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Selenoprotein F AlphaSync

May be involved in redox reactions associated with the formation of disulfide bonds (By similarity). May contribute to the quality control of protein folding in the endoplasmic reticulum¹. May regulate protein folding by enhancing the catalytic activity of UGGT1/UGCGL1 and UGGT2/UGCGL2².

AlphaFold DB , UniProt , Accession O60613, Species HUMAN (Homo sapiens, Human), Gene SELENOF, Length 165 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	39.1	Very low	241 Å²	241	129.2 Å²	129.2	100%	1.187	88%	0.878	S	S	*	*				0	157.6	0	-89.3	176.4	-179.2	0	0	108.7
2	V	35.7	Very low	39.2	Very low	149 Å²	149	131.9 Å²	131.9	90%	0.903	88%	0.876	S	S	*	*			trans	84.2	131.4	-174.1	-167	0	0	0	0	113.6
3	A	38.8	Very low	39.6	Very low	89 Å²	89	131.1 Å²	131.1	74%	0.736	87%	0.865	S	S	*	*			cis	-168.2	125.6	-33	0	0	0	0	0	102.8
4	M	37.6	Very low	40.4	Very low	204 Å²	204	130.6 Å²	130.6	100%	1.005	86%	0.861	S	S	*	*			trans	-101.4	122	178.8	-54.7	-169.2	-172.3	0	0	108.2
5	A	37.4	Very low	41.3	Very low	96 Å²	96	126.5 Å²	126.5	79%	0.793	84%	0.842	S	S	*	*			trans	-138.2	141.6	178.4	0	0	0	0	0	110.9
6	A	40	Very low	42	Very low	110 Å²	110	129.1 Å²	129.1	91%	0.909	84%	0.835	S	S	*	*			trans	82.6	114.4	157.4	0	0	0	0	0	119.7
7	G	35.9	Very low	42.6	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	82%	0.816	S	S	*	*			trans	144.1	102.6	143.8	0	0	0	0	0	115.6
8	P	49.7	Very low	43.4	Very low	131 Å²	131	124.7 Å²	124.7	85%	0.851	81%	0.809	S	S	*	*			trans	-117.5	96.2	151.3	31.6	-19.2	0	0	0	110.3
9	S	41.1	Very low	44	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	81%	0.808	S	S	*	*			trans	-94.8	100.1	159.7	-65.4	0	0	0	0	107.3	C11	S9-C11 PolarHBondContact O-N 3.32Å
10	G	38.5	Very low	44.7	Very low	80 Å²	80	129.2 Å²	129.2	83%	0.825	80%	0.801	S	S	*	*			trans	-70.9	113.6	179.7	0	0	0	0	0	111.8
11	C	40.3	Very low	45.2	Very low	131 Å²	131	128.3 Å²	128.3	89%	0.885	79%	0.79	S	S	*	*			trans	-81	117.5	167.7	-68.5	0	0	0	0	109.7	S9	S9-C11 PolarHBondContact O-N 3.32Å
12	L	40.1	Very low	46.3	Very low	162 Å²	162	122.4 Å²	122.4	85%	0.848	76%	0.763	S	S	*	*			trans	-116.7	71.2	-179.1	-120.3	169.7	0	0	0	110.1
13	V	44.6	Very low	47.4	Very low	121 Å²	121	117.9 Å²	117.9	73%	0.733	74%	0.741	S	S	*	*			trans	-150.2	92.9	164.7	-165	0	0	0	0	111.8
14	P	50.3	Low	48.4	Very low	124 Å²	124	117.4 Å²	117.4	81%	0.805	73%	0.729	S	S	*	*			trans	-138.1	77.9	156.8	36.5	-18.4	0	0	0	110.7
15	A	54.3	Low	49.5	Very low	70 Å²	70	111.9 Å²	111.9	58%	0.579	71%	0.707	S	S	*	*	S	Bend	trans	-146.3	-24.9	168.7	0	0	0	0	0	114
16	F	51.9	Low	50.3	Low	168 Å²	168	113.7 Å²	113.7	74%	0.737	70%	0.703	S	S	*	*	H	α-helix	trans	-81	-30.3	-177.1	-75.2	-83.9	0	0	0	114.2	L18	F16-L18 PolarHBondContact O-N 3.48Å
17	G	52.9	Low	51.2	Low	50 Å²	50	115.5 Å²	115.5	52%	0.515	69%	0.692	S	S	.	*	H	α-helix	trans	-68	-36.3	-175.7	0	0	0	0	0	114.4	L20 L21	G17-L20 PolarHBondContact O-N 3.49Å; G17-L21 PolarHBondContact O-N 3.32Å
18	L	55.8	Low	52.2	Low	129 Å²	129	115.1 Å²	115.1	68%	0.675	68%	0.682	S	S	*	*	H	α-helix	trans	-74.7	-32.9	-173.3	-159.6	72.3	0	0	0	112.6	F16 L22	F16-L18 PolarHBondContact O-N 3.48Å; L18-L22 PolarHBondContact O-N 3.22Å
19	R	55.6	Low	52.6	Low	211 Å²	211	113.2 Å²	113.2	80%	0.796	67%	0.668	S	S	*	*	H	α-helix	trans	-71.2	-34.8	176.2	-75.9	-167.6	173.4	-160.6	-0.8	112.6	A23	R19-A23 PolarHBondContact O-N 3.35Å
20	L	57	Low	53.1	Low	127 Å²	127	112.2 Å²	112.2	67%	0.665	66%	0.66	S	S	*	*	H	α-helix	trans	-66.9	-42.4	177.7	-120.4	93.4	0	0	0	111.7	G17 L22 A23 T24	G17-L20 PolarHBondContact O-N 3.49Å; L20-L22 PolarHBondContact O-N 3.11Å; L20-A23 PolarHBondContact O-N 3.32Å; L20-T24 PolarHBondContact O-N 3.43Å; L20-T24 VanDerWaalsContact O-N 3.12Å; L20-T24 PolarHBondContact O-OG1 3.31Å
21	L	57.1	Low	53.7	Low	111 Å²	111	112.3 Å²	112.3	58%	0.581	65%	0.654	S	S	*	*	H	α-helix	trans	-61.8	-43.5	177.6	-91.3	155.5	0	0	0	112.3	G17 A23 T24 V25	G17-L21 PolarHBondContact O-N 3.32Å; L21-A23 VanDerWaalsContact C-N 3.32Å; L21-A23 PolarHBondContact O-N 3.19Å; L21-T24 WeakPolarHBondContact CA-OG1 3.39Å; L21-T24 PolarHBondContact O-N 3.13Å; L21-T24 PolarHBondContact O-OG1 3.44Å; L21-V25 WeakPolarHBondContact O-CG2 3.45Å; L21-V25 PolarHBondContact O-N 3.5Å; L21-V25 VanDerWaalsContact O-N 3.11Å
22	L	58.2	Low	54.2	Low	118 Å²	118	114.2 Å²	114.2	62%	0.618	65%	0.647	S	S	*	*	H	α-helix	trans	-63.1	-38	176.9	-79.8	160.3	0	0	0	112.3	L18 L20 V25 L26	L18-L22 PolarHBondContact O-N 3.22Å; L20-L22 PolarHBondContact O-N 3.11Å; L22-V25 PolarHBondContact O-N 2.76Å; L22-L26 PolarHBondContact O-N 3.12Å; L22-L26 VanDerWaalsContact O-N 3.13Å
23	A	58.4	Low	54.4	Low	53 Å²	53	109.5 Å²	109.5	44%	0.438	64%	0.638	S	S	.	*	H	α-helix	trans	-66.9	-38.9	177.3	0	0	0	0	0	112.4	R19 L20 L21 L26 Q27	R19-A23 PolarHBondContact O-N 3.35Å; L20-A23 PolarHBondContact O-N 3.32Å; L21-A23 VanDerWaalsContact C-N 3.32Å; L21-A23 PolarHBondContact O-N 3.19Å; A23-L26 PolarHBondContact O-N 3.36Å; A23-Q27 PolarHBondContact O-N 3.27Å
24	T	59.8	Low	54.8	Low	80 Å²	80	107.8 Å²	107.8	49%	0.491	64%	0.636	S	S	.	*	H	α-helix	trans	-67.5	-36	176.4	47.7	0	0	0	0	113	L20 L21 L26 A28	L20-T24 PolarHBondContact O-N 3.43Å; L20-T24 VanDerWaalsContact O-N 3.12Å; L20-T24 PolarHBondContact O-OG1 3.31Å; L21-T24 WeakPolarHBondContact CA-OG1 3.39Å; L21-T24 PolarHBondContact O-N 3.13Å; L21-T24 PolarHBondContact O-OG1 3.44Å; T24-L26 VanDerWaalsContact C-N 3.35Å; T24-A28 PolarHBondContact O-N 3.3Å
25	V	60.5	Low	54.8	Low	88 Å²	88	110.8 Å²	110.8	53%	0.533	64%	0.64	S	S	.	*	H	α-helix	trans	-67.2	-39.1	175.9	174.3	0	0	0	0	110.6	L21 L22 Q27 A28 V29	L21-V25 WeakPolarHBondContact O-CG2 3.45Å; L21-V25 PolarHBondContact O-N 3.5Å; L21-V25 VanDerWaalsContact O-N 3.11Å; L22-V25 PolarHBondContact O-N 2.76Å; V25-Q27 PolarHBondContact O-N 3.42Å; V25-A28 PolarHBondContact O-N 2.9Å; V25-V29 PolarHBondContact O-N 3.38Å
26	L	54.9	Low	54.8	Low	134 Å²	134	112.7 Å²	112.7	70%	0.702	64%	0.635	S	S	*	*	H	α-helix	trans	-68.9	-35.3	-178.7	-150.1	72.5	0	0	0	112.5	L22 A23 T24 A28 V29 S30	L22-L26 PolarHBondContact O-N 3.12Å; L22-L26 VanDerWaalsContact O-N 3.13Å; A23-L26 PolarHBondContact O-N 3.36Å; T24-L26 VanDerWaalsContact C-N 3.35Å; L26-A28 VanDerWaalsContact C-N 3.34Å; L26-V29 PolarHBondContact O-N 3.49Å; L26-S30 PolarHBondContact O-OG 3.23Å
27	Q	57.4	Low	55.6	Low	148 Å²	148	107.2 Å²	107.2	69%	0.692	62%	0.618	S	S	*	*	H	α-helix	trans	-70	-29.9	174.2	-73.2	-177.8	-18.7	0	0	113	A23 V25 V29 S30	A23-Q27 PolarHBondContact O-N 3.27Å; V25-Q27 PolarHBondContact O-N 3.42Å; Q27-V29 VanDerWaalsContact C-N 3.33Å; Q27-S30 PolarHBondContact O-OG 3.29Å
28	A	57.6	Low	56.6	Low	63 Å²	63	108.4 Å²	108.4	52%	0.521	62%	0.618	S	S	.	*	H	α-helix	trans	-70.1	-28.6	175.8	0	0	0	0	0	112.9	T24 V25 L26	T24-A28 PolarHBondContact O-N 3.3Å; V25-A28 PolarHBondContact O-N 2.9Å; L26-A28 VanDerWaalsContact C-N 3.34Å
29	V	57.6	Low	57.9	Low	92 Å²	92	108.5 Å²	108.5	56%	0.558	62%	0.615	S	S	*	*	H	α-helix	trans	-77.4	-25.6	178.9	175.8	0	0	0	0	112.3	V25 L26 Q27 A31 F32	V25-V29 PolarHBondContact O-N 3.38Å; L26-V29 PolarHBondContact O-N 3.49Å; Q27-V29 VanDerWaalsContact C-N 3.33Å; V29-A31 PolarHBondContact O-N 3.26Å; V29-F32 WeakPolarHBondContact O-CD2 3.37Å
30	S	53.1	Low	59.3	Low	96 Å²	96	99.9 Å²	99.9	67%	0.671	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-3.8	178.4	33.3	0	0	0	0	115	L26 Q27	L26-S30 PolarHBondContact O-OG 3.23Å; Q27-S30 PolarHBondContact O-OG 3.29Å
31	A	50.4	Low	60.9	Low	83 Å²	83	94.2 Å²	94.2	69%	0.686	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-0.5	176.7	0	0	0	0	0	113.9	V29 G33	V29-A31 PolarHBondContact O-N 3.26Å; A31-G33 PolarHBondContact O-N 2.97Å
32	F	50.4	Low	62.5	Low	171 Å²	171	97.7 Å²	97.7	75%	0.75	57%	0.565	S	S	*	*			trans	-81.2	57.3	169.1	-60.8	-76.9	0	0	0	110.4	V29 A34	V29-F32 WeakPolarHBondContact O-CD2 3.37Å; F32-A34 PolarHBondContact O-N 2.98Å
33	G	45.5	Very low	64	Low	63 Å²	63	100.5 Å²	100.5	65%	0.649	58%	0.575	S	S	*	*			trans	-65.2	93.3	148.9	0	0	0	0	0	105.3	A31 E35	A31-G33 PolarHBondContact O-N 2.97Å; G33-E35 PolarHBondContact O-N 2.79Å
34	A	51.2	Low	65.4	Low	85 Å²	85	101.8 Å²	101.8	70%	0.702	57%	0.574	S	S	*	*			trans	-68.3	81.5	-178.9	0	0	0	0	0	109	F32 F36	F32-A34 PolarHBondContact O-N 2.98Å; A34-F36 PolarHBondContact O-N 2.98Å; A34-F36 VanDerWaalsContact O-N 3.12Å
35	E	50.8	Low	66.8	Low	187 Å²	187	101.1 Å²	101.1	87%	0.874	58%	0.583	S	S	*	*			trans	-62.9	105.4	152.2	-60.9	-167.3	100.5	0	0	105	G33 S37	G33-E35 PolarHBondContact O-N 2.79Å; E35-S37 PolarHBondContact O-N 3.12Å
36	F	54.5	Low	68.3	Low	110 Å²	110	98.3 Å²	98.3	48%	0.482	56%	0.564	S	S	.	*			trans	-53.3	114.3	171.3	-106.9	-95.9	0	0	0	107.2	A34 S38 A40	A34-F36 PolarHBondContact O-N 2.98Å; A34-F36 VanDerWaalsContact O-N 3.12Å; F36-S38 PolarHBondContact O-N 3.42Å; F36-A40 HydrophobicContact CD1-CB 4.27Å
37	S	68.5	Low	70	Confident	53 Å²	53	95.2 Å²	95.2	37%	0.371	55%	0.554	S	S	.	*			trans	-63.8	136.8	179.7	-176.6	0	0	0	0	108.7	E35 E39 A40	E35-S37 PolarHBondContact O-N 3.12Å; S37-E39 PolarHBondContact O-N 2.69Å; S37-E39 WeakPolarHBondContact OG-CG 3.46Å; S37-E39 PolarHBondContact OG-OE1 3.41Å; S37-A40 WeakPolarHBondContact O-CB 3.08Å; S37-A40 PolarHBondContact O-N 3.27Å
38	S	73.9	Confident	71.2	Confident	74 Å²	74	91.7 Å²	91.7	52%	0.517	55%	0.545	S	S	.	.	H	α-helix	trans	-50.2	-24.4	178.6	64	0	0	0	0	114	F36 R42	F36-S38 PolarHBondContact O-N 3.42Å; S38-R42 WeakPolarHBondContact O-CG 3.41Å; S38-R42 PolarHBondContact O-N 3.25Å
39	E	82.9	Confident	72.6	Confident	131 Å²	131	95 Å²	95	61%	0.612	55%	0.554	S	S	*	*	H	α-helix	trans	-70	-42.5	175.5	68.9	-161	98.6	0	0	113	S37 C41 R42 E43	S37-E39 PolarHBondContact O-N 2.69Å; S37-E39 WeakPolarHBondContact OG-CG 3.46Å; S37-E39 PolarHBondContact OG-OE1 3.41Å; E39-C41 VanDerWaalsContact C-N 3.31Å; E39-C41 PolarHBondContact O-N 3.5Å; E39-R42 WeakPolarHBondContact O-CB 3.37Å; E39-R42 PolarHBondContact O-N 3.02Å; E39-E43 PolarHBondContact O-N 3.25Å
40	A	86.1	Confident	74.2	Confident	31 Å²	31	91.9 Å²	91.9	26%	0.256	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-40.2	179.4	0	0	0	0	0	110.8	F36 S37 R42 E43 L44	F36-A40 HydrophobicContact CD1-CB 4.27Å; S37-A40 WeakPolarHBondContact O-CB 3.08Å; S37-A40 PolarHBondContact O-N 3.27Å; A40-R42 VanDerWaalsContact C-N 3.28Å; A40-R42 PolarHBondContact O-N 3.15Å; A40-E43 PolarHBondContact O-N 3.4Å; A40-L44 WeakPolarHBondContact O-CG 3.05Å; A40-L44 PolarHBondContact O-N 2.04Å
