A0A087XN02_POEFO Loading...

DET1 partner of COP1 E3 ubiquitin ligase

AlphaFold DB , UniProt , Accession A0A087XN02, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 554 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	I	38.3	Very low	48.3	Very low	225 Å²	225	157.5 Å²	157.5	100%	1.154	86%	0.856	S	S	*	*				0	87.5	0	-62.3	168.6	0	0	0	105.7
2	A	34.4	Very low	50.5	Low	99 Å²	99	160.3 Å²	160.3	82%	0.818	85%	0.854	S	S	*	*			trans	-100.1	119.3	-179.3	0	0	0	0	0	107.4	M4	A2-M4 PolarHBondContact O-N 3.5Å
3	T	37.5	Very low	52.2	Low	130 Å²	130	157.5 Å²	157.5	80%	0.798	85%	0.85	S	S	*	*			trans	-67.9	122.2	178	36.3	0	0	0	0	109.9	E5	T3-E5 PolarHBondContact O-N 3.33Å
4	M	43.2	Very low	53.8	Low	186 Å²	186	157.1 Å²	157.1	92%	0.916	83%	0.831	S	S	*	*			trans	-67.1	112.6	168.2	-63.4	172.8	83.1	0	0	108	A2	A2-M4 PolarHBondContact O-N 3.5Å
5	E	43.9	Very low	55.6	Low	188 Å²	188	162 Å²	162	88%	0.879	83%	0.833	S	S	*	*			trans	-77	117.5	163.4	-79.5	-177.3	154.6	0	0	108.2	T3 D7	T3-E5 PolarHBondContact O-N 3.33Å; E5-D7 PolarHBondContact O-N 2.86Å
6	E	48	Very low	57.5	Low	178 Å²	178	157.4 Å²	157.4	83%	0.832	81%	0.81	S	S	*	*			trans	-65.3	108.9	170.2	-71.4	-179.5	144.8	0	0	109.4	V8	E6-V8 VanDerWaalsContact C-N 3.28Å; E6-V8 PolarHBondContact O-N 3.22Å
7	D	49.2	Very low	59	Low	162 Å²	162	155.5 Å²	155.5	87%	0.866	80%	0.796	S	S	*	*			trans	-65	88.4	166.3	-102.6	-29.1	0	0	0	109.3	E5 L9	E5-D7 PolarHBondContact O-N 2.86Å; D7-L9 PolarHBondContact O-N 2.96Å
8	V	54.1	Low	60.4	Low	110 Å²	110	151.4 Å²	151.4	67%	0.667	78%	0.776	S	S	*	*			trans	-66.2	100.7	170.7	-179.4	0	0	0	0	107.9	E6 T10	E6-V8 VanDerWaalsContact C-N 3.28Å; E6-V8 PolarHBondContact O-N 3.22Å; V8-T10 VanDerWaalsContact C-N 3.28Å; V8-T10 PolarHBondContact O-N 2.76Å
9	L	52.4	Low	61.8	Low	165 Å²	165	145.4 Å²	145.4	86%	0.864	75%	0.745	S	S	*	*			trans	-57.3	88	170.8	-77.2	163.4	0	0	0	110.4	D7 L11	D7-L9 PolarHBondContact O-N 2.96Å; L9-L11 PolarHBondContact O-N 3.31Å; L9-L11 VanDerWaalsContact O-N 3.09Å
10	T	63.4	Low	63.1	Low	118 Å²	118	142.3 Å²	142.3	72%	0.724	73%	0.73	S	S	*	*			trans	-71.4	103.3	173.4	30	0	0	0	0	109	V8 K12	V8-T10 VanDerWaalsContact C-N 3.28Å; V8-T10 PolarHBondContact O-N 2.76Å; T10-K12 PolarHBondContact O-N 3.25Å
11	L	67.1	Low	64.3	Low	171 Å²	171	138.2 Å²	138.2	90%	0.895	71%	0.711	S	S	*	*			trans	-58.2	101.8	173.1	-72.5	167.2	0	0	0	109.6	L9	L9-L11 PolarHBondContact O-N 3.31Å; L9-L11 VanDerWaalsContact O-N 3.09Å
12	K	74.8	Confident	66.8	Low	191 Å²	191	131.7 Å²	131.7	83%	0.83	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-63.6	128.5	175.8	-72.9	-176	179.4	177.1	0	109.7	T10 R14	T10-K12 PolarHBondContact O-N 3.25Å; K12-R14 PolarHBondContact O-N 3.09Å
