A0A096N0S0_PAPAN Loading...

Tumor necrosis factor ligand superfamily member 4

Cytokine that binds to TNFRSF4. Co-stimulates T-cell proliferation and cytokine production.

AlphaFold DB , UniProt , Accession A0A096N0S0, Species PAPAN (Papio anubis, Olive baboon), Gene TNFSF4, Length 183 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	40.9	Very low	230 Å²	230	160.5 Å²	160.5	100%	1.133	81%	0.807	S	S	*	*				0	138	0	-149.8	142.1	176.1	0	0	107
2	E	35.7	Very low	40.6	Very low	154 Å²	154	153 Å²	153	72%	0.72	80%	0.801	S	S	*	*			trans	17.1	134.1	-173.4	-86.6	89.1	162.5	0	0	124.3
3	R	41.5	Very low	41.5	Very low	223 Å²	223	153.7 Å²	153.7	84%	0.842	81%	0.806	S	S	*	*			trans	-64.1	135.2	155.1	-170.4	-165.6	-72.6	168.6	-5.5	109.5
4	V	38.4	Very low	41.8	Very low	141 Å²	141	149.1 Å²	149.1	86%	0.855	80%	0.802	S	S	*	*			trans	-123.6	117	161.1	-176.2	0	0	0	0	108.8
5	Q	42.8	Very low	42.3	Very low	156 Å²	156	145.9 Å²	145.9	73%	0.729	80%	0.804	S	S	*	*			trans	-66.4	159.5	172.7	-85.2	173.8	-36.3	0	0	111.5
6	P	47.5	Very low	42.9	Very low	128 Å²	128	149.9 Å²	149.9	83%	0.831	80%	0.803	S	S	*	*			trans	-77.2	128.9	178.6	32.4	-30.5	0	0	0	109.6
7	L	39.7	Very low	43.4	Very low	163 Å²	163	146.9 Å²	146.9	85%	0.853	79%	0.794	S	S	*	*			trans	-102.4	106.5	170.9	-166.3	69.1	0	0	0	109
8	E	39.5	Very low	43.9	Very low	155 Å²	155	149.6 Å²	149.6	72%	0.724	79%	0.79	S	S	*	*			trans	16.1	133	144.5	-87.9	-179.8	154.6	0	0	121
9	E	42.5	Very low	44.1	Very low	147 Å²	147	149.7 Å²	149.7	69%	0.687	78%	0.784	S	S	*	*				78.9	100.5	124.7	-161.8	170.7	-157.6	0	0	117.6
10	N	37.1	Very low	44.7	Very low	164 Å²	164	149.4 Å²	149.4	88%	0.877	78%	0.778	S	S	*	*			trans	-139.9	89	142	-87.7	-57.8	0	0	0	110.1	G12	N10-G12 PolarHBondContact O-N 3.18Å
11	V	49.7	Very low	45.3	Very low	104 Å²	104	151.1 Å²	151.1	63%	0.63	77%	0.774	S	S	*	*			trans	39.8	73.4	132.2	-166.3	0	0	0	0	115.9
12	G	37.1	Very low	46.6	Very low	71 Å²	71	145 Å²	145	73%	0.732	75%	0.747	S	S	*	*			trans	-87.4	104.6	150.9	0	0	0	0	0	109	N10 A14	N10-G12 PolarHBondContact O-N 3.18Å; G12-A14 VanDerWaalsContact C-N 3.29Å; G12-A14 PolarHBondContact O-N 2.8Å
13	N	51.5	Low	48.1	Very low	162 Å²	162	143.5 Å²	143.5	87%	0.866	74%	0.738	S	S	*	*			trans	-57.6	88.3	168.8	-83.5	-32.4	0	0	0	110.4
14	A	46.8	Very low	49.6	Very low	90 Å²	90	139.3 Å²	139.3	74%	0.744	73%	0.731	S	S	*	*			trans	-97.5	109.6	165	0	0	0	0	0	108.1	G12 R16	G12-A14 VanDerWaalsContact C-N 3.29Å; G12-A14 PolarHBondContact O-N 2.8Å; A14-R16 PolarHBondContact O-N 3.1Å
15	A	48.7	Very low	51.3	Low	101 Å²	101	137.8 Å²	137.8	84%	0.835	72%	0.717	S	S	*	*			trans	-55	108.8	169	0	0	0	0	0	108.7
16	R	52.2	Low	52.9	Low	210 Å²	210	135.9 Å²	135.9	79%	0.792	71%	0.712	S	S	*	*			trans	-47.6	141.9	170.7	-98.7	178.2	170.4	171.6	-2.3	109.2	A14 R18	A14-R16 PolarHBondContact O-N 3.1Å; R16-R18 PolarHBondContact O-N 3.46Å
17	P	50.8	Low	54.5	Low	99 Å²	99	133.8 Å²	133.8	64%	0.643	70%	0.697	S	S	*	*	S	Bend	trans	-75.2	62.3	178.6	32.5	-33.8	0	0	0	110.3	F19	P17-F19 VanDerWaalsContact C-N 3.32Å
18	R	52.8	Low	56.4	Low	194 Å²	194	128.4 Å²	128.4	73%	0.732	68%	0.676	S	S	*	*	H	α-helix	trans	-72.4	-31.2	168.9	-100.3	-177.9	173.1	173.3	-2.3	110.7	R16 N22	R16-R18 PolarHBondContact O-N 3.46Å; R18-N22 PolarHBondContact O-N 3.16Å; R18-N22 VanDerWaalsContact O-N 3.12Å
19	F	48	Very low	58.4	Low	152 Å²	152	124.7 Å²	124.7	67%	0.667	67%	0.667	S	S	*	*	H	α-helix	trans	-69.7	-42.6	-176.2	-165.2	-106.7	0	0	0	112.7	P17 K23	P17-F19 VanDerWaalsContact C-N 3.32Å; F19-K23 HydrophobicContact CE1-CD 4.38Å; F19-K23 VanDerWaalsContact CE1-CE 3.48Å; F19-K23 PolarHBondContact O-N 3.06Å
20	E	55.8	Low	60.6	Low	144 Å²	144	121.4 Å²	121.4	67%	0.673	66%	0.656	S	S	*	*	H	α-helix	trans	-70.1	-37	176.2	-66.5	-133	142.8	0	0	112.5	N22 K23 L24	E20-N22 VanDerWaalsContact C-N 3.32Å; E20-N22 PolarHBondContact O-N 2.85Å; E20-K23 PolarHBondContact O-N 3.22Å; E20-L24 WeakPolarHBondContact O-CB 3.41Å; E20-L24 PolarHBondContact O-N 3.49Å
21	R	57.7	Low	63.1	Low	185 Å²	185	118.9 Å²	118.9	70%	0.698	64%	0.642	S	S	*	*	H	α-helix	trans	-64.1	-38.5	177.9	-150.9	172.4	179.3	170.1	-1.2	111.5	L24 L25	R21-L24 PolarHBondContact O-N 2.82Å; R21-L25 VanDerWaalsContact O-CB 3.3Å; R21-L25 WeakPolarHBondContact O-CB 3.32Å; R21-L25 WeakPolarHBondContact O-CD1 3.16Å; R21-L25 WeakPolarHBondContact O-CG 3.41Å; R21-L25 PolarHBondContact O-N 3.5Å
22	N	62.7	Low	64.9	Low	103 Å²	103	120.4 Å²	120.4	55%	0.551	64%	0.642	S	S	*	*	H	α-helix	trans	-66.2	-40.1	173.3	-73.7	0.7	0	0	0	112.1	R18 E20 L26	R18-N22 PolarHBondContact O-N 3.16Å; R18-N22 VanDerWaalsContact O-N 3.12Å; E20-N22 VanDerWaalsContact C-N 3.32Å; E20-N22 PolarHBondContact O-N 2.85Å; N22-L26 WeakPolarHBondContact O-CB 3.43Å; N22-L26 PolarHBondContact O-N 2.73Å
23	K	68.4	Low	67.4	Low	122 Å²	122	118.8 Å²	118.8	53%	0.53	63%	0.625	S	S	.	*	H	α-helix	trans	-64.3	-43.8	174.1	-75.7	-173.6	175.2	-176.3	0	112.1	F19 E20 L26 V27	F19-K23 HydrophobicContact CE1-CD 4.38Å; F19-K23 VanDerWaalsContact CE1-CE 3.48Å; F19-K23 PolarHBondContact O-N 3.06Å; E20-K23 PolarHBondContact O-N 3.22Å; K23-L26 PolarHBondContact O-N 3.02Å; K23-V27 VanDerWaalsContact O-CG2 3.31Å; K23-V27 WeakPolarHBondContact O-CG2 3.23Å; K23-V27 PolarHBondContact O-N 3.25Å
24	L	72.5	Confident	69.4	Low	135 Å²	135	115.8 Å²	115.8	71%	0.707	61%	0.609	S	S	*	*	H	α-helix	trans	-64.6	-42	178.8	-150.4	94.7	0	0	0	111.5	E20 R21 L26 V27 A28	E20-L24 WeakPolarHBondContact O-CB 3.41Å; E20-L24 PolarHBondContact O-N 3.49Å; R21-L24 PolarHBondContact O-N 2.82Å; L24-L26 VanDerWaalsContact C-N 3.32Å; L24-V27 PolarHBondContact O-N 2.92Å; L24-A28 WeakPolarHBondContact O-CB 3.42Å; L24-A28 PolarHBondContact O-N 3.01Å
25	L	73.8	Confident	71.5	Confident	108 Å²	108	113.1 Å²	113.1	57%	0.565	59%	0.59	S	S	*	*	H	α-helix	trans	-65.2	-35.9	174.2	-72.5	169.3	0	0	0	111.9	R21 A28 S29	R21-L25 VanDerWaalsContact O-CB 3.3Å; R21-L25 WeakPolarHBondContact O-CB 3.32Å; R21-L25 WeakPolarHBondContact O-CD1 3.16Å; R21-L25 WeakPolarHBondContact O-CG 3.41Å; R21-L25 PolarHBondContact O-N 3.5Å; L25-A28 PolarHBondContact O-N 2.87Å; L25-S29 VanDerWaalsContact O-CB 3.28Å; L25-S29 WeakPolarHBondContact O-CB 3.38Å; L25-S29 PolarHBondContact O-N 2.91Å
26	L	77.1	Confident	73.6	Confident	117 Å²	117	113.6 Å²	113.6	61%	0.613	58%	0.578	S	S	*	*	H	α-helix	trans	-69.9	-42	177.5	-157.6	149.9	0	0	0	110.9	N22 K23 L24 S29 V30	N22-L26 WeakPolarHBondContact O-CB 3.43Å; N22-L26 PolarHBondContact O-N 2.73Å; K23-L26 PolarHBondContact O-N 3.02Å; L24-L26 VanDerWaalsContact C-N 3.32Å; L26-S29 PolarHBondContact O-N 3.3Å; L26-V30 HydrophobicContact CD2-CG2 4.2Å; L26-V30 VanDerWaalsContact O-CG2 3.27Å; L26-V30 WeakPolarHBondContact O-CG2 3.45Å; L26-V30 PolarHBondContact O-N 2.77Å
27	V	80.1	Confident	75.5	Confident	84 Å²	84	108.6 Å²	108.6	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-62.6	-45.4	172.9	172.6	0	0	0	0	111.1	K23 L24 S29 V30 I31	K23-V27 VanDerWaalsContact O-CG2 3.31Å; K23-V27 WeakPolarHBondContact O-CG2 3.23Å; K23-V27 PolarHBondContact O-N 3.25Å; L24-V27 PolarHBondContact O-N 2.92Å; V27-S29 VanDerWaalsContact C-N 3.33Å; V27-S29 PolarHBondContact O-N 3.15Å; V27-V30 PolarHBondContact O-N 2.85Å; V27-I31 HydrophobicContact CG1-CD1 3.78Å; V27-I31 HydrophobicContact CG1-CG1 4.46Å; V27-I31 VanDerWaalsContact O-CG1 3.31Å; V27-I31 WeakPolarHBondContact O-CG1 3.42Å; V27-I31 PolarHBondContact O-N 3.26Å
28	A	79.1	Confident	77.5	Confident	50 Å²	50	109 Å²	109	41%	0.413	56%	0.563	S	S	.	*	H	α-helix	trans	-60.7	-42.4	176.4	0	0	0	0	0	111.9	L24 L25 I31 Q32	L24-A28 WeakPolarHBondContact O-CB 3.42Å; L24-A28 PolarHBondContact O-N 3.01Å; L25-A28 PolarHBondContact O-N 2.87Å; A28-I31 PolarHBondContact O-N 2.86Å; A28-Q32 VanDerWaalsContact O-CB 3.28Å; A28-Q32 WeakPolarHBondContact O-CB 3.34Å; A28-Q32 PolarHBondContact O-N 2.97Å
29	S	82.5	Confident	79.2	Confident	77 Å²	77	103.4 Å²	103.4	54%	0.538	55%	0.552	S	S	.	*	H	α-helix	trans	-63.5	-41.2	176	-175.5	0	0	0	0	112.2	L25 L26 V27 Q32 G33	L25-S29 VanDerWaalsContact O-CB 3.28Å; L25-S29 WeakPolarHBondContact O-CB 3.38Å; L25-S29 PolarHBondContact O-N 2.91Å; L26-S29 PolarHBondContact O-N 3.3Å; V27-S29 VanDerWaalsContact C-N 3.33Å; V27-S29 PolarHBondContact O-N 3.15Å; S29-Q32 PolarHBondContact O-N 3.29Å; S29-G33 PolarHBondContact O-N 2.88Å
30	V	88.2	Confident	81.1	Confident	77 Å²	77	103 Å²	103	47%	0.467	55%	0.55	S	S	.	*	H	α-helix	trans	-64.6	-45.1	176.2	169.7	0	0	0	0	111.2	L26 V27 G33 L34	L26-V30 HydrophobicContact CD2-CG2 4.2Å; L26-V30 VanDerWaalsContact O-CG2 3.27Å; L26-V30 WeakPolarHBondContact O-CG2 3.45Å; L26-V30 PolarHBondContact O-N 2.77Å; V27-V30 PolarHBondContact O-N 2.85Å; V30-G33 PolarHBondContact O-N 2.82Å; V30-L34 HydrophobicContact CG1-CD1 4.05Å; V30-L34 WeakPolarHBondContact O-CB 3.31Å; V30-L34 PolarHBondContact O-N 3.49Å
31	I	89.3	Confident	82.7	Confident	112 Å²	112	100 Å²	100	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-63.2	-44.6	177.7	-67	167.3	0	0	0	110.5	V27 A28 L34 G35	V27-I31 HydrophobicContact CG1-CD1 3.78Å; V27-I31 HydrophobicContact CG1-CG1 4.46Å; V27-I31 VanDerWaalsContact O-CG1 3.31Å; V27-I31 WeakPolarHBondContact O-CG1 3.42Å; V27-I31 PolarHBondContact O-N 3.26Å; A28-I31 PolarHBondContact O-N 2.86Å; I31-L34 PolarHBondContact O-N 3.09Å; I31-G35 PolarHBondContact O-N 2.95Å
32	Q	88.4	Confident	84.2	Confident	135 Å²	135	98.4 Å²	98.4	63%	0.631	53%	0.533	S	S	*	.	H	α-helix	trans	-65.1	-40.3	178	-172.5	173.6	-12.7	0	0	111.6	A28 S29 G35 L36	A28-Q32 VanDerWaalsContact O-CB 3.28Å; A28-Q32 WeakPolarHBondContact O-CB 3.34Å; A28-Q32 PolarHBondContact O-N 2.97Å; S29-Q32 PolarHBondContact O-N 3.29Å; Q32-G35 PolarHBondContact O-N 3.02Å; Q32-L36 HydrophobicContact CG-CD1 4.4Å; Q32-L36 WeakPolarHBondContact O-CB 3.37Å; Q32-L36 VanDerWaalsContact O-CG 3.32Å; Q32-L36 WeakPolarHBondContact O-CG 3.37Å; Q32-L36 PolarHBondContact O-N 3.39Å
33	G	89.9	Confident	85.3	Confident	37 Å²	37	98.4 Å²	98.4	38%	0.381	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-43.5	174.5	0	0	0	0	0	112.6	S29 V30 L36 L37	S29-G33 PolarHBondContact O-N 2.88Å; V30-G33 PolarHBondContact O-N 2.82Å; G33-L36 PolarHBondContact O-N 3Å; G33-L37 WeakPolarHBondContact O-CB 3.34Å; G33-L37 PolarHBondContact O-N 2.84Å
34	L	92.8	Very high	86	Confident	99 Å²	99	95.4 Å²	95.4	52%	0.518	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-42.2	174.5	-110.6	120.8	0	0	0	111.9	V30 I31 L37 L38	V30-L34 HydrophobicContact CG1-CD1 4.05Å; V30-L34 WeakPolarHBondContact O-CB 3.31Å; V30-L34 PolarHBondContact O-N 3.49Å; I31-L34 PolarHBondContact O-N 3.09Å; L34-L37 PolarHBondContact O-N 2.93Å; L34-L38 WeakPolarHBondContact O-CB 3.24Å; L34-L38 WeakPolarHBondContact O-CG 3.41Å; L34-L38 PolarHBondContact O-N 2.86Å
35	G	91.2	Very high	86.4	Confident	34 Å²	34	94.5 Å²	94.5	35%	0.351	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-44.4	175.7	0	0	0	0	0	112.2	I31 Q32 L38 C39	I31-G35 PolarHBondContact O-N 2.95Å; Q32-G35 PolarHBondContact O-N 3.02Å; G35-L38 PolarHBondContact O-N 2.85Å; G35-C39 PolarHBondContact O-N 2.99Å
36	L	92.8	Very high	86.5	Confident	112 Å²	112	94.1 Å²	94.1	59%	0.586	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-40.6	175.4	-73	172.2	0	0	0	112	Q32 G33 C39 F40	Q32-L36 HydrophobicContact CG-CD1 4.4Å; Q32-L36 WeakPolarHBondContact O-CB 3.37Å; Q32-L36 VanDerWaalsContact O-CG 3.32Å; Q32-L36 WeakPolarHBondContact O-CG 3.37Å; Q32-L36 PolarHBondContact O-N 3.39Å; G33-L36 PolarHBondContact O-N 3Å; L36-C39 PolarHBondContact O-N 3.46Å; L36-F40 WeakPolarHBondContact O-CB 3.44Å; L36-F40 PolarHBondContact O-N 2.84Å
37	L	92.4	Very high	86.1	Confident	105 Å²	105	95.5 Å²	95.5	55%	0.55	52%	0.518	S	S	.	.	H	α-helix	trans	-62.8	-44.2	176.2	-176	68.9	0	0	0	111.4	G33 L34 F40 I41	G33-L37 WeakPolarHBondContact O-CB 3.34Å; G33-L37 PolarHBondContact O-N 2.84Å; L34-L37 PolarHBondContact O-N 2.93Å; L37-F40 PolarHBondContact O-N 2.84Å; L37-I41 HydrophobicContact CD1-CD1 4.5Å; L37-I41 HydrophobicContact CG-CD1 4.04Å; L37-I41 VanDerWaalsContact O-CG1 3.3Å; L37-I41 WeakPolarHBondContact O-CG1 3.3Å; L37-I41 PolarHBondContact O-N 2.8Å
