondContact O-CA 3.38Å; L136-L142 WeakPolarHBondContact O-CD1 3.33Å; D137-L142 HydrophobicContact CB-CD1 3.66Å; L142-L164 CarbonylContact O-C 3.57Å; L142-L164 WeakPolarHBondContact O-CA 3.45Å; L142-I165 PolarHBondContact N-O 2.89Å; L142-I165 VanDerWaalsContact N-O 3.14Å; L142-I165 PolarHBondContact O-N 3.37Å
143	G	96.2	Very high	93.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	176.5	-179.2	0	0	0	0	0	115	L136 S163	L136-G143 PolarHBondContact N-O 3.04Å; L136-G143 PolarHBondContact O-N 2.89Å; G143-S163 CarbonylContact C-O 3.58Å; G143-S163 WeakPolarHBondContact CA-O 3.5Å
144	V	96.2	Very high	93.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	138.3	176.7	63	0	0	0	0	109.7	I77 F101 I110 E134 I135 R146 T162 S163	I77-V144 HydrophobicContact CD1-CG2 4.06Å; F101-V144 HydrophobicContact CD1-CB 3.58Å; F101-V144 HydrophobicContact CD1-CG1 3.6Å; F101-V144 HydrophobicContact CD1-CG2 4.39Å; F101-V144 HydrophobicContact CE1-CB 3.96Å; F101-V144 HydrophobicContact CE1-CG1 3.91Å; I110-V144 HydrophobicContact CD1-CG1 3.67Å; I110-V144 HydrophobicContact CG1-CG1 4.09Å; E134-V144 CarbonylContact O-C 3.56Å; E134-V144 WeakPolarHBondContact O-CA 3.5Å; I135-V144 HydrophobicContact CD1-CB 4.03Å; I135-V144 HydrophobicContact CD1-CG2 4.03Å; V144-R146 HydrophobicContact CG2-CG 4.02Å; V144-T162 WeakPolarHBondContact O-CA 3.28Å; V144-S163 PolarHBondContact N-O 2.75Å; V144-S163 PolarHBondContact O-N 2.89Å
145	K	96.3	Very high	92.9	Very high	25 Å²	25	43 Å²	43	11%	0.109	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.4	167.7	-177.5	177.4	-178.5	-173.3	0	108.5	S70 F73 S133 E134 T160	S70-K145 PolarHBondContact OG-NZ 2.88Å; F73-K145 HydrophobicContact CB-CB 4.41Å; F73-K145 HydrophobicContact CD1-CB 3.61Å; F73-K145 HydrophobicContact CD2-CB 4.24Å; F73-K145 HydrophobicContact CD2-CD 4.33Å; F73-K145 HydrophobicContact CE1-CB 3.86Å; F73-K145 HydrophobicContact CE2-CB 4.45Å; F73-K145 HydrophobicContact CG-CB 3.81Å; F73-K145 HydrophobicContact CG-CD 4.49Å; F73-K145 HydrophobicContact CZ-CB 4.27Å; S133-K145 CarbonylContact C-O 3.58Å; S133-K145 VanDerWaalsContact CA-O 3.3Å; S133-K145 WeakPolarHBondContact CA-O 3.45Å; E134-K145 PolarHBondContact N-O 3.37Å; E134-K145 PolarHBondContact O-N 3.37Å; K145-T160 HydrophobicContact CD-CG2 4.36Å; K145-T160 HydrophobicContact CG-CG2 4.11Å
146	R	95.5	Very high	92.8	Very high	3 Å²	3	48.7 Å²	48.7	1%	0.011	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.3	-178.3	-67.9	-169.5	172.6	109.3	-1.3	110.7	Y102 D108 D109 L131 E132 V144 F148 T160 M161	Y102-R146 PolarHBondContact O-NH2 2.84Å; D108-R146 PolarHBondContact O-NE 2.86Å; D108-R146 PolarHBondContact O-NH1 3.04Å; D108-R146 PolarHBondContact O-NH2 3.05Å; D109-R146 PolarHBondContact O-NH2 3.23Å; L131-R146 HydrophobicContact CD1-CB 3.88Å; L131-R146 HydrophobicContact CD1-CG 4.13Å; E132-R146 CarbonylContact O-C 3.58Å; E132-R146 WeakPolarHBondContact O-CA 3.13Å; V144-R146 HydrophobicContact CG2-CG 4.02Å; R146-F148 HydrophobicContact CB-CD2 4.28Å; R146-F148 HydrophobicContact CB-CE2 3.51Å; R146-F148 HydrophobicContact CB-CZ 3.76Å; R146-F148 HydrophobicContact CG-CZ 4.42Å; R146-T160 VanDerWaalsContact O-CA 3.31Å; R146-T160 WeakPolarHBondContact O-CA 3.42Å; R146-M161 PolarHBondContact N-O 3.03Å; R146-M161 PolarHBondContact O-N 2.84Å
147	N	95	Very high	92.8	Very high	29 Å²	29	49.7 Å²	49.7	16%	0.155	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	117.6	170.6	-61.5	-50.4	0	0	0	108.9	L131 E132 T158 A159 T160	L131-N147 WeakPolarHBondContact CA-O 3.31Å; E132-N147 HydrophobicContact CB-CB 4.35Å; E132-N147 PolarHBondContact N-O 2.79Å; E132-N147 PolarHBondContact O-N 2.81Å; N147-T158 HydrophobicContact CB-CG2 4.36Å; N147-A159 CarbonylContact C-O 3.51Å; N147-A159 WeakPolarHBondContact CA-O 3.5Å; N147-T160 WeakPolarHBondContact OD1-CB 3.06Å; N147-T160 WeakPolarHBondContact OD1-CG2 3.4Å; N147-T160 PolarHBondContact OD1-OG1 3.31Å
148	F	94.5	Very high	92.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.5	179.3	-57.4	-92.7	0	0	0	109.2	D108 N124 I125 Y128 K130 L131 R146 I150 T158 A159 M161	D108-F148 WeakPolarHBondContact OD2-CE1 3.34Å; N124-F148 VanDerWaalsContact OD1-CE1 3.26Å; N124-F148 WeakPolarHBondContact OD1-CE1 3.41Å; I125-F148 HydrophobicContact CD1-CB 4.27Å; I125-F148 HydrophobicContact CD1-CD2 4.08Å; I125-F148 HydrophobicContact CD1-CG 4.24Å; I125-F148 HydrophobicContact CG1-CD2 4.35Å; I125-F148 HydrophobicContact CG1-CG 4.46Å; Y128-F148 AromaticContact CD1-CD1 3.6Å; Y128-F148 HydrophobicContact CD1-CD1 3.6Å; Y128-F148 HydrophobicContact CD1-CE1 4.06Å; Y128-F148 AromaticContact CE1-CD1 3.95Å; Y128-F148 HydrophobicContact CE1-CD1 3.95Å; Y128-F148 AromaticContact CE1-CE1 3.96Å; Y128-F148 HydrophobicContact CE1-CE1 3.96Å; Y128-F148 AromaticContact CG-CD1 3.96Å; Y128-F148 HydrophobicContact CG-CD1 3.96Å; K130-F148 WeakPolarHBondContact O-CA 3.31Å; L131-F148 HydrophobicContact CD1-CD1 3.85Å; L131-F148 HydrophobicContact CD1-CE1 3.7Å; L131-F148 HydrophobicContact CD1-CG 4.37Å; L131-F148 HydrophobicContact CD1-CZ 4.09Å; R146-F148 HydrophobicContact CB-CD2 4.28Å; R146-F148 HydrophobicContact CB-CE2 3.51Å; R146-F148 HydrophobicContact CB-CZ 3.76Å; R146-F148 HydrophobicContact CG-CZ 4.42Å; F148-I150 HydrophobicContact CB-CD1 4Å; F148-I150 HydrophobicContact CB-CG1 4.22Å; F148-T158 CarbonylContact O-C 3.53Å; F148-T158 VanDerWaalsContact O-CA 3.29Å; F148-T158 WeakPolarHBondContact O-CA 2.94Å; F148-A159 HydrophobicContact CB-CB 4.44Å; F148-A159 PolarHBondContact N-O 2.76Å; F148-A159 PolarHBondContact O-N 3.17Å; F148-M161 HydrophobicContact CD2-SD 4.44Å; F148-M161 HydrophobicContact CE2-CB 4.23Å; F148-M161 HydrophobicContact CE2-CG 4.19Å; F148-M161 HydrophobicContact CE2-SD 3.86Å
149	S	94.3	Very high	93	Very high	15 Å²	15	47.7 Å²	47.7	11%	0.105	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.6	166	-53	0	0	0	0	108.7	Y128 T129 K130 V157	Y128-S149 CarbonylContact C-O 3.54Å; Y128-S149 WeakPolarHBondContact CA-O 3.32Å; Y128-S149 VanDerWaalsContact CB-O 3.29Å; Y128-S149 WeakPolarHBondContact CB-O 3.21Å; T129-S149 PolarHBondContact N-O 3.23Å; T129-S149 PolarHBondContact OG1-O 2.88Å; K130-S149 PolarHBondContact N-O 2.84Å; K130-S149 PolarHBondContact O-N 3.11Å; S149-V157 WeakPolarHBondContact CA-O 3.46Å
150	I	92.4	Very high	93.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135.2	-172.8	-61.5	156	0	0	0	109	I125 F148 A152 E156 V157 A159 I182	I125-I150 HydrophobicContact CB-CD1 3.92Å; I125-I150 HydrophobicContact CD1-CD1 3.59Å; I125-I150 HydrophobicContact CG1-CD1 4.36Å; I125-I150 HydrophobicContact CG2-CD1 3.46Å; I125-I150 VanDerWaalsContact CG2-CD1 3.46Å; I125-I150 HydrophobicContact CG2-CG1 4.43Å; F148-I150 HydrophobicContact CB-CD1 4Å; F148-I150 HydrophobicContact CB-CG1 4.22Å; I150-A152 PolarHBondContact O-N 2.84Å; I150-E156 WeakPolarHBondContact O-CA 3.39Å; I150-V157 HydrophobicContact CB-CG2 4.34Å; I150-V157 PolarHBondContact N-O 3.5Å; I150-V157 PolarHBondContact O-N 2.84Å; I150-A159 HydrophobicContact CD1-CB 4.27Å; I150-I182 HydrophobicContact CD1-CD1 3.57Å; I150-I182 HydrophobicContact CD1-CG1 4.28Å
151	N	90.5	Very high	93.4	Very high	92 Å²	92	34.8 Å²	34.8	49%	0.492	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	109.9	169.5	-72.5	-31.8	0	0	0	109.8	T129	T129-N151 VanDerWaalsContact CG2-ND2 3.33Å; T129-N151 WeakPolarHBondContact CG2-ND2 3.34Å
152	A	87.5	Confident	93.5	Very high	7 Å²	7	34.4 Å²	34.4	6%	0.058	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	116.5	174.4	0	0	0	0	0	109.3	I150 G154 S155 V157 E181	I150-A152 PolarHBondContact O-N 2.84Å; A152-G154 PolarHBondContact O-N 3.05Å; A152-G154 VanDerWaalsContact O-N 3.13Å; A152-S155 PolarHBondContact N-O 3.32Å; A152-S155 PolarHBondContact O-N 3.01Å; A152-S155 VanDerWaalsContact O-O 3.07Å; A152-V157 HydrophobicContact CB-CG1 4.5Å; A152-V157 HydrophobicContact CB-CG2 3.88Å; A152-E181 HydrophobicContact CB-CB 3.72Å
153	H	85.5	Confident	93.7	Very high	160 Å²	160	34.6 Å²	34.6	74%	0.741	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	38	-180	-56.7	-70.4	0	0	0	114.9	S155	H153-S155 VanDerWaalsContact C-N 3.3Å; H153-S155 PolarHBondContact O-N 3.39Å
154	G	85	Confident	93.7	Very high	80 Å²	80	34.7 Å²	34.7	83%	0.825	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.6	-0.1	179.4	0	0	0	0	0	115.1	A152	A152-G154 PolarHBondContact O-N 3.05Å; A152-G154 VanDerWaalsContact O-N 3.13Å
155	S	88.7	Confident	93.7	Very high	76 Å²	76	34.7 Å²	34.7	53%	0.531	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.5	172	-59.5	0	0	0	0	110.6	A152 H153	A152-S155 PolarHBondContact N-O 3.32Å; A152-S155 PolarHBondContact O-N 3.01Å; A152-S155 VanDerWaalsContact O-O 3.07Å; H153-S155 VanDerWaalsContact C-N 3.3Å; H153-S155 PolarHBondContact O-N 3.39Å
156	E	92.7	Very high	93.6	Very high	123 Å²	123	35.4 Å²	35.4	58%	0.575	21%	0.21	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	120.8	172.2	-171.6	173.4	73.5	0	0	109.4	T129 I150	T129-E156 PolarHBondContact OG1-OE2 2.89Å; I150-E156 WeakPolarHBondContact O-CA 3.39Å
157	V	95.2	Very high	93.5	Very high	22 Å²	22	37.5 Å²	37.5	13%	0.133	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.5	174.7	-61.6	0	0	0	0	109.8	S149 I150 A152 P179 I182	S149-V157 WeakPolarHBondContact CA-O 3.46Å; I150-V157 HydrophobicContact CB-CG2 4.34Å; I150-V157 PolarHBondContact N-O 3.5Å; I150-V157 PolarHBondContact O-N 2.84Å; A152-V157 HydrophobicContact CB-CG1 4.5Å; A152-V157 HydrophobicContact CB-CG2 3.88Å; V157-P179 HydrophobicContact CB-CB 4.06Å; V157-P179 HydrophobicContact CB-CG 3.93Å; V157-P179 HydrophobicContact CG1-CB 4.48Å; V157-P179 HydrophobicContact CG2-CB 4.04Å; V157-P179 HydrophobicContact CG2-CG 4.06Å; V157-I182 HydrophobicContact CG2-CD1 4.27Å; V157-I182 HydrophobicContact CG2-CG1 4.06Å
158	T	96	Very high	93.2	Very high	66 Å²	66	39.9 Å²	39.9	41%	0.405	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.6	177.4	-59.3	0	0	0	0	110.5	N147 F148 N177 P179	N147-T158 HydrophobicContact CB-CG2 4.36Å; F148-T158 CarbonylContact O-C 3.53Å; F148-T158 VanDerWaalsContact O-CA 3.29Å; F148-T158 WeakPolarHBondContact O-CA 2.94Å; T158-N177 PolarHBondContact O-ND2 3.06Å; T158-P179 WeakPolarHBondContact O-CG 3.31Å
159	A	96.9	Very high	93	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141.4	169.6	0	0	0	0	0	110.4	I125 N147 F148 I150 N177 I182	I125-A159 HydrophobicContact CD1-CB 3.25Å; N147-A159 CarbonylContact C-O 3.51Å; N147-A159 WeakPolarHBondContact CA-O 3.5Å; F148-A159 HydrophobicContact CB-CB 4.44Å; F148-A159 PolarHBondContact N-O 2.76Å; F148-A159 PolarHBondContact O-N 3.17Å; I150-A159 HydrophobicContact CD1-CB 4.27Å; A159-N177 CarbonylContact C-O 3.57Å; A159-N177 VanDerWaalsContact CA-O 3.22Å; A159-N177 WeakPolarHBondContact CA-O 3.38Å; A159-I182 HydrophobicContact CB-CD1 3.83Å
160	T	96.8	Very high	93	Very high	17 Å²	17	40.9 Å²	40.9	10%	0.104	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.8	-179.8	-57.8	0	0	0	0	109.6	K145 R146 N147 D176 N177	K145-T160 HydrophobicContact CD-CG2 4.36Å; K145-T160 HydrophobicContact CG-CG2 4.11Å; R146-T160 VanDerWaalsContact O-CA 3.31Å; R146-T160 WeakPolarHBondContact O-CA 3.42Å; N147-T160 WeakPolarHBondContact OD1-CB 3.06Å; N147-T160 WeakPolarHBondContact OD1-CG2 3.4Å; N147-T160 PolarHBondContact OD1-OG1 3.31Å; T160-D176 HydrophobicContact CG2-CB 3.63Å; T160-D176 PolarHBondContact O-N 3.49Å; T160-N177 PolarHBondContact N-O 3.35Å; T160-N177 PolarHBondContact O-N 2.85Å; T160-N177 VanDerWaalsContact O-N 3.09Å
161	M	97	Very high	93.2	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	140.6	-179	-60	177.5	159.5	0	0	110.2	N123 I125 R146 F148 Y174 Y175 I178 L187 I213	N123-M161 PolarHBondContact OD1-SD 2.74Å; N123-M161 VanDerWaalsContact OD1-SD 3.37Å; I125-M161 HydrophobicContact CD1-CE 3.67Å; I125-M161 HydrophobicContact CD1-SD 4.25Å; I125-M161 HydrophobicContact CG1-CE 3.42Å; I125-M161 VanDerWaalsContact CG1-CE 3.42Å; I125-M161 HydrophobicContact CG1-SD 3.92Å; R146-M161 PolarHBondContact N-O 3.03Å; R146-M161 PolarHBondContact O-N 2.84Å; F148-M161 HydrophobicContact CD2-SD 4.44Å; F148-M161 HydrophobicContact CE2-CB 4.23Å; F148-M161 HydrophobicContact CE2-CG 4.19Å; F148-M161 HydrophobicContact CE2-SD 3.86Å; M161-Y174 WeakPolarHBondContact CA-O 3.13Å; M161-Y175 HydrophobicContact CE-CD1 4.24Å; M161-Y175 HydrophobicContact CG-CD1 4.15Å; M161-I178 HydrophobicContact CE-CD1 3.35Å; M161-I178 HydrophobicContact CG-CD1 3.99Å; M161-L187 HydrophobicContact CE-CD2 4.11Å; M161-I213 HydrophobicContact CE-CG2 3.98Å