13	P	72.3	Confident	69.4	Low	125 Å²	125	132.7 Å²	132.7	81%	0.812	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-61.3	136.2	178	23.5	-31.6	0	0	0	110.2	R15	P13-R15 PolarHBondContact O-N 3.42Å
14	R	75.3	Confident	71.9	Confident	152 Å²	152	128 Å²	128	57%	0.574	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-64.4	124.7	-176.6	-175.5	-178.3	-177.7	163.2	9.8	110.5	K12 I16 R496 D497	K12-R14 PolarHBondContact O-N 3.09Å; R14-I16 PolarHBondContact O-N 2.92Å; R14-R496 PolarHBondContact NH1-O 3.3Å; R14-R496 PolarHBondContact NH2-O 3.2Å; R14-D497 PolarHBondContact NE-O 2.86Å; R14-D497 PolarHBondContact NH2-O 3.34Å
15	R	80.6	Confident	74	Confident	230 Å²	230	123 Å²	123	87%	0.868	61%	0.609	S	S	*	*			trans	-71.9	114.4	173.5	-169.4	175.9	-178.4	179.1	1.9	110.3	P13	P13-R15 PolarHBondContact O-N 3.42Å
16	I	85.3	Confident	76.2	Confident	89 Å²	89	118 Å²	118	46%	0.456	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-77.3	123	176	-60.8	174.8	0	0	0	108.9	R14 Q19 A498 L500	R14-I16 PolarHBondContact O-N 2.92Å; I16-Q19 HydrophobicContact CG2-CG 4.36Å; I16-A498 HydrophobicContact CG2-CB 3.89Å; I16-L500 HydrophobicContact CD1-CD2 4.37Å; I16-L500 HydrophobicContact CG2-CD1 4.45Å
17	Q	82.6	Confident	78	Confident	125 Å²	125	114 Å²	114	58%	0.584	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-74.1	154.8	173.1	-63.6	-168.3	7.6	0	0	110.8	Q19	Q17-Q19 WeakPolarHBondContact O-CG 3.43Å; Q17-Q19 PolarHBondContact O-N 3.16Å; Q17-Q19 PolarHBondContact O-NE2 3.05Å
18	N	85.1	Confident	79.6	Confident	81 Å²	81	112.2 Å²	112.2	43%	0.433	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-54.2	125.1	178	-168.4	-9.3	0	0	0	111.2	N20 Y23 R24	N18-N20 VanDerWaalsContact OD1-CB 3.27Å; N18-N20 WeakPolarHBondContact OD1-CB 3.27Å; N18-N20 PolarHBondContact OD1-N 2.97Å; N18-Y23 HydrophobicContact CB-CD1 3.62Å; N18-Y23 HydrophobicContact CB-CE1 3.79Å; N18-Y23 HydrophobicContact CB-CG 4.28Å; N18-Y23 VanDerWaalsContact ND2-CG 3.32Å; N18-R24 PolarHBondContact O-NE 2.94Å; N18-R24 VanDerWaalsContact O-NE 3.16Å
19	Q	86.6	Confident	81.1	Confident	38 Å²	38	116.5 Å²	116.5	18%	0.178	55%	0.551	C	S	.	*			trans	-94.8	-5.4	-177.1	-60.9	-62.5	-55.1	0	0	112.4	I16 Q17 V21 R24 N48 D497 L500	I16-Q19 HydrophobicContact CG2-CG 4.36Å; Q17-Q19 WeakPolarHBondContact O-CG 3.43Å; Q17-Q19 PolarHBondContact O-N 3.16Å; Q17-Q19 PolarHBondContact O-NE2 3.05Å; Q19-V21 PolarHBondContact O-N 2.83Å; Q19-R24 VanDerWaalsContact CD-NH2 3.3Å; Q19-N48 PolarHBondContact O-OD1 3Å; Q19-D497 PolarHBondContact NE2-OD2 3.02Å; Q19-D497 VanDerWaalsContact NE2-OD2 3.07Å; Q19-L500 HydrophobicContact CG-CD1 4.12Å