38	L	91.3	Very high	85.3	Confident	108 Å²	108	94.9 Å²	94.9	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-63.6	-42	176.1	-72.8	171.2	0	0	0	111.8	L34 G35 F40 I41 Y42	L34-L38 WeakPolarHBondContact O-CB 3.24Å; L34-L38 WeakPolarHBondContact O-CG 3.41Å; L34-L38 PolarHBondContact O-N 2.86Å; G35-L38 PolarHBondContact O-N 2.85Å; L38-F40 VanDerWaalsContact C-N 3.32Å; L38-F40 PolarHBondContact O-N 2.96Å; L38-I41 PolarHBondContact O-N 2.9Å; L38-Y42 WeakPolarHBondContact O-CB 3.27Å; L38-Y42 PolarHBondContact O-N 3.29Å
39	C	89.1	Confident	84.3	Confident	75 Å²	75	95.6 Å²	95.6	51%	0.507	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-42.3	172.4	-80.5	0	0	0	0	111.7	G35 L36 Y42 I43	G35-C39 PolarHBondContact O-N 2.99Å; L36-C39 PolarHBondContact O-N 3.46Å; C39-Y42 PolarHBondContact O-N 2.81Å; C39-I43 VanDerWaalsContact O-CG1 3.24Å; C39-I43 WeakPolarHBondContact O-CG1 3.44Å; C39-I43 PolarHBondContact O-N 3.17Å
40	F	89	Confident	82.9	Confident	144 Å²	144	97.9 Å²	97.9	63%	0.632	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-44.6	179.1	-150.7	-87.8	0	0	0	111.4	L36 L37 L38 Y42 I43 C44	L36-F40 WeakPolarHBondContact O-CB 3.44Å; L36-F40 PolarHBondContact O-N 2.84Å; L37-F40 PolarHBondContact O-N 2.84Å; L38-F40 VanDerWaalsContact C-N 3.32Å; L38-F40 PolarHBondContact O-N 2.96Å; F40-Y42 VanDerWaalsContact C-N 3.33Å; F40-Y42 PolarHBondContact O-N 2.83Å; F40-I43 PolarHBondContact O-N 3.12Å; F40-C44 WeakPolarHBondContact O-CB 3.39Å; F40-C44 PolarHBondContact O-N 2.98Å; F40-C44 PolarHBondContact O-SG 2.82Å
41	I	89.4	Confident	80.9	Confident	81 Å²	81	101.1 Å²	101.1	42%	0.415	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-43.4	174.6	-68.7	166.5	0	0	0	110.7	L37 L38 C44 L45	L37-I41 HydrophobicContact CD1-CD1 4.5Å; L37-I41 HydrophobicContact CG-CD1 4.04Å; L37-I41 VanDerWaalsContact O-CG1 3.3Å; L37-I41 WeakPolarHBondContact O-CG1 3.3Å; L37-I41 PolarHBondContact O-N 2.8Å; L38-I41 PolarHBondContact O-N 2.9Å; I41-C44 PolarHBondContact O-N 3Å; I41-L45 HydrophobicContact CG2-CD1 3.72Å; I41-L45 HydrophobicContact CG2-CG 4.31Å; I41-L45 WeakPolarHBondContact O-CB 3.33Å; I41-L45 WeakPolarHBondContact O-CG 3.38Å; I41-L45 PolarHBondContact O-N 3.31Å
42	Y	88.4	Confident	79	Confident	151 Å²	151	100.3 Å²	100.3	59%	0.592	54%	0.539	S	S	*	.	H	α-helix	trans	-61.5	-46.5	176.9	179.9	-95.7	0	0	0	111.7	L38 C39 F40 L45 H46	L38-Y42 WeakPolarHBondContact O-CB 3.27Å; L38-Y42 PolarHBondContact O-N 3.29Å; C39-Y42 PolarHBondContact O-N 2.81Å; F40-Y42 VanDerWaalsContact C-N 3.33Å; F40-Y42 PolarHBondContact O-N 2.83Å; Y42-L45 PolarHBondContact O-N 2.76Å; Y42-H46 AromaticContact CZ-CD2 3.73Å; Y42-H46 WeakPolarHBondContact O-CB 3.47Å; Y42-H46 PolarHBondContact O-N 2.74Å; Y42-H46 PolarHBondContact OH-CD2 2.97Å
43	I	86.3	Confident	76.8	Confident	104 Å²	104	98.6 Å²	98.6	53%	0.533	54%	0.541	S	S	.	.	H	α-helix	trans	-62	-45.8	176.5	-67.8	164	0	0	0	110.4	C39 F40 H46 F47	C39-I43 VanDerWaalsContact O-CG1 3.24Å; C39-I43 WeakPolarHBondContact O-CG1 3.44Å; C39-I43 PolarHBondContact O-N 3.17Å; F40-I43 PolarHBondContact O-N 3.12Å; I43-H46 PolarHBondContact O-N 3.26Å; I43-F47 WeakPolarHBondContact O-CB 3.41Å; I43-F47 PolarHBondContact O-N 2.77Å
44	C	83.8	Confident	74.7	Confident	58 Å²	58	102.5 Å²	102.5	39%	0.392	55%	0.55	S	S	.	.	H	α-helix	trans	-61.2	-47.1	177.4	-71.7	0	0	0	0	111.7	F40 I41 F47 S48	F40-C44 WeakPolarHBondContact O-CB 3.39Å; F40-C44 PolarHBondContact O-N 2.98Å; F40-C44 PolarHBondContact O-SG 2.82Å; I41-C44 PolarHBondContact O-N 3Å; C44-F47 PolarHBondContact O-N 3.09Å; C44-S48 WeakPolarHBondContact O-CB 3.3Å; C44-S48 PolarHBondContact O-N 2.98Å; C44-S48 PolarHBondContact O-OG 3.45Å
45	L	80.8	Confident	72.4	Confident	116 Å²	116	106.2 Å²	106.2	61%	0.607	56%	0.564	S	S	*	*	H	α-helix	trans	-64.1	-41.6	177.5	-76.8	169.2	0	0	0	111.9	I41 Y42 A49	I41-L45 HydrophobicContact CG2-CD1 3.72Å; I41-L45 HydrophobicContact CG2-CG 4.31Å; I41-L45 WeakPolarHBondContact O-CB 3.33Å; I41-L45 WeakPolarHBondContact O-CG 3.38Å; I41-L45 PolarHBondContact O-N 3.31Å; Y42-L45 PolarHBondContact O-N 2.76Å; L45-A49 WeakPolarHBondContact O-CB 3.49Å; L45-A49 PolarHBondContact O-N 3.38Å
46	H	76.1	Confident	70.4	Confident	101 Å²	101	112 Å²	112	47%	0.468	58%	0.577	S	S	.	*	H	α-helix	trans	-71.4	-33.7	-179.6	-154.1	-55.8	0	0	0	112.1	Y42 I43 L50	Y42-H46 AromaticContact CZ-CD2 3.73Å; Y42-H46 WeakPolarHBondContact O-CB 3.47Å; Y42-H46 PolarHBondContact O-N 2.74Å; Y42-H46 PolarHBondContact OH-CD2 2.97Å; I43-H46 PolarHBondContact O-N 3.26Å; H46-L50 VanDerWaalsContact O-CD1 3.25Å; H46-L50 WeakPolarHBondContact O-CD1 3.27Å; H46-L50 PolarHBondContact O-N 3.41Å
47	F	68.6	Low	68.8	Low	146 Å²	146	110.4 Å²	110.4	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-77.1	-37.9	175.6	-159	-93.3	0	0	0	111.8	I43 C44 L50 Q51	I43-F47 WeakPolarHBondContact O-CB 3.41Å; I43-F47 PolarHBondContact O-N 2.77Å; C44-F47 PolarHBondContact O-N 3.09Å; F47-L50 WeakPolarHBondContact O-CB 3.39Å; F47-L50 PolarHBondContact O-N 2.83Å; F47-Q51 PolarHBondContact O-N 2.86Å
48	S	61.6	Low	67.8	Low	70 Å²	70	114.1 Å²	114.1	49%	0.49	58%	0.58	S	S	.	*	H	α-helix	trans	-70.1	-32	172.5	-66.5	0	0	0	0	112.5	C44 L50 Q51	C44-S48 WeakPolarHBondContact O-CB 3.3Å; C44-S48 PolarHBondContact O-N 2.98Å; C44-S48 PolarHBondContact O-OG 3.45Å; S48-L50 VanDerWaalsContact C-N 3.26Å; S48-L50 PolarHBondContact O-N 3.39Å; S48-Q51 WeakPolarHBondContact O-CB 3.38Å; S48-Q51 PolarHBondContact O-N 3.21Å
49	A	57.8	Low	67.3	Low	66 Å²	66	113.5 Å²	113.5	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-69.1	-24.4	171	0	0	0	0	0	112.4	L45 V52	L45-A49 WeakPolarHBondContact O-CB 3.49Å; L45-A49 PolarHBondContact O-N 3.38Å; A49-V52 WeakPolarHBondContact O-CG2 3.07Å
50	L	54	Low	67.1	Low	125 Å²	125	110.2 Å²	110.2	65%	0.654	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-15.7	168.7	-104.4	98	0	0	0	113	H46 F47 S48 V52	H46-L50 VanDerWaalsContact O-CD1 3.25Å; H46-L50 WeakPolarHBondContact O-CD1 3.27Å; H46-L50 PolarHBondContact O-N 3.41Å; F47-L50 WeakPolarHBondContact O-CB 3.39Å; F47-L50 PolarHBondContact O-N 2.83Å; S48-L50 VanDerWaalsContact C-N 3.26Å; S48-L50 PolarHBondContact O-N 3.39Å; L50-V52 PolarHBondContact O-N 2.81Å
51	Q	47	Very low	67.3	Low	144 Å²	144	105.8 Å²	105.8	67%	0.673	54%	0.54	S	S	*	.			trans	-85.1	41	169.1	-70.9	-177.9	-28.9	0	0	111.6	F47 S48 S53	F47-Q51 PolarHBondContact O-N 2.86Å; S48-Q51 WeakPolarHBondContact O-CB 3.38Å; S48-Q51 PolarHBondContact O-N 3.21Å; Q51-S53 PolarHBondContact O-N 2.87Å
52	V	48	Very low	67.5	Low	96 Å²	96	102.2 Å²	102.2	58%	0.582	52%	0.521	S	S	*	.			trans	-56.8	115.5	149.8	-175.4	0	0	0	0	104.4	A49 L50 H54	A49-V52 WeakPolarHBondContact O-CG2 3.07Å; L50-V52 PolarHBondContact O-N 2.81Å; V52-H54 PolarHBondContact O-N 2.85Å
53	S	42.5	Very low	67.7	Low	98 Å²	98	98.9 Å²	98.9	69%	0.685	51%	0.51	S	S	*	.			trans	-56.6	87.4	163.7	176.6	0	0	0	0	105.9	Q51 Q55	Q51-S53 PolarHBondContact O-N 2.87Å; S53-Q55 PolarHBondContact O-N 3.16Å
54	H	45.3	Very low	68.2	Low	120 Å²	120	93.9 Å²	93.9	56%	0.556	49%	0.485	S	S	*	.			trans	-65.1	81	156.9	-78.7	-78.6	0	0	0	103.7	V52 Y56	V52-H54 PolarHBondContact O-N 2.85Å; H54-Y56 HydrophobicContact CB-CD1 4.44Å; H54-Y56 HydrophobicContact CB-CD2 3.56Å; H54-Y56 HydrophobicContact CB-CE1 4.26Å; H54-Y56 HydrophobicContact CB-CE2 3.33Å; H54-Y56 HydrophobicContact CB-CG 4.12Å; H54-Y56 AromaticContact CG-CZ 3.92Å; H54-Y56 VanDerWaalsContact O-CD2 3.26Å; H54-Y56 WeakPolarHBondContact O-CD2 3.49Å; H54-Y56 PolarHBondContact O-N 2.91Å
55	Q	45.6	Very low	68.7	Low	177 Å²	177	94.5 Å²	94.5	83%	0.827	48%	0.482	S	S	*	.			trans	-64.7	75.6	153.7	-161.5	162.5	-1.7	0	0	103.4	S53 P57	S53-Q55 PolarHBondContact O-N 3.16Å; Q55-P57 VanDerWaalsContact O-N 3.14Å
56	Y	49.3	Very low	69.4	Low	155 Å²	155	89 Å²	89	61%	0.608	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-52.3	126	179.4	-80	-81.8	0	0	0	104.8	H54 R58	H54-Y56 HydrophobicContact CB-CD1 4.44Å; H54-Y56 HydrophobicContact CB-CD2 3.56Å; H54-Y56 HydrophobicContact CB-CE1 4.26Å; H54-Y56 HydrophobicContact CB-CE2 3.33Å; H54-Y56 HydrophobicContact CB-CG 4.12Å; H54-Y56 AromaticContact CG-CZ 3.92Å; H54-Y56 VanDerWaalsContact O-CD2 3.26Å; H54-Y56 WeakPolarHBondContact O-CD2 3.49Å; H54-Y56 PolarHBondContact O-N 2.91Å; Y56-R58 PolarHBondContact O-N 2.8Å; Y56-R58 VanDerWaalsContact O-N 3.07Å
57	P	59.6	Low	70.2	Confident	78 Å²	78	88.1 Å²	88.1	51%	0.506	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-50.5	128	172.9	19.9	-29.2	0	0	0	106.6	Q55 I59	Q55-P57 VanDerWaalsContact O-N 3.14Å; P57-I59 PolarHBondContact O-N 2.99Å; P57-I59 VanDerWaalsContact O-N 3.08Å
58	R	71.1	Confident	71.3	Confident	184 Å²	184	86.3 Å²	86.3	69%	0.694	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-54.6	122	-171.7	-161	-174.6	-179.3	-166.4	4.6	107	Y56 Q60 I85	Y56-R58 PolarHBondContact O-N 2.8Å; Y56-R58 VanDerWaalsContact O-N 3.07Å; R58-Q60 PolarHBondContact O-N 3.36Å; R58-I85 HydrophobicContact CB-CD1 3.56Å; R58-I85 HydrophobicContact CG-CD1 3.52Å; R58-I85 HydrophobicContact CG-CG1 4.47Å; R58-I85 WeakPolarHBondContact O-CD1 3.25Å
59	I	79.6	Confident	72.8	Confident	94 Å²	94	85.7 Å²	85.7	48%	0.482	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-55.6	124.5	-171	-64.8	171.9	0	0	0	109.2	P57 S61 I85 I173	P57-I59 PolarHBondContact O-N 2.99Å; P57-I59 VanDerWaalsContact O-N 3.08Å; I59-S61 PolarHBondContact O-N 2.81Å; I59-S61 PolarHBondContact O-OG 2.89Å; I59-I85 WeakPolarHBondContact O-CD1 3.36Å; I59-I173 HydrophobicContact CG2-CG2 4.25Å
60	Q	86.6	Confident	74.4	Confident	7 Å²	7	86.2 Å²	86.2	3%	0.033	43%	0.426	C	S	.	.			trans	-62.8	110.8	174.9	-67.1	-73.6	-12.9	0	0	108.5	R58 I85 M86 C97 H174	R58-Q60 PolarHBondContact O-N 3.36Å; Q60-I85 VanDerWaalsContact CD-CG2 3.48Å; Q60-I85 VanDerWaalsContact OE1-CG2 3.25Å; Q60-M86 HydrophobicContact CB-CG 4.05Å; Q60-M86 HydrophobicContact CB-SD 3.98Å; Q60-C97 HydrophobicContact CG-CB 4.32Å; Q60-C97 VanDerWaalsContact CG-SG 3.54Å; Q60-H174 HydrophobicContact CB-CB 3.75Å; Q60-H174 VanDerWaalsContact O-CB 3.31Å; Q60-H174 WeakPolarHBondContact O-CB 3.28Å; Q60-H174 PolarHBondContact O-N 2.91Å
61	S	91.4	Very high	75.8	Confident	51 Å²	51	88.5 Å²	88.5	36%	0.357	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	149.9	176.5	57.3	0	0	0	0	110.4	I59 L172	I59-S61 PolarHBondContact O-N 2.81Å; I59-S61 PolarHBondContact O-OG 2.89Å; S61-L172 WeakPolarHBondContact CA-O 3.48Å
62	I	93.5	Very high	77.7	Confident	5 Å²	5	90.8 Å²	90.8	3%	0.026	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	143.9	175.7	-170.1	164.7	0	0	0	110.4	V64 E84 M86 V88 V93 I171 L172	I62-V64 HydrophobicContact CD1-CG2 3.73Å; I62-V64 HydrophobicContact CG1-CG2 3.67Å; I62-V64 HydrophobicContact CG2-CG2 4.39Å; I62-E84 WeakPolarHBondContact CG1-OE2 3.41Å; I62-M86 HydrophobicContact CB-CB 3.95Å; I62-M86 HydrophobicContact CB-SD 4.3Å; I62-M86 HydrophobicContact CD1-CB 4.28Å; I62-M86 HydrophobicContact CG2-CB 4.18Å; I62-M86 HydrophobicContact CG2-CE 4.14Å; I62-M86 HydrophobicContact CG2-SD 3.94Å; I62-V88 HydrophobicContact CD1-CG2 3.88Å; I62-V93 HydrophobicContact CG2-CG1 3.69Å; I62-V93 HydrophobicContact CG2-CG2 4.33Å; I62-I171 WeakPolarHBondContact O-CA 3.36Å; I62-L172 HydrophobicContact CG2-CB 4.07Å; I62-L172 HydrophobicContact CG2-CD1 4.38Å; I62-L172 PolarHBondContact N-O 2.89Å; I62-L172 PolarHBondContact O-N 3.35Å
63	K	94.4	Very high	79.6	Confident	81 Å²	81	91.6 Å²	91.6	35%	0.352	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	116.2	167.7	171.4	169.9	159.6	159	0	108.2	E169 I171	K63-E169 WeakPolarHBondContact CE-OE2 3.24Å; K63-E169 HydrophobicContact CG-CG 4.4Å; K63-E169 IonicContact NZ-OE2 2.63Å; K63-E169 PolarHBondContact NZ-OE2 3.44Å; K63-I171 HydrophobicContact CB-CG1 4.16Å; K63-I171 HydrophobicContact CD-CD1 4.38Å; K63-I171 HydrophobicContact CD-CG1 4.38Å; K63-I171 HydrophobicContact CG-CG1 4.03Å