162	T	97.4	Very high	93.5	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.031	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.5	-179	-60.3	0	0	0	0	110.1	F73 N123 V144 L164 L173 Y174 D176	F73-T162 HydrophobicContact CE1-CG2 4.08Å; F73-T162 HydrophobicContact CE2-CG2 4.22Å; F73-T162 HydrophobicContact CZ-CG2 3.44Å; F73-T162 VanDerWaalsContact CZ-CG2 3.44Å; N123-T162 PolarHBondContact ND2-O 2.97Å; V144-T162 WeakPolarHBondContact O-CA 3.28Å; T162-L164 HydrophobicContact CG2-CD2 4.15Å; T162-L164 HydrophobicContact CG2-CG 4.09Å; T162-L173 CarbonylContact O-C 3.55Å; T162-L173 WeakPolarHBondContact O-CA 3.48Å; T162-Y174 PolarHBondContact N-O 3.25Å; T162-Y174 PolarHBondContact O-N 3.08Å; T162-D176 WeakPolarHBondContact CB-OD2 3.39Å; T162-D176 PolarHBondContact N-OD2 2.91Å; T162-D176 PolarHBondContact OG1-OD2 2.94Å
163	S	97.7	Very high	94	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130	175.1	-58.3	0	0	0	0	109.4	I110 N123 G143 V144 S172	I110-S163 VanDerWaalsContact CD1-CB 3.46Å; N123-S163 VanDerWaalsContact CB-OG 3.3Å; N123-S163 WeakPolarHBondContact CB-OG 3.24Å; N123-S163 PolarHBondContact ND2-OG 2.96Å; G143-S163 CarbonylContact C-O 3.58Å; G143-S163 WeakPolarHBondContact CA-O 3.5Å; V144-S163 PolarHBondContact N-O 2.75Å; V144-S163 PolarHBondContact O-N 2.89Å; S163-S172 CarbonylContact C-O 3.49Å; S163-S172 WeakPolarHBondContact CA-O 3.35Å
164	L	97	Very high	94.6	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.5	-177.1	-60	171	0	0	0	111	P67 V68 F73 L141 L142 T162 M171 S172	P67-L164 HydrophobicContact CB-CD1 4.02Å; P67-L164 HydrophobicContact CG-CD1 3.71Å; V68-L164 HydrophobicContact CB-CD1 4.43Å; V68-L164 HydrophobicContact CG2-CD1 3.49Å; V68-L164 VanDerWaalsContact CG2-CD1 3.49Å; V68-L164 HydrophobicContact CG2-CD2 4.13Å; V68-L164 HydrophobicContact CG2-CG 4.48Å; F73-L164 HydrophobicContact CE1-CD2 4.39Å; F73-L164 HydrophobicContact CZ-CD2 3.92Å; L141-L164 HydrophobicContact CD1-CB 4.32Å; L141-L164 HydrophobicContact CD1-CD2 4.48Å; L141-L164 HydrophobicContact CD2-CD2 4.19Å; L141-L164 HydrophobicContact CG-CD2 4.33Å; L142-L164 CarbonylContact O-C 3.57Å; L142-L164 WeakPolarHBondContact O-CA 3.45Å; T162-L164 HydrophobicContact CG2-CD2 4.15Å; T162-L164 HydrophobicContact CG2-CG 4.09Å; L164-M171 CarbonylContact O-C 3.57Å; L164-M171 WeakPolarHBondContact O-CA 3.32Å; L164-S172 PolarHBondContact N-O 2.81Å; L164-S172 PolarHBondContact O-N 2.94Å
165	I	96.5	Very high	95.3	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120.6	177.4	-56.1	177	0	0	0	107.4	F87 F89 I99 I110 I121 L142	F87-I165 HydrophobicContact CE2-CG2 4.21Å; F87-I165 HydrophobicContact CZ-CG2 4.28Å; F89-I165 HydrophobicContact CE1-CG2 4.01Å; F89-I165 HydrophobicContact CE2-CG2 3.95Å; F89-I165 HydrophobicContact CZ-CG2 3.65Å; I99-I165 HydrophobicContact CD1-CD1 3.39Å; I99-I165 HydrophobicContact CD1-CG2 4.44Å; I99-I165 HydrophobicContact CG2-CD1 4.2Å; I110-I165 HydrophobicContact CG2-CD1 4.4Å; I121-I165 HydrophobicContact CD1-CD1 3.72Å; I121-I165 HydrophobicContact CD1-CG1 4.14Å; L142-I165 PolarHBondContact N-O 2.89Å; L142-I165 VanDerWaalsContact N-O 3.14Å; L142-I165 PolarHBondContact O-N 3.37Å
166	H	94.7	Very high	95.7	Very high	40 Å²	40	23.3 Å²	23.3	19%	0.185	12%	0.124	C	C	.	.			trans	-99.1	160.2	-175.4	-63.4	-89.7	0	0	0	111.9	L141 N168 G169 K170 S172	L141-H166 WeakPolarHBondContact CD1-ND1 3.5Å; H166-N168 WeakPolarHBondContact CB-OD1 3.41Å; H166-N168 PolarHBondContact O-N 3.17Å; H166-N168 VanDerWaalsContact O-N 3.17Å; H166-G169 WeakPolarHBondContact O-CA 3.4Å; H166-G169 PolarHBondContact O-N 2.72Å; H166-K170 HydrophobicContact CB-CB 4.18Å; H166-K170 PolarHBondContact CD2-O 2.8Å; H166-K170 PolarHBondContact N-O 2.81Å; H166-S172 PolarHBondContact CD2-OG 3.19Å; H166-S172 PolarHBondContact NE2-OG 3.3Å
167	P	92.3	Very high	95.9	Very high	47 Å²	47	20.8 Å²	20.8	31%	0.305	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.1	-178.2	-29.4	37.8	0	0	0	115.3	F87 E140 G169	F87-P167 HydrophobicContact CB-CB 3.92Å; F87-P167 HydrophobicContact CB-CG 4.37Å; F87-P167 HydrophobicContact CD1-CB 4.42Å; F87-P167 HydrophobicContact CD1-CG 4.06Å; F87-P167 VanDerWaalsContact CD2-CA 3.46Å; F87-P167 HydrophobicContact CD2-CB 4.24Å; F87-P167 HydrophobicContact CE1-CG 4.47Å; F87-P167 HydrophobicContact CG-CB 3.96Å; F87-P167 HydrophobicContact CG-CG 4.11Å; E140-P167 HydrophobicContact CB-CG 4.08Å; E140-P167 WeakPolarHBondContact O-CD 3.34Å; E140-P167 VanDerWaalsContact O-CG 3.3Å; E140-P167 WeakPolarHBondContact O-CG 3.3Å; P167-G169 PolarHBondContact O-N 2.86Å
168	N	88	Confident	96	Very high	79 Å²	79	20.3 Å²	20.3	42%	0.422	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	3.3	176.4	65.7	-6.8	0	0	0	113.6	H166 K170 D261	H166-N168 WeakPolarHBondContact CB-OD1 3.41Å; H166-N168 PolarHBondContact O-N 3.17Å; H166-N168 VanDerWaalsContact O-N 3.17Å; N168-K170 VanDerWaalsContact C-N 3.29Å; N168-K170 PolarHBondContact O-N 2.85Å; N168-K170 WeakPolarHBondContact OD1-CB 3.44Å; N168-K170 PolarHBondContact OD1-N 2.95Å; N168-D261 PolarHBondContact ND2-OD2 2.97Å
169	G	91.2	Very high	96	Very high	2 Å²	2	17.9 Å²	17.9	2%	0.021	10%	0.096	C	C	.	.	S	Bend	trans	79.9	4.6	-175.6	0	0	0	0	0	114.7	H166 P167 M171	H166-G169 WeakPolarHBondContact O-CA 3.4Å; H166-G169 PolarHBondContact O-N 2.72Å; P167-G169 PolarHBondContact O-N 2.86Å; G169-M171 PolarHBondContact O-N 2.85Å
170	K	94	Very high	95.8	Very high	34 Å²	34	24.4 Å²	24.4	15%	0.148	14%	0.136	C	C	.	.			trans	-63.9	134.3	170.3	-176.6	176.3	70.4	167.3	0	109.4	H166 N168 E220 F221 E222	H166-K170 HydrophobicContact CB-CB 4.18Å; H166-K170 PolarHBondContact CD2-O 2.8Å; H166-K170 PolarHBondContact N-O 2.81Å; N168-K170 VanDerWaalsContact C-N 3.29Å; N168-K170 PolarHBondContact O-N 2.85Å; N168-K170 WeakPolarHBondContact OD1-CB 3.44Å; N168-K170 PolarHBondContact OD1-N 2.95Å; K170-E220 HydrophobicContact CD-CB 4.28Å; K170-E220 HydrophobicContact CD-CG 4.44Å; K170-E220 WeakPolarHBondContact CE-OE1 3.47Å; K170-E220 IonicContact NZ-OE1 3.35Å; K170-E220 PolarHBondContact NZ-OE1 3.3Å; K170-F221 VanDerWaalsContact CA-O 3.31Å; K170-F221 WeakPolarHBondContact CA-O 3.45Å; K170-F221 WeakPolarHBondContact CG-O 3.46Å; K170-E222 HydrophobicContact CB-CG 4.24Å; K170-E222 HydrophobicContact CD-CG 3.84Å; K170-E222 HydrophobicContact CG-CG 3.79Å
171	M	96.4	Very high	95.6	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.4	174.8	-60.4	166.9	-69	0	0	108.9	Y56 Y91 I121 L164 G169 I191 E220 F221	Y56-M171 HydrophobicContact CD1-CE 4.15Å; Y56-M171 HydrophobicContact CE1-CE 3.5Å; Y56-M171 VanDerWaalsContact CE1-CE 3.5Å; Y91-M171 HydrophobicContact CD2-CE 4.23Å; Y91-M171 HydrophobicContact CD2-SD 3.84Å; Y91-M171 HydrophobicContact CE2-CE 3.88Å; Y91-M171 HydrophobicContact CE2-SD 3.52Å; Y91-M171 VanDerWaalsContact CE2-SD 3.52Å; I121-M171 HydrophobicContact CD1-CG 3.99Å; I121-M171 HydrophobicContact CD1-SD 3.38Å; I121-M171 WeakPolarHBondContact CD1-SD 3.31Å; I121-M171 HydrophobicContact CG1-SD 3.69Å; L164-M171 CarbonylContact O-C 3.57Å; L164-M171 WeakPolarHBondContact O-CA 3.32Å; G169-M171 PolarHBondContact O-N 2.85Å; M171-I191 HydrophobicContact CE-CD1 3.71Å; M171-I191 HydrophobicContact CE-CG2 4.03Å; M171-I191 HydrophobicContact SD-CG2 4.24Å; M171-E220 CarbonylContact O-C 3.55Å; M171-E220 WeakPolarHBondContact O-CA 3.46Å; M171-F221 HydrophobicContact CB-CB 4.35Å; M171-F221 HydrophobicContact CB-CD2 4.46Å; M171-F221 HydrophobicContact CE-CB 3.82Å; M171-F221 PolarHBondContact N-O 3.41Å; M171-F221 PolarHBondContact O-N 2.84Å
172	S	97.5	Very high	95.4	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.2	-176.8	-49.5	0	0	0	0	109.8	S163 L164 H166 V219	S163-S172 CarbonylContact C-O 3.49Å; S163-S172 WeakPolarHBondContact CA-O 3.35Å; L164-S172 PolarHBondContact N-O 2.81Å; L164-S172 PolarHBondContact O-N 2.94Å; H166-S172 PolarHBondContact CD2-OG 3.19Å; H166-S172 PolarHBondContact NE2-OG 3.3Å; S172-V219 CarbonylContact C-O 3.5Å; S172-V219 VanDerWaalsContact CA-O 3.27Å; S172-V219 WeakPolarHBondContact CA-O 3.33Å
173	L	98.3	Very high	95.2	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121	170.7	-48.6	-176.2	0	0	0	108.2	I121 N123 T162 V208 V219 F221	I121-L173 HydrophobicContact CG2-CD2 3.84Å; N123-L173 HydrophobicContact CB-CD1 4.42Å; N123-L173 HydrophobicContact CB-CD2 4.14Å; T162-L173 CarbonylContact O-C 3.55Å; T162-L173 WeakPolarHBondContact O-CA 3.48Å; L173-V208 HydrophobicContact CD1-CG2 4.36Å; L173-V219 HydrophobicContact CB-CB 4.24Å; L173-V219 PolarHBondContact N-O 3.29Å; L173-V219 PolarHBondContact O-N 2.67Å; L173-F221 HydrophobicContact CD1-CE2 3.88Å; L173-F221 HydrophobicContact CG-CE2 4.15Å
174	Y	98.4	Very high	95	Very high	15 Å²	15	37.7 Å²	37.7	6%	0.059	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.3	178.4	-176.1	-105.5	0	0	0	110	Q64 P65 Q66 P67 M161 T162 D176 T217 L218	Q64-Y174 HydrophobicContact CB-CE2 4.29Å; Q64-Y174 WeakPolarHBondContact O-CE2 3.34Å; Q64-Y174 PolarHBondContact O-OH 3.14Å; P65-Y174 WeakPolarHBondContact O-CE2 3.42Å; Q66-Y174 HydrophobicContact CB-CE1 4.23Å; Q66-Y174 HydrophobicContact CG-CD1 4.27Å; Q66-Y174 HydrophobicContact CG-CE1 3.47Å; Q66-Y174 VanDerWaalsContact CG-CE1 3.47Å; Q66-Y174 PolarHBondContact N-OH 3.36Å; P67-Y174 VanDerWaalsContact CD-CG 3.5Å; P67-Y174 HydrophobicContact CG-CD2 4.47Å; P67-Y174 HydrophobicContact CG-CG 4.11Å; M161-Y174 WeakPolarHBondContact CA-O 3.13Å; T162-Y174 PolarHBondContact N-O 3.25Å; T162-Y174 PolarHBondContact O-N 3.08Å; Y174-D176 HydrophobicContact CD1-CB 4.32Å; Y174-D176 HydrophobicContact CE1-CB 4.13Å; Y174-D176 WeakPolarHBondContact CE1-OD1 3.37Å; Y174-T217 WeakPolarHBondContact CD2-O 3.41Å; Y174-L218 HydrophobicContact CD2-CB 4.1Å; Y174-L218 HydrophobicContact CD2-CD1 4.1Å
175	Y	98.2	Very high	94.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	91.9	177.7	-48.8	-51.3	0	0	0	109.1	N123 M161 I178 S189 I213 K214 S215 G216 T217 V219	N123-Y175 WeakPolarHBondContact OD1-CE1 3.29Å; M161-Y175 HydrophobicContact CE-CD1 4.24Å; M161-Y175 HydrophobicContact CG-CD1 4.15Å; Y175-I178 HydrophobicContact CD1-CD1 4.46Å; Y175-I178 HydrophobicContact CG-CD1 4.42Å; Y175-I178 HydrophobicContact CG-CG1 4.28Å; Y175-S189 VanDerWaalsContact OH-CB 3.32Å; Y175-S189 WeakPolarHBondContact OH-CB 3.4Å; Y175-S189 PolarHBondContact OH-OG 2.84Å; Y175-I213 HydrophobicContact CD1-CG2 3.94Å; Y175-I213 HydrophobicContact CD2-CB 4.3Å; Y175-I213 HydrophobicContact CD2-CG2 3.95Å; Y175-I213 HydrophobicContact CE1-CG2 3.81Å; Y175-I213 HydrophobicContact CE2-CB 4Å; Y175-I213 HydrophobicContact CE2-CG1 3.96Å; Y175-I213 HydrophobicContact CE2-CG2 3.92Å; Y175-I213 HydrophobicContact CG-CG2 4.04Å; Y175-K214 WeakPolarHBondContact CB-O 3.49Å; Y175-S215 CarbonylContact O-C 3.54Å; Y175-S215 WeakPolarHBondContact O-CA 3.23Å; Y175-G216 PolarHBondContact O-N 2.94Å; Y175-T217 HydrophobicContact CD2-CG2 4.32Å; Y175-T217 HydrophobicContact CE2-CG2 4.25Å; Y175-T217 PolarHBondContact N-O 3.4Å; Y175-T217 VanDerWaalsContact N-O 3.09Å; Y175-V219 HydrophobicContact CE2-CG2 3.99Å
176	D	97.2	Very high	94.5	Very high	27 Å²	27	44.7 Å²	44.7	14%	0.144	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	-47.4	-179.3	-60.1	-101.7	0	0	0	111.9	Q66 T160 T162 Y174	Q66-D176 WeakPolarHBondContact CG-OD1 3.2Å; Q66-D176 PolarHBondContact NE2-OD1 3.17Å; T160-D176 HydrophobicContact CG2-CB 3.63Å; T160-D176 PolarHBondContact O-N 3.49Å; T162-D176 WeakPolarHBondContact CB-OD2 3.39Å; T162-D176 PolarHBondContact N-OD2 2.91Å; T162-D176 PolarHBondContact OG1-OD2 2.94Å; Y174-D176 HydrophobicContact CD1-CB 4.32Å; Y174-D176 HydrophobicContact CE1-CB 4.13Å; Y174-D176 WeakPolarHBondContact CE1-OD1 3.37Å
177	N	96.9	Very high	94.5	Very high	69 Å²	69	43.5 Å²	43.5	37%	0.369	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	120.6	177.5	-176	47	0	0	0	110.9	T158 A159 T160	T158-N177 PolarHBondContact O-ND2 3.06Å; A159-N177 CarbonylContact C-O 3.57Å; A159-N177 VanDerWaalsContact CA-O 3.22Å; A159-N177 WeakPolarHBondContact CA-O 3.38Å; T160-N177 PolarHBondContact N-O 3.35Å; T160-N177 PolarHBondContact O-N 2.85Å; T160-N177 VanDerWaalsContact O-N 3.09Å
178	I	97	Very high	94.7	Very high	12 Å²	12	46 Å²	46	6%	0.062	23%	0.231	C	C	.	.			trans	-124.4	98.8	172.7	-52.2	-64.9	0	0	0	107.4	M161 Y175 T180 L187 I213 S215	M161-I178 HydrophobicContact CE-CD1 3.35Å; M161-I178 HydrophobicContact CG-CD1 3.99Å; Y175-I178 HydrophobicContact CD1-CD1 4.46Å; Y175-I178 HydrophobicContact CG-CD1 4.42Å; Y175-I178 HydrophobicContact CG-CG1 4.28Å; I178-T180 PolarHBondContact O-N 2.75Å; I178-L187 HydrophobicContact CG2-CD1 3.98Å; I178-L187 HydrophobicContact CG2-CD2 4.1Å; I178-I213 HydrophobicContact CD1-CG2 4.27Å; I178-I213 HydrophobicContact CG1-CG2 4.37Å; I178-S215 PolarHBondContact N-OG 3.23Å; I178-S215 PolarHBondContact O-OG 2.92Å
