A0A087YPV5_POEFO Loading...

AlkB homolog 6

AlphaFold DB , UniProt , Accession A0A087YPV5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 271 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	35	Very low	29.8	Very low	245 Å²	245	152 Å²	152	100%	1.207	83%	0.829	S	S	*	*				0	101.6	0	-91	-173	-88.3	0	0	107.8
2	Y	25.8	Very low	29.6	Very low	234 Å²	234	147.9 Å²	147.9	92%	0.918	80%	0.802	S	S	*	*			trans	-113.4	134.9	166.7	-83	-83.8	0	0	0	106.9
3	P	31.5	Very low	29.8	Very low	117 Å²	117	149.4 Å²	149.4	76%	0.76	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-83	162	164.1	33.2	-28.1	0	0	0	110.9
4	P	30.8	Very low	30	Very low	125 Å²	125	141.4 Å²	141.4	81%	0.812	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-94.2	173.2	-159.8	36.7	-31.3	0	0	0	114.6
5	A	32.6	Very low	30.4	Very low	92 Å²	92	140.5 Å²	140.5	76%	0.76	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-53.9	154.1	-174.9	0	0	0	0	0	117.5
6	F	26	Very low	30.3	Very low	202 Å²	202	139.1 Å²	139.1	89%	0.886	74%	0.736	S	S	*	*			trans	-121.7	135.9	144.3	-84	-80	0	0	0	109.4
7	P	33.3	Very low	30.7	Very low	118 Å²	118	135.4 Å²	135.4	77%	0.766	72%	0.716	S	S	*	*			trans	-89.3	124.3	174.1	33.9	-27	0	0	0	109.2
8	T	30	Very low	30.5	Very low	123 Å²	123	131.2 Å²	131.2	76%	0.755	71%	0.711	S	S	*	*			trans	-122.1	90.6	161.1	45.3	0	0	0	0	108.6	H10	T8-H10 PolarHBondContact O-N 3.34Å; T8-H10 VanDerWaalsContact O-N 3.13Å
9	G	28.5	Very low	30.7	Very low	66 Å²	66	134.4 Å²	134.4	68%	0.68	72%	0.721	S	S	*	*			trans	-69.7	97.8	158.8	0	0	0	0	0	108.2
10	H	25.7	Very low	30.5	Very low	157 Å²	157	137.5 Å²	137.5	73%	0.727	73%	0.73	S	S	*	*			trans	-106.7	90.7	159.4	-90.1	40.3	0	0	0	106.8	T8 M12	T8-H10 PolarHBondContact O-N 3.34Å; T8-H10 VanDerWaalsContact O-N 3.13Å; H10-M12 PolarHBondContact O-N 3.38Å
11	F	28.9	Very low	30.3	Very low	193 Å²	193	139 Å²	139	85%	0.846	73%	0.733	S	S	*	*			trans	-96	85.2	162.9	-79.5	-78.8	0	0	0	107.4
12	M	26.7	Very low	30.1	Very low	103 Å²	103	136 Å²	136	51%	0.507	71%	0.713	S	S	.	*			trans	-93.3	109.3	176.8	-161.6	160.1	69.9	0	0	107	H10 L14	H10-M12 PolarHBondContact O-N 3.38Å; M12-L14 HydrophobicContact CE-CB 4.35Å; M12-L14 HydrophobicContact CE-CD1 4.04Å; M12-L14 HydrophobicContact CG-CB 3.93Å; M12-L14 HydrophobicContact CG-CD1 3.82Å; M12-L14 HydrophobicContact CG-CG 3.82Å; M12-L14 PolarHBondContact O-N 3.28Å; M12-L14 HydrophobicContact SD-CD1 3.74Å; M12-L14 HydrophobicContact SD-CG 4.41Å
13	W	32.4	Very low	30.3	Very low	167 Å²	167	128.7 Å²	128.7	63%	0.633	71%	0.71	S	S	*	*			trans	-77.7	47.9	165.2	-74.4	94.7	0	0	0	110.4
14	L	33.5	Very low	30.1	Very low	37 Å²	37	127.9 Å²	127.9	19%	0.194	71%	0.707	C	S	.	*	S	Bend	trans	-96.3	114.3	152.6	-69.3	174.4	0	0	0	103	M12 T16 T90 L97	M12-L14 HydrophobicContact CE-CB 4.35Å; M12-L14 HydrophobicContact CE-CD1 4.04Å; M12-L14 HydrophobicContact CG-CB 3.93Å; M12-L14 HydrophobicContact CG-CD1 3.82Å; M12-L14 HydrophobicContact CG-CG 3.82Å; M12-L14 PolarHBondContact O-N 3.28Å; M12-L14 HydrophobicContact SD-CD1 3.74Å; M12-L14 HydrophobicContact SD-CG 4.41Å; L14-T16 PolarHBondContact O-N 2.87Å; L14-T90 HydrophobicContact CD1-CG2 4.24Å; L14-L97 HydrophobicContact CD1-CD2 4.4Å; L14-L97 HydrophobicContact CD2-CD2 3.32Å
15	H	36	Very low	30.4	Very low	129 Å²	129	127.2 Å²	127.2	60%	0.597	70%	0.696	S	S	*	*			trans	-50.6	105.3	176.1	-77.4	27.4	0	0	0	108.3	D17	H15-D17 PolarHBondContact O-N 2.85Å
16	T	27.6	Very low	30.7	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.724	69%	0.685	S	S	*	*			trans	-74.2	115.4	165.1	47.2	0	0	0	0	105.1	L14 G18	L14-T16 PolarHBondContact O-N 2.87Å; T16-G18 PolarHBondContact O-N 2.92Å
17	D	38.1	Very low	31.3	Very low	75 Å²	75	123.1 Å²	123.1	40%	0.401	67%	0.67	S	S	.	*			trans	-55.9	106.5	172.9	-58.1	-54.1	0	0	0	108.3	H15 S93	H15-D17 PolarHBondContact O-N 2.85Å; D17-S93 VanDerWaalsContact OD2-CB 3.22Å; D17-S93 WeakPolarHBondContact OD2-CB 3.48Å; D17-S93 PolarHBondContact OD2-OG 3.33Å
18	G	26.9	Very low	31.6	Very low	61 Å²	61	122.5 Å²	122.5	63%	0.629	66%	0.66	S	S	*	*			trans	-141.4	114.9	-179.1	0	0	0	0	0	109	T16 H20	T16-G18 PolarHBondContact O-N 2.92Å; G18-H20 PolarHBondContact O-N 2.91Å; G18-H20 VanDerWaalsContact O-N 3.12Å
19	E	33.5	Very low	32.1	Very low	192 Å²	192	118.1 Å²	118.1	90%	0.897	63%	0.634	S	S	*	*			trans	-54.1	110.3	170.4	-66.4	-179.5	139.3	0	0	110.3
20	H	26.9	Very low	32.8	Very low	195 Å²	195	118.3 Å²	118.3	90%	0.903	62%	0.619	S	S	*	*			trans	-140.2	120	150.9	-90.2	-64.5	0	0	0	110.2	G18	G18-H20 PolarHBondContact O-N 2.91Å; G18-H20 VanDerWaalsContact O-N 3.12Å
21	Q	27.6	Very low	33.5	Very low	170 Å²	170	117.1 Å²	117.1	79%	0.794	61%	0.611	S	S	*	*			trans	-71.5	136.7	178.5	-86.9	-169	1.6	0	0	112.5
22	F	30.5	Very low	34.4	Very low	181 Å²	181	108.2 Å²	108.2	79%	0.794	57%	0.572	S	S	*	*			trans	49.9	125.9	147.4	-70.4	-80.9	0	0	0	120.9
23	G	29.4	Very low	35.6	Very low	82 Å²	82	106.9 Å²	106.9	85%	0.845	57%	0.566	S	S	*	*			trans	130.6	55.8	139.5	0	0	0	0	0	117.7
24	S	27.9	Very low	36.4	Very low	100 Å²	100	104.3 Å²	104.3	70%	0.699	56%	0.562	S	S	*	*			trans	-172.5	137.1	149.6	-174.8	0	0	0	0	106.3	D26	S24-D26 VanDerWaalsContact C-N 3.29Å; S24-D26 PolarHBondContact O-N 3.16Å
25	L	36.4	Very low	37.3	Very low	110 Å²	110	108.9 Å²	108.9	58%	0.576	58%	0.577	S	S	*	*			trans	-56.1	109.9	153.1	-84.3	155.7	0	0	0	104.3	I27 I30	L25-I27 PolarHBondContact O-N 3.31Å; L25-I27 VanDerWaalsContact O-N 3.13Å; L25-I30 HydrophobicContact CB-CD1 4.06Å; L25-I30 HydrophobicContact CB-CG1 4.33Å
26	D	40.1	Very low	38	Very low	99 Å²	99	103.7 Å²	103.7	53%	0.529	56%	0.555	S	S	.	*			trans	-58.3	123.3	-178.2	-153.4	-29.7	0	0	0	105.4	S24 N28 C29 I30	S24-D26 VanDerWaalsContact C-N 3.29Å; S24-D26 PolarHBondContact O-N 3.16Å; D26-N28 PolarHBondContact O-N 3.13Å; D26-N28 PolarHBondContact OD1-ND2 2.67Å; D26-N28 VanDerWaalsContact OD1-ND2 3.09Å; D26-C29 HydrophobicContact CB-CB 4.28Å; D26-C29 WeakPolarHBondContact O-CA 3.36Å; D26-C29 VanDerWaalsContact O-CB 3.23Å; D26-C29 WeakPolarHBondContact O-CB 3.27Å; D26-C29 PolarHBondContact O-N 2.85Å; D26-I30 PolarHBondContact O-N 3.21Å
27	I	37.3	Very low	38.9	Very low	110 Å²	110	101.7 Å²	101.7	56%	0.564	55%	0.55	S	S	*	*	H	α-helix	trans	-53.9	-29.8	-175.5	-71.1	168.1	0	0	0	109.7	L25 C29 I30 F31	L25-I27 PolarHBondContact O-N 3.31Å; L25-I27 VanDerWaalsContact O-N 3.13Å; I27-C29 VanDerWaalsContact C-N 3.35Å; I27-C29 PolarHBondContact O-N 3.31Å; I27-I30 PolarHBondContact O-N 3.4Å; I27-F31 HydrophobicContact CG2-CD2 3.57Å; I27-F31 HydrophobicContact CG2-CE2 3.38Å; I27-F31 WeakPolarHBondContact O-CD2 3.49Å; I27-F31 PolarHBondContact O-N 3.5Å; I27-F31 VanDerWaalsContact O-N 3.08Å
28	N	39.2	Very low	39	Very low	105 Å²	105	100.2 Å²	100.2	56%	0.561	55%	0.553	S	S	*	*	H	α-helix	trans	-61.6	-34.4	172.4	-61.3	-54.7	0	0	0	114.3	D26 F32	D26-N28 PolarHBondContact O-N 3.13Å; D26-N28 PolarHBondContact OD1-ND2 2.67Å; D26-N28 VanDerWaalsContact OD1-ND2 3.09Å; N28-F32 VanDerWaalsContact O-CB 3.24Å; N28-F32 WeakPolarHBondContact O-CB 3.43Å; N28-F32 PolarHBondContact O-N 2.9Å
29	C	40.7	Very low	39.6	Very low	30 Å²	30	105.4 Å²	105.4	20%	0.203	57%	0.566	C	S	.	*	H	α-helix	trans	-72.7	-40.4	178	-165.5	0	0	0	0	111	D26 I27 F32 I33	D26-C29 HydrophobicContact CB-CB 4.28Å; D26-C29 WeakPolarHBondContact O-CA 3.36Å; D26-C29 VanDerWaalsContact O-CB 3.23Å; D26-C29 WeakPolarHBondContact O-CB 3.27Å; D26-C29 PolarHBondContact O-N 2.85Å; I27-C29 VanDerWaalsContact C-N 3.35Å; I27-C29 PolarHBondContact O-N 3.31Å; C29-F32 PolarHBondContact O-N 2.8Å; C29-I33 VanDerWaalsContact O-CG1 3.32Å; C29-I33 WeakPolarHBondContact O-CG1 3.32Å; C29-I33 PolarHBondContact O-N 2.89Å
30	I	43.5	Very low	40.2	Very low	71 Å²	71	99.7 Å²	99.7	36%	0.364	54%	0.54	S	S	.	.	H	α-helix	trans	-63.3	-48.5	174	-62	176.3	0	0	0	110.5	L25 D26 I27 F32 I33 E34	L25-I30 HydrophobicContact CB-CD1 4.06Å; L25-I30 HydrophobicContact CB-CG1 4.33Å; D26-I30 PolarHBondContact O-N 3.21Å; I27-I30 PolarHBondContact O-N 3.4Å; I30-F32 VanDerWaalsContact C-N 3.26Å; I30-F32 PolarHBondContact O-N 2.94Å; I30-I33 PolarHBondContact O-N 3.4Å; I30-E34 WeakPolarHBondContact O-CG 3.3Å; I30-E34 PolarHBondContact O-N 2.83Å
31	F	41.3	Very low	40.8	Very low	131 Å²	131	99.1 Å²	99.1	58%	0.575	54%	0.538	S	S	*	.	H	α-helix	trans	-63.2	-31.1	176.4	-80.8	-64.2	0	0	0	113.1	I27 Y35	I27-F31 HydrophobicContact CG2-CD2 3.57Å; I27-F31 HydrophobicContact CG2-CE2 3.38Å; I27-F31 WeakPolarHBondContact O-CD2 3.49Å; I27-F31 PolarHBondContact O-N 3.5Å; I27-F31 VanDerWaalsContact O-N 3.08Å; F31-Y35 WeakPolarHBondContact O-CB 3.39Å; F31-Y35 PolarHBondContact O-N 2.87Å
32	F	47.9	Very low	41.6	Very low	6 Å²	6	101.1 Å²	101.1	3%	0.026	54%	0.538	C	S	.	.	H	α-helix	trans	-71.3	-43.1	176.2	179.7	-120.7	0	0	0	112	N28 C29 I30 Y35 C36 P157 Y212 C213	N28-F32 VanDerWaalsContact O-CB 3.24Å; N28-F32 WeakPolarHBondContact O-CB 3.43Å; N28-F32 PolarHBondContact O-N 2.9Å; C29-F32 PolarHBondContact O-N 2.8Å; I30-F32 VanDerWaalsContact C-N 3.26Å; I30-F32 PolarHBondContact O-N 2.94Å; F32-Y35 PolarHBondContact O-N 2.91Å; F32-C36 PolarHBondContact O-N 3.42Å; F32-C36 PolarHBondContact O-SG 3.13Å; F32-C36 VanDerWaalsContact O-SG 3.4Å; F32-P157 HydrophobicContact CD2-CB 3.53Å; F32-P157 HydrophobicContact CE2-CB 4.06Å; F32-P157 HydrophobicContact CG-CB 4.29Å; F32-Y212 AromaticContact CE2-CE1 3.97Å; F32-Y212 HydrophobicContact CE2-CE1 3.97Å; F32-Y212 HydrophobicContact CZ-CD1 4.2Å; F32-Y212 AromaticContact CZ-CE1 3.51Å; F32-Y212 HydrophobicContact CZ-CE1 3.51Å; F32-Y212 AromaticContact CZ-CZ 3.97Å; F32-C213 HydrophobicContact CE1-CB 4.41Å
33	I	51	Low	42.2	Very low	75 Å²	75	95.1 Å²	95.1	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-44.3	173.7	-66.8	167	0	0	0	110.2	C29 I30 C36 A37	C29-I33 VanDerWaalsContact O-CG1 3.32Å; C29-I33 WeakPolarHBondContact O-CG1 3.32Å; C29-I33 PolarHBondContact O-N 2.89Å; I30-I33 PolarHBondContact O-N 3.4Å; I33-C36 CarbonylContact O-C 3.57Å; I33-C36 PolarHBondContact O-N 3.3Å; I33-A37 VanDerWaalsContact O-CB 3.27Å; I33-A37 WeakPolarHBondContact O-CB 3.08Å; I33-A37 PolarHBondContact O-N 3.37Å
34	E	48.3	Very low	43	Very low	114 Å²	114	97.4 Å²	97.4	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-38.1	175.4	-73.3	-178.4	168.9	0	0	112.8	I30 C36 A37 G38	I30-E34 WeakPolarHBondContact O-CG 3.3Å; I30-E34 PolarHBondContact O-N 2.83Å; E34-C36 VanDerWaalsContact C-N 3.29Å; E34-C36 PolarHBondContact O-N 3.44Å; E34-A37 PolarHBondContact O-N 2.69Å; E34-A37 VanDerWaalsContact O-N 3.13Å; E34-G38 PolarHBondContact O-N 3.38Å
35	Y	52.7	Low	43.8	Very low	133 Å²	133	95.1 Å²	95.1	52%	0.522	50%	0.504	S	S	.	.	H	α-helix	trans	-62	-36.7	173.4	178.5	-101.5	0	0	0	112.1	F31 F32	F31-Y35 WeakPolarHBondContact O-CB 3.39Å; F31-Y35 PolarHBondContact O-N 2.87Å; F32-Y35 PolarHBondContact O-N 2.91Å
36	C	51.2	Low	44.8	Very low	20 Å²	20	91.8 Å²	91.8	14%	0.135	49%	0.488	C	S	.	.	H	α-helix	trans	-76.2	-25.3	172.4	-67.1	0	0	0	0	113.7	F32 I33 E34 M40 C213	F32-C36 PolarHBondContact O-N 3.42Å; F32-C36 PolarHBondContact O-SG 3.13Å; F32-C36 VanDerWaalsContact O-SG 3.4Å; I33-C36 CarbonylContact O-C 3.57Å; I33-C36 PolarHBondContact O-N 3.3Å; E34-C36 VanDerWaalsContact C-N 3.29Å; E34-C36 PolarHBondContact O-N 3.44Å; C36-M40 VanDerWaalsContact O-CE 3.29Å; C36-M40 WeakPolarHBondContact O-CE 3.26Å; C36-C213 HydrophobicContact CB-CB 3.62Å; C36-C213 WeakPolarHBondContact CB-SG 3.43Å; C36-C213 WeakPolarHBondContact SG-CB 3.29Å; C36-C213 CovalentContact SG-SG 2.04Å; C36-C213 PolarHBondContact SG-SG 3.33Å
37	A	46.9	Very low	45.6	Very low	75 Å²	75	89.7 Å²	89.7	62%	0.62	48%	0.479	S	S	*	.	H	α-helix	trans	-90.7	-21.4	-176.6	0	0	0	0	0	114.2	I33 E34	I33-A37 VanDerWaalsContact O-CB 3.27Å; I33-A37 WeakPolarHBondContact O-CB 3.08Å; I33-A37 PolarHBondContact O-N 3.37Å; E34-A37 PolarHBondContact O-N 2.69Å; E34-A37 VanDerWaalsContact O-N 3.13Å
38	G	39.8	Very low	46.6	Very low	44 Å²	44	87 Å²	87	45%	0.454	48%	0.478	S	S	.	.	S	Bend	trans	-63.6	136.7	170.8	0	0	0	0	0	110.1	E34 M40	E34-G38 PolarHBondContact O-N 3.38Å; G38-M40 VanDerWaalsContact C-N 3.27Å; G38-M40 PolarHBondContact O-N 3.28Å
39	D	40	Very low	48.2	Very low	170 Å²	170	87.2 Å²	87.2	91%	0.909	48%	0.479	S	S	*	.			trans	-42.2	84.2	-173.5	-72.7	-40	0	0	0	113	E41	D39-E41 PolarHBondContact O-N 2.91Å; D39-E41 VanDerWaalsContact O-N 3.07Å
40	M	46.1	Very low	50.3	Low	72 Å²	72	85.9 Å²	85.9	36%	0.355	47%	0.47	S	S	.	.			trans	-70.9	102.8	163	-81	-165.4	-76.2	0	0	104.4	C36 G38 R42 P161	C36-M40 VanDerWaalsContact O-CE 3.29Å; C36-M40 WeakPolarHBondContact O-CE 3.26Å; G38-M40 VanDerWaalsContact C-N 3.27Å; G38-M40 PolarHBondContact O-N 3.28Å; M40-R42 VanDerWaalsContact C-N 3.29Å; M40-R42 PolarHBondContact O-N 3.49Å; M40-P161 HydrophobicContact CE-CB 4.35Å; M40-P161 HydrophobicContact CE-CG 3.99Å; M40-P161 HydrophobicContact SD-CB 4.27Å; M40-P161 HydrophobicContact SD-CG 3.3Å; M40-P161 WeakPolarHBondContact SD-CG 3.44Å
41	E	39.1	Very low	52.2	Low	184 Å²	184	90.2 Å²	90.2	86%	0.86	49%	0.487	S	S	*	.			trans	-47.4	104.4	160	-74.8	-170.5	159.4	0	0	106.7	D39 P43	D39-E41 PolarHBondContact O-N 2.91Å; D39-E41 VanDerWaalsContact O-N 3.07Å; E41-P43 WeakPolarHBondContact O-CD 3.27Å
42	R	44.3	Very low	54.4	Low	211 Å²	211	90.7 Å²	90.7	80%	0.796	49%	0.49	S	S	*	.			trans	-53.6	113.2	176.5	-79.4	-178.7	175.6	171.1	-1.3	105.6	M40 S44	M40-R42 VanDerWaalsContact C-N 3.29Å; M40-R42 PolarHBondContact O-N 3.49Å; R42-S44 PolarHBondContact O-N 2.91Å
43	P	43.7	Very low	56.5	Low	55 Å²	55	93.2 Å²	93.2	36%	0.357	50%	0.501	S	S	.	.			trans	-60.9	116.5	180	12.1	-14.5	0	0	0	106.7	E41 C45	E41-P43 WeakPolarHBondContact O-CD 3.27Å; P43-C45 PolarHBondContact O-N 3.4Å
44	S	45.3	Very low	58.5	Low	130 Å²	130	91.2 Å²	91.2	91%	0.909	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	10.3	178.6	56.4	0	0	0	0	113.3	R42	R42-S44 PolarHBondContact O-N 2.91Å
45	C	45.7	Very low	60.6	Low	53 Å²	53	86.1 Å²	86.1	36%	0.358	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	7.2	-170.6	72.4	0	0	0	0	114.7	P43 V47	P43-C45 PolarHBondContact O-N 3.4Å; C45-V47 PolarHBondContact O-N 3.48Å
46	V	55.8	Low	62.3	Low	40 Å²	40	85.6 Å²	85.6	24%	0.242	48%	0.476	C	S	.	.	S	Bend	trans	-55.8	110.8	160.1	177.3	0	0	0	0	105.8	G48 L50	V46-G48 PolarHBondContact O-N 3.15Å; V46-L50 HydrophobicContact CG1-CB 3.71Å; V46-L50 HydrophobicContact CG1-CD1 3.57Å; V46-L50 HydrophobicContact CG1-CG 4.23Å
47	V	57.7	Low	64	Low	55 Å²	55	91 Å²	91	33%	0.333	50%	0.499	S	S	.	.			trans	-52.4	133.6	-175.3	179	0	0	0	0	107.4	C45 D49 L50 L128	C45-V47 PolarHBondContact O-N 3.48Å; V47-D49 HydrophobicContact CG1-CB 4.04Å; V47-D49 PolarHBondContact O-N 3.4Å; V47-L50 PolarHBondContact O-N 2.94Å; V47-L128 PolarHBondContact N-O 2.83Å
48	G	59.2	Low	65.9	Low	53 Å²	53	88 Å²	88	55%	0.546	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-49.7	-25.6	-175.3	0	0	0	0	0	113.6	V46 L50 K51	V46-G48 PolarHBondContact O-N 3.15Å; G48-L50 VanDerWaalsContact C-N 3.31Å; G48-L50 PolarHBondContact O-N 3.31Å; G48-K51 WeakPolarHBondContact O-CB 3.49Å; G48-K51 PolarHBondContact O-N 3.08Å
49	D	71.9	Confident	67.8	Low	109 Å²	109	88.2 Å²	88.2	58%	0.583	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-65.7	-21.7	177	-58.8	-20.2	0	0	0	114.7	V47 K51 Q52 F53	V47-D49 HydrophobicContact CG1-CB 4.04Å; V47-D49 PolarHBondContact O-N 3.4Å; D49-K51 VanDerWaalsContact C-N 3.3Å; D49-K51 PolarHBondContact O-N 2.98Å; D49-Q52 VanDerWaalsContact O-CG 3.27Å; D49-Q52 WeakPolarHBondContact O-CG 3.32Å; D49-Q52 PolarHBondContact O-NE2 3.45Å; D49-F53 WeakPolarHBondContact O-CD2 3.38Å; D49-F53 WeakPolarHBondContact O-CE2 3.27Å
50	L	83.9	Confident	69.4	Low	3 Å²	3	88 Å²	88	2%	0.016	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-73.6	-23.2	177	-78.1	174.4	0	0	0	112.9	V46 V47 G48 Q52 F53 F63 I65 L128 V130	V46-L50 HydrophobicContact CG1-CB 3.71Å; V46-L50 HydrophobicContact CG1-CD1 3.57Å; V46-L50 HydrophobicContact CG1-CG 4.23Å; V47-L50 PolarHBondContact O-N 2.94Å; G48-L50 VanDerWaalsContact C-N 3.31Å; G48-L50 PolarHBondContact O-N 3.31Å; L50-Q52 PolarHBondContact O-N 3.23Å; L50-Q52 VanDerWaalsContact O-N 3.15Å; L50-F53 HydrophobicContact CD2-CD2 4.41Å; L50-F53 PolarHBondContact O-N 2.85Å; L50-F63 HydrophobicContact CB-CD1 4.19Å; L50-F63 HydrophobicContact CB-CE1 4.29Å; L50-F63 VanDerWaalsContact O-CD1 3.27Å; L50-F63 WeakPolarHBondContact O-CD1 3.44Å; L50-I65 HydrophobicContact CD2-CD1 3.47Å; L50-I65 VanDerWaalsContact CD2-CD1 3.47Å; L50-I65 HydrophobicContact CD2-CG1 4.31Å; L50-L128 HydrophobicContact CD1-CB 3.96Å; L50-L128 HydrophobicContact CD2-CD1 4.4Å; L50-V130 HydrophobicContact CD1-CG1 3.53Å
51	K	84	Confident	71.3	Confident	162 Å²	162	85.2 Å²	85.2	70%	0.704	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-60.5	-27.9	-178.8	-67.2	-177	178.3	179.4	0	113	G48 D49 F53 V54	G48-K51 WeakPolarHBondContact O-CB 3.49Å; G48-K51 PolarHBondContact O-N 3.08Å; D49-K51 VanDerWaalsContact C-N 3.3Å; D49-K51 PolarHBondContact O-N 2.98Å; K51-F53 PolarHBondContact O-N 2.95Å; K51-V54 WeakPolarHBondContact O-CG2 3.36Å
52	Q	88.3	Confident	73.8	Confident	140 Å²	140	76.4 Å²	76.4	65%	0.654	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-73.9	-14.3	177.3	79.7	-163.2	-44.2	0	0	113.3	D49 L50	D49-Q52 VanDerWaalsContact O-CG 3.27Å; D49-Q52 WeakPolarHBondContact O-CG 3.32Å; D49-Q52 PolarHBondContact O-NE2 3.45Å; L50-Q52 PolarHBondContact O-N 3.23Å; L50-Q52 VanDerWaalsContact O-N 3.15Å
53	F	92.3	Very high	76.3	Confident	59 Å²	59	67.1 Å²	67.1	26%	0.259	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-103.6	8.4	-177.2	-61.9	-67.4	0	0	0	113.2	D49 L50 K51 V55 F63 Y64 I65	D49-F53 WeakPolarHBondContact O-CD2 3.38Å; D49-F53 WeakPolarHBondContact O-CE2 3.27Å; L50-F53 HydrophobicContact CD2-CD2 4.41Å; L50-F53 PolarHBondContact O-N 2.85Å; K51-F53 PolarHBondContact O-N 2.95Å; F53-V55 PolarHBondContact O-N 2.6Å; F53-F63 CarbonylContact O-C 3.59Å; F53-F63 VanDerWaalsContact O-CA 3.31Å; F53-F63 WeakPolarHBondContact O-CA 3.45Å; F53-Y64 PolarHBondContact O-N 2.97Å; F53-I65 HydrophobicContact CB-CG1 4.03Å; F53-I65 HydrophobicContact CD1-CB 4.3Å; F53-I65 HydrophobicContact CD1-CG1 4.23Å; F53-I65 HydrophobicContact CD1-CG2 4.14Å; F53-I65 HydrophobicContact CD2-CD1 4.3Å; F53-I65 HydrophobicContact CD2-CG1 3.98Å; F53-I65 HydrophobicContact CD2-CG2 4.42Å; F53-I65 HydrophobicContact CE1-CG2 3.88Å; F53-I65 HydrophobicContact CE2-CG2 4.18Å; F53-I65 HydrophobicContact CG-CB 4.4Å; F53-I65 HydrophobicContact CG-CG1 3.82Å; F53-I65 HydrophobicContact CG-CG2 4.41Å; F53-I65 HydrophobicContact CZ-CG2 3.91Å