64	V	94.9	Very high	82	Confident	0 Å²	0	87.6 Å²	87.6	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.3	-179.1	-176.3	0	0	0	0	108.8	I62 L77 T78 V88 V93 E169 L170	I62-V64 HydrophobicContact CD1-CG2 3.73Å; I62-V64 HydrophobicContact CG1-CG2 3.67Å; I62-V64 HydrophobicContact CG2-CG2 4.39Å; V64-L77 HydrophobicContact CG1-CB 3.55Å; V64-L77 HydrophobicContact CG1-CD1 4.36Å; V64-L77 HydrophobicContact CG1-CD2 3.88Å; V64-L77 HydrophobicContact CG1-CG 4.1Å; V64-T78 CarbonylContact C-O 3.58Å; V64-T78 WeakPolarHBondContact CA-O 3.22Å; V64-T78 WeakPolarHBondContact CG1-O 3.32Å; V64-V88 HydrophobicContact CG1-CG2 4.31Å; V64-V88 HydrophobicContact CG2-CG2 3.8Å; V64-V93 HydrophobicContact CG2-CG2 3.81Å; V64-E169 WeakPolarHBondContact O-CA 3.49Å; V64-L170 HydrophobicContact CB-CB 4.44Å; V64-L170 PolarHBondContact N-O 3.5Å; V64-L170 PolarHBondContact O-N 3.25Å
65	Q	96.1	Very high	84.4	Confident	70 Å²	70	82 Å²	82	33%	0.327	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	147.8	169	-65.4	-174.1	-45.8	0	0	110	T78 G168	Q65-T78 PolarHBondContact N-O 2.89Å; Q65-T78 PolarHBondContact O-N 2.91Å; Q65-T78 PolarHBondContact O-OG1 2.92Å; Q65-G168 WeakPolarHBondContact CA-O 3.34Å
66	F	95.3	Very high	86.8	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	118.8	174.3	59	-92.5	0	0	0	109.5	F75 I76 L77 L105 K106 F109 L151 V165 G168 L170	F66-F75 HydrophobicContact CB-CB 4.12Å; F66-F75 HydrophobicContact CD2-CB 4.1Å; F66-F75 HydrophobicContact CD2-CD1 4.25Å; F66-F75 HydrophobicContact CD2-CG 4.06Å; F66-F75 HydrophobicContact CG-CB 4.47Å; F66-I76 WeakPolarHBondContact CA-O 3.19Å; F66-L77 HydrophobicContact CB-CD2 3.82Å; F66-L77 HydrophobicContact CD1-CD2 4.11Å; F66-L77 HydrophobicContact CG-CD2 4.26Å; F66-L105 HydrophobicContact CE1-CD1 3.57Å; F66-L105 HydrophobicContact CZ-CD1 3.7Å; F66-K106 WeakPolarHBondContact CZ-O 3.39Å; F66-F109 HydrophobicContact CE2-CZ 4.42Å; F66-L151 HydrophobicContact CD1-CD2 4.13Å; F66-L151 HydrophobicContact CD2-CD2 3.84Å; F66-L151 HydrophobicContact CE1-CD2 3.99Å; F66-L151 HydrophobicContact CE2-CD2 3.72Å; F66-L151 HydrophobicContact CG-CD2 4.07Å; F66-L151 HydrophobicContact CZ-CD2 3.81Å; F66-V165 HydrophobicContact CD2-CG1 3.95Å; F66-V165 HydrophobicContact CE2-CG1 4.19Å; F66-V165 HydrophobicContact CE2-CG2 4.16Å; F66-V165 WeakPolarHBondContact O-CG1 3.3Å; F66-G168 VanDerWaalsContact CE1-C 3.5Å; F66-G168 PolarHBondContact N-O 2.7Å; F66-G168 VanDerWaalsContact N-O 3.17Å; F66-G168 WeakPolarHBondContact O-CA 3.42Å; F66-L170 HydrophobicContact CD1-CB 4.5Å; F66-L170 HydrophobicContact CE1-CB 4.23Å
67	T	92.2	Very high	89	Confident	84 Å²	84	67.8 Å²	67.8	52%	0.515	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	-43.9	-172.4	50.3	0	0	0	0	111.4
68	E	92.4	Very high	90.6	Very high	108 Å²	108	67.2 Å²	67.2	51%	0.505	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	132.2	175.5	-172.8	-174.9	163.4	0	0	110.8	K70 F75 I76	E68-K70 WeakPolarHBondContact OE1-CE 3.35Å; E68-F75 CarbonylContact O-C 3.58Å; E68-F75 VanDerWaalsContact O-CA 3.31Å; E68-F75 WeakPolarHBondContact O-CA 3.45Å; E68-I76 HydrophobicContact CB-CB 4.48Å; E68-I76 HydrophobicContact CB-CG1 4.41Å; E68-I76 HydrophobicContact CG-CG1 4.46Å; E68-I76 PolarHBondContact O-N 2.03Å
69	Y	92.3	Very high	91.3	Very high	56 Å²	56	60.8 Å²	60.8	22%	0.22	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.4	172.6	-176.9	-96.8	0	0	0	110.6	F75 L160 F163	Y69-F75 HydrophobicContact CD2-CD1 4.27Å; Y69-F75 AromaticContact CD2-CD2 3.81Å; Y69-F75 HydrophobicContact CD2-CD2 3.81Å; Y69-F75 HydrophobicContact CD2-CE1 4.32Å; Y69-F75 AromaticContact CD2-CE2 3.87Å; Y69-F75 HydrophobicContact CD2-CE2 3.87Å; Y69-F75 HydrophobicContact CD2-CG 4Å; Y69-F75 HydrophobicContact CD2-CZ 4.13Å; Y69-F75 HydrophobicContact CE2-CD2 4.42Å; Y69-F75 HydrophobicContact CE2-CE2 4.49Å; Y69-L160 HydrophobicContact CD1-CD2 4.3Å; Y69-L160 HydrophobicContact CE1-CD1 4.25Å; Y69-L160 HydrophobicContact CE1-CD2 3.78Å; Y69-F163 AromaticContact CD1-CD1 3.62Å; Y69-F163 HydrophobicContact CD1-CD1 3.62Å; Y69-F163 HydrophobicContact CD1-CE1 4.01Å; Y69-F163 AromaticContact CD2-CD1 3.91Å; Y69-F163 HydrophobicContact CD2-CD1 3.91Å; Y69-F163 AromaticContact CD2-CE1 3.46Å; Y69-F163 HydrophobicContact CD2-CE1 3.46Å; Y69-F163 VanDerWaalsContact CD2-CE1 3.46Å; Y69-F163 AromaticContact CE1-CD1 3.96Å; Y69-F163 HydrophobicContact CE1-CD1 3.96Å; Y69-F163 HydrophobicContact CE1-CE1 4.13Å; Y69-F163 HydrophobicContact CE2-CD1 4.23Å; Y69-F163 AromaticContact CE2-CE1 3.6Å; Y69-F163 HydrophobicContact CE2-CE1 3.6Å; Y69-F163 AromaticContact CG-CD1 3.58Å; Y69-F163 HydrophobicContact CG-CD1 3.58Å; Y69-F163 AromaticContact CG-CE1 3.66Å; Y69-F163 HydrophobicContact CG-CE1 3.66Å; Y69-F163 AromaticContact CZ-CE1 3.94Å
70	K	90.8	Very high	90.9	Very high	77 Å²	77	62 Å²	62	34%	0.335	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.4	172	-65.5	-171.2	-164.4	161.7	0	110.2	E68 E72 E73 G74 I76	E68-K70 WeakPolarHBondContact OE1-CE 3.35Å; K70-E72 PolarHBondContact O-N 3.33Å; K70-E72 VanDerWaalsContact O-N 3.1Å; K70-E73 HydrophobicContact CB-CB 4.14Å; K70-E73 WeakPolarHBondContact CD-OE2 3.33Å; K70-E73 IonicContact NZ-OE2 3.16Å; K70-E73 PolarHBondContact NZ-OE2 2.89Å; K70-E73 VanDerWaalsContact NZ-OE2 3.16Å; K70-E73 PolarHBondContact O-N 2.88Å; K70-G74 PolarHBondContact N-O 2.9Å; K70-G74 WeakPolarHBondContact O-CA 3.38Å; K70-G74 PolarHBondContact O-N 3.02Å; K70-I76 HydrophobicContact CB-CD1 4.32Å; K70-I76 HydrophobicContact CD-CD1 3.92Å; K70-I76 HydrophobicContact CD-CG1 4.17Å; K70-I76 HydrophobicContact CG-CD1 4.07Å; K70-I76 HydrophobicContact CG-CG1 4.07Å
71	K	84.8	Confident	90	Very high	173 Å²	173	68.4 Å²	68.4	75%	0.752	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-37.1	-173.4	-172.7	176.8	179.5	-179.7	0	114.4	L160	K71-L160 HydrophobicContact CB-CD1 4.42Å; K71-L160 HydrophobicContact CD-CD1 4.36Å; K71-L160 HydrophobicContact CG-CD1 4.12Å
72	E	86.3	Confident	88.4	Confident	193 Å²	193	75.6 Å²	75.6	90%	0.902	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-23	-177.5	-62.6	-175.4	179	0	0	113.6	K70	K70-E72 PolarHBondContact O-N 3.33Å; K70-E72 VanDerWaalsContact O-N 3.1Å
73	E	88.5	Confident	86.9	Confident	113 Å²	113	81.9 Å²	81.9	53%	0.528	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-14.4	-173.1	-61.9	175.6	-174	0	0	113.3	K70 I76 N91	K70-E73 HydrophobicContact CB-CB 4.14Å; K70-E73 WeakPolarHBondContact CD-OE2 3.33Å; K70-E73 IonicContact NZ-OE2 3.16Å; K70-E73 PolarHBondContact NZ-OE2 2.89Å; K70-E73 VanDerWaalsContact NZ-OE2 3.16Å; K70-E73 PolarHBondContact O-N 2.88Å; E73-I76 HydrophobicContact CB-CD1 3.86Å; E73-I76 VanDerWaalsContact OE2-CD1 3.32Å; E73-I76 WeakPolarHBondContact OE2-CD1 3.21Å; E73-N91 PolarHBondContact O-ND2 3.06Å; E73-N91 VanDerWaalsContact O-ND2 3.15Å
74	G	92.7	Very high	85.8	Confident	14 Å²	14	79.5 Å²	79.5	14%	0.144	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	78	-154	-172.1	0	0	0	0	0	112.8	K70	K70-G74 PolarHBondContact N-O 2.9Å; K70-G74 WeakPolarHBondContact O-CA 3.38Å; K70-G74 PolarHBondContact O-N 3.02Å
75	F	95.3	Very high	85.2	Confident	1 Å²	1	81.6 Å²	81.6	0%	0.004	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	132.3	174.2	-82.5	-72.4	0	0	0	111.1	F66 E68 Y69 N91 F109 V153 F163 V165	F66-F75 HydrophobicContact CB-CB 4.12Å; F66-F75 HydrophobicContact CD2-CB 4.1Å; F66-F75 HydrophobicContact CD2-CD1 4.25Å; F66-F75 HydrophobicContact CD2-CG 4.06Å; F66-F75 HydrophobicContact CG-CB 4.47Å; E68-F75 CarbonylContact O-C 3.58Å; E68-F75 VanDerWaalsContact O-CA 3.31Å; E68-F75 WeakPolarHBondContact O-CA 3.45Å; Y69-F75 HydrophobicContact CD2-CD1 4.27Å; Y69-F75 AromaticContact CD2-CD2 3.81Å; Y69-F75 HydrophobicContact CD2-CD2 3.81Å; Y69-F75 HydrophobicContact CD2-CE1 4.32Å; Y69-F75 AromaticContact CD2-CE2 3.87Å; Y69-F75 HydrophobicContact CD2-CE2 3.87Å; Y69-F75 HydrophobicContact CD2-CG 4Å; Y69-F75 HydrophobicContact CD2-CZ 4.13Å; Y69-F75 HydrophobicContact CE2-CD2 4.42Å; Y69-F75 HydrophobicContact CE2-CE2 4.49Å; F75-N91 PolarHBondContact O-ND2 3Å; F75-N91 PolarHBondContact O-OD1 3.03Å; F75-F109 HydrophobicContact CD2-CE1 4.37Å; F75-F109 HydrophobicContact CE2-CD1 4.01Å; F75-F109 AromaticContact CE2-CE1 3.63Å; F75-F109 HydrophobicContact CE2-CE1 3.63Å; F75-F109 HydrophobicContact CZ-CD1 4.07Å; F75-F109 HydrophobicContact CZ-CE1 4.01Å; F75-V153 HydrophobicContact CD2-CB 3.78Å; F75-V153 HydrophobicContact CD2-CG1 4.25Å; F75-V153 HydrophobicContact CD2-CG2 3.74Å; F75-V153 HydrophobicContact CE2-CB 3.97Å; F75-V153 HydrophobicContact CE2-CG1 3.91Å; F75-V153 HydrophobicContact CE2-CG2 4.17Å; F75-F163 AromaticContact CE2-CE1 3.66Å; F75-F163 HydrophobicContact CE2-CE1 3.66Å; F75-F163 AromaticContact CE2-CZ 3.56Å; F75-F163 HydrophobicContact CE2-CZ 3.56Å; F75-F163 HydrophobicContact CZ-CD1 4.33Å; F75-F163 AromaticContact CZ-CE1 3.64Å; F75-F163 HydrophobicContact CZ-CE1 3.64Å; F75-F163 HydrophobicContact CZ-CE2 4.29Å; F75-F163 AromaticContact CZ-CZ 3.63Å; F75-F163 HydrophobicContact CZ-CZ 3.63Å; F75-V165 HydrophobicContact CD1-CG1 3.85Å; F75-V165 HydrophobicContact CE1-CB 3.89Å; F75-V165 HydrophobicContact CE1-CG1 3.36Å; F75-V165 HydrophobicContact CZ-CB 3.9Å; F75-V165 HydrophobicContact CZ-CG1 3.88Å
76	I	95.6	Very high	84.9	Confident	26 Å²	26	78.3 Å²	78.3	13%	0.133	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.6	-177.6	-51.7	-54.5	0	0	0	110.5	F66 E68 K70 E73 T78 N91	F66-I76 WeakPolarHBondContact CA-O 3.19Å; E68-I76 HydrophobicContact CB-CB 4.48Å; E68-I76 HydrophobicContact CB-CG1 4.41Å; E68-I76 HydrophobicContact CG-CG1 4.46Å; E68-I76 PolarHBondContact O-N 2.03Å; K70-I76 HydrophobicContact CB-CD1 4.32Å; K70-I76 HydrophobicContact CD-CD1 3.92Å; K70-I76 HydrophobicContact CD-CG1 4.17Å; K70-I76 HydrophobicContact CG-CD1 4.07Å; K70-I76 HydrophobicContact CG-CG1 4.07Å; E73-I76 HydrophobicContact CB-CD1 3.86Å; E73-I76 VanDerWaalsContact OE2-CD1 3.32Å; E73-I76 WeakPolarHBondContact OE2-CD1 3.21Å; I76-T78 HydrophobicContact CG2-CG2 4.31Å; I76-N91 WeakPolarHBondContact CA-OD1 3.47Å
77	L	95	Very high	84.8	Confident	9 Å²	9	85 Å²	85	5%	0.047	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	120.7	174.9	-66.6	-162.7	0	0	0	110	V64 F66 V88 N91 V93	V64-L77 HydrophobicContact CG1-CB 3.55Å; V64-L77 HydrophobicContact CG1-CD1 4.36Å; V64-L77 HydrophobicContact CG1-CD2 3.88Å; V64-L77 HydrophobicContact CG1-CG 4.1Å; F66-L77 HydrophobicContact CB-CD2 3.82Å; F66-L77 HydrophobicContact CD1-CD2 4.11Å; F66-L77 HydrophobicContact CG-CD2 4.26Å; L77-V88 HydrophobicContact CB-CG1 3.83Å; L77-N91 WeakPolarHBondContact CB-OD1 3.33Å; L77-N91 WeakPolarHBondContact CD1-O 3.16Å; L77-N91 WeakPolarHBondContact CG-OD1 3.4Å; L77-N91 PolarHBondContact N-OD1 2.85Å; L77-V93 HydrophobicContact CD1-CG2 4.45Å
78	T	92.9	Very high	84.9	Confident	65 Å²	65	82.9 Å²	82.9	40%	0.399	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.7	177.9	54.7	0	0	0	0	110.2	V64 Q65 I76	V64-T78 CarbonylContact C-O 3.58Å; V64-T78 WeakPolarHBondContact CA-O 3.22Å; V64-T78 WeakPolarHBondContact CG1-O 3.32Å; Q65-T78 PolarHBondContact N-O 2.89Å; Q65-T78 PolarHBondContact O-N 2.91Å; Q65-T78 PolarHBondContact O-OG1 2.92Å; I76-T78 HydrophobicContact CG2-CG2 4.31Å
79	S	86.8	Confident	84.9	Confident	49 Å²	49	83.1 Å²	83.1	34%	0.343	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	147.8	172.1	62	0	0	0	0	110.7	E84	S79-E84 VanDerWaalsContact CB-OE2 3.25Å; S79-E84 WeakPolarHBondContact CB-OE2 3.43Å
80	Q	71.9	Confident	85	Confident	120 Å²	120	87 Å²	87	56%	0.561	43%	0.425	S	S	*	.	S	Bend	trans	-85.8	-11.9	-171.9	-71.7	-172.5	-13.2	0	0	114.2
81	K	67.8	Low	85.2	Confident	141 Å²	141	84.9 Å²	84.9	61%	0.613	42%	0.418	S	S	*	.			trans	-131.2	132.4	-169.6	-63.1	-179.5	-179.2	179.9	0	112.1	D83 E84	K81-D83 VanDerWaalsContact C-N 3.28Å; K81-D83 PolarHBondContact O-N 2.94Å; K81-E84 HydrophobicContact CB-CG 3.84Å; K81-E84 HydrophobicContact CD-CG 4.48Å