179	P	95.8	Very high	95.1	Very high	15 Å²	15	42.4 Å²	42.4	10%	0.097	21%	0.212	C	C	.	.			trans	-52.4	137.1	173.1	-26	32.4	0	0	0	111.8	V157 T158 E181 I182	V157-P179 HydrophobicContact CB-CB 4.06Å; V157-P179 HydrophobicContact CB-CG 3.93Å; V157-P179 HydrophobicContact CG1-CB 4.48Å; V157-P179 HydrophobicContact CG2-CB 4.04Å; V157-P179 HydrophobicContact CG2-CG 4.06Å; T158-P179 WeakPolarHBondContact O-CG 3.31Å; P179-E181 VanDerWaalsContact CB-OE2 3.23Å; P179-E181 WeakPolarHBondContact CB-OE2 3.2Å; P179-E181 PolarHBondContact O-N 3.12Å; P179-I182 HydrophobicContact CB-CD1 4.16Å; P179-I182 HydrophobicContact CB-CG1 4.28Å; P179-I182 HydrophobicContact CG-CD1 4.06Å; P179-I182 PolarHBondContact O-N 2.93Å
180	T	93.9	Very high	95.4	Very high	137 Å²	137	42.6 Å²	42.6	84%	0.84	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-17.8	-177.5	45.8	0	0	0	0	113.7	I178 I182	I178-T180 PolarHBondContact O-N 2.75Å; T180-I182 PolarHBondContact O-N 2.85Å
181	E	93.1	Very high	95.5	Very high	92 Å²	92	41 Å²	41	43%	0.43	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.1	177.9	-57.1	85.4	165.8	0	0	112.4	A152 P179 E183	A152-E181 HydrophobicContact CB-CB 3.72Å; P179-E181 VanDerWaalsContact CB-OE2 3.23Å; P179-E181 WeakPolarHBondContact CB-OE2 3.2Å; P179-E181 PolarHBondContact O-N 3.12Å; E181-E183 PolarHBondContact O-N 3.1Å
182	I	92.5	Very high	95.5	Very high	10 Å²	10	42.4 Å²	42.4	5%	0.051	21%	0.211	C	C	.	.	S	Bend	trans	-80.4	119.4	176.8	-59.2	170.4	0	0	0	109	I125 I150 V157 A159 P179 T180 K186 L187	I125-I182 HydrophobicContact CD1-CD1 4.23Å; I125-I182 HydrophobicContact CG2-CG2 4.05Å; I150-I182 HydrophobicContact CD1-CD1 3.57Å; I150-I182 HydrophobicContact CD1-CG1 4.28Å; V157-I182 HydrophobicContact CG2-CD1 4.27Å; V157-I182 HydrophobicContact CG2-CG1 4.06Å; A159-I182 HydrophobicContact CB-CD1 3.83Å; P179-I182 HydrophobicContact CB-CD1 4.16Å; P179-I182 HydrophobicContact CB-CG1 4.28Å; P179-I182 HydrophobicContact CG-CD1 4.06Å; P179-I182 PolarHBondContact O-N 2.93Å; T180-I182 PolarHBondContact O-N 2.85Å; I182-K186 HydrophobicContact CG2-CB 4.24Å; I182-L187 HydrophobicContact CG2-CD2 3.76Å; I182-L187 HydrophobicContact CG2-CG 4.18Å
183	E	92.4	Very high	95.3	Very high	92 Å²	92	42.2 Å²	42.2	43%	0.43	21%	0.21	S	C	.	.			trans	-60	137.3	175.3	-65.4	172.5	-147.1	0	0	111.9	E181 N185 K186	E181-E183 PolarHBondContact O-N 3.1Å; E183-N185 WeakPolarHBondContact CB-OD1 3.49Å; E183-N185 PolarHBondContact O-N 2.96Å; E183-N185 VanDerWaalsContact O-N 3.15Å; E183-N185 PolarHBondContact OE2-ND2 2.86Å; E183-N185 VanDerWaalsContact OE2-ND2 3.08Å; E183-N185 PolarHBondContact OE2-OD1 3.41Å; E183-K186 WeakPolarHBondContact O-CB 3.24Å; E183-K186 PolarHBondContact O-N 3.31Å
184	Q	93.2	Very high	95.1	Very high	113 Å²	113	46 Å²	46	53%	0.528	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-58.8	-29.7	-177.7	-71.5	-178	0.9	0	0	113.7	K186 L187 A210	Q184-K186 PolarHBondContact O-N 3.05Å; Q184-L187 PolarHBondContact O-N 2.53Å; Q184-A210 HydrophobicContact CB-CB 4.1Å
185	N	92	Very high	94.8	Very high	111 Å²	111	45.6 Å²	45.6	59%	0.594	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-65.9	-19.6	177.5	61.3	1.2	0	0	0	113.2	E183	E183-N185 WeakPolarHBondContact CB-OD1 3.49Å; E183-N185 PolarHBondContact O-N 2.96Å; E183-N185 VanDerWaalsContact O-N 3.15Å; E183-N185 PolarHBondContact OE2-ND2 2.86Å; E183-N185 VanDerWaalsContact OE2-ND2 3.08Å; E183-N185 PolarHBondContact OE2-OD1 3.41Å
186	K	92.6	Very high	94.2	Very high	38 Å²	38	46.9 Å²	46.9	17%	0.165	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-85.2	-22.1	176.2	-62.7	-178.8	-174.2	175.2	0	111.9	I125 Q126 I182 E183 Q184	I125-K186 CarbonylContact C-O 3.6Å; I125-K186 VanDerWaalsContact CA-O 3.29Å; I125-K186 WeakPolarHBondContact CA-O 3.46Å; I125-K186 HydrophobicContact CG2-CB 4Å; Q126-K186 HydrophobicContact CB-CB 4.42Å; Q126-K186 PolarHBondContact N-O 3.31Å; I182-K186 HydrophobicContact CG2-CB 4.24Å; E183-K186 WeakPolarHBondContact O-CB 3.24Å; E183-K186 PolarHBondContact O-N 3.31Å; Q184-K186 PolarHBondContact O-N 3.05Å
187	L	94.7	Very high	93.8	Very high	16 Å²	16	46.1 Å²	46.1	8%	0.084	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	119	-176.8	-58.7	175.2	0	0	0	109.7	I125 M161 I178 I182 Q184 I213	I125-L187 HydrophobicContact CD1-CD2 4.03Å; I125-L187 HydrophobicContact CG1-CD2 3.86Å; I125-L187 HydrophobicContact CG2-CD2 4.21Å; M161-L187 HydrophobicContact CE-CD2 4.11Å; I178-L187 HydrophobicContact CG2-CD1 3.98Å; I178-L187 HydrophobicContact CG2-CD2 4.1Å; I182-L187 HydrophobicContact CG2-CD2 3.76Å; I182-L187 HydrophobicContact CG2-CG 4.18Å; Q184-L187 PolarHBondContact O-N 2.53Å; L187-I213 HydrophobicContact CB-CB 4.31Å; L187-I213 HydrophobicContact CB-CD1 3.91Å; L187-I213 HydrophobicContact CB-CG2 4.1Å; L187-I213 HydrophobicContact CD1-CB 4.02Å; L187-I213 HydrophobicContact CD1-CG2 3.94Å; L187-I213 HydrophobicContact CD2-CG2 4.31Å; L187-I213 HydrophobicContact CG-CG2 4.35Å
188	R	95	Very high	93.1	Very high	100 Å²	100	48.9 Å²	48.9	38%	0.377	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	110.1	-179	-171.7	-179.5	-178.3	-144.2	2	110.8	I122 N124 L190	I122-R188 HydrophobicContact CG2-CG 4.32Å; N124-R188 PolarHBondContact N-O 3.17Å; N124-R188 CarbonylContact O-C 3.54Å; N124-R188 PolarHBondContact O-N 3.07Å; R188-L190 HydrophobicContact CG-CD2 4.39Å
189	S	96.9	Very high	92.4	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.4	172.2	-53.1	0	0	0	0	109.4	I122 N123 Y175 V208	I122-S189 CarbonylContact O-C 3.55Å; I122-S189 WeakPolarHBondContact O-CA 3.39Å; N123-S189 PolarHBondContact OD1-OG 2.82Å; Y175-S189 VanDerWaalsContact OH-CB 3.32Å; Y175-S189 WeakPolarHBondContact OH-CB 3.4Å; Y175-S189 PolarHBondContact OH-OG 2.84Å; S189-V208 WeakPolarHBondContact O-CB 3.19Å; S189-V208 PolarHBondContact O-N 2.87Å
190	L	96.7	Very high	92	Very high	6 Å²	6	56.2 Å²	56.2	3%	0.031	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	162.8	-179.2	67.1	82.1	0	0	0	111.5	I122 R188 I206 P207	I122-L190 HydrophobicContact CB-CD1 4.23Å; I122-L190 HydrophobicContact CB-CG 4.02Å; I122-L190 HydrophobicContact CD1-CD1 3.72Å; I122-L190 HydrophobicContact CD1-CD2 4.4Å; I122-L190 HydrophobicContact CD1-CG 4.03Å; I122-L190 HydrophobicContact CG1-CD1 3.93Å; I122-L190 HydrophobicContact CG1-CG 4.23Å; I122-L190 PolarHBondContact N-O 2.85Å; I122-L190 PolarHBondContact O-N 3.48Å; R188-L190 HydrophobicContact CG-CD2 4.39Å; L190-I206 VanDerWaalsContact CA-O 3.26Å; L190-I206 WeakPolarHBondContact CA-O 3.35Å; L190-I206 WeakPolarHBondContact CB-O 3.41Å; L190-P207 HydrophobicContact CB-CB 4.43Å
191	I	96.7	Very high	91.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.4	160.1	60.2	170	0	0	0	109.8	Y56 I121 M171 E205 I206 F221	Y56-I191 HydrophobicContact CD1-CD1 4.03Å; Y56-I191 HydrophobicContact CD2-CD1 4.1Å; Y56-I191 HydrophobicContact CE1-CD1 4.28Å; Y56-I191 HydrophobicContact CE2-CD1 4.36Å; Y56-I191 HydrophobicContact CG-CD1 3.94Å; I121-I191 HydrophobicContact CG1-CG2 4.23Å; I121-I191 HydrophobicContact CG2-CG2 4.21Å; M171-I191 HydrophobicContact CE-CD1 3.71Å; M171-I191 HydrophobicContact CE-CG2 4.03Å; M171-I191 HydrophobicContact SD-CG2 4.24Å; I191-E205 WeakPolarHBondContact O-CA 3.24Å; I191-I206 HydrophobicContact CD1-CB 4.46Å; I191-I206 HydrophobicContact CD1-CD1 3.71Å; I191-I206 HydrophobicContact CG1-CB 3.78Å; I191-I206 HydrophobicContact CG1-CD1 3.92Å; I191-I206 HydrophobicContact CG1-CG1 4.2Å; I191-I206 PolarHBondContact N-O 3.14Å; I191-I206 VanDerWaalsContact N-O 3.16Å; I191-I206 PolarHBondContact O-N 3.06Å; I191-F221 HydrophobicContact CD1-CB 4.01Å; I191-F221 HydrophobicContact CD1-CD1 3.62Å; I191-F221 HydrophobicContact CD1-CD2 4.48Å; I191-F221 HydrophobicContact CD1-CE1 4.19Å; I191-F221 HydrophobicContact CD1-CG 3.78Å; I191-F221 HydrophobicContact CG1-CD1 3.98Å; I191-F221 HydrophobicContact CG1-CE1 4.03Å; I191-F221 HydrophobicContact CG1-CG 4.3Å; I191-F221 HydrophobicContact CG1-CZ 4.38Å; I191-F221 HydrophobicContact CG2-CD2 3.87Å; I191-F221 HydrophobicContact CG2-CE2 3.92Å; I191-F221 HydrophobicContact CG2-CG 4.24Å; I191-F221 HydrophobicContact CG2-CZ 4.33Å
192	Y	95.8	Very high	91.6	Very high	30 Å²	30	52 Å²	52	12%	0.118	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.6	179.3	164.3	-85	0	0	0	109.3	Y91 Y117 G119 D120 K194 D203 H204 E205	Y91-Y192 WeakPolarHBondContact CE1-O 3.48Å; Y91-Y192 PolarHBondContact OH-N 3.09Å; Y91-Y192 PolarHBondContact OH-O 2.85Å; Y117-Y192 AromaticContact CE1-CE1 3.86Å; Y117-Y192 HydrophobicContact CE1-CE1 3.86Å; Y117-Y192 AromaticContact CZ-CE1 3.84Å; Y117-Y192 WeakPolarHBondContact OH-CD1 3.47Å; Y117-Y192 WeakPolarHBondContact OH-CE1 3.26Å; G119-Y192 CarbonylContact C-O 3.55Å; G119-Y192 VanDerWaalsContact CA-O 3.24Å; G119-Y192 WeakPolarHBondContact CA-O 3.32Å; D120-Y192 HydrophobicContact CB-CD1 4.45Å; D120-Y192 PolarHBondContact N-O 2.9Å; D120-Y192 PolarHBondContact O-N 3.2Å; Y192-K194 HydrophobicContact CE1-CB 4.1Å; Y192-D203 HydrophobicContact CE2-CB 3.66Å; Y192-D203 VanDerWaalsContact OH-CG 3.31Å; Y192-D203 PolarHBondContact OH-OD1 2.83Å; Y192-H204 CarbonylContact C-O 3.49Å; Y192-H204 WeakPolarHBondContact CA-O 3.15Å; Y192-E205 HydrophobicContact CD2-CG 3.65Å; Y192-E205 HydrophobicContact CG-CG 4.41Å
193	G	94.9	Very high	91.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130	176.8	0	0	0	0	0	112.1	Y92 D203 H204	Y92-G193 VanDerWaalsContact CE2-CA 3.42Å; G193-D203 WeakPolarHBondContact O-CA 3.36Å; G193-H204 PolarHBondContact N-O 2.62Å; G193-H204 PolarHBondContact O-N 3.46Å
194	K	93.6	Very high	91.7	Very high	81 Å²	81	49.9 Å²	49.9	35%	0.352	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	106.8	169.8	-172	177.5	-169.6	161	0	109.9	Y117 L118 Y192 H201	Y117-K194 HydrophobicContact CD1-CB 4.19Å; Y117-K194 HydrophobicContact CD1-CD 3.62Å; Y117-K194 HydrophobicContact CE1-CB 3.92Å; Y117-K194 HydrophobicContact CE1-CD 3.78Å; L118-K194 PolarHBondContact O-N 2.93Å; Y192-K194 HydrophobicContact CE1-CB 4.1Å; K194-H201 WeakPolarHBondContact CE-CD2 3.47Å; K194-H201 HydrophobicContact CG-CB 3.96Å
195	I	91	Very high	91.8	Very high	6 Å²	6	48.8 Å²	48.8	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	118.4	-171.4	-59.7	149.6	0	0	0	109	N27 I29 Y54 Y92 H201 R202 H204	N27-I195 HydrophobicContact CB-CG2 3.91Å; N27-I195 VanDerWaalsContact ND2-CG2 3.28Å; N27-I195 WeakPolarHBondContact ND2-CG2 3.42Å; I29-I195 HydrophobicContact CD1-CD1 4.01Å; I29-I195 HydrophobicContact CG2-CB 4.36Å; I29-I195 HydrophobicContact CG2-CD1 4.03Å; I29-I195 HydrophobicContact CG2-CG2 3.85Å; Y54-I195 HydrophobicContact CD1-CD1 4.22Å; Y54-I195 HydrophobicContact CE1-CD1 3.84Å; Y92-I195 HydrophobicContact CD1-CD1 3.78Å; Y92-I195 HydrophobicContact CD1-CG1 4.01Å; Y92-I195 HydrophobicContact CE1-CD1 4.12Å; Y92-I195 HydrophobicContact CG-CG1 4.43Å; I195-H201 CarbonylContact O-C 3.56Å; I195-H201 WeakPolarHBondContact O-CA 3.49Å; I195-H201 WeakPolarHBondContact O-CB 3.44Å; I195-R202 WeakPolarHBondContact CB-O 3.42Å; I195-R202 PolarHBondContact N-O 3.02Å; I195-R202 PolarHBondContact O-N 3.08Å; I195-H204 HydrophobicContact CD1-CB 3.75Å
196	G	87.4	Confident	92	Very high	27 Å²	27	43.5 Å²	43.5	28%	0.278	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	135.6	177.4	0	0	0	0	0	112.3	N27	N27-G196 PolarHBondContact ND2-O 2.98Å
197	C	87.3	Confident	92.2	Very high	10 Å²	10	45.3 Å²	45.3	7%	0.068	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	166.8	175.1	-61.1	0	0	0	0	109.8	C30 N199 G200 R202	C30-C197 VanDerWaalsContact CA-SG 3.59Å; C30-C197 HydrophobicContact CB-CB 3.76Å; C30-C197 WeakPolarHBondContact CB-SG 3.38Å; C30-C197 VanDerWaalsContact SG-CA 3.53Å; C30-C197 WeakPolarHBondContact SG-CB 3.39Å; C30-C197 CovalentContact SG-SG 2.03Å; C30-C197 PolarHBondContact SG-SG 2.93Å; C197-N199 VanDerWaalsContact C-N 3.3Å; C197-N199 PolarHBondContact O-N 2.83Å; C197-G200 PolarHBondContact N-O 2.84Å; C197-G200 PolarHBondContact O-N 2.57Å; C197-R202 WeakPolarHBondContact SG-CG 3.45Å
198	E	82.8	Confident	92.4	Very high	127 Å²	127	44.9 Å²	44.9	59%	0.593	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-44.2	175.6	-173.8	170.9	-149.2	0	0	112.1	N25 G200	N25-E198 PolarHBondContact OD1-OE2 3.25Å; E198-G200 PolarHBondContact O-N 2.87Å