41	C	91.4	Very high	76	Confident	7 Å²	7	90.7 Å²	90.7	5%	0.047	52%	0.52	C	S	.	.	H	α-helix	trans	-60.6	-38.6	173.9	-66.2	0	0	0	0	112.1	E39 L44 G45 F46 C73	E39-C41 VanDerWaalsContact C-N 3.31Å; E39-C41 PolarHBondContact O-N 3.5Å; C41-L44 PolarHBondContact O-N 3.41Å; C41-G45 PolarHBondContact O-N 3.48Å; C41-F46 CarbonylContact C-O 3.5Å; C41-F46 HydrophobicContact CB-CB 4.33Å; C41-F46 WeakPolarHBondContact O-CA 3.37Å; C41-F46 WeakPolarHBondContact O-CB 3.38Å; C41-F46 PolarHBondContact O-N 2.03Å; C41-C73 WeakPolarHBondContact CA-SG 3.43Å; C41-C73 HydrophobicContact CB-CB 3.71Å; C41-C73 WeakPolarHBondContact CB-SG 3.41Å; C41-C73 WeakPolarHBondContact SG-CA 3.42Å; C41-C73 WeakPolarHBondContact SG-CB 3.42Å; C41-C73 CovalentContact SG-SG 2.03Å; C41-C73 PolarHBondContact SG-SG 3.16Å
42	R	89.4	Confident	78	Confident	184 Å²	184	87.8 Å²	87.8	69%	0.694	49%	0.494	S	S	*	.	H	α-helix	trans	-69.7	-34.7	176.2	-69.7	176.7	72.9	176.9	3.7	112.8	S38 E39 A40 L44 G45 F46	S38-R42 WeakPolarHBondContact O-CG 3.41Å; S38-R42 PolarHBondContact O-N 3.25Å; E39-R42 WeakPolarHBondContact O-CB 3.37Å; E39-R42 PolarHBondContact O-N 3.02Å; A40-R42 VanDerWaalsContact C-N 3.28Å; A40-R42 PolarHBondContact O-N 3.15Å; R42-L44 VanDerWaalsContact C-N 3.31Å; R42-G45 PolarHBondContact O-N 3.37Å; R42-G45 VanDerWaalsContact O-N 3.09Å; R42-F46 WeakPolarHBondContact CA-O 3.35Å
43	E	90.3	Very high	79.9	Confident	178 Å²	178	81.8 Å²	81.8	83%	0.832	47%	0.474	S	S	*	.	H	α-helix	trans	-66.5	-34.1	173.5	-68.4	-160.7	131.1	0	0	112.3	E39 A40 G45	E39-E43 PolarHBondContact O-N 3.25Å; A40-E43 PolarHBondContact O-N 3.4Å; E43-G45 PolarHBondContact O-N 2.8Å
44	L	88.2	Confident	81.9	Confident	80 Å²	80	81.4 Å²	81.4	42%	0.419	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.5	171.6	-64.6	169.9	0	0	0	113.1	A40 C41 R42 F46 D69	A40-L44 WeakPolarHBondContact O-CG 3.05Å; A40-L44 PolarHBondContact O-N 2.04Å; C41-L44 PolarHBondContact O-N 3.41Å; R42-L44 VanDerWaalsContact C-N 3.31Å; L44-F46 HydrophobicContact CB-CD2 3.82Å; L44-F46 HydrophobicContact CB-CE2 4.11Å; L44-D69 HydrophobicContact CD1-CB 4.22Å
45	G	89.2	Confident	83.9	Confident	66 Å²	66	77.4 Å²	77.4	68%	0.68	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	9.9	179.3	0	0	0	0	0	115	C41 R42 E43	C41-G45 PolarHBondContact O-N 3.48Å; R42-G45 PolarHBondContact O-N 3.37Å; R42-G45 VanDerWaalsContact O-N 3.09Å; E43-G45 PolarHBondContact O-N 2.8Å
46	F	91.9	Very high	85.8	Confident	29 Å²	29	73.2 Å²	73.2	13%	0.127	41%	0.411	C	S	.	.			trans	-91.2	151.2	176.4	-63.6	-68.8	0	0	0	112.8	C41 R42 L44 L50 L66 D69 C70 C73	C41-F46 CarbonylContact C-O 3.5Å; C41-F46 HydrophobicContact CB-CB 4.33Å; C41-F46 WeakPolarHBondContact O-CA 3.37Å; C41-F46 WeakPolarHBondContact O-CB 3.38Å; C41-F46 PolarHBondContact O-N 2.03Å; R42-F46 WeakPolarHBondContact CA-O 3.35Å; L44-F46 HydrophobicContact CB-CD2 3.82Å; L44-F46 HydrophobicContact CB-CE2 4.11Å; F46-L50 HydrophobicContact CB-CD2 4.13Å; F46-L50 HydrophobicContact CD1-CD2 3.47Å; F46-L50 VanDerWaalsContact CD1-CD2 3.47Å; F46-L50 HydrophobicContact CE1-CD2 4.13Å; F46-L50 HydrophobicContact CG-CD2 3.99Å; F46-L66 HydrophobicContact CZ-CB 4.32Å; F46-D69 HydrophobicContact CE2-CB 3.76Å; F46-D69 HydrophobicContact CZ-CB 4.39Å; F46-C70 HydrophobicContact CE1-CB 3.75Å; F46-C70 HydrophobicContact CE2-CB 4.47Å; F46-C70 HydrophobicContact CZ-CB 3.66Å; F46-C73 HydrophobicContact CB-CB 4.21Å; F46-C73 HydrophobicContact CD2-CB 4.29Å; F46-C73 HydrophobicContact CG-CB 4.36Å
47	S	89.4	Confident	87.4	Confident	69 Å²	69	72 Å²	72	48%	0.483	41%	0.409	S	S	.	.			trans	-78.9	152.2	172.7	-179.8	0	0	0	0	110.8	N49 L50	S47-N49 PolarHBondContact O-N 3.41Å; S47-N49 PolarHBondContact OG-N 3.03Å; S47-L50 WeakPolarHBondContact O-CB 2.97Å; S47-L50 PolarHBondContact O-N 3.2Å
48	S	83.4	Confident	88.4	Confident	73 Å²	73	70.4 Å²	70.4	51%	0.51	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-11.3	176.3	60.8	0	0	0	0	114.3
49	N	87.5	Confident	89.1	Confident	133 Å²	133	68.3 Å²	68.3	71%	0.711	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	34.1	177.5	-60.8	-79.7	0	0	0	110.7	S47	S47-N49 PolarHBondContact O-N 3.41Å; S47-N49 PolarHBondContact OG-N 3.03Å
50	L	89.8	Confident	89.5	Confident	27 Å²	27	68.8 Å²	68.8	14%	0.141	39%	0.389	C	S	.	.			trans	-66.9	134.7	178.1	-176.6	67.9	0	0	0	109.8	F46 S47 C74 Q75	F46-L50 HydrophobicContact CB-CD2 4.13Å; F46-L50 HydrophobicContact CD1-CD2 3.47Å; F46-L50 VanDerWaalsContact CD1-CD2 3.47Å; F46-L50 HydrophobicContact CE1-CD2 4.13Å; F46-L50 HydrophobicContact CG-CD2 3.99Å; S47-L50 WeakPolarHBondContact O-CB 2.97Å; S47-L50 PolarHBondContact O-N 3.2Å; L50-C74 HydrophobicContact CB-CB 4.49Å; L50-C74 HydrophobicContact CD2-CB 4.11Å; L50-C74 HydrophobicContact CG-CB 4.1Å; L50-C74 CarbonylContact O-C 3.44Å; L50-C74 WeakPolarHBondContact O-CA 3.3Å; L50-Q75 PolarHBondContact O-N 3.05Å
51	L	92	Very high	89.7	Confident	71 Å²	71	74.1 Å²	74.1	37%	0.372	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-99.3	140.1	176.4	-60.6	177.1	0	0	0	109.9	S53 S54 E77	L51-S53 PolarHBondContact O-N 2.76Å; L51-S54 VanDerWaalsContact O-CB 3.3Å; L51-S54 WeakPolarHBondContact O-CB 3.38Å; L51-S54 PolarHBondContact O-N 3.37Å; L51-E77 HydrophobicContact CB-CG 3.75Å; L51-E77 HydrophobicContact CD1-CG 3.8Å; L51-E77 WeakPolarHBondContact CD1-OE1 3.39Å; L51-E77 HydrophobicContact CD2-CG 3.71Å; L51-E77 HydrophobicContact CG-CG 3.92Å
52	C	92	Very high	89.6	Confident	22 Å²	22	81 Å²	81	15%	0.149	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-24	-173.5	-64.4	0	0	0	0	114.1	S54 C55 C74 Q75	C52-S54 PolarHBondContact O-N 2.92Å; C52-C55 VanDerWaalsContact O-CB 3.31Å; C52-C55 WeakPolarHBondContact O-CB 3.49Å; C52-C55 PolarHBondContact O-N 3.28Å; C52-C74 WeakPolarHBondContact CA-SG 3.45Å; C52-C74 HydrophobicContact CB-CB 3.9Å; C52-C74 WeakPolarHBondContact CB-SG 3.35Å; C52-C74 WeakPolarHBondContact SG-CB 2.96Å; C52-C74 CovalentContact SG-SG 2.04Å; C52-C74 PolarHBondContact SG-SG 3.2Å; C52-Q75 PolarHBondContact N-O 2.91Å; C52-Q75 VanDerWaalsContact N-O 3.09Å; C52-Q75 PolarHBondContact SG-O 3.3Å; C52-Q75 VanDerWaalsContact SG-O 3.4Å
53	S	89.5	Confident	89.6	Confident	45 Å²	45	75.9 Å²	75.9	32%	0.315	43%	0.429	S	S	.	.	H	α-helix	trans	-57.5	-27.8	170.8	54.4	0	0	0	0	113.7	L51 C55 D56 E77	L51-S53 PolarHBondContact O-N 2.76Å; S53-C55 VanDerWaalsContact C-N 3.29Å; S53-C55 PolarHBondContact O-N 3.39Å; S53-D56 PolarHBondContact O-N 3.31Å; S53-E77 WeakPolarHBondContact CB-OE2 3.32Å; S53-E77 PolarHBondContact N-OE2 2.72Å; S53-E77 VanDerWaalsContact OG-CD 3.24Å; S53-E77 PolarHBondContact OG-OE1 2.83Å; S53-E77 PolarHBondContact OG-OE2 2.84Å
54	S	88.8	Confident	89.6	Confident	54 Å²	54	72.9 Å²	72.9	38%	0.378	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-27.8	175.4	-60.9	0	0	0	0	112.2	L51 C52 L57	L51-S54 VanDerWaalsContact O-CB 3.3Å; L51-S54 WeakPolarHBondContact O-CB 3.38Å; L51-S54 PolarHBondContact O-N 3.37Å; C52-S54 PolarHBondContact O-N 2.92Å; S54-L57 PolarHBondContact O-N 2.82Å
55	C	92.6	Very high	89.8	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.014	44%	0.437	C	S	.	.	H	α-helix	trans	-70.8	-35.2	176.8	-54	0	0	0	0	111.5	C52 S53 L57 L58 C70 R71	C52-C55 VanDerWaalsContact O-CB 3.31Å; C52-C55 WeakPolarHBondContact O-CB 3.49Å; C52-C55 PolarHBondContact O-N 3.28Å; S53-C55 VanDerWaalsContact C-N 3.29Å; S53-C55 PolarHBondContact O-N 3.39Å; C55-L57 PolarHBondContact O-N 2.94Å; C55-L58 HydrophobicContact CB-CD1 4.31Å; C55-L58 VanDerWaalsContact O-CB 3.3Å; C55-L58 WeakPolarHBondContact O-CB 3.34Å; C55-L58 WeakPolarHBondContact O-CG 3.3Å; C55-L58 PolarHBondContact O-N 3.35Å; C55-L58 VanDerWaalsContact O-N 3.14Å; C55-C70 WeakPolarHBondContact CA-SG 3.47Å; C55-C70 HydrophobicContact CB-CB 3.86Å; C55-C70 WeakPolarHBondContact CB-SG 3.44Å; C55-C70 WeakPolarHBondContact SG-CB 3.04Å; C55-C70 CovalentContact SG-SG 2.03Å; C55-C70 PolarHBondContact SG-SG 3.34Å; C55-R71 HydrophobicContact CB-CG 4.32Å
56	D	90.3	Very high	89.9	Confident	98 Å²	98	77.5 Å²	77.5	52%	0.524	42%	0.421	S	S	.	.	H	α-helix	trans	-66.2	-23.9	178.2	-58.5	-51.5	0	0	0	112.7	S53 R71	S53-D56 PolarHBondContact O-N 3.31Å; D56-R71 IonicContact OD1-CZ 2.93Å; D56-R71 IonicContact OD1-NH1 3.92Å; D56-R71 IonicContact OD1-NH2 2.97Å; D56-R71 PolarHBondContact OD1-NH2 2.88Å
57	L	89.1	Confident	89.9	Confident	84 Å²	84	77.9 Å²	77.9	44%	0.44	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-78.6	-18.2	176.6	-63.5	174	0	0	0	113.5	S54 C55 G59 Q60 F61	S54-L57 PolarHBondContact O-N 2.82Å; C55-L57 PolarHBondContact O-N 2.94Å; L57-G59 PolarHBondContact O-N 2.67Å; L57-G59 VanDerWaalsContact O-N 3.11Å; L57-Q60 WeakPolarHBondContact O-CB 3.31Å; L57-Q60 PolarHBondContact O-N 2.95Å; L57-F61 WeakPolarHBondContact O-CD2 3.43Å
58	L	89	Confident	90	Very high	20 Å²	20	78.9 Å²	78.9	11%	0.105	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-56.6	-31.9	-177.5	-70.7	168.3	0	0	0	112.3	C55 Q60 F61 N62 L63 L66 D67 C70	C55-L58 HydrophobicContact CB-CD1 4.31Å; C55-L58 VanDerWaalsContact O-CB 3.3Å; C55-L58 WeakPolarHBondContact O-CB 3.34Å; C55-L58 WeakPolarHBondContact O-CG 3.3Å; C55-L58 PolarHBondContact O-N 3.35Å; C55-L58 VanDerWaalsContact O-N 3.14Å; L58-Q60 VanDerWaalsContact C-N 3.3Å; L58-Q60 PolarHBondContact O-N 3.09Å; L58-F61 PolarHBondContact O-N 2.03Å; L58-N62 PolarHBondContact O-N 2.88Å; L58-L63 HydrophobicContact CB-CB 4.03Å; L58-L63 HydrophobicContact CD2-CB 3.7Å; L58-L63 HydrophobicContact CD2-CD1 4.01Å; L58-L63 HydrophobicContact CG-CB 4.47Å; L58-L63 PolarHBondContact O-N 2.97Å; L58-L66 HydrophobicContact CD1-CB 4.2Å; L58-D67 HydrophobicContact CD1-CB 4.48Å; L58-C70 HydrophobicContact CD1-CB 3.79Å
59	G	88.4	Confident	90.4	Very high	30 Å²	30	78.2 Å²	78.2	31%	0.309	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-59.1	-36.7	176.5	0	0	0	0	0	114.2	L57 F61 N62	L57-G59 PolarHBondContact O-N 2.67Å; L57-G59 VanDerWaalsContact O-N 3.11Å; G59-F61 PolarHBondContact O-N 3.18Å; G59-N62 PolarHBondContact O-N 3.18Å
60	Q	90.7	Very high	90.6	Very high	142 Å²	142	72 Å²	72	66%	0.664	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-67.2	-24.9	-179.5	-62.7	177.8	33.1	0	0	112.3	L57 L58	L57-Q60 WeakPolarHBondContact O-CB 3.31Å; L57-Q60 PolarHBondContact O-N 2.95Å; L58-Q60 VanDerWaalsContact C-N 3.3Å; L58-Q60 PolarHBondContact O-N 3.09Å
61	F	91.1	Very high	90.7	Very high	142 Å²	142	76.2 Å²	76.2	62%	0.623	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-102.2	11	-179.6	-57.1	-74.3	0	0	0	112.9	L57 L58 G59 L63	L57-F61 WeakPolarHBondContact O-CD2 3.43Å; L58-F61 PolarHBondContact O-N 2.03Å; G59-F61 PolarHBondContact O-N 3.18Å; F61-L63 HydrophobicContact CB-CD1 3.94Å; F61-L63 HydrophobicContact CB-CG 4.03Å; F61-L63 PolarHBondContact O-N 2.67Å
62	N	89.5	Confident	90.7	Very high	152 Å²	152	74.4 Å²	74.4	81%	0.813	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	31.2	-173.5	-58.3	-74.2	0	0	0	113.8	L58 G59	L58-N62 PolarHBondContact O-N 2.88Å; G59-N62 PolarHBondContact O-N 3.18Å