54	V	92.6	Very high	78.8	Confident	34 Å²	34	64.6 Å²	64.6	21%	0.206	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-62	131.8	175.8	174.9	0	0	0	0	109.9	K51 N56 F63	K51-V54 WeakPolarHBondContact O-CG2 3.36Å; V54-N56 PolarHBondContact O-N 3.36Å; V54-F63 HydrophobicContact CG2-CD1 3.74Å; V54-F63 HydrophobicContact CG2-CE1 3.41Å; V54-F63 VanDerWaalsContact CG2-CE1 3.41Å; V54-F63 HydrophobicContact CG2-CZ 4.36Å
55	V	92.8	Very high	81.3	Confident	6 Å²	6	59 Å²	59	4%	0.036	32%	0.316	C	S	.	.			trans	-85.3	97.1	170.5	-175.9	0	0	0	0	108.1	F53 E57 A58 A62 L197 A232 N233	F53-V55 PolarHBondContact O-N 2.6Å; V55-E57 PolarHBondContact O-N 3.05Å; V55-A58 HydrophobicContact CB-CB 4.12Å; V55-A58 HydrophobicContact CG1-CB 3.88Å; V55-A58 PolarHBondContact O-N 3.14Å; V55-A62 HydrophobicContact CB-CB 4.49Å; V55-A62 PolarHBondContact N-O 2.81Å; V55-L197 HydrophobicContact CG1-CD2 4.05Å; V55-A232 HydrophobicContact CG1-CB 3.78Å; V55-N233 HydrophobicContact CG1-CB 3.96Å; V55-N233 HydrophobicContact CG2-CB 4Å
56	N	88.4	Confident	83.8	Confident	122 Å²	122	58.7 Å²	58.7	65%	0.652	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.8	-172	-64.5	-62.8	0	0	0	113.6	V54 A58	V54-N56 PolarHBondContact O-N 3.36Å; N56-A58 VanDerWaalsContact C-N 3.25Å
57	E	86.9	Confident	85.7	Confident	135 Å²	135	62 Å²	62	63%	0.631	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.6	178.3	-61.3	76.3	-170.4	0	0	112.6	V55 A232	V55-E57 PolarHBondContact O-N 3.05Å; E57-A232 HydrophobicContact CB-CB 3.84Å
58	A	85.8	Confident	87.7	Confident	10 Å²	10	60.7 Å²	60.7	8%	0.083	32%	0.319	C	S	.	.	S	Bend	trans	-111.6	167.9	170.1	0	0	0	0	0	109.8	V55 N56 A62 L195 A232	V55-A58 HydrophobicContact CB-CB 4.12Å; V55-A58 HydrophobicContact CG1-CB 3.88Å; V55-A58 PolarHBondContact O-N 3.14Å; N56-A58 VanDerWaalsContact C-N 3.25Å; A58-A62 HydrophobicContact CB-CB 4.21Å; A58-L195 HydrophobicContact CB-CD2 3.89Å; A58-A232 HydrophobicContact CB-CB 4.41Å
59	P	80.4	Confident	89.5	Confident	50 Å²	50	58.4 Å²	58.4	33%	0.325	29%	0.294	S	S	.	.			trans	-48.3	143.4	165.9	-27	34.6	0	0	0	111.4	T61 A62 M211	P59-T61 PolarHBondContact O-N 2.98Å; P59-A62 PolarHBondContact O-N 2.88Å; P59-M211 HydrophobicContact CB-CG 3.99Å; P59-M211 HydrophobicContact CB-SD 4.08Å; P59-M211 VanDerWaalsContact CD-SD 3.55Å; P59-M211 HydrophobicContact CG-CG 4.21Å; P59-M211 HydrophobicContact CG-SD 3.62Å
60	Q	74.2	Confident	90.8	Very high	164 Å²	164	55.3 Å²	55.3	77%	0.766	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	38.2	-171.4	-69.8	-168.1	-11.9	0	0	115.1
61	T	84.3	Confident	91.5	Very high	14 Å²	14	60.7 Å²	60.7	9%	0.086	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.9	15.4	-172.7	69.1	0	0	0	0	110.7	P59 Q208 D209 M211	P59-T61 PolarHBondContact O-N 2.98Å; T61-Q208 WeakPolarHBondContact CB-O 3.2Å; T61-Q208 PolarHBondContact O-N 2.89Å; T61-Q208 PolarHBondContact OG1-O 2.82Å; T61-D209 HydrophobicContact CG2-CB 3.8Å; T61-D209 WeakPolarHBondContact CG2-OD2 3.49Å; T61-M211 WeakPolarHBondContact OG1-CG 3.45Å
62	A	92.9	Very high	92.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.4	169.2	0	0	0	0	0	110.2	V55 A58 P59 V206 L207 M211	V55-A62 HydrophobicContact CB-CB 4.49Å; V55-A62 PolarHBondContact N-O 2.81Å; A58-A62 HydrophobicContact CB-CB 4.21Å; P59-A62 PolarHBondContact O-N 2.88Å; A62-V206 WeakPolarHBondContact CA-O 3.3Å; A62-L207 HydrophobicContact CB-CD2 3.87Å; A62-M211 HydrophobicContact CB-CE 4.23Å; A62-M211 HydrophobicContact CB-CG 4.26Å
63	F	95.4	Very high	92.7	Very high	16 Å²	16	56.3 Å²	56.3	7%	0.07	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.8	176.4	-52.6	-94.1	0	0	0	109.8	L50 F53 V54 L205 V206	L50-F63 HydrophobicContact CB-CD1 4.19Å; L50-F63 HydrophobicContact CB-CE1 4.29Å; L50-F63 VanDerWaalsContact O-CD1 3.27Å; L50-F63 WeakPolarHBondContact O-CD1 3.44Å; F53-F63 CarbonylContact O-C 3.59Å; F53-F63 VanDerWaalsContact O-CA 3.31Å; F53-F63 WeakPolarHBondContact O-CA 3.45Å; V54-F63 HydrophobicContact CG2-CD1 3.74Å; V54-F63 HydrophobicContact CG2-CE1 3.41Å; V54-F63 VanDerWaalsContact CG2-CE1 3.41Å; V54-F63 HydrophobicContact CG2-CZ 4.36Å; F63-L205 WeakPolarHBondContact O-CA 3.29Å; F63-V206 HydrophobicContact CB-CB 4.23Å; F63-V206 HydrophobicContact CD2-CB 4.25Å; F63-V206 HydrophobicContact CD2-CG1 4.38Å; F63-V206 PolarHBondContact N-O 2.86Å; F63-V206 PolarHBondContact O-N 3.14Å
64	Y	97.4	Very high	93	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.008	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114.6	178.2	179	-99.2	0	0	0	110.3	F53 P66 L198 L199 R200 S203 N233 A236 A237	F53-Y64 PolarHBondContact O-N 2.97Å; Y64-P66 HydrophobicContact CE1-CB 4.13Å; Y64-L198 WeakPolarHBondContact CE2-O 3.44Å; Y64-L199 HydrophobicContact CD2-CD2 4.38Å; Y64-L199 HydrophobicContact CE2-CD2 4.34Å; Y64-R200 WeakPolarHBondContact OH-CB 3.45Å; Y64-R200 PolarHBondContact OH-N 3.48Å; Y64-S203 WeakPolarHBondContact CE2-OG 3.18Å; Y64-S203 WeakPolarHBondContact OH-CB 3.47Å; Y64-S203 PolarHBondContact OH-OG 2.85Å; Y64-N233 WeakPolarHBondContact CD2-ND2 3.28Å; Y64-A236 HydrophobicContact CD1-CB 3.9Å; Y64-A236 HydrophobicContact CE1-CB 4.41Å; Y64-A237 HydrophobicContact CE1-CB 3.96Å
65	I	97.6	Very high	93.3	Very high	13 Å²	13	56.3 Å²	56.3	7%	0.067	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	105.3	-179.2	-44.5	179.9	0	0	0	108.1	L50 F53 F68 L128 S203 L204	L50-I65 HydrophobicContact CD2-CD1 3.47Å; L50-I65 VanDerWaalsContact CD2-CD1 3.47Å; L50-I65 HydrophobicContact CD2-CG1 4.31Å; F53-I65 HydrophobicContact CB-CG1 4.03Å; F53-I65 HydrophobicContact CD1-CB 4.3Å; F53-I65 HydrophobicContact CD1-CG1 4.23Å; F53-I65 HydrophobicContact CD1-CG2 4.14Å; F53-I65 HydrophobicContact CD2-CD1 4.3Å; F53-I65 HydrophobicContact CD2-CG1 3.98Å; F53-I65 HydrophobicContact CD2-CG2 4.42Å; F53-I65 HydrophobicContact CE1-CG2 3.88Å; F53-I65 HydrophobicContact CE2-CG2 4.18Å; F53-I65 HydrophobicContact CG-CB 4.4Å; F53-I65 HydrophobicContact CG-CG1 3.82Å; F53-I65 HydrophobicContact CG-CG2 4.41Å; F53-I65 HydrophobicContact CZ-CG2 3.91Å; I65-F68 HydrophobicContact CB-CB 4.41Å; I65-F68 HydrophobicContact CD1-CD2 4.27Å; I65-F68 HydrophobicContact CG2-CB 4.22Å; I65-F68 HydrophobicContact CG2-CD2 4.22Å; I65-L128 HydrophobicContact CD1-CD1 4.27Å; I65-S203 CarbonylContact O-C 3.58Å; I65-S203 WeakPolarHBondContact O-CA 3.47Å; I65-S203 VanDerWaalsContact O-CB 3.29Å; I65-S203 WeakPolarHBondContact O-CB 3.48Å; I65-L204 HydrophobicContact CB-CB 4.22Å; I65-L204 HydrophobicContact CD1-CB 4.42Å; I65-L204 HydrophobicContact CD1-CD2 3.82Å; I65-L204 HydrophobicContact CG1-CB 4.5Å; I65-L204 PolarHBondContact N-O 2.74Å; I65-L204 PolarHBondContact O-N 3.12Å
66	P	97.6	Very high	93.5	Very high	45 Å²	45	60.6 Å²	60.6	29%	0.292	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	153.3	171.3	30.5	-34	0	0	0	110.3	Y64 F68	Y64-P66 HydrophobicContact CE1-CB 4.13Å; P66-F68 PolarHBondContact O-N 3.41Å
67	D	96.7	Very high	94	Very high	109 Å²	109	55.1 Å²	55.1	58%	0.583	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	38.9	175.1	-56.9	-54.6	0	0	0	114.3	I69 R202	D67-I69 PolarHBondContact O-N 3.36Å; D67-R202 IonicContact OD1-NE 2.83Å; D67-R202 IonicContact OD1-NH2 3.35Å
68	F	98.1	Very high	94.6	Very high	28 Å²	28	50.5 Å²	50.5	12%	0.123	26%	0.263	C	S	.	.			trans	-64.8	-29.1	179.2	177.1	-108.7	0	0	0	112.8	I65 P66 K124 V125 L128 I166 R202 L204	I65-F68 HydrophobicContact CB-CB 4.41Å; I65-F68 HydrophobicContact CD1-CD2 4.27Å; I65-F68 HydrophobicContact CG2-CB 4.22Å; I65-F68 HydrophobicContact CG2-CD2 4.22Å; P66-F68 PolarHBondContact O-N 3.41Å; F68-K124 HydrophobicContact CE1-CD 4.1Å; F68-K124 HydrophobicContact CE1-CG 4.26Å; F68-K124 HydrophobicContact CZ-CD 4.06Å; F68-K124 HydrophobicContact CZ-CG 3.8Å; F68-K124 PolarHBondContact O-NZ 3.26Å; F68-K124 VanDerWaalsContact O-NZ 3.14Å; F68-V125 HydrophobicContact CE1-CG2 4.01Å; F68-V125 HydrophobicContact CZ-CG2 4.14Å; F68-L128 HydrophobicContact CE2-CD1 3.94Å; F68-L128 HydrophobicContact CZ-CD1 4.19Å; F68-I166 HydrophobicContact CD1-CD1 4.25Å; F68-I166 HydrophobicContact CD1-CG1 4.19Å; F68-I166 HydrophobicContact CE1-CD1 3.94Å; F68-I166 HydrophobicContact CE1-CG1 4.2Å; F68-R202 WeakPolarHBondContact CB-O 3.4Å; F68-R202 PolarHBondContact N-O 3.2Å; F68-L204 HydrophobicContact CB-CB 3.74Å; F68-L204 HydrophobicContact CD1-CB 3.67Å; F68-L204 HydrophobicContact CD1-CD1 4.39Å; F68-L204 HydrophobicContact CD1-CD2 4.25Å; F68-L204 HydrophobicContact CD1-CG 4.33Å; F68-L204 HydrophobicContact CD2-CB 4.09Å; F68-L204 HydrophobicContact CD2-CD2 4.09Å; F68-L204 HydrophobicContact CE1-CB 4.29Å; F68-L204 HydrophobicContact CE1-CD1 4.33Å; F68-L204 HydrophobicContact CE1-CD2 4.06Å; F68-L204 HydrophobicContact CE1-CG 4.47Å; F68-L204 HydrophobicContact CE2-CD2 3.9Å; F68-L204 HydrophobicContact CG-CB 3.55Å; F68-L204 HydrophobicContact CG-CD2 4.26Å; F68-L204 HydrophobicContact CG-CG 4.45Å; F68-L204 HydrophobicContact CZ-CD2 3.87Å
69	I	98.4	Very high	95.2	Very high	6 Å²	6	55.8 Å²	55.8	3%	0.031	29%	0.286	C	S	.	.	S	Bend	trans	-119.5	155.6	169.9	62	165.6	0	0	0	110.4	D67 E73 E74 L77 I166 L168 R202	D67-I69 PolarHBondContact O-N 3.36Å; I69-E73 WeakPolarHBondContact CA-OE2 3.18Å; I69-E73 HydrophobicContact CB-CB 3.91Å; I69-E73 VanDerWaalsContact CB-OE2 3.26Å; I69-E73 WeakPolarHBondContact CB-OE2 3.41Å; I69-E73 HydrophobicContact CD1-CB 4.5Å; I69-E74 HydrophobicContact CD1-CB 3.9Å; I69-L77 HydrophobicContact CD1-CD1 3.88Å; I69-I166 HydrophobicContact CD1-CG2 3.92Å; I69-I166 HydrophobicContact CG1-CG2 4.37Å; I69-I166 HydrophobicContact CG2-CG2 4.37Å; I69-L168 HydrophobicContact CD1-CD2 3.32Å; I69-R202 HydrophobicContact CD1-CG 4.38Å; I69-R202 HydrophobicContact CG1-CB 3.73Å; I69-R202 HydrophobicContact CG1-CG 3.93Å; I69-R202 PolarHBondContact N-O 3.41Å; I69-R202 WeakPolarHBondContact O-CB 3.42Å; I69-R202 WeakPolarHBondContact O-CD 3.49Å
70	S	98.4	Very high	96.1	Very high	43 Å²	43	55.3 Å²	55.3	30%	0.301	28%	0.28	S	S	.	.			trans	-75.8	169.1	174.3	88.4	0	0	0	0	112.3	E72 E73 E74	S70-E72 VanDerWaalsContact C-N 3.29Å; S70-E72 VanDerWaalsContact CB-OE2 3.27Å; S70-E72 WeakPolarHBondContact CB-OE2 3.41Å; S70-E72 PolarHBondContact O-N 2.88Å; S70-E72 PolarHBondContact OG-N 3.38Å; S70-E72 PolarHBondContact OG-OE2 2.95Å; S70-E73 PolarHBondContact N-OE2 3.31Å; S70-E73 PolarHBondContact O-N 2.95Å; S70-E73 PolarHBondContact OG-N 2.82Å; S70-E73 VanDerWaalsContact OG-N 3.13Å; S70-E74 PolarHBondContact O-N 2.93Å
71	E	98.5	Very high	97.2	Very high	117 Å²	117	47.5 Å²	47.5	55%	0.547	24%	0.243	S	C	.	.	H	α-helix	trans	-65.3	-33.4	174.5	-63.6	-172.1	170.8	0	0	112.1	S75 R202	E71-S75 WeakPolarHBondContact O-CB 3.44Å; E71-S75 PolarHBondContact O-N 3.15Å; E71-S75 PolarHBondContact O-OG 2.96Å; E71-R202 IonicContact OE1-CZ 3.52Å; E71-R202 IonicContact OE1-NH2 3.86Å
72	E	98.6	Very high	97.9	Very high	136 Å²	136	51.8 Å²	51.8	64%	0.636	26%	0.258	S	S	*	.	H	α-helix	trans	-69	-43.5	174.4	-57.5	75.1	-163.6	0	0	111.2	S70 E74 S75 F76	S70-E72 VanDerWaalsContact C-N 3.29Å; S70-E72 VanDerWaalsContact CB-OE2 3.27Å; S70-E72 WeakPolarHBondContact CB-OE2 3.41Å; S70-E72 PolarHBondContact O-N 2.88Å; S70-E72 PolarHBondContact OG-N 3.38Å; S70-E72 PolarHBondContact OG-OE2 2.95Å; E72-E74 VanDerWaalsContact C-N 3.35Å; E72-S75 PolarHBondContact O-N 3.23Å; E72-F76 WeakPolarHBondContact O-CB 3.43Å; E72-F76 PolarHBondContact O-N 3.24Å
73	E	98.6	Very high	98.1	Very high	73 Å²	73	59.2 Å²	59.2	34%	0.341	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-45.4	173.7	-74	179.9	127.9	0	0	110.5	I69 S70 F76 L77 K124	I69-E73 WeakPolarHBondContact CA-OE2 3.18Å; I69-E73 HydrophobicContact CB-CB 3.91Å; I69-E73 VanDerWaalsContact CB-OE2 3.26Å; I69-E73 WeakPolarHBondContact CB-OE2 3.41Å; I69-E73 HydrophobicContact CD1-CB 4.5Å; S70-E73 PolarHBondContact N-OE2 3.31Å; S70-E73 PolarHBondContact O-N 2.95Å; S70-E73 PolarHBondContact OG-N 2.82Å; S70-E73 VanDerWaalsContact OG-N 3.13Å; E73-F76 PolarHBondContact O-N 2.94Å; E73-L77 WeakPolarHBondContact O-CB 3.17Å; E73-L77 WeakPolarHBondContact O-CG 3.41Å; E73-L77 PolarHBondContact O-N 3.04Å; E73-K124 VanDerWaalsContact CD-NZ 3.28Å; E73-K124 IonicContact OE1-NZ 2.89Å; E73-K124 PolarHBondContact OE1-NZ 3.39Å; E73-K124 IonicContact OE2-NZ 3.81Å; E73-K124 PolarHBondContact OE2-NZ 2.89Å
74	E	98.8	Very high	98.1	Very high	17 Å²	17	59.2 Å²	59.2	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-47.9	176.1	172.6	169.1	-130.8	0	0	112.1	I69 S70 E72 F76 L77 L78 L168 G169 P201 R202	I69-E74 HydrophobicContact CD1-CB 3.9Å; S70-E74 PolarHBondContact O-N 2.93Å; E72-E74 VanDerWaalsContact C-N 3.35Å; E74-F76 VanDerWaalsContact C-N 3.33Å; E74-F76 PolarHBondContact O-N 3.44Å; E74-L77 PolarHBondContact O-N 2.77Å; E74-L78 HydrophobicContact CG-CD1 3.96Å; E74-L78 WeakPolarHBondContact O-CB 3.44Å; E74-L78 WeakPolarHBondContact O-CG 3.5Å; E74-L78 PolarHBondContact O-N 3.38Å; E74-L168 HydrophobicContact CB-CD2 4.33Å; E74-L168 HydrophobicContact CG-CB 4.49Å; E74-L168 HydrophobicContact CG-CD2 4.12Å; E74-L168 WeakPolarHBondContact OE1-CA 3.46Å; E74-G169 PolarHBondContact OE1-N 3Å; E74-P201 VanDerWaalsContact OE1-CB 3.27Å; E74-P201 WeakPolarHBondContact OE1-CB 3.41Å; E74-R202 HydrophobicContact CB-CG 3.94Å; E74-R202 HydrophobicContact CG-CG 4.33Å; E74-R202 WeakPolarHBondContact OE2-CD 3.49Å; E74-R202 WeakPolarHBondContact OE2-CG 3.26Å; E74-R202 IonicContact OE2-CZ 3.75Å; E74-R202 IonicContact OE2-NH1 3.93Å; E74-R202 PolarHBondContact OE2-NH1 2.89Å
75	S	98.7	Very high	97.9	Very high	77 Å²	77	62.8 Å²	62.8	54%	0.538	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-44.3	179	-62.7	0	0	0	0	111.5	E71 E72 Q79	E71-S75 WeakPolarHBondContact O-CB 3.44Å; E71-S75 PolarHBondContact O-N 3.15Å; E71-S75 PolarHBondContact O-OG 2.96Å; E72-S75 PolarHBondContact O-N 3.23Å; S75-Q79 WeakPolarHBondContact O-CB 3.47Å; S75-Q79 PolarHBondContact O-N 3.05Å
76	F	98.7	Very high	97.6	Very high	96 Å²	96	71.5 Å²	71.5	42%	0.421	35%	0.354	S	S	.	.	H	α-helix	trans	-62.8	-47.2	176.6	173.3	-102	0	0	0	111.7	E72 E73 E74 Q79 Q80 W117	E72-F76 WeakPolarHBondContact O-CB 3.43Å; E72-F76 PolarHBondContact O-N 3.24Å; E73-F76 PolarHBondContact O-N 2.94Å; E74-F76 VanDerWaalsContact C-N 3.33Å; E74-F76 PolarHBondContact O-N 3.44Å; F76-Q79 WeakPolarHBondContact O-CB 3.41Å; F76-Q79 PolarHBondContact O-N 3.22Å; F76-Q80 HydrophobicContact CD1-CG 4.45Å; F76-Q80 HydrophobicContact CE1-CG 4.02Å; F76-Q80 HydrophobicContact CE2-CG 4.09Å; F76-Q80 HydrophobicContact CZ-CG 3.83Å; F76-Q80 WeakPolarHBondContact O-CG 3.37Å; F76-Q80 PolarHBondContact O-N 3Å; F76-W117 HydrophobicContact CE1-CB 3.72Å; F76-W117 HydrophobicContact CZ-CB 4.12Å
77	L	98.8	Very high	97.3	Very high	7 Å²	7	75.6 Å²	75.6	4%	0.037	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-46.3	179.9	-70.5	171.9	0	0	0	111.8	I69 E73 E74 Q79 Q80 V81 W117 C121 L168 L253	I69-L77 HydrophobicContact CD1-CD1 3.88Å; E73-L77 WeakPolarHBondContact O-CB 3.17Å; E73-L77 WeakPolarHBondContact O-CG 3.41Å; E73-L77 PolarHBondContact O-N 3.04Å; E74-L77 PolarHBondContact O-N 2.77Å; L77-Q79 VanDerWaalsContact C-N 3.29Å; L77-Q79 PolarHBondContact O-N 3.44Å; L77-Q80 PolarHBondContact O-N 3.02Å; L77-Q80 VanDerWaalsContact O-N 3.16Å; L77-V81 WeakPolarHBondContact O-CG2 3.43Å; L77-V81 PolarHBondContact O-N 2.91Å; L77-W117 HydrophobicContact CD2-CE3 3.63Å; L77-W117 HydrophobicContact CD2-CZ3 4.19Å; L77-C121 VanDerWaalsContact CD2-SG 3.57Å; L77-L168 HydrophobicContact CB-CD1 3.81Å; L77-L168 HydrophobicContact CD1-CD1 4.42Å; L77-L168 HydrophobicContact CD1-CD2 4.16Å; L77-L253 HydrophobicContact CD1-CD2 4.34Å; L77-L253 HydrophobicContact CD2-CD2 4.31Å
78	L	98.8	Very high	97.2	Very high	38 Å²	38	73 Å²	73	20%	0.199	36%	0.362	C	S	.	.	H	α-helix	trans	-58.7	-42.4	175.5	-72.8	172.2	0	0	0	111.1	E74 Q80 V81 Y82 L168 V251	E74-L78 HydrophobicContact CG-CD1 3.96Å; E74-L78 WeakPolarHBondContact O-CB 3.44Å; E74-L78 WeakPolarHBondContact O-CG 3.5Å; E74-L78 PolarHBondContact O-N 3.38Å; L78-Q80 PolarHBondContact O-N 2.87Å; L78-V81 PolarHBondContact O-N 3.24Å; L78-Y82 HydrophobicContact CD2-CE2 4.24Å; L78-Y82 WeakPolarHBondContact O-CD2 3.37Å; L78-Y82 PolarHBondContact O-N 3.14Å; L78-L168 HydrophobicContact CD2-CB 3.87Å; L78-L168 HydrophobicContact CD2-CD1 4.1Å; L78-L168 HydrophobicContact CG-CB 4.22Å; L78-L168 HydrophobicContact CG-CD1 4.26Å; L78-V251 HydrophobicContact CD2-CB 3.92Å; L78-V251 HydrophobicContact CD2-CG2 3.88Å
79	Q	98.6	Very high	97.1	Very high	120 Å²	120	73.6 Å²	73.6	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-59.5	-45	175.4	-170.6	-174.8	14.7	0	0	112.1	S75 F76 L77 Y82 K83	S75-Q79 WeakPolarHBondContact O-CB 3.47Å; S75-Q79 PolarHBondContact O-N 3.05Å; F76-Q79 WeakPolarHBondContact O-CB 3.41Å; F76-Q79 PolarHBondContact O-N 3.22Å; L77-Q79 VanDerWaalsContact C-N 3.29Å; L77-Q79 PolarHBondContact O-N 3.44Å; Q79-Y82 PolarHBondContact O-N 3.23Å; Q79-K83 WeakPolarHBondContact O-CB 3.45Å; Q79-K83 PolarHBondContact O-N 3.19Å
80	Q	98.6	Very high	97	Very high	41 Å²	41	75.8 Å²	75.8	19%	0.192	38%	0.377	C	S	.	.	H	α-helix	trans	-66.7	-42.1	178.8	-63.1	-52.8	-41.5	0	0	112.4	F76 L77 L78 Y82 K83 S84 W117	F76-Q80 HydrophobicContact CD1-CG 4.45Å; F76-Q80 HydrophobicContact CE1-CG 4.02Å; F76-Q80 HydrophobicContact CE2-CG 4.09Å; F76-Q80 HydrophobicContact CZ-CG 3.83Å; F76-Q80 WeakPolarHBondContact O-CG 3.37Å; F76-Q80 PolarHBondContact O-N 3Å; L77-Q80 PolarHBondContact O-N 3.02Å; L77-Q80 VanDerWaalsContact O-N 3.16Å; L78-Q80 PolarHBondContact O-N 2.87Å; Q80-Y82 VanDerWaalsContact C-N 3.31Å; Q80-Y82 PolarHBondContact O-N 2.87Å; Q80-K83 PolarHBondContact O-N 3.2Å; Q80-S84 PolarHBondContact O-N 3.19Å; Q80-S84 VanDerWaalsContact O-N 3.14Å; Q80-S84 PolarHBondContact O-OG 3.4Å; Q80-W117 HydrophobicContact CB-CD2 3.69Å; Q80-W117 HydrophobicContact CB-CE3 4.12Å; Q80-W117 HydrophobicContact CB-CG 3.89Å; Q80-W117 HydrophobicContact CB-CZ2 4.34Å; Q80-W117 HydrophobicContact CG-CB 4.07Å; Q80-W117 HydrophobicContact CG-CD2 4.17Å; Q80-W117 HydrophobicContact CG-CG 3.86Å