199	N	82	Confident	92.5	Very high	135 Å²	135	41.9 Å²	41.9	72%	0.722	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	58	178.3	-65.1	-31.8	0	0	0	111.8	C197	C197-N199 VanDerWaalsContact C-N 3.3Å; C197-N199 PolarHBondContact O-N 2.83Å
200	G	87.7	Confident	92.4	Very high	46 Å²	46	43.2 Å²	43.2	47%	0.474	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	93.4	-121.3	175.4	0	0	0	0	0	113.5	C197 E198	C197-G200 PolarHBondContact N-O 2.84Å; C197-G200 PolarHBondContact O-N 2.57Å; E198-G200 PolarHBondContact O-N 2.87Å
201	H	88.4	Confident	92.3	Very high	80 Å²	80	47.7 Å²	47.7	37%	0.37	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	165.9	179.8	58.9	-81.6	0	0	0	111.6	K194 I195 D203	K194-H201 WeakPolarHBondContact CE-CD2 3.47Å; K194-H201 HydrophobicContact CG-CB 3.96Å; I195-H201 CarbonylContact O-C 3.56Å; I195-H201 WeakPolarHBondContact O-CA 3.49Å; I195-H201 WeakPolarHBondContact O-CB 3.44Å; H201-D203 IonicContact CD2-OD1 2.72Å; H201-D203 PolarHBondContact CD2-OD1 2.95Å; H201-D203 VanDerWaalsContact CD2-OD1 3.3Å; H201-D203 IonicContact NE2-OD1 3.88Å
202	R	90.8	Very high	92.4	Very high	60 Å²	60	48.1 Å²	48.1	23%	0.226	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.6	170.7	-64.4	-67.6	179.3	-91.2	0.6	108	I29 I195 C197	I29-R202 HydrophobicContact CG1-CB 4.39Å; I29-R202 HydrophobicContact CG2-CB 4.29Å; I195-R202 WeakPolarHBondContact CB-O 3.42Å; I195-R202 PolarHBondContact N-O 3.02Å; I195-R202 PolarHBondContact O-N 3.08Å; C197-R202 WeakPolarHBondContact SG-CG 3.45Å
203	D	91.6	Very high	92.5	Very high	55 Å²	55	46.9 Å²	46.9	29%	0.294	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	139.5	174.8	-58.1	-40.6	0	0	0	109	Y192 G193 H201	Y192-D203 HydrophobicContact CE2-CB 3.66Å; Y192-D203 VanDerWaalsContact OH-CG 3.31Å; Y192-D203 PolarHBondContact OH-OD1 2.83Å; G193-D203 WeakPolarHBondContact O-CA 3.36Å; H201-D203 IonicContact CD2-OD1 2.72Å; H201-D203 PolarHBondContact CD2-OD1 2.95Å; H201-D203 VanDerWaalsContact CD2-OD1 3.3Å; H201-D203 IonicContact NE2-OD1 3.88Å
204	H	94.3	Very high	92.6	Very high	3 Å²	3	51.7 Å²	51.7	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	128.8	173.1	-177.2	-97.5	0	0	0	109.3	I29 L35 Y54 Y92 Y192 G193 I195 I206	I29-H204 HydrophobicContact CD1-CB 3.96Å; L35-H204 PolarHBondContact O-CD2 2.89Å; Y54-H204 WeakPolarHBondContact CB-NE2 3.48Å; Y92-H204 HydrophobicContact CE1-CB 4Å; Y92-H204 AromaticContact CE1-CG 3.99Å; Y92-H204 AromaticContact CE1-ND1 3.46Å; Y92-H204 WeakPolarHBondContact CE1-ND1 3.43Å; Y92-H204 AromaticContact CZ-ND1 3.62Å; Y92-H204 PolarHBondContact OH-ND1 3.43Å; Y192-H204 CarbonylContact C-O 3.49Å; Y192-H204 WeakPolarHBondContact CA-O 3.15Å; G193-H204 PolarHBondContact N-O 2.62Å; G193-H204 PolarHBondContact O-N 3.46Å; I195-H204 HydrophobicContact CD1-CB 3.75Å; H204-I206 WeakPolarHBondContact CE1-CG1 3.32Å
205	E	95.4	Very high	92.8	Very high	91 Å²	91	49.9 Å²	49.9	43%	0.425	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.7	178.3	-71.1	-173.6	-172.3	0	0	109.9	I191 Y192	I191-E205 WeakPolarHBondContact O-CA 3.24Å; Y192-E205 HydrophobicContact CD2-CG 3.65Å; Y192-E205 HydrophobicContact CG-CG 4.41Å
206	I	96.8	Very high	93.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	94.2	169.5	-56.4	165.9	0	0	0	107.5	H53 Y56 M58 L190 I191 H204 F221	H53-I206 HydrophobicContact CB-CD1 3.56Å; H53-I206 HydrophobicContact CB-CG1 3.82Å; H53-I206 HydrophobicContact CB-CG2 4.44Å; Y56-I206 HydrophobicContact CD2-CD1 4.12Å; Y56-I206 HydrophobicContact CG-CD1 4.16Å; M58-I206 HydrophobicContact SD-CG2 4.38Å; L190-I206 VanDerWaalsContact CA-O 3.26Å; L190-I206 WeakPolarHBondContact CA-O 3.35Å; L190-I206 WeakPolarHBondContact CB-O 3.41Å; I191-I206 HydrophobicContact CD1-CB 4.46Å; I191-I206 HydrophobicContact CD1-CD1 3.71Å; I191-I206 HydrophobicContact CG1-CB 3.78Å; I191-I206 HydrophobicContact CG1-CD1 3.92Å; I191-I206 HydrophobicContact CG1-CG1 4.2Å; I191-I206 PolarHBondContact N-O 3.14Å; I191-I206 VanDerWaalsContact N-O 3.16Å; I191-I206 PolarHBondContact O-N 3.06Å; H204-I206 WeakPolarHBondContact CE1-CG1 3.32Å; I206-F221 HydrophobicContact CB-CE1 4.19Å; I206-F221 HydrophobicContact CG2-CD1 4.34Å; I206-F221 HydrophobicContact CG2-CE1 3.66Å
207	P	97	Very high	93.6	Very high	75 Å²	75	48.9 Å²	48.9	49%	0.487	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	138.2	178.7	30.9	-33.9	0	0	0	111.5	L190 P209	L190-P207 HydrophobicContact CB-CB 4.43Å; P207-P209 WeakPolarHBondContact O-CD 3.4Å
208	V	97.8	Very high	94.2	Very high	8 Å²	8	49.3 Å²	49.3	5%	0.048	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-74.8	122.5	163.3	-176.5	0	0	0	0	107.7	M58 I60 L173 S189 A210 W212 I213 V219 F221	M58-V208 HydrophobicContact SD-CG2 4.42Å; I60-V208 HydrophobicContact CD1-CG1 4.24Å; L173-V208 HydrophobicContact CD1-CG2 4.36Å; S189-V208 WeakPolarHBondContact O-CB 3.19Å; S189-V208 PolarHBondContact O-N 2.87Å; V208-A210 PolarHBondContact O-N 2.82Å; V208-W212 HydrophobicContact CG1-CB 4.29Å; V208-I213 HydrophobicContact CG1-CG1 4.01Å; V208-V219 HydrophobicContact CG1-CG2 3.85Å; V208-V219 HydrophobicContact CG2-CB 4.46Å; V208-V219 HydrophobicContact CG2-CG1 3.88Å; V208-V219 HydrophobicContact CG2-CG2 4.19Å; V208-F221 HydrophobicContact CG2-CE2 4.42Å; V208-F221 HydrophobicContact CG2-CZ 3.85Å
209	P	96.8	Very high	94.9	Very high	36 Å²	36	43.3 Å²	43.3	23%	0.234	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-63	127.8	179.6	-15.1	25.6	0	0	0	110.2	P207 K211 W212	P207-P209 WeakPolarHBondContact O-CD 3.4Å; P209-K211 HydrophobicContact CB-CG 4.37Å; P209-K211 PolarHBondContact O-N 3.45Å; P209-W212 WeakPolarHBondContact O-CB 3.32Å; P209-W212 PolarHBondContact O-N 2.83Å
210	A	95.7	Very high	95.6	Very high	32 Å²	32	37.8 Å²	37.8	26%	0.264	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-54	-29.5	-170.5	0	0	0	0	0	114.2	Q184 V208 W212 I213	Q184-A210 HydrophobicContact CB-CB 4.1Å; V208-A210 PolarHBondContact O-N 2.82Å; A210-W212 PolarHBondContact O-N 3.42Å; A210-W212 VanDerWaalsContact O-N 3.1Å; A210-I213 PolarHBondContact O-N 2.98Å
211	K	95.5	Very high	96.1	Very high	100 Å²	100	35.6 Å²	35.6	44%	0.435	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-57.5	-23.7	174.5	71.5	177.4	-174.2	174.6	0	114.1	E44 P209 K214	E44-K211 IonicContact OE1-NZ 3.81Å; E44-K211 PolarHBondContact OE1-NZ 2.82Å; P209-K211 HydrophobicContact CB-CG 4.37Å; P209-K211 PolarHBondContact O-N 3.45Å; K211-K214 WeakPolarHBondContact O-CE 3.32Å
212	W	97.3	Very high	96.4	Very high	9 Å²	9	32.1 Å²	32.1	3%	0.034	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-89.6	-18.4	178.8	-68.5	105.6	0	0	0	113.4	E44 N45 R49 I60 R62 V208 P209 A210 K214 T217	E44-W212 HydrophobicContact CG-CZ2 4.12Å; N45-W212 WeakPolarHBondContact O-CH2 3.34Å; R49-W212 HydrophobicContact CB-CH2 4.1Å; R49-W212 HydrophobicContact CB-CZ2 3.66Å; I60-W212 HydrophobicContact CB-CD2 4.37Å; I60-W212 HydrophobicContact CB-CE3 4.28Å; I60-W212 HydrophobicContact CD1-CB 4.05Å; I60-W212 HydrophobicContact CD1-CD2 4.16Å; I60-W212 HydrophobicContact CD1-CG 3.74Å; I60-W212 HydrophobicContact CG2-CB 3.94Å; I60-W212 HydrophobicContact CG2-CD2 3.67Å; I60-W212 HydrophobicContact CG2-CE3 3.38Å; I60-W212 HydrophobicContact CG2-CG 3.92Å; I60-W212 HydrophobicContact CG2-CZ3 4.06Å; R62-W212 HydrophobicContact CG-CE3 4.13Å; R62-W212 HydrophobicContact CG-CZ3 3.78Å; V208-W212 HydrophobicContact CG1-CB 4.29Å; P209-W212 WeakPolarHBondContact O-CB 3.32Å; P209-W212 PolarHBondContact O-N 2.83Å; A210-W212 PolarHBondContact O-N 3.42Å; A210-W212 VanDerWaalsContact O-N 3.1Å; W212-K214 VanDerWaalsContact C-N 3.29Å; W212-K214 PolarHBondContact O-N 3.16Å; W212-T217 VanDerWaalsContact O-CB 3.31Å; W212-T217 WeakPolarHBondContact O-CB 3.48Å; W212-T217 WeakPolarHBondContact O-CG2 3.45Å; W212-T217 PolarHBondContact O-OG1 2.9Å
213	I	97.6	Very high	96.4	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.015	17%	0.174	C	C	.	.			trans	-76.7	79.7	179.9	-50.1	177.6	0	0	0	109.2	M161 Y175 I178 L187 V208 A210	M161-I213 HydrophobicContact CE-CG2 3.98Å; Y175-I213 HydrophobicContact CD1-CG2 3.94Å; Y175-I213 HydrophobicContact CD2-CB 4.3Å; Y175-I213 HydrophobicContact CD2-CG2 3.95Å; Y175-I213 HydrophobicContact CE1-CG2 3.81Å; Y175-I213 HydrophobicContact CE2-CB 4Å; Y175-I213 HydrophobicContact CE2-CG1 3.96Å; Y175-I213 HydrophobicContact CE2-CG2 3.92Å; Y175-I213 HydrophobicContact CG-CG2 4.04Å; I178-I213 HydrophobicContact CD1-CG2 4.27Å; I178-I213 HydrophobicContact CG1-CG2 4.37Å; L187-I213 HydrophobicContact CB-CB 4.31Å; L187-I213 HydrophobicContact CB-CD1 3.91Å; L187-I213 HydrophobicContact CB-CG2 4.1Å; L187-I213 HydrophobicContact CD1-CB 4.02Å; L187-I213 HydrophobicContact CD1-CG2 3.94Å; L187-I213 HydrophobicContact CD2-CG2 4.31Å; L187-I213 HydrophobicContact CG-CG2 4.35Å; V208-I213 HydrophobicContact CG1-CG1 4.01Å; A210-I213 PolarHBondContact O-N 2.98Å
214	K	97.3	Very high	96.2	Very high	101 Å²	101	29.8 Å²	29.8	44%	0.439	16%	0.164	S	C	.	.	S	Bend	trans	-138.6	164.9	171.1	-28.3	179.2	-172.4	176.3	0	110.2	R62 Y175 K211 W212 G216 T217	R62-K214 VanDerWaalsContact NH1-CD 3.3Å; Y175-K214 WeakPolarHBondContact CB-O 3.49Å; K211-K214 WeakPolarHBondContact O-CE 3.32Å; W212-K214 VanDerWaalsContact C-N 3.29Å; W212-K214 PolarHBondContact O-N 3.16Å; K214-G216 PolarHBondContact O-N 3.4Å; K214-T217 WeakPolarHBondContact O-CB 3.12Å; K214-T217 PolarHBondContact O-N 2.81Å; K214-T217 PolarHBondContact O-OG1 2.88Å; K214-T217 VanDerWaalsContact O-OG1 3.07Å
215	S	97.9	Very high	95.7	Very high	44 Å²	44	31 Å²	31	31%	0.308	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	135.3	179.2	-48.8	0	0	0	0	112.6	Y175 I178 T217	Y175-S215 CarbonylContact O-C 3.54Å; Y175-S215 WeakPolarHBondContact O-CA 3.23Å; I178-S215 PolarHBondContact N-OG 3.23Å; I178-S215 PolarHBondContact O-OG 2.92Å; S215-T217 VanDerWaalsContact C-N 3.32Å; S215-T217 PolarHBondContact O-N 3.23Å
216	G	97.7	Very high	95.1	Very high	12 Å²	12	30.5 Å²	30.5	12%	0.124	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	11.9	179	0	0	0	0	0	114.9	R62 Y63 Q64 Y175 K214	R62-G216 CarbonylContact C-O 3.47Å; Y63-G216 WeakPolarHBondContact CA-O 3.2Å; Y63-G216 PolarHBondContact N-O 2.77Å; Q64-G216 PolarHBondContact N-O 2.83Å; Y175-G216 PolarHBondContact O-N 2.94Å; K214-G216 PolarHBondContact O-N 3.4Å
217	T	98.5	Very high	94.4	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.8	169.9	-50.2	0	0	0	0	110.5	I60 Q61 R62 Y174 Y175 W212 K214 S215 V219	I60-T217 HydrophobicContact CG2-CG2 3.41Å; I60-T217 VanDerWaalsContact CG2-CG2 3.41Å; Q61-T217 CarbonylContact O-C 3.52Å; Q61-T217 VanDerWaalsContact O-CA 3.31Å; Q61-T217 WeakPolarHBondContact O-CA 3.33Å; R62-T217 VanDerWaalsContact CD-OG1 3.25Å; R62-T217 WeakPolarHBondContact CD-OG1 3.01Å; R62-T217 PolarHBondContact NH1-OG1 2.91Å; Y174-T217 WeakPolarHBondContact CD2-O 3.41Å; Y175-T217 HydrophobicContact CD2-CG2 4.32Å; Y175-T217 HydrophobicContact CE2-CG2 4.25Å; Y175-T217 PolarHBondContact N-O 3.4Å; Y175-T217 VanDerWaalsContact N-O 3.09Å; W212-T217 VanDerWaalsContact O-CB 3.31Å; W212-T217 WeakPolarHBondContact O-CB 3.48Å; W212-T217 WeakPolarHBondContact O-CG2 3.45Å; W212-T217 PolarHBondContact O-OG1 2.9Å; K214-T217 WeakPolarHBondContact O-CB 3.12Å; K214-T217 PolarHBondContact O-N 2.81Å; K214-T217 PolarHBondContact O-OG1 2.88Å; K214-T217 VanDerWaalsContact O-OG1 3.07Å; S215-T217 VanDerWaalsContact C-N 3.32Å; S215-T217 PolarHBondContact O-N 3.23Å; T217-V219 HydrophobicContact CG2-CG2 4.32Å
218	L	98.4	Very high	94.1	Very high	19 Å²	19	31.4 Å²	31.4	10%	0.099	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.8	167.6	-178.6	64.7	0	0	0	109.2	I60 Q61 Q64 P67 Y174 E220	I60-L218 WeakPolarHBondContact CA-O 3.35Å; Q61-L218 PolarHBondContact N-O 3.13Å; Q61-L218 PolarHBondContact O-N 2.87Å; Q64-L218 HydrophobicContact CB-CB 3.97Å; Q64-L218 HydrophobicContact CG-CB 3.85Å; P67-L218 HydrophobicContact CG-CD1 4.36Å; Y174-L218 HydrophobicContact CD2-CB 4.1Å; Y174-L218 HydrophobicContact CD2-CD1 4.1Å; L218-E220 HydrophobicContact CD2-CG 4.12Å; L218-E220 HydrophobicContact CG-CG 4.02Å