20	N	88.5	Confident	82.7	Confident	83 Å²	83	114.6 Å²	114.6	44%	0.444	55%	0.546	S	S	.	.			trans	-63.7	125.9	178.2	-174.7	-45.2	0	0	0	110.5	N18 V22 Y23 R24	N18-N20 VanDerWaalsContact OD1-CB 3.27Å; N18-N20 WeakPolarHBondContact OD1-CB 3.27Å; N18-N20 PolarHBondContact OD1-N 2.97Å; N20-V22 PolarHBondContact O-N 3.28Å; N20-V22 WeakPolarHBondContact OD1-CA 3.43Å; N20-V22 VanDerWaalsContact OD1-CB 3.3Å; N20-V22 WeakPolarHBondContact OD1-CB 3.34Å; N20-V22 PolarHBondContact OD1-N 3.26Å; N20-Y23 PolarHBondContact O-N 3.37Å; N20-Y23 PolarHBondContact OD1-N 2.66Å; N20-R24 WeakPolarHBondContact O-CG 3.39Å; N20-R24 PolarHBondContact O-N 3.21Å; N20-R24 VanDerWaalsContact O-N 3.08Å
21	V	88.6	Confident	83.4	Confident	56 Å²	56	111.8 Å²	111.8	34%	0.339	53%	0.53	S	S	.	.	H	α-helix	trans	-63.1	-39.5	-178.3	67.3	0	0	0	0	112.3	Q19 R24 L25 N48	Q19-V21 PolarHBondContact O-N 2.83Å; V21-R24 PolarHBondContact O-N 3.02Å; V21-L25 HydrophobicContact CG2-CD1 4.24Å; V21-L25 HydrophobicContact CG2-CG 4.44Å; V21-L25 WeakPolarHBondContact O-CG 3.49Å; V21-L25 PolarHBondContact O-N 2.92Å; V21-N48 HydrophobicContact CB-CB 4.23Å; V21-N48 HydrophobicContact CG2-CB 4.13Å
22	V	91.1	Very high	83.5	Confident	88 Å²	88	108.4 Å²	108.4	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-47	178.8	-178	0	0	0	0	109.9	N20 R24 L25 E26	N20-V22 PolarHBondContact O-N 3.28Å; N20-V22 WeakPolarHBondContact OD1-CA 3.43Å; N20-V22 VanDerWaalsContact OD1-CB 3.3Å; N20-V22 WeakPolarHBondContact OD1-CB 3.34Å; N20-V22 PolarHBondContact OD1-N 3.26Å; V22-R24 VanDerWaalsContact C-N 3.32Å; V22-R24 PolarHBondContact O-N 3.08Å; V22-L25 PolarHBondContact O-N 3.19Å; V22-E26 PolarHBondContact O-N 2.89Å
23	Y	88.9	Confident	83.5	Confident	121 Å²	121	100.9 Å²	100.9	48%	0.475	50%	0.498	S	S	.	.	H	α-helix	trans	-59.7	-41.9	175.9	177.3	-95.8	0	0	0	112.2	N18 N20 K27	N18-Y23 HydrophobicContact CB-CD1 3.62Å; N18-Y23 HydrophobicContact CB-CE1 3.79Å; N18-Y23 HydrophobicContact CB-CG 4.28Å; N18-Y23 VanDerWaalsContact ND2-CG 3.32Å; N20-Y23 PolarHBondContact O-N 3.37Å; N20-Y23 PolarHBondContact OD1-N 2.66Å; Y23-K27 HydrophobicContact CE1-CD 4.36Å; Y23-K27 WeakPolarHBondContact O-CB 3.23Å; Y23-K27 PolarHBondContact O-N 3.37Å
24	R	88.2	Confident	83.9	Confident	32 Å²	32	105.1 Å²	105.1	12%	0.121	50%	0.497	C	S	.	.	