81	V	98.3	Very high	96.8	Very high	0 Å²	0	79.5 Å²	79.5	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-55.8	-47.8	175.9	166.2	0	0	0	0	110.4	L77 L78 S84 W89 Q98 W117 V141 V251	L77-V81 WeakPolarHBondContact O-CG2 3.43Å; L77-V81 PolarHBondContact O-N 2.91Å; L78-V81 PolarHBondContact O-N 3.24Å; V81-S84 VanDerWaalsContact O-CB 3.32Å; V81-S84 WeakPolarHBondContact O-CB 3.31Å; V81-S84 PolarHBondContact O-N 3.19Å; V81-S84 PolarHBondContact O-OG 2.91Å; V81-W89 HydrophobicContact CG1-CH2 3.72Å; V81-W89 HydrophobicContact CG1-CZ2 3.7Å; V81-Q98 PolarHBondContact O-NE2 3.18Å; V81-W117 HydrophobicContact CG2-CH2 3.73Å; V81-W117 HydrophobicContact CG2-CZ3 3.93Å; V81-V141 HydrophobicContact CG1-CG1 3.85Å; V81-V141 HydrophobicContact CG2-CG1 3.92Å; V81-V251 HydrophobicContact CG1-CG1 4.24Å; V81-V251 HydrophobicContact CG2-CG1 4.4Å
82	Y	98.3	Very high	96.5	Very high	103 Å²	103	75.2 Å²	75.2	40%	0.404	37%	0.37	S	S	.	.	H	α-helix	trans	-80.9	-23.4	-177.8	-70.8	-60.2	0	0	0	114.6	L78 Q79 Q80 S84 W89 E143 V251	L78-Y82 HydrophobicContact CD2-CE2 4.24Å; L78-Y82 WeakPolarHBondContact O-CD2 3.37Å; L78-Y82 PolarHBondContact O-N 3.14Å; Q79-Y82 PolarHBondContact O-N 3.23Å; Q80-Y82 VanDerWaalsContact C-N 3.31Å; Q80-Y82 PolarHBondContact O-N 2.87Å; Y82-S84 PolarHBondContact O-N 2.88Å; Y82-W89 HydrophobicContact CD1-CZ2 4.14Å; Y82-W89 HydrophobicContact CE1-CZ2 4.17Å; Y82-E143 WeakPolarHBondContact CE1-OE2 3.12Å; Y82-E143 VanDerWaalsContact CZ-OE2 3.31Å; Y82-E143 PolarHBondContact OH-OE2 3.48Å; Y82-V251 HydrophobicContact CE2-CG2 4.45Å
83	K	97.5	Very high	95.8	Very high	156 Å²	156	72.9 Å²	72.9	68%	0.678	37%	0.369	S	S	*	.	H	α-helix	trans	-73.4	-16.9	172	-172.1	175	179.7	-175.8	0	112.6	Q79 Q80	Q79-K83 WeakPolarHBondContact O-CB 3.45Å; Q79-K83 PolarHBondContact O-N 3.19Å; Q80-K83 PolarHBondContact O-N 3.2Å
84	S	94.5	Very high	95.5	Very high	16 Å²	16	70.7 Å²	70.7	11%	0.112	36%	0.361	C	S	.	.	S	Bend	trans	-59.5	144.7	-179.9	-67.1	0	0	0	0	111.8	Q80 V81 Y82	Q80-S84 PolarHBondContact O-N 3.19Å; Q80-S84 VanDerWaalsContact O-N 3.14Å; Q80-S84 PolarHBondContact O-OG 3.4Å; V81-S84 VanDerWaalsContact O-CB 3.32Å; V81-S84 WeakPolarHBondContact O-CB 3.31Å; V81-S84 PolarHBondContact O-N 3.19Å; V81-S84 PolarHBondContact O-OG 2.91Å; Y82-S84 PolarHBondContact O-N 2.88Å
85	P	93.5	Very high	95.3	Very high	77 Å²	77	71.2 Å²	71.2	50%	0.5	36%	0.363	S	S	.	.			trans	-55.2	145.4	-179.1	-26	34.4	0	0	0	112.4	T87 K88	P85-T87 PolarHBondContact O-N 2.84Å; P85-K88 WeakPolarHBondContact O-CB 3.5Å; P85-K88 PolarHBondContact O-N 2.71Å
86	K	91.3	Very high	95.2	Very high	197 Å²	197	70.8 Å²	70.8	86%	0.857	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-53.8	-30.8	176.9	-69.7	-175.9	179.9	179.7	0	112.9	K88 W89	K86-K88 PolarHBondContact O-N 3.4Å; K86-W89 WeakPolarHBondContact O-CB 3.37Å; K86-W89 PolarHBondContact O-N 3.17Å; K86-W89 VanDerWaalsContact O-N 3.1Å
87	T	92.7	Very high	95.1	Very high	131 Å²	131	66.4 Å²	66.4	80%	0.804	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-66.9	-18.8	177.6	52.8	0	0	0	0	114.2	P85 W89	P85-T87 PolarHBondContact O-N 2.84Å; T87-W89 VanDerWaalsContact C-N 3.31Å
88	K	93.8	Very high	95.1	Very high	55 Å²	55	66 Å²	66	24%	0.239	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-79.3	-15.4	172.5	-78	-70	-173	179.4	0	112.8	P85 K86 Q98 W100 E112	P85-K88 WeakPolarHBondContact O-CB 3.5Å; P85-K88 PolarHBondContact O-N 2.71Å; K86-K88 PolarHBondContact O-N 3.4Å; K88-Q98 WeakPolarHBondContact O-CA 3.39Å; K88-W100 HydrophobicContact CB-CZ2 4.27Å; K88-W100 HydrophobicContact CD-CH2 3.99Å; K88-W100 HydrophobicContact CD-CZ2 4.07Å; K88-W100 HydrophobicContact CD-CZ3 4.24Å; K88-W100 HydrophobicContact CG-CH2 3.87Å; K88-W100 HydrophobicContact CG-CZ2 3.92Å; K88-E112 IonicContact NZ-OE2 3.59Å
89	W	96.3	Very high	95	Very high	39 Å²	39	65.6 Å²	65.6	15%	0.148	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124.4	176.6	-70	100.8	0	0	0	111.1	V81 Y82 K86 T87 R96 L97 Q98 E143	V81-W89 HydrophobicContact CG1-CH2 3.72Å; V81-W89 HydrophobicContact CG1-CZ2 3.7Å; Y82-W89 HydrophobicContact CD1-CZ2 4.14Å; Y82-W89 HydrophobicContact CE1-CZ2 4.17Å; K86-W89 WeakPolarHBondContact O-CB 3.37Å; K86-W89 PolarHBondContact O-N 3.17Å; K86-W89 VanDerWaalsContact O-N 3.1Å; T87-W89 VanDerWaalsContact C-N 3.31Å; W89-R96 HydrophobicContact CE3-CB 3.7Å; W89-R96 HydrophobicContact CZ3-CB 3.95Å; W89-L97 CarbonylContact C-O 3.54Å; W89-L97 WeakPolarHBondContact CA-O 3.26Å; W89-Q98 HydrophobicContact CD2-CG 3.73Å; W89-Q98 HydrophobicContact CE3-CG 3.55Å; W89-Q98 HydrophobicContact CG-CG 4.4Å; W89-Q98 HydrophobicContact CH2-CG 4.06Å; W89-Q98 HydrophobicContact CZ2-CG 4.21Å; W89-Q98 HydrophobicContact CZ3-CG 3.73Å; W89-E143 HydrophobicContact CH2-CB 4.08Å; W89-E143 HydrophobicContact CZ3-CB 4Å
90	T	95.7	Very high	94.9	Very high	52 Å²	52	61.2 Å²	61.2	32%	0.319	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.2	166.4	-54	0	0	0	0	108.6	L14 L92 R96 L97	L14-T90 HydrophobicContact CD1-CG2 4.24Å; T90-L92 HydrophobicContact CG2-CD2 4.11Å; T90-R96 WeakPolarHBondContact O-CA 3.37Å; T90-L97 PolarHBondContact N-O 3.14Å; T90-L97 PolarHBondContact O-N 3.39Å
91	Q	94.9	Very high	94.7	Very high	121 Å²	121	59.4 Å²	59.4	57%	0.565	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	122.7	169.9	-176.8	67.1	56.2	0	0	108.8	R95	Q91-R95 PolarHBondContact NE2-O 3.04Å; Q91-R95 VanDerWaalsContact NE2-O 3.17Å
92	L	92.3	Very high	94.5	Very high	27 Å²	27	59.4 Å²	59.4	14%	0.141	30%	0.297	C	S	.	.			trans	-102.6	176.2	169.7	-56.8	175.8	0	0	0	108.8	T90 S94 R95 L97	T90-L92 HydrophobicContact CG2-CD2 4.11Å; L92-S94 PolarHBondContact O-N 3.01Å; L92-S94 VanDerWaalsContact O-N 3.09Å; L92-R95 WeakPolarHBondContact CA-O 3.37Å; L92-R95 HydrophobicContact CB-CG 4.21Å; L92-R95 WeakPolarHBondContact CB-O 3.49Å; L92-R95 HydrophobicContact CD1-CG 4.15Å; L92-R95 VanDerWaalsContact CD1-CZ 3.4Å; L92-R95 PolarHBondContact N-O 2.79Å; L92-L97 HydrophobicContact CD1-CB 3.99Å; L92-L97 HydrophobicContact CD1-CD2 4.29Å
93	S	84.1	Confident	93.9	Very high	88 Å²	88	59 Å²	59	62%	0.615	30%	0.301	S	S	*	.	S	Bend	trans	-49.3	-40.2	-175.3	62.4	0	0	0	0	114	D17	D17-S93 VanDerWaalsContact OD2-CB 3.22Å; D17-S93 WeakPolarHBondContact OD2-CB 3.48Å; D17-S93 PolarHBondContact OD2-OG 3.33Å
94	S	90.6	Very high	93.3	Very high	26 Å²	26	53.1 Å²	53.1	18%	0.182	28%	0.279	C	S	.	.	S	Bend	trans	-136.7	3.8	-166.9	47.6	0	0	0	0	113.4	L92 E148 G149	L92-S94 PolarHBondContact O-N 3.01Å; L92-S94 VanDerWaalsContact O-N 3.09Å; S94-E148 WeakPolarHBondContact O-CB 3.47Å; S94-E148 WeakPolarHBondContact O-CG 3.27Å; S94-G149 PolarHBondContact OG-O 2.91Å
95	R	95.4	Very high	92.8	Very high	28 Å²	28	56.1 Å²	56.1	11%	0.106	29%	0.291	C	S	.	.	S	Bend	trans	-160.7	173.4	-177	73.4	-178.6	-172.9	-73.1	0.1	111.1	Q91 L92 N142 E143 Y144 I150	Q91-R95 PolarHBondContact NE2-O 3.04Å; Q91-R95 VanDerWaalsContact NE2-O 3.17Å; L92-R95 WeakPolarHBondContact CA-O 3.37Å; L92-R95 HydrophobicContact CB-CG 4.21Å; L92-R95 WeakPolarHBondContact CB-O 3.49Å; L92-R95 HydrophobicContact CD1-CG 4.15Å; L92-R95 VanDerWaalsContact CD1-CZ 3.4Å; L92-R95 PolarHBondContact N-O 2.79Å; R95-N142 PolarHBondContact NE-OD1 3.3Å; R95-E143 WeakPolarHBondContact CB-O 3.35Å; R95-Y144 HydrophobicContact CB-CD1 3.94Å; R95-Y144 HydrophobicContact CB-CE1 3.93Å; R95-Y144 VanDerWaalsContact CD-CZ 3.45Å; R95-Y144 WeakPolarHBondContact CD-OH 3.46Å; R95-Y144 HydrophobicContact CG-CE1 4.27Å; R95-I150 VanDerWaalsContact NH2-CD1 3.29Å
96	R	97.1	Very high	92.1	Very high	69 Å²	69	56.8 Å²	56.8	26%	0.26	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.8	170	-61.4	-171.3	-66.4	173.9	2.5	111.7	W89 T90 N142 E143	W89-R96 HydrophobicContact CE3-CB 3.7Å; W89-R96 HydrophobicContact CZ3-CB 3.95Å; T90-R96 WeakPolarHBondContact O-CA 3.37Å; R96-N142 WeakPolarHBondContact O-CA 3.33Å; R96-E143 IonicContact CZ-OE1 2.79Å; R96-E143 PolarHBondContact N-O 2.84Å; R96-E143 IonicContact NE-OE1 3.87Å; R96-E143 PolarHBondContact NE-OE1 2.91Å; R96-E143 VanDerWaalsContact NH2-CD 3.31Å; R96-E143 IonicContact NH2-OE1 3.65Å; R96-E143 PolarHBondContact NH2-OE1 2.85Å; R96-E143 IonicContact NH2-OE2 3.64Å; R96-E143 PolarHBondContact NH2-OE2 2.84Å; R96-E143 PolarHBondContact O-N 2.77Å
97	L	96.9	Very high	91.7	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.016	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.9	-175.5	179.4	72.7	0	0	0	111	L14 W89 T90 L92 L140 V141 N142	L14-L97 HydrophobicContact CD1-CD2 4.4Å; L14-L97 HydrophobicContact CD2-CD2 3.32Å; W89-L97 CarbonylContact C-O 3.54Å; W89-L97 WeakPolarHBondContact CA-O 3.26Å; T90-L97 PolarHBondContact N-O 3.14Å; T90-L97 PolarHBondContact O-N 3.39Å; L92-L97 HydrophobicContact CD1-CB 3.99Å; L92-L97 HydrophobicContact CD1-CD2 4.29Å; L97-L140 HydrophobicContact CD1-CB 4.01Å; L97-L140 HydrophobicContact CD1-CD2 4.2Å; L97-V141 CarbonylContact C-O 3.43Å; L97-V141 VanDerWaalsContact CA-O 3.29Å; L97-V141 WeakPolarHBondContact CA-O 3.44Å; L97-N142 VanDerWaalsContact CD1-OD1 3.3Å; L97-N142 WeakPolarHBondContact CD1-OD1 3.5Å
98	Q	97.6	Very high	91.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	147.3	157.5	-42.8	177.7	-5.3	0	0	110.4	V81 K88 W89 L140 V141	V81-Q98 PolarHBondContact O-NE2 3.18Å; K88-Q98 WeakPolarHBondContact O-CA 3.39Å; W89-Q98 HydrophobicContact CD2-CG 3.73Å; W89-Q98 HydrophobicContact CE3-CG 3.55Å; W89-Q98 HydrophobicContact CG-CG 4.4Å; W89-Q98 HydrophobicContact CH2-CG 4.06Å; W89-Q98 HydrophobicContact CZ2-CG 4.21Å; W89-Q98 HydrophobicContact CZ3-CG 3.73Å; Q98-L140 WeakPolarHBondContact O-CA 3.3Å; Q98-V141 HydrophobicContact CB-CB 3.96Å; Q98-V141 HydrophobicContact CB-CG2 4.44Å; Q98-V141 HydrophobicContact CG-CB 4.14Å; Q98-V141 PolarHBondContact N-O 2.89Å; Q98-V141 PolarHBondContact O-N 3.12Å
99	N	96.4	Very high	91.1	Very high	29 Å²	29	45.8 Å²	45.8	16%	0.155	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129	174.8	-175.1	-34.4	0	0	0	110.7	G102 P104 H138 L140	N99-G102 PolarHBondContact OD1-O 2.93Å; N99-P104 WeakPolarHBondContact ND2-CD 3.32Å; N99-H138 PolarHBondContact ND2-NE2 2.87Å; N99-H138 PolarHBondContact OD1-NE2 2.68Å; N99-L140 HydrophobicContact CB-CD2 4.03Å
100	W	97.6	Very high	90.9	Very high	28 Å²	28	47.3 Å²	47.3	11%	0.106	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	146.4	-178.7	-60.8	98	0	0	0	112.6	K88 G102 L114 P115 W117 L118 H138 V139	K88-W100 HydrophobicContact CB-CZ2 4.27Å; K88-W100 HydrophobicContact CD-CH2 3.99Å; K88-W100 HydrophobicContact CD-CZ2 4.07Å; K88-W100 HydrophobicContact CD-CZ3 4.24Å; K88-W100 HydrophobicContact CG-CH2 3.87Å; K88-W100 HydrophobicContact CG-CZ2 3.92Å; W100-G102 VanDerWaalsContact C-N 3.34Å; W100-L114 HydrophobicContact CB-CD2 3.77Å; W100-P115 HydrophobicContact CD2-CG 4.39Å; W100-P115 HydrophobicContact CE3-CG 3.86Å; W100-P115 HydrophobicContact CZ3-CG 3.94Å; W100-W117 HydrophobicContact CZ2-CZ2 4.42Å; W100-L118 HydrophobicContact CB-CD1 3.45Å; W100-L118 VanDerWaalsContact CB-CD1 3.45Å; W100-L118 HydrophobicContact CD2-CD1 3.8Å; W100-L118 HydrophobicContact CE3-CD1 4.49Å; W100-L118 HydrophobicContact CG-CD1 3.3Å; W100-H138 WeakPolarHBondContact O-CA 3.45Å; W100-H138 PolarHBondContact O-CD2 2.87Å; W100-H138 VanDerWaalsContact O-CD2 3.25Å; W100-V139 HydrophobicContact CB-CB 4.37Å; W100-V139 PolarHBondContact N-O 3.31Å; W100-V139 PolarHBondContact O-N 2.87Å
101	G	95.1	Very high	90.6	Very high	3 Å²	3	48.5 Å²	48.5	3%	0.031	26%	0.255	C	S	.	.	S	Bend	trans	92.8	-10	177.3	0	0	0	0	0	114.2	M109 E112 L114 N137	G101-M109 WeakPolarHBondContact O-CE 3.4Å; G101-E112 CarbonylContact C-O 3.53Å; G101-E112 WeakPolarHBondContact CA-O 3.43Å; G101-E112 PolarHBondContact O-N 3.37Å; G101-L114 VanDerWaalsContact CA-CD2 3.45Å; G101-N137 WeakPolarHBondContact CA-O 3.19Å
102	G	92.1	Very high	90.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.3	170.8	170.6	0	0	0	0	0	113.3	N99 W100 P104 L110	N99-G102 PolarHBondContact OD1-O 2.93Å; W100-G102 VanDerWaalsContact C-N 3.34Å; G102-P104 WeakPolarHBondContact O-CD 3.42Å; G102-L110 CarbonylContact C-O 3.47Å; G102-L110 WeakPolarHBondContact CA-O 3.44Å
103	L	87.7	Confident	90.6	Very high	94 Å²	94	52.3 Å²	52.3	49%	0.492	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.6	176.9	-65.7	175.4	0	0	0	110.4	H105 M109 L110	L103-H105 PolarHBondContact O-N 3.41Å; L103-M109 WeakPolarHBondContact O-CA 3.38Å; L103-L110 PolarHBondContact N-O 2.6Å; L103-L110 PolarHBondContact O-N 3.37Å
104	P	84.8	Confident	91.2	Very high	33 Å²	33	49.1 Å²	49.1	21%	0.214	26%	0.257	C	S	.	.			trans	-52.5	133.2	168.1	-30.8	38.4	0	0	0	112	N99 G102 L158	N99-P104 WeakPolarHBondContact ND2-CD 3.32Å; G102-P104 WeakPolarHBondContact O-CD 3.42Å; P104-L158 HydrophobicContact CB-CD2 3.6Å; P104-L158 HydrophobicContact CG-CD2 4.05Å
105	H	83.3	Confident	91.5	Very high	78 Å²	78	49.4 Å²	49.4	36%	0.361	26%	0.259	S	S	.	.			trans	-141.8	151.4	174.6	174.3	-83.5	0	0	0	109.4	L103 K107 G108 I262	L103-H105 PolarHBondContact O-N 3.41Å; H105-K107 PolarHBondContact ND1-N 3.45Å; H105-K107 VanDerWaalsContact ND1-N 3.19Å; H105-K107 PolarHBondContact O-N 3.45Å; H105-G108 CarbonylContact C-O 3.49Å; H105-G108 WeakPolarHBondContact CA-O 3.29Å; H105-G108 VanDerWaalsContact CB-O 3.23Å; H105-G108 WeakPolarHBondContact CB-O 3.36Å; H105-G108 PolarHBondContact N-O 2.91Å; H105-G108 CarbonylContact O-C 3.56Å; H105-G108 PolarHBondContact O-N 2.94Å; H105-I262 HydrophobicContact CB-CD1 4.2Å
106	P	79.1	Confident	91.6	Very high	91 Å²	91	54 Å²	54	59%	0.591	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-26.1	-176.8	-31.1	35.9	0	0	0	115.3
107	K	81.5	Confident	91.6	Very high	151 Å²	151	51.9 Å²	51.9	66%	0.657	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	3.1	178.9	-61.5	-175.2	180	179	0	114.2	H105 K260 I262	H105-K107 PolarHBondContact ND1-N 3.45Å; H105-K107 VanDerWaalsContact ND1-N 3.19Å; H105-K107 PolarHBondContact O-N 3.45Å; K107-K260 WeakPolarHBondContact O-CD 3.42Å; K107-K260 WeakPolarHBondContact O-CE 3.49Å; K107-I262 HydrophobicContact CB-CD1 4.05Å
108	G	84.3	Confident	91.6	Very high	2 Å²	2	51.7 Å²	51.7	2%	0.021	28%	0.277	C	S	.	.	S	Bend	trans	122	176.2	-170.3	0	0	0	0	0	111.3	H105 K260 I262	H105-G108 CarbonylContact C-O 3.49Å; H105-G108 WeakPolarHBondContact CA-O 3.29Å; H105-G108 VanDerWaalsContact CB-O 3.23Å; H105-G108 WeakPolarHBondContact CB-O 3.36Å; H105-G108 PolarHBondContact N-O 2.91Å; H105-G108 CarbonylContact O-C 3.56Å; H105-G108 PolarHBondContact O-N 2.94Å; G108-K260 CarbonylContact C-O 3.51Å; G108-K260 WeakPolarHBondContact CA-O 3.22Å; G108-I262 VanDerWaalsContact O-CD1 3.26Å; G108-I262 WeakPolarHBondContact O-CD1 3.42Å
109	M	91.4	Very high	91.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	135	-178.8	-179.8	173.9	75.3	0	0	112	G101 L103 T111 H138 V258 K260 V261 I262	G101-M109 WeakPolarHBondContact O-CE 3.4Å; L103-M109 WeakPolarHBondContact O-CA 3.38Å; M109-T111 HydrophobicContact CE-CG2 4.04Å; M109-T111 PolarHBondContact O-N 3.18Å; M109-H138 HydrophobicContact CE-CB 4.19Å; M109-H138 HydrophobicContact SD-CB 3.93Å; M109-H138 PolarHBondContact SD-CD2 2.94Å; M109-V258 HydrophobicContact CB-CB 4.46Å; M109-V258 HydrophobicContact CB-CG1 3.78Å; M109-V258 HydrophobicContact CE-CB 3.92Å; M109-V258 HydrophobicContact CE-CG1 4.46Å; M109-V258 HydrophobicContact CE-CG2 4.04Å; M109-V258 HydrophobicContact SD-CB 4.27Å; M109-V258 HydrophobicContact SD-CG2 3.86Å; M109-K260 PolarHBondContact N-O 3.02Å; M109-V261 HydrophobicContact CE-CG1 4.44Å; M109-V261 WeakPolarHBondContact O-CA 3.41Å; M109-I262 PolarHBondContact O-N 2.7Å
110	L	90.2	Very high	91.6	Very high	70 Å²	70	57.7 Å²	57.7	37%	0.366	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	104.2	165.5	-68.1	168.2	0	0	0	108	G102 L103 I262	G102-L110 CarbonylContact C-O 3.47Å; G102-L110 WeakPolarHBondContact CA-O 3.44Å; L103-L110 PolarHBondContact N-O 2.6Å; L103-L110 PolarHBondContact O-N 3.37Å; L110-I262 HydrophobicContact CD2-CB 3.91Å; L110-I262 HydrophobicContact CD2-CD1 4.06Å; L110-I262 HydrophobicContact CD2-CG2 3.85Å; L110-I262 HydrophobicContact CG-CD1 4.24Å
111	T	90.8	Very high	91.6	Very high	78 Å²	78	56.9 Å²	56.9	48%	0.479	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	140.1	-170.7	51.8	0	0	0	0	112.9	M109 V261	M109-T111 HydrophobicContact CE-CG2 4.04Å; M109-T111 PolarHBondContact O-N 3.18Å; T111-V261 HydrophobicContact CG2-CB 3.6Å; T111-V261 HydrophobicContact CG2-CG1 3.39Å
112	E	92.7	Very high	91.7	Very high	92 Å²	92	56.9 Å²	56.9	43%	0.43	31%	0.309	S	S	.	.			trans	-123.8	153.7	168.7	-69.2	-178.6	-173.2	0	0	109.5	K88 G101 L114	K88-E112 IonicContact NZ-OE2 3.59Å; G101-E112 CarbonylContact C-O 3.53Å; G101-E112 WeakPolarHBondContact CA-O 3.43Å; G101-E112 PolarHBondContact O-N 3.37Å; E112-L114 PolarHBondContact O-N 2.96Å
113	T	94.1	Very high	91.9	Very high	136 Å²	136	61.5 Å²	61.5	83%	0.834	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-65.5	129	174.8	-53.8	0	0	0	0	110.1
114	L	96.4	Very high	92.3	Very high	20 Å²	20	60.2 Å²	60.2	11%	0.105	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-72.6	141.5	171.3	-74.8	170.2	0	0	0	110	W100 G101 E112 L118 V139	W100-L114 HydrophobicContact CB-CD2 3.77Å; G101-L114 VanDerWaalsContact CA-CD2 3.45Å; E112-L114 PolarHBondContact O-N 2.96Å; L114-L118 HydrophobicContact CD2-CB 4.28Å; L114-L118 HydrophobicContact CD2-CD1 4.3Å; L114-V139 HydrophobicContact CD2-CG2 4.27Å
115	P	97	Very high	92.9	Very high	32 Å²	32	58.6 Å²	58.6	21%	0.208	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-68.6	148.8	169.1	31.1	-35.1	0	0	0	110.7	W100 W117 L118 Q119	W100-P115 HydrophobicContact CD2-CG 4.39Å; W100-P115 HydrophobicContact CE3-CG 3.86Å; W100-P115 HydrophobicContact CZ3-CG 3.94Å; P115-W117 HydrophobicContact CG-CZ2 4.32Å; P115-W117 VanDerWaalsContact CG-NE1 3.34Å; P115-W117 PolarHBondContact O-N 3.42Å; P115-L118 HydrophobicContact CG-CB 4.13Å; P115-L118 HydrophobicContact CG-CD1 3.86Å; P115-L118 HydrophobicContact CG-CG 4.11Å; P115-L118 WeakPolarHBondContact O-CA 3.18Å; P115-L118 PolarHBondContact O-N 2.94Å; P115-Q119 PolarHBondContact O-N 2.96Å
116	D	97.2	Very high	93.4	Very high	125 Å²	125	55.7 Å²	55.7	67%	0.668	30%	0.3	S	S	*	.	H	α-helix	trans	-52.1	-36.7	-171.8	-58.5	-8	0	0	0	114.1	L118 Q119 S120	D116-L118 VanDerWaalsContact C-N 3.32Å; D116-L118 PolarHBondContact O-N 3.05Å; D116-Q119 PolarHBondContact O-N 3.37Å; D116-S120 WeakPolarHBondContact O-CB 3.38Å; D116-S120 PolarHBondContact O-N 3.38Å; D116-S120 PolarHBondContact O-OG 3.03Å