219	V	98.5	Very high	93.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.8	171	-176.9	0	0	0	0	108.4	M58 R59 I60 S172 L173 Y175 V208 T217 F221	M58-V219 HydrophobicContact CG-CG1 3.91Å; M58-V219 HydrophobicContact SD-CG1 4.16Å; R59-V219 CarbonylContact O-C 3.6Å; R59-V219 VanDerWaalsContact O-CA 3.29Å; R59-V219 WeakPolarHBondContact O-CA 3.46Å; I60-V219 HydrophobicContact CG1-CG1 4.26Å; I60-V219 HydrophobicContact CG1-CG2 4.21Å; I60-V219 HydrophobicContact CG2-CG2 4.24Å; S172-V219 CarbonylContact C-O 3.5Å; S172-V219 VanDerWaalsContact CA-O 3.27Å; S172-V219 WeakPolarHBondContact CA-O 3.33Å; L173-V219 HydrophobicContact CB-CB 4.24Å; L173-V219 PolarHBondContact N-O 3.29Å; L173-V219 PolarHBondContact O-N 2.67Å; Y175-V219 HydrophobicContact CE2-CG2 3.99Å; V208-V219 HydrophobicContact CG1-CG2 3.85Å; V208-V219 HydrophobicContact CG2-CB 4.46Å; V208-V219 HydrophobicContact CG2-CG1 3.88Å; V208-V219 HydrophobicContact CG2-CG2 4.19Å; T217-V219 HydrophobicContact CG2-CG2 4.32Å; V219-F221 HydrophobicContact CG1-CD2 4.37Å; V219-F221 HydrophobicContact CG1-CE1 4.49Å; V219-F221 HydrophobicContact CG1-CE2 3.73Å; V219-F221 HydrophobicContact CG1-CZ 3.82Å
220	E	97.6	Very high	93	Very high	19 Å²	19	38.5 Å²	38.5	9%	0.089	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.5	177.6	-59.5	-177.2	118.1	0	0	110.2	M58 R59 K170 M171 L218	M58-E220 CarbonylContact C-O 3.4Å; M58-E220 WeakPolarHBondContact CA-O 3.35Å; R59-E220 HydrophobicContact CB-CB 4.43Å; R59-E220 PolarHBondContact N-O 3.37Å; R59-E220 IonicContact NH1-OE2 3.61Å; R59-E220 PolarHBondContact NH1-OE2 3.05Å; R59-E220 PolarHBondContact O-N 3.09Å; K170-E220 HydrophobicContact CD-CB 4.28Å; K170-E220 HydrophobicContact CD-CG 4.44Å; K170-E220 WeakPolarHBondContact CE-OE1 3.47Å; K170-E220 IonicContact NZ-OE1 3.35Å; K170-E220 PolarHBondContact NZ-OE1 3.3Å; M171-E220 CarbonylContact O-C 3.55Å; M171-E220 WeakPolarHBondContact O-CA 3.46Å; L218-E220 HydrophobicContact CD2-CG 4.12Å; L218-E220 HydrophobicContact CG-CG 4.02Å
221	F	96.8	Very high	92.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.2	169.6	-58.9	-82.9	0	0	0	109	Y56 S57 M58 K170 M171 L173 I191 I206 V208 V219	Y56-F221 HydrophobicContact CD1-CB 4.27Å; S57-F221 WeakPolarHBondContact O-CA 3.5Å; M58-F221 HydrophobicContact CB-CD1 4.08Å; M58-F221 HydrophobicContact CB-CE1 4.01Å; M58-F221 HydrophobicContact CG-CD1 4.14Å; M58-F221 HydrophobicContact CG-CE1 3.72Å; M58-F221 HydrophobicContact CG-CZ 4.3Å; M58-F221 HydrophobicContact SD-CE1 3.73Å; M58-F221 HydrophobicContact SD-CZ 4.06Å; K170-F221 VanDerWaalsContact CA-O 3.31Å; K170-F221 WeakPolarHBondContact CA-O 3.45Å; K170-F221 WeakPolarHBondContact CG-O 3.46Å; M171-F221 HydrophobicContact CB-CB 4.35Å; M171-F221 HydrophobicContact CB-CD2 4.46Å; M171-F221 HydrophobicContact CE-CB 3.82Å; M171-F221 PolarHBondContact N-O 3.41Å; M171-F221 PolarHBondContact O-N 2.84Å; L173-F221 HydrophobicContact CD1-CE2 3.88Å; L173-F221 HydrophobicContact CG-CE2 4.15Å; I191-F221 HydrophobicContact CD1-CB 4.01Å; I191-F221 HydrophobicContact CD1-CD1 3.62Å; I191-F221 HydrophobicContact CD1-CD2 4.48Å; I191-F221 HydrophobicContact CD1-CE1 4.19Å; I191-F221 HydrophobicContact CD1-CG 3.78Å; I191-F221 HydrophobicContact CG1-CD1 3.98Å; I191-F221 HydrophobicContact CG1-CE1 4.03Å; I191-F221 HydrophobicContact CG1-CG 4.3Å; I191-F221 HydrophobicContact CG1-CZ 4.38Å; I191-F221 HydrophobicContact CG2-CD2 3.87Å; I191-F221 HydrophobicContact CG2-CE2 3.92Å; I191-F221 HydrophobicContact CG2-CG 4.24Å; I191-F221 HydrophobicContact CG2-CZ 4.33Å; I206-F221 HydrophobicContact CB-CE1 4.19Å; I206-F221 HydrophobicContact CG2-CD1 4.34Å; I206-F221 HydrophobicContact CG2-CE1 3.66Å; V208-F221 HydrophobicContact CG2-CE2 4.42Å; V208-F221 HydrophobicContact CG2-CZ 3.85Å; V219-F221 HydrophobicContact CG1-CD2 4.37Å; V219-F221 HydrophobicContact CG1-CE1 4.49Å; V219-F221 HydrophobicContact CG1-CE2 3.73Å; V219-F221 HydrophobicContact CG1-CZ 3.82Å
222	E	94.1	Very high	92.4	Very high	7 Å²	7	40.4 Å²	40.4	3%	0.033	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.3	175.8	-69.4	-180	-135.7	0	0	109.8	Y56 S57 R59 K170 I224 T264 K268	Y56-E222 CarbonylContact C-O 3.48Å; Y56-E222 VanDerWaalsContact CA-O 3.24Å; Y56-E222 WeakPolarHBondContact CA-O 3.21Å; S57-E222 PolarHBondContact N-O 2.92Å; S57-E222 PolarHBondContact O-N 3.29Å; S57-E222 PolarHBondContact OG-O 2.88Å; R59-E222 IonicContact CZ-OE1 3.73Å; R59-E222 IonicContact NH1-OE1 2.65Å; R59-E222 PolarHBondContact NH1-OE1 2.65Å; K170-E222 HydrophobicContact CB-CG 4.24Å; K170-E222 HydrophobicContact CD-CG 3.84Å; K170-E222 HydrophobicContact CG-CG 3.79Å; E222-I224 PolarHBondContact O-N 2.62Å; E222-T264 WeakPolarHBondContact OE1-CG2 3.12Å; E222-T264 PolarHBondContact OE2-OG1 3.24Å; E222-K268 WeakPolarHBondContact OE2-CE 3.06Å; E222-K268 IonicContact OE2-NZ 2.62Å; E222-K268 PolarHBondContact OE2-NZ 2.84Å
223	V	91.5	Very high	92.1	Very high	51 Å²	51	42.5 Å²	42.5	31%	0.309	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.1	175.9	179.2	0	0	0	0	109.6	N55 Y56	N55-V223 CarbonylContact O-C 3.49Å; N55-V223 WeakPolarHBondContact O-CA 3.28Å; Y56-V223 HydrophobicContact CD1-CG2 4.25Å; Y56-V223 HydrophobicContact CE1-CG2 3.6Å
224	I	87.9	Confident	91.9	Very high	16 Å²	16	44.9 Å²	44.9	8%	0.082	25%	0.247	C	C	.	.			trans	-97	130.5	165.2	-54.4	170.8	0	0	0	106.4	L52 N55 Y56 E222 I257 E258	L52-I224 HydrophobicContact CB-CD1 4.26Å; L52-I224 HydrophobicContact CD2-CD1 3.75Å; N55-I224 PolarHBondContact O-N 3.38Å; Y56-I224 WeakPolarHBondContact O-CD1 3.27Å; E222-I224 PolarHBondContact O-N 2.62Å; I224-I257 HydrophobicContact CG2-CB 4.14Å; I224-I257 HydrophobicContact CG2-CG2 4.18Å; I224-E258 WeakPolarHBondContact CG2-OE2 3Å
225	G	83.7	Confident	91.7	Very high	29 Å²	29	46.3 Å²	46.3	30%	0.299	26%	0.255	S	S	.	.			trans	-70.3	-176.9	173.5	0	0	0	0	0	111.6	E258	G225-E258 VanDerWaalsContact CA-OE1 3.28Å; G225-E258 WeakPolarHBondContact CA-OE1 3.4Å; G225-E258 WeakPolarHBondContact CA-OE2 3.44Å; G225-E258 PolarHBondContact N-OE2 2.75Å
226	K	82.2	Confident	91.5	Very high	80 Å²	80	51.5 Å²	51.5	35%	0.348	27%	0.268	S	S	.	.	S	Bend	trans	-114.7	-4.7	-178.2	-61.5	-172.6	176.6	-169.3	0	113.9	N27 N55 S229 E258	N27-K226 PolarHBondContact OD1-NZ 3.44Å; N55-K226 WeakPolarHBondContact OD1-CE 3.07Å; K226-S229 VanDerWaalsContact C-OG 3.29Å; K226-S229 WeakPolarHBondContact CA-OG 3.39Å; K226-S229 PolarHBondContact O-OG 2.77Å; K226-E258 PolarHBondContact N-OE1 3.02Å
227	I	83.4	Confident	91.3	Very high	94 Å²	94	51 Å²	51	48%	0.482	26%	0.263	S	S	.	.	S	Bend	trans	-81.9	-47.5	-173.9	-54.8	175	0	0	0	109.4	S229 Q230 Y231 M245 E258	I227-S229 VanDerWaalsContact C-N 3.34Å; I227-Q230 VanDerWaalsContact O-CD 3.27Å; I227-Q230 WeakPolarHBondContact O-CG 3.42Å; I227-Q230 PolarHBondContact O-NE2 2.87Å; I227-Y231 WeakPolarHBondContact O-CE2 3.44Å; I227-M245 HydrophobicContact CB-CE 4.23Å; I227-M245 HydrophobicContact CB-SD 3.46Å; I227-M245 WeakPolarHBondContact CB-SD 3.42Å; I227-M245 HydrophobicContact CD1-SD 3.88Å; I227-M245 HydrophobicContact CG1-SD 4.24Å; I227-M245 HydrophobicContact CG2-CE 3.54Å; I227-M245 HydrophobicContact CG2-SD 3.45Å; I227-M245 WeakPolarHBondContact CG2-SD 3.43Å; I227-E258 WeakPolarHBondContact CA-OE1 2.95Å; I227-E258 PolarHBondContact N-OE1 3.01Å
228	C	89.1	Confident	90.9	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-68.1	-36.6	177.4	-65.7	0	0	0	0	111	Q230 Y231 C247 C256 E258	C228-Q230 PolarHBondContact O-N 3.39Å; C228-Y231 VanDerWaalsContact O-CD2 3.26Å; C228-Y231 WeakPolarHBondContact O-CD2 3.1Å; C228-Y231 PolarHBondContact O-N 2.95Å; C228-C247 HydrophobicContact CB-CB 3.88Å; C228-C247 WeakPolarHBondContact CB-SG 3.12Å; C228-C247 WeakPolarHBondContact SG-CA 3.43Å; C228-C247 WeakPolarHBondContact SG-CB 3.37Å; C228-C247 CovalentContact SG-SG 2.03Å; C228-C247 PolarHBondContact SG-SG 3.1Å; C228-C256 CarbonylContact C-O 3.56Å; C228-C256 WeakPolarHBondContact O-CB 3.32Å; C228-C256 PolarHBondContact O-SG 3.44Å; C228-E258 HydrophobicContact CB-CG 4.04Å; C228-E258 PolarHBondContact N-OE1 3.4Å; C228-E258 VanDerWaalsContact SG-CG 3.53Å
229	S	86.5	Confident	90.6	Very high	70 Å²	70	60.9 Å²	60.9	49%	0.49	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-61.8	-15.4	-177.8	64.4	0	0	0	0	114.7	K226 I227 Y231 C256	K226-S229 VanDerWaalsContact C-OG 3.29Å; K226-S229 WeakPolarHBondContact CA-OG 3.39Å; K226-S229 PolarHBondContact O-OG 2.77Å; I227-S229 VanDerWaalsContact C-N 3.34Å; S229-Y231 VanDerWaalsContact C-N 3.28Å; S229-C256 VanDerWaalsContact CA-O 3.3Å; S229-C256 WeakPolarHBondContact CA-O 3.37Å; S229-C256 PolarHBondContact N-O 2.8Å
230	Q	85.3	Confident	90.3	Very high	122 Å²	122	61.5 Å²	61.5	57%	0.57	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-73.8	-19	175.2	83.9	-165.3	-38.2	0	0	113.1	I227 C228	I227-Q230 VanDerWaalsContact O-CD 3.27Å; I227-Q230 WeakPolarHBondContact O-CG 3.42Å; I227-Q230 PolarHBondContact O-NE2 2.87Å; C228-Q230 PolarHBondContact O-N 3.39Å
231	Y	89.3	Confident	89.9	Confident	66 Å²	66	63.6 Å²	63.6	26%	0.259	33%	0.331	S	S	.	.			trans	-88.9	117.4	-179.2	-55.2	-71	0	0	0	110.2	I227 C228 S229 R236 A240 C256	I227-Y231 WeakPolarHBondContact O-CE2 3.44Å; C228-Y231 VanDerWaalsContact O-CD2 3.26Å; C228-Y231 WeakPolarHBondContact O-CD2 3.1Å; C228-Y231 PolarHBondContact O-N 2.95Å; S229-Y231 VanDerWaalsContact C-N 3.28Å; Y231-R236 HydrophobicContact CD1-CB 3.94Å; Y231-R236 HydrophobicContact CG-CB 4.36Å; Y231-A240 HydrophobicContact CD1-CB 4.44Å; Y231-A240 HydrophobicContact CD2-CB 3.53Å; Y231-A240 HydrophobicContact CE1-CB 4.04Å; Y231-A240 HydrophobicContact CE2-CB 3.08Å; Y231-A240 HydrophobicContact CG-CB 4.2Å; Y231-C256 WeakPolarHBondContact O-CB 3.18Å
232	N	89.6	Confident	89.5	Confident	107 Å²	107	67.3 Å²	67.3	57%	0.572	35%	0.354	S	S	*	.			trans	-99	9.4	-174.2	65.1	-15.9	0	0	0	114.1	W249	N232-W249 WeakPolarHBondContact O-CH2 3.46Å
233	T	91.7	Very high	89	Confident	52 Å²	52	72.6 Å²	72.6	32%	0.319	39%	0.392	S	S	.	.	S	Bend	trans	-134.8	149.4	174.6	69.9	0	0	0	0	110.5	E235 R236 C237 W249	T233-E235 VanDerWaalsContact C-N 3.32Å; T233-E235 PolarHBondContact O-N 2.56Å; T233-R236 PolarHBondContact O-N 2.98Å; T233-R236 WeakPolarHBondContact OG1-CB 3.46Å; T233-R236 VanDerWaalsContact OG1-CG 3.31Å; T233-R236 WeakPolarHBondContact OG1-CG 3.09Å; T233-R236 PolarHBondContact OG1-N 3.15Å; T233-C237 VanDerWaalsContact O-CB 3.25Å; T233-C237 WeakPolarHBondContact O-CB 3.29Å; T233-C237 PolarHBondContact O-N 3.35Å; T233-W249 VanDerWaalsContact C-CZ3 3.49Å
234	S	92.5	Very high	88.6	Confident	53 Å²	53	76.9 Å²	76.9	37%	0.371	41%	0.413	S	S	.	.	H	α-helix	trans	-56.4	-45.4	178.6	56.6	0	0	0	0	112.4	C237 Q238 W249	S234-C237 WeakPolarHBondContact O-CB 3.46Å; S234-C237 PolarHBondContact O-N 3.39Å; S234-Q238 WeakPolarHBondContact O-CB 3.07Å; S234-Q238 VanDerWaalsContact O-CG 3.29Å; S234-Q238 WeakPolarHBondContact O-CG 3.15Å; S234-Q238 PolarHBondContact O-N 2.84Å; S234-W249 VanDerWaalsContact CA-CD2 3.46Å
235	E	93.1	Very high	88.6	Confident	131 Å²	131	77 Å²	77	61%	0.612	41%	0.414	S	S	*	.	H	α-helix	trans	-59.9	-50.5	179	-175.8	-174	-177.9	0	0	111.8	T233 C237 Q238 N239	T233-E235 VanDerWaalsContact C-N 3.32Å; T233-E235 PolarHBondContact O-N 2.56Å; E235-C237 VanDerWaalsContact C-N 3.33Å; E235-C237 PolarHBondContact O-N 2.83Å; E235-Q238 PolarHBondContact O-N 3.35Å; E235-N239 VanDerWaalsContact O-CB 3.3Å; E235-N239 WeakPolarHBondContact O-CB 3.28Å; E235-N239 PolarHBondContact O-N 3.15Å; E235-N239 PolarHBondContact O-ND2 2.82Å
236	R	94.2	Very high	88.9	Confident	154 Å²	154	77.7 Å²	77.7	58%	0.581	41%	0.412	S	S	*	.	H	α-helix	trans	-65.7	-39	179.4	-71.6	-179.5	176.6	-175.5	-1.2	111.6	Y231 T233 N239 A240	Y231-R236 HydrophobicContact CD1-CB 3.94Å; Y231-R236 HydrophobicContact CG-CB 4.36Å; T233-R236 PolarHBondContact O-N 2.98Å; T233-R236 WeakPolarHBondContact OG1-CB 3.46Å; T233-R236 VanDerWaalsContact OG1-CG 3.31Å; T233-R236 WeakPolarHBondContact OG1-CG 3.09Å; T233-R236 PolarHBondContact OG1-N 3.15Å; R236-N239 PolarHBondContact O-N 2.9Å; R236-A240 WeakPolarHBondContact O-CB 3.21Å; R236-A240 PolarHBondContact O-N 2.8Å
237	C	93.5	Very high	89.4	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-59.5	-51.6	176.3	179.2	0	0	0	0	111.4	T233 S234 E235 N239 A240 C247 I248 W249 C256	T233-C237 VanDerWaalsContact O-CB 3.25Å; T233-C237 WeakPolarHBondContact O-CB 3.29Å; T233-C237 PolarHBondContact O-N 3.35Å; S234-C237 WeakPolarHBondContact O-CB 3.46Å; S234-C237 PolarHBondContact O-N 3.39Å; E235-C237 VanDerWaalsContact C-N 3.33Å; E235-C237 PolarHBondContact O-N 2.83Å; C237-N239 PolarHBondContact O-N 3.39Å; C237-A240 WeakPolarHBondContact O-CB 3.42Å; C237-A240 PolarHBondContact O-N 3.1Å; C237-C247 WeakPolarHBondContact O-CB 3.38Å; C237-I248 PolarHBondContact SG-O 2.04Å; C237-W249 HydrophobicContact CB-CB 4.4Å; C237-W249 HydrophobicContact CB-CD2 4.47Å; C237-W249 HydrophobicContact CB-CE3 3.62Å; C237-W249 HydrophobicContact CB-CZ3 4.31Å; C237-C256 WeakPolarHBondContact CA-SG 3.32Å; C237-C256 HydrophobicContact CB-CB 3.61Å; C237-C256 WeakPolarHBondContact CB-SG 3.3Å; C237-C256 WeakPolarHBondContact SG-CB 3.13Å; C237-C256 CovalentContact SG-SG 2.02Å; C237-C256 PolarHBondContact SG-SG 2.69Å