H	α-helix	trans	-66.3	-37.6	177.3	-73.1	176.1	173.7	-146.4	-3.9	112.3	N18 Q19 N20 V21 V22 R28 F45 N48 D497	N18-R24 PolarHBondContact O-NE 2.94Å; N18-R24 VanDerWaalsContact O-NE 3.16Å; Q19-R24 VanDerWaalsContact CD-NH2 3.3Å; N20-R24 WeakPolarHBondContact O-CG 3.39Å; N20-R24 PolarHBondContact O-N 3.21Å; N20-R24 VanDerWaalsContact O-N 3.08Å; V21-R24 PolarHBondContact O-N 3.02Å; V22-R24 VanDerWaalsContact C-N 3.32Å; V22-R24 PolarHBondContact O-N 3.08Å; R24-R28 PolarHBondContact O-N 3.08Å; R24-F45 HydrophobicContact CB-CE1 3.73Å; R24-F45 HydrophobicContact CB-CZ 4.12Å; R24-N48 WeakPolarHBondContact CD-ND2 3.48Å; R24-D497 IonicContact CZ-OD2 3.67Å; R24-D497 IonicContact NH1-OD2 3.79Å; R24-D497 IonicContact NH2-OD2 2.66Å; R24-D497 PolarHBondContact NH2-OD2 3.47Å
25	L	88.9	Confident	84	Confident	79 Å²	79	104.3 Å²	104.3	41%	0.414	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-46.5	175.8	-73.8	171.5	0	0	0	111.4	V21 V22 K27 R28 R29 F45	V21-L25 HydrophobicContact CG2-CD1 4.24Å; V21-L25 HydrophobicContact CG2-CG 4.44Å; V21-L25 WeakPolarHBondContact O-CG 3.49Å; V21-L25 PolarHBondContact O-N 2.92Å; V22-L25 PolarHBondContact O-N 3.19Å; L25-K27 PolarHBondContact O-N 3.21Å; L25-R28 WeakPolarHBondContact O-CB 3.3Å; L25-R28 PolarHBondContact O-N 3.38Å; L25-R28 VanDerWaalsContact O-N 3.08Å; L25-R29 PolarHBondContact O-N 2.83Å; L25-F45 HydrophobicContact CD2-CD1 4.09Å; L25-F45 HydrophobicContact CD2-CE1 3.49Å; L25-F45 VanDerWaalsContact CD2-CE1 3.49Å; L25-F45 HydrophobicContact CD2-CZ 3.94Å; L25-F45 HydrophobicContact CG-CD1 4.48Å; L25-F45 HydrophobicContact CG-CE1 3.75Å; L25-F45 HydrophobicContact CG-CZ 4.45Å
26	E	88.8	Confident	83.5	Confident	83 Å²	83	96.2 Å²	96.2	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-44.5	175.3	-75.6	-55.6	138.7	0	0	111.6	V22 R28 R29 V30	V22-E26 PolarHBondContact O-N 2.89Å; E26-R28 PolarHBondContact O-N 3.41Å; E26-R29 WeakPolarHBondContact O-CB 3.49Å; E26-R29 PolarHBondContact O-N 3.47Å; E26-R29 IonicContact OE1-CZ 3.88Å; E26-R29 IonicContact OE1-NH1 2.83Å; E26-R29 PolarHBondContact OE1-NH1 2.66Å; E26-V30 WeakPolarHBondContact O-CG2 3.27Å; E26-V30 PolarHBondContact O-N 3.16Å
27	K	85.8	Confident	83.1	Confident	96 Å²	96	93.4 Å²	93.4	42%	0.417	49%	0.49	S	S	.	.	H	α-helix	trans	-61.7	-29.4	174.6	-170.8	177.5	179.6	-178.6	0	113.1	Y23 L25 C31 R41	Y23-K27 HydrophobicContact CE1-CD 4.36Å; Y23-K27 WeakPolarHBondContact O-CB 3.23Å; Y23-K27 PolarHBondContact O-N 3.37Å; L25-K27 PolarHBondContact O-N 3.21Å; K27-C31 PolarHBondContact O-N 3.31Å; K27-C31 VanDerWaalsContact O-N 3.16Å; K27-R41 PolarHBondContact O-NH2 2.89Å
28	R	84.3	Confident	82.8	Confident	123 Å²	123	92 Å²	92	46%	0.464	48%	0.483	S	S	.	.	H	α-helix	trans	-72.5	-37.3	173.8	177.5	-175.1	170.9	-174.6	-2.9	111.5	R24 L25 E26 C31 F45	R24-R28 PolarHBondContact O-N 3.08Å; L25-R28 WeakPolarHBondContact O-CB 3.3Å; L25-R28 PolarHBondContact O-N 3.38Å; L25-R28 VanDerWaalsContact O-N 3.08Å; E26-R28 PolarHBondContact O-N 3.41Å; R28-C31 VanDerWaalsContact O-O 3.11Å; R28-F45 HydrophobicContact CB-CE2 4.42Å; R28-F45 HydrophobicContact CB-CZ 4.09Å