82	E	57.2	Low	85.7	Confident	202 Å²	202	77 Å²	77	94%	0.944	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.5	175.8	-71.5	171.6	158.1	0	0	112.7
83	D	61.2	Low	86.2	Confident	137 Å²	137	67.8 Å²	67.8	73%	0.733	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	22.8	-177.5	-64.6	-35	0	0	0	114.5	K81	K81-D83 VanDerWaalsContact C-N 3.28Å; K81-D83 PolarHBondContact O-N 2.94Å
84	E	71.3	Confident	86.5	Confident	32 Å²	32	63.6 Å²	63.6	15%	0.15	32%	0.322	C	S	.	.			trans	-73.5	136.2	175.1	-88.2	168.5	-168.9	0	0	111.7	I62 S79 K81 M86	I62-E84 WeakPolarHBondContact CG1-OE2 3.41Å; S79-E84 VanDerWaalsContact CB-OE2 3.25Å; S79-E84 WeakPolarHBondContact CB-OE2 3.43Å; K81-E84 HydrophobicContact CB-CG 3.84Å; K81-E84 HydrophobicContact CD-CG 4.48Å; E84-M86 CarbonylContact C-O 3.56Å; E84-M86 WeakPolarHBondContact CB-O 3.34Å
85	I	83.5	Confident	86.7	Confident	44 Å²	44	63 Å²	63	23%	0.226	32%	0.315	C	S	.	.	S	Bend	trans	-70.6	-40.1	-176	-47.4	163.4	0	0	0	110.1	R58 I59 Q60 N96 L183	R58-I85 HydrophobicContact CB-CD1 3.56Å; R58-I85 HydrophobicContact CG-CD1 3.52Å; R58-I85 HydrophobicContact CG-CG1 4.47Å; R58-I85 WeakPolarHBondContact O-CD1 3.25Å; I59-I85 WeakPolarHBondContact O-CD1 3.36Å; Q60-I85 VanDerWaalsContact CD-CG2 3.48Å; Q60-I85 VanDerWaalsContact OE1-CG2 3.25Å; I85-N96 PolarHBondContact O-ND2 2.78Å; I85-L183 HydrophobicContact CG2-CD2 4.33Å
86	M	90.3	Very high	86.6	Confident	1 Å²	1	64 Å²	64	1%	0.005	32%	0.321	C	S	.	.	S	Bend	trans	-88.1	146	170.2	-62.2	179.7	74.5	0	0	108.7	Q60 I62 E84 V93 I95 Y101 L172	Q60-M86 HydrophobicContact CB-CG 4.05Å; Q60-M86 HydrophobicContact CB-SD 3.98Å; I62-M86 HydrophobicContact CB-CB 3.95Å; I62-M86 HydrophobicContact CB-SD 4.3Å; I62-M86 HydrophobicContact CD1-CB 4.28Å; I62-M86 HydrophobicContact CG2-CB 4.18Å; I62-M86 HydrophobicContact CG2-CE 4.14Å; I62-M86 HydrophobicContact CG2-SD 3.94Å; E84-M86 CarbonylContact C-O 3.56Å; E84-M86 WeakPolarHBondContact CB-O 3.34Å; M86-V93 HydrophobicContact CE-CG1 3.6Å; M86-I95 HydrophobicContact CE-CD1 3.68Å; M86-Y101 HydrophobicContact CE-CE1 3.99Å; M86-Y101 HydrophobicContact SD-CE1 4.28Å; M86-L172 HydrophobicContact CE-CB 4.42Å; M86-L172 HydrophobicContact CE-CD2 4.4Å
87	K	92.3	Very high	86.4	Confident	141 Å²	141	62.8 Å²	62.8	61%	0.613	32%	0.315	S	S	*	.			trans	-122.2	148.3	-175.7	-65.3	179.6	-179.4	173.8	0	111	I94	K87-I94 PolarHBondContact O-N 3.49Å
88	V	93.9	Very high	86.3	Confident	39 Å²	39	64.3 Å²	64.3	24%	0.236	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	124.6	164.2	-176.9	0	0	0	0	108.3	I62 V64 L77 S92 V93	I62-V88 HydrophobicContact CD1-CG2 3.88Å; V64-V88 HydrophobicContact CG1-CG2 4.31Å; V64-V88 HydrophobicContact CG2-CG2 3.8Å; L77-V88 HydrophobicContact CB-CG1 3.83Å; V88-S92 CarbonylContact C-O 3.54Å; V88-S92 VanDerWaalsContact CA-O 3.27Å; V88-S92 WeakPolarHBondContact CA-O 3.41Å; V88-V93 HydrophobicContact CG2-CG2 4.37Å
89	Q	93.8	Very high	86.4	Confident	113 Å²	113	61.8 Å²	61.8	53%	0.528	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	134.1	174.7	-173	-179.6	13.5	0	0	109.4	N91 S92 I94	Q89-N91 VanDerWaalsContact C-N 3.29Å; Q89-N91 PolarHBondContact O-N 2.89Å; Q89-S92 PolarHBondContact N-O 3.44Å; Q89-S92 PolarHBondContact O-N 3.2Å; Q89-S92 VanDerWaalsContact O-O 3.1Å; Q89-S92 PolarHBondContact O-OG 3.45Å; Q89-I94 HydrophobicContact CB-CD1 4.07Å; Q89-I94 HydrophobicContact CB-CG1 3.89Å
90	N	93.4	Very high	86.9	Confident	137 Å²	137	64.5 Å²	64.5	73%	0.733	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	47.2	-179.4	-56.8	-20	0	0	0	112.8	S92	N90-S92 PolarHBondContact O-N 2.63Å
91	N	95.3	Very high	88.1	Confident	33 Å²	33	58.8 Å²	58.8	18%	0.176	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	28.8	-177.8	-153	31.9	0	0	0	115.1	E73 F75 I76 L77 Q89	E73-N91 PolarHBondContact O-ND2 3.06Å; E73-N91 VanDerWaalsContact O-ND2 3.15Å; F75-N91 PolarHBondContact O-ND2 3Å; F75-N91 PolarHBondContact O-OD1 3.03Å; I76-N91 WeakPolarHBondContact CA-OD1 3.47Å; L77-N91 WeakPolarHBondContact CB-OD1 3.33Å; L77-N91 WeakPolarHBondContact CD1-O 3.16Å; L77-N91 WeakPolarHBondContact CG-OD1 3.4Å; L77-N91 PolarHBondContact N-OD1 2.85Å; Q89-N91 VanDerWaalsContact C-N 3.29Å; Q89-N91 PolarHBondContact O-N 2.89Å
92	S	95.9	Very high	89.5	Confident	7 Å²	7	54.4 Å²	54.4	5%	0.049	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	148.8	179	69.4	0	0	0	0	111.5	V88 Q89 N90 V149	V88-S92 CarbonylContact C-O 3.54Å; V88-S92 VanDerWaalsContact CA-O 3.27Å; V88-S92 WeakPolarHBondContact CA-O 3.41Å; Q89-S92 PolarHBondContact N-O 3.44Å; Q89-S92 PolarHBondContact O-N 3.2Å; Q89-S92 VanDerWaalsContact O-O 3.1Å; Q89-S92 PolarHBondContact O-OG 3.45Å; N90-S92 PolarHBondContact O-N 2.63Å; S92-V149 CarbonylContact C-O 3.33Å; S92-V149 WeakPolarHBondContact CA-O 3.36Å
93	V	96.1	Very high	91.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	123.8	172	176.2	0	0	0	0	109	I62 V64 L77 M86 V88 K148 V149 L172	I62-V93 HydrophobicContact CG2-CG1 3.69Å; I62-V93 HydrophobicContact CG2-CG2 4.33Å; V64-V93 HydrophobicContact CG2-CG2 3.81Å; L77-V93 HydrophobicContact CD1-CG2 4.45Å; M86-V93 HydrophobicContact CE-CG1 3.6Å; V88-V93 HydrophobicContact CG2-CG2 4.37Å; V93-K148 CarbonylContact O-C 3.55Å; V93-K148 WeakPolarHBondContact O-CA 3.42Å; V93-V149 HydrophobicContact CB-CB 4.29Å; V93-V149 PolarHBondContact N-O 2.89Å; V93-V149 PolarHBondContact O-N 3.32Å; V93-L172 HydrophobicContact CG1-CD2 4.12Å; V93-L172 HydrophobicContact CG2-CD1 4.46Å
94	I	95.4	Very high	93.2	Very high	25 Å²	25	39.1 Å²	39.1	13%	0.128	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.3	-179.8	-53.6	-54.1	0	0	0	110.5	K87 Q89 K148	K87-I94 PolarHBondContact O-N 3.49Å; Q89-I94 HydrophobicContact CB-CD1 4.07Å; Q89-I94 HydrophobicContact CB-CG1 3.89Å; I94-K148 HydrophobicContact CD1-CD 4.02Å; I94-K148 HydrophobicContact CD1-CG 3.83Å
95	I	95.4	Very high	94.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-88.2	116	174.6	-55.4	-55.5	0	0	0	109.5	M86 C97 Y101 L143 T144 K146 D147 V149 L172	M86-I95 HydrophobicContact CE-CD1 3.68Å; I95-C97 WeakPolarHBondContact CG2-O 3.38Å; I95-Y101 HydrophobicContact CD1-CE1 4.29Å; I95-Y101 HydrophobicContact CG2-CE2 3.94Å; I95-L143 HydrophobicContact CD1-CD1 3.7Å; I95-L143 HydrophobicContact CG1-CB 4.31Å; I95-L143 HydrophobicContact CG1-CD1 3.94Å; I95-L143 HydrophobicContact CG2-CB 4.05Å; I95-T144 WeakPolarHBondContact CG2-O 3.25Å; I95-K146 PolarHBondContact O-N 3.47Å; I95-D147 HydrophobicContact CB-CB 4.04Å; I95-D147 WeakPolarHBondContact CB-O 3.43Å; I95-D147 HydrophobicContact CG1-CB 3.87Å; I95-D147 WeakPolarHBondContact CG1-O 3.14Å; I95-D147 PolarHBondContact N-O 3.36Å; I95-V149 HydrophobicContact CD1-CG2 4Å; I95-V149 HydrophobicContact CG1-CG2 4.13Å; I95-L172 HydrophobicContact CD1-CD2 3.9Å
96	N	92.7	Very high	95.1	Very high	22 Å²	22	39.4 Å²	39.4	12%	0.118	20%	0.197	C	C	.	.			trans	-94.9	-22.3	-177.5	-67.1	-25.7	0	0	0	113.1	I85 C181 V182	I85-N96 PolarHBondContact O-ND2 2.78Å; N96-C181 CarbonylContact O-C 3.51Å; N96-C181 WeakPolarHBondContact O-CA 3.5Å; N96-V182 WeakPolarHBondContact CB-O 3.3Å; N96-V182 PolarHBondContact O-N 3.32Å
97	C	92.3	Very high	95.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.007	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-130.9	147	-173.7	-60.8	0	0	0	0	111.5	Q60 I95 Y101 F180 C181	Q60-C97 HydrophobicContact CG-CB 4.32Å; Q60-C97 VanDerWaalsContact CG-SG 3.54Å; I95-C97 WeakPolarHBondContact CG2-O 3.38Å; C97-Y101 WeakPolarHBondContact O-CE2 3.33Å; C97-Y101 PolarHBondContact O-OH 2.82Å; C97-F180 CarbonylContact C-O 3.46Å; C97-F180 WeakPolarHBondContact CA-O 3.45Å; C97-C181 HydrophobicContact CB-CB 4.1Å; C97-C181 WeakPolarHBondContact CB-SG 3.13Å; C97-C181 WeakPolarHBondContact SG-CB 3.44Å; C97-C181 CovalentContact SG-SG 2.03Å; C97-C181 PolarHBondContact SG-SG 2.81Å
98	D	93.9	Very high	95.8	Very high	42 Å²	42	39.2 Å²	39.2	23%	0.225	19%	0.193	C	C	.	.			trans	-75.5	149.6	173	-64.5	-4.4	0	0	0	110.6	L143 T144 Y145 H174 E179 F180	D98-L143 CarbonylContact C-O 3.56Å; D98-L143 WeakPolarHBondContact CA-O 3.38Å; D98-T144 VanDerWaalsContact OD1-CA 3.24Å; D98-T144 WeakPolarHBondContact OD1-CA 3.37Å; D98-Y145 PolarHBondContact OD1-N 2.82Å; D98-H174 PolarHBondContact O-NE2 2.82Å; D98-E179 HydrophobicContact CB-CB 4.48Å; D98-E179 WeakPolarHBondContact O-CB 3.28Å; D98-F180 PolarHBondContact N-O 2.71Å
99	G	94.8	Very high	95.9	Very high	11 Å²	11	38 Å²	38	11%	0.113	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	134.9	-167.2	168.4	0	0	0	0	0	113.8	Y101 L143	G99-Y101 WeakPolarHBondContact O-CD2 3.39Å; G99-L143 PolarHBondContact N-O 2.98Å; G99-L143 PolarHBondContact O-N 2.84Å
100	F	96.4	Very high	95.9	Very high	107 Å²	107	34.8 Å²	34.8	47%	0.469	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.1	178.7	-61.6	-68.7	0	0	0	111.2	V140 A141 Q175 N176	F100-V140 HydrophobicContact CB-CG1 3.92Å; F100-V140 HydrophobicContact CD1-CG1 4.16Å; F100-V140 HydrophobicContact CG-CG1 4.35Å; F100-A141 CarbonylContact C-O 3.56Å; F100-A141 WeakPolarHBondContact CA-O 3.4Å; F100-Q175 HydrophobicContact CB-CB 4.36Å; F100-Q175 WeakPolarHBondContact O-CB 3.39Å; F100-Q175 PolarHBondContact O-N 3.04Å; F100-N176 WeakPolarHBondContact CA-OD1 3.27Å; F100-N176 VanDerWaalsContact CB-OD1 3.29Å; F100-N176 WeakPolarHBondContact CB-OD1 3.31Å; F100-N176 VanDerWaalsContact CD2-OD1 3.31Å; F100-N176 WeakPolarHBondContact CD2-OD1 3.38Å; F100-N176 PolarHBondContact N-OD1 3.21Å
101	Y	96.8	Very high	95.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.4	174.9	-77.2	-99.3	0	0	0	109.5	M86 I95 C97 G99 V140 A141 L143 L172 I173 H174	M86-Y101 HydrophobicContact CE-CE1 3.99Å; M86-Y101 HydrophobicContact SD-CE1 4.28Å; I95-Y101 HydrophobicContact CD1-CE1 4.29Å; I95-Y101 HydrophobicContact CG2-CE2 3.94Å; C97-Y101 WeakPolarHBondContact O-CE2 3.33Å; C97-Y101 PolarHBondContact O-OH 2.82Å; G99-Y101 WeakPolarHBondContact O-CD2 3.39Å; Y101-V140 VanDerWaalsContact O-CA 3.3Å; Y101-V140 WeakPolarHBondContact O-CA 3.31Å; Y101-A141 PolarHBondContact N-O 3.38Å; Y101-A141 PolarHBondContact O-N 2.83Å; Y101-L143 HydrophobicContact CD2-CB 3.73Å; Y101-L143 HydrophobicContact CD2-CD1 3.83Å; Y101-L143 HydrophobicContact CD2-CG 4.01Å; Y101-L143 HydrophobicContact CE2-CB 4.02Å; Y101-L143 HydrophobicContact CG-CD1 3.86Å; Y101-L143 HydrophobicContact CG-CG 4.44Å; Y101-L172 HydrophobicContact CD1-CB 4.36Å; Y101-I173 WeakPolarHBondContact CA-O 3.37Å; Y101-H174 HydrophobicContact CD1-CB 4.09Å; Y101-H174 HydrophobicContact CE1-CB 3.6Å; Y101-H174 AromaticContact CE2-CD2 3.56Å; Y101-H174 AromaticContact CZ-CD2 3.61Å; Y101-H174 AromaticContact CZ-CG 3.93Å
102	L	97.7	Very high	95.9	Very high	49 Å²	49	32.2 Å²	32.2	26%	0.257	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.1	164.1	-176.4	69.3	0	0	0	107.9	L138 V140 L172 I173 Q175	L102-L138 HydrophobicContact CD1-CD1 3.69Å; L102-L138 HydrophobicContact CD1-CD2 4.22Å; L102-L138 HydrophobicContact CD1-CG 3.86Å; L102-L138 HydrophobicContact CD2-CD1 4.3Å; L102-L138 HydrophobicContact CG-CD1 3.9Å; L102-V140 HydrophobicContact CD1-CG2 3.84Å; L102-L172 CarbonylContact O-C 3.52Å; L102-L172 WeakPolarHBondContact O-CA 3.31Å; L102-I173 HydrophobicContact CB-CB 4.41Å; L102-I173 PolarHBondContact N-O 3.23Å; L102-I173 PolarHBondContact O-N 3.44Å; L102-Q175 HydrophobicContact CB-CG 4.29Å
103	I	98.2	Very high	95.9	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.1	-175.6	-52.3	177.3	0	0	0	108.7	L117 L126 L138 M139 A141 L143 L170 I171 L172	I103-L117 HydrophobicContact CG2-CD2 3.68Å; I103-L126 HydrophobicContact CD1-CD1 3.6Å; I103-L138 WeakPolarHBondContact O-CA 3.3Å; I103-M139 HydrophobicContact CB-CG 3.89Å; I103-M139 PolarHBondContact N-O 3.43Å; I103-M139 PolarHBondContact O-N 2.79Å; I103-A141 HydrophobicContact CD1-CB 3.95Å; I103-L143 HydrophobicContact CD1-CD1 4.33Å; I103-L170 HydrophobicContact CG2-CD1 3.85Å; I103-I171 CarbonylContact C-O 3.58Å; I103-I171 WeakPolarHBondContact CA-O 3.48Å; I103-L172 HydrophobicContact CG1-CG 4.25Å; I103-L172 HydrophobicContact CG2-CG 4.45Å