117	W	96.8	Very high	94.1	Very high	24 Å²	24	55.4 Å²	55.4	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-33.2	178.9	67.3	-91.5	0	0	0	112.9	F76 L77 Q80 V81 W100 P115 C121 V141 L253	F76-W117 HydrophobicContact CE1-CB 3.72Å; F76-W117 HydrophobicContact CZ-CB 4.12Å; L77-W117 HydrophobicContact CD2-CE3 3.63Å; L77-W117 HydrophobicContact CD2-CZ3 4.19Å; Q80-W117 HydrophobicContact CB-CD2 3.69Å; Q80-W117 HydrophobicContact CB-CE3 4.12Å; Q80-W117 HydrophobicContact CB-CG 3.89Å; Q80-W117 HydrophobicContact CB-CZ2 4.34Å; Q80-W117 HydrophobicContact CG-CB 4.07Å; Q80-W117 HydrophobicContact CG-CD2 4.17Å; Q80-W117 HydrophobicContact CG-CG 3.86Å; V81-W117 HydrophobicContact CG2-CH2 3.73Å; V81-W117 HydrophobicContact CG2-CZ3 3.93Å; W100-W117 HydrophobicContact CZ2-CZ2 4.42Å; P115-W117 HydrophobicContact CG-CZ2 4.32Å; P115-W117 VanDerWaalsContact CG-NE1 3.34Å; P115-W117 PolarHBondContact O-N 3.42Å; W117-C121 PolarHBondContact O-SG 2.8Å; W117-V141 HydrophobicContact CH2-CG2 4.37Å; W117-L253 HydrophobicContact CZ3-CD2 4.19Å
118	L	98.1	Very high	94.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-81.9	-36	172.4	-76	178.3	0	0	0	111.9	W100 L114 P115 D116 S120 C121 C122 V139 L253	W100-L118 HydrophobicContact CB-CD1 3.45Å; W100-L118 VanDerWaalsContact CB-CD1 3.45Å; W100-L118 HydrophobicContact CD2-CD1 3.8Å; W100-L118 HydrophobicContact CE3-CD1 4.49Å; W100-L118 HydrophobicContact CG-CD1 3.3Å; L114-L118 HydrophobicContact CD2-CB 4.28Å; L114-L118 HydrophobicContact CD2-CD1 4.3Å; P115-L118 HydrophobicContact CG-CB 4.13Å; P115-L118 HydrophobicContact CG-CD1 3.86Å; P115-L118 HydrophobicContact CG-CG 4.11Å; P115-L118 WeakPolarHBondContact O-CA 3.18Å; P115-L118 PolarHBondContact O-N 2.94Å; D116-L118 VanDerWaalsContact C-N 3.32Å; D116-L118 PolarHBondContact O-N 3.05Å; L118-S120 VanDerWaalsContact C-N 3.28Å; L118-S120 PolarHBondContact O-N 2.95Å; L118-C121 WeakPolarHBondContact O-CB 3.44Å; L118-C121 PolarHBondContact O-N 3.4Å; L118-C121 VanDerWaalsContact O-N 3.15Å; L118-C122 PolarHBondContact O-N 2.91Å; L118-C122 PolarHBondContact O-SG 2.77Å; L118-C122 VanDerWaalsContact O-SG 3.41Å; L118-V139 HydrophobicContact CB-CG2 4.46Å; L118-V139 HydrophobicContact CD1-CB 4.2Å; L118-V139 HydrophobicContact CD1-CG2 4.47Å; L118-V139 HydrophobicContact CD2-CB 4.2Å; L118-V139 HydrophobicContact CD2-CG1 3.83Å; L118-V139 HydrophobicContact CD2-CG2 4.2Å; L118-L253 HydrophobicContact CD2-CD2 4.01Å; L118-L253 HydrophobicContact CD2-CG 4.48Å
119	Q	97.3	Very high	95	Very high	84 Å²	84	49.9 Å²	49.9	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-58.5	-44	175.3	-178.4	170.5	0.8	0	0	110.9	P115 D116 C121 C122 E123	P115-Q119 PolarHBondContact O-N 2.96Å; D116-Q119 PolarHBondContact O-N 3.37Å; Q119-C121 VanDerWaalsContact C-N 3.3Å; Q119-C121 PolarHBondContact O-N 3.14Å; Q119-C122 WeakPolarHBondContact O-CB 3.35Å; Q119-C122 PolarHBondContact O-N 3.05Å; Q119-C122 VanDerWaalsContact O-N 3.14Å; Q119-E123 HydrophobicContact CG-CG 4.39Å; Q119-E123 VanDerWaalsContact CG-OE1 3.3Å; Q119-E123 WeakPolarHBondContact CG-OE1 3.28Å; Q119-E123 PolarHBondContact NE2-OE1 3.05Å; Q119-E123 WeakPolarHBondContact O-CG 3.44Å; Q119-E123 PolarHBondContact O-N 2.91Å
120	S	96.3	Very high	95	Very high	71 Å²	71	50 Å²	50	50%	0.497	28%	0.279	S	S	.	.	H	α-helix	trans	-58.5	-41.3	175.4	-57	0	0	0	0	112	D116 L118 E123 K124	D116-S120 WeakPolarHBondContact O-CB 3.38Å; D116-S120 PolarHBondContact O-N 3.38Å; D116-S120 PolarHBondContact O-OG 3.03Å; L118-S120 VanDerWaalsContact C-N 3.28Å; L118-S120 PolarHBondContact O-N 2.95Å; S120-E123 PolarHBondContact O-N 3.13Å; S120-K124 WeakPolarHBondContact O-CB 3.4Å; S120-K124 PolarHBondContact O-N 3.39Å
121	C	97.9	Very high	95.1	Very high	11 Å²	11	46.6 Å²	46.6	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-65.4	-44.7	174.9	-64	0	0	0	0	111.9	L77 W117 L118 Q119 E123 K124 V125 I166 I255	L77-C121 VanDerWaalsContact CD2-SG 3.57Å; W117-C121 PolarHBondContact O-SG 2.8Å; L118-C121 WeakPolarHBondContact O-CB 3.44Å; L118-C121 PolarHBondContact O-N 3.4Å; L118-C121 VanDerWaalsContact O-N 3.15Å; Q119-C121 VanDerWaalsContact C-N 3.3Å; Q119-C121 PolarHBondContact O-N 3.14Å; C121-E123 VanDerWaalsContact C-N 3.34Å; C121-E123 PolarHBondContact O-N 2.71Å; C121-K124 PolarHBondContact O-N 3.45Å; C121-V125 WeakPolarHBondContact O-CG2 3.45Å; C121-V125 PolarHBondContact O-N 3.46Å; C121-I166 HydrophobicContact CB-CD1 4.24Å; C121-I255 HydrophobicContact CB-CD1 3.77Å
122	C	97.6	Very high	95	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-58.8	-45.5	176.6	-74.9	0	0	0	0	111.4	L118 Q119 S126 A136 V139	L118-C122 PolarHBondContact O-N 2.91Å; L118-C122 PolarHBondContact O-SG 2.77Å; L118-C122 VanDerWaalsContact O-SG 3.41Å; Q119-C122 WeakPolarHBondContact O-CB 3.35Å; Q119-C122 PolarHBondContact O-N 3.05Å; Q119-C122 VanDerWaalsContact O-N 3.14Å; C122-S126 WeakPolarHBondContact O-CB 3.27Å; C122-S126 PolarHBondContact O-N 3.34Å; C122-S126 PolarHBondContact O-OG 2.94Å; C122-A136 HydrophobicContact CB-CB 3.91Å; C122-V139 VanDerWaalsContact SG-CG2 3.59Å
123	E	95.9	Very high	94.7	Very high	98 Å²	98	43 Å²	43	46%	0.458	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-47.2	177.9	-72.6	171.1	-173.1	0	0	111.3	Q119 S120 C121 V125 S126 S127	Q119-E123 HydrophobicContact CG-CG 4.39Å; Q119-E123 VanDerWaalsContact CG-OE1 3.3Å; Q119-E123 WeakPolarHBondContact CG-OE1 3.28Å; Q119-E123 PolarHBondContact NE2-OE1 3.05Å; Q119-E123 WeakPolarHBondContact O-CG 3.44Å; Q119-E123 PolarHBondContact O-N 2.91Å; S120-E123 PolarHBondContact O-N 3.13Å; C121-E123 VanDerWaalsContact C-N 3.34Å; C121-E123 PolarHBondContact O-N 2.71Å; E123-V125 PolarHBondContact O-N 3.16Å; E123-S126 PolarHBondContact O-N 3.39Å; E123-S127 WeakPolarHBondContact O-CB 3.36Å; E123-S127 PolarHBondContact O-N 3.14Å
124	K	95.7	Very high	94.5	Very high	66 Å²	66	40.8 Å²	40.8	29%	0.287	24%	0.243	S	C	.	.	H	α-helix	trans	-56.3	-48.5	177.5	-165.1	177.9	-173	174.5	0	111.3	F68 E73 S120 C121 S127	F68-K124 HydrophobicContact CE1-CD 4.1Å; F68-K124 HydrophobicContact CE1-CG 4.26Å; F68-K124 HydrophobicContact CZ-CD 4.06Å; F68-K124 HydrophobicContact CZ-CG 3.8Å; F68-K124 PolarHBondContact O-NZ 3.26Å; F68-K124 VanDerWaalsContact O-NZ 3.14Å; E73-K124 VanDerWaalsContact CD-NZ 3.28Å; E73-K124 IonicContact OE1-NZ 2.89Å; E73-K124 PolarHBondContact OE1-NZ 3.39Å; E73-K124 IonicContact OE2-NZ 3.81Å; E73-K124 PolarHBondContact OE2-NZ 2.89Å; S120-K124 WeakPolarHBondContact O-CB 3.4Å; S120-K124 PolarHBondContact O-N 3.39Å; C121-K124 PolarHBondContact O-N 3.45Å; K124-S127 PolarHBondContact O-OG 3.46Å
125	V	96.4	Very high	94.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.8	-41.9	177.2	176.7	0	0	0	0	111.9	F68 C121 E123 S127 L128 V130 F131 S164 I166 L204 I255	F68-V125 HydrophobicContact CE1-CG2 4.01Å; F68-V125 HydrophobicContact CZ-CG2 4.14Å; C121-V125 WeakPolarHBondContact O-CG2 3.45Å; C121-V125 PolarHBondContact O-N 3.46Å; E123-V125 PolarHBondContact O-N 3.16Å; V125-S127 PolarHBondContact O-N 2.89Å; V125-L128 VanDerWaalsContact O-CB 3.28Å; V125-L128 WeakPolarHBondContact O-CB 3.33Å; V125-L128 WeakPolarHBondContact O-CG 3.14Å; V125-L128 PolarHBondContact O-N 3.48Å; V125-L128 VanDerWaalsContact O-N 3.13Å; V125-V130 HydrophobicContact CG1-CG2 3.91Å; V125-F131 HydrophobicContact CG1-CE2 3.8Å; V125-F131 HydrophobicContact CG1-CZ 4.08Å; V125-S164 WeakPolarHBondContact CG1-OG 3.39Å; V125-I166 HydrophobicContact CG2-CD1 4.13Å; V125-I166 HydrophobicContact CG2-CG1 4.43Å; V125-L204 HydrophobicContact CG2-CD1 4.01Å; V125-L204 HydrophobicContact CG2-CD2 4.5Å; V125-I255 HydrophobicContact CG2-CD1 3.96Å
126	S	95.3	Very high	94.3	Very high	17 Å²	17	42.6 Å²	42.6	12%	0.119	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-30.2	-179.5	-56.3	0	0	0	0	112.3	C122 E123 L128 G129 A136	C122-S126 WeakPolarHBondContact O-CB 3.27Å; C122-S126 PolarHBondContact O-N 3.34Å; C122-S126 PolarHBondContact O-OG 2.94Å; E123-S126 PolarHBondContact O-N 3.39Å; S126-L128 PolarHBondContact O-N 3.07Å; S126-L128 VanDerWaalsContact O-N 3.16Å; S126-G129 PolarHBondContact O-N 3.25Å; S126-A136 PolarHBondContact OG-N 3.28Å
127	S	93.8	Very high	94.3	Very high	85 Å²	85	38.4 Å²	38.4	59%	0.594	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.9	176.2	78.9	0	0	0	0	113.6	E123 K124 V125 G129	E123-S127 WeakPolarHBondContact O-CB 3.36Å; E123-S127 PolarHBondContact O-N 3.14Å; K124-S127 PolarHBondContact O-OG 3.46Å; V125-S127 PolarHBondContact O-N 2.89Å; S127-G129 PolarHBondContact O-N 3.46Å
128	L	92.8	Very high	94.3	Very high	29 Å²	29	37.2 Å²	37.2	15%	0.152	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-6.7	173.6	-55.2	175.9	0	0	0	113.2	V47 L50 I65 F68 V125 S126 V130 L204	V47-L128 PolarHBondContact N-O 2.83Å; L50-L128 HydrophobicContact CD1-CB 3.96Å; L50-L128 HydrophobicContact CD2-CD1 4.4Å; I65-L128 HydrophobicContact CD1-CD1 4.27Å; F68-L128 HydrophobicContact CE2-CD1 3.94Å; F68-L128 HydrophobicContact CZ-CD1 4.19Å; V125-L128 VanDerWaalsContact O-CB 3.28Å; V125-L128 WeakPolarHBondContact O-CB 3.33Å; V125-L128 WeakPolarHBondContact O-CG 3.14Å; V125-L128 PolarHBondContact O-N 3.48Å; V125-L128 VanDerWaalsContact O-N 3.13Å; S126-L128 PolarHBondContact O-N 3.07Å; S126-L128 VanDerWaalsContact O-N 3.16Å; L128-V130 HydrophobicContact CB-CG1 3.9Å; L128-V130 PolarHBondContact O-N 2.64Å; L128-L204 HydrophobicContact CD1-CD2 3.48Å; L128-L204 VanDerWaalsContact CD1-CD2 3.48Å
129	G	91.9	Very high	94.3	Very high	8 Å²	8	37.2 Å²	37.2	8%	0.082	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	4.2	-179.5	0	0	0	0	0	114.6	S126 S127 F131 G132	S126-G129 PolarHBondContact O-N 3.25Å; S127-G129 PolarHBondContact O-N 3.46Å; G129-F131 PolarHBondContact O-N 3.34Å; G129-F131 VanDerWaalsContact O-N 3.08Å; G129-G132 PolarHBondContact O-N 3.06Å
130	V	91.2	Very high	94.3	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.3	-173.1	-62	0	0	0	0	114.1	L50 V125 L128 T162 V206 Q208	L50-V130 HydrophobicContact CD1-CG1 3.53Å; V125-V130 HydrophobicContact CG1-CG2 3.91Å; L128-V130 HydrophobicContact CB-CG1 3.9Å; L128-V130 PolarHBondContact O-N 2.64Å; V130-T162 HydrophobicContact CB-CG2 4.12Å; V130-T162 HydrophobicContact CG2-CG2 4.41Å; V130-T162 WeakPolarHBondContact O-CG2 3.09Å; V130-T162 PolarHBondContact O-OG1 3.18Å; V130-V206 HydrophobicContact CB-CG1 4.13Å; V130-V206 HydrophobicContact CG1-CG1 3.94Å; V130-V206 HydrophobicContact CG1-CG2 4.29Å; V130-Q208 PolarHBondContact O-NE2 2.91Å; V130-Q208 VanDerWaalsContact O-NE2 3.14Å
131	F	91.6	Very high	94.4	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	21.2	175.8	-53.8	-60.4	0	0	0	113.4	V125 G129 G133 K134 A136 T162 I255 H257	V125-F131 HydrophobicContact CG1-CE2 3.8Å; V125-F131 HydrophobicContact CG1-CZ 4.08Å; G129-F131 PolarHBondContact O-N 3.34Å; G129-F131 VanDerWaalsContact O-N 3.08Å; F131-G133 PolarHBondContact O-N 3.35Å; F131-K134 HydrophobicContact CB-CB 4.29Å; F131-K134 WeakPolarHBondContact CB-O 3.21Å; F131-K134 WeakPolarHBondContact O-CB 3.32Å; F131-K134 WeakPolarHBondContact O-CG 3.16Å; F131-K134 PolarHBondContact O-N 2.75Å; F131-A136 HydrophobicContact CD2-CB 4.17Å; F131-A136 HydrophobicContact CE2-CB 3.65Å; F131-A136 HydrophobicContact CZ-CB 4.15Å; F131-T162 HydrophobicContact CD1-CG2 4.1Å; F131-T162 HydrophobicContact CE1-CG2 3.92Å; F131-I255 HydrophobicContact CE2-CG2 4.49Å; F131-I255 HydrophobicContact CZ-CG2 4.37Å; F131-H257 HydrophobicContact CB-CB 4.28Å; F131-H257 HydrophobicContact CD1-CB 4.08Å; F131-H257 HydrophobicContact CG-CB 4.13Å
132	G	88.3	Confident	94.5	Very high	26 Å²	26	31 Å²	31	27%	0.268	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	43.5	176.6	0	0	0	0	0	113.3	G129 K134	G129-G132 PolarHBondContact O-N 3.06Å; G132-K134 VanDerWaalsContact C-N 3.29Å; G132-K134 PolarHBondContact O-N 2.69Å
133	G	87.1	Confident	94.5	Very high	68 Å²	68	31.2 Å²	31.2	70%	0.701	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.1	4.8	-178.5	0	0	0	0	0	115.4	F131	F131-G133 PolarHBondContact O-N 3.35Å
134	K	90.5	Very high	94.6	Very high	89 Å²	89	27.3 Å²	27.3	39%	0.387	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-93.3	155.3	175.2	-54.9	173.5	-169.1	162.8	0	110.8	F131 G132 H257	F131-K134 HydrophobicContact CB-CB 4.29Å; F131-K134 WeakPolarHBondContact CB-O 3.21Å; F131-K134 WeakPolarHBondContact O-CB 3.32Å; F131-K134 WeakPolarHBondContact O-CG 3.16Å; F131-K134 PolarHBondContact O-N 2.75Å; G132-K134 VanDerWaalsContact C-N 3.29Å; G132-K134 PolarHBondContact O-N 2.69Å; K134-H257 WeakPolarHBondContact CD-NE2 3.24Å
135	T	93	Very high	94.7	Very high	86 Å²	86	29 Å²	29	53%	0.528	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-93.7	133.1	174.8	-46.8	0	0	0	0	110.6	H257	T135-H257 PolarHBondContact O-ND1 3.17Å
136	A	96.4	Very high	94.8	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.033	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-57.7	139.9	169.5	0	0	0	0	0	111.2	C122 S126 F131 I255 R256	C122-A136 HydrophobicContact CB-CB 3.91Å; S126-A136 PolarHBondContact OG-N 3.28Å; F131-A136 HydrophobicContact CD2-CB 4.17Å; F131-A136 HydrophobicContact CE2-CB 3.65Å; F131-A136 HydrophobicContact CZ-CB 4.15Å; A136-I255 HydrophobicContact CB-CG2 3.36Å; A136-R256 WeakPolarHBondContact CA-O 3.35Å; A136-R256 WeakPolarHBondContact CB-O 3.37Å
137	N	95.9	Very high	94.9	Very high	37 Å²	37	31.9 Å²	31.9	20%	0.198	20%	0.203	C	C	.	.			trans	-136.3	6.2	-173.1	64	0	0	0	0	113	G101 R256 V258	G101-N137 WeakPolarHBondContact CA-O 3.19Å; N137-R256 PolarHBondContact N-O 2.91Å; N137-V258 PolarHBondContact ND2-O 3.32Å; N137-V258 PolarHBondContact OD1-N 3.28Å
138	H	97.1	Very high	95.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	136.4	-179.7	-175.9	-104.8	0	0	0	110.3	N99 W100 M109 Y159 R256 V258	N99-H138 PolarHBondContact ND2-NE2 2.87Å; N99-H138 PolarHBondContact OD1-NE2 2.68Å; W100-H138 WeakPolarHBondContact O-CA 3.45Å; W100-H138 PolarHBondContact O-CD2 2.87Å; W100-H138 VanDerWaalsContact O-CD2 3.25Å; M109-H138 HydrophobicContact CE-CB 4.19Å; M109-H138 HydrophobicContact SD-CB 3.93Å; M109-H138 PolarHBondContact SD-CD2 2.94Å; H138-Y159 AromaticContact ND1-CE1 3.69Å; H138-R256 PolarHBondContact N-O 3.13Å; H138-R256 VanDerWaalsContact N-O 3.17Å; H138-R256 PolarHBondContact O-N 3.47Å; H138-V258 HydrophobicContact CB-CG2 3.83Å
139	V	98.3	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128.9	179.1	-170.7	0	0	0	0	110.5	W100 L114 L118 C122 V141 L253 T254 I255	W100-V139 HydrophobicContact CB-CB 4.37Å; W100-V139 PolarHBondContact N-O 3.31Å; W100-V139 PolarHBondContact O-N 2.87Å; L114-V139 HydrophobicContact CD2-CG2 4.27Å; L118-V139 HydrophobicContact CB-CG2 4.46Å; L118-V139 HydrophobicContact CD1-CB 4.2Å; L118-V139 HydrophobicContact CD1-CG2 4.47Å; L118-V139 HydrophobicContact CD2-CB 4.2Å; L118-V139 HydrophobicContact CD2-CG1 3.83Å; L118-V139 HydrophobicContact CD2-CG2 4.2Å; C122-V139 VanDerWaalsContact SG-CG2 3.59Å; V139-V141 HydrophobicContact CG1-CG2 4.41Å; V139-L253 HydrophobicContact CG1-CB 4.24Å; V139-T254 WeakPolarHBondContact CA-O 3.28Å; V139-I255 HydrophobicContact CG1-CG1 4.02Å; V139-I255 HydrophobicContact CG2-CG1 4Å
140	L	97.8	Very high	95.5	Very high	24 Å²	24	28.8 Å²	28.8	13%	0.126	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.1	167.9	-66.3	-177.8	0	0	0	109.3	L97 Q98 N99 T254	L97-L140 HydrophobicContact CD1-CB 4.01Å; L97-L140 HydrophobicContact CD1-CD2 4.2Å; Q98-L140 WeakPolarHBondContact O-CA 3.3Å; N99-L140 HydrophobicContact CB-CD2 4.03Å; L140-T254 PolarHBondContact N-O 2.78Å; L140-T254 PolarHBondContact O-N 3.44Å
141	V	98.6	Very high	95.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	113	174.6	-177.5	0	0	0	0	108.6	V81 L97 Q98 W117 V139 V251 S252 L253	V81-V141 HydrophobicContact CG1-CG1 3.85Å; V81-V141 HydrophobicContact CG2-CG1 3.92Å; L97-V141 CarbonylContact C-O 3.43Å; L97-V141 VanDerWaalsContact CA-O 3.29Å; L97-V141 WeakPolarHBondContact CA-O 3.44Å; Q98-V141 HydrophobicContact CB-CB 3.96Å; Q98-V141 HydrophobicContact CB-CG2 4.44Å; Q98-V141 HydrophobicContact CG-CB 4.14Å; Q98-V141 PolarHBondContact N-O 2.89Å; Q98-V141 PolarHBondContact O-N 3.12Å; W117-V141 HydrophobicContact CH2-CG2 4.37Å; V139-V141 HydrophobicContact CG1-CG2 4.41Å; V141-V251 HydrophobicContact CG1-CG1 3.68Å; V141-S252 CarbonylContact C-O 3.49Å; V141-S252 VanDerWaalsContact CA-O 3.27Å; V141-S252 WeakPolarHBondContact CA-O 3.23Å; V141-L253 HydrophobicContact CG2-CG 4.39Å
142	N	98.4	Very high	95.8	Very high	12 Å²	12	35.5 Å²	35.5	6%	0.064	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.1	176.6	-65.3	-94	0	0	0	110.3	R95 R96 L97 Y144 V251 S252	R95-N142 PolarHBondContact NE-OD1 3.3Å; R96-N142 WeakPolarHBondContact O-CA 3.33Å; L97-N142 VanDerWaalsContact CD1-OD1 3.3Å; L97-N142 WeakPolarHBondContact CD1-OD1 3.5Å; N142-Y144 HydrophobicContact CB-CD2 4.28Å; N142-Y144 HydrophobicContact CB-CE2 3.42Å; N142-Y144 VanDerWaalsContact CB-CE2 3.42Å; N142-V251 CarbonylContact O-C 3.59Å; N142-V251 VanDerWaalsContact O-CA 3.29Å; N142-V251 WeakPolarHBondContact O-CA 3.4Å; N142-S252 PolarHBondContact N-O 3.22Å; N142-S252 PolarHBondContact O-N 2.98Å; N142-S252 PolarHBondContact O-OG 3.01Å
143	E	98.6	Very high	96	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.028	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.8	169.3	-178.9	-166.3	70.1	0	0	110	Y82 W89 R95 R96 T249 R250 V251	Y82-E143 WeakPolarHBondContact CE1-OE2 3.12Å; Y82-E143 VanDerWaalsContact CZ-OE2 3.31Å; Y82-E143 PolarHBondContact OH-OE2 3.48Å; W89-E143 HydrophobicContact CH2-CB 4.08Å; W89-E143 HydrophobicContact CZ3-CB 4Å; R95-E143 WeakPolarHBondContact CB-O 3.35Å; R96-E143 IonicContact CZ-OE1 2.79Å; R96-E143 PolarHBondContact N-O 2.84Å; R96-E143 IonicContact NE-OE1 3.87Å; R96-E143 PolarHBondContact NE-OE1 2.91Å; R96-E143 VanDerWaalsContact NH2-CD 3.31Å; R96-E143 IonicContact NH2-OE1 3.65Å; R96-E143 PolarHBondContact NH2-OE1 2.85Å; R96-E143 IonicContact NH2-OE2 3.64Å; R96-E143 PolarHBondContact NH2-OE2 2.84Å; R96-E143 PolarHBondContact O-N 2.77Å; E143-T249 HydrophobicContact CG-CG2 3.85Å; E143-R250 WeakPolarHBondContact CA-O 3.43Å; E143-V251 HydrophobicContact CB-CG2 4.38Å; E143-V251 HydrophobicContact CG-CG2 4.32Å