63	L	90.2	Very high	90.7	Very high	76 Å²	76	74 Å²	74	40%	0.398	40%	0.397	S	S	.	.			trans	-103.1	23.8	-179	-64	175	0	0	0	112.8	L58 F61 Q65 L66	L58-L63 HydrophobicContact CB-CB 4.03Å; L58-L63 HydrophobicContact CD2-CB 3.7Å; L58-L63 HydrophobicContact CD2-CD1 4.01Å; L58-L63 HydrophobicContact CG-CB 4.47Å; L58-L63 PolarHBondContact O-N 2.97Å; F61-L63 HydrophobicContact CB-CD1 3.94Å; F61-L63 HydrophobicContact CB-CG 4.03Å; F61-L63 PolarHBondContact O-N 2.67Å; L63-Q65 PolarHBondContact O-N 3.32Å; L63-L66 HydrophobicContact CB-CD1 4.25Å; L63-L66 HydrophobicContact CD2-CD1 4.22Å; L63-L66 WeakPolarHBondContact O-CB 3.21Å; L63-L66 PolarHBondContact O-N 3.39Å
64	L	90.1	Very high	90.8	Very high	116 Å²	116	72.9 Å²	72.9	61%	0.607	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-56.3	-24	-179.2	-70.5	173.1	0	0	0	113.8	L66 D67	L64-L66 PolarHBondContact O-N 3.09Å; L64-D67 VanDerWaalsContact O-CB 3.3Å; L64-D67 WeakPolarHBondContact O-CB 2.97Å; L64-D67 PolarHBondContact O-N 3Å
65	Q	92.1	Very high	90.8	Very high	176 Å²	176	76.6 Å²	76.6	82%	0.822	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-62.9	-27.2	175.8	-172.3	173.8	17.2	0	0	112.7	L63 P68	L63-Q65 PolarHBondContact O-N 3.32Å; Q65-P68 WeakPolarHBondContact O-CD 3.08Å
66	L	90.5	Very high	90.6	Very high	66 Å²	66	84 Å²	84	35%	0.346	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-86.3	-10.6	178.9	-65.1	172.6	0	0	0	113	F46 L58 L63 L64 D69 C70	F46-L66 HydrophobicContact CZ-CB 4.32Å; L58-L66 HydrophobicContact CD1-CB 4.2Å; L63-L66 HydrophobicContact CB-CD1 4.25Å; L63-L66 HydrophobicContact CD2-CD1 4.22Å; L63-L66 WeakPolarHBondContact O-CB 3.21Å; L63-L66 PolarHBondContact O-N 3.39Å; L64-L66 PolarHBondContact O-N 3.09Å; L66-D69 PolarHBondContact O-N 3.34Å; L66-C70 WeakPolarHBondContact O-CB 3.33Å; L66-C70 PolarHBondContact O-N 3.28Å
67	D	92.2	Very high	90.1	Very high	37 Å²	37	83.6 Å²	83.6	20%	0.198	43%	0.43	C	S	.	.	H	α-helix	trans	-54.3	-46.2	-179.3	-168.1	25.5	0	0	0	113.7	L58 L64 D69 C70 R71	L58-D67 HydrophobicContact CD1-CB 4.48Å; L64-D67 VanDerWaalsContact O-CB 3.3Å; L64-D67 WeakPolarHBondContact O-CB 2.97Å; L64-D67 PolarHBondContact O-N 3Å; D67-D69 PolarHBondContact O-N 2.98Å; D67-C70 PolarHBondContact O-N 2.8Å; D67-R71 WeakPolarHBondContact O-CB 3.3Å; D67-R71 WeakPolarHBondContact O-CG 3.47Å; D67-R71 PolarHBondContact O-N 3.09Å; D67-R71 IonicContact OD1-CZ 3.61Å; D67-R71 IonicContact OD1-NE 3.63Å; D67-R71 PolarHBondContact OD1-NE 3.03Å; D67-R71 IonicContact OD1-NH2 3.28Å; D67-R71 PolarHBondContact OD1-NH2 3.14Å; D67-R71 IonicContact OD2-CZ 3.57Å; D67-R71 IonicContact OD2-NE 3.47Å; D67-R71 PolarHBondContact OD2-NE 3.2Å; D67-R71 IonicContact OD2-NH2 3.7Å
68	P	91.7	Very high	89.2	Confident	90 Å²	90	83.1 Å²	83.1	58%	0.584	44%	0.438	S	S	*	.	H	α-helix	trans	-61.5	-42	178.2	23.5	-34.3	0	0	0	113.1	Q65 G72	Q65-P68 WeakPolarHBondContact O-CD 3.08Å; P68-G72 PolarHBondContact O-N 3.37Å; P68-G72 VanDerWaalsContact O-N 3.15Å
69	D	91.8	Very high	87.8	Confident	59 Å²	59	89.8 Å²	89.8	32%	0.316	47%	0.469	S	S	.	.	H	α-helix	trans	-69.1	-40.7	177.7	-61.5	-65.9	0	0	0	111.4	L44 F46 L66 D67 R71 G72 C73	L44-D69 HydrophobicContact CD1-CB 4.22Å; F46-D69 HydrophobicContact CE2-CB 3.76Å; F46-D69 HydrophobicContact CZ-CB 4.39Å; L66-D69 PolarHBondContact O-N 3.34Å; D67-D69 PolarHBondContact O-N 2.98Å; D69-R71 PolarHBondContact O-N 3.48Å; D69-G72 PolarHBondContact O-N 3.26Å; D69-C73 PolarHBondContact O-N 3.42Å
70	C	92.3	Very high	86.1	Confident	2 Å²	2	97.4 Å²	97.4	1%	0.014	49%	0.494	C	S	.	.	H	α-helix	trans	-59.5	-46.9	176.2	-170.1	0	0	0	0	111	F46 C55 L58 L66 D67 G72 C73 C74	F46-C70 HydrophobicContact CE1-CB 3.75Å; F46-C70 HydrophobicContact CE2-CB 4.47Å; F46-C70 HydrophobicContact CZ-CB 3.66Å; C55-C70 WeakPolarHBondContact CA-SG 3.47Å; C55-C70 HydrophobicContact CB-CB 3.86Å; C55-C70 WeakPolarHBondContact CB-SG 3.44Å; C55-C70 WeakPolarHBondContact SG-CB 3.04Å; C55-C70 CovalentContact SG-SG 2.03Å; C55-C70 PolarHBondContact SG-SG 3.34Å; L58-C70 HydrophobicContact CD1-CB 3.79Å; L66-C70 WeakPolarHBondContact O-CB 3.33Å; L66-C70 PolarHBondContact O-N 3.28Å; D67-C70 PolarHBondContact O-N 2.8Å; C70-G72 VanDerWaalsContact C-N 3.3Å; C70-G72 PolarHBondContact O-N 3.45Å; C70-C73 CarbonylContact O-C 3.56Å; C70-C73 PolarHBondContact O-N 2.9Å; C70-C74 WeakPolarHBondContact O-CB 3.41Å; C70-C74 PolarHBondContact O-N 3.07Å
71	R	91.6	Very high	84.5	Confident	116 Å²	116	98.9 Å²	98.9	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-67.8	-27.3	178.6	-70.5	-174.9	-168.8	-78.7	-5.7	113.6	C55 D56 D67 D69 C73	C55-R71 HydrophobicContact CB-CG 4.32Å; D56-R71 IonicContact OD1-CZ 2.93Å; D56-R71 IonicContact OD1-NH1 3.92Å; D56-R71 IonicContact OD1-NH2 2.97Å; D56-R71 PolarHBondContact OD1-NH2 2.88Å; D67-R71 WeakPolarHBondContact O-CB 3.3Å; D67-R71 WeakPolarHBondContact O-CG 3.47Å; D67-R71 PolarHBondContact O-N 3.09Å; D67-R71 IonicContact OD1-CZ 3.61Å; D67-R71 IonicContact OD1-NE 3.63Å; D67-R71 PolarHBondContact OD1-NE 3.03Å; D67-R71 IonicContact OD1-NH2 3.28Å; D67-R71 PolarHBondContact OD1-NH2 3.14Å; D67-R71 IonicContact OD2-CZ 3.57Å; D67-R71 IonicContact OD2-NE 3.47Å; D67-R71 PolarHBondContact OD2-NE 3.2Å; D67-R71 IonicContact OD2-NH2 3.7Å; D69-R71 PolarHBondContact O-N 3.48Å; R71-C73 PolarHBondContact O-N 3.11Å
72	G	90.4	Very high	82.8	Confident	33 Å²	33	96.7 Å²	96.7	34%	0.34	50%	0.499	S	S	.	.	H	α-helix	trans	-71.3	-19.3	170.5	0	0	0	0	0	113.9	P68 D69 C70	P68-G72 PolarHBondContact O-N 3.37Å; P68-G72 VanDerWaalsContact O-N 3.15Å; D69-G72 PolarHBondContact O-N 3.26Å; C70-G72 VanDerWaalsContact C-N 3.3Å; C70-G72 PolarHBondContact O-N 3.45Å
73	C	92.2	Very high	81.6	Confident	15 Å²	15	96 Å²	96	10%	0.101	49%	0.488	C	S	.	.	H	α-helix	trans	-115.4	-7.8	-173.3	-74	0	0	0	0	114.7	C41 F46 D69 C70 R71	C41-C73 WeakPolarHBondContact CA-SG 3.43Å; C41-C73 HydrophobicContact CB-CB 3.71Å; C41-C73 WeakPolarHBondContact CB-SG 3.41Å; C41-C73 WeakPolarHBondContact SG-CA 3.42Å; C41-C73 WeakPolarHBondContact SG-CB 3.42Å; C41-C73 CovalentContact SG-SG 2.03Å; C41-C73 PolarHBondContact SG-SG 3.16Å; F46-C73 HydrophobicContact CB-CB 4.21Å; F46-C73 HydrophobicContact CD2-CB 4.29Å; F46-C73 HydrophobicContact CG-CB 4.36Å; D69-C73 PolarHBondContact O-N 3.42Å; C70-C73 CarbonylContact O-C 3.56Å; C70-C73 PolarHBondContact O-N 2.9Å; R71-C73 PolarHBondContact O-N 3.11Å
74	C	92.3	Very high	80.6	Confident	21 Å²	21	99 Å²	99	14%	0.142	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-92.6	147.8	-177.4	72.7	0	0	0	0	112	L50 C52 C70	L50-C74 HydrophobicContact CB-CB 4.49Å; L50-C74 HydrophobicContact CD2-CB 4.11Å; L50-C74 HydrophobicContact CG-CB 4.1Å; L50-C74 CarbonylContact O-C 3.44Å; L50-C74 WeakPolarHBondContact O-CA 3.3Å; C52-C74 WeakPolarHBondContact CA-SG 3.45Å; C52-C74 HydrophobicContact CB-CB 3.9Å; C52-C74 WeakPolarHBondContact CB-SG 3.35Å; C52-C74 WeakPolarHBondContact SG-CB 2.96Å; C52-C74 CovalentContact SG-SG 2.04Å; C52-C74 PolarHBondContact SG-SG 3.2Å; C70-C74 WeakPolarHBondContact O-CB 3.41Å; C70-C74 PolarHBondContact O-N 3.07Å
75	Q	89.1	Confident	80.3	Confident	131 Å²	131	98.4 Å²	98.4	61%	0.612	50%	0.495	S	S	*	.	B	Isolated β-bridge	trans	-93.6	136	169.7	-179.3	55.4	50.2	0	0	109.4	L50 C52 E77	L50-Q75 PolarHBondContact O-N 3.05Å; C52-Q75 PolarHBondContact N-O 2.91Å; C52-Q75 VanDerWaalsContact N-O 3.09Å; C52-Q75 PolarHBondContact SG-O 3.3Å; C52-Q75 VanDerWaalsContact SG-O 3.4Å; Q75-E77 PolarHBondContact O-N 2.88Å
76	E	87.9	Confident	80.4	Confident	159 Å²	159	91.6 Å²	91.6	74%	0.743	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-63.1	125.3	169.4	-71.4	-175	93	0	0	109.5	A78	E76-A78 PolarHBondContact O-N 2.73Å
77	E	80	Confident	80.5	Confident	88 Å²	88	91.7 Å²	91.7	41%	0.411	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-65.5	125.6	171.4	-73.3	160	114.3	0	0	108.6	L51 S53 Q75 Q79	L51-E77 HydrophobicContact CB-CG 3.75Å; L51-E77 HydrophobicContact CD1-CG 3.8Å; L51-E77 WeakPolarHBondContact CD1-OE1 3.39Å; L51-E77 HydrophobicContact CD2-CG 3.71Å; L51-E77 HydrophobicContact CG-CG 3.92Å; S53-E77 WeakPolarHBondContact CB-OE2 3.32Å; S53-E77 PolarHBondContact N-OE2 2.72Å; S53-E77 VanDerWaalsContact OG-CD 3.24Å; S53-E77 PolarHBondContact OG-OE1 2.83Å; S53-E77 PolarHBondContact OG-OE2 2.84Å; Q75-E77 PolarHBondContact O-N 2.88Å; E77-Q79 PolarHBondContact O-N 3.19Å
78	A	69.8	Low	80.7	Confident	74 Å²	74	90.1 Å²	90.1	61%	0.612	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-58.5	116	163.8	0	0	0	0	0	106.7	E76 F80	E76-A78 PolarHBondContact O-N 2.73Å; A78-F80 HydrophobicContact CB-CD2 3.6Å; A78-F80 HydrophobicContact CB-CE2 3.72Å; A78-F80 PolarHBondContact O-N 3.47Å
79	Q	59	Low	80.9	Confident	160 Å²	160	85.8 Å²	85.8	75%	0.748	44%	0.437	S	S	*	.	S	Bend	trans	-61	30.6	-171.3	-72.7	-173.7	-29.5	0	0	115.6	E77 E81 T82	E77-Q79 PolarHBondContact O-N 3.19Å; Q79-E81 PolarHBondContact O-N 3.17Å; Q79-E81 VanDerWaalsContact O-N 3.09Å; Q79-T82 HydrophobicContact CB-CG2 4.35Å; Q79-T82 PolarHBondContact O-N 3.01Å
80	F	54.5	Low	81.2	Confident	191 Å²	191	84.4 Å²	84.4	84%	0.838	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.7	179.6	-73.7	-73	0	0	0	113.3	A78	A78-F80 HydrophobicContact CB-CD2 3.6Å; A78-F80 HydrophobicContact CB-CE2 3.72Å; A78-F80 PolarHBondContact O-N 3.47Å
81	E	55.4	Low	81.4	Confident	172 Å²	172	84.3 Å²	84.3	80%	0.804	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	33.8	175.3	-62	-175.6	-178.9	0	0	113.1	Q79 K83	Q79-E81 PolarHBondContact O-N 3.17Å; Q79-E81 VanDerWaalsContact O-N 3.09Å; E81-K83 PolarHBondContact O-N 3.36Å
82	T	55.9	Low	81.7	Confident	96 Å²	96	79.6 Å²	79.6	59%	0.589	41%	0.411	S	S	*	.	S	Bend	trans	-57	99.5	151	47.5	0	0	0	0	105.8	Q79 K84	Q79-T82 HydrophobicContact CB-CG2 4.35Å; Q79-T82 PolarHBondContact O-N 3.01Å; T82-K84 VanDerWaalsContact C-N 3.34Å; T82-K84 PolarHBondContact O-N 3.2Å
83	K	64.3	Low	81.9	Confident	137 Å²	137	78 Å²	78	60%	0.596	40%	0.395	S	S	*	.			trans	-39.7	99.3	-175.8	-73.3	-179.5	179.1	-178.3	0	108.2	E81 L85 E160	E81-K83 PolarHBondContact O-N 3.36Å; K83-L85 VanDerWaalsContact C-N 3.28Å; K83-L85 PolarHBondContact O-N 3.27Å; K83-E160 HydrophobicContact CD-CG 4.07Å; K83-E160 HydrophobicContact CG-CG 4.15Å
84	K	68.7	Low	82.1	Confident	141 Å²	141	77.5 Å²	77.5	61%	0.613	39%	0.392	S	S	*	.			trans	-70.5	99.1	-179.1	-172.5	-178.2	178.5	-174.5	0	105.1	T82 Y86	T82-K84 VanDerWaalsContact C-N 3.34Å; T82-K84 PolarHBondContact O-N 3.2Å; K84-Y86 WeakPolarHBondContact O-CD2 3.42Å; K84-Y86 PolarHBondContact O-N 3.36Å
85	L	84.4	Confident	82.1	Confident	102 Å²	102	78.8 Å²	78.8	53%	0.534	41%	0.409	S	S	.	.			trans	-71.2	121.5	174.6	-65.9	179.6	0	0	0	107.3	K83 K161	K83-L85 VanDerWaalsContact C-N 3.28Å; K83-L85 PolarHBondContact O-N 3.27Å; L85-K161 WeakPolarHBondContact CA-O 3.34Å