104	S	98	Very high	95.9	Very high	16 Å²	16	33.5 Å²	33.5	11%	0.112	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.3	175.2	168.1	0	0	0	0	109.5	S137 L170 I171	S104-S137 WeakPolarHBondContact CA-O 3.24Å; S104-L170 CarbonylContact O-C 3.58Å; S104-L170 WeakPolarHBondContact O-CA 3.43Å; S104-I171 PolarHBondContact N-O 2.89Å; S104-I171 PolarHBondContact O-N 2.91Å
105	L	97.9	Very high	96	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.8	173.7	-175.8	74.3	0	0	0	110.8	F66 I115 F127 V135 N136 S137 L151 E169 L170	F66-L105 HydrophobicContact CE1-CD1 3.57Å; F66-L105 HydrophobicContact CZ-CD1 3.7Å; L105-I115 HydrophobicContact CD2-CG2 4.04Å; L105-F127 HydrophobicContact CB-CE1 4.45Å; L105-F127 HydrophobicContact CD2-CE1 3.52Å; L105-F127 HydrophobicContact CD2-CE2 4.31Å; L105-F127 HydrophobicContact CD2-CZ 3.18Å; L105-V135 HydrophobicContact CD2-CG1 3.83Å; L105-V135 HydrophobicContact CD2-CG2 3.98Å; L105-V135 HydrophobicContact CG-CG1 3.86Å; L105-V135 HydrophobicContact CG-CG2 4.33Å; L105-N136 WeakPolarHBondContact O-CA 3.44Å; L105-S137 PolarHBondContact N-O 2.82Å; L105-S137 PolarHBondContact O-N 2.83Å; L105-L151 HydrophobicContact CD1-CD1 4.19Å; L105-L151 HydrophobicContact CD2-CD1 3.87Å; L105-E169 WeakPolarHBondContact CA-O 3.19Å; L105-L170 HydrophobicContact CB-CD1 4.48Å; L105-L170 HydrophobicContact CD1-CB 3.99Å; L105-L170 HydrophobicContact CD1-CD1 4.1Å
106	K	97.7	Very high	96.1	Very high	79 Å²	79	33 Å²	33	34%	0.343	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	148.3	177	-65.9	176	-174.8	166.3	0	111.4	F66 V135 N136 G168 E169	F66-K106 WeakPolarHBondContact CZ-O 3.39Å; K106-V135 CarbonylContact C-O 3.58Å; K106-V135 VanDerWaalsContact CA-O 3.26Å; K106-V135 WeakPolarHBondContact CA-O 3.42Å; K106-N136 WeakPolarHBondContact CE-OD1 3.45Å; K106-G168 WeakPolarHBondContact O-CA 3.32Å; K106-E169 HydrophobicContact CB-CB 4.42Å; K106-E169 PolarHBondContact N-O 2.92Å; K106-E169 PolarHBondContact O-N 3.35Å
107	G	97.5	Very high	96.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.5	147.5	171.6	0	0	0	0	0	112.4	S134 V135	G107-S134 CarbonylContact O-C 3.59Å; G107-S134 WeakPolarHBondContact O-CA 3.44Å; G107-S134 WeakPolarHBondContact O-CB 3.01Å; G107-V135 PolarHBondContact N-O 2.9Å; G107-V135 PolarHBondContact O-N 3.4Å
108	Y	97.7	Very high	96.6	Very high	139 Å²	139	33.1 Å²	33.1	55%	0.545	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	110.8	175.3	-61.2	-91.6	0	0	0	108.8	V165 N166	Y108-V165 CarbonylContact O-C 3.56Å; Y108-V165 WeakPolarHBondContact O-CA 3.02Å; Y108-N166 PolarHBondContact N-O 3.27Å; Y108-N166 PolarHBondContact O-N 3.37Å
109	F	96.1	Very high	96.7	Very high	14 Å²	14	33.4 Å²	33.4	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	142.3	-174.9	-57	-88.8	0	0	0	110.6	F66 F75 Q111 V113 I115 R133 V135 V153 F163 V165	F66-F109 HydrophobicContact CE2-CZ 4.42Å; F75-F109 HydrophobicContact CD2-CE1 4.37Å; F75-F109 HydrophobicContact CE2-CD1 4.01Å; F75-F109 AromaticContact CE2-CE1 3.63Å; F75-F109 HydrophobicContact CE2-CE1 3.63Å; F75-F109 HydrophobicContact CZ-CD1 4.07Å; F75-F109 HydrophobicContact CZ-CE1 4.01Å; F109-Q111 WeakPolarHBondContact CB-O 3.36Å; F109-Q111 PolarHBondContact O-N 2.86Å; F109-V113 HydrophobicContact CB-CG1 4.28Å; F109-V113 HydrophobicContact CB-CG2 4.22Å; F109-V113 HydrophobicContact CD1-CG1 4.19Å; F109-V113 HydrophobicContact CD1-CG2 4.13Å; F109-V113 HydrophobicContact CD2-CG2 3.64Å; F109-V113 HydrophobicContact CE1-CG2 4.45Å; F109-V113 HydrophobicContact CE2-CG2 4.02Å; F109-V113 HydrophobicContact CG-CG1 4.21Å; F109-V113 HydrophobicContact CG-CG2 3.71Å; F109-V113 HydrophobicContact CZ-CG2 4.4Å; F109-I115 HydrophobicContact CD2-CD1 4.12Å; F109-I115 HydrophobicContact CE2-CD1 3.3Å; F109-I115 HydrophobicContact CE2-CG1 4.24Å; F109-I115 HydrophobicContact CZ-CD1 3.74Å; F109-I115 HydrophobicContact CZ-CG1 4.31Å; F109-R133 PolarHBondContact N-O 2.85Å; F109-V135 HydrophobicContact CE2-CG1 4.12Å; F109-V153 HydrophobicContact CE1-CG1 4.06Å; F109-V153 HydrophobicContact CE1-CG2 4.4Å; F109-F163 HydrophobicContact CD1-CE2 4.38Å; F109-F163 HydrophobicContact CD1-CZ 4.45Å; F109-V165 HydrophobicContact CD1-CB 3.87Å; F109-V165 HydrophobicContact CD1-CG2 3.8Å; F109-V165 HydrophobicContact CE1-CB 3.96Å; F109-V165 HydrophobicContact CE1-CG2 3.68Å; F109-V165 HydrophobicContact CE2-CG2 4.48Å; F109-V165 HydrophobicContact CG-CG2 4.28Å; F109-V165 HydrophobicContact CZ-CG2 4.05Å
110	S	94.4	Very high	96.7	Very high	44 Å²	44	36.6 Å²	36.6	31%	0.308	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	-25.5	173.2	46	0	0	0	0	113.9	D162 H164	S110-D162 PolarHBondContact OG-O 2.91Å; S110-H164 VanDerWaalsContact CB-CE1 3.49Å; S110-H164 WeakPolarHBondContact CB-CE1 3.39Å; S110-H164 PolarHBondContact N-O 3.36Å; S110-H164 PolarHBondContact OG-N 2.89Å; S110-H164 PolarHBondContact OG-O 2.88Å
111	Q	93.3	Very high	96	Very high	22 Å²	22	39.8 Å²	39.8	10%	0.103	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	175.3	-179.1	66.9	-166.1	12.8	0	0	112.6	F109 T155 N157 F163	F109-Q111 WeakPolarHBondContact CB-O 3.36Å; F109-Q111 PolarHBondContact O-N 2.86Å; Q111-T155 VanDerWaalsContact NE2-CG2 3.25Å; Q111-T155 PolarHBondContact NE2-OG1 2.91Å; Q111-N157 WeakPolarHBondContact CB-ND2 3.33Å; Q111-N157 VanDerWaalsContact CD-ND2 3.29Å; Q111-N157 PolarHBondContact OE1-ND2 2.92Å; Q111-F163 HydrophobicContact CG-CD2 3.57Å; Q111-F163 HydrophobicContact CG-CE2 3.76Å; Q111-F163 VanDerWaalsContact NE2-CD2 3.32Å
112	E	95.4	Very high	95.6	Very high	94 Å²	94	47.3 Å²	47.3	44%	0.439	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	134.5	177	-78.2	175.5	-157.5	0	0	111.7	V132 R133 T155	E112-V132 WeakPolarHBondContact CA-O 3.33Å; E112-R133 HydrophobicContact CG-CG 3.84Å; E112-R133 IonicContact OE1-NE 3.95Å; E112-T155 PolarHBondContact O-OG1 3.36Å
113	V	96	Very high	95.4	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	156.6	-176.6	-64.5	0	0	0	0	111.6	F109 I115 K131 V132 V153 T154 F163	F109-V113 HydrophobicContact CB-CG1 4.28Å; F109-V113 HydrophobicContact CB-CG2 4.22Å; F109-V113 HydrophobicContact CD1-CG1 4.19Å; F109-V113 HydrophobicContact CD1-CG2 4.13Å; F109-V113 HydrophobicContact CD2-CG2 3.64Å; F109-V113 HydrophobicContact CE1-CG2 4.45Å; F109-V113 HydrophobicContact CE2-CG2 4.02Å; F109-V113 HydrophobicContact CG-CG1 4.21Å; F109-V113 HydrophobicContact CG-CG2 3.71Å; F109-V113 HydrophobicContact CZ-CG2 4.4Å; V113-I115 HydrophobicContact CB-CG1 4.41Å; V113-I115 HydrophobicContact CG2-CD1 3.82Å; V113-I115 HydrophobicContact CG2-CG1 3.6Å; V113-K131 WeakPolarHBondContact O-CA 3.37Å; V113-K131 PolarHBondContact O-N 3.08Å; V113-K131 VanDerWaalsContact O-N 3.12Å; V113-V132 HydrophobicContact CG2-CG2 4.28Å; V113-V132 VanDerWaalsContact CG2-O 3.3Å; V113-V132 WeakPolarHBondContact CG2-O 3.44Å; V113-V132 PolarHBondContact N-O 3.07Å; V113-V132 PolarHBondContact O-N 2.74Å; V113-V153 HydrophobicContact CB-CG1 3.67Å; V113-V153 HydrophobicContact CG1-CG1 3.77Å; V113-V153 HydrophobicContact CG2-CG1 4.09Å; V113-T154 CarbonylContact C-O 3.52Å; V113-T154 VanDerWaalsContact CA-O 3.23Å; V113-T154 WeakPolarHBondContact CA-O 3.33Å; V113-T154 WeakPolarHBondContact CB-O 3.21Å; V113-F163 HydrophobicContact CG1-CE2 3.64Å; V113-F163 HydrophobicContact CG1-CZ 3.7Å
114	N	96.8	Very high	95.2	Very high	34 Å²	34	56.6 Å²	56.6	18%	0.182	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.4	160.5	-54.2	-52.1	0	0	0	107.6	L129 K130 K131 V153 T154	N114-L129 CarbonylContact C-O 3.58Å; N114-L129 WeakPolarHBondContact CA-O 3.45Å; N114-K130 VanDerWaalsContact OD1-CA 3.24Å; N114-K130 WeakPolarHBondContact OD1-CA 3.36Å; N114-K131 PolarHBondContact OD1-N 2.73Å; N114-V153 WeakPolarHBondContact O-CA 3.21Å; N114-T154 PolarHBondContact N-O 2.94Å; N114-T154 PolarHBondContact O-N 3.35Å
115	I	97	Very high	95.2	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.3	-175.6	-51.4	171.3	0	0	0	107.5	L105 F109 V113 F127 Q128 L129 V132 V135 L151 V153	L105-I115 HydrophobicContact CD2-CG2 4.04Å; F109-I115 HydrophobicContact CD2-CD1 4.12Å; F109-I115 HydrophobicContact CE2-CD1 3.3Å; F109-I115 HydrophobicContact CE2-CG1 4.24Å; F109-I115 HydrophobicContact CZ-CD1 3.74Å; F109-I115 HydrophobicContact CZ-CG1 4.31Å; V113-I115 HydrophobicContact CB-CG1 4.41Å; V113-I115 HydrophobicContact CG2-CD1 3.82Å; V113-I115 HydrophobicContact CG2-CG1 3.6Å; I115-F127 HydrophobicContact CB-CE2 4.36Å; I115-F127 HydrophobicContact CG2-CE2 3.96Å; I115-F127 HydrophobicContact CG2-CZ 3.67Å; I115-Q128 CarbonylContact O-C 3.59Å; I115-Q128 WeakPolarHBondContact O-CA 3.31Å; I115-L129 PolarHBondContact N-O 3.01Å; I115-L129 PolarHBondContact O-N 3.2Å; I115-V132 HydrophobicContact CD1-CG2 3.6Å; I115-V132 HydrophobicContact CG1-CG2 4.07Å; I115-V135 HydrophobicContact CD1-CB 3.88Å; I115-V135 HydrophobicContact CD1-CG1 4Å; I115-L151 HydrophobicContact CG2-CD1 3.85Å; I115-V153 HydrophobicContact CG1-CG1 4.39Å; I115-V153 HydrophobicContact CG2-CG2 4.33Å
116	S	97	Very high	95.1	Very high	12 Å²	12	59.1 Å²	59.1	8%	0.084	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	141.9	169.9	53.5	0	0	0	0	110.5	H118 F127 N152	S116-H118 VanDerWaalsContact CB-NE2 3.34Å; S116-H118 WeakPolarHBondContact CB-NE2 3.42Å; S116-H118 PolarHBondContact OG-NE2 2.66Å; S116-F127 WeakPolarHBondContact CA-O 3.5Å; S116-N152 PolarHBondContact N-O 3.21Å; S116-N152 PolarHBondContact O-N 3.47Å; S116-N152 PolarHBondContact OG-O 2.87Å
117	L	97.8	Very high	94.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.6	175	-171.1	79.3	0	0	0	108.6	I103 P125 L126 F127 V149 L151 L170	I103-L117 HydrophobicContact CG2-CD2 3.68Å; L117-P125 CarbonylContact O-C 3.52Å; L117-P125 WeakPolarHBondContact O-CA 3.14Å; L117-P125 WeakPolarHBondContact O-CB 3.29Å; L117-L126 HydrophobicContact CD2-CD1 4.17Å; L117-L126 PolarHBondContact O-N 3.46Å; L117-F127 HydrophobicContact CB-CD1 3.42Å; L117-F127 VanDerWaalsContact CB-CD1 3.42Å; L117-F127 HydrophobicContact CB-CE1 3.18Å; L117-F127 HydrophobicContact CB-CZ 4.09Å; L117-F127 HydrophobicContact CD2-CD1 4.11Å; L117-F127 HydrophobicContact CD2-CE1 3.97Å; L117-F127 HydrophobicContact CG-CD1 4.41Å; L117-F127 HydrophobicContact CG-CE1 4.13Å; L117-F127 PolarHBondContact N-O 3.44Å; L117-F127 VanDerWaalsContact N-O 3.09Å; L117-V149 HydrophobicContact CD1-CG1 3.84Å; L117-V149 HydrophobicContact CD2-CG1 4.04Å; L117-V149 HydrophobicContact CG-CG1 3.9Å; L117-L151 HydrophobicContact CD1-CB 4.35Å; L117-L151 HydrophobicContact CD1-CD1 4.12Å; L117-L170 HydrophobicContact CD1-CD1 4.28Å; L117-L170 HydrophobicContact CD1-CD2 4.05Å; L117-L170 HydrophobicContact CD2-CD1 4.29Å
118	H	97.6	Very high	94.9	Very high	27 Å²	27	61.4 Å²	61.4	13%	0.125	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	159	-172.7	-66	-102.6	0	0	0	109.6	S116 V149 Y150	S116-H118 VanDerWaalsContact CB-NE2 3.34Å; S116-H118 WeakPolarHBondContact CB-NE2 3.42Å; S116-H118 PolarHBondContact OG-NE2 2.66Å; H118-V149 CarbonylContact O-C 3.56Å; H118-V149 VanDerWaalsContact O-CA 3.22Å; H118-V149 WeakPolarHBondContact O-CA 3.38Å; H118-Y150 HydrophobicContact CB-CD1 4.03Å; H118-Y150 HydrophobicContact CB-CD2 3.99Å; H118-Y150 HydrophobicContact CB-CE1 3.49Å; H118-Y150 VanDerWaalsContact CB-CE1 3.49Å; H118-Y150 HydrophobicContact CB-CE2 3.44Å; H118-Y150 VanDerWaalsContact CB-CE2 3.44Å; H118-Y150 HydrophobicContact CB-CG 4.25Å; H118-Y150 WeakPolarHBondContact CB-OH 3.17Å; H118-Y150 AromaticContact CD2-CE2 3.82Å; H118-Y150 AromaticContact CG-CE2 3.63Å; H118-Y150 AromaticContact CG-CZ 3.65Å; H118-Y150 PolarHBondContact N-O 3.41Å; H118-Y150 PolarHBondContact O-N 2.9Å