144	Y	98.5	Very high	96.1	Very high	16 Å²	16	35.1 Å²	35.1	6%	0.063	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.3	173.1	-56.2	-95.5	0	0	0	109.3	R95 N142 E148 I150 I219 T249 R250	R95-Y144 HydrophobicContact CB-CD1 3.94Å; R95-Y144 HydrophobicContact CB-CE1 3.93Å; R95-Y144 VanDerWaalsContact CD-CZ 3.45Å; R95-Y144 WeakPolarHBondContact CD-OH 3.46Å; R95-Y144 HydrophobicContact CG-CE1 4.27Å; N142-Y144 HydrophobicContact CB-CD2 4.28Å; N142-Y144 HydrophobicContact CB-CE2 3.42Å; N142-Y144 VanDerWaalsContact CB-CE2 3.42Å; Y144-E148 WeakPolarHBondContact CA-OE2 3.07Å; Y144-E148 HydrophobicContact CD1-CB 4.45Å; Y144-I150 HydrophobicContact CE1-CB 4.26Å; Y144-I150 HydrophobicContact CE1-CG2 4.33Å; Y144-I219 HydrophobicContact CE1-CD1 4.17Å; Y144-I219 HydrophobicContact CE2-CD1 4.11Å; Y144-T249 CarbonylContact O-C 3.59Å; Y144-T249 WeakPolarHBondContact O-CA 3.32Å; Y144-R250 PolarHBondContact N-O 3.09Å; Y144-R250 PolarHBondContact O-N 2.65Å
145	K	98.3	Very high	95.7	Very high	100 Å²	100	32.1 Å²	32.1	44%	0.435	17%	0.174	S	C	.	.			trans	-80.4	167.4	166.8	-65	177.3	-177.5	173.2	0	110.6	G147 E148	K145-G147 PolarHBondContact O-N 2.71Å; K145-E148 HydrophobicContact CB-CG 4.13Å; K145-E148 WeakPolarHBondContact CB-OE2 3.34Å; K145-E148 PolarHBondContact N-OE2 2.87Å; K145-E148 VanDerWaalsContact O-CB 3.3Å; K145-E148 WeakPolarHBondContact O-CB 3.17Å; K145-E148 PolarHBondContact O-N 2.85Å
146	P	98.3	Very high	95.1	Very high	54 Å²	54	29 Å²	29	35%	0.351	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	134.4	168	-25.6	36	0	0	0	110.9	E148 D223 R247	P146-E148 VanDerWaalsContact C-N 3.27Å; P146-E148 PolarHBondContact O-N 2.96Å; P146-D223 WeakPolarHBondContact CB-OD1 3.39Å; P146-R247 WeakPolarHBondContact CG-O 3.04Å
147	G	97.7	Very high	94.3	Very high	25 Å²	25	33 Å²	33	26%	0.258	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-16.4	-177.2	0	0	0	0	0	114.7	K145 N221 R222 D223	K145-G147 PolarHBondContact O-N 2.71Å; G147-N221 CarbonylContact O-C 3.55Å; G147-N221 WeakPolarHBondContact O-CA 3.24Å; G147-N221 VanDerWaalsContact O-CB 3.24Å; G147-N221 WeakPolarHBondContact O-CB 3.44Å; G147-R222 WeakPolarHBondContact CA-O 3.44Å; G147-R222 PolarHBondContact N-O 2.54Å; G147-D223 WeakPolarHBondContact CA-OD1 3.09Å; G147-D223 PolarHBondContact N-OD1 3.42Å
148	E	97.9	Very high	93.5	Very high	40 Å²	40	33.4 Å²	33.4	19%	0.187	19%	0.186	C	C	.	.			trans	-84.7	156.7	178.5	-70	-175.5	166.7	0	0	112.4	S94 Y144 K145 P146	S94-E148 WeakPolarHBondContact O-CB 3.47Å; S94-E148 WeakPolarHBondContact O-CG 3.27Å; Y144-E148 WeakPolarHBondContact CA-OE2 3.07Å; Y144-E148 HydrophobicContact CD1-CB 4.45Å; K145-E148 HydrophobicContact CB-CG 4.13Å; K145-E148 WeakPolarHBondContact CB-OE2 3.34Å; K145-E148 PolarHBondContact N-OE2 2.87Å; K145-E148 VanDerWaalsContact O-CB 3.3Å; K145-E148 WeakPolarHBondContact O-CB 3.17Å; K145-E148 PolarHBondContact O-N 2.85Å; P146-E148 VanDerWaalsContact C-N 3.27Å; P146-E148 PolarHBondContact O-N 2.96Å
149	G	96.8	Very high	92.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.			trans	-165.9	-166.5	-174.2	0	0	0	0	0	112.9	S94 I219 N221	S94-G149 PolarHBondContact OG-O 2.91Å; G149-I219 CarbonylContact C-O 3.56Å; G149-I219 WeakPolarHBondContact CA-O 3.32Å; G149-N221 WeakPolarHBondContact CA-OD1 3.38Å; G149-N221 PolarHBondContact N-OD1 2.84Å; G149-N221 VanDerWaalsContact N-OD1 3.08Å
150	I	95.6	Very high	91.8	Very high	16 Å²	16	35.4 Å²	35.4	8%	0.082	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	132.9	175.7	-172.9	171.9	0	0	0	108.5	R95 Y144 H153 G218 I219	R95-I150 VanDerWaalsContact NH2-CD1 3.29Å; Y144-I150 HydrophobicContact CE1-CB 4.26Å; Y144-I150 HydrophobicContact CE1-CG2 4.33Å; I150-H153 WeakPolarHBondContact CD1-CE1 2.92Å; I150-G218 CarbonylContact O-C 3.49Å; I150-G218 WeakPolarHBondContact O-CA 3.11Å; I150-I219 HydrophobicContact CG2-CB 4.05Å; I150-I219 HydrophobicContact CG2-CD1 4.31Å; I150-I219 HydrophobicContact CG2-CG1 4.13Å; I150-I219 PolarHBondContact N-O 3.29Å; I150-I219 PolarHBondContact O-N 2.98Å; I150-I219 VanDerWaalsContact O-O 3.04Å
151	M	94.3	Very high	91.2	Very high	125 Å²	125	34.6 Å²	34.6	62%	0.616	19%	0.191	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	157.9	177.9	62.9	-172.2	-74.8	0	0	112	H153	M151-H153 PolarHBondContact O-N 3.44Å; M151-H153 PolarHBondContact O-ND1 3.23Å
152	A	94.6	Very high	90.8	Very high	18 Å²	18	34.7 Å²	34.7	15%	0.149	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	121.8	177.4	0	0	0	0	0	110.2	Y177 L216 H217	A152-Y177 HydrophobicContact CB-CD2 3.76Å; A152-Y177 HydrophobicContact CB-CE2 4.06Å; A152-Y177 HydrophobicContact CB-CG 4.45Å; A152-L216 HydrophobicContact CB-CB 4.04Å; A152-H217 CarbonylContact C-O 3.59Å; A152-H217 VanDerWaalsContact CA-O 3.29Å; A152-H217 WeakPolarHBondContact CA-O 3.08Å
153	H	91.8	Very high	90.4	Very high	40 Å²	40	34.4 Å²	34.4	19%	0.185	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	169.8	-174.3	66.1	-65.8	0	0	0	111.6	I150 M151 L216 H217	I150-H153 WeakPolarHBondContact CD1-CE1 2.92Å; M151-H153 PolarHBondContact O-N 3.44Å; M151-H153 PolarHBondContact O-ND1 3.23Å; H153-L216 WeakPolarHBondContact O-CA 3.45Å; H153-H217 AromaticContact CE1-CD2 3.72Å; H153-H217 AromaticContact CE1-NE2 3.55Å; H153-H217 PolarHBondContact CE1-O 2.84Å; H153-H217 PolarHBondContact N-O 2.98Å; H153-H217 PolarHBondContact ND1-O 3.08Å; H153-H217 AromaticContact NE2-NE2 3.54Å; H153-H217 PolarHBondContact O-N 3.28Å; H153-H217 PolarHBondContact O-ND1 2.89Å
154	E	89.4	Confident	90.3	Very high	45 Å²	45	34.1 Å²	34.1	21%	0.21	19%	0.189	C	C	.	.			trans	-104.8	158.4	169.4	-86.6	159.6	-141.2	0	0	110.1	L216	E154-L216 HydrophobicContact CG-CD2 3.89Å
155	D	81.8	Confident	90.3	Very high	27 Å²	27	34 Å²	34	14%	0.144	19%	0.19	C	C	.	.			trans	-84.4	-14.2	179.8	-84.7	-38.8	0	0	0	115	Y159 V163 Y212 H217 R256	D155-Y159 WeakPolarHBondContact O-CE2 3.47Å; D155-V163 WeakPolarHBondContact OD2-CG2 3.38Å; D155-Y212 HydrophobicContact CB-CD2 4.48Å; D155-Y212 HydrophobicContact CB-CE2 3.61Å; D155-H217 IonicContact OD1-CE1 3.96Å; D155-H217 IonicContact OD1-NE2 3.6Å; D155-H217 IonicContact OD2-CE1 3.95Å; D155-H217 PolarHBondContact OD2-CE1 2.95Å; D155-H217 IonicContact OD2-NE2 2.95Å; D155-R256 IonicContact OD1-CZ 3.86Å; D155-R256 IonicContact OD1-NH1 2.74Å; D155-R256 PolarHBondContact OD1-NH1 3.37Å; D155-R256 IonicContact OD1-NH2 3.21Å; D155-R256 PolarHBondContact OD1-NH2 3.31Å; D155-R256 IonicContact OD2-CZ 3.49Å; D155-R256 IonicContact OD2-NH1 3.12Å; D155-R256 IonicContact OD2-NH2 3.38Å; D155-R256 PolarHBondContact OD2-NH2 3.19Å
156	G	80.8	Confident	90.4	Very high	20 Å²	20	29.3 Å²	29.3	21%	0.206	17%	0.17	C	C	.	.			trans	78	165.8	178.3	0	0	0	0	0	115	L158 Y212	G156-L158 VanDerWaalsContact C-N 3.26Å; G156-L158 PolarHBondContact O-N 3.25Å; G156-L158 VanDerWaalsContact O-N 3.14Å; G156-Y212 PolarHBondContact O-OH 3.29Å
157	P	80	Confident	90.4	Very high	88 Å²	88	26.7 Å²	26.7	57%	0.571	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	1.9	-165.6	32.1	-38.9	0	0	0	115.5	F32 Y159	F32-P157 HydrophobicContact CD2-CB 3.53Å; F32-P157 HydrophobicContact CE2-CB 4.06Å; F32-P157 HydrophobicContact CG-CB 4.29Å; P157-Y159 VanDerWaalsContact C-N 3.26Å; P157-Y159 PolarHBondContact O-N 3.35Å
158	L	79.7	Confident	90.4	Very high	46 Å²	46	25.5 Å²	25.5	24%	0.241	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.1	-172.9	-178.8	61.5	0	0	0	113.1	P104 G156 V258 P259	P104-L158 HydrophobicContact CB-CD2 3.6Å; P104-L158 HydrophobicContact CG-CD2 4.05Å; G156-L158 VanDerWaalsContact C-N 3.26Å; G156-L158 PolarHBondContact O-N 3.25Å; G156-L158 VanDerWaalsContact O-N 3.14Å; L158-V258 HydrophobicContact CD1-CG1 4.08Å; L158-V258 HydrophobicContact CG-CG1 4.14Å; L158-P259 WeakPolarHBondContact O-CD 3.2Å
159	Y	80.5	Confident	90.5	Very high	19 Å²	19	25.5 Å²	25.5	8%	0.075	15%	0.151	C	C	.	.	S	Bend	trans	-102.3	159.7	-166.8	-54.2	-74.9	0	0	0	111.9	H138 D155 P157 R256 V258	H138-Y159 AromaticContact ND1-CE1 3.69Å; D155-Y159 WeakPolarHBondContact O-CE2 3.47Å; P157-Y159 VanDerWaalsContact C-N 3.26Å; P157-Y159 PolarHBondContact O-N 3.35Å; Y159-R256 HydrophobicContact CD1-CB 3.63Å; Y159-R256 HydrophobicContact CD1-CG 4.11Å; Y159-R256 HydrophobicContact CE1-CB 4.15Å; Y159-R256 HydrophobicContact CE1-CG 4.49Å; Y159-R256 HydrophobicContact CG-CB 4.28Å; Y159-R256 VanDerWaalsContact CG-CD 3.44Å; Y159-R256 HydrophobicContact CG-CG 4.43Å; Y159-V258 HydrophobicContact CD1-CG2 3.63Å; Y159-V258 HydrophobicContact CE1-CG2 3.69Å
160	H	78.9	Confident	90.6	Very high	23 Å²	23	26 Å²	26	11%	0.106	15%	0.154	C	C	.	.			trans	-51.1	143.6	156.6	-170.5	-84.9	0	0	0	109	T162 H257	H160-T162 PolarHBondContact ND1-OG1 3.29Å; H160-T162 PolarHBondContact O-N 2.91Å; H160-H257 HydrophobicContact CB-CB 4.06Å; H160-H257 PolarHBondContact N-O 2.87Å
161	P	85.2	Confident	90.7	Very high	6 Å²	6	26 Å²	26	4%	0.039	15%	0.154	C	C	.	.	S	Bend	trans	-74.1	57.1	-176.8	28.5	-33	0	0	0	112.8	M40 Y212	M40-P161 HydrophobicContact CE-CB 4.35Å; M40-P161 HydrophobicContact CE-CG 3.99Å; M40-P161 HydrophobicContact SD-CB 4.27Å; M40-P161 HydrophobicContact SD-CG 3.3Å; M40-P161 WeakPolarHBondContact SD-CG 3.44Å; P161-Y212 VanDerWaalsContact CA-CD1 3.46Å; P161-Y212 HydrophobicContact CB-CD1 3.74Å; P161-Y212 HydrophobicContact CB-CE1 3.86Å
162	T	89.1	Confident	90.9	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.012	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	127.5	179.4	-58.2	0	0	0	0	108.3	V130 F131 H160 V206 L207 Q208	V130-T162 HydrophobicContact CB-CG2 4.12Å; V130-T162 HydrophobicContact CG2-CG2 4.41Å; V130-T162 WeakPolarHBondContact O-CG2 3.09Å; V130-T162 PolarHBondContact O-OG1 3.18Å; F131-T162 HydrophobicContact CD1-CG2 4.1Å; F131-T162 HydrophobicContact CE1-CG2 3.92Å; H160-T162 PolarHBondContact ND1-OG1 3.29Å; H160-T162 PolarHBondContact O-N 2.91Å; T162-V206 HydrophobicContact CG2-CG1 3.86Å; T162-L207 WeakPolarHBondContact CA-O 3.45Å; T162-Q208 HydrophobicContact CG2-CG 3.84Å; T162-Q208 PolarHBondContact OG1-NE2 2.79Å
163	V	91.4	Very high	91.1	Very high	6 Å²	6	19.5 Å²	19.5	4%	0.036	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.3	172.5	176	0	0	0	0	107.8	D155 V206 L207 Y212 T254	D155-V163 WeakPolarHBondContact OD2-CG2 3.38Å; V163-V206 CarbonylContact O-C 3.51Å; V163-V206 WeakPolarHBondContact O-CA 3.36Å; V163-L207 PolarHBondContact N-O 3.36Å; V163-L207 PolarHBondContact O-N 3.47Å; V163-Y212 HydrophobicContact CB-CD2 4.29Å; V163-Y212 HydrophobicContact CG2-CD2 3.26Å; V163-Y212 HydrophobicContact CG2-CE2 3.23Å; V163-Y212 HydrophobicContact CG2-CG 4.47Å; V163-T254 HydrophobicContact CG1-CG2 3.86Å
164	S	96.8	Very high	91.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.8	173.6	70.8	0	0	0	0	109.6	V125 L205 T254 I255	V125-S164 WeakPolarHBondContact CG1-OG 3.39Å; S164-L205 CarbonylContact C-O 3.5Å; S164-L205 VanDerWaalsContact CA-O 3.26Å; S164-L205 WeakPolarHBondContact CA-O 3.28Å; S164-T254 CarbonylContact O-C 3.45Å; S164-T254 WeakPolarHBondContact O-CA 3.16Å; S164-I255 PolarHBondContact N-O 3.09Å; S164-I255 PolarHBondContact O-N 3.13Å; S164-I255 WeakPolarHBondContact OG-CB 3.27Å; S164-I255 PolarHBondContact OG-O 2.73Å
165	T	98.4	Very high	91.8	Very high	14 Å²	14	16.5 Å²	16.5	9%	0.086	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	116.1	-176.9	-56.9	0	0	0	0	110.7	N167 L204 L205 L253	T165-N167 PolarHBondContact O-ND2 3.49Å; T165-L204 WeakPolarHBondContact O-CA 3.19Å; T165-L205 PolarHBondContact N-O 2.82Å; T165-L205 PolarHBondContact O-N 3Å; T165-L253 WeakPolarHBondContact CA-O 3.41Å
166	I	98.8	Very high	92.6	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.3	167.1	-58.2	174.6	0	0	0	107.8	F68 I69 C121 V125 L168 L204 S252 L253 I255	F68-I166 HydrophobicContact CD1-CD1 4.25Å; F68-I166 HydrophobicContact CD1-CG1 4.19Å; F68-I166 HydrophobicContact CE1-CD1 3.94Å; F68-I166 HydrophobicContact CE1-CG1 4.2Å; I69-I166 HydrophobicContact CD1-CG2 3.92Å; I69-I166 HydrophobicContact CG1-CG2 4.37Å; I69-I166 HydrophobicContact CG2-CG2 4.37Å; C121-I166 HydrophobicContact CB-CD1 4.24Å; V125-I166 HydrophobicContact CG2-CD1 4.13Å; V125-I166 HydrophobicContact CG2-CG1 4.43Å; I166-L168 HydrophobicContact CG2-CD2 3.94Å; I166-L204 HydrophobicContact CG1-CD1 3.73Å; I166-S252 WeakPolarHBondContact O-CA 3.46Å; I166-L253 HydrophobicContact CB-CB 4.34Å; I166-L253 PolarHBondContact N-O 2.87Å; I166-L253 PolarHBondContact O-N 2.95Å; I166-I255 HydrophobicContact CD1-CD1 3.8Å; I166-I255 HydrophobicContact CG1-CD1 4.23Å
167	N	98.8	Very high	93.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.2	-177.4	-62	-80.9	0	0	0	110.3	T165 R200 P201 R202 S203 R250	T165-N167 PolarHBondContact O-ND2 3.49Å; N167-R200 VanDerWaalsContact CB-O 3.28Å; N167-R200 WeakPolarHBondContact CB-O 3.22Å; N167-P201 CarbonylContact O-C 3.57Å; N167-R202 WeakPolarHBondContact O-CA 3.23Å; N167-R202 PolarHBondContact O-N 3.48Å; N167-S203 PolarHBondContact N-O 3.37Å; N167-S203 PolarHBondContact ND2-O 3.43Å; N167-S203 PolarHBondContact ND2-OG 2.98Å; N167-R250 PolarHBondContact OD1-NE 2.94Å; N167-R250 PolarHBondContact OD1-NH2 2.96Å
168	L	98.9	Very high	93.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	152.8	-177.1	-50.6	179	0	0	0	111.5	I69 E74 L77 L78 I166 S170 V251 L253	I69-L168 HydrophobicContact CD1-CD2 3.32Å; E74-L168 HydrophobicContact CB-CD2 4.33Å; E74-L168 HydrophobicContact CG-CB 4.49Å; E74-L168 HydrophobicContact CG-CD2 4.12Å; E74-L168 WeakPolarHBondContact OE1-CA 3.46Å; L77-L168 HydrophobicContact CB-CD1 3.81Å; L77-L168 HydrophobicContact CD1-CD1 4.42Å; L77-L168 HydrophobicContact CD1-CD2 4.16Å; L78-L168 HydrophobicContact CD2-CB 3.87Å; L78-L168 HydrophobicContact CD2-CD1 4.1Å; L78-L168 HydrophobicContact CG-CB 4.22Å; L78-L168 HydrophobicContact CG-CD1 4.26Å; I166-L168 HydrophobicContact CG2-CD2 3.94Å; L168-S170 PolarHBondContact O-N 2.96Å; L168-V251 HydrophobicContact CB-CB 4.18Å; L168-V251 HydrophobicContact CD1-CG1 4.25Å; L168-V251 PolarHBondContact N-O 2.84Å; L168-V251 PolarHBondContact O-N 3.27Å; L168-L253 HydrophobicContact CD1-CD1 3.37Å; L168-L253 HydrophobicContact CG-CD1 4.04Å
169	G	98.6	Very high	94.4	Very high	39 Å²	39	17.8 Å²	17.8	40%	0.402	10%	0.095	S	C	.	.	S	Bend	trans	79.1	-73.2	170.4	0	0	0	0	0	113.6	E74	E74-G169 PolarHBondContact OE1-N 3Å
170	S	98.6	Very high	94.8	Very high	11 Å²	11	20.5 Å²	20.5	8%	0.077	11%	0.114	C	C	.	.	S	Bend	trans	-127.3	160.8	-178.6	178.2	0	0	0	0	111.5	L168 G248 T249 R250	L168-S170 PolarHBondContact O-N 2.96Å; S170-G248 WeakPolarHBondContact CB-O 3.37Å; S170-G248 PolarHBondContact OG-N 3.26Å; S170-T249 WeakPolarHBondContact CB-O 3.29Å; S170-T249 PolarHBondContact N-O 2.9Å; S170-R250 WeakPolarHBondContact O-CG 3.44Å
171	H	98.7	Very high	95.1	Very high	16 Å²	16	21.6 Å²	21.6	7%	0.074	12%	0.123	C	C	.	.			trans	-74	166.8	171	77.4	-75.1	0	0	0	112.8	L198 L199 D225 L245 S246	H171-L198 HydrophobicContact CB-CD1 4.16Å; H171-L199 CarbonylContact C-O 3.59Å; H171-L199 WeakPolarHBondContact CA-O 3.48Å; H171-L199 WeakPolarHBondContact CB-O 3.33Å; H171-D225 IonicContact CD2-OD2 3.17Å; H171-D225 IonicContact NE2-OD2 2.79Å; H171-L245 WeakPolarHBondContact CE1-CB 3.48Å; H171-L245 WeakPolarHBondContact NE2-CB 3.3Å; H171-S246 PolarHBondContact CE1-O 2.66Å
172	T	98.5	Very high	94.7	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.018	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	160.4	161.2	-168.1	0	0	0	0	110.3	L199 I219 R250	T172-L199 HydrophobicContact CG2-CB 4.2Å; T172-L199 HydrophobicContact CG2-CD1 4.19Å; T172-L199 HydrophobicContact CG2-CG 4.43Å; T172-L199 PolarHBondContact N-O 2.95Å; T172-L199 PolarHBondContact O-N 2.87Å; T172-I219 HydrophobicContact CG2-CD1 4.14Å; T172-I219 HydrophobicContact CG2-CG1 4.45Å; T172-I219 VanDerWaalsContact OG1-CG2 3.28Å; T172-I219 WeakPolarHBondContact OG1-CG2 3.35Å; T172-R250 VanDerWaalsContact CG2-NE 3.31Å
173	L	98.6	Very high	94.4	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	131.1	154.5	-66.4	-179.8	0	0	0	110.3	L197 L198 D225 L227 V231	L173-L197 WeakPolarHBondContact CA-O 3.35Å; L173-L198 HydrophobicContact CD2-CB 3.97Å; L173-L198 HydrophobicContact CD2-CD1 4.06Å; L173-D225 HydrophobicContact CD1-CB 3.86Å; L173-D225 HydrophobicContact CG-CB 3.89Å; L173-D225 PolarHBondContact N-OD2 2.91Å; L173-L227 HydrophobicContact CD2-CD2 4.1Å; L173-V231 HydrophobicContact CD1-CG2 4.36Å; L173-V231 HydrophobicContact CD2-CG1 3.99Å; L173-V231 HydrophobicContact CD2-CG2 3.88Å
174	L	98.4	Very high	93.8	Very high	15 Å²	15	40.8 Å²	40.8	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.9	166.1	-178.5	68.8	0	0	0	107.9	F176 S196 L197 L199 L205 L207 H217 I219	L174-F176 HydrophobicContact CB-CE2 4.44Å; L174-F176 HydrophobicContact CD2-CE2 3.83Å; L174-F176 HydrophobicContact CD2-CZ 3.6Å; L174-F176 HydrophobicContact CG-CE2 3.88Å; L174-F176 HydrophobicContact CG-CZ 4.06Å; L174-S196 CarbonylContact O-C 3.57Å; L174-S196 VanDerWaalsContact O-CA 3.22Å; L174-S196 WeakPolarHBondContact O-CA 3.16Å; L174-L197 PolarHBondContact N-O 3.18Å; L174-L197 PolarHBondContact O-N 3.04Å; L174-L199 HydrophobicContact CB-CD1 3.79Å; L174-L199 HydrophobicContact CB-CG 4.23Å; L174-L199 HydrophobicContact CD2-CD1 4.17Å; L174-L205 HydrophobicContact CD2-CD2 3.68Å; L174-L207 HydrophobicContact CD2-CD1 4.44Å; L174-H217 HydrophobicContact CD1-CB 4.17Å; L174-H217 HydrophobicContact CG-CB 4.42Å; L174-I219 HydrophobicContact CD1-CG1 4.1Å
175	D	98.1	Very high	93.1	Very high	6 Å²	6	42.8 Å²	42.8	3%	0.032	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.8	-174.8	-61	-24	0	0	0	110.8	Y177 Y193 S196 H217 G218 Q220	D175-Y177 HydrophobicContact CB-CD2 4.41Å; D175-Y177 HydrophobicContact CB-CE2 3.38Å; D175-Y177 VanDerWaalsContact CB-CZ 3.5Å; D175-Y177 VanDerWaalsContact CB-OH 3.22Å; D175-Y177 WeakPolarHBondContact CB-OH 3.1Å; D175-Y177 PolarHBondContact OD2-OH 2.89Å; D175-Y193 HydrophobicContact CB-CD2 4.36Å; D175-Y193 HydrophobicContact CB-CE2 4.02Å; D175-S196 WeakPolarHBondContact OD1-CB 3.19Å; D175-S196 PolarHBondContact OD1-OG 2.79Å; D175-H217 CarbonylContact O-C 3.34Å; D175-H217 WeakPolarHBondContact O-CA 3.44Å; D175-G218 PolarHBondContact N-O 3.05Å; D175-G218 PolarHBondContact O-N 2.9Å; D175-Q220 WeakPolarHBondContact OD2-CG 3.27Å