238	Q	90.3	Very high	89.8	Confident	107 Å²	107	70.2 Å²	70.2	50%	0.5	38%	0.377	S	S	.	.	H	α-helix	trans	-63.7	-42.9	-179.5	-70.7	174.6	-0.3	0	0	111.5	S234 E235 A240 T241	S234-Q238 WeakPolarHBondContact O-CB 3.07Å; S234-Q238 VanDerWaalsContact O-CG 3.29Å; S234-Q238 WeakPolarHBondContact O-CG 3.15Å; S234-Q238 PolarHBondContact O-N 2.84Å; E235-Q238 PolarHBondContact O-N 3.35Å; Q238-A240 PolarHBondContact O-N 3.11Å; Q238-T241 PolarHBondContact O-N 2.03Å; Q238-T241 PolarHBondContact O-OG1 2.89Å
239	N	92.4	Very high	90	Very high	121 Å²	121	71.3 Å²	71.3	65%	0.647	38%	0.382	S	S	*	.	H	α-helix	trans	-69.7	-15.5	179.1	-70.5	-17.7	0	0	0	114	E235 R236 C237 T241	E235-N239 VanDerWaalsContact O-CB 3.3Å; E235-N239 WeakPolarHBondContact O-CB 3.28Å; E235-N239 PolarHBondContact O-N 3.15Å; E235-N239 PolarHBondContact O-ND2 2.82Å; R236-N239 PolarHBondContact O-N 2.9Å; C237-N239 PolarHBondContact O-N 3.39Å; N239-T241 VanDerWaalsContact C-N 3.26Å; N239-T241 PolarHBondContact O-N 2.76Å
240	A	91.2	Very high	90.3	Very high	12 Å²	12	68 Å²	68	10%	0.099	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.2	178.1	0	0	0	0	0	114.1	Y231 R236 C237 Q238 T242 M245	Y231-A240 HydrophobicContact CD1-CB 4.44Å; Y231-A240 HydrophobicContact CD2-CB 3.53Å; Y231-A240 HydrophobicContact CE1-CB 4.04Å; Y231-A240 HydrophobicContact CE2-CB 3.08Å; Y231-A240 HydrophobicContact CG-CB 4.2Å; R236-A240 WeakPolarHBondContact O-CB 3.21Å; R236-A240 PolarHBondContact O-N 2.8Å; C237-A240 WeakPolarHBondContact O-CB 3.42Å; C237-A240 PolarHBondContact O-N 3.1Å; Q238-A240 PolarHBondContact O-N 3.11Å; A240-T242 PolarHBondContact O-N 3.25Å; A240-M245 WeakPolarHBondContact O-CE 3.35Å
241	T	89	Confident	90.5	Very high	63 Å²	63	68.2 Å²	68.2	39%	0.387	36%	0.359	S	S	.	.			trans	-62.4	129.5	176.4	-65.4	0	0	0	0	110.5	Q238 N239 M245 T246 C247	Q238-T241 PolarHBondContact O-N 2.03Å; Q238-T241 PolarHBondContact O-OG1 2.89Å; N239-T241 VanDerWaalsContact C-N 3.26Å; N239-T241 PolarHBondContact O-N 2.76Å; T241-M245 CarbonylContact C-O 3.5Å; T241-M245 WeakPolarHBondContact CA-O 3.1Å; T241-T246 HydrophobicContact CG2-CG2 4.18Å; T241-C247 PolarHBondContact OG1-N 2.89Å; T241-C247 VanDerWaalsContact OG1-N 3.1Å
242	T	88.2	Confident	90.4	Very high	78 Å²	78	71.4 Å²	71.4	48%	0.479	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-124	177.8	178	66	0	0	0	0	110.2	A240 N244 M245	A240-T242 PolarHBondContact O-N 3.25Å; T242-N244 PolarHBondContact O-N 2.87Å; T242-N244 VanDerWaalsContact O-N 3.15Å; T242-M245 PolarHBondContact N-O 3.3Å; T242-M245 PolarHBondContact O-N 3.45Å; T242-M245 VanDerWaalsContact O-O 3.07Å; T242-M245 PolarHBondContact OG1-N 3.28Å
243	S	83.9	Confident	90.2	Very high	118 Å²	118	66.7 Å²	66.7	83%	0.825	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.5	176.9	61.7	0	0	0	0	114.2
244	N	82.9	Confident	90.1	Very high	142 Å²	142	69.7 Å²	69.7	76%	0.759	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-4	-173.7	-63.2	-0.4	0	0	0	112.9	T242	T242-N244 PolarHBondContact O-N 2.87Å; T242-N244 VanDerWaalsContact O-N 3.15Å
245	M	88.5	Confident	90	Very high	18 Å²	18	68 Å²	68	9%	0.089	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-151.3	125.8	-174.9	178.5	-173.3	70	0	0	110.5	I227 A240 T241 T242 E258 N260	I227-M245 HydrophobicContact CB-CE 4.23Å; I227-M245 HydrophobicContact CB-SD 3.46Å; I227-M245 WeakPolarHBondContact CB-SD 3.42Å; I227-M245 HydrophobicContact CD1-SD 3.88Å; I227-M245 HydrophobicContact CG1-SD 4.24Å; I227-M245 HydrophobicContact CG2-CE 3.54Å; I227-M245 HydrophobicContact CG2-SD 3.45Å; I227-M245 WeakPolarHBondContact CG2-SD 3.43Å; A240-M245 WeakPolarHBondContact O-CE 3.35Å; T241-M245 CarbonylContact C-O 3.5Å; T241-M245 WeakPolarHBondContact CA-O 3.1Å; T242-M245 PolarHBondContact N-O 3.3Å; T242-M245 PolarHBondContact O-N 3.45Å; T242-M245 VanDerWaalsContact O-O 3.07Å; T242-M245 PolarHBondContact OG1-N 3.28Å; M245-E258 HydrophobicContact CG-CG 4.2Å; M245-E258 HydrophobicContact SD-CG 4.25Å; M245-N260 WeakPolarHBondContact CA-OD1 3.4Å; M245-N260 WeakPolarHBondContact CG-OD1 3.45Å
246	T	91	Very high	89.9	Confident	44 Å²	44	61.9 Å²	61.9	27%	0.27	33%	0.326	S	S	.	.			trans	-107.1	126.9	175.2	-54.4	0	0	0	0	109.3	T241 E258 S259 N260 H265	T241-T246 HydrophobicContact CG2-CG2 4.18Å; T246-E258 CarbonylContact O-C 3.48Å; T246-E258 WeakPolarHBondContact O-CA 3.48Å; T246-S259 PolarHBondContact O-N 3.34Å; T246-N260 PolarHBondContact N-OD1 2.99Å; T246-H265 VanDerWaalsContact CG2-CE1 3.47Å; T246-H265 WeakPolarHBondContact CG2-CE1 3.24Å
247	C	92	Very high	89.7	Confident	7 Å²	7	54.7 Å²	54.7	5%	0.047	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.7	175.5	-65.2	0	0	0	0	110.3	C228 C237 T241 I257	C228-C247 HydrophobicContact CB-CB 3.88Å; C228-C247 WeakPolarHBondContact CB-SG 3.12Å; C228-C247 WeakPolarHBondContact SG-CA 3.43Å; C228-C247 WeakPolarHBondContact SG-CB 3.37Å; C228-C247 CovalentContact SG-SG 2.03Å; C228-C247 PolarHBondContact SG-SG 3.1Å; C237-C247 WeakPolarHBondContact O-CB 3.38Å; T241-C247 PolarHBondContact OG1-N 2.89Å; T241-C247 VanDerWaalsContact OG1-N 3.1Å; C247-I257 WeakPolarHBondContact CA-O 3.3Å
248	I	92.3	Very high	89.6	Confident	9 Å²	9	55 Å²	55	5%	0.046	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.1	175.1	-55.6	172.6	0	0	0	108.8	C237 C256 I257 S259 K268 V269 C272	C237-I248 PolarHBondContact SG-O 2.04Å; I248-C256 WeakPolarHBondContact O-CA 3.41Å; I248-I257 HydrophobicContact CB-CG1 4.33Å; I248-I257 PolarHBondContact N-O 2.76Å; I248-I257 PolarHBondContact O-N 2.85Å; I248-S259 WeakPolarHBondContact CD1-OG 3.25Å; I248-K268 HydrophobicContact CD1-CB 4.04Å; I248-V269 HydrophobicContact CD1-CB 4.3Å; I248-V269 HydrophobicContact CD1-CG2 3.38Å; I248-V269 HydrophobicContact CG1-CG2 4.15Å; I248-C272 HydrophobicContact CG2-CB 4.05Å
249	W	93.2	Very high	89.5	Confident	24 Å²	24	50 Å²	50	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.3	171.7	-172.7	-106.1	0	0	0	111.1	N232 T233 S234 C237 N254 C256	N232-W249 WeakPolarHBondContact O-CH2 3.46Å; T233-W249 VanDerWaalsContact C-CZ3 3.49Å; S234-W249 VanDerWaalsContact CA-CD2 3.46Å; C237-W249 HydrophobicContact CB-CB 4.4Å; C237-W249 HydrophobicContact CB-CD2 4.47Å; C237-W249 HydrophobicContact CB-CE3 3.62Å; C237-W249 HydrophobicContact CB-CZ3 4.31Å; W249-N254 WeakPolarHBondContact CZ2-OD1 3.33Å; W249-C256 HydrophobicContact CE3-CB 3.83Å; W249-C256 HydrophobicContact CZ3-CB 4Å
250	C	92.1	Very high	88.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	101.9	174.4	-50.7	0	0	0	0	109.1	I42 K252 G253 N254 A255 I257 C272	I42-C250 HydrophobicContact CD1-CB 4.01Å; C250-K252 PolarHBondContact O-N 2.84Å; C250-G253 CarbonylContact O-C 3.57Å; C250-G253 PolarHBondContact O-N 3.33Å; C250-G253 VanDerWaalsContact O-N 3.13Å; C250-N254 PolarHBondContact O-N 3.24Å; C250-A255 PolarHBondContact N-O 3.38Å; C250-A255 PolarHBondContact O-N 2.8Å; C250-I257 VanDerWaalsContact SG-CD1 3.54Å; C250-C272 HydrophobicContact CB-CB 3.6Å; C250-C272 WeakPolarHBondContact CB-SG 3.05Å; C250-C272 WeakPolarHBondContact SG-CB 3.32Å; C250-C272 CovalentContact SG-SG 2.04Å; C250-C272 PolarHBondContact SG-SG 2.86Å
251	E	90.2	Very high	88.5	Confident	127 Å²	127	49.3 Å²	49.3	59%	0.593	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-51.7	-167.5	-68.3	-176.7	178.4	0	0	112.3	G253 N254 C272	E251-G253 PolarHBondContact O-N 3.47Å; E251-N254 PolarHBondContact O-N 2.81Å; E251-N254 VanDerWaalsContact O-N 3.08Å; E251-C272 PolarHBondContact N-O 2.84Å
252	K	86.9	Confident	88	Confident	132 Å²	132	54.7 Å²	54.7	57%	0.574	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-28.4	179.4	178.6	158.4	155.1	-152	0	113.1	V41 I42 C250	V41-K252 WeakPolarHBondContact O-CE 3.27Å; I42-K252 WeakPolarHBondContact O-CD 3.26Å; I42-K252 WeakPolarHBondContact O-CE 3.48Å; I42-K252 PolarHBondContact O-NZ 2.86Å; C250-K252 PolarHBondContact O-N 2.84Å
253	G	84.6	Confident	87.6	Confident	9 Å²	9	58.1 Å²	58.1	9%	0.093	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-9.9	177.2	0	0	0	0	0	114.8	C250 E251 A255	C250-G253 CarbonylContact O-C 3.57Å; C250-G253 PolarHBondContact O-N 3.33Å; C250-G253 VanDerWaalsContact O-N 3.13Å; E251-G253 PolarHBondContact O-N 3.47Å; G253-A255 PolarHBondContact O-N 3.3Å
254	N	89.4	Confident	87.5	Confident	115 Å²	115	52.9 Å²	52.9	62%	0.615	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	40.5	-169.6	-167.1	42.9	0	0	0	112.2	W249 C250 E251	W249-N254 WeakPolarHBondContact CZ2-OD1 3.33Å; C250-N254 PolarHBondContact O-N 3.24Å; E251-N254 PolarHBondContact O-N 2.81Å; E251-N254 VanDerWaalsContact O-N 3.08Å
255	A	90.2	Very high	87.6	Confident	16 Å²	16	49.1 Å²	49.1	13%	0.132	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.3	-169.5	0	0	0	0	0	111.1	L52 C250 G253	L52-A255 HydrophobicContact CD1-CB 4Å; C250-A255 PolarHBondContact N-O 3.38Å; C250-A255 PolarHBondContact O-N 2.8Å; G253-A255 PolarHBondContact O-N 3.3Å
256	C	91.3	Very high	87.4	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.02	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	128.7	173.9	-173.1	0	0	0	0	109.8	C228 S229 Y231 C237 I248 W249	C228-C256 CarbonylContact C-O 3.56Å; C228-C256 WeakPolarHBondContact O-CB 3.32Å; C228-C256 PolarHBondContact O-SG 3.44Å; S229-C256 VanDerWaalsContact CA-O 3.3Å; S229-C256 WeakPolarHBondContact CA-O 3.37Å; S229-C256 PolarHBondContact N-O 2.8Å; Y231-C256 WeakPolarHBondContact O-CB 3.18Å; C237-C256 WeakPolarHBondContact CA-SG 3.32Å; C237-C256 HydrophobicContact CB-CB 3.61Å; C237-C256 WeakPolarHBondContact CB-SG 3.3Å; C237-C256 WeakPolarHBondContact SG-CB 3.13Å; C237-C256 CovalentContact SG-SG 2.02Å; C237-C256 PolarHBondContact SG-SG 2.69Å; I248-C256 WeakPolarHBondContact O-CA 3.41Å; W249-C256 HydrophobicContact CE3-CB 3.83Å; W249-C256 HydrophobicContact CZ3-CB 4Å
257	I	91.3	Very high	87.1	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	148.3	-177.9	65.8	170.5	0	0	0	111.6	Y50 L52 I224 C247 I248 C250	Y50-I257 WeakPolarHBondContact OH-CD1 3.13Å; L52-I257 HydrophobicContact CD1-CG2 3.69Å; L52-I257 HydrophobicContact CD2-CD1 4.47Å; L52-I257 HydrophobicContact CD2-CG2 4.06Å; I224-I257 HydrophobicContact CG2-CB 4.14Å; I224-I257 HydrophobicContact CG2-CG2 4.18Å; C247-I257 WeakPolarHBondContact CA-O 3.3Å; I248-I257 HydrophobicContact CB-CG1 4.33Å; I248-I257 PolarHBondContact N-O 2.76Å; I248-I257 PolarHBondContact O-N 2.85Å; C250-I257 VanDerWaalsContact SG-CD1 3.54Å
258	E	90.6	Very high	86.8	Confident	7 Å²	7	51 Å²	51	3%	0.033	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	144.3	167.2	-67.7	75.9	-179.9	0	0	111.1	I224 G225 K226 I227 C228 M245 T246	I224-E258 WeakPolarHBondContact CG2-OE2 3Å; G225-E258 VanDerWaalsContact CA-OE1 3.28Å; G225-E258 WeakPolarHBondContact CA-OE1 3.4Å; G225-E258 WeakPolarHBondContact CA-OE2 3.44Å; G225-E258 PolarHBondContact N-OE2 2.75Å; K226-E258 PolarHBondContact N-OE1 3.02Å; I227-E258 WeakPolarHBondContact CA-OE1 2.95Å; I227-E258 PolarHBondContact N-OE1 3.01Å; C228-E258 HydrophobicContact CB-CG 4.04Å; C228-E258 PolarHBondContact N-OE1 3.4Å; C228-E258 VanDerWaalsContact SG-CG 3.53Å; M245-E258 HydrophobicContact CG-CG 4.2Å; M245-E258 HydrophobicContact SD-CG 4.25Å; T246-E258 CarbonylContact O-C 3.48Å; T246-E258 WeakPolarHBondContact O-CA 3.48Å
259	S	87.7	Confident	86.5	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.014	27%	0.271	C	S	.	.			trans	-139.3	56.5	177.4	-163.8	0	0	0	0	110.1	T246 I248 H265	T246-S259 PolarHBondContact O-N 3.34Å; I248-S259 WeakPolarHBondContact CD1-OG 3.25Å; S259-H265 WeakPolarHBondContact CB-ND1 3.35Å; S259-H265 PolarHBondContact O-ND1 3.46Å; S259-H265 WeakPolarHBondContact OG-CA 3.47Å; S259-H265 PolarHBondContact OG-ND1 3.5Å
260	N	81.2	Confident	86.3	Confident	82 Å²	82	58.5 Å²	58.5	44%	0.439	30%	0.301	S	S	.	.			trans	-82.3	-21.3	-172.6	-58.1	-19.7	0	0	0	112.7	M245 T246 Q262	M245-N260 WeakPolarHBondContact CA-OD1 3.4Å; M245-N260 WeakPolarHBondContact CG-OD1 3.45Å; T246-N260 PolarHBondContact N-OD1 2.99Å; N260-Q262 PolarHBondContact O-N 3.37Å