29	R	84.9	Confident	82.4	Confident	200 Å²	200	91.8 Å²	91.8	76%	0.755	48%	0.477	S	S	*	.	H	α-helix	trans	-64.4	-46.4	175.4	-76.8	177	167.8	168.4	-8.3	111.8	L25 E26	L25-R29 PolarHBondContact O-N 2.83Å; E26-R29 WeakPolarHBondContact O-CB 3.49Å; E26-R29 PolarHBondContact O-N 3.47Å; E26-R29 IonicContact OE1-CZ 3.88Å; E26-R29 IonicContact OE1-NH1 2.83Å; E26-R29 PolarHBondContact OE1-NH1 2.66Å
30	V	85.7	Confident	82	Confident	125 Å²	125	95.4 Å²	95.4	76%	0.758	49%	0.489	S	S	*	.	H	α-helix	trans	-81.9	-27.8	-171.4	-179.4	0	0	0	0	112.9	E26	E26-V30 WeakPolarHBondContact O-CG2 3.27Å; E26-V30 PolarHBondContact O-N 3.16Å
31	C	79	Confident	81.5	Confident	59 Å²	59	94 Å²	94	40%	0.399	48%	0.478	S	S	.	.			trans	-132.8	130.6	-177.5	-179.4	0	0	0	0	109.8	K27 R28 G33 R41	K27-C31 PolarHBondContact O-N 3.31Å; K27-C31 VanDerWaalsContact O-N 3.16Å; R28-C31 VanDerWaalsContact O-O 3.11Å; C31-G33 PolarHBondContact SG-N 3.21Å; C31-G33 VanDerWaalsContact SG-N 3.37Å; C31-R41 PolarHBondContact O-NH1 3.28Å; C31-R41 PolarHBondContact O-NH2 2.88Å
32	S	68.5	Low	81.1	Confident	100 Å²	100	93.7 Å²	93.7	70%	0.699	48%	0.476	S	S	*	.			trans	-83.1	-14.9	173.8	47.1	0	0	0	0	113.2	R41	S32-R41 PolarHBondContact O-NH1 2.67Å
33	G	75.4	Confident	80.7	Confident	33 Å²	33	91 Å²	91	34%	0.34	46%	0.456	S	S	.	.			trans	81.1	-160	178.3	0	0	0	0	0	111.5	C31	C31-G33 PolarHBondContact SG-N 3.21Å; C31-G33 VanDerWaalsContact SG-N 3.37Å
34	R	79.5	Confident	80.6	Confident	214 Å²	214	86.3 Å²	86.3	81%	0.808	44%	0.441	S	S	*	.	S	Bend	trans	-67.7	145.3	174.6	-66.9	-176	-179.2	-178.9	-1	110	G36 A37	R34-G36 PolarHBondContact O-N 2.76Å; R34-A37 HydrophobicContact CB-CB 4.29Å; R34-A37 VanDerWaalsContact O-CB 3.27Å; R34-A37 WeakPolarHBondContact O-CB 3.33Å; R34-A37 PolarHBondContact O-N 3.18Å
35	P	77.4	Confident	80.6	Confident	136 Å²	136	86.1 Å²	86.1	88%	0.883	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	136.7	172.6	-27	34.9	0	0	0	111.3	A37	P35-A37 PolarHBondContact O-N 2.88Å
36	G	71.4	Confident	80.6	Confident	59 Å²	59	84 Å²	84	61%	0.608	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	-11.9	-178.2	0	0	0	0	0	116.2	R34 H38	R34-G36 PolarHBondContact O-N 2.76Å; G36-H38 VanDerWaalsContact C-N 3.28Å; G36-H38 PolarHBondContact O-N 3.07Å
37	A	76.6	Confident	80.7	Confident	30 Å²	30	80.2 Å²	80.2	25%	0.248	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	1.8	-177.8	0	0	0	0	0	114.7	R34 P35 W39 Y40 R41	R34-A37 HydrophobicContact CB-CB 4.29Å; R34-A37 VanDerWaalsContact O-CB 3.27Å; R34-A37 WeakPolarHBondContact O-CB 3.33Å; R34-A37 PolarHBondContact O-N 3.18Å; P35-A37 PolarHBondContact O-N 2.88Å; A37-W39 PolarHBondContact O-N 2.93Å; A37-Y40 PolarHBondContact O-N 3.43Å; A37-R41 WeakPolarHBondContact O-CG 3.36Å; A37-R41 PolarHBondContact O-N 3.2Å