86	Y	93.5	Very high	82.2	Confident	34 Å²	34	77.3 Å²	77.3	13%	0.133	41%	0.412	C	S	.	.			trans	-78.3	150	172.4	-71.6	-88.4	0	0	0	109.2	K84 G88 L133 L134 A141 E142 K161	K84-Y86 WeakPolarHBondContact O-CD2 3.42Å; K84-Y86 PolarHBondContact O-N 3.36Å; Y86-G88 PolarHBondContact O-N 2.87Å; Y86-L133 HydrophobicContact CD1-CB 3.64Å; Y86-L133 HydrophobicContact CD2-CB 4.18Å; Y86-L133 HydrophobicContact CD2-CD1 3.76Å; Y86-L133 HydrophobicContact CD2-CD2 4.47Å; Y86-L133 HydrophobicContact CD2-CG 4.35Å; Y86-L133 HydrophobicContact CE1-CB 3.8Å; Y86-L133 HydrophobicContact CE1-CD1 4.25Å; Y86-L133 HydrophobicContact CE2-CB 4.3Å; Y86-L133 HydrophobicContact CE2-CD1 3.39Å; Y86-L133 HydrophobicContact CE2-CG 4.37Å; Y86-L133 HydrophobicContact CG-CB 3.82Å; Y86-L133 HydrophobicContact CG-CD1 4.29Å; Y86-L133 HydrophobicContact CG-CG 4.45Å; Y86-L134 WeakPolarHBondContact CB-O 3.31Å; Y86-A141 HydrophobicContact CD1-CB 4.25Å; Y86-A141 HydrophobicContact CE1-CB 3.8Å; Y86-E142 PolarHBondContact OH-OE2 3.36Å; Y86-K161 HydrophobicContact CD2-CB 4Å; Y86-K161 HydrophobicContact CD2-CD 4.44Å; Y86-K161 HydrophobicContact CD2-CG 4.44Å; Y86-K161 HydrophobicContact CE2-CB 4.47Å; Y86-K161 HydrophobicContact CE2-CD 4.18Å; Y86-K161 HydrophobicContact CE2-CG 4.42Å; Y86-K161 PolarHBondContact N-O 3.19Å
87	A	93.7	Very high	82.4	Confident	68 Å²	68	72.3 Å²	72.3	56%	0.562	39%	0.388	S	S	*	.	S	Bend	trans	-69.1	-22.2	-179.2	0	0	0	0	0	112.3	L134 D135	A87-L134 PolarHBondContact N-O 2.93Å; A87-D135 WeakPolarHBondContact CB-O 3.47Å
88	G	95.3	Very high	82.9	Confident	3 Å²	3	68.3 Å²	68.3	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177	-176	174.9	0	0	0	0	0	112.2	Y86 L134	Y86-G88 PolarHBondContact O-N 2.87Å; G88-L134 PolarHBondContact O-N 3.18Å
89	A	97.2	Very high	83.9	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.1	175.3	0	0	0	0	0	111.9	G118 L119 Q120 L131 K132 L133 L158 L162	A89-G118 PolarHBondContact N-O 2.7Å; A89-G118 VanDerWaalsContact O-O 3.11Å; A89-L119 HydrophobicContact CB-CD1 3.97Å; A89-L119 CarbonylContact O-C 3.54Å; A89-L119 WeakPolarHBondContact O-CA 3.46Å; A89-Q120 PolarHBondContact O-N 2.97Å; A89-L131 HydrophobicContact CB-CD1 4.11Å; A89-K132 CarbonylContact C-O 3.55Å; A89-K132 WeakPolarHBondContact CA-O 3.36Å; A89-L133 HydrophobicContact CB-CD2 3.85Å; A89-L158 HydrophobicContact CB-CD2 4.5Å; A89-L162 HydrophobicContact CB-CD1 3.81Å; A89-L162 HydrophobicContact CB-CD2 4.27Å
90	I	97.4	Very high	85.6	Confident	29 Å²	29	69.8 Å²	69.8	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118	173.9	-54.6	174.8	0	0	0	108.3	E92 Q120 K122 K132 L134	I90-E92 HydrophobicContact CG2-CG 3.88Å; I90-Q120 CarbonylContact C-O 3.6Å; I90-Q120 WeakPolarHBondContact CA-O 3.18Å; I90-Q120 HydrophobicContact CG1-CB 4.42Å; I90-K122 HydrophobicContact CG2-CB 3.81Å; I90-K122 HydrophobicContact CG2-CD 4.18Å; I90-K132 HydrophobicContact CB-CB 4.38Å; I90-K132 PolarHBondContact N-O 2.99Å; I90-K132 PolarHBondContact O-N 3.4Å; I90-L134 HydrophobicContact CD1-CD1 4.08Å; I90-L134 HydrophobicContact CD1-CD2 4.14Å; I90-L134 HydrophobicContact CG1-CD1 3.96Å; I90-L134 HydrophobicContact CG1-CD2 4.41Å; I90-L134 HydrophobicContact CG1-CG 4.37Å
91	L	97.3	Very high	87.5	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	104	169.9	175	51	0	0	0	109.1	V93 F107 V108 L119 Q120 I121 K122 V130 L131 I146	L91-V93 HydrophobicContact CD1-CG1 3.95Å; L91-V93 HydrophobicContact CG-CG1 4.05Å; L91-F107 HydrophobicContact CD2-CD1 3.98Å; L91-F107 HydrophobicContact CD2-CE1 4.14Å; L91-V108 HydrophobicContact CD2-CG2 3.66Å; L91-V108 HydrophobicContact CG-CG2 4.46Å; L91-L119 HydrophobicContact CB-CD1 4.45Å; L91-Q120 PolarHBondContact N-O 2.84Å; L91-I121 HydrophobicContact CB-CD1 3.79Å; L91-I121 HydrophobicContact CD2-CD1 3.92Å; L91-I121 HydrophobicContact CG-CD1 4.17Å; L91-K122 PolarHBondContact O-N 3.09Å; L91-V130 WeakPolarHBondContact CD1-O 3.41Å; L91-L131 HydrophobicContact CB-CD1 4.15Å; L91-I146 HydrophobicContact CD1-CD1 3.47Å; L91-I146 VanDerWaalsContact CD1-CD1 3.47Å; L91-I146 HydrophobicContact CD1-CG1 4.37Å; L91-I146 HydrophobicContact CD2-CD1 4.48Å
92	E	97	Very high	89.3	Confident	17 Å²	17	58 Å²	58	8%	0.079	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.9	176.6	-65	-164.7	152.9	0	0	110.4	I90 K122 V124 P129 V130 K132	I90-E92 HydrophobicContact CG2-CG 3.88Å; E92-K122 WeakPolarHBondContact CA-O 3.32Å; E92-K122 HydrophobicContact CG-CB 4.25Å; E92-K122 HydrophobicContact CG-CD 4.25Å; E92-K122 WeakPolarHBondContact OE1-CD 3.47Å; E92-K122 IonicContact OE1-NZ 3.79Å; E92-K122 PolarHBondContact OE1-NZ 3.15Å; E92-V124 HydrophobicContact CB-CG2 4.31Å; E92-V124 HydrophobicContact CG-CG2 4.22Å; E92-P129 WeakPolarHBondContact O-CA 3.29Å; E92-V130 PolarHBondContact N-O 2.96Å; E92-V130 PolarHBondContact O-N 3.23Å; E92-K132 VanDerWaalsContact CD-NZ 3.34Å; E92-K132 HydrophobicContact CG-CD 4.34Å; E92-K132 IonicContact OE1-NZ 2.83Å; E92-K132 VanDerWaalsContact OE2-CE 3.3Å; E92-K132 WeakPolarHBondContact OE2-CE 3.35Å; E92-K132 IonicContact OE2-NZ 3.39Å; E92-K132 PolarHBondContact OE2-NZ 3.13Å
93	V	96	Very high	91.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.7	179.8	-67.6	0	0	0	0	111.3	L91 L98 V104 V108 I121 K122 Y123 V124 P129	L91-V93 HydrophobicContact CD1-CG1 3.95Å; L91-V93 HydrophobicContact CG-CG1 4.05Å; V93-L98 HydrophobicContact CB-CD1 4.3Å; V93-L98 HydrophobicContact CG1-CD1 4.33Å; V93-V104 HydrophobicContact CG1-CG1 4.07Å; V93-V108 HydrophobicContact CG1-CG2 4.44Å; V93-I121 HydrophobicContact CG2-CG2 4.18Å; V93-K122 PolarHBondContact N-O 3.07Å; V93-Y123 HydrophobicContact CG2-CD1 3.76Å; V93-Y123 HydrophobicContact CG2-CE1 3.68Å; V93-Y123 CarbonylContact O-C 3.46Å; V93-Y123 WeakPolarHBondContact O-CA 3.46Å; V93-V124 PolarHBondContact O-N 3.18Å; V93-P129 HydrophobicContact CG1-CB 4.21Å; V93-P129 HydrophobicContact CG1-CG 4.31Å
94	C	95.7	Very high	92.7	Very high	4 Å²	4	51.1 Å²	51.1	3%	0.027	29%	0.288	C	S	.	.			trans	-95.7	122.3	169.1	176.9	0	0	0	0	110.7	U96 K97 L98 V124 G126 S127	C94-C96 PolarHBondContact O-N 3.07Å; C94-C96 VanDerWaalsContact O-N 3.13Å; C94-C96 PolarHBondContact SG-N 3.36Å; C94-C96 VanDerWaalsContact SG-N 3.42Å; C94-K97 HydrophobicContact CB-CB 4.05Å; C94-K97 HydrophobicContact CB-CD 4.32Å; C94-K97 HydrophobicContact CB-CG 4.2Å; C94-K97 PolarHBondContact O-N 2.87Å; C94-L98 WeakPolarHBondContact O-CB 3.45Å; C94-L98 PolarHBondContact O-N 3.3Å; C94-V124 VanDerWaalsContact CA-O 3.31Å; C94-V124 WeakPolarHBondContact CA-O 3.37Å; C94-V124 VanDerWaalsContact CB-O 3.24Å; C94-V124 WeakPolarHBondContact CB-O 3.36Å; C94-G126 PolarHBondContact SG-N 2.99Å; C94-S127 WeakPolarHBondContact CB-O 3.28Å; C94-S127 PolarHBondContact N-O 2.97Å
95	G	91.4	Very high	93.9	Very high	49 Å²	49	46.5 Å²	46.5	51%	0.505	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.4	176.1	0	0	0	0	0	113.9
96	U	92.7	Very high	94.4	Very high	99 Å²	99	44 Å²	44	67%	0.669	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-28.5	178.7	-48.6	0	0	0	0	113.4	C94	C94-C96 PolarHBondContact O-N 3.07Å; C94-C96 VanDerWaalsContact O-N 3.13Å; C94-C96 PolarHBondContact SG-N 3.36Å; C94-C96 VanDerWaalsContact SG-N 3.42Å
97	K	91.5	Very high	94.5	Very high	55 Å²	55	42.3 Å²	42.3	24%	0.239	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-17.5	-179.5	-69	-177.6	166.5	-176.4	0	112.8	C94 G99 R100 F101 G126 D128	C94-K97 HydrophobicContact CB-CB 4.05Å; C94-K97 HydrophobicContact CB-CD 4.32Å; C94-K97 HydrophobicContact CB-CG 4.2Å; C94-K97 PolarHBondContact O-N 2.87Å; K97-G99 PolarHBondContact O-N 2.71Å; K97-R100 WeakPolarHBondContact O-CB 3.41Å; K97-R100 PolarHBondContact O-N 3.14Å; K97-F101 HydrophobicContact CB-CE2 4.23Å; K97-F101 WeakPolarHBondContact O-CD2 3.41Å; K97-G126 WeakPolarHBondContact CE-O 3.47Å; K97-G126 PolarHBondContact NZ-O 3.19Å; K97-D128 VanDerWaalsContact CD-OD1 3.28Å; K97-D128 WeakPolarHBondContact CD-OD1 3.26Å; K97-D128 IonicContact NZ-OD1 3.8Å; K97-D128 PolarHBondContact NZ-OD1 3.48Å; K97-D128 IonicContact NZ-OD2 2.78Å
98	L	89.6	Confident	94.6	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-55.8	-30.8	-172	-163	61	0	0	0	113.5	V93 C94 R100 F101 V104 Q105	V93-L98 HydrophobicContact CB-CD1 4.3Å; V93-L98 HydrophobicContact CG1-CD1 4.33Å; C94-L98 WeakPolarHBondContact O-CB 3.45Å; C94-L98 PolarHBondContact O-N 3.3Å; L98-R100 PolarHBondContact O-N 2.86Å; L98-R100 VanDerWaalsContact O-N 3.14Å; L98-F101 CarbonylContact O-C 3.4Å; L98-F101 PolarHBondContact O-N 3.5Å; L98-V104 HydrophobicContact CD1-CG1 4.25Å; L98-Q105 VanDerWaalsContact C-OE1 3.29Å; L98-Q105 HydrophobicContact CD1-CB 4.12Å; L98-Q105 HydrophobicContact CD2-CB 4.2Å; L98-Q105 HydrophobicContact CD2-CG 3.84Å; L98-Q105 HydrophobicContact CG-CB 3.69Å; L98-Q105 HydrophobicContact CG-CG 3.76Å; L98-Q105 PolarHBondContact O-OE1 3.03Å
99	G	91.5	Very high	94.4	Very high	60 Å²	60	48 Å²	48	62%	0.619	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-61.2	-20.2	174.9	0	0	0	0	0	114.8	K97 F101	K97-G99 PolarHBondContact O-N 2.71Å; G99-F101 VanDerWaalsContact C-N 3.34Å
100	R	94.1	Very high	94.2	Very high	204 Å²	204	49.7 Å²	49.7	77%	0.77	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-84.3	-10.2	173.9	-59.1	-178.9	-178	172	-0.3	113.1	K97 L98 P102	K97-R100 WeakPolarHBondContact O-CB 3.41Å; K97-R100 PolarHBondContact O-N 3.14Å; L98-R100 PolarHBondContact O-N 2.86Å; L98-R100 VanDerWaalsContact O-N 3.14Å; R100-P102 VanDerWaalsContact C-CD 3.42Å; R100-P102 WeakPolarHBondContact O-CD 3.45Å
101	F	94.9	Very high	94	Very high	37 Å²	37	53.4 Å²	53.4	16%	0.162	30%	0.295	C	S	.	.			trans	-122.3	67.8	-177.8	-55.4	-73.6	0	0	0	109.6	K97 L98 G99 Q103 V104 Q105 P129 L147	K97-F101 HydrophobicContact CB-CE2 4.23Å; K97-F101 WeakPolarHBondContact O-CD2 3.41Å; L98-F101 CarbonylContact O-C 3.4Å; L98-F101 PolarHBondContact O-N 3.5Å; G99-F101 VanDerWaalsContact C-N 3.34Å; F101-Q103 PolarHBondContact O-N 2.86Å; F101-V104 HydrophobicContact CB-CB 4.1Å; F101-V104 HydrophobicContact CB-CG2 4.33Å; F101-V104 PolarHBondContact O-N 3.29Å; F101-Q105 WeakPolarHBondContact O-CB 3.25Å; F101-Q105 PolarHBondContact O-N 2.91Å; F101-P129 HydrophobicContact CB-CG 4.28Å; F101-P129 HydrophobicContact CD1-CG 4.34Å; F101-P129 HydrophobicContact CD2-CG 3.61Å; F101-P129 VanDerWaalsContact CE2-CD 3.46Å; F101-P129 HydrophobicContact CE2-CG 3.95Å; F101-P129 HydrophobicContact CG-CG 3.82Å; F101-P129 HydrophobicContact CZ-CG 4.46Å; F101-L147 HydrophobicContact CD1-CD2 4.35Å; F101-L147 HydrophobicContact CE1-CB 4.38Å; F101-L147 HydrophobicContact CE1-CD2 3.49Å; F101-L147 VanDerWaalsContact CE1-CD2 3.49Å; F101-L147 HydrophobicContact CE2-CD2 4.42Å; F101-L147 HydrophobicContact CZ-CD2 3.52Å
102	P	94.2	Very high	93.8	Very high	80 Å²	80	56.3 Å²	56.3	52%	0.519	31%	0.308	S	S	.	.	H	α-helix	trans	-58.2	-35.1	-172.2	20.4	-31.2	0	0	0	113	R100 Q105 A106	R100-P102 VanDerWaalsContact C-CD 3.42Å; R100-P102 WeakPolarHBondContact O-CD 3.45Å; P102-Q105 PolarHBondContact O-N 3.49Å; P102-A106 WeakPolarHBondContact O-CB 3.34Å; P102-A106 PolarHBondContact O-N 2.84Å