261	D	80.9	Confident	86	Confident	36 Å²	36	59 Å²	59	19%	0.193	30%	0.303	C	S	.	.			trans	-77.3	110.1	174.7	-173.1	-20.7	0	0	0	109.8	N168 N263 T264 H265	N168-D261 PolarHBondContact ND2-OD2 2.97Å; D261-N263 PolarHBondContact O-N 3.39Å; D261-N263 VanDerWaalsContact OD1-CB 3.28Å; D261-N263 WeakPolarHBondContact OD1-CB 3.47Å; D261-N263 PolarHBondContact OD1-N 3.26Å; D261-T264 PolarHBondContact O-N 3.09Å; D261-H265 WeakPolarHBondContact O-CB 3.09Å; D261-H265 PolarHBondContact O-N 3Å
262	Q	79.8	Confident	85.9	Confident	177 Å²	177	53 Å²	53	83%	0.827	28%	0.275	S	S	*	.	H	α-helix	trans	-60.4	-28.8	-179.8	-65.6	-173.9	-5.6	0	0	112.9	N260	N260-Q262 PolarHBondContact O-N 3.37Å
263	N	80.3	Confident	85.7	Confident	149 Å²	149	53.1 Å²	53.1	80%	0.797	27%	0.272	S	S	*	.	H	α-helix	trans	-73.5	-31.5	-179.9	-61.8	-44	0	0	0	111.9	D261	D261-N263 PolarHBondContact O-N 3.39Å; D261-N263 VanDerWaalsContact OD1-CB 3.28Å; D261-N263 WeakPolarHBondContact OD1-CB 3.47Å; D261-N263 PolarHBondContact OD1-N 3.26Å
264	T	81.6	Confident	84.7	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.055	28%	0.283	C	S	.	.	H	α-helix	trans	-104.5	-7.9	-178.6	73.2	0	0	0	0	113.1	E222 D261 G266 M267 K268	E222-T264 WeakPolarHBondContact OE1-CG2 3.12Å; E222-T264 PolarHBondContact OE2-OG1 3.24Å; D261-T264 PolarHBondContact O-N 3.09Å; T264-G266 PolarHBondContact O-N 2.98Å; T264-M267 PolarHBondContact O-N 3.41Å; T264-M267 VanDerWaalsContact O-N 3.14Å; T264-K268 PolarHBondContact O-N 3.19Å
265	H	83.3	Confident	83	Confident	63 Å²	63	57 Å²	57	29%	0.292	29%	0.287	S	S	.	.	H	α-helix	trans	-52.7	-56	-177.2	178.2	69.1	0	0	0	113.1	T246 S259 D261 M267 K268 V269	T246-H265 VanDerWaalsContact CG2-CE1 3.47Å; T246-H265 WeakPolarHBondContact CG2-CE1 3.24Å; S259-H265 WeakPolarHBondContact CB-ND1 3.35Å; S259-H265 PolarHBondContact O-ND1 3.46Å; S259-H265 WeakPolarHBondContact OG-CA 3.47Å; S259-H265 PolarHBondContact OG-ND1 3.5Å; D261-H265 WeakPolarHBondContact O-CB 3.09Å; D261-H265 PolarHBondContact O-N 3Å; H265-M267 PolarHBondContact O-N 2.91Å; H265-K268 PolarHBondContact O-N 3.04Å; H265-V269 WeakPolarHBondContact O-CG2 3.28Å; H265-V269 PolarHBondContact O-N 3.47Å
266	G	84.6	Confident	80.7	Confident	41 Å²	41	63.7 Å²	63.7	42%	0.423	32%	0.321	S	S	.	.	H	α-helix	trans	-61.4	-32.6	-178.3	0	0	0	0	0	113.3	T264 K270	T264-G266 PolarHBondContact O-N 2.98Å; G266-K270 WeakPolarHBondContact O-CG 3.09Å; G266-K270 PolarHBondContact O-N 2.02Å
267	M	84.9	Confident	78.2	Confident	62 Å²	62	68.8 Å²	68.8	31%	0.305	35%	0.352	S	S	.	.	H	α-helix	trans	-71.2	-47.1	175.2	-173.7	158.1	63.5	0	0	110.9	R59 T264 H265 V269 K270 D271	R59-M267 VanDerWaalsContact NE-CE 3.29Å; T264-M267 PolarHBondContact O-N 3.41Å; T264-M267 VanDerWaalsContact O-N 3.14Å; H265-M267 PolarHBondContact O-N 2.91Å; M267-V269 VanDerWaalsContact C-N 3.29Å; M267-V269 PolarHBondContact O-N 3.45Å; M267-K270 WeakPolarHBondContact O-CB 3.44Å; M267-K270 PolarHBondContact O-N 2.82Å; M267-D271 PolarHBondContact O-N 3.39Å
268	K	85.6	Confident	75.4	Confident	6 Å²	6	73.3 Å²	73.3	3%	0.026	38%	0.384	C	S	.	.	H	α-helix	trans	-58.2	-38.6	175.6	-73.5	-176.8	177.2	173.9	0	112.8	E222 I248 T264 H265 D271 C272	E222-K268 WeakPolarHBondContact OE2-CE 3.06Å; E222-K268 IonicContact OE2-NZ 2.62Å; E222-K268 PolarHBondContact OE2-NZ 2.84Å; I248-K268 HydrophobicContact CD1-CB 4.04Å; T264-K268 PolarHBondContact O-N 3.19Å; H265-K268 PolarHBondContact O-N 3.04Å; K268-D271 PolarHBondContact O-N 3.36Å; K268-C272 VanDerWaalsContact O-CB 3.32Å; K268-C272 WeakPolarHBondContact O-CB 3.33Å; K268-C272 PolarHBondContact O-N 3.08Å
269	V	87.7	Confident	72.6	Confident	24 Å²	24	78.9 Å²	78.9	15%	0.145	42%	0.419	C	S	.	.	H	α-helix	trans	-58.7	-48.8	173.9	174.3	0	0	0	0	110.6	I248 H265 M267 C272 R273	I248-V269 HydrophobicContact CD1-CB 4.3Å; I248-V269 HydrophobicContact CD1-CG2 3.38Å; I248-V269 HydrophobicContact CG1-CG2 4.15Å; H265-V269 WeakPolarHBondContact O-CG2 3.28Å; H265-V269 PolarHBondContact O-N 3.47Å; M267-V269 VanDerWaalsContact C-N 3.29Å; M267-V269 PolarHBondContact O-N 3.45Å; V269-C272 PolarHBondContact O-N 3.35Å; V269-R273 HydrophobicContact CG1-CG 4.34Å; V269-R273 WeakPolarHBondContact O-CB 3.43Å; V269-R273 WeakPolarHBondContact O-CG 3.06Å; V269-R273 PolarHBondContact O-N 2.91Å; V269-R273 VanDerWaalsContact O-N 3.09Å
270	K	87.3	Confident	70.2	Confident	166 Å²	166	87.7 Å²	87.7	72%	0.722	46%	0.46	S	S	*	.	H	α-helix	trans	-63.9	-43.4	178.7	-70.1	178.9	179.7	-173.4	0	111.9	G266 M267 C272 R273	G266-K270 WeakPolarHBondContact O-CG 3.09Å; G266-K270 PolarHBondContact O-N 2.02Å; M267-K270 WeakPolarHBondContact O-CB 3.44Å; M267-K270 PolarHBondContact O-N 2.82Å; K270-C272 PolarHBondContact O-N 3.25Å; K270-R273 PolarHBondContact O-N 3.31Å
271	D	87.1	Confident	67.8	Low	11 Å²	11	89.9 Å²	89.9	6%	0.059	48%	0.476	C	S	.	.	H	α-helix	trans	-57.3	-39.4	178.5	-64.9	-25.5	0	0	0	111.7	I42 Y48 Y50 R59 M267 K268 V274	I42-D271 WeakPolarHBondContact CG2-O 3.39Å; Y48-D271 WeakPolarHBondContact CE1-OD1 3.06Å; Y48-D271 VanDerWaalsContact CZ-OD1 3.29Å; Y48-D271 PolarHBondContact OH-OD1 3.18Å; Y48-D271 PolarHBondContact OH-OD2 3.46Å; Y48-D271 VanDerWaalsContact OH-OD2 3.06Å; Y50-D271 HydrophobicContact CD1-CB 3.66Å; Y50-D271 HydrophobicContact CE1-CB 3.98Å; Y50-D271 HydrophobicContact CG-CB 3.98Å; R59-D271 IonicContact CZ-OD2 3.57Å; R59-D271 IonicContact NE-OD2 3.44Å; R59-D271 PolarHBondContact NE-OD2 2.97Å; R59-D271 IonicContact NH2-OD2 2.77Å; R59-D271 PolarHBondContact NH2-OD2 3.13Å; M267-D271 PolarHBondContact O-N 3.39Å; K268-D271 PolarHBondContact O-N 3.36Å; D271-V274 WeakPolarHBondContact O-CG2 3.1Å
272	C	87.9	Confident	65.5	Low	1 Å²	1	94.2 Å²	94.2	1%	0.007	50%	0.504	C	S	.	.	H	α-helix	trans	-89.2	-18.6	-174.2	-78.8	0	0	0	0	115.3	I248 C250 E251 K268 V269 K270	I248-C272 HydrophobicContact CG2-CB 4.05Å; C250-C272 HydrophobicContact CB-CB 3.6Å; C250-C272 WeakPolarHBondContact CB-SG 3.05Å; C250-C272 WeakPolarHBondContact SG-CB 3.32Å; C250-C272 CovalentContact SG-SG 2.04Å; C250-C272 PolarHBondContact SG-SG 2.86Å; E251-C272 PolarHBondContact N-O 2.84Å; K268-C272 VanDerWaalsContact O-CB 3.32Å; K268-C272 WeakPolarHBondContact O-CB 3.33Å; K268-C272 PolarHBondContact O-N 3.08Å; V269-C272 PolarHBondContact O-N 3.35Å; K270-C272 PolarHBondContact O-N 3.25Å
273	R	81.7	Confident	63.4	Low	134 Å²	134	93.6 Å²	93.6	51%	0.506	50%	0.501	S	S	.	.	H	α-helix	trans	-94.8	-1.2	-176	-76.8	-172.6	-178.4	174.5	2	115.7	V269 K270 E275	V269-R273 HydrophobicContact CG1-CG 4.34Å; V269-R273 WeakPolarHBondContact O-CB 3.43Å; V269-R273 WeakPolarHBondContact O-CG 3.06Å; V269-R273 PolarHBondContact O-N 2.91Å; V269-R273 VanDerWaalsContact O-N 3.09Å; K270-R273 PolarHBondContact O-N 3.31Å; R273-E275 VanDerWaalsContact C-N 3.32Å; R273-E275 PolarHBondContact O-N 3.11Å
274	V	64.9	Low	61.1	Low	51 Å²	51	95.5 Å²	95.5	31%	0.309	51%	0.506	S	S	.	.			trans	-0.8	80.1	-178.1	-170.1	0	0	0	0	112.9	I42 I43 D271 N276	I42-V274 HydrophobicContact CG2-CG2 4.45Å; I43-V274 HydrophobicContact CB-CG2 4.1Å; I43-V274 HydrophobicContact CD1-CG1 4.43Å; I43-V274 HydrophobicContact CD1-CG2 4.22Å; D271-V274 WeakPolarHBondContact O-CG2 3.1Å; V274-N276 PolarHBondContact O-N 3.41Å
275	E	53.6	Low	59.1	Low	153 Å²	153	101.5 Å²	101.5	72%	0.715	54%	0.537	S	S	*	.			trans	-68.7	129.3	174.5	-73.8	-179.8	-178.9	0	0	106.6	R273 T277	R273-E275 VanDerWaalsContact C-N 3.32Å; R273-E275 PolarHBondContact O-N 3.11Å; E275-T277 PolarHBondContact O-N 3.43Å; E275-T277 PolarHBondContact O-OG1 3.42Å
276	N	42.2	Very low	56.7	Low	158 Å²	158	107.9 Å²	107.9	85%	0.845	56%	0.564	S	S	*	*			trans	-66.4	74.8	171.2	-76.5	-28.8	0	0	0	109.2	V274 S278	V274-N276 PolarHBondContact O-N 3.41Å; N276-S278 VanDerWaalsContact C-N 3.32Å; N276-S278 PolarHBondContact O-N 3.25Å
277	T	37	Very low	54.6	Low	109 Å²	109	111.9 Å²	111.9	67%	0.669	58%	0.583	S	S	*	*			trans	-85.3	80.2	177.1	-38.7	0	0	0	0	109.4	E275	E275-T277 PolarHBondContact O-N 3.43Å; E275-T277 PolarHBondContact O-OG1 3.42Å
278	S	33.7	Very low	52.5	Low	98 Å²	98	116.7 Å²	116.7	69%	0.685	60%	0.604	S	S	*	*			trans	-64.4	123.7	145.5	49.9	0	0	0	0	108.1	N276	N276-S278 VanDerWaalsContact C-N 3.32Å; N276-S278 PolarHBondContact O-N 3.25Å
279	T	32.1	Very low	50.5	Low	124 Å²	124	125.5 Å²	125.5	76%	0.761	64%	0.642	S	S	*	*			trans	51.4	97.5	156.1	49	0	0	0	0	117.1
280	E	35.9	Very low	48.7	Very low	187 Å²	187	128.4 Å²	128.4	87%	0.874	66%	0.664	S	S	*	*				-160.8	112.3	129	-109.2	166.7	-157.6	0	0	110.3
281	T	31.9	Very low	47.5	Very low	129 Å²	129	127.2 Å²	127.2	79%	0.791	66%	0.656	S	S	*	*			trans	-56.8	155.6	161.1	30.9	0	0	0	0	111.1
282	T	33.4	Very low	46.4	Very low	127 Å²	127	134.8 Å²	134.8	78%	0.779	68%	0.684	S	S	*	*			trans	84.2	97.8	159.5	-8.7	0	0	0	0	115.7
283	E	35.3	Very low	45.5	Very low	163 Å²	163	141.5 Å²	141.5	76%	0.762	71%	0.71	S	S	*	*				174.5	127.9	98.3	-92.6	-170.9	172.1	0	0	111	N285	E283-N285 PolarHBondContact O-N 2.94Å
284	E	32.3	Very low	45.1	Very low	190 Å²	190	139.6 Å²	139.6	89%	0.888	71%	0.709	S	S	*	*			trans	-62.2	109.4	169.2	-170.5	179.4	-156.5	0	0	109.5
285	N	37.8	Very low	45.5	Very low	134 Å²	134	145.5 Å²	145.5	72%	0.717	73%	0.727	S	S	*	*			trans	-148.7	101.9	166.4	-91.2	-45.5	0	0	0	111.8	E283	E283-N285 PolarHBondContact O-N 2.94Å
286	K	34.5	Very low	46.7	Very low	197 Å²	197	141.3 Å²	141.3	86%	0.857	71%	0.712	S	S	*	*			trans	-55.6	128.3	161.3	-81.4	172	173.3	169.1	0	109.1	H288	K286-H288 PolarHBondContact O-N 3.31Å
287	P	39.6	Very low	48.3	Very low	126 Å²	126	136.3 Å²	136.3	82%	0.818	69%	0.687	S	S	*	*			trans	-77.1	101.8	162.4	29.8	-27.2	0	0	0	107.6	K289	P287-K289 PolarHBondContact O-N 3.01Å
288	H	40.2	Very low	50.4	Low	163 Å²	163	134.5 Å²	134.5	76%	0.755	67%	0.672	S	S	*	*			trans	-47.2	112.7	159.7	-135	-87.5	0	0	0	107.4	K286 S290	K286-H288 PolarHBondContact O-N 3.31Å; H288-S290 PolarHBondContact O-N 3.47Å
289	K	45	Very low	52.6	Low	191 Å²	191	132.7 Å²	132.7	83%	0.83	66%	0.659	S	S	*	*			trans	-51.9	116.6	170.2	-109.1	178	178	177.3	0	106.8	P287 Y291	P287-K289 PolarHBondContact O-N 3.01Å; K289-Y291 WeakPolarHBondContact O-CD2 3.18Å; K289-Y291 PolarHBondContact O-N 3.44Å
290	S	48.6	Very low	55	Low	85 Å²	85	131.6 Å²	131.6	59%	0.594	65%	0.647	S	S	*	*			trans	-62	100.2	-168.2	-179	0	0	0	0	111.3	H288 W292	H288-S290 PolarHBondContact O-N 3.47Å; S290-W292 PolarHBondContact O-N 2.87Å; S290-W292 WeakPolarHBondContact OG-CB 3.49Å
291	Y	62.5	Low	57.2	Low	140 Å²	140	125.3 Å²	125.3	55%	0.549	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-2	166.4	-79.9	-87.2	0	0	0	112.5	K289 Y293 L294 Y295	K289-Y291 WeakPolarHBondContact O-CD2 3.18Å; K289-Y291 PolarHBondContact O-N 3.44Å; Y291-Y293 PolarHBondContact O-N 3.42Å; Y291-Y293 VanDerWaalsContact O-N 3.16Å; Y291-L294 HydrophobicContact CD1-CD1 3.62Å; Y291-L294 HydrophobicContact CE1-CD1 3.99Å; Y291-L294 PolarHBondContact O-N 3.4Å; Y291-L294 VanDerWaalsContact O-N 3.17Å; Y291-Y295 HydrophobicContact CD1-CE2 4.24Å; Y291-Y295 HydrophobicContact CG-CE2 4.43Å; Y291-Y295 WeakPolarHBondContact O-CD2 3.28Å; Y291-Y295 PolarHBondContact O-N 3.1Å
292	W	64.4	Low	59.7	Low	170 Å²	170	122.7 Å²	122.7	64%	0.644	61%	0.611	S	S	*	*	H	α-helix	trans	-56.8	-31.8	176.1	132.9	-45.2	0	0	0	111.8	S290 L294 Y295 V296	S290-W292 PolarHBondContact O-N 2.87Å; S290-W292 WeakPolarHBondContact OG-CB 3.49Å; W292-L294 VanDerWaalsContact C-N 3.33Å; W292-L294 PolarHBondContact O-N 2.89Å; W292-Y295 PolarHBondContact O-N 3.38Å; W292-V296 WeakPolarHBondContact O-CA 3.3Å; W292-V296 VanDerWaalsContact O-CB 3.28Å; W292-V296 WeakPolarHBondContact O-CB 3.31Å; W292-V296 PolarHBondContact O-N 3.19Å
293	Y	68.6	Low	62.2	Low	142 Å²	142	119 Å²	119	56%	0.557	59%	0.59	S	S	*	*	I	π-helix	trans	-67.8	-39.8	-176.9	177.1	-92.4	0	0	0	110.5	Y291 V297 I298	Y291-Y293 PolarHBondContact O-N 3.42Å; Y291-Y293 VanDerWaalsContact O-N 3.16Å; Y293-V297 HydrophobicContact CD2-CB 3.72Å; Y293-V297 HydrophobicContact CD2-CG1 3.93Å; Y293-V297 HydrophobicContact CD2-CG2 3.85Å; Y293-V297 HydrophobicContact CE2-CB 3.96Å; Y293-V297 HydrophobicContact CE2-CG1 3.66Å; Y293-V297 HydrophobicContact CE2-CG2 4.44Å; Y293-V297 HydrophobicContact CG-CB 4.34Å; Y293-V297 WeakPolarHBondContact O-CB 3.34Å; Y293-V297 PolarHBondContact O-N 3.15Å; Y293-I298 HydrophobicContact CE1-CD1 4.26Å; Y293-I298 HydrophobicContact CE1-CG1 4.15Å; Y293-I298 PolarHBondContact O-N 3.15Å
294	L	72.7	Confident	64.6	Low	95 Å²	95	116.3 Å²	116.3	50%	0.497	58%	0.581	S	S	.	*	I	π-helix	trans	-67.7	-36.6	178	-78.9	156.4	0	0	0	112.4	Y291 W292 I298	Y291-L294 HydrophobicContact CD1-CD1 3.62Å; Y291-L294 HydrophobicContact CE1-CD1 3.99Å; Y291-L294 PolarHBondContact O-N 3.4Å; Y291-L294 VanDerWaalsContact O-N 3.17Å; W292-L294 VanDerWaalsContact C-N 3.33Å; W292-L294 PolarHBondContact O-N 2.89Å; L294-I298 HydrophobicContact CD2-CD1 3.83Å