119	Y	96.7	Very high	94.9	Very high	48 Å²	48	57.4 Å²	57.4	19%	0.188	28%	0.281	C	S	.	.	S	Bend	trans	-125.6	-23	175.8	67.9	-76.4	0	0	0	112.7	E123 E124 L126 L143 K148	Y119-E123 HydrophobicContact CE1-CB 4.01Å; Y119-E123 HydrophobicContact CE2-CG 4.45Å; Y119-E124 WeakPolarHBondContact CE1-O 3.26Å; Y119-L126 HydrophobicContact CD1-CD2 3.42Å; Y119-L126 VanDerWaalsContact CD1-CD2 3.42Å; Y119-L126 HydrophobicContact CD1-CG 3.72Å; Y119-L126 HydrophobicContact CE1-CD2 3.89Å; Y119-L126 HydrophobicContact CG-CD2 4.06Å; Y119-L126 HydrophobicContact CG-CG 4.36Å; Y119-L143 HydrophobicContact CD2-CD2 4.19Å; Y119-L143 HydrophobicContact CG-CD2 4.08Å; Y119-K148 CarbonylContact C-O 3.59Å; Y119-K148 VanDerWaalsContact CA-O 3.27Å; Y119-K148 WeakPolarHBondContact CA-O 3.25Å; Y119-K148 CarbonylContact O-C 3.56Å; Y119-K148 PolarHBondContact O-N 3.27Å; Y119-K148 VanDerWaalsContact O-O 3.05Å
120	Q	94	Very high	94.9	Very high	77 Å²	77	63.5 Å²	63.5	36%	0.36	31%	0.308	S	S	.	.	S	Bend	trans	-138.4	152.1	169.8	-71	-175.1	16.7	0	0	110.4	D122 E123 D147 Y150	Q120-D122 PolarHBondContact O-N 3.23Å; Q120-E123 HydrophobicContact CB-CB 4.04Å; Q120-E123 HydrophobicContact CB-CG 3.84Å; Q120-D147 WeakPolarHBondContact CG-OD1 2.94Å; Q120-D147 PolarHBondContact NE2-OD1 3.29Å; Q120-Y150 PolarHBondContact O-OH 2.88Å
121	K	82.9	Confident	94.9	Very high	175 Å²	175	68.5 Å²	68.5	76%	0.761	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	122.2	171.9	-170.4	175.5	-178.8	-178.9	0	106.4
122	D	87.2	Confident	95.1	Very high	157 Å²	157	69 Å²	69	84%	0.84	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	1.5	-178.9	-42.7	-43	0	0	0	116.5	Q120	Q120-D122 PolarHBondContact O-N 3.23Å
123	E	93.8	Very high	95.1	Very high	95 Å²	95	72 Å²	72	44%	0.444	34%	0.335	S	S	.	.	S	Bend	trans	-95.2	160.3	169.1	-76.1	-66	159.3	0	0	111.9	Y119 Q120	Y119-E123 HydrophobicContact CE1-CB 4.01Å; Y119-E123 HydrophobicContact CE2-CG 4.45Å; Q120-E123 HydrophobicContact CB-CB 4.04Å; Q120-E123 HydrophobicContact CB-CG 3.84Å
124	E	95	Very high	95.2	Very high	150 Å²	150	74.6 Å²	74.6	70%	0.701	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-61.6	140.6	172.1	-72.9	-65.6	147.6	0	0	110.6	Y119	Y119-E124 WeakPolarHBondContact CE1-O 3.26Å
125	P	96.8	Very high	95.3	Very high	30 Å²	30	73.1 Å²	73.1	20%	0.195	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-65.6	148	-179.6	27.9	-34	0	0	0	111.3	L117 F127 Q128	L117-P125 CarbonylContact O-C 3.52Å; L117-P125 WeakPolarHBondContact O-CA 3.14Å; L117-P125 WeakPolarHBondContact O-CB 3.29Å; P125-F127 PolarHBondContact O-N 3.06Å; P125-Q128 HydrophobicContact CG-CB 4.16Å
126	L	96.4	Very high	95.3	Very high	43 Å²	43	78.3 Å²	78.3	23%	0.225	37%	0.374	C	S	.	.	S	Bend	trans	-57.3	-36.9	172.5	-63.2	179.6	0	0	0	111.5	I103 L117 Y119 M139 A141 L143	I103-L126 HydrophobicContact CD1-CD1 3.6Å; L117-L126 HydrophobicContact CD2-CD1 4.17Å; L117-L126 PolarHBondContact O-N 3.46Å; Y119-L126 HydrophobicContact CD1-CD2 3.42Å; Y119-L126 VanDerWaalsContact CD1-CD2 3.42Å; Y119-L126 HydrophobicContact CD1-CG 3.72Å; Y119-L126 HydrophobicContact CE1-CD2 3.89Å; Y119-L126 HydrophobicContact CG-CD2 4.06Å; Y119-L126 HydrophobicContact CG-CG 4.36Å; L126-M139 HydrophobicContact CB-SD 4.14Å; L126-A141 HydrophobicContact CD1-CB 4.3Å; L126-A141 HydrophobicContact CD2-CB 3.74Å; L126-L143 HydrophobicContact CD1-CD2 4.37Å; L126-L143 HydrophobicContact CD2-CD2 4.38Å
127	F	94.4	Very high	95.3	Very high	23 Å²	23	79.5 Å²	79.5	10%	0.101	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	157.8	167.1	86.4	-88.3	0	0	0	111	L105 I115 S116 L117 P125 L129 V135 M139	L105-F127 HydrophobicContact CB-CE1 4.45Å; L105-F127 HydrophobicContact CD2-CE1 3.52Å; L105-F127 HydrophobicContact CD2-CE2 4.31Å; L105-F127 HydrophobicContact CD2-CZ 3.18Å; I115-F127 HydrophobicContact CB-CE2 4.36Å; I115-F127 HydrophobicContact CG2-CE2 3.96Å; I115-F127 HydrophobicContact CG2-CZ 3.67Å; S116-F127 WeakPolarHBondContact CA-O 3.5Å; L117-F127 HydrophobicContact CB-CD1 3.42Å; L117-F127 VanDerWaalsContact CB-CD1 3.42Å; L117-F127 HydrophobicContact CB-CE1 3.18Å; L117-F127 HydrophobicContact CB-CZ 4.09Å; L117-F127 HydrophobicContact CD2-CD1 4.11Å; L117-F127 HydrophobicContact CD2-CE1 3.97Å; L117-F127 HydrophobicContact CG-CD1 4.41Å; L117-F127 HydrophobicContact CG-CE1 4.13Å; L117-F127 PolarHBondContact N-O 3.44Å; L117-F127 VanDerWaalsContact N-O 3.09Å; P125-F127 PolarHBondContact O-N 3.06Å; F127-L129 HydrophobicContact CD2-CD1 4.4Å; F127-L129 HydrophobicContact CD2-CG 4.04Å; F127-L129 HydrophobicContact CE2-CD1 4.06Å; F127-L129 HydrophobicContact CE2-CG 4.01Å; F127-V135 HydrophobicContact CE2-CG2 4.44Å; F127-V135 HydrophobicContact CZ-CG2 4.5Å; F127-M139 HydrophobicContact CB-CE 3.52Å; F127-M139 HydrophobicContact CB-SD 4.07Å; F127-M139 HydrophobicContact CD1-CE 3.42Å; F127-M139 VanDerWaalsContact CD1-CE 3.42Å; F127-M139 HydrophobicContact CD1-SD 3.99Å; F127-M139 HydrophobicContact CE1-CE 4.33Å; F127-M139 HydrophobicContact CG-CE 3.61Å; F127-M139 HydrophobicContact CG-SD 4.43Å
128	Q	96.8	Very high	95.3	Very high	103 Å²	103	85.1 Å²	85.1	48%	0.481	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	136.7	173.2	-172.4	177.2	29.8	0	0	110.9	I115 P125	I115-Q128 CarbonylContact O-C 3.59Å; I115-Q128 WeakPolarHBondContact O-CA 3.31Å; P125-Q128 HydrophobicContact CG-CB 4.16Å
129	L	96.8	Very high	95.3	Very high	56 Å²	56	85.7 Å²	85.7	29%	0.293	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141	171	-64.9	174.1	0	0	0	108.8	N114 I115 F127 V132 V135	N114-L129 CarbonylContact C-O 3.58Å; N114-L129 WeakPolarHBondContact CA-O 3.45Å; I115-L129 PolarHBondContact N-O 3.01Å; I115-L129 PolarHBondContact O-N 3.2Å; F127-L129 HydrophobicContact CD2-CD1 4.4Å; F127-L129 HydrophobicContact CD2-CG 4.04Å; F127-L129 HydrophobicContact CE2-CD1 4.06Å; F127-L129 HydrophobicContact CE2-CG 4.01Å; L129-V132 HydrophobicContact CB-CG1 4.06Å; L129-V132 HydrophobicContact CB-CG2 3.98Å; L129-V135 HydrophobicContact CD1-CB 4.33Å; L129-V135 HydrophobicContact CD1-CG2 3.77Å
130	K	96.3	Very high	95.3	Very high	142 Å²	142	87.8 Å²	87.8	62%	0.617	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.1	-179.2	-64.8	-178.2	-178.7	177.6	0	110.3	N114 V132	N114-K130 VanDerWaalsContact OD1-CA 3.24Å; N114-K130 WeakPolarHBondContact OD1-CA 3.36Å; K130-V132 PolarHBondContact O-N 2.79Å
131	K	95.4	Very high	95.5	Very high	149 Å²	149	84.7 Å²	84.7	65%	0.648	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.3	50.3	177.2	-57.5	-173.4	175.9	-171.3	0	113.4	V113 N114	V113-K131 WeakPolarHBondContact O-CA 3.37Å; V113-K131 PolarHBondContact O-N 3.08Å; V113-K131 VanDerWaalsContact O-N 3.12Å; N114-K131 PolarHBondContact OD1-N 2.73Å
132	V	96.7	Very high	96.1	Very high	33 Å²	33	80.1 Å²	80.1	20%	0.2	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	155	177.8	-64	0	0	0	0	110.9	E112 V113 I115 L129 K130	E112-V132 WeakPolarHBondContact CA-O 3.33Å; V113-V132 HydrophobicContact CG2-CG2 4.28Å; V113-V132 VanDerWaalsContact CG2-O 3.3Å; V113-V132 WeakPolarHBondContact CG2-O 3.44Å; V113-V132 PolarHBondContact N-O 3.07Å; V113-V132 PolarHBondContact O-N 2.74Å; I115-V132 HydrophobicContact CD1-CG2 3.6Å; I115-V132 HydrophobicContact CG1-CG2 4.07Å; L129-V132 HydrophobicContact CB-CG1 4.06Å; L129-V132 HydrophobicContact CB-CG2 3.98Å; K130-V132 PolarHBondContact O-N 2.79Å
133	R	96.5	Very high	96.5	Very high	155 Å²	155	72.6 Å²	72.6	59%	0.585	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	-8.6	171.8	-67.3	-169.3	179.3	-152.4	-0.9	113.4	F109 E112	F109-R133 PolarHBondContact N-O 2.85Å; E112-R133 HydrophobicContact CG-CG 3.84Å; E112-R133 IonicContact OE1-NE 3.95Å
134	S	97.5	Very high	96.6	Very high	57 Å²	57	71 Å²	71	40%	0.399	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	159.8	176.8	60.4	0	0	0	0	110.7	G107	G107-S134 CarbonylContact O-C 3.59Å; G107-S134 WeakPolarHBondContact O-CA 3.44Å; G107-S134 WeakPolarHBondContact O-CB 3.01Å
135	V	97.8	Very high	96.5	Very high	3 Å²	3	68 Å²	68	2%	0.018	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139.3	170.8	63.3	0	0	0	0	108.4	L105 K106 G107 F109 I115 F127 L129	L105-V135 HydrophobicContact CD2-CG1 3.83Å; L105-V135 HydrophobicContact CD2-CG2 3.98Å; L105-V135 HydrophobicContact CG-CG1 3.86Å; L105-V135 HydrophobicContact CG-CG2 4.33Å; K106-V135 CarbonylContact C-O 3.58Å; K106-V135 VanDerWaalsContact CA-O 3.26Å; K106-V135 WeakPolarHBondContact CA-O 3.42Å; G107-V135 PolarHBondContact N-O 2.9Å; G107-V135 PolarHBondContact O-N 3.4Å; F109-V135 HydrophobicContact CE2-CG1 4.12Å; I115-V135 HydrophobicContact CD1-CB 3.88Å; I115-V135 HydrophobicContact CD1-CG1 4Å; F127-V135 HydrophobicContact CE2-CG2 4.44Å; F127-V135 HydrophobicContact CZ-CG2 4.5Å; L129-V135 HydrophobicContact CD1-CB 4.33Å; L129-V135 HydrophobicContact CD1-CG2 3.77Å
136	N	97.8	Very high	96.4	Very high	110 Å²	110	73.9 Å²	73.9	59%	0.588	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.2	86.5	169.5	-179	15	0	0	0	106.3	L105 K106	L105-N136 WeakPolarHBondContact O-CA 3.44Å; K106-N136 WeakPolarHBondContact CE-OD1 3.45Å
137	S	97	Very high	96.4	Very high	36 Å²	36	72 Å²	72	25%	0.252	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	142	-170.1	-61.7	0	0	0	0	110.2	S104 L105	S104-S137 WeakPolarHBondContact CA-O 3.24Å; L105-S137 PolarHBondContact N-O 2.82Å; L105-S137 PolarHBondContact O-N 2.83Å
138	L	97.9	Very high	96.5	Very high	119 Å²	119	75.5 Å²	75.5	62%	0.623	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.9	175.3	-172.2	71.5	0	0	0	107.8	L102 I103	L102-L138 HydrophobicContact CD1-CD1 3.69Å; L102-L138 HydrophobicContact CD1-CD2 4.22Å; L102-L138 HydrophobicContact CD1-CG 3.86Å; L102-L138 HydrophobicContact CD2-CD1 4.3Å; L102-L138 HydrophobicContact CG-CD1 3.9Å; I103-L138 WeakPolarHBondContact O-CA 3.3Å
139	M	97.4	Very high	96.6	Very high	39 Å²	39	70.6 Å²	70.6	19%	0.192	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	167.4	178.4	68	-165.2	60.9	0	0	111.4	I103 L126 F127	I103-M139 HydrophobicContact CB-CG 3.89Å; I103-M139 PolarHBondContact N-O 3.43Å; I103-M139 PolarHBondContact O-N 2.79Å; L126-M139 HydrophobicContact CB-SD 4.14Å; F127-M139 HydrophobicContact CB-CE 3.52Å; F127-M139 HydrophobicContact CB-SD 4.07Å; F127-M139 HydrophobicContact CD1-CE 3.42Å; F127-M139 VanDerWaalsContact CD1-CE 3.42Å; F127-M139 HydrophobicContact CD1-SD 3.99Å; F127-M139 HydrophobicContact CE1-CE 4.33Å; F127-M139 HydrophobicContact CG-CE 3.61Å; F127-M139 HydrophobicContact CG-SD 4.43Å
140	V	97.5	Very high	96.6	Very high	91 Å²	91	71 Å²	71	55%	0.552	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	132	170.3	179.4	0	0	0	0	108.2	F100 Y101 L102	F100-V140 HydrophobicContact CB-CG1 3.92Å; F100-V140 HydrophobicContact CD1-CG1 4.16Å; F100-V140 HydrophobicContact CG-CG1 4.35Å; Y101-V140 VanDerWaalsContact O-CA 3.3Å; Y101-V140 WeakPolarHBondContact O-CA 3.31Å; L102-V140 HydrophobicContact CD1-CG2 3.84Å
141	A	97.1	Very high	96.6	Very high	13 Å²	13	64.8 Å²	64.8	11%	0.107	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.8	176.3	0	0	0	0	0	110.2	F100 Y101 I103 L126 L143	F100-A141 CarbonylContact C-O 3.56Å; F100-A141 WeakPolarHBondContact CA-O 3.4Å; Y101-A141 PolarHBondContact N-O 3.38Å; Y101-A141 PolarHBondContact O-N 2.83Å; I103-A141 HydrophobicContact CD1-CB 3.95Å; L126-A141 HydrophobicContact CD1-CB 4.3Å; L126-A141 HydrophobicContact CD2-CB 3.74Å; A141-L143 HydrophobicContact CB-CD2 4.32Å; A141-L143 HydrophobicContact CB-CG 4.44Å
142	S	96.1	Very high	96.6	Very high	78 Å²	78	61 Å²	61	55%	0.545	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119.3	167.4	-173.7	0	0	0	0	108