103	Q	95.7	Very high	93.6	Very high	85 Å²	85	56.3 Å²	56.3	40%	0.397	31%	0.309	S	S	.	.	H	α-helix	trans	-66.6	-50.7	177.2	-60	-59	96.8	0	0	112.1	F101 Q105 A106 F107 N150 T151	F101-Q103 PolarHBondContact O-N 2.86Å; Q103-Q105 VanDerWaalsContact C-N 3.3Å; Q103-Q105 PolarHBondContact O-N 3.5Å; Q103-A106 WeakPolarHBondContact O-CB 3.19Å; Q103-A106 PolarHBondContact O-N 2.83Å; Q103-F107 PolarHBondContact O-N 3.02Å; Q103-N150 HydrophobicContact CG-CB 4.26Å; Q103-T151 PolarHBondContact O-OG1 2.78Å; Q103-T151 VanDerWaalsContact O-OG1 3.1Å
104	V	94.7	Very high	93.5	Very high	3 Å²	3	63.4 Å²	63.4	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-38.8	175.9	-178.8	0	0	0	0	110.9	V93 L98 F101 A106 F107 V108 P129 I146	V93-V104 HydrophobicContact CG1-CG1 4.07Å; L98-V104 HydrophobicContact CD1-CG1 4.25Å; F101-V104 HydrophobicContact CB-CB 4.1Å; F101-V104 HydrophobicContact CB-CG2 4.33Å; F101-V104 PolarHBondContact O-N 3.29Å; V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 3.4Å; V104-F107 PolarHBondContact O-N 3.48Å; V104-V108 HydrophobicContact CG1-CG2 4.23Å; V104-V108 WeakPolarHBondContact O-CG2 3.29Å; V104-V108 PolarHBondContact O-N 3Å; V104-P129 HydrophobicContact CG1-CB 4.1Å; V104-P129 HydrophobicContact CG1-CG 4.28Å; V104-P129 HydrophobicContact CG2-CB 4.3Å; V104-I146 HydrophobicContact CG1-CD1 4.09Å; V104-I146 HydrophobicContact CG2-CD1 4.03Å; V104-I146 HydrophobicContact CG2-CG1 4.36Å
105	Q	94.7	Very high	93.3	Very high	44 Å²	44	66.3 Å²	66.3	21%	0.206	36%	0.355	C	S	.	.	H	α-helix	trans	-58.5	-44.6	174.3	-172.3	173.2	-69.5	0	0	111.6	L98 F101 P102 Q103 V108 R109	L98-Q105 VanDerWaalsContact C-OE1 3.29Å; L98-Q105 HydrophobicContact CD1-CB 4.12Å; L98-Q105 HydrophobicContact CD2-CB 4.2Å; L98-Q105 HydrophobicContact CD2-CG 3.84Å; L98-Q105 HydrophobicContact CG-CB 3.69Å; L98-Q105 HydrophobicContact CG-CG 3.76Å; L98-Q105 PolarHBondContact O-OE1 3.03Å; F101-Q105 WeakPolarHBondContact O-CB 3.25Å; F101-Q105 PolarHBondContact O-N 2.91Å; P102-Q105 PolarHBondContact O-N 3.49Å; Q103-Q105 VanDerWaalsContact C-N 3.3Å; Q103-Q105 PolarHBondContact O-N 3.5Å; Q105-V108 PolarHBondContact O-N 2.88Å; Q105-R109 HydrophobicContact CG-CG 4.34Å; Q105-R109 VanDerWaalsContact NE2-NH1 3.2Å; Q105-R109 WeakPolarHBondContact O-CB 3.46Å; Q105-R109 WeakPolarHBondContact O-CG 3.23Å; Q105-R109 PolarHBondContact O-N 3.4Å
106	A	95	Very high	93.5	Very high	48 Å²	48	64.2 Å²	64.2	40%	0.397	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-43.8	178	0	0	0	0	0	110.9	P102 Q103 V104 S110	P102-A106 WeakPolarHBondContact O-CB 3.34Å; P102-A106 PolarHBondContact O-N 2.84Å; Q103-A106 WeakPolarHBondContact O-CB 3.19Å; Q103-A106 PolarHBondContact O-N 2.83Å; V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 3.4Å; A106-S110 WeakPolarHBondContact O-CB 3.46Å; A106-S110 PolarHBondContact O-N 3.41Å; A106-S110 PolarHBondContact O-OG 2.76Å
107	F	95.5	Very high	93.5	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-57.8	-56.3	174	-176.9	-94.8	0	0	0	111.4	L91 Q103 V104 R109 S110 K112 P113 F116 L119 T151 V154 E155 L158	L91-F107 HydrophobicContact CD2-CD1 3.98Å; L91-F107 HydrophobicContact CD2-CE1 4.14Å; Q103-F107 PolarHBondContact O-N 3.02Å; V104-F107 PolarHBondContact O-N 3.48Å; F107-R109 VanDerWaalsContact C-N 3.32Å; F107-R109 PolarHBondContact O-N 3.07Å; F107-S110 PolarHBondContact O-N 2.83Å; F107-S110 PolarHBondContact O-OG 3.22Å; F107-K112 HydrophobicContact CD2-CB 4.08Å; F107-K112 HydrophobicContact CD2-CD 3.96Å; F107-K112 HydrophobicContact CE2-CB 3.79Å; F107-K112 HydrophobicContact CE2-CD 4.23Å; F107-K112 HydrophobicContact CZ-CB 4.43Å; F107-P113 HydrophobicContact CD1-CG 4.12Å; F107-P113 HydrophobicContact CE1-CB 4.34Å; F107-P113 HydrophobicContact CE1-CG 3.81Å; F107-P113 HydrophobicContact CZ-CG 4.25Å; F107-P113 VanDerWaalsContact O-CD 3.29Å; F107-P113 WeakPolarHBondContact O-CD 3.38Å; F107-P113 WeakPolarHBondContact O-CG 3.35Å; F107-F116 HydrophobicContact CE2-CE2 4.28Å; F107-F116 HydrophobicContact CZ-CD2 4.41Å; F107-F116 HydrophobicContact CZ-CE2 4.14Å; F107-L119 HydrophobicContact CE1-CD2 4.15Å; F107-L119 HydrophobicContact CZ-CD2 4.14Å; F107-T151 HydrophobicContact CB-CG2 4.15Å; F107-T151 HydrophobicContact CD2-CG2 4.45Å; F107-V154 HydrophobicContact CD1-CG1 3.9Å; F107-V154 HydrophobicContact CD2-CB 4.29Å; F107-V154 HydrophobicContact CD2-CG1 3.89Å; F107-V154 HydrophobicContact CE1-CG1 3.93Å; F107-V154 HydrophobicContact CE2-CG1 3.93Å; F107-V154 HydrophobicContact CG-CB 4.47Å; F107-V154 HydrophobicContact CG-CG1 3.89Å; F107-V154 HydrophobicContact CZ-CG1 3.97Å; F107-E155 HydrophobicContact CE2-CB 4.18Å; F107-L158 HydrophobicContact CE1-CD1 3.87Å; F107-L158 HydrophobicContact CE2-CD1 4.08Å; F107-L158 HydrophobicContact CZ-CD1 3.32Å
108	V	94.3	Very high	93.5	Very high	14 Å²	14	66 Å²	66	9%	0.085	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-35.3	-175.7	171.7	0	0	0	0	113.1	L91 V93 V104 Q105 I121 Y123	L91-V108 HydrophobicContact CD2-CG2 3.66Å; L91-V108 HydrophobicContact CG-CG2 4.46Å; V93-V108 HydrophobicContact CG1-CG2 4.44Å; V104-V108 HydrophobicContact CG1-CG2 4.23Å; V104-V108 WeakPolarHBondContact O-CG2 3.29Å; V104-V108 PolarHBondContact O-N 3Å; Q105-V108 PolarHBondContact O-N 2.88Å; V108-I121 HydrophobicContact CG1-CG2 3.81Å; V108-Y123 WeakPolarHBondContact CG1-OH 3.3Å
109	R	93	Very high	93.8	Very high	175 Å²	175	66.8 Å²	66.8	66%	0.66	34%	0.338	S	S	*	.	H	α-helix	trans	-88.1	-11.8	-178.9	-67.8	-174.5	-179.6	178.3	2.3	114.2	Q105 F107	Q105-R109 HydrophobicContact CG-CG 4.34Å; Q105-R109 VanDerWaalsContact NE2-NH1 3.2Å; Q105-R109 WeakPolarHBondContact O-CB 3.46Å; Q105-R109 WeakPolarHBondContact O-CG 3.23Å; Q105-R109 PolarHBondContact O-N 3.4Å; F107-R109 VanDerWaalsContact C-N 3.32Å; F107-R109 PolarHBondContact O-N 3.07Å
110	S	92.3	Very high	94	Very high	36 Å²	36	69.5 Å²	69.5	25%	0.252	33%	0.334	S	S	.	.	S	Bend	trans	-80.5	177.5	176	72	0	0	0	0	111.6	A106 F107 K112 P113	A106-S110 WeakPolarHBondContact O-CB 3.46Å; A106-S110 PolarHBondContact O-N 3.41Å; A106-S110 PolarHBondContact O-OG 2.76Å; F107-S110 PolarHBondContact O-N 2.83Å; F107-S110 PolarHBondContact O-OG 3.22Å; S110-K112 PolarHBondContact O-N 2.82Å; S110-K112 VanDerWaalsContact OG-CB 3.31Å; S110-K112 WeakPolarHBondContact OG-CB 3.38Å; S110-K112 WeakPolarHBondContact OG-CG 3.3Å; S110-K112 PolarHBondContact OG-N 2.72Å; S110-P113 VanDerWaalsContact O-CD 3.26Å; S110-P113 WeakPolarHBondContact O-CD 3.39Å
111	D	92.7	Very high	94.1	Very high	108 Å²	108	62.2 Å²	62.2	58%	0.578	31%	0.31	S	S	*	.	S	Bend	trans	-78.6	-7	171.3	-62.6	-67.9	0	0	0	113.4	P113 K114	D111-P113 VanDerWaalsContact C-CD 3.47Å; D111-K114 WeakPolarHBondContact O-CB 3.36Å; D111-K114 PolarHBondContact O-N 2.81Å; D111-K114 VanDerWaalsContact O-N 3.09Å; D111-K114 IonicContact OD1-NZ 2.72Å; D111-K114 PolarHBondContact OD1-NZ 3.49Å
112	K	92.5	Very high	94.2	Very high	61 Å²	61	65.3 Å²	65.3	27%	0.265	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-55	-42.4	-178	-66	-178.7	163.8	90.5	0	114.4	F107 S110 K114 L115 F116 T151 E155	F107-K112 HydrophobicContact CD2-CB 4.08Å; F107-K112 HydrophobicContact CD2-CD 3.96Å; F107-K112 HydrophobicContact CE2-CB 3.79Å; F107-K112 HydrophobicContact CE2-CD 4.23Å; F107-K112 HydrophobicContact CZ-CB 4.43Å; S110-K112 PolarHBondContact O-N 2.82Å; S110-K112 VanDerWaalsContact OG-CB 3.31Å; S110-K112 WeakPolarHBondContact OG-CB 3.38Å; S110-K112 WeakPolarHBondContact OG-CG 3.3Å; S110-K112 PolarHBondContact OG-N 2.72Å; K112-K114 PolarHBondContact O-N 2.84Å; K112-K114 VanDerWaalsContact O-N 3.13Å; K112-L115 VanDerWaalsContact O-CB 3.28Å; K112-L115 WeakPolarHBondContact O-CB 3.4Å; K112-L115 WeakPolarHBondContact O-CG 3.2Å; K112-L115 PolarHBondContact O-N 3.48Å; K112-F116 WeakPolarHBondContact O-CD2 3.12Å; K112-T151 HydrophobicContact CD-CG2 4.18Å; K112-E155 HydrophobicContact CD-CG 4.49Å; K112-E155 VanDerWaalsContact CD-OE2 3.28Å; K112-E155 WeakPolarHBondContact CD-OE2 3.41Å; K112-E155 WeakPolarHBondContact CE-OE2 3Å
113	P	93.8	Very high	94.2	Very high	17 Å²	17	68.1 Å²	68.1	11%	0.11	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-60.9	-25.6	180	-23.8	34.8	0	0	0	113.6	F107 S110 D111 L115 F116 L119 I121	F107-P113 HydrophobicContact CD1-CG 4.12Å; F107-P113 HydrophobicContact CE1-CB 4.34Å; F107-P113 HydrophobicContact CE1-CG 3.81Å; F107-P113 HydrophobicContact CZ-CG 4.25Å; F107-P113 VanDerWaalsContact O-CD 3.29Å; F107-P113 WeakPolarHBondContact O-CD 3.38Å; F107-P113 WeakPolarHBondContact O-CG 3.35Å; S110-P113 VanDerWaalsContact O-CD 3.26Å; S110-P113 WeakPolarHBondContact O-CD 3.39Å; D111-P113 VanDerWaalsContact C-CD 3.47Å; P113-L115 PolarHBondContact O-N 3.47Å; P113-F116 PolarHBondContact O-N 2.93Å; P113-L119 HydrophobicContact CB-CD2 3.93Å; P113-I121 HydrophobicContact CB-CD1 4.21Å; P113-I121 HydrophobicContact CB-CG1 4.37Å; P113-I121 HydrophobicContact CG-CD1 4.49Å
114	K	93.1	Very high	94.2	Very high	148 Å²	148	66.2 Å²	66.2	64%	0.643	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-74.1	-14.7	178.4	-56.8	173	-175.2	162.7	0	112.7	D111 K112 F116	D111-K114 WeakPolarHBondContact O-CB 3.36Å; D111-K114 PolarHBondContact O-N 2.81Å; D111-K114 VanDerWaalsContact O-N 3.09Å; D111-K114 IonicContact OD1-NZ 2.72Å; D111-K114 PolarHBondContact OD1-NZ 3.49Å; K112-K114 PolarHBondContact O-N 2.84Å; K112-K114 VanDerWaalsContact O-N 3.13Å; K114-F116 VanDerWaalsContact C-N 3.28Å
115	L	92.9	Very high	94.2	Very high	65 Å²	65	76.6 Å²	76.6	34%	0.34	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-78.2	-12.8	178.8	-56.5	175.2	0	0	0	112.5	K112 P113 R164 I165	K112-L115 VanDerWaalsContact O-CB 3.28Å; K112-L115 WeakPolarHBondContact O-CB 3.4Å; K112-L115 WeakPolarHBondContact O-CG 3.2Å; K112-L115 PolarHBondContact O-N 3.48Å; P113-L115 PolarHBondContact O-N 3.47Å; L115-R164 CarbonylContact O-C 3.54Å; L115-R164 WeakPolarHBondContact O-CA 3.34Å; L115-R164 WeakPolarHBondContact O-CG 3.41Å; L115-I165 PolarHBondContact O-N 2.91Å
116	F	94.8	Very high	94.1	Very high	6 Å²	6	76.7 Å²	76.7	3%	0.026	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-111	122.3	-175	-59.6	-74.4	0	0	0	111	F107 K112 P113 K114 G118 L119 E155 L158 S159 L162	F107-F116 HydrophobicContact CE2-CE2 4.28Å; F107-F116 HydrophobicContact CZ-CD2 4.41Å; F107-F116 HydrophobicContact CZ-CE2 4.14Å; K112-F116 WeakPolarHBondContact O-CD2 3.12Å; P113-F116 PolarHBondContact O-N 2.93Å; K114-F116 VanDerWaalsContact C-N 3.28Å; F116-G118 PolarHBondContact O-N 2.81Å; F116-L119 HydrophobicContact CB-CB 3.79Å; F116-L119 HydrophobicContact CB-CD2 4.04Å; F116-L119 HydrophobicContact CD2-CD2 3.92Å; F116-L119 HydrophobicContact CG-CD2 4.35Å; F116-L119 PolarHBondContact O-N 3.37Å; F116-E155 HydrophobicContact CE2-CG 4.13Å; F116-E155 HydrophobicContact CZ-CG 3.73Å; F116-L158 HydrophobicContact CD1-CB 4.02Å; F116-L158 HydrophobicContact CD2-CB 4.33Å; F116-L158 HydrophobicContact CD2-CD1 4.35Å; F116-L158 HydrophobicContact CE1-CB 3.82Å; F116-L158 HydrophobicContact CE2-CB 4.13Å; F116-L158 HydrophobicContact CE2-CD1 4.31Å; F116-L158 HydrophobicContact CG-CB 4.27Å; F116-L158 HydrophobicContact CZ-CB 3.86Å; F116-S159 WeakPolarHBondContact CE1-OG 3.32Å; F116-L162 HydrophobicContact CB-CD1 4.26Å; F116-L162 HydrophobicContact CD1-CB 4.49Å