38	H	76.4	Confident	81	Confident	97 Å²	97	76.4 Å²	76.4	45%	0.449	40%	0.395	S	S	.	.	H	α-helix	trans	-60.5	-43.6	-174.6	63.2	-77.3	0	0	0	112.3	G36 R41 V42	G36-H38 VanDerWaalsContact C-N 3.28Å; G36-H38 PolarHBondContact O-N 3.07Å; H38-R41 PolarHBondContact O-N 3.04Å; H38-V42 WeakPolarHBondContact O-CG2 3.19Å; H38-V42 PolarHBondContact O-N 3.41Å
39	W	75.8	Confident	81.3	Confident	76 Å²	76	74.2 Å²	74.2	29%	0.288	39%	0.392	S	S	.	.	H	α-helix	trans	-59.5	-48.6	176.7	-66.7	117.5	0	0	0	112.8	A37 R41 V42 R43 F412	A37-W39 PolarHBondContact O-N 2.93Å; W39-R41 VanDerWaalsContact C-N 3.3Å; W39-R41 PolarHBondContact O-N 3.14Å; W39-V42 PolarHBondContact O-N 3.44Å; W39-R43 WeakPolarHBondContact O-CG 3.42Å; W39-R43 PolarHBondContact O-N 3.15Å; W39-F412 HydrophobicContact CB-CD2 3.88Å; W39-F412 HydrophobicContact CB-CE2 3.64Å; W39-F412 AromaticContact CD1-CE2 3.32Å; W39-F412 AromaticContact CD1-CZ 3.93Å; W39-F412 HydrophobicContact CD2-CE2 4.5Å; W39-F412 HydrophobicContact CG-CD2 4.2Å; W39-F412 AromaticContact CG-CE2 3.56Å; W39-F412 HydrophobicContact CG-CE2 3.56Å
40	Y	78.1	Confident	81.6	Confident	113 Å²	113	66.2 Å²	66.2	44%	0.443	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-42.6	176.3	179.2	-102	0	0	0	111.5	A37 V42 R43 C44 L469	A37-Y40 PolarHBondContact O-N 3.43Å; Y40-V42 PolarHBondContact O-N 3.4Å; Y40-R43 WeakPolarHBondContact O-CB 3.34Å; Y40-R43 PolarHBondContact O-N 3.38Å; Y40-R43 VanDerWaalsContact O-N 3.15Å; Y40-C44 VanDerWaalsContact CE1-SG 3.51Å; Y40-C44 PolarHBondContact O-N 2.89Å; Y40-C44 PolarHBondContact O-SG 3.48Å; Y40-L469 HydrophobicContact CE2-CD2 4.44Å
41	R	78.6	Confident	82	Confident	54 Å²	54	60.4 Å²	60.4	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-66	-37.4	179	-70.3	-178.4	79.9	-156	1.6	113	K27 C31 S32 A37 H38 W39 R43 C44 F45	K27-R41 PolarHBondContact O-NH2 2.89Å; C31-R41 PolarHBondContact O-NH1 3.28Å; C31-R41 PolarHBondContact O-NH2 2.88Å; S32-R41 PolarHBondContact O-NH1 2.67Å; A37-R41 WeakPolarHBondContact O-CG 3.36Å; A37-R41 PolarHBondContact O-N 3.2Å; H38-R41 PolarHBondContact O-N 3.04Å; W39-R41 VanDerWaalsContact C-N 3.3Å; W39-R41 PolarHBondContact O-N 3.14Å; R41-R43 VanDerWaalsContact C-N 3.32Å; R41-C44 PolarHBondContact O-N 3.35Å; R41-F45 WeakPolarHBondContact O-CD2 3.21Å; R41-F45 WeakPolarHBondContact O-CE2 3.49Å