176	F	96.8	Very high	92.5	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.1	178.1	-68.5	-93.7	0	0	0	111.5	L174 L194 L195 L197 L207 M211 L215 L216 H217	L174-F176 HydrophobicContact CB-CE2 4.44Å; L174-F176 HydrophobicContact CD2-CE2 3.83Å; L174-F176 HydrophobicContact CD2-CZ 3.6Å; L174-F176 HydrophobicContact CG-CE2 3.88Å; L174-F176 HydrophobicContact CG-CZ 4.06Å; F176-L194 PolarHBondContact O-N 3.32Å; F176-L195 HydrophobicContact CB-CD1 4.43Å; F176-L195 HydrophobicContact CB-CG 4.43Å; F176-L195 HydrophobicContact CD2-CD1 3.7Å; F176-L195 HydrophobicContact CE2-CD1 4.38Å; F176-L195 HydrophobicContact CG-CD1 4.34Å; F176-L195 PolarHBondContact N-O 2.87Å; F176-L197 HydrophobicContact CD2-CG 4.49Å; F176-L197 HydrophobicContact CE2-CB 4.43Å; F176-L197 HydrophobicContact CE2-CD1 3.69Å; F176-L197 HydrophobicContact CE2-CG 3.84Å; F176-L197 HydrophobicContact CZ-CD1 4.11Å; F176-L207 HydrophobicContact CE1-CD1 3.87Å; F176-L207 HydrophobicContact CZ-CD1 3.64Å; F176-L207 HydrophobicContact CZ-CD2 4.06Å; F176-M211 HydrophobicContact CD1-CE 3.62Å; F176-M211 HydrophobicContact CD1-SD 4.47Å; F176-M211 HydrophobicContact CD2-CE 4.03Å; F176-M211 HydrophobicContact CE1-CE 3.39Å; F176-M211 HydrophobicContact CE2-CE 3.82Å; F176-M211 HydrophobicContact CG-CE 3.93Å; F176-M211 HydrophobicContact CZ-CE 3.49Å; F176-M211 VanDerWaalsContact CZ-CE 3.49Å; F176-L215 HydrophobicContact CB-CD1 4.29Å; F176-L215 HydrophobicContact CD1-CB 4.14Å; F176-L215 HydrophobicContact CD1-CD1 4.18Å; F176-L216 CarbonylContact C-O 3.48Å; F176-L216 WeakPolarHBondContact CA-O 3.29Å; F176-H217 HydrophobicContact CD1-CB 3.98Å; F176-H217 HydrophobicContact CE1-CB 3.83Å; F176-H217 HydrophobicContact CZ-CB 4.36Å
177	Y	95.4	Very high	92	Very high	5 Å²	5	51.2 Å²	51.2	2%	0.02	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.9	-175.2	-51.1	-96.6	0	0	0	110.5	A152 D175 Q189 R192 Y193 L216 Q220	A152-Y177 HydrophobicContact CB-CD2 3.76Å; A152-Y177 HydrophobicContact CB-CE2 4.06Å; A152-Y177 HydrophobicContact CB-CG 4.45Å; D175-Y177 HydrophobicContact CB-CD2 4.41Å; D175-Y177 HydrophobicContact CB-CE2 3.38Å; D175-Y177 VanDerWaalsContact CB-CZ 3.5Å; D175-Y177 VanDerWaalsContact CB-OH 3.22Å; D175-Y177 WeakPolarHBondContact CB-OH 3.1Å; D175-Y177 PolarHBondContact OD2-OH 2.89Å; Y177-Q189 HydrophobicContact CD1-CG 3.68Å; Y177-Q189 WeakPolarHBondContact CD1-O 3.42Å; Y177-Q189 HydrophobicContact CE1-CG 3.4Å; Y177-Q189 VanDerWaalsContact CZ-NE2 3.29Å; Y177-Q189 PolarHBondContact OH-NE2 3.13Å; Y177-R192 CarbonylContact C-O 3.51Å; Y177-R192 VanDerWaalsContact CA-O 3.28Å; Y177-R192 WeakPolarHBondContact CA-O 2.98Å; Y177-Y193 HydrophobicContact CD1-CD2 4.15Å; Y177-Y193 HydrophobicContact CD1-CG 4.49Å; Y177-Y193 AromaticContact CE1-CD2 3.7Å; Y177-Y193 HydrophobicContact CE1-CD2 3.7Å; Y177-Y193 HydrophobicContact CE1-CG 4.17Å; Y177-L216 PolarHBondContact N-O 2.85Å; Y177-L216 PolarHBondContact O-N 2.96Å; Y177-Q220 PolarHBondContact OH-NE2 2.87Å
178	R	93	Very high	91.6	Very high	148 Å²	148	55.4 Å²	55.4	56%	0.558	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-63.9	147.4	165.8	-66.7	-172.9	-179	128.8	5.3	110.4	R192 L194	R178-R192 HydrophobicContact CB-CB 4.36Å; R178-R192 PolarHBondContact N-O 3.14Å; R178-R192 WeakPolarHBondContact O-CD 3.46Å; R178-R192 PolarHBondContact O-NH1 3Å; R178-L194 HydrophobicContact CG-CD1 3.84Å; R178-L194 HydrophobicContact CG-CD2 3.85Å; R178-L194 HydrophobicContact CG-CG 4Å
179	P	90.7	Very high	91.1	Very high	55 Å²	55	59.1 Å²	59.1	36%	0.357	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-59.7	162.9	169	-23.3	34.9	0	0	0	112.1	C181 Q214	P179-C181 PolarHBondContact O-N 3.44Å; P179-Q214 WeakPolarHBondContact CD-O 3.5Å; P179-Q214 WeakPolarHBondContact CG-O 3.37Å
180	V	88.1	Confident	90.7	Very high	77 Å²	77	63.6 Å²	63.6	47%	0.467	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-73	126.3	174	177.3	0	0	0	0	109.1
181	C	86.1	Confident	90.5	Very high	45 Å²	45	66.5 Å²	66.5	30%	0.304	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-102.7	117	174.6	-172.4	0	0	0	0	110.1	P179 Q183 E184	P179-C181 PolarHBondContact O-N 3.44Å; C181-Q183 PolarHBondContact O-N 3.23Å; C181-E184 HydrophobicContact CB-CB 4.24Å; C181-E184 HydrophobicContact CB-CG 3.99Å; C181-E184 PolarHBondContact O-N 2.98Å
182	S	77.6	Confident	90.3	Very high	102 Å²	102	67 Å²	67	71%	0.713	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-64	-20.9	-179	54.5	0	0	0	0	113.9
183	Q	81.2	Confident	90.1	Very high	181 Å²	181	68.3 Å²	68.3	85%	0.846	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-83.6	-14.6	179.7	-62.7	-171.7	-23.9	0	0	113.5	C181	C181-Q183 PolarHBondContact O-N 3.23Å
184	E	79.1	Confident	90	Very high	135 Å²	135	70.5 Å²	70.5	63%	0.631	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-98	15.4	-174.1	-65.5	-172.9	161.1	0	0	113.6	C181 Q187	C181-E184 HydrophobicContact CB-CB 4.24Å; C181-E184 HydrophobicContact CB-CG 3.99Å; C181-E184 PolarHBondContact O-N 2.98Å; E184-Q187 PolarHBondContact OE2-NE2 2.86Å
185	G	82.5	Confident	89.9	Confident	42 Å²	42	70.7 Å²	70.7	43%	0.433	39%	0.387	S	S	.	.			trans	69.9	-165	-178.4	0	0	0	0	0	113.4	Q187	G185-Q187 PolarHBondContact O-N 3.31Å
186	P	85.6	Confident	89.9	Confident	143 Å²	143	70.5 Å²	70.5	93%	0.929	39%	0.386	S	S	*	.	S	Bend	trans	-65.6	120.2	-180	-21.3	33.3	0	0	0	112.3
187	Q	87.9	Confident	89.9	Confident	48 Å²	48	70.5 Å²	70.5	22%	0.224	39%	0.386	C	S	.	.			trans	-113.2	132.9	-179.6	-62.9	-179.1	-51.9	0	0	111.5	E184 G185 R192	E184-Q187 PolarHBondContact OE2-NE2 2.86Å; G185-Q187 PolarHBondContact O-N 3.31Å; Q187-R192 HydrophobicContact CB-CG 4.19Å
188	T	90.6	Very high	90.1	Very high	89 Å²	89	70.2 Å²	70.2	55%	0.546	39%	0.385	S	S	.	.			trans	-89.8	157.5	171.6	67.3	0	0	0	0	110.4	Q190 S191 R192	T188-Q190 PolarHBondContact O-N 3.26Å; T188-S191 PolarHBondContact N-OG 2.94Å; T188-S191 PolarHBondContact O-N 2.96Å; T188-S191 VanDerWaalsContact O-N 3.16Å; T188-S191 PolarHBondContact O-OG 2.78Å; T188-S191 WeakPolarHBondContact OG1-CB 3.46Å; T188-S191 PolarHBondContact OG1-N 3.47Å; T188-S191 VanDerWaalsContact OG1-N 3.14Å; T188-S191 PolarHBondContact OG1-OG 2.04Å; T188-R192 PolarHBondContact O-N 3.4Å
189	Q	88.9	Confident	90.4	Very high	77 Å²	77	63.2 Å²	63.2	36%	0.36	36%	0.359	S	S	.	.	H	α-helix	trans	-56.4	-40.1	173.5	-179.1	170.9	-16.3	0	0	112	Y177 S191 R192 Y193	Y177-Q189 HydrophobicContact CD1-CG 3.68Å; Y177-Q189 WeakPolarHBondContact CD1-O 3.42Å; Y177-Q189 HydrophobicContact CE1-CG 3.4Å; Y177-Q189 VanDerWaalsContact CZ-NE2 3.29Å; Y177-Q189 PolarHBondContact OH-NE2 3.13Å; Q189-S191 PolarHBondContact O-N 3.25Å; Q189-R192 PolarHBondContact O-N 2.94Å; Q189-Y193 PolarHBondContact O-N 3Å; Q189-Y193 VanDerWaalsContact O-N 3.14Å
190	Q	91.4	Very high	90.7	Very high	134 Å²	134	63.9 Å²	63.9	63%	0.626	35%	0.354	S	S	*	.	H	α-helix	trans	-63.7	-39.8	177.7	-172.7	60.8	33.3	0	0	112.5	T188 R192 Y193	T188-Q190 PolarHBondContact O-N 3.26Å; Q190-R192 PolarHBondContact O-N 3.35Å; Q190-Y193 WeakPolarHBondContact O-CB 3.48Å; Q190-Y193 PolarHBondContact O-N 3.38Å
191	S	92.9	Very high	91.3	Very high	72 Å²	72	61.6 Å²	61.6	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-65.8	-24.7	177.6	66.6	0	0	0	0	113.3	T188 Q189	T188-S191 PolarHBondContact N-OG 2.94Å; T188-S191 PolarHBondContact O-N 2.96Å; T188-S191 VanDerWaalsContact O-N 3.16Å; T188-S191 PolarHBondContact O-OG 2.78Å; T188-S191 WeakPolarHBondContact OG1-CB 3.46Å; T188-S191 PolarHBondContact OG1-N 3.47Å; T188-S191 VanDerWaalsContact OG1-N 3.14Å; T188-S191 PolarHBondContact OG1-OG 2.04Å; Q189-S191 PolarHBondContact O-N 3.25Å
192	R	94.6	Very high	91.9	Very high	26 Å²	26	61.7 Å²	61.7	10%	0.098	34%	0.335	C	S	.	.	H	α-helix	trans	-93.5	-7.9	178.6	-64	-175.2	-64.4	101.7	-6.1	113.6	Y177 R178 Q187 T188 Q189 Q190 L194	Y177-R192 CarbonylContact C-O 3.51Å; Y177-R192 VanDerWaalsContact CA-O 3.28Å; Y177-R192 WeakPolarHBondContact CA-O 2.98Å; R178-R192 HydrophobicContact CB-CB 4.36Å; R178-R192 PolarHBondContact N-O 3.14Å; R178-R192 WeakPolarHBondContact O-CD 3.46Å; R178-R192 PolarHBondContact O-NH1 3Å; Q187-R192 HydrophobicContact CB-CG 4.19Å; T188-R192 PolarHBondContact O-N 3.4Å; Q189-R192 PolarHBondContact O-N 2.94Å; Q190-R192 PolarHBondContact O-N 3.35Å; R192-L194 PolarHBondContact O-N 2.88Å
193	Y	95.5	Very high	92.9	Very high	30 Å²	30	56.9 Å²	56.9	12%	0.118	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	127.4	-178.3	173	-110.7	0	0	0	111.4	D175 Y177 Q189 Q190 L195 S196 R230	D175-Y193 HydrophobicContact CB-CD2 4.36Å; D175-Y193 HydrophobicContact CB-CE2 4.02Å; Y177-Y193 HydrophobicContact CD1-CD2 4.15Å; Y177-Y193 HydrophobicContact CD1-CG 4.49Å; Y177-Y193 AromaticContact CE1-CD2 3.7Å; Y177-Y193 HydrophobicContact CE1-CD2 3.7Å; Y177-Y193 HydrophobicContact CE1-CG 4.17Å; Q189-Y193 PolarHBondContact O-N 3Å; Q189-Y193 VanDerWaalsContact O-N 3.14Å; Q190-Y193 WeakPolarHBondContact O-CB 3.48Å; Q190-Y193 PolarHBondContact O-N 3.38Å; Y193-L195 VanDerWaalsContact CE2-O 3.28Å; Y193-L195 WeakPolarHBondContact CE2-O 3.2Å; Y193-S196 WeakPolarHBondContact CE2-OG 3.49Å; Y193-S196 PolarHBondContact OH-N 3.49Å; Y193-S196 PolarHBondContact OH-OG 2.61Å; Y193-R230 HydrophobicContact CE1-CB 4.13Å; Y193-R230 VanDerWaalsContact CE1-CD 3.5Å; Y193-R230 HydrophobicContact CE1-CG 4.49Å
194	L	95.1	Very high	93.7	Very high	50 Å²	50	48.2 Å²	48.2	26%	0.262	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-66.5	-178.1	-66.2	-178.8	0	0	0	111.2	F176 R178 R192 L215	F176-L194 PolarHBondContact O-N 3.32Å; R178-L194 HydrophobicContact CG-CD1 3.84Å; R178-L194 HydrophobicContact CG-CD2 3.85Å; R178-L194 HydrophobicContact CG-CG 4Å; R192-L194 PolarHBondContact O-N 2.88Å; L194-L215 HydrophobicContact CD1-CD1 4.01Å; L194-L215 HydrophobicContact CD1-CD2 3.5Å; L194-L215 VanDerWaalsContact CD1-CD2 3.5Å; L194-L215 HydrophobicContact CD1-CG 4.42Å
195	L	96.4	Very high	94.6	Very high	19 Å²	19	41.9 Å²	41.9	10%	0.099	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	169.2	-172.9	65.6	86.6	0	0	0	110.1	A58 F176 Y193 L197 R230 A232	A58-L195 HydrophobicContact CB-CD2 3.89Å; F176-L195 HydrophobicContact CB-CD1 4.43Å; F176-L195 HydrophobicContact CB-CG 4.43Å; F176-L195 HydrophobicContact CD2-CD1 3.7Å; F176-L195 HydrophobicContact CE2-CD1 4.38Å; F176-L195 HydrophobicContact CG-CD1 4.34Å; F176-L195 PolarHBondContact N-O 2.87Å; Y193-L195 VanDerWaalsContact CE2-O 3.28Å; Y193-L195 WeakPolarHBondContact CE2-O 3.2Å; L195-L197 HydrophobicContact CD1-CD2 4.07Å; L195-L197 HydrophobicContact CD1-CG 4.05Å; L195-R230 WeakPolarHBondContact CA-O 3.06Å; L195-A232 HydrophobicContact CD1-CB 4.25Å
196	S	97.9	Very high	95.3	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	156.1	165.8	-53.5	0	0	0	0	111.2	L174 D175 Y193 R230 V231 A232	L174-S196 CarbonylContact O-C 3.57Å; L174-S196 VanDerWaalsContact O-CA 3.22Å; L174-S196 WeakPolarHBondContact O-CA 3.16Å; D175-S196 WeakPolarHBondContact OD1-CB 3.19Å; D175-S196 PolarHBondContact OD1-OG 2.79Å; Y193-S196 WeakPolarHBondContact CE2-OG 3.49Å; Y193-S196 PolarHBondContact OH-N 3.49Å; Y193-S196 PolarHBondContact OH-OG 2.61Å; S196-R230 PolarHBondContact N-O 2.95Å; S196-V231 CarbonylContact O-C 3.54Å; S196-V231 WeakPolarHBondContact O-CA 3.22Å; S196-A232 PolarHBondContact O-N 2.81Å
197	L	98.3	Very high	95.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.2	165.9	-60.2	177.5	0	0	0	109.3	V55 L173 L174 F176 L195 L199 L205 L207 M211 A232 N233	V55-L197 HydrophobicContact CG1-CD2 4.05Å; L173-L197 WeakPolarHBondContact CA-O 3.35Å; L174-L197 PolarHBondContact N-O 3.18Å; L174-L197 PolarHBondContact O-N 3.04Å; F176-L197 HydrophobicContact CD2-CG 4.49Å; F176-L197 HydrophobicContact CE2-CB 4.43Å; F176-L197 HydrophobicContact CE2-CD1 3.69Å; F176-L197 HydrophobicContact CE2-CG 3.84Å; F176-L197 HydrophobicContact CZ-CD1 4.11Å; L195-L197 HydrophobicContact CD1-CD2 4.07Å; L195-L197 HydrophobicContact CD1-CG 4.05Å; L197-L199 HydrophobicContact CB-CD2 4.02Å; L197-L205 HydrophobicContact CD1-CD1 3.61Å; L197-L205 HydrophobicContact CD1-CD2 4.33Å; L197-L207 HydrophobicContact CD1-CD2 4.21Å; L197-M211 HydrophobicContact CD1-CE 4.44Å; L197-A232 HydrophobicContact CD2-CB 3.92Å; L197-N233 WeakPolarHBondContact CA-OD1 3.05Å; L197-N233 HydrophobicContact CD2-CB 4.2Å
198	L	98.7	Very high	95.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	116.1	170.8	177.2	60.5	0	0	0	109.5	Y64 H171 L173 L227 V231 N233 A237 A239 L245	Y64-L198 WeakPolarHBondContact CE2-O 3.44Å; H171-L198 HydrophobicContact CB-CD1 4.16Å; L173-L198 HydrophobicContact CD2-CB 3.97Å; L173-L198 HydrophobicContact CD2-CD1 4.06Å; L198-L227 HydrophobicContact CD1-CD2 4.41Å; L198-L227 HydrophobicContact CD2-CD1 4.04Å; L198-L227 HydrophobicContact CD2-CD2 4.37Å; L198-V231 HydrophobicContact CB-CG1 3.78Å; L198-N233 PolarHBondContact N-OD1 2.82Å; L198-N233 PolarHBondContact O-ND2 2.84Å; L198-A237 HydrophobicContact CB-CB 4.2Å; L198-A237 HydrophobicContact CD2-CB 3.85Å; L198-A237 HydrophobicContact CG-CB 4.1Å; L198-A239 HydrophobicContact CD2-CB 3.67Å; L198-L245 HydrophobicContact CD1-CD1 4.15Å; L198-L245 HydrophobicContact CD2-CD1 4.2Å
199	L	98.7	Very high	95.5	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	94.7	-178.6	-51.4	-173.9	0	0	0	109.2	Y64 H171 T172 L174 L197 L205	Y64-L199 HydrophobicContact CD2-CD2 4.38Å; Y64-L199 HydrophobicContact CE2-CD2 4.34Å; H171-L199 CarbonylContact C-O 3.59Å; H171-L199 WeakPolarHBondContact CA-O 3.48Å; H171-L199 WeakPolarHBondContact CB-O 3.33Å; T172-L199 HydrophobicContact CG2-CB 4.2Å; T172-L199 HydrophobicContact CG2-CD1 4.19Å; T172-L199 HydrophobicContact CG2-CG 4.43Å; T172-L199 PolarHBondContact N-O 2.95Å; T172-L199 PolarHBondContact O-N 2.87Å; L174-L199 HydrophobicContact CB-CD1 3.79Å; L174-L199 HydrophobicContact CB-CG 4.23Å; L174-L199 HydrophobicContact CD2-CD1 4.17Å; L197-L199 HydrophobicContact CB-CD2 4.02Å; L199-L205 HydrophobicContact CD1-CD2 4.16Å; L199-L205 HydrophobicContact CD2-CB 4.16Å; L199-L205 HydrophobicContact CD2-CD1 4.29Å; L199-L205 HydrophobicContact CD2-CD2 3.86Å; L199-L205 HydrophobicContact CD2-CG 4.33Å
200	R	98.7	Very high	95.1	Very high	68 Å²	68	30.2 Å²	30.2	26%	0.257	15%	0.151	S	C	.	.			trans	-68.9	155.8	174.8	-64.6	-77.6	-164.3	175.3	0.9	111.6	Y64 N167 S203 A237 G238	Y64-R200 WeakPolarHBondContact OH-CB 3.45Å; Y64-R200 PolarHBondContact OH-N 3.48Å; N167-R200 VanDerWaalsContact CB-O 3.28Å; N167-R200 WeakPolarHBondContact CB-O 3.22Å; R200-S203 WeakPolarHBondContact O-CB 3.4Å; R200-S203 PolarHBondContact O-N 3.19Å; R200-S203 PolarHBondContact O-OG 3.33Å; R200-A237 HydrophobicContact CG-CB 4.18Å; R200-A237 PolarHBondContact NE-O 3.18Å; R200-A237 PolarHBondContact NH2-O 2.98Å; R200-G238 PolarHBondContact NH2-O 3.03Å
201	P	98.7	Very high	94.9	Very high	29 Å²	29	23.9 Å²	23.9	19%	0.188	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	154.3	165.7	25.4	-34.7	0	0	0	111	E74 N167 S203	E74-P201 VanDerWaalsContact OE1-CB 3.27Å; E74-P201 WeakPolarHBondContact OE1-CB 3.41Å; N167-P201 CarbonylContact O-C 3.57Å; P201-S203 PolarHBondContact O-N 2.8Å
202	R	98.7	Very high	94.5	Very high	48 Å²	48	20.8 Å²	20.8	18%	0.181	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	-1.9	-176	-57.3	-177.4	-63.3	-90.5	11.3	117.1	D67 F68 I69 E71 E74 N167	D67-R202 IonicContact OD1-NE 2.83Å; D67-R202 IonicContact OD1-NH2 3.35Å; F68-R202 WeakPolarHBondContact CB-O 3.4Å; F68-R202 PolarHBondContact N-O 3.2Å; I69-R202 HydrophobicContact CD1-CG 4.38Å; I69-R202 HydrophobicContact CG1-CB 3.73Å; I69-R202 HydrophobicContact CG1-CG 3.93Å; I69-R202 PolarHBondContact N-O 3.41Å; I69-R202 WeakPolarHBondContact O-CB 3.42Å; I69-R202 WeakPolarHBondContact O-CD 3.49Å; E71-R202 IonicContact OE1-CZ 3.52Å; E71-R202 IonicContact OE1-NH2 3.86Å; E74-R202 HydrophobicContact CB-CG 3.94Å; E74-R202 HydrophobicContact CG-CG 4.33Å; E74-R202 WeakPolarHBondContact OE2-CD 3.49Å; E74-R202 WeakPolarHBondContact OE2-CG 3.26Å; E74-R202 IonicContact OE2-CZ 3.75Å; E74-R202 IonicContact OE2-NH1 3.93Å; E74-R202 PolarHBondContact OE2-NH1 2.89Å; N167-R202 WeakPolarHBondContact O-CA 3.23Å; N167-R202 PolarHBondContact O-N 3.48Å
203	S	98.8	Very high	93.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.095	C	C	.	.			trans	-82.9	151	179.4	68.5	0	0	0	0	112.8	Y64 I65 N167 R200 P201	Y64-S203 WeakPolarHBondContact CE2-OG 3.18Å; Y64-S203 WeakPolarHBondContact OH-CB 3.47Å; Y64-S203 PolarHBondContact OH-OG 2.85Å; I65-S203 CarbonylContact O-C 3.58Å; I65-S203 WeakPolarHBondContact O-CA 3.47Å; I65-S203 VanDerWaalsContact O-CB 3.29Å; I65-S203 WeakPolarHBondContact O-CB 3.48Å; N167-S203 PolarHBondContact N-O 3.37Å; N167-S203 PolarHBondContact ND2-O 3.43Å; N167-S203 PolarHBondContact ND2-OG 2.98Å; R200-S203 WeakPolarHBondContact O-CB 3.4Å; R200-S203 PolarHBondContact O-N 3.19Å; R200-S203 PolarHBondContact O-OG 3.33Å; P201-S203 PolarHBondContact O-N 2.8Å
204	L	98.6	Very high	93.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.8	166.3	-178.7	72.5	0	0	0	109.7	I65 F68 V125 L128 T165 I166 V206	I65-L204 HydrophobicContact CB-CB 4.22Å; I65-L204 HydrophobicContact CD1-CB 4.42Å; I65-L204 HydrophobicContact CD1-CD2 3.82Å; I65-L204 HydrophobicContact CG1-CB 4.5Å; I65-L204 PolarHBondContact N-O 2.74Å; I65-L204 PolarHBondContact O-N 3.12Å; F68-L204 HydrophobicContact CB-CB 3.74Å; F68-L204 HydrophobicContact CD1-CB 3.67Å; F68-L204 HydrophobicContact CD1-CD1 4.39Å; F68-L204 HydrophobicContact CD1-CD2 4.25Å; F68-L204 HydrophobicContact CD1-CG 4.33Å; F68-L204 HydrophobicContact CD2-CB 4.09Å; F68-L204 HydrophobicContact CD2-CD2 4.09Å; F68-L204 HydrophobicContact CE1-CB 4.29Å; F68-L204 HydrophobicContact CE1-CD1 4.33Å; F68-L204 HydrophobicContact CE1-CD2 4.06Å; F68-L204 HydrophobicContact CE1-CG 4.47Å; F68-L204 HydrophobicContact CE2-CD2 3.9Å; F68-L204 HydrophobicContact CG-CB 3.55Å; F68-L204 HydrophobicContact CG-CD2 4.26Å; F68-L204 HydrophobicContact CG-CG 4.45Å; F68-L204 HydrophobicContact CZ-CD2 3.87Å; V125-L204 HydrophobicContact CG2-CD1 4.01Å; V125-L204 HydrophobicContact CG2-CD2 4.5Å; L128-L204 HydrophobicContact CD1-CD2 3.48Å; L128-L204 VanDerWaalsContact CD1-CD2 3.48Å; T165-L204 WeakPolarHBondContact O-CA 3.19Å; I166-L204 HydrophobicContact CG1-CD1 3.73Å; L204-V206 HydrophobicContact CD2-CG2 3.78Å; L204-V206 HydrophobicContact CG-CG2 3.97Å
205	L	98.2	Very high	93.2	Very high	2 Å²	2	21 Å²	21	1%	0.01	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.7	163.8	179.5	69.5	0	0	0	109.1	F63 S164 T165 L174 L197 L199 L207	F63-L205 WeakPolarHBondContact O-CA 3.29Å; S164-L205 CarbonylContact C-O 3.5Å; S164-L205 VanDerWaalsContact CA-O 3.26Å; S164-L205 WeakPolarHBondContact CA-O 3.28Å; T165-L205 PolarHBondContact N-O 2.82Å; T165-L205 PolarHBondContact O-N 3Å; L174-L205 HydrophobicContact CD2-CD2 3.68Å; L197-L205 HydrophobicContact CD1-CD1 3.61Å; L197-L205 HydrophobicContact CD1-CD2 4.33Å; L199-L205 HydrophobicContact CD1-CD2 4.16Å; L199-L205 HydrophobicContact CD2-CB 4.16Å; L199-L205 HydrophobicContact CD2-CD1 4.29Å; L199-L205 HydrophobicContact CD2-CD2 3.86Å; L199-L205 HydrophobicContact CD2-CG 4.33Å; L205-L207 HydrophobicContact CD1-CD2 3.94Å; L205-L207 HydrophobicContact CD1-CG 4.43Å; L205-L207 HydrophobicContact CD2-CD1 3.95Å; L205-L207 HydrophobicContact CD2-CD2 4.12Å; L205-L207 HydrophobicContact CD2-CG 3.95Å; L205-L207 HydrophobicContact CG-CD2 4.07Å; L205-L207 HydrophobicContact CG-CG 4Å