117	R	92.3	Very high	93.9	Very high	157 Å²	157	75.6 Å²	75.6	59%	0.592	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	133.5	176.2	-164.9	-176.9	179.9	-173.7	0.3	109.6	L119 E163 I165	R117-L119 PolarHBondContact O-N 2.77Å; R117-E163 HydrophobicContact CB-CB 4.44Å; R117-E163 VanDerWaalsContact CD-OE2 3.23Å; R117-E163 WeakPolarHBondContact CD-OE2 3.42Å; R117-E163 IonicContact CZ-OE2 3.64Å; R117-E163 PolarHBondContact N-O 2.89Å; R117-E163 IonicContact NE-OE2 3.42Å; R117-E163 IonicContact NH1-OE2 2.76Å; R117-E163 PolarHBondContact NH1-OE2 2.8Å; R117-I165 HydrophobicContact CB-CD1 4.11Å; R117-I165 HydrophobicContact CB-CG1 3.78Å; R117-I165 HydrophobicContact CG-CG1 4.47Å
118	G	92.6	Very high	93.9	Very high	33 Å²	33	78.7 Å²	78.7	34%	0.34	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	2	177.9	0	0	0	0	0	115.1	A89 F116	A89-G118 PolarHBondContact N-O 2.7Å; A89-G118 VanDerWaalsContact O-O 3.11Å; F116-G118 PolarHBondContact O-N 2.81Å
119	L	96.1	Very high	94	Very high	21 Å²	21	78.1 Å²	78.1	11%	0.11	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	125.3	171	-180	64.4	0	0	0	110.6	A89 L91 F107 P113 F116 R117 I121 L131 L158 L162	A89-L119 HydrophobicContact CB-CD1 3.97Å; A89-L119 CarbonylContact O-C 3.54Å; A89-L119 WeakPolarHBondContact O-CA 3.46Å; L91-L119 HydrophobicContact CB-CD1 4.45Å; F107-L119 HydrophobicContact CE1-CD2 4.15Å; F107-L119 HydrophobicContact CZ-CD2 4.14Å; P113-L119 HydrophobicContact CB-CD2 3.93Å; F116-L119 HydrophobicContact CB-CB 3.79Å; F116-L119 HydrophobicContact CB-CD2 4.04Å; F116-L119 HydrophobicContact CD2-CD2 3.92Å; F116-L119 HydrophobicContact CG-CD2 4.35Å; F116-L119 PolarHBondContact O-N 3.37Å; R117-L119 PolarHBondContact O-N 2.77Å; L119-I121 HydrophobicContact CG-CD1 4.49Å; L119-L131 HydrophobicContact CD1-CD1 4.42Å; L119-L158 HydrophobicContact CD1-CD2 4.21Å; L119-L158 HydrophobicContact CD2-CD1 3.99Å; L119-L162 HydrophobicContact CB-CD1 4.31Å
120	Q	95.5	Very high	94.2	Very high	117 Å²	117	70.6 Å²	70.6	55%	0.547	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.4	178.5	-61.7	-179.7	39.6	0	0	110.7	A89 I90 L91	A89-Q120 PolarHBondContact O-N 2.97Å; I90-Q120 CarbonylContact C-O 3.6Å; I90-Q120 WeakPolarHBondContact CA-O 3.18Å; I90-Q120 HydrophobicContact CG1-CB 4.42Å; L91-Q120 PolarHBondContact N-O 2.84Å
121	I	95.8	Very high	94.4	Very high	52 Å²	52	68.9 Å²	68.9	27%	0.267	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	121.2	173.6	-51	-53.2	0	0	0	108.9	L91 V93 V108 P113 L119 Y123	L91-I121 HydrophobicContact CB-CD1 3.79Å; L91-I121 HydrophobicContact CD2-CD1 3.92Å; L91-I121 HydrophobicContact CG-CD1 4.17Å; V93-I121 HydrophobicContact CG2-CG2 4.18Å; V108-I121 HydrophobicContact CG1-CG2 3.81Å; P113-I121 HydrophobicContact CB-CD1 4.21Å; P113-I121 HydrophobicContact CB-CG1 4.37Å; P113-I121 HydrophobicContact CG-CD1 4.49Å; L119-I121 HydrophobicContact CG-CD1 4.49Å; I121-Y123 HydrophobicContact CG2-CE2 3.92Å
122	K	96.1	Very high	94.7	Very high	102 Å²	102	65.1 Å²	65.1	44%	0.443	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.3	-178.8	-172.9	-179	171.8	-163.2	0	111.1	I90 L91 E92 V93 V124	I90-K122 HydrophobicContact CG2-CB 3.81Å; I90-K122 HydrophobicContact CG2-CD 4.18Å; L91-K122 PolarHBondContact O-N 3.09Å; E92-K122 WeakPolarHBondContact CA-O 3.32Å; E92-K122 HydrophobicContact CG-CB 4.25Å; E92-K122 HydrophobicContact CG-CD 4.25Å; E92-K122 WeakPolarHBondContact OE1-CD 3.47Å; E92-K122 IonicContact OE1-NZ 3.79Å; E92-K122 PolarHBondContact OE1-NZ 3.15Å; V93-K122 PolarHBondContact N-O 3.07Å; K122-V124 HydrophobicContact CD-CG2 4.14Å; K122-V124 HydrophobicContact CG-CG2 3.96Å; K122-V124 PolarHBondContact O-N 3.13Å
123	Y	95.6	Very high	94.9	Very high	139 Å²	139	62.2 Å²	62.2	55%	0.545	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	102.8	-179.9	-68	-83.7	0	0	0	111.6	V93 V108 I121	V93-Y123 HydrophobicContact CG2-CD1 3.76Å; V93-Y123 HydrophobicContact CG2-CE1 3.68Å; V93-Y123 CarbonylContact O-C 3.46Å; V93-Y123 WeakPolarHBondContact O-CA 3.46Å; V108-Y123 WeakPolarHBondContact CG1-OH 3.3Å; I121-Y123 HydrophobicContact CG2-CE2 3.92Å
124	V	95.9	Very high	95	Very high	44 Å²	44	62.3 Å²	62.3	27%	0.267	30%	0.3	S	S	.	.			trans	-109.2	119.6	-179.5	-175.8	0	0	0	0	109.6	E92 V93 C94 K122 G126 S127	E92-V124 HydrophobicContact CB-CG2 4.31Å; E92-V124 HydrophobicContact CG-CG2 4.22Å; V93-V124 PolarHBondContact O-N 3.18Å; C94-V124 VanDerWaalsContact CA-O 3.31Å; C94-V124 WeakPolarHBondContact CA-O 3.37Å; C94-V124 VanDerWaalsContact CB-O 3.24Å; C94-V124 WeakPolarHBondContact CB-O 3.36Å; K122-V124 HydrophobicContact CD-CG2 4.14Å; K122-V124 HydrophobicContact CG-CG2 3.96Å; K122-V124 PolarHBondContact O-N 3.13Å; V124-G126 PolarHBondContact O-N 3.39Å; V124-S127 WeakPolarHBondContact O-CB 3.38Å; V124-S127 PolarHBondContact O-N 2.81Å
125	R	94.1	Very high	95	Very high	221 Å²	221	57.2 Å²	57.2	83%	0.834	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	130	179.7	-75.1	-90.1	-176.9	128.7	-0.8	110.2	S127	R125-S127 PolarHBondContact O-N 2.84Å
126	G	92.2	Very high	95	Very high	46 Å²	46	60.4 Å²	60.4	47%	0.474	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	-13.4	178.2	0	0	0	0	0	115.1	C94 K97 V124	C94-G126 PolarHBondContact SG-N 2.99Å; K97-G126 WeakPolarHBondContact CE-O 3.47Å; K97-G126 PolarHBondContact NZ-O 3.19Å; V124-G126 PolarHBondContact O-N 3.39Å
127	S	91.6	Very high	95	Very high	26 Å²	26	65.7 Å²	65.7	18%	0.182	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-68.9	136.7	178.9	-163.4	0	0	0	0	111.6	C94 V124 R125	C94-S127 WeakPolarHBondContact CB-O 3.28Å; C94-S127 PolarHBondContact N-O 2.97Å; V124-S127 WeakPolarHBondContact O-CB 3.38Å; V124-S127 PolarHBondContact O-N 2.81Å; R125-S127 PolarHBondContact O-N 2.84Å
128	D	94.5	Very high	95	Very high	65 Å²	65	60.5 Å²	60.5	35%	0.348	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-75.2	156.3	163.3	-72.6	-23.2	0	0	0	109.4	K97 V130 L147	K97-D128 VanDerWaalsContact CD-OD1 3.28Å; K97-D128 WeakPolarHBondContact CD-OD1 3.26Å; K97-D128 IonicContact NZ-OD1 3.8Å; K97-D128 PolarHBondContact NZ-OD1 3.48Å; K97-D128 IonicContact NZ-OD2 2.78Å; D128-V130 PolarHBondContact O-N 3.36Å; D128-L147 HydrophobicContact CB-CD2 3.63Å
129	P	96.3	Very high	95.1	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.006	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-55.1	116.3	175.2	-31.5	35.9	0	0	0	114	E92 V93 F101 V104 I146 L147	E92-P129 WeakPolarHBondContact O-CA 3.29Å; V93-P129 HydrophobicContact CG1-CB 4.21Å; V93-P129 HydrophobicContact CG1-CG 4.31Å; F101-P129 HydrophobicContact CB-CG 4.28Å; F101-P129 HydrophobicContact CD1-CG 4.34Å; F101-P129 HydrophobicContact CD2-CG 3.61Å; F101-P129 VanDerWaalsContact CE2-CD 3.46Å; F101-P129 HydrophobicContact CE2-CG 3.95Å; F101-P129 HydrophobicContact CG-CG 3.82Å; F101-P129 HydrophobicContact CZ-CG 4.46Å; V104-P129 HydrophobicContact CG1-CB 4.1Å; V104-P129 HydrophobicContact CG1-CG 4.28Å; V104-P129 HydrophobicContact CG2-CB 4.3Å; P129-I146 HydrophobicContact CB-CD1 4.29Å; P129-I146 HydrophobicContact CB-CG1 3.8Å; P129-I146 PolarHBondContact O-N 3.05Å; P129-L147 HydrophobicContact CB-CD2 4.48Å; P129-L147 HydrophobicContact CG-CD2 4.39Å
130	V	97.2	Very high	95.1	Very high	17 Å²	17	66.9 Å²	66.9	10%	0.103	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	133.9	-179.9	174.9	0	0	0	0	109.3	L91 E92 D128 K132 E143 L144	L91-V130 WeakPolarHBondContact CD1-O 3.41Å; E92-V130 PolarHBondContact N-O 2.96Å; E92-V130 PolarHBondContact O-N 3.23Å; D128-V130 PolarHBondContact O-N 3.36Å; V130-K132 HydrophobicContact CG1-CG 4.16Å; V130-E143 HydrophobicContact CG1-CG 3.35Å; V130-L144 WeakPolarHBondContact CA-O 3.35Å
131	L	97.5	Very high	95.1	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.2	174.1	-176.2	66	0	0	0	109.3	A89 L91 L119 L133 L144 I146 F157 L158	A89-L131 HydrophobicContact CB-CD1 4.11Å; L91-L131 HydrophobicContact CB-CD1 4.15Å; L119-L131 HydrophobicContact CD1-CD1 4.42Å; L131-L133 HydrophobicContact CD2-CD2 4.36Å; L131-L133 HydrophobicContact CG-CD2 4.38Å; L131-L144 PolarHBondContact N-O 3.48Å; L131-L144 PolarHBondContact O-N 3.19Å; L131-I146 HydrophobicContact CB-CG2 3.91Å; L131-F157 HydrophobicContact CD2-CD1 3.78Å; L131-F157 HydrophobicContact CD2-CE1 3.76Å; L131-L158 HydrophobicContact CD1-CD2 4.02Å; L131-L158 HydrophobicContact CD2-CD2 3.83Å; L131-L158 HydrophobicContact CD2-CG 4.47Å
132	K	97.5	Very high	95	Very high	29 Å²	29	64.9 Å²	64.9	13%	0.126	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.1	178.2	-65	175.2	173.3	-178.6	0	108.9	A89 I90 E92 V130 I140 E142 E143	A89-K132 CarbonylContact C-O 3.55Å; A89-K132 WeakPolarHBondContact CA-O 3.36Å; I90-K132 HydrophobicContact CB-CB 4.38Å; I90-K132 PolarHBondContact N-O 2.99Å; I90-K132 PolarHBondContact O-N 3.4Å; E92-K132 VanDerWaalsContact CD-NZ 3.34Å; E92-K132 HydrophobicContact CG-CD 4.34Å; E92-K132 IonicContact OE1-NZ 2.83Å; E92-K132 VanDerWaalsContact OE2-CE 3.3Å; E92-K132 WeakPolarHBondContact OE2-CE 3.35Å; E92-K132 IonicContact OE2-NZ 3.39Å; E92-K132 PolarHBondContact OE2-NZ 3.13Å; V130-K132 HydrophobicContact CG1-CG 4.16Å; K132-I140 HydrophobicContact CB-CG1 4.45Å; K132-I140 HydrophobicContact CB-CG2 4.16Å; K132-I140 HydrophobicContact CD-CD1 3.91Å; K132-I140 HydrophobicContact CD-CG1 4.38Å; K132-I140 HydrophobicContact CG-CG2 4.38Å; K132-E142 CarbonylContact C-O 3.56Å; K132-E142 WeakPolarHBondContact CA-O 3.28Å; K132-E143 WeakPolarHBondContact CE-OE2 3.39Å; K132-E143 HydrophobicContact CG-CG 4.08Å; K132-E143 IonicContact NZ-OE2 2.72Å
133	L	96.7	Very high	95	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	138.1	177	-58	176	0	0	0	109.5	Y86 A89 L131 A141 E142 L144 F157	Y86-L133 HydrophobicContact CD1-CB 3.64Å; Y86-L133 HydrophobicContact CD2-CB 4.18Å; Y86-L133 HydrophobicContact CD2-CD1 3.76Å; Y86-L133 HydrophobicContact CD2-CD2 4.47Å; Y86-L133 HydrophobicContact CD2-CG 4.35Å; Y86-L133 HydrophobicContact CE1-CB 3.8Å; Y86-L133 HydrophobicContact CE1-CD1 4.25Å; Y86-L133 HydrophobicContact CE2-CB 4.3Å; Y86-L133 HydrophobicContact CE2-CD1 3.39Å; Y86-L133 HydrophobicContact CE2-CG 4.37Å; Y86-L133 HydrophobicContact CG-CB 3.82Å; Y86-L133 HydrophobicContact CG-CD1 4.29Å; Y86-L133 HydrophobicContact CG-CG 4.45Å; A89-L133 HydrophobicContact CB-CD2 3.85Å; L131-L133 HydrophobicContact CD2-CD2 4.36Å; L131-L133 HydrophobicContact CG-CD2 4.38Å; L133-A141 PolarHBondContact O-N 2.88Å; L133-E142 HydrophobicContact CB-CB 4.23Å; L133-E142 HydrophobicContact CD1-CB 4.22Å; L133-E142 PolarHBondContact N-O 3.09Å; L133-E142 PolarHBondContact O-N 3.43Å; L133-L144 HydrophobicContact CD1-CD1 4.42Å; L133-F157 HydrophobicContact CD1-CE1 4.07Å; L133-F157 HydrophobicContact CD1-CZ 4.06Å; L133-F157 HydrophobicContact CD2-CE1 4.4Å