42	V	80.3	Confident	82.6	Confident	49 Å²	49	60.2 Å²	60.2	30%	0.297	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-44.3	171.8	174.4	0	0	0	0	109.9	H38 W39 Y40 C44 F45	H38-V42 WeakPolarHBondContact O-CG2 3.19Å; H38-V42 PolarHBondContact O-N 3.41Å; W39-V42 PolarHBondContact O-N 3.44Å; Y40-V42 PolarHBondContact O-N 3.4Å; V42-C44 VanDerWaalsContact C-N 3.32Å; V42-C44 PolarHBondContact O-N 2.81Å; V42-F45 WeakPolarHBondContact O-CB 3.45Å; V42-F45 WeakPolarHBondContact O-CD2 3.31Å; V42-F45 PolarHBondContact O-N 3.32Å; V42-F45 VanDerWaalsContact O-N 3.12Å
43	R	82.6	Confident	83.8	Confident	32 Å²	32	55.7 Å²	55.7	12%	0.121	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-35.3	178.3	-76.5	-174.7	176.7	-165.5	5.4	113.5	W39 Y40 R41 F45 H46 V410 F412 D466 L469	W39-R43 WeakPolarHBondContact O-CG 3.42Å; W39-R43 PolarHBondContact O-N 3.15Å; Y40-R43 WeakPolarHBondContact O-CB 3.34Å; Y40-R43 PolarHBondContact O-N 3.38Å; Y40-R43 VanDerWaalsContact O-N 3.15Å; R41-R43 VanDerWaalsContact C-N 3.32Å; R43-F45 PolarHBondContact O-N 3.43Å; R43-H46 WeakPolarHBondContact O-CB 3.02Å; R43-H46 PolarHBondContact O-N 3.39Å; R43-H46 PolarHBondContact O-ND1 3.23Å; R43-V410 PolarHBondContact NH2-O 3.13Å; R43-F412 PolarHBondContact NH1-O 3.44Å; R43-F412 PolarHBondContact NH2-O 3.3Å; R43-D466 IonicContact NH1-OD2 3.3Å; R43-D466 PolarHBondContact NH1-OD2 2.93Å; R43-L469 HydrophobicContact CB-CD1 4.16Å; R43-L469 WeakPolarHBondContact O-CD1 3.44Å
44	C	85.6	Confident	84.6	Confident	23 Å²	23	54.2 Å²	54.2	16%	0.155	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-57.7	-19.2	174.7	-64.4	0	0	0	0	114.3	Y40 R41 V42 H46 Q47	Y40-C44 VanDerWaalsContact CE1-SG 3.51Å; Y40-C44 PolarHBondContact O-N 2.89Å; Y40-C44 PolarHBondContact O-SG 3.48Å; R41-C44 PolarHBondContact O-N 3.35Å; V42-C44 VanDerWaalsContact C-N 3.32Å; V42-C44 PolarHBondContact O-N 2.81Å; C44-H46 PolarHBondContact O-N 3.3Å; C44-Q47 WeakPolarHBondContact O-CB 3.22Å; C44-Q47 PolarHBondContact O-N 2.78Å; C44-Q47 VanDerWaalsContact O-N 3.15Å
45	F	88.1	Confident	85.2	Confident	28 Å²	28	44 Å²	44	12%	0.123	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-69.4	-22.1	176	-73.5	-86.3	0	0	0	113.3	R24 L25 R28 R41 V42 R43 Q47 N48 L49	R24-F45 HydrophobicContact CB-CE1 3.73Å; R24-F45 HydrophobicContact CB-CZ 4.12Å; L25-F45 HydrophobicContact CD2-CD1 4.09Å; L25-F45 HydrophobicContact CD2-CE1 3.49Å; L25-F45 VanDerWaalsContact CD2-CE1 3.49Å; L25-F45 HydrophobicContact CD2-CZ 3.94Å; L25-F45 HydrophobicContact CG-CD1 4.48Å; L25-F45 HydrophobicContact CG-CE1 3.75Å; L25-F45 HydrophobicContact CG-CZ 4.45Å; R28-F45 HydrophobicContact CB-CE2 4.42Å; R28-F45 HydrophobicContact CB-CZ 4.09Å; R41-F45 WeakPolarHBondContact O-CD2 3.21Å; R41-F45 WeakPolarHBondContact O-CE2 3.49Å; V42-F45 WeakPolarHBondContact O-CB 3.45Å; V42-F45 WeakPolarHBondContact O-CD2 3.31Å; V42-F45 PolarHBondContact O-N 3.32Å; V42-F45 VanDerWaalsContact O-N 3.12Å; R43-F45 PolarHBondContact O-N 3.43Å; F45-Q47 PolarHBondContact O-N 2.96Å; F45-N48 WeakPolarHBondContact O-CB 3.37Å; F45-N48 PolarHBondContact O-N 3.03Å; F45-L49 PolarHBondContact O-N 3.22Å