295	Y	75.1	Confident	67.2	Low	175 Å²	175	114.4 Å²	114.4	69%	0.686	57%	0.57	S	S	*	*	I	π-helix	trans	-98.9	-20.6	-174.1	-63.5	-67.3	0	0	0	115.3	Y291 W292 P299	Y291-Y295 HydrophobicContact CD1-CE2 4.24Å; Y291-Y295 HydrophobicContact CG-CE2 4.43Å; Y291-Y295 WeakPolarHBondContact O-CD2 3.28Å; Y291-Y295 PolarHBondContact O-N 3.1Å; W292-Y295 PolarHBondContact O-N 3.38Å; Y295-P299 WeakPolarHBondContact O-CG 3.36Å
296	V	77.5	Confident	69.6	Low	64 Å²	64	113.9 Å²	113.9	39%	0.388	57%	0.566	S	S	.	*	I	π-helix	trans	-111.1	-50.7	-177.2	-176	0	0	0	0	110.8	W292 L300	W292-V296 WeakPolarHBondContact O-CA 3.3Å; W292-V296 VanDerWaalsContact O-CB 3.28Å; W292-V296 WeakPolarHBondContact O-CB 3.31Å; W292-V296 PolarHBondContact O-N 3.19Å; V296-L300 HydrophobicContact CG1-CD1 3.99Å; V296-L300 WeakPolarHBondContact O-CB 3.44Å; V296-L300 WeakPolarHBondContact O-CD1 3.38Å; V296-L300 PolarHBondContact O-N 3.42Å
297	V	76.8	Confident	72.2	Confident	54 Å²	54	109.8 Å²	109.8	33%	0.327	55%	0.553	S	S	.	*	I	π-helix	trans	-75.6	-42.5	-171.9	-176.3	0	0	0	0	111.6	Y293 L300 A301	Y293-V297 HydrophobicContact CD2-CB 3.72Å; Y293-V297 HydrophobicContact CD2-CG1 3.93Å; Y293-V297 HydrophobicContact CD2-CG2 3.85Å; Y293-V297 HydrophobicContact CE2-CB 3.96Å; Y293-V297 HydrophobicContact CE2-CG1 3.66Å; Y293-V297 HydrophobicContact CE2-CG2 4.44Å; Y293-V297 HydrophobicContact CG-CB 4.34Å; Y293-V297 WeakPolarHBondContact O-CB 3.34Å; Y293-V297 PolarHBondContact O-N 3.15Å; V297-L300 PolarHBondContact O-N 2.03Å; V297-A301 WeakPolarHBondContact O-CB 3.47Å; V297-A301 PolarHBondContact O-N 2.98Å
298	I	79.4	Confident	74.5	Confident	70 Å²	70	107.3 Å²	107.3	36%	0.359	54%	0.538	S	S	.	.	H	α-helix	trans	-63.6	-49.3	179.6	-62.3	177.7	0	0	0	111.6	Y293 L294 L300 A301 T302	Y293-I298 HydrophobicContact CE1-CD1 4.26Å; Y293-I298 HydrophobicContact CE1-CG1 4.15Å; Y293-I298 PolarHBondContact O-N 3.15Å; L294-I298 HydrophobicContact CD2-CD1 3.83Å; I298-L300 VanDerWaalsContact C-N 3.35Å; I298-L300 PolarHBondContact O-N 3.37Å; I298-A301 PolarHBondContact O-N 3.37Å; I298-T302 HydrophobicContact CG2-CG2 4.31Å; I298-T302 WeakPolarHBondContact O-CG2 3.16Å; I298-T302 PolarHBondContact O-N 3.19Å; I298-T302 PolarHBondContact O-OG1 3.34Å
299	P	81.9	Confident	76.9	Confident	61 Å²	61	103.2 Å²	103.2	40%	0.396	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-41.2	178	-28	39.3	0	0	0	113.1	Y295 A301 T302 S303	Y295-P299 WeakPolarHBondContact O-CG 3.36Å; P299-A301 PolarHBondContact O-N 3Å; P299-T302 WeakPolarHBondContact CA-OG1 3.44Å; P299-T302 PolarHBondContact O-N 2.89Å; P299-T302 PolarHBondContact O-OG1 2.86Å; P299-S303 PolarHBondContact O-N 3.05Å
300	L	81.1	Confident	79	Confident	100 Å²	100	96 Å²	96	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-42.7	176.2	-86.8	163	0	0	0	112.6	V296 V297 I298 S303 L304	V296-L300 HydrophobicContact CG1-CD1 3.99Å; V296-L300 WeakPolarHBondContact O-CB 3.44Å; V296-L300 WeakPolarHBondContact O-CD1 3.38Å; V296-L300 PolarHBondContact O-N 3.42Å; V297-L300 PolarHBondContact O-N 2.03Å; I298-L300 VanDerWaalsContact C-N 3.35Å; I298-L300 PolarHBondContact O-N 3.37Å; L300-S303 PolarHBondContact O-N 3.12Å; L300-S303 PolarHBondContact O-OG 3.26Å; L300-L304 WeakPolarHBondContact O-CG 3.18Å; L300-L304 PolarHBondContact O-N 2.99Å; L300-L304 VanDerWaalsContact O-N 3.08Å
301	A	83.3	Confident	81	Confident	55 Å²	55	99 Å²	99	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-64.8	-42.4	176.2	0	0	0	0	0	111.3	V297 I298 P299 L304 F305	V297-A301 WeakPolarHBondContact O-CB 3.47Å; V297-A301 PolarHBondContact O-N 2.98Å; I298-A301 PolarHBondContact O-N 3.37Å; P299-A301 PolarHBondContact O-N 3Å; A301-L304 PolarHBondContact O-N 3.37Å; A301-F305 PolarHBondContact O-N 3.34Å
302	T	84.1	Confident	82.3	Confident	74 Å²	74	97.1 Å²	97.1	45%	0.454	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-38.4	177.4	60	0	0	0	0	112.6	I298 P299 F305 L306	I298-T302 HydrophobicContact CG2-CG2 4.31Å; I298-T302 WeakPolarHBondContact O-CG2 3.16Å; I298-T302 PolarHBondContact O-N 3.19Å; I298-T302 PolarHBondContact O-OG1 3.34Å; P299-T302 WeakPolarHBondContact CA-OG1 3.44Å; P299-T302 PolarHBondContact O-N 2.89Å; P299-T302 PolarHBondContact O-OG1 2.86Å; T302-F305 PolarHBondContact O-N 3.19Å; T302-L306 WeakPolarHBondContact O-CG 3.39Å; T302-L306 PolarHBondContact O-N 3.37Å
303	S	85.3	Confident	83.4	Confident	49 Å²	49	93.5 Å²	93.5	34%	0.343	49%	0.49	S	S	.	.	H	α-helix	trans	-66.9	-41.3	177.5	71.1	0	0	0	0	111.6	P299 L300 F305 L306 I307	P299-S303 PolarHBondContact O-N 3.05Å; L300-S303 PolarHBondContact O-N 3.12Å; L300-S303 PolarHBondContact O-OG 3.26Å; S303-F305 VanDerWaalsContact C-N 3.33Å; S303-F305 PolarHBondContact O-N 3.35Å; S303-L306 PolarHBondContact O-N 3.27Å; S303-I307 WeakPolarHBondContact O-CD1 3.14Å; S303-I307 VanDerWaalsContact O-CG1 3.25Å; S303-I307 WeakPolarHBondContact O-CG1 3.18Å; S303-I307 PolarHBondContact O-N 3.48Å
304	L	85.6	Confident	84.3	Confident	108 Å²	108	95.2 Å²	95.2	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-62.6	-40.8	175	-76.1	167.8	0	0	0	111.5	L300 A301 I307 C308	L300-L304 WeakPolarHBondContact O-CG 3.18Å; L300-L304 PolarHBondContact O-N 2.99Å; L300-L304 VanDerWaalsContact O-N 3.08Å; A301-L304 PolarHBondContact O-N 3.37Å; L304-I307 PolarHBondContact O-N 3.37Å; L304-C308 PolarHBondContact O-N 3.11Å; L304-C308 PolarHBondContact O-SG 3.33Å
305	F	86.9	Confident	84.9	Confident	150 Å²	150	98.5 Å²	98.5	66%	0.658	50%	0.501	S	S	*	.	H	α-helix	trans	-63.8	-42.1	177.4	-131.7	-89.6	0	0	0	112.2	A301 T302 S303 C308 I309	A301-F305 PolarHBondContact O-N 3.34Å; T302-F305 PolarHBondContact O-N 3.19Å; S303-F305 VanDerWaalsContact C-N 3.33Å; S303-F305 PolarHBondContact O-N 3.35Å; F305-C308 PolarHBondContact O-N 3.3Å; F305-I309 HydrophobicContact CD1-CD1 3.94Å; F305-I309 HydrophobicContact CD1-CG1 4.45Å; F305-I309 HydrophobicContact CE1-CD1 4.48Å; F305-I309 WeakPolarHBondContact O-CG1 3.2Å; F305-I309 PolarHBondContact O-N 2.82Å
306	L	88.9	Confident	85.3	Confident	122 Å²	122	99.9 Å²	99.9	64%	0.639	51%	0.505	S	S	*	.	H	α-helix	trans	-66.3	-39.1	176.7	-70.8	173.4	0	0	0	112.5	T302 S303 I309 G310	T302-L306 WeakPolarHBondContact O-CG 3.39Å; T302-L306 PolarHBondContact O-N 3.37Å; S303-L306 PolarHBondContact O-N 3.27Å; L306-I309 PolarHBondContact O-N 3.07Å; L306-G310 PolarHBondContact O-N 2.93Å
307	I	89.1	Confident	85.8	Confident	112 Å²	112	103.1 Å²	103.1	57%	0.574	52%	0.52	S	S	*	.	H	α-helix	trans	-63.6	-43.1	174.8	-68	165	0	0	0	110.4	S303 L304 G310 Y311	S303-I307 WeakPolarHBondContact O-CD1 3.14Å; S303-I307 VanDerWaalsContact O-CG1 3.25Å; S303-I307 WeakPolarHBondContact O-CG1 3.18Å; S303-I307 PolarHBondContact O-N 3.48Å; L304-I307 PolarHBondContact O-N 3.37Å; I307-G310 PolarHBondContact O-N 3.3Å; I307-Y311 WeakPolarHBondContact O-CB 3.27Å; I307-Y311 PolarHBondContact O-N 3.06Å
308	C	88.6	Confident	86	Confident	74 Å²	74	106.9 Å²	106.9	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-62.1	-44.5	176.4	-73.2	0	0	0	0	112.1	L304 F305 Y311 I312	L304-C308 PolarHBondContact O-N 3.11Å; L304-C308 PolarHBondContact O-SG 3.33Å; F305-C308 PolarHBondContact O-N 3.3Å; C308-Y311 PolarHBondContact O-N 2.87Å; C308-I312 VanDerWaalsContact O-CG1 3.27Å; C308-I312 WeakPolarHBondContact O-CG1 3.15Å; C308-I312 PolarHBondContact O-N 2.83Å
309	I	90	Very high	85.8	Confident	77 Å²	77	114.6 Å²	114.6	40%	0.395	56%	0.562	S	S	.	*	H	α-helix	trans	-62.5	-45.8	176.2	-67.9	167.1	0	0	0	110.4	F305 L306 Y311 I312 I313	F305-I309 HydrophobicContact CD1-CD1 3.94Å; F305-I309 HydrophobicContact CD1-CG1 4.45Å; F305-I309 HydrophobicContact CE1-CD1 4.48Å; F305-I309 WeakPolarHBondContact O-CG1 3.2Å; F305-I309 PolarHBondContact O-N 2.82Å; L306-I309 PolarHBondContact O-N 3.07Å; I309-Y311 VanDerWaalsContact C-N 3.32Å; I309-Y311 PolarHBondContact O-N 3.39Å; I309-I312 PolarHBondContact O-N 3.45Å; I309-I313 HydrophobicContact CG2-CD1 3.68Å; I309-I313 HydrophobicContact CG2-CG1 4.34Å; I309-I313 VanDerWaalsContact O-CG1 3.32Å; I309-I313 WeakPolarHBondContact O-CG1 3.46Å; I309-I313 PolarHBondContact O-N 2.98Å
310	G	89.3	Confident	85.2	Confident	38 Å²	38	117.6 Å²	117.6	39%	0.392	60%	0.604	S	S	.	*	H	α-helix	trans	-59.1	-41.2	176.3	0	0	0	0	0	112.8	L306 I307 I313 W314	L306-G310 PolarHBondContact O-N 2.93Å; I307-G310 PolarHBondContact O-N 3.3Å; G310-I313 PolarHBondContact O-N 3.49Å; G310-W314 WeakPolarHBondContact O-CB 3.44Å; G310-W314 PolarHBondContact O-N 2.83Å
311	Y	89.5	Confident	85.4	Confident	150 Å²	150	118.5 Å²	118.5	59%	0.588	61%	0.608	S	S	*	*	H	α-helix	trans	-67.4	-37.9	177.6	-162.7	-94	0	0	0	112.4	I307 C308 I309 R315	I307-Y311 WeakPolarHBondContact O-CB 3.27Å; I307-Y311 PolarHBondContact O-N 3.06Å; C308-Y311 PolarHBondContact O-N 2.87Å; I309-Y311 VanDerWaalsContact C-N 3.32Å; I309-Y311 PolarHBondContact O-N 3.39Å; Y311-R315 WeakPolarHBondContact O-CB 3.41Å; Y311-R315 PolarHBondContact O-N 3.49Å
312	I	89.3	Confident	85.5	Confident	100 Å²	100	121.8 Å²	121.8	51%	0.513	62%	0.616	S	S	.	*	H	α-helix	trans	-66.3	-46.4	175.2	-67.6	166.1	0	0	0	110.4	C308 I309 R315 W316	C308-I312 VanDerWaalsContact O-CG1 3.27Å; C308-I312 WeakPolarHBondContact O-CG1 3.15Å; C308-I312 PolarHBondContact O-N 2.83Å; I309-I312 PolarHBondContact O-N 3.45Å; I312-R315 PolarHBondContact O-N 3.05Å; I312-W316 PolarHBondContact O-N 3.33Å
313	I	88.7	Confident	85.6	Confident	94 Å²	94	124.5 Å²	124.5	48%	0.482	63%	0.625	S	S	.	*	H	α-helix	trans	-62.3	-44.3	178.2	-66.2	168.9	0	0	0	110.6	I309 G310 R315 W316 L317	I309-I313 HydrophobicContact CG2-CD1 3.68Å; I309-I313 HydrophobicContact CG2-CG1 4.34Å; I309-I313 VanDerWaalsContact O-CG1 3.32Å; I309-I313 WeakPolarHBondContact O-CG1 3.46Å; I309-I313 PolarHBondContact O-N 2.98Å; G310-I313 PolarHBondContact O-N 3.49Å; I313-R315 PolarHBondContact O-N 3.39Å; I313-W316 PolarHBondContact O-N 3.43Å; I313-L317 HydrophobicContact CG2-CD1 3.96Å; I313-L317 HydrophobicContact CG2-CG 4.47Å; I313-L317 WeakPolarHBondContact O-CG 3.38Å; I313-L317 PolarHBondContact O-N 3.12Å
314	W	86.3	Confident	85.6	Confident	178 Å²	178	128.9 Å²	128.9	67%	0.674	64%	0.642	S	S	*	*	H	α-helix	trans	-58	-48.8	174.8	-173.7	-44.3	0	0	0	110.7	G310 W316 L317 L318	G310-W314 WeakPolarHBondContact O-CB 3.44Å; G310-W314 PolarHBondContact O-N 2.83Å; W314-W316 PolarHBondContact O-N 3.43Å; W314-L317 PolarHBondContact O-N 3.32Å; W314-L317 VanDerWaalsContact O-N 3.17Å; W314-L318 VanDerWaalsContact CD1-CD1 3.45Å; W314-L318 PolarHBondContact O-N 3.11Å
315	R	87	Confident	85.6	Confident	163 Å²	163	130.3 Å²	130.3	62%	0.615	65%	0.647	S	S	*	*	H	α-helix	trans	-61	-33.6	178.5	-111	-170.5	177.1	-166.8	0.7	113.2	Y311 I312 I313	Y311-R315 WeakPolarHBondContact O-CB 3.41Å; Y311-R315 PolarHBondContact O-N 3.49Å; I312-R315 PolarHBondContact O-N 3.05Å; I313-R315 PolarHBondContact O-N 3.39Å
316	W	83.7	Confident	85.5	Confident	204 Å²	204	128.9 Å²	128.9	77%	0.773	65%	0.646	S	S	*	*	H	α-helix	trans	-70.2	-42.5	174.6	-94	76.8	0	0	0	111.8	I312 I313 W314 R319 G320	I312-W316 PolarHBondContact O-N 3.33Å; I313-W316 PolarHBondContact O-N 3.43Å; W314-W316 PolarHBondContact O-N 3.43Å; W316-R319 PolarHBondContact O-N 2.95Å; W316-G320 PolarHBondContact O-N 3.15Å
317	L	86.6	Confident	85.3	Confident	132 Å²	132	129.4 Å²	129.4	69%	0.691	65%	0.647	S	S	*	*	H	α-helix	trans	-70.6	-28.8	179	-71.9	170.6	0	0	0	113.7	I313 W314 R319	I313-L317 HydrophobicContact CG2-CD1 3.96Å; I313-L317 HydrophobicContact CG2-CG 4.47Å; I313-L317 WeakPolarHBondContact O-CG 3.38Å; I313-L317 PolarHBondContact O-N 3.12Å; W314-L317 PolarHBondContact O-N 3.32Å; W314-L317 VanDerWaalsContact O-N 3.17Å; L317-R319 VanDerWaalsContact C-N 3.29Å
318	L	82.1	Confident	85	Confident	133 Å²	133	130.8 Å²	130.8	70%	0.696	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-7.3	174	-92.5	176.5	0	0	0	114	W314	W314-L318 VanDerWaalsContact CD1-CD1 3.45Å; W314-L318 PolarHBondContact O-N 3.11Å
319	R	74.5	Confident	84.7	Confident	233 Å²	233	135.5 Å²	135.5	88%	0.879	67%	0.665	S	S	*	*			trans	-108.2	-2.1	179.1	-103.4	-177.8	175.7	-179.6	-2.3	114.1	W316 L317	W316-R319 PolarHBondContact O-N 2.95Å; L317-R319 VanDerWaalsContact C-N 3.29Å
320	G	69	Low	84.2	Confident	124 Å²	124	140.8 Å²	140.8	100%	1.278	69%	0.689	S	S	*	*			trans	-104	0	171.2	0	0	0	0	0	111.2	W316	W316-G320 PolarHBondContact O-N 3.15Å

Retrieved 320 of 320 residues in 244.6 ms (Link to these results)

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