134	L	96.3	Very high	95.1	Very high	19 Å²	19	60.9 Å²	60.9	10%	0.099	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.5	-176	-56.5	179.5	0	0	0	111.3	Y86 A87 G88 I90 N139 I140	Y86-L134 WeakPolarHBondContact CB-O 3.31Å; A87-L134 PolarHBondContact N-O 2.93Å; G88-L134 PolarHBondContact O-N 3.18Å; I90-L134 HydrophobicContact CD1-CD1 4.08Å; I90-L134 HydrophobicContact CD1-CD2 4.14Å; I90-L134 HydrophobicContact CG1-CD1 3.96Å; I90-L134 HydrophobicContact CG1-CD2 4.41Å; I90-L134 HydrophobicContact CG1-CG 4.37Å; L134-N139 VanDerWaalsContact CA-O 3.25Å; L134-N139 WeakPolarHBondContact CA-O 3.5Å; L134-I140 HydrophobicContact CD2-CG1 4.18Å
135	D	94.4	Very high	95.1	Very high	40 Å²	40	62.1 Å²	62.1	21%	0.214	34%	0.344	C	S	.	.			trans	-76.6	177	167.6	65.8	24.1	0	0	0	112.1	A87 N137 G138 N139 A141	A87-D135 WeakPolarHBondContact CB-O 3.47Å; D135-N137 PolarHBondContact O-N 3.05Å; D135-N137 VanDerWaalsContact O-N 3.16Å; D135-N137 WeakPolarHBondContact OD1-CA 2.73Å; D135-N137 WeakPolarHBondContact OD1-CB 3.19Å; D135-N137 PolarHBondContact OD1-N 3.32Å; D135-G138 PolarHBondContact O-N 3.21Å; D135-G138 PolarHBondContact OD1-N 2.77Å; D135-N139 PolarHBondContact N-O 2.89Å; D135-N139 PolarHBondContact OD1-N 3.49Å; D135-A141 HydrophobicContact CB-CB 4.22Å
136	D	92.6	Very high	95.2	Very high	133 Å²	133	51.6 Å²	51.6	71%	0.711	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.2	175.9	47.8	-76	0	0	0	114.2	G138	D136-G138 VanDerWaalsContact C-N 3.34Å
137	N	94.4	Very high	95.2	Very high	117 Å²	117	52.4 Å²	52.4	63%	0.626	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-2.9	178.1	-57	-74.5	0	0	0	112.3	D135 N139	D135-N137 PolarHBondContact O-N 3.05Å; D135-N137 VanDerWaalsContact O-N 3.16Å; D135-N137 WeakPolarHBondContact OD1-CA 2.73Å; D135-N137 WeakPolarHBondContact OD1-CB 3.19Å; D135-N137 PolarHBondContact OD1-N 3.32Å; N137-N139 VanDerWaalsContact C-N 3.3Å; N137-N139 WeakPolarHBondContact CB-ND2 3.33Å
138	G	91.9	Very high	95.3	Very high	47 Å²	47	60.9 Å²	60.9	49%	0.485	33%	0.331	S	S	.	.	S	Bend	trans	77.2	13.1	-175.7	0	0	0	0	0	114	D135 D136	D135-G138 PolarHBondContact O-N 3.21Å; D135-G138 PolarHBondContact OD1-N 2.77Å; D136-G138 VanDerWaalsContact C-N 3.34Å
139	N	95.9	Very high	95.4	Very high	96 Å²	96	61.2 Å²	61.2	51%	0.513	33%	0.328	S	S	.	.			trans	-85.1	155.3	174	-57.5	-59.5	0	0	0	110.6	L134 D135 N137 A141	L134-N139 VanDerWaalsContact CA-O 3.25Å; L134-N139 WeakPolarHBondContact CA-O 3.5Å; D135-N139 PolarHBondContact N-O 2.89Å; D135-N139 PolarHBondContact OD1-N 3.49Å; N137-N139 VanDerWaalsContact C-N 3.3Å; N137-N139 WeakPolarHBondContact CB-ND2 3.33Å; N139-A141 PolarHBondContact O-N 3.36Å; N139-A141 VanDerWaalsContact O-N 3.14Å
140	I	95.4	Very high	95.4	Very high	93 Å²	93	64.2 Å²	64.2	48%	0.477	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	109	175.6	-58.2	161.1	0	0	0	108.1	K132 L134	K132-I140 HydrophobicContact CB-CG1 4.45Å; K132-I140 HydrophobicContact CB-CG2 4.16Å; K132-I140 HydrophobicContact CD-CD1 3.91Å; K132-I140 HydrophobicContact CD-CG1 4.38Å; K132-I140 HydrophobicContact CG-CG2 4.38Å; L134-I140 HydrophobicContact CD2-CG1 4.18Å
141	A	94.8	Very high	95.3	Very high	54 Å²	54	64 Å²	64	45%	0.446	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-38.1	176.9	0	0	0	0	0	111.6	Y86 L133 D135 N139	Y86-A141 HydrophobicContact CD1-CB 4.25Å; Y86-A141 HydrophobicContact CE1-CB 3.8Å; L133-A141 PolarHBondContact O-N 2.88Å; D135-A141 HydrophobicContact CB-CB 4.22Å; N139-A141 PolarHBondContact O-N 3.36Å; N139-A141 VanDerWaalsContact O-N 3.14Å
142	E	94.3	Very high	95.2	Very high	73 Å²	73	68.9 Å²	68.9	34%	0.341	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	144.5	-177.1	-167	177	172.1	0	0	110.5	Y86 K132 L133 L144	Y86-E142 PolarHBondContact OH-OE2 3.36Å; K132-E142 CarbonylContact C-O 3.56Å; K132-E142 WeakPolarHBondContact CA-O 3.28Å; L133-E142 HydrophobicContact CB-CB 4.23Å; L133-E142 HydrophobicContact CD1-CB 4.22Å; L133-E142 PolarHBondContact N-O 3.09Å; L133-E142 PolarHBondContact O-N 3.43Å; E142-L144 HydrophobicContact CG-CD2 4.43Å; E142-L144 HydrophobicContact CG-CG 4.27Å
143	E	96.6	Very high	95.1	Very high	117 Å²	117	69.5 Å²	69.5	55%	0.547	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.6	177.7	-175.5	172.3	135.2	0	0	109.9	V130 K132	V130-E143 HydrophobicContact CG1-CG 3.35Å; K132-E143 WeakPolarHBondContact CE-OE2 3.39Å; K132-E143 HydrophobicContact CG-CG 4.08Å; K132-E143 IonicContact NZ-OE2 2.72Å
144	L	96.7	Very high	95	Very high	39 Å²	39	69.6 Å²	69.6	20%	0.204	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.5	-174.8	-65.6	172.4	0	0	0	111	V130 L131 L133 E142 I146 F157	V130-L144 WeakPolarHBondContact CA-O 3.35Å; L131-L144 PolarHBondContact N-O 3.48Å; L131-L144 PolarHBondContact O-N 3.19Å; L133-L144 HydrophobicContact CD1-CD1 4.42Å; E142-L144 HydrophobicContact CG-CD2 4.43Å; E142-L144 HydrophobicContact CG-CG 4.27Å; L144-I146 PolarHBondContact O-N 2.77Å; L144-F157 HydrophobicContact CD1-CE1 3.6Å; L144-F157 HydrophobicContact CD1-CE2 4.11Å; L144-F157 HydrophobicContact CD1-CZ 3.25Å
145	S	96	Very high	95	Very high	70 Å²	70	70.7 Å²	70.7	49%	0.49	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	117.7	171.8	-172.4	0	0	0	0	110.1	L147 W149	S145-L147 WeakPolarHBondContact OG-CD1 3.24Å; S145-L147 VanDerWaalsContact OG-CG 3.3Å; S145-L147 WeakPolarHBondContact OG-CG 3.31Å; S145-W149 PolarHBondContact O-NE1 2.72Å
146	I	95.6	Very high	95	Very high	1 Å²	1	75.3 Å²	75.3	1%	0.005	40%	0.402	C	S	.	.			trans	-103.2	21.4	-179	65.8	162.6	0	0	0	112.7	L91 V104 P129 L131 L144 K148 W149 V154	L91-I146 HydrophobicContact CD1-CD1 3.47Å; L91-I146 VanDerWaalsContact CD1-CD1 3.47Å; L91-I146 HydrophobicContact CD1-CG1 4.37Å; L91-I146 HydrophobicContact CD2-CD1 4.48Å; V104-I146 HydrophobicContact CG1-CD1 4.09Å; V104-I146 HydrophobicContact CG2-CD1 4.03Å; V104-I146 HydrophobicContact CG2-CG1 4.36Å; P129-I146 HydrophobicContact CB-CD1 4.29Å; P129-I146 HydrophobicContact CB-CG1 3.8Å; P129-I146 PolarHBondContact O-N 3.05Å; L131-I146 HydrophobicContact CB-CG2 3.91Å; L144-I146 PolarHBondContact O-N 2.77Å; I146-K148 PolarHBondContact O-N 3.09Å; I146-K148 VanDerWaalsContact O-N 3.14Å; I146-W149 HydrophobicContact CB-CB 4.08Å; I146-W149 HydrophobicContact CB-CD2 4Å; I146-W149 HydrophobicContact CB-CE3 4.43Å; I146-W149 HydrophobicContact CB-CG 3.83Å; I146-W149 HydrophobicContact CG2-CD2 3.76Å; I146-W149 HydrophobicContact CG2-CE3 3.93Å; I146-W149 HydrophobicContact CG2-CG 4.16Å; I146-W149 HydrophobicContact CG2-CZ2 4.38Å; I146-W149 HydrophobicContact CG2-CZ3 4.28Å; I146-W149 WeakPolarHBondContact O-CB 3.49Å; I146-W149 PolarHBondContact O-N 3.14Å; I146-W149 VanDerWaalsContact O-N 3.09Å; I146-V154 HydrophobicContact CD1-CG2 4.17Å
147	L	93	Very high	95.1	Very high	62 Å²	62	70.8 Å²	70.8	33%	0.325	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-35.3	-174.1	-69.2	173	0	0	0	114.2	F101 D128 P129 S145	F101-L147 HydrophobicContact CD1-CD2 4.35Å; F101-L147 HydrophobicContact CE1-CB 4.38Å; F101-L147 HydrophobicContact CE1-CD2 3.49Å; F101-L147 VanDerWaalsContact CE1-CD2 3.49Å; F101-L147 HydrophobicContact CE2-CD2 4.42Å; F101-L147 HydrophobicContact CZ-CD2 3.52Å; D128-L147 HydrophobicContact CB-CD2 3.63Å; P129-L147 HydrophobicContact CB-CD2 4.48Å; P129-L147 HydrophobicContact CG-CD2 4.39Å; S145-L147 WeakPolarHBondContact OG-CD1 3.24Å; S145-L147 VanDerWaalsContact OG-CG 3.3Å; S145-L147 WeakPolarHBondContact OG-CG 3.31Å
148	K	94.2	Very high	95.1	Very high	204 Å²	204	65.2 Å²	65.2	89%	0.887	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	7.8	-175.9	-62.7	-178	-179.3	177	0	112.7	I146	I146-K148 PolarHBondContact O-N 3.09Å; I146-K148 VanDerWaalsContact O-N 3.14Å
149	W	96.9	Very high	95.1	Very high	72 Å²	72	65 Å²	65	27%	0.273	34%	0.337	S	S	.	.			trans	-83.6	145.6	-175.6	-68.5	33.7	0	0	0	110	S145 I146 V154 F157	S145-W149 PolarHBondContact O-NE1 2.72Å; I146-W149 HydrophobicContact CB-CB 4.08Å; I146-W149 HydrophobicContact CB-CD2 4Å; I146-W149 HydrophobicContact CB-CE3 4.43Å; I146-W149 HydrophobicContact CB-CG 3.83Å; I146-W149 HydrophobicContact CG2-CD2 3.76Å; I146-W149 HydrophobicContact CG2-CE3 3.93Å; I146-W149 HydrophobicContact CG2-CG 4.16Å; I146-W149 HydrophobicContact CG2-CZ2 4.38Å; I146-W149 HydrophobicContact CG2-CZ3 4.28Å; I146-W149 WeakPolarHBondContact O-CB 3.49Å; I146-W149 PolarHBondContact O-N 3.14Å; I146-W149 VanDerWaalsContact O-N 3.09Å; W149-V154 HydrophobicContact CB-CG2 3.84Å; W149-V154 HydrophobicContact CE3-CG2 3.89Å; W149-F157 HydrophobicContact CH2-CB 4.09Å; W149-F157 HydrophobicContact CH2-CD1 4.03Å; W149-F157 AromaticContact CH2-CD2 3.84Å; W149-F157 HydrophobicContact CH2-CD2 3.84Å; W149-F157 HydrophobicContact CH2-CE1 4.46Å; W149-F157 HydrophobicContact CH2-CE2 4.28Å; W149-F157 AromaticContact CH2-CG 3.7Å; W149-F157 HydrophobicContact CH2-CG 3.7Å; W149-F157 HydrophobicContact CZ3-CB 3.56Å; W149-F157 AromaticContact CZ3-CD1 3.96Å; W149-F157 HydrophobicContact CZ3-CD1 3.96Å; W149-F157 HydrophobicContact CZ3-CD2 4.2Å; W149-F157 AromaticContact CZ3-CG 3.64Å; W149-F157 HydrophobicContact CZ3-CG 3.64Å
150	N	94.9	Very high	94.9	Very high	64 Å²	64	63.6 Å²	63.6	34%	0.342	33%	0.328	S	S	.	.			trans	-89	169.1	170.6	67.7	49.2	0	0	0	110.1	Q103 D152 S153 V154	Q103-N150 HydrophobicContact CG-CB 4.26Å; N150-D152 PolarHBondContact O-N 3.49Å; N150-D152 PolarHBondContact OD1-N 3.22Å; N150-S153 PolarHBondContact ND2-OG 3.29Å; N150-S153 PolarHBondContact O-N 3.21Å; N150-S153 WeakPolarHBondContact OD1-CB 3.35Å; N150-S153 PolarHBondContact OD1-N 3.06Å; N150-S153 PolarHBondContact OD1-OG 2.98Å; N150-S153 VanDerWaalsContact OD1-OG 3.05Å; N150-V154 WeakPolarHBondContact O-CG2 3.46Å; N150-V154 PolarHBondContact O-N 2.75Å
151	T	95.2	Very high	94.8	Very high	13 Å²	13	61.1 Å²	61.1	8%	0.08	31%	0.314	C	S	.	.	H	α-helix	trans	-57.8	-39	-178.4	-51.3	0	0	0	0	112.3	Q103 F107 K112 E155	Q103-T151 PolarHBondContact O-OG1 2.78Å; Q103-T151 VanDerWaalsContact O-OG1 3.1Å; F107-T151 HydrophobicContact CB-CG2 4.15Å; F107-T151 HydrophobicContact CD2-CG2 4.45Å; K112-T151 HydrophobicContact CD-CG2 4.18Å; T151-E155 PolarHBondContact O-N 3.47Å; T151-E155 VanDerWaalsContact O-N 3.13Å
152	D	95.5	Very high	94.6	Very high	103 Å²	103	58.7 Å²	58.7	55%	0.551	29%	0.293	S	S	*	.	H	α-helix	trans	-74.6	-42.8	-173.4	-51.7	-39	0	0	0	110.6	N150 V154 E155 E156	N150-D152 PolarHBondContact O-N 3.49Å; N150-D152 PolarHBondContact OD1-N 3.22Å; D152-V154 VanDerWaalsContact C-N 3.31Å; D152-V154 PolarHBondContact O-N 3.31Å; D152-E155 PolarHBondContact O-N 2.93Å; D152-E155 VanDerWaalsContact O-N 3.15Å; D152-E156 WeakPolarHBondContact O-CB 3.34Å; D152-E156 PolarHBondContact O-N 3.02Å