206	V	96.5	Very high	93.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.2	168.8	-176	0	0	0	0	108.8	A62 F63 V130 T162 V163 L204 Q208	A62-V206 WeakPolarHBondContact CA-O 3.3Å; F63-V206 HydrophobicContact CB-CB 4.23Å; F63-V206 HydrophobicContact CD2-CB 4.25Å; F63-V206 HydrophobicContact CD2-CG1 4.38Å; F63-V206 PolarHBondContact N-O 2.86Å; F63-V206 PolarHBondContact O-N 3.14Å; V130-V206 HydrophobicContact CB-CG1 4.13Å; V130-V206 HydrophobicContact CG1-CG1 3.94Å; V130-V206 HydrophobicContact CG1-CG2 4.29Å; T162-V206 HydrophobicContact CG2-CG1 3.86Å; V163-V206 CarbonylContact O-C 3.51Å; V163-V206 WeakPolarHBondContact O-CA 3.36Å; L204-V206 HydrophobicContact CD2-CG2 3.78Å; L204-V206 HydrophobicContact CG-CG2 3.97Å; V206-Q208 HydrophobicContact CG1-CG 4.19Å
207	L	94.1	Very high	93	Very high	7 Å²	7	22.4 Å²	22.4	4%	0.037	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.2	177.2	-57.9	174	0	0	0	109.5	A62 T162 V163 L174 F176 L197 L205 M211	A62-L207 HydrophobicContact CB-CD2 3.87Å; T162-L207 WeakPolarHBondContact CA-O 3.45Å; V163-L207 PolarHBondContact N-O 3.36Å; V163-L207 PolarHBondContact O-N 3.47Å; L174-L207 HydrophobicContact CD2-CD1 4.44Å; F176-L207 HydrophobicContact CE1-CD1 3.87Å; F176-L207 HydrophobicContact CZ-CD1 3.64Å; F176-L207 HydrophobicContact CZ-CD2 4.06Å; L197-L207 HydrophobicContact CD1-CD2 4.21Å; L205-L207 HydrophobicContact CD1-CD2 3.94Å; L205-L207 HydrophobicContact CD1-CG 4.43Å; L205-L207 HydrophobicContact CD2-CD1 3.95Å; L205-L207 HydrophobicContact CD2-CD2 4.12Å; L205-L207 HydrophobicContact CD2-CG 3.95Å; L205-L207 HydrophobicContact CG-CD2 4.07Å; L205-L207 HydrophobicContact CG-CG 4Å; L207-M211 HydrophobicContact CB-CB 4.23Å; L207-M211 HydrophobicContact CD2-CB 4.16Å; L207-M211 HydrophobicContact CD2-CE 3.9Å
208	Q	89.8	Confident	92.9	Very high	21 Å²	21	22.5 Å²	22.5	10%	0.098	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	167.7	-179	-62.9	-175.3	-53.3	0	0	111.1	T61 V130 T162 V206 D210 M211	T61-Q208 WeakPolarHBondContact CB-O 3.2Å; T61-Q208 PolarHBondContact O-N 2.89Å; T61-Q208 PolarHBondContact OG1-O 2.82Å; V130-Q208 PolarHBondContact O-NE2 2.91Å; V130-Q208 VanDerWaalsContact O-NE2 3.14Å; T162-Q208 HydrophobicContact CG2-CG 3.84Å; T162-Q208 PolarHBondContact OG1-NE2 2.79Å; V206-Q208 HydrophobicContact CG1-CG 4.19Å; Q208-D210 PolarHBondContact O-N 2.85Å; Q208-M211 PolarHBondContact O-N 3.23Å
209	D	84.4	Confident	92.9	Very high	49 Å²	49	22.9 Å²	22.9	26%	0.262	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	-123	172.4	-48.3	-36.4	0	0	0	112.1	T61 M211 Y212 C213	T61-D209 HydrophobicContact CG2-CB 3.8Å; T61-D209 WeakPolarHBondContact CG2-OD2 3.49Å; D209-M211 VanDerWaalsContact C-N 3.31Å; D209-M211 PolarHBondContact O-N 2.91Å; D209-Y212 CarbonylContact O-C 3.48Å; D209-Y212 WeakPolarHBondContact O-CA 3.49Å; D209-Y212 WeakPolarHBondContact O-CB 3.37Å; D209-Y212 PolarHBondContact O-N 2.91Å; D209-C213 WeakPolarHBondContact O-CB 3.41Å; D209-C213 PolarHBondContact O-N 2.81Å
210	D	81.8	Confident	92.8	Very high	76 Å²	76	25.6 Å²	25.6	41%	0.406	12%	0.123	S	C	.	.	H	α-helix	trans	-57.5	-39.2	-175.6	-65.3	-8.1	0	0	0	113.5	Q208 Y212 Q214 L215	Q208-D210 PolarHBondContact O-N 2.85Å; D210-Y212 PolarHBondContact O-N 3.17Å; D210-Q214 HydrophobicContact CB-CG 4.48Å; D210-Q214 WeakPolarHBondContact O-CB 3.36Å; D210-Q214 PolarHBondContact O-N 2.67Å; D210-Q214 PolarHBondContact OD1-NE2 3.1Å; D210-L215 PolarHBondContact O-N 2.84Å
211	M	86.7	Confident	92.7	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-63.5	-26.3	177.1	-71.3	-66.1	-70.9	0	0	112.5	P59 T61 A62 F176 L197 L207 Q208 D209 L215	P59-M211 HydrophobicContact CB-CG 3.99Å; P59-M211 HydrophobicContact CB-SD 4.08Å; P59-M211 VanDerWaalsContact CD-SD 3.55Å; P59-M211 HydrophobicContact CG-CG 4.21Å; P59-M211 HydrophobicContact CG-SD 3.62Å; T61-M211 WeakPolarHBondContact OG1-CG 3.45Å; A62-M211 HydrophobicContact CB-CE 4.23Å; A62-M211 HydrophobicContact CB-CG 4.26Å; F176-M211 HydrophobicContact CD1-CE 3.62Å; F176-M211 HydrophobicContact CD1-SD 4.47Å; F176-M211 HydrophobicContact CD2-CE 4.03Å; F176-M211 HydrophobicContact CE1-CE 3.39Å; F176-M211 HydrophobicContact CE2-CE 3.82Å; F176-M211 HydrophobicContact CG-CE 3.93Å; F176-M211 HydrophobicContact CZ-CE 3.49Å; F176-M211 VanDerWaalsContact CZ-CE 3.49Å; L197-M211 HydrophobicContact CD1-CE 4.44Å; L207-M211 HydrophobicContact CB-CB 4.23Å; L207-M211 HydrophobicContact CD2-CB 4.16Å; L207-M211 HydrophobicContact CD2-CE 3.9Å; Q208-M211 PolarHBondContact O-N 3.23Å; D209-M211 VanDerWaalsContact C-N 3.31Å; D209-M211 PolarHBondContact O-N 2.91Å; M211-L215 HydrophobicContact SD-CD1 3.57Å; M211-L215 VanDerWaalsContact SD-CD1 3.57Å
212	Y	84	Confident	92.6	Very high	8 Å²	8	29.9 Å²	29.9	3%	0.031	14%	0.144	C	C	.	.	H	α-helix	trans	-93.6	-44.6	177.6	174.4	-105.6	0	0	0	112.7	F32 D155 G156 P161 V163 D209 D210	F32-Y212 AromaticContact CE2-CE1 3.97Å; F32-Y212 HydrophobicContact CE2-CE1 3.97Å; F32-Y212 HydrophobicContact CZ-CD1 4.2Å; F32-Y212 AromaticContact CZ-CE1 3.51Å; F32-Y212 HydrophobicContact CZ-CE1 3.51Å; F32-Y212 AromaticContact CZ-CZ 3.97Å; D155-Y212 HydrophobicContact CB-CD2 4.48Å; D155-Y212 HydrophobicContact CB-CE2 3.61Å; G156-Y212 PolarHBondContact O-OH 3.29Å; P161-Y212 VanDerWaalsContact CA-CD1 3.46Å; P161-Y212 HydrophobicContact CB-CD1 3.74Å; P161-Y212 HydrophobicContact CB-CE1 3.86Å; V163-Y212 HydrophobicContact CB-CD2 4.29Å; V163-Y212 HydrophobicContact CG2-CD2 3.26Å; V163-Y212 HydrophobicContact CG2-CE2 3.23Å; V163-Y212 HydrophobicContact CG2-CG 4.47Å; D209-Y212 CarbonylContact O-C 3.48Å; D209-Y212 WeakPolarHBondContact O-CA 3.49Å; D209-Y212 WeakPolarHBondContact O-CB 3.37Å; D209-Y212 PolarHBondContact O-N 2.91Å; D210-Y212 PolarHBondContact O-N 3.17Å
213	C	81.6	Confident	92.6	Very high	3 Å²	3	32 Å²	32	2%	0.02	16%	0.159	C	C	.	.	H	α-helix	trans	-91.7	-25.9	-168.4	-61.2	0	0	0	0	114	F32 C36 D209	F32-C213 HydrophobicContact CE1-CB 4.41Å; C36-C213 HydrophobicContact CB-CB 3.62Å; C36-C213 WeakPolarHBondContact CB-SG 3.43Å; C36-C213 WeakPolarHBondContact SG-CB 3.29Å; C36-C213 CovalentContact SG-SG 2.04Å; C36-C213 PolarHBondContact SG-SG 3.33Å; D209-C213 WeakPolarHBondContact O-CB 3.41Å; D209-C213 PolarHBondContact O-N 2.81Å
214	Q	85.5	Confident	92.5	Very high	92 Å²	92	38.7 Å²	38.7	43%	0.43	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-13.7	-168.1	-59.1	-172.7	20.1	0	0	114.1	P179 D210	P179-Q214 WeakPolarHBondContact CD-O 3.5Å; P179-Q214 WeakPolarHBondContact CG-O 3.37Å; D210-Q214 HydrophobicContact CB-CG 4.48Å; D210-Q214 WeakPolarHBondContact O-CB 3.36Å; D210-Q214 PolarHBondContact O-N 2.67Å; D210-Q214 PolarHBondContact OD1-NE2 3.1Å
215	L	91.3	Very high	92.5	Very high	16 Å²	16	38.7 Å²	38.7	8%	0.084	18%	0.184	C	C	.	.			trans	-114.3	139	-175.3	-60.2	-175.7	0	0	0	111.6	F176 L194 D210 M211	F176-L215 HydrophobicContact CB-CD1 4.29Å; F176-L215 HydrophobicContact CD1-CB 4.14Å; F176-L215 HydrophobicContact CD1-CD1 4.18Å; L194-L215 HydrophobicContact CD1-CD1 4.01Å; L194-L215 HydrophobicContact CD1-CD2 3.5Å; L194-L215 VanDerWaalsContact CD1-CD2 3.5Å; L194-L215 HydrophobicContact CD1-CG 4.42Å; D210-L215 PolarHBondContact O-N 2.84Å; M211-L215 HydrophobicContact SD-CD1 3.57Å; M211-L215 VanDerWaalsContact SD-CD1 3.57Å
216	L	94	Very high	92.5	Very high	27 Å²	27	41.7 Å²	41.7	14%	0.141	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.5	166.5	-62.6	167.8	0	0	0	108.6	A152 H153 E154 F176 Y177	A152-L216 HydrophobicContact CB-CB 4.04Å; H153-L216 WeakPolarHBondContact O-CA 3.45Å; E154-L216 HydrophobicContact CG-CD2 3.89Å; F176-L216 CarbonylContact C-O 3.48Å; F176-L216 WeakPolarHBondContact CA-O 3.29Å; Y177-L216 PolarHBondContact N-O 2.85Å; Y177-L216 PolarHBondContact O-N 2.96Å
217	H	95.6	Very high	92.5	Very high	22 Å²	22	41.9 Å²	41.9	10%	0.102	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.7	175.4	63.8	-88.5	0	0	0	112	A152 H153 D155 L174 D175 F176	A152-H217 CarbonylContact C-O 3.59Å; A152-H217 VanDerWaalsContact CA-O 3.29Å; A152-H217 WeakPolarHBondContact CA-O 3.08Å; H153-H217 AromaticContact CE1-CD2 3.72Å; H153-H217 AromaticContact CE1-NE2 3.55Å; H153-H217 PolarHBondContact CE1-O 2.84Å; H153-H217 PolarHBondContact N-O 2.98Å; H153-H217 PolarHBondContact ND1-O 3.08Å; H153-H217 AromaticContact NE2-NE2 3.54Å; H153-H217 PolarHBondContact O-N 3.28Å; H153-H217 PolarHBondContact O-ND1 2.89Å; D155-H217 IonicContact OD1-CE1 3.96Å; D155-H217 IonicContact OD1-NE2 3.6Å; D155-H217 IonicContact OD2-CE1 3.95Å; D155-H217 PolarHBondContact OD2-CE1 2.95Å; D155-H217 IonicContact OD2-NE2 2.95Å; L174-H217 HydrophobicContact CD1-CB 4.17Å; L174-H217 HydrophobicContact CG-CB 4.42Å; D175-H217 CarbonylContact O-C 3.34Å; D175-H217 WeakPolarHBondContact O-CA 3.44Å; F176-H217 HydrophobicContact CD1-CB 3.98Å; F176-H217 HydrophobicContact CE1-CB 3.83Å; F176-H217 HydrophobicContact CZ-CB 4.36Å
218	G	96.8	Very high	92.6	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	165.6	-178	0	0	0	0	0	113.5	I150 D175	I150-G218 CarbonylContact O-C 3.49Å; I150-G218 WeakPolarHBondContact O-CA 3.11Å; D175-G218 PolarHBondContact N-O 3.05Å; D175-G218 PolarHBondContact O-N 2.9Å
219	I	98.1	Very high	92.9	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.041	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.8	173.5	-60.8	169.4	0	0	0	106.9	Y144 G149 I150 T172 L174	Y144-I219 HydrophobicContact CE1-CD1 4.17Å; Y144-I219 HydrophobicContact CE2-CD1 4.11Å; G149-I219 CarbonylContact C-O 3.56Å; G149-I219 WeakPolarHBondContact CA-O 3.32Å; I150-I219 HydrophobicContact CG2-CB 4.05Å; I150-I219 HydrophobicContact CG2-CD1 4.31Å; I150-I219 HydrophobicContact CG2-CG1 4.13Å; I150-I219 PolarHBondContact N-O 3.29Å; I150-I219 PolarHBondContact O-N 2.98Å; I150-I219 VanDerWaalsContact O-O 3.04Å; T172-I219 HydrophobicContact CG2-CD1 4.14Å; T172-I219 HydrophobicContact CG2-CG1 4.45Å; T172-I219 VanDerWaalsContact OG1-CG2 3.28Å; T172-I219 WeakPolarHBondContact OG1-CG2 3.35Å; L174-I219 HydrophobicContact CD1-CG1 4.1Å
220	Q	96.9	Very high	93.4	Very high	57 Å²	57	54.3 Å²	54.3	27%	0.266	26%	0.264	S	S	.	.			trans	-70.7	144.1	-179.6	-71.1	-78.2	-9.8	0	0	111.9	D175 Y177 R222 R247	D175-Q220 WeakPolarHBondContact OD2-CG 3.27Å; Y177-Q220 PolarHBondContact OH-NE2 2.87Å; Q220-R222 VanDerWaalsContact CB-NH2 3.32Å; Q220-R222 VanDerWaalsContact CG-NH2 3.3Å; Q220-R222 PolarHBondContact O-N 2.63Å; Q220-R222 VanDerWaalsContact O-N 3.11Å; Q220-R247 PolarHBondContact O-NH1 3.45Å
221	N	96.6	Very high	94.2	Very high	105 Å²	105	51 Å²	51	56%	0.561	25%	0.246	S	C	*	.	S	Bend	trans	-72.9	98.4	173.9	-66.7	-7.1	0	0	0	109.6	G147 G149	G147-N221 CarbonylContact O-C 3.55Å; G147-N221 WeakPolarHBondContact O-CA 3.24Å; G147-N221 VanDerWaalsContact O-CB 3.24Å; G147-N221 WeakPolarHBondContact O-CB 3.44Å; G149-N221 WeakPolarHBondContact CA-OD1 3.38Å; G149-N221 PolarHBondContact N-OD1 2.84Å; G149-N221 VanDerWaalsContact N-OD1 3.08Å
222	R	96.6	Very high	94.7	Very high	82 Å²	82	51.5 Å²	51.5	31%	0.309	25%	0.251	S	S	.	.			trans	-160.3	157.2	178.2	61.8	-176	73.4	157.6	-3.3	111.4	G147 Q220 R224 D225 R247	G147-R222 WeakPolarHBondContact CA-O 3.44Å; G147-R222 PolarHBondContact N-O 2.54Å; Q220-R222 VanDerWaalsContact CB-NH2 3.32Å; Q220-R222 VanDerWaalsContact CG-NH2 3.3Å; Q220-R222 PolarHBondContact O-N 2.63Å; Q220-R222 VanDerWaalsContact O-N 3.11Å; R222-R224 WeakPolarHBondContact CD-O 3.28Å; R222-R224 WeakPolarHBondContact CG-O 3.4Å; R222-D225 WeakPolarHBondContact CD-OD1 3.38Å; R222-D225 IonicContact NH1-OD1 3.57Å; R222-R247 WeakPolarHBondContact O-CD 3.4Å; R222-R247 PolarHBondContact O-NH1 2.98Å
223	D	97.9	Very high	95.3	Very high	94 Å²	94	51.2 Å²	51.2	50%	0.503	25%	0.25	S	S	.	.	S	Bend	trans	-90.8	-16.8	178.2	-60.7	-56.4	0	0	0	113.6	P146 G147 R247	P146-D223 WeakPolarHBondContact CB-OD1 3.39Å; G147-D223 WeakPolarHBondContact CA-OD1 3.09Å; G147-D223 PolarHBondContact N-OD1 3.42Å; D223-R247 WeakPolarHBondContact O-CB 3.48Å; D223-R247 PolarHBondContact O-N 2.73Å
224	R	98.2	Very high	96	Very high	140 Å²	140	51.8 Å²	51.8	53%	0.528	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	141.5	-174.6	-52.9	-179.2	76.9	-154.3	0	110.7	R222 T244 L245 S246	R222-R224 WeakPolarHBondContact CD-O 3.28Å; R222-R224 WeakPolarHBondContact CG-O 3.4Å; R224-T244 HydrophobicContact CB-CG2 3.94Å; R224-L245 CarbonylContact C-O 3.56Å; R224-L245 WeakPolarHBondContact CA-O 3.07Å; R224-S246 PolarHBondContact NE-OG 3.4Å
225	D	98.3	Very high	96.5	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	106.4	178.4	-78.3	-48.3	0	0	0	110.4	H171 L173 R222 L227 T244 L245 R247	H171-D225 IonicContact CD2-OD2 3.17Å; H171-D225 IonicContact NE2-OD2 2.79Å; L173-D225 HydrophobicContact CD1-CB 3.86Å; L173-D225 HydrophobicContact CG-CB 3.89Å; L173-D225 PolarHBondContact N-OD2 2.91Å; R222-D225 WeakPolarHBondContact CD-OD1 3.38Å; R222-D225 IonicContact NH1-OD1 3.57Å; D225-L227 PolarHBondContact O-N 2.87Å; D225-T244 WeakPolarHBondContact O-CA 3.37Å; D225-L245 PolarHBondContact N-O 3.32Å; D225-L245 PolarHBondContact O-N 3.37Å; D225-R247 IonicContact OD1-CZ 2.61Å; D225-R247 IonicContact OD1-NE 3.04Å; D225-R247 IonicContact OD1-NH2 3.74Å; D225-R247 PolarHBondContact OD1-NH2 3.44Å; D225-R247 IonicContact OD2-CZ 3.15Å; D225-R247 IonicContact OD2-NE 2.84Å; D225-R247 PolarHBondContact OD2-NE 2.86Å; D225-R247 IonicContact OD2-NH2 2.67Å; D225-R247 PolarHBondContact OD2-NH2 2.95Å; D225-R247 VanDerWaalsContact OD2-NH2 3.12Å
226	P	97.1	Very high	96.7	Very high	64 Å²	64	54.9 Å²	54.9	42%	0.416	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	124.5	167.5	30	-31.5	0	0	0	109.3
227	L	97.9	Very high	96.8	Very high	4 Å²	4	54 Å²	54	2%	0.021	29%	0.285	C	S	.	.			trans	-86	117.5	-179.9	-56.4	-167.5	0	0	0	109.3	L173 L198 D225 L234 A239 G242 E243 L245	L173-L227 HydrophobicContact CD2-CD2 4.1Å; L198-L227 HydrophobicContact CD1-CD2 4.41Å; L198-L227 HydrophobicContact CD2-CD1 4.04Å; L198-L227 HydrophobicContact CD2-CD2 4.37Å; D225-L227 PolarHBondContact O-N 2.87Å; L227-L234 HydrophobicContact CB-CD2 3.98Å; L227-L234 HydrophobicContact CD1-CD2 3.73Å; L227-L234 HydrophobicContact CG-CD2 4.3Å; L227-A239 HydrophobicContact CD1-CB 3.6Å; L227-G242 PolarHBondContact O-N 2.76Å; L227-E243 HydrophobicContact CB-CB 4.43Å; L227-E243 HydrophobicContact CD1-CB 3.97Å; L227-E243 HydrophobicContact CG-CB 4.25Å; L227-E243 PolarHBondContact N-O 3.39Å; L227-L245 HydrophobicContact CD1-CD1 3.97Å; L227-L245 HydrophobicContact CD1-CG 4.13Å; L227-L245 HydrophobicContact CD2-CD1 4.39Å; L227-L245 HydrophobicContact CG-CG 4.39Å
228	T	96	Very high	96.8	Very high	66 Å²	66	55.8 Å²	55.8	41%	0.405	31%	0.31	S	S	.	.			trans	-112.3	170.4	179.7	71.4	0	0	0	0	110.2	R230 V231 L234	T228-R230 PolarHBondContact O-N 2.92Å; T228-R230 PolarHBondContact OG1-N 3.02Å; T228-V231 WeakPolarHBondContact O-CB 3.2Å; T228-V231 PolarHBondContact O-N 3.48Å; T228-L234 WeakPolarHBondContact O-CD1 3.32Å
229	D	94.8	Very high	96.8	Very high	138 Å²	138	56 Å²	56	74%	0.738	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-8.4	175	-55.7	-39	0	0	0	113.6	V231 P241	D229-V231 VanDerWaalsContact C-N 3.33Å; D229-P241 WeakPolarHBondContact OD1-CB 3.2Å; D229-P241 WeakPolarHBondContact OD1-CG 3.19Å
230	R	95.6	Very high	96.6	Very high	135 Å²	135	64.5 Å²	64.5	51%	0.509	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.3	173.5	-64.7	-172	174.2	-148.6	4.7	113.9	Y193 L195 S196 T228 A232	Y193-R230 HydrophobicContact CE1-CB 4.13Å; Y193-R230 VanDerWaalsContact CE1-CD 3.5Å; Y193-R230 HydrophobicContact CE1-CG 4.49Å; L195-R230 WeakPolarHBondContact CA-O 3.06Å; S196-R230 PolarHBondContact N-O 2.95Å; T228-R230 PolarHBondContact O-N 2.92Å; T228-R230 PolarHBondContact OG1-N 3.02Å; R230-A232 PolarHBondContact O-N 3.5Å
231	V	97.8	Very high	96.5	Very high	5 Å²	5	65.1 Å²	65.1	3%	0.03	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-83.6	103.8	171.1	-177.3	0	0	0	0	107.7	L173 S196 L198 T228 D229 N233 L234	L173-V231 HydrophobicContact CD1-CG2 4.36Å; L173-V231 HydrophobicContact CD2-CG1 3.99Å; L173-V231 HydrophobicContact CD2-CG2 3.88Å; S196-V231 CarbonylContact O-C 3.54Å; S196-V231 WeakPolarHBondContact O-CA 3.22Å; L198-V231 HydrophobicContact CB-CG1 3.78Å; T228-V231 WeakPolarHBondContact O-CB 3.2Å; T228-V231 PolarHBondContact O-N 3.48Å; D229-V231 VanDerWaalsContact C-N 3.33Å; V231-N233 VanDerWaalsContact C-N 3.33Å; V231-N233 PolarHBondContact O-N 2.88Å; V231-L234 HydrophobicContact CB-CD1 4.07Å; V231-L234 HydrophobicContact CB-CD2 3.85Å; V231-L234 HydrophobicContact CB-CG 3.7Å; V231-L234 HydrophobicContact CG1-CD2 3.67Å; V231-L234 HydrophobicContact CG1-CG 3.78Å; V231-L234 WeakPolarHBondContact O-CG 3.36Å
232	A	97.3	Very high	96.5	Very high	12 Å²	12	63.4 Å²	63.4	10%	0.099	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-29.5	-164.4	0	0	0	0	0	113.7	V55 E57 A58 L195 S196 L197 R230	V55-A232 HydrophobicContact CG1-CB 3.78Å; E57-A232 HydrophobicContact CB-CB 3.84Å; A58-A232 HydrophobicContact CB-CB 4.41Å; L195-A232 HydrophobicContact CD1-CB 4.25Å; S196-A232 PolarHBondContact O-N 2.81Å; L197-A232 HydrophobicContact CD2-CB 3.92Å; R230-A232 PolarHBondContact O-N 3.5Å
233	N	97.6	Very high	96.5	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.016	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	24.6	-173.1	71.7	-34.1	0	0	0	114.2	V55 Y64 L197 L198 V231 S235 A236 A237	V55-N233 HydrophobicContact CG1-CB 3.96Å; V55-N233 HydrophobicContact CG2-CB 4Å; Y64-N233 WeakPolarHBondContact CD2-ND2 3.28Å; L197-N233 WeakPolarHBondContact CA-OD1 3.05Å; L197-N233 HydrophobicContact CD2-CB 4.2Å; L198-N233 PolarHBondContact N-OD1 2.82Å; L198-N233 PolarHBondContact O-ND2 2.84Å; V231-N233 VanDerWaalsContact C-N 3.33Å; V231-N233 PolarHBondContact O-N 2.88Å; N233-S235 PolarHBondContact O-N 2.8Å; N233-A236 PolarHBondContact O-N 3.08Å; N233-A237 VanDerWaalsContact O-CB 3.32Å; N233-A237 WeakPolarHBondContact O-CB 3.29Å; N233-A237 PolarHBondContact O-N 2.97Å