143	L	96.4	Very high	96.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	155.7	177.6	-56.4	176.5	0	0	0	109.5	I95 D98 G99 Y101 I103 Y119 L126 A141 D147 V149	I95-L143 HydrophobicContact CD1-CD1 3.7Å; I95-L143 HydrophobicContact CG1-CB 4.31Å; I95-L143 HydrophobicContact CG1-CD1 3.94Å; I95-L143 HydrophobicContact CG2-CB 4.05Å; D98-L143 CarbonylContact C-O 3.56Å; D98-L143 WeakPolarHBondContact CA-O 3.38Å; G99-L143 PolarHBondContact N-O 2.98Å; G99-L143 PolarHBondContact O-N 2.84Å; Y101-L143 HydrophobicContact CD2-CB 3.73Å; Y101-L143 HydrophobicContact CD2-CD1 3.83Å; Y101-L143 HydrophobicContact CD2-CG 4.01Å; Y101-L143 HydrophobicContact CE2-CB 4.02Å; Y101-L143 HydrophobicContact CG-CD1 3.86Å; Y101-L143 HydrophobicContact CG-CG 4.44Å; I103-L143 HydrophobicContact CD1-CD1 4.33Å; Y119-L143 HydrophobicContact CD2-CD2 4.19Å; Y119-L143 HydrophobicContact CG-CD2 4.08Å; L126-L143 HydrophobicContact CD1-CD2 4.37Å; L126-L143 HydrophobicContact CD2-CD2 4.38Å; A141-L143 HydrophobicContact CB-CD2 4.32Å; A141-L143 HydrophobicContact CB-CG 4.44Å; L143-D147 WeakPolarHBondContact CA-OD2 3.4Å; L143-V149 HydrophobicContact CD1-CG2 3.77Å
144	T	95	Very high	96.4	Very high	62 Å²	62	55.2 Å²	55.2	38%	0.38	30%	0.295	S	S	.	.			trans	-129	160	-178.6	59.2	0	0	0	0	111.2	I95 D98 K146 D147	I95-T144 WeakPolarHBondContact CG2-O 3.25Å; D98-T144 VanDerWaalsContact OD1-CA 3.24Å; D98-T144 WeakPolarHBondContact OD1-CA 3.37Å; T144-K146 PolarHBondContact O-N 3.35Å; T144-D147 PolarHBondContact N-OD2 2.86Å; T144-D147 WeakPolarHBondContact O-CB 3.26Å; T144-D147 PolarHBondContact O-N 2.86Å; T144-D147 PolarHBondContact OG1-OD2 3.45Å
145	Y	93.6	Very high	96.1	Very high	87 Å²	87	53.7 Å²	53.7	34%	0.341	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	134.5	174	171.5	-114.6	0	0	0	110.6	D98 D147 F180 V182	D98-Y145 PolarHBondContact OD1-N 2.82Å; Y145-D147 VanDerWaalsContact C-N 3.35Å; Y145-F180 HydrophobicContact CD1-CE1 4.1Å; Y145-F180 HydrophobicContact CG-CE1 4.17Å; Y145-V182 HydrophobicContact CD1-CG2 4.1Å; Y145-V182 HydrophobicContact CD2-CB 3.94Å; Y145-V182 HydrophobicContact CD2-CG2 3.83Å; Y145-V182 HydrophobicContact CE1-CG2 3.95Å; Y145-V182 HydrophobicContact CE2-CB 3.59Å; Y145-V182 HydrophobicContact CE2-CG1 4.1Å; Y145-V182 HydrophobicContact CE2-CG2 3.69Å; Y145-V182 HydrophobicContact CG-CG2 4.04Å
146	K	93.5	Very high	95.4	Very high	153 Å²	153	59.5 Å²	59.5	67%	0.665	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-10.2	-171.7	-54.5	173.8	177.3	174.9	0	115.7	I95 T144	I95-K146 PolarHBondContact O-N 3.47Å; T144-K146 PolarHBondContact O-N 3.35Å
147	D	96.8	Very high	94.2	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.016	31%	0.307	C	S	.	.			trans	-60.7	144.8	168.4	-68.9	-17.9	0	0	0	110.1	I95 Q120 L143 T144 Y145	I95-D147 HydrophobicContact CB-CB 4.04Å; I95-D147 WeakPolarHBondContact CB-O 3.43Å; I95-D147 HydrophobicContact CG1-CB 3.87Å; I95-D147 WeakPolarHBondContact CG1-O 3.14Å; I95-D147 PolarHBondContact N-O 3.36Å; Q120-D147 WeakPolarHBondContact CG-OD1 2.94Å; Q120-D147 PolarHBondContact NE2-OD1 3.29Å; L143-D147 WeakPolarHBondContact CA-OD2 3.4Å; T144-D147 PolarHBondContact N-OD2 2.86Å; T144-D147 WeakPolarHBondContact O-CB 3.26Å; T144-D147 PolarHBondContact O-N 2.86Å; T144-D147 PolarHBondContact OG1-OD2 3.45Å; Y145-D147 VanDerWaalsContact C-N 3.35Å
148	K	97.2	Very high	92.9	Very high	97 Å²	97	63.6 Å²	63.6	42%	0.422	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	108.4	-179.2	-63.4	-174.3	-174.4	175.7	0	108.6	V93 I94 Y119 Y150	V93-K148 CarbonylContact O-C 3.55Å; V93-K148 WeakPolarHBondContact O-CA 3.42Å; I94-K148 HydrophobicContact CD1-CD 4.02Å; I94-K148 HydrophobicContact CD1-CG 3.83Å; Y119-K148 CarbonylContact C-O 3.59Å; Y119-K148 VanDerWaalsContact CA-O 3.27Å; Y119-K148 WeakPolarHBondContact CA-O 3.25Å; Y119-K148 CarbonylContact O-C 3.56Å; Y119-K148 PolarHBondContact O-N 3.27Å; Y119-K148 VanDerWaalsContact O-O 3.05Å; K148-Y150 VanDerWaalsContact O-CD1 3.3Å; K148-Y150 WeakPolarHBondContact O-CD1 3.16Å; K148-Y150 PolarHBondContact O-N 3.38Å
149	V	97.6	Very high	92	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	113.4	-178.5	-179.9	0	0	0	0	109.6	S92 V93 I95 L117 H118 L143 L170 L172	S92-V149 CarbonylContact C-O 3.33Å; S92-V149 WeakPolarHBondContact CA-O 3.36Å; V93-V149 HydrophobicContact CB-CB 4.29Å; V93-V149 PolarHBondContact N-O 2.89Å; V93-V149 PolarHBondContact O-N 3.32Å; I95-V149 HydrophobicContact CD1-CG2 4Å; I95-V149 HydrophobicContact CG1-CG2 4.13Å; L117-V149 HydrophobicContact CD1-CG1 3.84Å; L117-V149 HydrophobicContact CD2-CG1 4.04Å; L117-V149 HydrophobicContact CG-CG1 3.9Å; H118-V149 CarbonylContact O-C 3.56Å; H118-V149 VanDerWaalsContact O-CA 3.22Å; H118-V149 WeakPolarHBondContact O-CA 3.38Å; L143-V149 HydrophobicContact CD1-CG2 3.77Å; V149-L170 HydrophobicContact CG1-CD2 4.47Å; V149-L172 HydrophobicContact CB-CD2 3.97Å; V149-L172 HydrophobicContact CG1-CD2 4.13Å; V149-L172 HydrophobicContact CG2-CD2 3.83Å
150	Y	96.8	Very high	91.3	Very high	64 Å²	64	61.5 Å²	61.5	25%	0.251	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148.8	-179.5	64.2	-91	0	0	0	112.2	H118 Q120 K148	H118-Y150 HydrophobicContact CB-CD1 4.03Å; H118-Y150 HydrophobicContact CB-CD2 3.99Å; H118-Y150 HydrophobicContact CB-CE1 3.49Å; H118-Y150 VanDerWaalsContact CB-CE1 3.49Å; H118-Y150 HydrophobicContact CB-CE2 3.44Å; H118-Y150 VanDerWaalsContact CB-CE2 3.44Å; H118-Y150 HydrophobicContact CB-CG 4.25Å; H118-Y150 WeakPolarHBondContact CB-OH 3.17Å; H118-Y150 AromaticContact CD2-CE2 3.82Å; H118-Y150 AromaticContact CG-CE2 3.63Å; H118-Y150 AromaticContact CG-CZ 3.65Å; H118-Y150 PolarHBondContact N-O 3.41Å; H118-Y150 PolarHBondContact O-N 2.9Å; Q120-Y150 PolarHBondContact O-OH 2.88Å; K148-Y150 VanDerWaalsContact O-CD1 3.3Å; K148-Y150 WeakPolarHBondContact O-CD1 3.16Å; K148-Y150 PolarHBondContact O-N 3.38Å
151	L	96.8	Very high	90.4	Very high	11 Å²	11	64.5 Å²	64.5	6%	0.058	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.4	-179.8	-174.8	69.7	0	0	0	109.4	F66 L105 I115 L117 V153	F66-L151 HydrophobicContact CD1-CD2 4.13Å; F66-L151 HydrophobicContact CD2-CD2 3.84Å; F66-L151 HydrophobicContact CE1-CD2 3.99Å; F66-L151 HydrophobicContact CE2-CD2 3.72Å; F66-L151 HydrophobicContact CG-CD2 4.07Å; F66-L151 HydrophobicContact CZ-CD2 3.81Å; L105-L151 HydrophobicContact CD1-CD1 4.19Å; L105-L151 HydrophobicContact CD2-CD1 3.87Å; I115-L151 HydrophobicContact CG2-CD1 3.85Å; L117-L151 HydrophobicContact CD1-CB 4.35Å; L117-L151 HydrophobicContact CD1-CD1 4.12Å; L151-V153 HydrophobicContact CD1-CG2 4.27Å; L151-V153 HydrophobicContact CD2-CG2 3.83Å; L151-V153 HydrophobicContact CG-CG2 3.78Å
152	N	95.6	Very high	89.7	Confident	71 Å²	71	70 Å²	70	38%	0.38	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	116.7	170.9	-178.7	5.1	0	0	0	109.1	S116	S116-N152 PolarHBondContact N-O 3.21Å; S116-N152 PolarHBondContact O-N 3.47Å; S116-N152 PolarHBondContact OG-O 2.87Å
153	V	95.2	Very high	89.4	Confident	4 Å²	4	67 Å²	67	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	121.4	177	-172.4	0	0	0	0	108.5	F75 F109 V113 N114 I115 L151 F163	F75-V153 HydrophobicContact CD2-CB 3.78Å; F75-V153 HydrophobicContact CD2-CG1 4.25Å; F75-V153 HydrophobicContact CD2-CG2 3.74Å; F75-V153 HydrophobicContact CE2-CB 3.97Å; F75-V153 HydrophobicContact CE2-CG1 3.91Å; F75-V153 HydrophobicContact CE2-CG2 4.17Å; F109-V153 HydrophobicContact CE1-CG1 4.06Å; F109-V153 HydrophobicContact CE1-CG2 4.4Å; V113-V153 HydrophobicContact CB-CG1 3.67Å; V113-V153 HydrophobicContact CG1-CG1 3.77Å; V113-V153 HydrophobicContact CG2-CG1 4.09Å; N114-V153 WeakPolarHBondContact O-CA 3.21Å; I115-V153 HydrophobicContact CG1-CG1 4.39Å; I115-V153 HydrophobicContact CG2-CG2 4.33Å; L151-V153 HydrophobicContact CD1-CG2 4.27Å; L151-V153 HydrophobicContact CD2-CG2 3.83Å; L151-V153 HydrophobicContact CG-CG2 3.78Å; V153-F163 HydrophobicContact CG1-CZ 4.32Å
154	T	93.4	Very high	89.3	Confident	62 Å²	62	71 Å²	71	38%	0.38	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	152.1	174.7	63.5	0	0	0	0	110.4	V113 N114	V113-T154 CarbonylContact C-O 3.52Å; V113-T154 VanDerWaalsContact CA-O 3.23Å; V113-T154 WeakPolarHBondContact CA-O 3.33Å; V113-T154 WeakPolarHBondContact CB-O 3.21Å; N114-T154 PolarHBondContact N-O 2.94Å; N114-T154 PolarHBondContact O-N 3.35Å
155	T	90.8	Very high	89.4	Confident	24 Å²	24	68.3 Å²	68.3	15%	0.147	35%	0.353	C	S	.	.			trans	-136.7	138.8	177.2	-171.5	0	0	0	0	108.7	Q111 E112 N157 L160 F163	Q111-T155 VanDerWaalsContact NE2-CG2 3.25Å; Q111-T155 PolarHBondContact NE2-OG1 2.91Å; E112-T155 PolarHBondContact O-OG1 3.36Å; T155-N157 PolarHBondContact O-N 3.31Å; T155-L160 HydrophobicContact CG2-CD2 4.13Å; T155-F163 HydrophobicContact CG2-CE1 4.46Å; T155-F163 HydrophobicContact CG2-CZ 4.48Å
156	D	83.3	Confident	89.5	Confident	126 Å²	126	68.7 Å²	68.7	67%	0.674	36%	0.361	S	S	*	.			trans	-82.1	-6.1	178.9	-61.9	-28.1	0	0	0	111.5
157	N	72.9	Confident	89.6	Confident	80 Å²	80	64.1 Å²	64.1	43%	0.428	36%	0.357	S	S	.	.			trans	-74.8	132.9	-178.5	-80.1	-4.1	0	0	0	111.5	Q111 T155 S159	Q111-N157 WeakPolarHBondContact CB-ND2 3.33Å; Q111-N157 VanDerWaalsContact CD-ND2 3.29Å; Q111-N157 PolarHBondContact OE1-ND2 2.92Å; T155-N157 PolarHBondContact O-N 3.31Å; N157-S159 VanDerWaalsContact C-N 3.3Å; N157-S159 PolarHBondContact O-N 3.39Å
158	T	70.9	Confident	89.6	Confident	151 Å²	151	64.1 Å²	64.1	93%	0.926	36%	0.357	S	S	*	.	S	Bend	trans	-73.4	-20.6	178.9	46.2	0	0	0	0	113.6
159	S	78.9	Confident	89.6	Confident	55 Å²	55	61 Å²	61	39%	0.385	34%	0.344	S	S	.	.			trans	-93.5	121.4	176.8	-175.5	0	0	0	0	110.5	N157	N157-S159 VanDerWaalsContact C-N 3.3Å; N157-S159 PolarHBondContact O-N 3.39Å
160	L	82.4	Confident	89.5	Confident	60 Å²	60	61 Å²	61	31%	0.314	34%	0.344	S	S	.	.			trans	-104.6	-6.5	171.5	-67.5	174.3	0	0	0	112.2	Y69 K71 T155 D162 F163	Y69-L160 HydrophobicContact CD1-CD2 4.3Å; Y69-L160 HydrophobicContact CE1-CD1 4.25Å; Y69-L160 HydrophobicContact CE1-CD2 3.78Å; K71-L160 HydrophobicContact CB-CD1 4.42Å; K71-L160 HydrophobicContact CD-CD1 4.36Å; K71-L160 HydrophobicContact CG-CD1 4.12Å; T155-L160 HydrophobicContact CG2-CD2 4.13Å; L160-D162 PolarHBondContact O-N 2.89Å; L160-F163 HydrophobicContact CD2-CB 4.19Å; L160-F163 HydrophobicContact CD2-CD1 4.03Å; L160-F163 HydrophobicContact CD2-CG 4.37Å; L160-F163 PolarHBondContact O-N 2.89Å
161	D	78.4	Confident	89.5	Confident	154 Å²	154	59.7 Å²	59.7	82%	0.824	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-30.4	-171.2	-66.4	-15.2	0	0	0	112.5
162	D	81.6	Confident	89.5	Confident	128 Å²	128	59.1 Å²	59.1	68%	0.684	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	13.2	176.1	-72.5	-34.2	0	0	0	113.1	S110 L160 H164	S110-D162 PolarHBondContact OG-O 2.91Å; L160-D162 PolarHBondContact O-N 2.89Å; D162-H164 PolarHBondContact O-N 3.44Å; D162-H164 VanDerWaalsContact O-N 3.09Å; D162-H164 PolarHBondContact O-ND1 3.4Å
163	F	91.1	Very high	89.4	Confident	15 Å²	15	58.6 Å²	58.6	7%	0.066	34%	0.335	C	S	.	.			trans	-78	102.1	-176.2	-175.7	-129.9	0	0	0	111.9	Y69 F75 F109 Q111 V113 V153 T155 L160	Y69-F163 AromaticContact CD1-CD1 3.62Å; Y69-F163 HydrophobicContact CD1-CD1 3.62Å; Y69-F163 HydrophobicContact CD1-CE1 4.01Å; Y69-F163 AromaticContact CD2-CD1 3.91Å; Y69-F163 HydrophobicContact CD2-CD1 3.91Å; Y69-F163 AromaticContact CD2-CE1 3.46Å; Y69-F163 HydrophobicContact CD2-CE1 3.46Å; Y69-F163 VanDerWaalsContact CD2-CE1 3.46Å; Y69-F163 AromaticContact CE1-CD1 3.96Å; Y69-F163 HydrophobicContact CE1-CD1 3.96Å; Y69-F163 HydrophobicContact CE1-CE1 4.13Å; Y69-F163 HydrophobicContact CE2-CD1 4.23Å; Y69-F163 AromaticContact CE2-CE1 3.6Å; Y69-F163 HydrophobicContact CE2-CE1 3.6Å; Y69-F163 AromaticContact CG-CD1 3.58Å; Y69-F163 HydrophobicContact CG-CD1 3.58Å; Y69-F163 AromaticContact CG-CE1 3.66Å; Y69-F163 HydrophobicContact CG-CE1 3.66Å; Y69-F163 AromaticContact CZ-CE1 3.94Å; F75-F163 AromaticContact CE2-CE1 3.66Å; F75-F163 HydrophobicContact CE2-CE1 3.66Å; F75-F163 AromaticContact CE2-CZ 3.56Å; F75-F163 HydrophobicContact CE2-CZ 3.56Å; F75-F163 HydrophobicContact CZ-CD1 4.33Å; F75-F163 AromaticContact CZ-CE1 3.64Å; F75-F163 HydrophobicContact CZ-CE1 3.64Å; F75-F163 HydrophobicContact CZ-CE2 4.29Å; F75-F163 AromaticContact CZ-CZ 3.63Å; F75-F163 HydrophobicContact CZ-CZ 3.63Å; F109-F163 HydrophobicContact CD1-CE2 4.38Å; F109-F163 HydrophobicContact CD1-CZ 4.45Å; Q111-F163 HydrophobicContact CG-CD2 3.57Å; Q111-F163 HydrophobicContact CG-CE2 3.76Å; Q111-F163 VanDerWaalsContact NE2-CD2 3.32Å; V113-F163 HydrophobicContact CG1-CE2 3.64Å; V113-F163 HydrophobicContact CG1-CZ 3.7Å; V153-F163 HydrophobicContact CG1-CZ 4.32Å; T155-F163 HydrophobicContact CG2-CE1 4.46Å; T155-F163 HydrophobicContact CG2-CZ 4.48Å; L160-F163 HydrophobicContact CD2-CB 4.19Å; L160-F163 HydrophobicContact CD2-CD1 4.03Å; L160-F163 HydrophobicContact CD2-CG 4.37Å; L160-F163 PolarHBondContact O-N 2.89Å