153	S	95.9	Very high	94.5	Very high	43 Å²	43	60.1 Å²	60.1	30%	0.301	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-36.5	174.5	-58.9	0	0	0	0	112.4	N150 F157	N150-S153 PolarHBondContact ND2-OG 3.29Å; N150-S153 PolarHBondContact O-N 3.21Å; N150-S153 WeakPolarHBondContact OD1-CB 3.35Å; N150-S153 PolarHBondContact OD1-N 3.06Å; N150-S153 PolarHBondContact OD1-OG 2.98Å; N150-S153 VanDerWaalsContact OD1-OG 3.05Å; S153-F157 WeakPolarHBondContact O-CB 3.2Å; S153-F157 PolarHBondContact O-N 2.88Å
154	V	95.8	Very high	94.1	Very high	1 Å²	1	60 Å²	60	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-45.6	173.7	175.5	0	0	0	0	110.3	F107 I146 W149 N150 D152 L158	F107-V154 HydrophobicContact CD1-CG1 3.9Å; F107-V154 HydrophobicContact CD2-CB 4.29Å; F107-V154 HydrophobicContact CD2-CG1 3.89Å; F107-V154 HydrophobicContact CE1-CG1 3.93Å; F107-V154 HydrophobicContact CE2-CG1 3.93Å; F107-V154 HydrophobicContact CG-CB 4.47Å; F107-V154 HydrophobicContact CG-CG1 3.89Å; F107-V154 HydrophobicContact CZ-CG1 3.97Å; I146-V154 HydrophobicContact CD1-CG2 4.17Å; W149-V154 HydrophobicContact CB-CG2 3.84Å; W149-V154 HydrophobicContact CE3-CG2 3.89Å; N150-V154 WeakPolarHBondContact O-CG2 3.46Å; N150-V154 PolarHBondContact O-N 2.75Å; D152-V154 VanDerWaalsContact C-N 3.31Å; D152-V154 PolarHBondContact O-N 3.31Å; V154-L158 HydrophobicContact CG1-CD1 3.78Å; V154-L158 WeakPolarHBondContact O-CB 3.34Å; V154-L158 WeakPolarHBondContact O-CD1 3.36Å; V154-L158 WeakPolarHBondContact O-CG 3.35Å; V154-L158 PolarHBondContact O-N 3.18Å; V154-L158 VanDerWaalsContact O-N 3.09Å
155	E	95	Very high	93.7	Very high	42 Å²	42	65.7 Å²	65.7	20%	0.196	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-46	179.2	-170.7	-175.3	168.7	0	0	112.5	F107 K112 F116 T151 D152 L158 S159 R164	F107-E155 HydrophobicContact CE2-CB 4.18Å; K112-E155 HydrophobicContact CD-CG 4.49Å; K112-E155 VanDerWaalsContact CD-OE2 3.28Å; K112-E155 WeakPolarHBondContact CD-OE2 3.41Å; K112-E155 WeakPolarHBondContact CE-OE2 3Å; F116-E155 HydrophobicContact CE2-CG 4.13Å; F116-E155 HydrophobicContact CZ-CG 3.73Å; T151-E155 PolarHBondContact O-N 3.47Å; T151-E155 VanDerWaalsContact O-N 3.13Å; D152-E155 PolarHBondContact O-N 2.93Å; D152-E155 VanDerWaalsContact O-N 3.15Å; E155-L158 PolarHBondContact O-N 3.28Å; E155-S159 WeakPolarHBondContact O-CB 3.46Å; E155-S159 PolarHBondContact O-N 3.1Å; E155-S159 PolarHBondContact O-OG 3.06Å; E155-R164 IonicContact OE1-CZ 3.82Å; E155-R164 IonicContact OE1-NH1 2.86Å; E155-R164 PolarHBondContact OE1-NH1 3.07Å; E155-R164 IonicContact OE1-NH2 3.97Å; E155-R164 PolarHBondContact OE1-NH2 3.27Å
156	E	94	Very high	93.6	Very high	138 Å²	138	65.5 Å²	65.5	65%	0.645	32%	0.315	S	S	*	.	H	α-helix	trans	-60.5	-49.4	180	-178.9	175.7	-153.5	0	0	110.8	D152 L158 S159 E160	D152-E156 WeakPolarHBondContact O-CB 3.34Å; D152-E156 PolarHBondContact O-N 3.02Å; E156-L158 PolarHBondContact O-N 3.44Å; E156-S159 WeakPolarHBondContact O-CB 3.28Å; E156-S159 PolarHBondContact O-N 3.41Å; E156-S159 VanDerWaalsContact O-N 3.07Å; E156-E160 PolarHBondContact O-N 2.98Å
157	F	94.9	Very high	93.5	Very high	37 Å²	37	68.9 Å²	68.9	16%	0.162	33%	0.332	C	S	.	.	H	α-helix	trans	-60	-44.8	177.7	-177.8	-97.8	0	0	0	112.2	L131 L133 L144 W149 S153 S159 E160 K161	L131-F157 HydrophobicContact CD2-CD1 3.78Å; L131-F157 HydrophobicContact CD2-CE1 3.76Å; L133-F157 HydrophobicContact CD1-CE1 4.07Å; L133-F157 HydrophobicContact CD1-CZ 4.06Å; L133-F157 HydrophobicContact CD2-CE1 4.4Å; L144-F157 HydrophobicContact CD1-CE1 3.6Å; L144-F157 HydrophobicContact CD1-CE2 4.11Å; L144-F157 HydrophobicContact CD1-CZ 3.25Å; W149-F157 HydrophobicContact CH2-CB 4.09Å; W149-F157 HydrophobicContact CH2-CD1 4.03Å; W149-F157 AromaticContact CH2-CD2 3.84Å; W149-F157 HydrophobicContact CH2-CD2 3.84Å; W149-F157 HydrophobicContact CH2-CE1 4.46Å; W149-F157 HydrophobicContact CH2-CE2 4.28Å; W149-F157 AromaticContact CH2-CG 3.7Å; W149-F157 HydrophobicContact CH2-CG 3.7Å; W149-F157 HydrophobicContact CZ3-CB 3.56Å; W149-F157 AromaticContact CZ3-CD1 3.96Å; W149-F157 HydrophobicContact CZ3-CD1 3.96Å; W149-F157 HydrophobicContact CZ3-CD2 4.2Å; W149-F157 AromaticContact CZ3-CG 3.64Å; W149-F157 HydrophobicContact CZ3-CG 3.64Å; S153-F157 WeakPolarHBondContact O-CB 3.2Å; S153-F157 PolarHBondContact O-N 2.88Å; F157-S159 VanDerWaalsContact C-N 3.27Å; F157-S159 PolarHBondContact O-N 3.13Å; F157-E160 PolarHBondContact O-N 3.31Å; F157-K161 HydrophobicContact CD1-CG 4.35Å; F157-K161 HydrophobicContact CD2-CG 4.38Å; F157-K161 HydrophobicContact CE1-CG 3.92Å; F157-K161 HydrophobicContact CE2-CG 3.97Å; F157-K161 HydrophobicContact CZ-CG 3.71Å; F157-K161 WeakPolarHBondContact O-CB 3.47Å; F157-K161 WeakPolarHBondContact O-CG 3.43Å; F157-K161 PolarHBondContact O-N 3.49Å
158	L	94.7	Very high	93.5	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-34	176.3	-70	168.5	0	0	0	111.9	A89 F107 F116 L119 L131 V154 E155 E156 E160 K161 L162	A89-L158 HydrophobicContact CB-CD2 4.5Å; F107-L158 HydrophobicContact CE1-CD1 3.87Å; F107-L158 HydrophobicContact CE2-CD1 4.08Å; F107-L158 HydrophobicContact CZ-CD1 3.32Å; F116-L158 HydrophobicContact CD1-CB 4.02Å; F116-L158 HydrophobicContact CD2-CB 4.33Å; F116-L158 HydrophobicContact CD2-CD1 4.35Å; F116-L158 HydrophobicContact CE1-CB 3.82Å; F116-L158 HydrophobicContact CE2-CB 4.13Å; F116-L158 HydrophobicContact CE2-CD1 4.31Å; F116-L158 HydrophobicContact CG-CB 4.27Å; F116-L158 HydrophobicContact CZ-CB 3.86Å; L119-L158 HydrophobicContact CD1-CD2 4.21Å; L119-L158 HydrophobicContact CD2-CD1 3.99Å; L131-L158 HydrophobicContact CD1-CD2 4.02Å; L131-L158 HydrophobicContact CD2-CD2 3.83Å; L131-L158 HydrophobicContact CD2-CG 4.47Å; V154-L158 HydrophobicContact CG1-CD1 3.78Å; V154-L158 WeakPolarHBondContact O-CB 3.34Å; V154-L158 WeakPolarHBondContact O-CD1 3.36Å; V154-L158 WeakPolarHBondContact O-CG 3.35Å; V154-L158 PolarHBondContact O-N 3.18Å; V154-L158 VanDerWaalsContact O-N 3.09Å; E155-L158 PolarHBondContact O-N 3.28Å; E156-L158 PolarHBondContact O-N 3.44Å; L158-E160 VanDerWaalsContact C-N 3.3Å; L158-E160 PolarHBondContact O-N 2.82Å; L158-K161 PolarHBondContact O-N 3.2Å; L158-L162 HydrophobicContact CB-CD1 4.5Å; L158-L162 HydrophobicContact CD2-CD1 3.62Å; L158-L162 HydrophobicContact CD2-CG 4.42Å; L158-L162 WeakPolarHBondContact O-CA 3.4Å; L158-L162 VanDerWaalsContact O-CB 3.29Å; L158-L162 WeakPolarHBondContact O-CB 3.35Å; L158-L162 PolarHBondContact O-N 3.32Å
159	S	92.2	Very high	93.4	Very high	42 Å²	42	61.4 Å²	61.4	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-69.6	-27.8	176.4	-55	0	0	0	0	113.2	F116 E155 E156 F157 R164	F116-S159 WeakPolarHBondContact CE1-OG 3.32Å; E155-S159 WeakPolarHBondContact O-CB 3.46Å; E155-S159 PolarHBondContact O-N 3.1Å; E155-S159 PolarHBondContact O-OG 3.06Å; E156-S159 WeakPolarHBondContact O-CB 3.28Å; E156-S159 PolarHBondContact O-N 3.41Å; E156-S159 VanDerWaalsContact O-N 3.07Å; F157-S159 VanDerWaalsContact C-N 3.27Å; F157-S159 PolarHBondContact O-N 3.13Å; S159-R164 PolarHBondContact OG-NH2 3.14Å
160	E	91.6	Very high	93.2	Very high	68 Å²	68	60.7 Å²	60.7	32%	0.318	30%	0.301	S	S	.	.	H	α-helix	trans	-79.8	-35.6	175	-163.7	-162.7	117.7	0	0	112	K83 E156 F157 L158	K83-E160 HydrophobicContact CD-CG 4.07Å; K83-E160 HydrophobicContact CG-CG 4.15Å; E156-E160 PolarHBondContact O-N 2.98Å; F157-E160 PolarHBondContact O-N 3.31Å; L158-E160 VanDerWaalsContact C-N 3.3Å; L158-E160 PolarHBondContact O-N 2.82Å
161	K	92.4	Very high	93.1	Very high	41 Å²	41	60.5 Å²	60.5	18%	0.178	30%	0.298	C	S	.	.	H	α-helix	trans	-98.8	-17	-171.6	-63.3	-44.8	-171.8	-158.6	0	115	L85 Y86 F157 L158	L85-K161 WeakPolarHBondContact CA-O 3.34Å; Y86-K161 HydrophobicContact CD2-CB 4Å; Y86-K161 HydrophobicContact CD2-CD 4.44Å; Y86-K161 HydrophobicContact CD2-CG 4.44Å; Y86-K161 HydrophobicContact CE2-CB 4.47Å; Y86-K161 HydrophobicContact CE2-CD 4.18Å; Y86-K161 HydrophobicContact CE2-CG 4.42Å; Y86-K161 PolarHBondContact N-O 3.19Å; F157-K161 HydrophobicContact CD1-CG 4.35Å; F157-K161 HydrophobicContact CD2-CG 4.38Å; F157-K161 HydrophobicContact CE1-CG 3.92Å; F157-K161 HydrophobicContact CE2-CG 3.97Å; F157-K161 HydrophobicContact CZ-CG 3.71Å; F157-K161 WeakPolarHBondContact O-CB 3.47Å; F157-K161 WeakPolarHBondContact O-CG 3.43Å; F157-K161 PolarHBondContact O-N 3.49Å; L158-K161 PolarHBondContact O-N 3.2Å
162	L	92.3	Very high	93	Very high	3 Å²	3	63.9 Å²	63.9	2%	0.016	31%	0.314	C	S	.	.	S	Bend	trans	-128.2	157.8	-177.8	-59	176	0	0	0	112.1	A89 F116 L119 L158 R164	A89-L162 HydrophobicContact CB-CD1 3.81Å; A89-L162 HydrophobicContact CB-CD2 4.27Å; F116-L162 HydrophobicContact CB-CD1 4.26Å; F116-L162 HydrophobicContact CD1-CB 4.49Å; L119-L162 HydrophobicContact CB-CD1 4.31Å; L158-L162 HydrophobicContact CB-CD1 4.5Å; L158-L162 HydrophobicContact CD2-CD1 3.62Å; L158-L162 HydrophobicContact CD2-CG 4.42Å; L158-L162 WeakPolarHBondContact O-CA 3.4Å; L158-L162 VanDerWaalsContact O-CB 3.29Å; L158-L162 WeakPolarHBondContact O-CB 3.35Å; L158-L162 PolarHBondContact O-N 3.32Å; L162-R164 PolarHBondContact O-N 3.42Å
163	E	90.4	Very high	92.8	Very high	103 Å²	103	60.8 Å²	60.8	48%	0.481	30%	0.296	S	S	.	.			trans	-72	125	171.8	-172.6	175.9	-137.3	0	0	110.5	R117	R117-E163 HydrophobicContact CB-CB 4.44Å; R117-E163 VanDerWaalsContact CD-OE2 3.23Å; R117-E163 WeakPolarHBondContact CD-OE2 3.42Å; R117-E163 IonicContact CZ-OE2 3.64Å; R117-E163 PolarHBondContact N-O 2.89Å; R117-E163 IonicContact NE-OE2 3.42Å; R117-E163 IonicContact NH1-OE2 2.76Å; R117-E163 PolarHBondContact NH1-OE2 2.8Å
164	R	90.1	Very high	92.5	Very high	113 Å²	113	62.3 Å²	62.3	43%	0.426	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-84.4	133.8	173.5	-173.2	179.4	-79.2	-104.5	6	109.5	L115 E155 S159 L162	L115-R164 CarbonylContact O-C 3.54Å; L115-R164 WeakPolarHBondContact O-CA 3.34Å; L115-R164 WeakPolarHBondContact O-CG 3.41Å; E155-R164 IonicContact OE1-CZ 3.82Å; E155-R164 IonicContact OE1-NH1 2.86Å; E155-R164 PolarHBondContact OE1-NH1 3.07Å; E155-R164 IonicContact OE1-NH2 3.97Å; E155-R164 PolarHBondContact OE1-NH2 3.27Å; S159-R164 PolarHBondContact OG-NH2 3.14Å; L162-R164 PolarHBondContact O-N 3.42Å
165	I	86.8	Confident	92.2	Very high	160 Å²	160	67.9 Å²	67.9	82%	0.821	32%	0.322	S	S	*	.			trans	-78.9	0	176	-54.1	174.8	0	0	0	110	L115 R117	L115-I165 PolarHBondContact O-N 2.91Å; R117-I165 HydrophobicContact CB-CD1 4.11Å; R117-I165 HydrophobicContact CB-CG1 3.78Å; R117-I165 HydrophobicContact CG-CG1 4.47Å

Retrieved 165 of 165 residues in 168.8 ms (Link to these results)

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