234	L	96.9	Very high	96.5	Very high	15 Å²	15	61.2 Å²	61.2	8%	0.079	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-48.4	-175.7	-76.4	171.7	0	0	0	113.3	L227 T228 V231 A236 A237 G238 A239 P241	L227-L234 HydrophobicContact CB-CD2 3.98Å; L227-L234 HydrophobicContact CD1-CD2 3.73Å; L227-L234 HydrophobicContact CG-CD2 4.3Å; T228-L234 WeakPolarHBondContact O-CD1 3.32Å; V231-L234 HydrophobicContact CB-CD1 4.07Å; V231-L234 HydrophobicContact CB-CD2 3.85Å; V231-L234 HydrophobicContact CB-CG 3.7Å; V231-L234 HydrophobicContact CG1-CD2 3.67Å; V231-L234 HydrophobicContact CG1-CG 3.78Å; V231-L234 WeakPolarHBondContact O-CG 3.36Å; L234-A236 PolarHBondContact O-N 3.17Å; L234-A237 CarbonylContact O-C 3.54Å; L234-A237 PolarHBondContact O-N 3.48Å; L234-G238 PolarHBondContact O-N 2.79Å; L234-G238 VanDerWaalsContact O-N 3.12Å; L234-A239 CarbonylContact C-O 3.46Å; L234-A239 HydrophobicContact CD2-CB 3.76Å; L234-A239 PolarHBondContact O-N 3.44Å; L234-P241 HydrophobicContact CD1-CB 4.39Å; L234-P241 HydrophobicContact CD1-CG 3.71Å
235	S	94.8	Very high	96.5	Very high	120 Å²	120	55.9 Å²	55.9	84%	0.839	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-46.7	179.9	-173.2	0	0	0	0	111.6	N233 A237 G238	N233-S235 PolarHBondContact O-N 2.8Å; S235-A237 VanDerWaalsContact C-N 3.28Å; S235-A237 PolarHBondContact O-N 3.11Å; S235-G238 PolarHBondContact O-N 2.83Å
236	A	95.3	Very high	96.5	Very high	53 Å²	53	59.7 Å²	59.7	44%	0.438	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-29.3	179.2	0	0	0	0	0	112.6	Y64 N233 L234 G238	Y64-A236 HydrophobicContact CD1-CB 3.9Å; Y64-A236 HydrophobicContact CE1-CB 4.41Å; N233-A236 PolarHBondContact O-N 3.08Å; L234-A236 PolarHBondContact O-N 3.17Å; A236-G238 VanDerWaalsContact C-N 3.3Å
237	A	96.8	Very high	96.6	Very high	7 Å²	7	57.7 Å²	57.7	6%	0.058	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	8	176.5	0	0	0	0	0	113.7	Y64 L198 R200 N233 L234 S235 A239	Y64-A237 HydrophobicContact CE1-CB 3.96Å; L198-A237 HydrophobicContact CB-CB 4.2Å; L198-A237 HydrophobicContact CD2-CB 3.85Å; L198-A237 HydrophobicContact CG-CB 4.1Å; R200-A237 HydrophobicContact CG-CB 4.18Å; R200-A237 PolarHBondContact NE-O 3.18Å; R200-A237 PolarHBondContact NH2-O 2.98Å; N233-A237 VanDerWaalsContact O-CB 3.32Å; N233-A237 WeakPolarHBondContact O-CB 3.29Å; N233-A237 PolarHBondContact O-N 2.97Å; L234-A237 CarbonylContact O-C 3.54Å; L234-A237 PolarHBondContact O-N 3.48Å; S235-A237 VanDerWaalsContact C-N 3.28Å; S235-A237 PolarHBondContact O-N 3.11Å; A237-A239 VanDerWaalsContact C-N 3.35Å; A237-A239 PolarHBondContact O-N 3.34Å
238	G	96	Very high	96.6	Very high	61 Å²	61	59 Å²	59	63%	0.629	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	43	179.3	0	0	0	0	0	112.9	R200 L234 S235 A236	R200-G238 PolarHBondContact NH2-O 3.03Å; L234-G238 PolarHBondContact O-N 2.79Å; L234-G238 VanDerWaalsContact O-N 3.12Å; S235-G238 PolarHBondContact O-N 2.83Å; A236-G238 VanDerWaalsContact C-N 3.3Å
239	A	96.6	Very high	96.7	Very high	8 Å²	8	58.7 Å²	58.7	7%	0.066	36%	0.359	C	S	.	.			trans	-132.1	161.6	-177	0	0	0	0	0	111.4	L198 L227 L234 A237	L198-A239 HydrophobicContact CD2-CB 3.67Å; L227-A239 HydrophobicContact CD1-CB 3.6Å; L234-A239 CarbonylContact C-O 3.46Å; L234-A239 HydrophobicContact CD2-CB 3.76Å; L234-A239 PolarHBondContact O-N 3.44Å; A237-A239 VanDerWaalsContact C-N 3.35Å; A237-A239 PolarHBondContact O-N 3.34Å
240	R	94.1	Very high	96.9	Very high	186 Å²	186	52.7 Å²	52.7	70%	0.702	33%	0.326	S	S	*	.			trans	-124.3	150.4	178.8	-55.2	-179.8	-176.7	-160.2	-0.2	111.7	E243	R240-E243 HydrophobicContact CB-CG 4.44Å; R240-E243 VanDerWaalsContact CB-OE1 3.27Å; R240-E243 WeakPolarHBondContact CB-OE1 3.14Å; R240-E243 PolarHBondContact N-OE1 3.17Å; R240-E243 WeakPolarHBondContact O-CB 3.49Å; R240-E243 WeakPolarHBondContact O-CG 3.4Å; R240-E243 PolarHBondContact O-N 2.86Å
241	P	94.4	Very high	97.1	Very high	70 Å²	70	46.3 Å²	46.3	46%	0.455	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	145.4	170	-20.5	31	0	0	0	111.7	D229 L234 E243	D229-P241 WeakPolarHBondContact OD1-CB 3.2Å; D229-P241 WeakPolarHBondContact OD1-CG 3.19Å; L234-P241 HydrophobicContact CD1-CB 4.39Å; L234-P241 HydrophobicContact CD1-CG 3.71Å; P241-E243 VanDerWaalsContact C-N 3.3Å; P241-E243 PolarHBondContact O-N 3.38Å
242	G	95.6	Very high	97.1	Very high	69 Å²	69	46.2 Å²	46.2	71%	0.711	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	-14.2	-178.8	0	0	0	0	0	114.8	L227	L227-G242 PolarHBondContact O-N 2.76Å
243	E	97.2	Very high	97.2	Very high	67 Å²	67	45.6 Å²	45.6	31%	0.313	30%	0.297	S	S	.	.			trans	-64.2	153.1	170.5	-69.9	178.9	-140.5	0	0	111.1	L227 R240 P241	L227-E243 HydrophobicContact CB-CB 4.43Å; L227-E243 HydrophobicContact CD1-CB 3.97Å; L227-E243 HydrophobicContact CG-CB 4.25Å; L227-E243 PolarHBondContact N-O 3.39Å; R240-E243 HydrophobicContact CB-CG 4.44Å; R240-E243 VanDerWaalsContact CB-OE1 3.27Å; R240-E243 WeakPolarHBondContact CB-OE1 3.14Å; R240-E243 PolarHBondContact N-OE1 3.17Å; R240-E243 WeakPolarHBondContact O-CB 3.49Å; R240-E243 WeakPolarHBondContact O-CG 3.4Å; R240-E243 PolarHBondContact O-N 2.86Å; P241-E243 VanDerWaalsContact C-N 3.3Å; P241-E243 PolarHBondContact O-N 3.38Å
244	T	98.1	Very high	97.2	Very high	62 Å²	62	46.1 Å²	46.1	38%	0.38	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	114.3	170.9	-61.8	0	0	0	0	108.9	R224 D225	R224-T244 HydrophobicContact CB-CG2 3.94Å; D225-T244 WeakPolarHBondContact O-CA 3.37Å
245	L	98.3	Very high	97.3	Very high	28 Å²	28	45.4 Å²	45.4	15%	0.147	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	137.7	-177	-55.9	-177.1	0	0	0	110	H171 L198 R224 D225 L227	H171-L245 WeakPolarHBondContact CE1-CB 3.48Å; H171-L245 WeakPolarHBondContact NE2-CB 3.3Å; L198-L245 HydrophobicContact CD1-CD1 4.15Å; L198-L245 HydrophobicContact CD2-CD1 4.2Å; R224-L245 CarbonylContact C-O 3.56Å; R224-L245 WeakPolarHBondContact CA-O 3.07Å; D225-L245 PolarHBondContact N-O 3.32Å; D225-L245 PolarHBondContact O-N 3.37Å; L227-L245 HydrophobicContact CD1-CD1 3.97Å; L227-L245 HydrophobicContact CD1-CG 4.13Å; L227-L245 HydrophobicContact CD2-CD1 4.39Å; L227-L245 HydrophobicContact CG-CG 4.39Å
246	S	98.5	Very high	97.3	Very high	80 Å²	80	40.2 Å²	40.2	56%	0.559	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.2	175.3	-62.1	0	0	0	0	110.2	H171 R224	H171-S246 PolarHBondContact CE1-O 2.66Å; R224-S246 PolarHBondContact NE-OG 3.4Å
247	R	98.4	Very high	97.3	Very high	22 Å²	22	38.9 Å²	38.9	8%	0.083	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-73.6	138	179.2	-63.9	-169.7	-176.6	174	1.3	110.5	P146 Q220 R222 D223 D225	P146-R247 WeakPolarHBondContact CG-O 3.04Å; Q220-R247 PolarHBondContact O-NH1 3.45Å; R222-R247 WeakPolarHBondContact O-CD 3.4Å; R222-R247 PolarHBondContact O-NH1 2.98Å; D223-R247 WeakPolarHBondContact O-CB 3.48Å; D223-R247 PolarHBondContact O-N 2.73Å; D225-R247 IonicContact OD1-CZ 2.61Å; D225-R247 IonicContact OD1-NE 3.04Å; D225-R247 IonicContact OD1-NH2 3.74Å; D225-R247 PolarHBondContact OD1-NH2 3.44Å; D225-R247 IonicContact OD2-CZ 3.15Å; D225-R247 IonicContact OD2-NE 2.84Å; D225-R247 PolarHBondContact OD2-NE 2.86Å; D225-R247 IonicContact OD2-NH2 2.67Å; D225-R247 PolarHBondContact OD2-NH2 2.95Å; D225-R247 VanDerWaalsContact OD2-NH2 3.12Å
248	G	98.6	Very high	97.1	Very high	31 Å²	31	38.6 Å²	38.6	32%	0.32	24%	0.24	S	C	.	.			trans	-101.9	-166.1	157.7	0	0	0	0	0	110.5	S170 R250	S170-G248 WeakPolarHBondContact CB-O 3.37Å; S170-G248 PolarHBondContact OG-N 3.26Å; G248-R250 PolarHBondContact O-N 3.14Å
249	T	98.6	Very high	96.7	Very high	60 Å²	60	38.5 Å²	38.5	37%	0.368	23%	0.229	S	C	.	.			trans	-69.2	123.5	170.5	-56	0	0	0	0	109.8	E143 Y144 S170	E143-T249 HydrophobicContact CG-CG2 3.85Å; Y144-T249 CarbonylContact O-C 3.59Å; Y144-T249 WeakPolarHBondContact O-CA 3.32Å; S170-T249 WeakPolarHBondContact CB-O 3.29Å; S170-T249 PolarHBondContact N-O 2.9Å
250	R	98.6	Very high	96.3	Very high	13 Å²	13	44.5 Å²	44.5	5%	0.049	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.1	175.3	174.2	177.9	172.7	-88.4	4.6	109.9	E143 Y144 N167 S170 T172 G248 S252	E143-R250 WeakPolarHBondContact CA-O 3.43Å; Y144-R250 PolarHBondContact N-O 3.09Å; Y144-R250 PolarHBondContact O-N 2.65Å; N167-R250 PolarHBondContact OD1-NE 2.94Å; N167-R250 PolarHBondContact OD1-NH2 2.96Å; S170-R250 WeakPolarHBondContact O-CG 3.44Å; T172-R250 VanDerWaalsContact CG2-NE 3.31Å; G248-R250 PolarHBondContact O-N 3.14Å; R250-S252 PolarHBondContact NH1-OG 3.22Å
251	V	98.8	Very high	96	Very high	1 Å²	1	38 Å²	38	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	144.5	165.7	175.2	0	0	0	0	108.4	L78 V81 Y82 V141 N142 E143 L168 L253	L78-V251 HydrophobicContact CD2-CB 3.92Å; L78-V251 HydrophobicContact CD2-CG2 3.88Å; V81-V251 HydrophobicContact CG1-CG1 4.24Å; V81-V251 HydrophobicContact CG2-CG1 4.4Å; Y82-V251 HydrophobicContact CE2-CG2 4.45Å; V141-V251 HydrophobicContact CG1-CG1 3.68Å; N142-V251 CarbonylContact O-C 3.59Å; N142-V251 VanDerWaalsContact O-CA 3.29Å; N142-V251 WeakPolarHBondContact O-CA 3.4Å; E143-V251 HydrophobicContact CB-CG2 4.38Å; E143-V251 HydrophobicContact CG-CG2 4.32Å; L168-V251 HydrophobicContact CB-CB 4.18Å; L168-V251 HydrophobicContact CD1-CG1 4.25Å; L168-V251 PolarHBondContact N-O 2.84Å; L168-V251 PolarHBondContact O-N 3.27Å; V251-L253 HydrophobicContact CG1-CD1 4.02Å
252	S	98.8	Very high	95.6	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.014	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.7	174.6	51.6	0	0	0	0	111.3	V141 N142 I166 R250	V141-S252 CarbonylContact C-O 3.49Å; V141-S252 VanDerWaalsContact CA-O 3.27Å; V141-S252 WeakPolarHBondContact CA-O 3.23Å; N142-S252 PolarHBondContact N-O 3.22Å; N142-S252 PolarHBondContact O-N 2.98Å; N142-S252 PolarHBondContact O-OG 3.01Å; I166-S252 WeakPolarHBondContact O-CA 3.46Å; R250-S252 PolarHBondContact NH1-OG 3.22Å
253	L	98.8	Very high	94.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	98.2	176	-75.1	59.6	0	0	0	106.9	L77 W117 L118 V139 V141 T165 I166 L168 V251 I255	L77-L253 HydrophobicContact CD1-CD2 4.34Å; L77-L253 HydrophobicContact CD2-CD2 4.31Å; W117-L253 HydrophobicContact CZ3-CD2 4.19Å; L118-L253 HydrophobicContact CD2-CD2 4.01Å; L118-L253 HydrophobicContact CD2-CG 4.48Å; V139-L253 HydrophobicContact CG1-CB 4.24Å; V141-L253 HydrophobicContact CG2-CG 4.39Å; T165-L253 WeakPolarHBondContact CA-O 3.41Å; I166-L253 HydrophobicContact CB-CB 4.34Å; I166-L253 PolarHBondContact N-O 2.87Å; I166-L253 PolarHBondContact O-N 2.95Å; L168-L253 HydrophobicContact CD1-CD1 3.37Å; L168-L253 HydrophobicContact CG-CD1 4.04Å; V251-L253 HydrophobicContact CG1-CD1 4.02Å; L253-I255 HydrophobicContact CB-CG1 4.47Å; L253-I255 PolarHBondContact O-N 2.5Å
254	T	98.3	Very high	92.7	Very high	14 Å²	14	46.4 Å²	46.4	9%	0.086	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	106.2	176.8	-55	0	0	0	0	108.9	V139 L140 V163 S164 R256	V139-T254 WeakPolarHBondContact CA-O 3.28Å; L140-T254 PolarHBondContact N-O 2.78Å; L140-T254 PolarHBondContact O-N 3.44Å; V163-T254 HydrophobicContact CG1-CG2 3.86Å; S164-T254 CarbonylContact O-C 3.45Å; S164-T254 WeakPolarHBondContact O-CA 3.16Å; T254-R256 HydrophobicContact CG2-CG 4.37Å; T254-R256 VanDerWaalsContact CG2-NH2 3.3Å
255	I	98.1	Very high	90.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.6	-171.4	-64.2	165	0	0	0	108.8	C121 V125 F131 A136 V139 S164 I166 L253	C121-I255 HydrophobicContact CB-CD1 3.77Å; V125-I255 HydrophobicContact CG2-CD1 3.96Å; F131-I255 HydrophobicContact CE2-CG2 4.49Å; F131-I255 HydrophobicContact CZ-CG2 4.37Å; A136-I255 HydrophobicContact CB-CG2 3.36Å; V139-I255 HydrophobicContact CG1-CG1 4.02Å; V139-I255 HydrophobicContact CG2-CG1 4Å; S164-I255 PolarHBondContact N-O 3.09Å; S164-I255 PolarHBondContact O-N 3.13Å; S164-I255 WeakPolarHBondContact OG-CB 3.27Å; S164-I255 PolarHBondContact OG-O 2.73Å; I166-I255 HydrophobicContact CD1-CD1 3.8Å; I166-I255 HydrophobicContact CG1-CD1 4.23Å; L253-I255 HydrophobicContact CB-CG1 4.47Å; L253-I255 PolarHBondContact O-N 2.5Å
256	R	95.4	Very high	88.3	Confident	11 Å²	11	60.8 Å²	60.8	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	156.5	-175	-59.4	-173.4	-176	168.7	4.3	112.1	A136 N137 H138 D155 Y159 T254	A136-R256 WeakPolarHBondContact CA-O 3.35Å; A136-R256 WeakPolarHBondContact CB-O 3.37Å; N137-R256 PolarHBondContact N-O 2.91Å; H138-R256 PolarHBondContact N-O 3.13Å; H138-R256 VanDerWaalsContact N-O 3.17Å; H138-R256 PolarHBondContact O-N 3.47Å; D155-R256 IonicContact OD1-CZ 3.86Å; D155-R256 IonicContact OD1-NH1 2.74Å; D155-R256 PolarHBondContact OD1-NH1 3.37Å; D155-R256 IonicContact OD1-NH2 3.21Å; D155-R256 PolarHBondContact OD1-NH2 3.31Å; D155-R256 IonicContact OD2-CZ 3.49Å; D155-R256 IonicContact OD2-NH1 3.12Å; D155-R256 IonicContact OD2-NH2 3.38Å; D155-R256 PolarHBondContact OD2-NH2 3.19Å; Y159-R256 HydrophobicContact CD1-CB 3.63Å; Y159-R256 HydrophobicContact CD1-CG 4.11Å; Y159-R256 HydrophobicContact CE1-CB 4.15Å; Y159-R256 HydrophobicContact CE1-CG 4.49Å; Y159-R256 HydrophobicContact CG-CB 4.28Å; Y159-R256 VanDerWaalsContact CG-CD 3.44Å; Y159-R256 HydrophobicContact CG-CG 4.43Å; T254-R256 HydrophobicContact CG2-CG 4.37Å; T254-R256 VanDerWaalsContact CG2-NH2 3.3Å
257	H	94.8	Very high	85.8	Confident	24 Å²	24	63.2 Å²	63.2	11%	0.111	31%	0.314	C	S	.	.			trans	-99.7	124.7	164.6	178.4	74.2	0	0	0	109.9	F131 K134 T135 H160	F131-H257 HydrophobicContact CB-CB 4.28Å; F131-H257 HydrophobicContact CD1-CB 4.08Å; F131-H257 HydrophobicContact CG-CB 4.13Å; K134-H257 WeakPolarHBondContact CD-NE2 3.24Å; T135-H257 PolarHBondContact O-ND1 3.17Å; H160-H257 HydrophobicContact CB-CB 4.06Å; H160-H257 PolarHBondContact N-O 2.87Å
258	V	92.8	Very high	83.5	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.006	35%	0.347	C	S	.	.			trans	-100.1	111.5	171	-178.3	0	0	0	0	108.7	M109 N137 H138 L158 Y159	M109-V258 HydrophobicContact CB-CB 4.46Å; M109-V258 HydrophobicContact CB-CG1 3.78Å; M109-V258 HydrophobicContact CE-CB 3.92Å; M109-V258 HydrophobicContact CE-CG1 4.46Å; M109-V258 HydrophobicContact CE-CG2 4.04Å; M109-V258 HydrophobicContact SD-CB 4.27Å; M109-V258 HydrophobicContact SD-CG2 3.86Å; N137-V258 PolarHBondContact ND2-O 3.32Å; N137-V258 PolarHBondContact OD1-N 3.28Å; H138-V258 HydrophobicContact CB-CG2 3.83Å; L158-V258 HydrophobicContact CD1-CG1 4.08Å; L158-V258 HydrophobicContact CG-CG1 4.14Å; Y159-V258 HydrophobicContact CD1-CG2 3.63Å; Y159-V258 HydrophobicContact CE1-CG2 3.69Å
259	P	88.4	Confident	80.9	Confident	59 Å²	59	71 Å²	71	38%	0.383	37%	0.365	S	S	.	.	S	Bend	trans	-69.3	-38.9	-175.7	-20.1	31.7	0	0	0	113.6	L158	L158-P259 WeakPolarHBondContact O-CD 3.2Å
260	K	88.3	Confident	78.4	Confident	134 Å²	134	80 Å²	80	58%	0.583	39%	0.393	S	S	*	.			trans	-98.5	105.7	-174.5	-167.6	178.3	-173.4	-179.1	0	110.6	K107 G108 M109	K107-K260 WeakPolarHBondContact O-CD 3.42Å; K107-K260 WeakPolarHBondContact O-CE 3.49Å; G108-K260 CarbonylContact C-O 3.51Å; G108-K260 WeakPolarHBondContact CA-O 3.22Å; M109-K260 PolarHBondContact N-O 3.02Å
261	V	88.1	Confident	75.6	Confident	51 Å²	51	92.7 Å²	92.7	31%	0.309	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.8	177.1	-64.1	0	0	0	0	111.2	M109 T111 R263	M109-V261 HydrophobicContact CE-CG1 4.44Å; M109-V261 WeakPolarHBondContact O-CA 3.41Å; T111-V261 HydrophobicContact CG2-CB 3.6Å; T111-V261 HydrophobicContact CG2-CG1 3.39Å; V261-R263 PolarHBondContact O-N 3.14Å
262	I	85.2	Confident	74.5	Confident	46 Å²	46	97.3 Å²	97.3	24%	0.236	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	109.1	176.1	-59.3	172.5	0	0	0	107.5	H105 K107 G108 M109 L110 T264	H105-I262 HydrophobicContact CB-CD1 4.2Å; K107-I262 HydrophobicContact CB-CD1 4.05Å; G108-I262 VanDerWaalsContact O-CD1 3.26Å; G108-I262 WeakPolarHBondContact O-CD1 3.42Å; M109-I262 PolarHBondContact O-N 2.7Å; L110-I262 HydrophobicContact CD2-CB 3.91Å; L110-I262 HydrophobicContact CD2-CD1 4.06Å; L110-I262 HydrophobicContact CD2-CG2 3.85Å; L110-I262 HydrophobicContact CG-CD1 4.24Å; I262-T264 PolarHBondContact O-N 3.16Å
263	R	73	Confident	73.2	Confident	221 Å²	221	102.3 Å²	102.3	83%	0.834	49%	0.494	S	S	*	.			trans	-82.4	107.2	173.5	-66	-173.2	-178.9	-172.2	0.9	109.6	V261 R265	V261-R263 PolarHBondContact O-N 3.14Å; R263-R265 PolarHBondContact O-N 3.46Å; R263-R265 VanDerWaalsContact O-N 3.14Å
264	T	59.9	Low	71.8	Confident	114 Å²	114	108 Å²	108	70%	0.699	52%	0.522	S	S	*	.			trans	-72.4	104.8	169	-34.1	0	0	0	0	108.2	I262 M266	I262-T264 PolarHBondContact O-N 3.16Å; T264-M266 PolarHBondContact O-N 3.3Å; T264-M266 VanDerWaalsContact O-N 3.14Å
265	R	51.8	Low	70.2	Confident	228 Å²	228	113.5 Å²	113.5	86%	0.86	55%	0.548	S	S	*	.			trans	-70.4	106.6	167.4	-78.8	-174.7	169.6	-174.4	-2.4	107.4	R263 V267	R263-R265 PolarHBondContact O-N 3.46Å; R263-R265 VanDerWaalsContact O-N 3.14Å; R265-V267 VanDerWaalsContact C-N 3.34Å; R265-V267 PolarHBondContact O-N 2.95Å
266	M	50.8	Low	68.5	Low	164 Å²	164	120.6 Å²	120.6	81%	0.808	58%	0.582	S	S	*	*			trans	-64.3	99.8	164	-68.7	-163.8	-62.6	0	0	107.7	T264 L268	T264-M266 PolarHBondContact O-N 3.3Å; T264-M266 VanDerWaalsContact O-N 3.14Å; M266-L268 VanDerWaalsContact C-N 3.32Å; M266-L268 PolarHBondContact O-N 3.12Å; M266-L268 VanDerWaalsContact O-N 3.13Å
267	V	46.3	Very low	66.7	Low	131 Å²	131	127.9 Å²	127.9	79%	0.794	62%	0.618	S	S	*	*			trans	-75.8	94.9	163.3	-179.2	0	0	0	0	105.3	R265 G269	R265-V267 VanDerWaalsContact C-N 3.34Å; R265-V267 PolarHBondContact O-N 2.95Å; V267-G269 PolarHBondContact O-N 3.18Å
268	L	49.7	Very low	64.7	Low	148 Å²	148	135.4 Å²	135.4	78%	0.775	65%	0.654	S	S	*	*			trans	-59.6	111.9	162.6	-88.8	100.4	0	0	0	106.7	M266 R270	M266-L268 VanDerWaalsContact C-N 3.32Å; M266-L268 PolarHBondContact O-N 3.12Å; M266-L268 VanDerWaalsContact O-N 3.13Å; L268-R270 PolarHBondContact O-N 3.19Å
269	G	45.5	Very low	62.5	Low	69 Å²	69	145.7 Å²	145.7	71%	0.711	70%	0.704	S	S	*	*			trans	-50.9	125.6	170.1	0	0	0	0	0	109	V267 K271	V267-G269 PolarHBondContact O-N 3.18Å; G269-K271 PolarHBondContact O-N 3.28Å
270	R	44.5	Very low	60.4	Low	249 Å²	249	152.9 Å²	152.9	94%	0.94	73%	0.731	S	S	*	*			trans	-62.2	121.2	170.7	-80.8	177.9	167.6	176.6	-4.2	107.9	L268	L268-R270 PolarHBondContact O-N 3.19Å
271	K	41.3	Very low	57.8	Low	280 Å²	280	154.6 Å²	154.6	100%	1.217	74%	0.744	S	S	*	*			trans	23.6	0	158.3	-68.7	-173.8	176.9	-176.2	0	117.9	G269	G269-K271 PolarHBondContact O-N 3.28Å

Retrieved 271 of 271 residues in 115.8 ms (Link to these results)

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