164	H	93.4	Very high	89.4	Confident	83 Å²	83	58.9 Å²	58.9	38%	0.384	34%	0.336	S	S	.	.			trans	-134.3	164	177.6	64.9	-82.2	0	0	0	112.5	S110 D162	S110-H164 VanDerWaalsContact CB-CE1 3.49Å; S110-H164 WeakPolarHBondContact CB-CE1 3.39Å; S110-H164 PolarHBondContact N-O 3.36Å; S110-H164 PolarHBondContact OG-N 2.89Å; S110-H164 PolarHBondContact OG-O 2.88Å; D162-H164 PolarHBondContact O-N 3.44Å; D162-H164 VanDerWaalsContact O-N 3.09Å; D162-H164 PolarHBondContact O-ND1 3.4Å
165	V	96.5	Very high	89.3	Confident	6 Å²	6	60.5 Å²	60.5	4%	0.036	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.2	171.5	65.6	0	0	0	0	110.1	F66 F75 Y108 F109	F66-V165 HydrophobicContact CD2-CG1 3.95Å; F66-V165 HydrophobicContact CE2-CG1 4.19Å; F66-V165 HydrophobicContact CE2-CG2 4.16Å; F66-V165 WeakPolarHBondContact O-CG1 3.3Å; F75-V165 HydrophobicContact CD1-CG1 3.85Å; F75-V165 HydrophobicContact CE1-CB 3.89Å; F75-V165 HydrophobicContact CE1-CG1 3.36Å; F75-V165 HydrophobicContact CZ-CB 3.9Å; F75-V165 HydrophobicContact CZ-CG1 3.88Å; Y108-V165 CarbonylContact O-C 3.56Å; Y108-V165 WeakPolarHBondContact O-CA 3.02Å; F109-V165 HydrophobicContact CD1-CB 3.87Å; F109-V165 HydrophobicContact CD1-CG2 3.8Å; F109-V165 HydrophobicContact CE1-CB 3.96Å; F109-V165 HydrophobicContact CE1-CG2 3.68Å; F109-V165 HydrophobicContact CE2-CG2 4.48Å; F109-V165 HydrophobicContact CG-CG2 4.28Å; F109-V165 HydrophobicContact CZ-CG2 4.05Å
166	N	96.6	Very high	89.1	Confident	96 Å²	96	61.7 Å²	61.7	51%	0.513	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133	173	-68.6	-42.6	0	0	0	109.6	Y108 G168	Y108-N166 PolarHBondContact N-O 3.27Å; Y108-N166 PolarHBondContact O-N 3.37Å; N166-G168 VanDerWaalsContact C-N 3.27Å; N166-G168 PolarHBondContact O-N 2.95Å
167	G	95.1	Very high	88.5	Confident	56 Å²	56	59.3 Å²	59.3	58%	0.577	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	64	29.2	179.2	0	0	0	0	0	114.1	E169	G167-E169 PolarHBondContact O-N 2.81Å; G167-E169 VanDerWaalsContact O-N 3.16Å
168	G	97	Very high	88.3	Confident	3 Å²	3	58.8 Å²	58.8	3%	0.031	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	110.2	174.2	0	0	0	0	0	111	Q65 F66 K106 N166	Q65-G168 WeakPolarHBondContact CA-O 3.34Å; F66-G168 VanDerWaalsContact CE1-C 3.5Å; F66-G168 PolarHBondContact N-O 2.7Å; F66-G168 VanDerWaalsContact N-O 3.17Å; F66-G168 WeakPolarHBondContact O-CA 3.42Å; K106-G168 WeakPolarHBondContact O-CA 3.32Å; N166-G168 VanDerWaalsContact C-N 3.27Å; N166-G168 PolarHBondContact O-N 2.95Å
169	E	96.9	Very high	88.6	Confident	32 Å²	32	56.6 Å²	56.6	15%	0.15	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	130.5	-174.7	178.1	-177.8	82.8	0	0	110.7	K63 V64 L105 K106 G167 I171	K63-E169 WeakPolarHBondContact CE-OE2 3.24Å; K63-E169 HydrophobicContact CG-CG 4.4Å; K63-E169 IonicContact NZ-OE2 2.63Å; K63-E169 PolarHBondContact NZ-OE2 3.44Å; V64-E169 WeakPolarHBondContact O-CA 3.49Å; L105-E169 WeakPolarHBondContact CA-O 3.19Å; K106-E169 HydrophobicContact CB-CB 4.42Å; K106-E169 PolarHBondContact N-O 2.92Å; K106-E169 PolarHBondContact O-N 3.35Å; G167-E169 PolarHBondContact O-N 2.81Å; G167-E169 VanDerWaalsContact O-N 3.16Å; E169-I171 HydrophobicContact CG-CD1 4.1Å; E169-I171 HydrophobicContact CG-CG1 3.92Å; E169-I171 WeakPolarHBondContact OE1-CD1 3.32Å
170	L	97.1	Very high	88.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	122.9	171.8	173.4	61.6	0	0	0	108.8	V64 F66 I103 S104 L105 L117 V149 L172	V64-L170 HydrophobicContact CB-CB 4.44Å; V64-L170 PolarHBondContact N-O 3.5Å; V64-L170 PolarHBondContact O-N 3.25Å; F66-L170 HydrophobicContact CD1-CB 4.5Å; F66-L170 HydrophobicContact CE1-CB 4.23Å; I103-L170 HydrophobicContact CG2-CD1 3.85Å; S104-L170 CarbonylContact O-C 3.58Å; S104-L170 WeakPolarHBondContact O-CA 3.43Å; L105-L170 HydrophobicContact CB-CD1 4.48Å; L105-L170 HydrophobicContact CD1-CB 3.99Å; L105-L170 HydrophobicContact CD1-CD1 4.1Å; L117-L170 HydrophobicContact CD1-CD1 4.28Å; L117-L170 HydrophobicContact CD1-CD2 4.05Å; L117-L170 HydrophobicContact CD2-CD1 4.29Å; V149-L170 HydrophobicContact CG1-CD2 4.47Å; L170-L172 HydrophobicContact CD1-CD1 3.74Å; L170-L172 HydrophobicContact CD2-CD1 3.98Å; L170-L172 HydrophobicContact CG-CD1 3.58Å
171	I	96.1	Very high	89.1	Confident	36 Å²	36	59.1 Å²	59.1	19%	0.185	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	132.4	178.3	-60.9	169.5	0	0	0	108.8	I62 K63 I103 S104 E169 I173	I62-I171 WeakPolarHBondContact O-CA 3.36Å; K63-I171 HydrophobicContact CB-CG1 4.16Å; K63-I171 HydrophobicContact CD-CD1 4.38Å; K63-I171 HydrophobicContact CD-CG1 4.38Å; K63-I171 HydrophobicContact CG-CG1 4.03Å; I103-I171 CarbonylContact C-O 3.58Å; I103-I171 WeakPolarHBondContact CA-O 3.48Å; S104-I171 PolarHBondContact N-O 2.89Å; S104-I171 PolarHBondContact O-N 2.91Å; E169-I171 HydrophobicContact CG-CD1 4.1Å; E169-I171 HydrophobicContact CG-CG1 3.92Å; E169-I171 WeakPolarHBondContact OE1-CD1 3.32Å; I171-I173 HydrophobicContact CG2-CD1 4.02Å; I171-I173 HydrophobicContact CG2-CG1 3.78Å
172	L	95.9	Very high	89.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.2	170.3	-71.4	77.9	0	0	0	109	S61 I62 M86 V93 I95 Y101 L102 I103 V149 L170	S61-L172 WeakPolarHBondContact CA-O 3.48Å; I62-L172 HydrophobicContact CG2-CB 4.07Å; I62-L172 HydrophobicContact CG2-CD1 4.38Å; I62-L172 PolarHBondContact N-O 2.89Å; I62-L172 PolarHBondContact O-N 3.35Å; M86-L172 HydrophobicContact CE-CB 4.42Å; M86-L172 HydrophobicContact CE-CD2 4.4Å; V93-L172 HydrophobicContact CG1-CD2 4.12Å; V93-L172 HydrophobicContact CG2-CD1 4.46Å; I95-L172 HydrophobicContact CD1-CD2 3.9Å; Y101-L172 HydrophobicContact CD1-CB 4.36Å; L102-L172 CarbonylContact O-C 3.52Å; L102-L172 WeakPolarHBondContact O-CA 3.31Å; I103-L172 HydrophobicContact CG1-CG 4.25Å; I103-L172 HydrophobicContact CG2-CG 4.45Å; V149-L172 HydrophobicContact CB-CD2 3.97Å; V149-L172 HydrophobicContact CG1-CD2 4.13Å; V149-L172 HydrophobicContact CG2-CD2 3.83Å; L170-L172 HydrophobicContact CD1-CD1 3.74Å; L170-L172 HydrophobicContact CD2-CD1 3.98Å; L170-L172 HydrophobicContact CG-CD1 3.58Å
173	I	94.6	Very high	89.1	Confident	60 Å²	60	57 Å²	57	31%	0.308	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	116.2	178.2	-49.7	177.8	0	0	0	108.9	I59 Y101 L102 I171 Q175	I59-I173 HydrophobicContact CG2-CG2 4.25Å; Y101-I173 WeakPolarHBondContact CA-O 3.37Å; L102-I173 HydrophobicContact CB-CB 4.41Å; L102-I173 PolarHBondContact N-O 3.23Å; L102-I173 PolarHBondContact O-N 3.44Å; I171-I173 HydrophobicContact CG2-CD1 4.02Å; I171-I173 HydrophobicContact CG2-CG1 3.78Å; I173-Q175 PolarHBondContact O-NE2 3.46Å
174	H	93.9	Very high	89	Confident	10 Å²	10	59.1 Å²	59.1	5%	0.046	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134	174.3	-175.7	-138.3	0	0	0	111.2	Q60 D98 Y101 N176	Q60-H174 HydrophobicContact CB-CB 3.75Å; Q60-H174 VanDerWaalsContact O-CB 3.31Å; Q60-H174 WeakPolarHBondContact O-CB 3.28Å; Q60-H174 PolarHBondContact O-N 2.91Å; D98-H174 PolarHBondContact O-NE2 2.82Å; Y101-H174 HydrophobicContact CD1-CB 4.09Å; Y101-H174 HydrophobicContact CE1-CB 3.6Å; Y101-H174 AromaticContact CE2-CD2 3.56Å; Y101-H174 AromaticContact CZ-CD2 3.61Å; Y101-H174 AromaticContact CZ-CG 3.93Å; H174-N176 VanDerWaalsContact CE1-C 3.44Å; H174-N176 PolarHBondContact CE1-O 2.84Å; H174-N176 PolarHBondContact NE2-O 3.18Å
175	Q	92.8	Very high	88.7	Confident	95 Å²	95	57.8 Å²	57.8	44%	0.444	34%	0.337	S	S	.	.			trans	-104	-10.1	-174.8	-57.2	-58.9	-61.3	0	0	113.2	F100 L102 I173 P177	F100-Q175 HydrophobicContact CB-CB 4.36Å; F100-Q175 WeakPolarHBondContact O-CB 3.39Å; F100-Q175 PolarHBondContact O-N 3.04Å; L102-Q175 HydrophobicContact CB-CG 4.29Å; I173-Q175 PolarHBondContact O-NE2 3.46Å; Q175-P177 VanDerWaalsContact O-CD 3.25Å; Q175-P177 WeakPolarHBondContact O-CD 3.21Å
176	N	85.9	Confident	88.3	Confident	49 Å²	49	60.7 Å²	60.7	26%	0.262	35%	0.354	S	S	.	.			trans	-119.2	73	-172.2	-61	94.7	0	0	0	112.3	F100 H174 G178 E179	F100-N176 WeakPolarHBondContact CA-OD1 3.27Å; F100-N176 VanDerWaalsContact CB-OD1 3.29Å; F100-N176 WeakPolarHBondContact CB-OD1 3.31Å; F100-N176 VanDerWaalsContact CD2-OD1 3.31Å; F100-N176 WeakPolarHBondContact CD2-OD1 3.38Å; F100-N176 PolarHBondContact N-OD1 3.21Å; H174-N176 VanDerWaalsContact CE1-C 3.44Å; H174-N176 PolarHBondContact CE1-O 2.84Å; H174-N176 PolarHBondContact NE2-O 3.18Å; N176-G178 PolarHBondContact O-N 2.93Å; N176-E179 HydrophobicContact CB-CG 3.78Å; N176-E179 PolarHBondContact O-N 3.43Å
177	P	71.3	Confident	87.8	Confident	76 Å²	76	58.6 Å²	58.6	49%	0.494	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	127.7	176.7	27	-33.3	0	0	0	110.6	Q175	Q175-P177 VanDerWaalsContact O-CD 3.25Å; Q175-P177 WeakPolarHBondContact O-CD 3.21Å
178	G	68.6	Low	87.3	Confident	70 Å²	70	58.8 Å²	58.8	72%	0.722	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	109	-4.2	177.5	0	0	0	0	0	115.8	N176	N176-G178 PolarHBondContact O-N 2.93Å
179	E	76.1	Confident	86.7	Confident	105 Å²	105	62.5 Å²	62.5	49%	0.491	35%	0.35	S	S	.	.	S	Bend	trans	-69.8	170.7	169.4	-72.6	-65.5	166.6	0	0	112.6	D98 N176 C181	D98-E179 HydrophobicContact CB-CB 4.48Å; D98-E179 WeakPolarHBondContact O-CB 3.28Å; N176-E179 HydrophobicContact CB-CG 3.78Å; N176-E179 PolarHBondContact O-N 3.43Å; E179-C181 PolarHBondContact O-N 2.94Å; E179-C181 PolarHBondContact O-SG 3.12Å
180	F	84.4	Confident	86	Confident	117 Å²	117	64.7 Å²	64.7	51%	0.513	36%	0.364	S	S	.	.			trans	-55.2	129.7	178.1	177	-99	0	0	0	111.2	C97 D98 Y145 V182	C97-F180 CarbonylContact C-O 3.46Å; C97-F180 WeakPolarHBondContact CA-O 3.45Å; D98-F180 PolarHBondContact N-O 2.71Å; Y145-F180 HydrophobicContact CD1-CE1 4.1Å; Y145-F180 HydrophobicContact CG-CE1 4.17Å; F180-V182 HydrophobicContact CE1-CG2 3.77Å; F180-V182 HydrophobicContact CZ-CG2 3.72Å
181	C	86.9	Confident	85.1	Confident	51 Å²	51	69.7 Å²	69.7	35%	0.345	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-139.1	142.8	-178.2	-71.5	0	0	0	0	111.2	N96 C97 E179	N96-C181 CarbonylContact O-C 3.51Å; N96-C181 WeakPolarHBondContact O-CA 3.5Å; C97-C181 HydrophobicContact CB-CB 4.1Å; C97-C181 WeakPolarHBondContact CB-SG 3.13Å; C97-C181 WeakPolarHBondContact SG-CB 3.44Å; C97-C181 CovalentContact SG-SG 2.03Å; C97-C181 PolarHBondContact SG-SG 2.81Å; E179-C181 PolarHBondContact O-N 2.94Å; E179-C181 PolarHBondContact O-SG 3.12Å
182	V	85	Confident	84.2	Confident	54 Å²	54	72.5 Å²	72.5	33%	0.327	41%	0.409	S	S	.	.			trans	-115.4	108.9	166.6	-175.6	0	0	0	0	108	N96 Y145 F180	N96-V182 WeakPolarHBondContact CB-O 3.3Å; N96-V182 PolarHBondContact O-N 3.32Å; Y145-V182 HydrophobicContact CD1-CG2 4.1Å; Y145-V182 HydrophobicContact CD2-CB 3.94Å; Y145-V182 HydrophobicContact CD2-CG2 3.83Å; Y145-V182 HydrophobicContact CE1-CG2 3.95Å; Y145-V182 HydrophobicContact CE2-CB 3.59Å; Y145-V182 HydrophobicContact CE2-CG1 4.1Å; Y145-V182 HydrophobicContact CE2-CG2 3.69Å; Y145-V182 HydrophobicContact CG-CG2 4.04Å; F180-V182 HydrophobicContact CE1-CG2 3.77Å; F180-V182 HydrophobicContact CZ-CG2 3.72Å
183	L	75	Confident	83.1	Confident	183 Å²	183	79.1 Å²	79.1	96%	0.958	45%	0.446	S	S	*	.			trans	-97.1	0	-177.7	-63.3	176.2	0	0	0	112.1	I85	I85-L183 HydrophobicContact CG2-CD2 4.33Å

Retrieved 183 of 183 residues in 274.3 ms (Link to these results)

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