46	H	89.8	Confident	85.8	Confident	35 Å²	35	38 Å²	38	16%	0.162	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-65.1	-16.5	171.9	-57.7	87.3	0	0	0	112	R43 C44 N48 L49 P463 Y464 L469 F470 F529	R43-H46 WeakPolarHBondContact O-CB 3.02Å; R43-H46 PolarHBondContact O-N 3.39Å; R43-H46 PolarHBondContact O-ND1 3.23Å; C44-H46 PolarHBondContact O-N 3.3Å; H46-N48 PolarHBondContact O-N 3.35Å; H46-L49 CarbonylContact C-O 3.49Å; H46-L49 WeakPolarHBondContact CA-O 3.4Å; H46-L49 CarbonylContact O-C 3.45Å; H46-P463 HydrophobicContact CB-CB 4.18Å; H46-P463 HydrophobicContact CB-CG 4.32Å; H46-P463 WeakPolarHBondContact CD2-CG 3.13Å; H46-P463 WeakPolarHBondContact NE2-CG 3.33Å; H46-Y464 HydrophobicContact CB-CE1 4.07Å; H46-Y464 AromaticContact CD2-CZ 3.94Å; H46-L469 HydrophobicContact CB-CD1 4.42Å; H46-F470 WeakPolarHBondContact O-CZ 3.36Å; H46-F529 PolarHBondContact CD2-O 3.17Å; H46-F529 PolarHBondContact NE2-O 3.25Å
47	Q	91.4	Very high	86.7	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.009	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-75.2	-8.6	169.9	-60.5	174.3	-39.7	0	0	113.4	C44 F45 F50 L469 F470 D497 K502	C44-Q47 WeakPolarHBondContact O-CB 3.22Å; C44-Q47 PolarHBondContact O-N 2.78Å; C44-Q47 VanDerWaalsContact O-N 3.15Å; F45-Q47 PolarHBondContact O-N 2.96Å; Q47-F50 WeakPolarHBondContact O-CE1 3.37Å; Q47-L469 HydrophobicContact CG-CB 4.37Å; Q47-L469 HydrophobicContact CG-CD2 4.42Å; Q47-L469 PolarHBondContact NE2-O 3.13Å; Q47-F470 HydrophobicContact CG-CE1 4.23Å; Q47-F470 HydrophobicContact CG-CZ 4.08Å; Q47-D497 PolarHBondContact NE2-OD1 3.43Å; Q47-K502 VanDerWaalsContact O-CD 3.31Å; Q47-K502 WeakPolarHBondContact O-CD 3.21Å; Q47-K502 WeakPolarHBondContact O-CE 3.31Å; Q47-K502 PolarHBondContact O-NZ 3Å
48	N	90.6	Very high	87.5	Confident	16 Å²	16	36.7 Å²	36.7	9%	0.086	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-31.3	173.7	-54.1	-45.4	0	0	0	111.9	Q19 V21 R24 F45 H46 R550	Q19-N48 PolarHBondContact O-OD1 3Å; V21-N48 HydrophobicContact CB-CB 4.23Å; V21-N48 HydrophobicContact CG2-CB 4.13Å; R24-N48 WeakPolarHBondContact CD-ND2 3.48Å; F45-N48 WeakPolarHBondContact O-CB 3.37Å; F45-N48 PolarHBondContact O-N 3.03Å; H46-N48 PolarHBondContact O-N 3.35Å; N48-R550 PolarHBondContact O-NH1 3.38Å; N48-R550 VanDerWaalsContact O-NH1 3.14Å; N48-R550 PolarHBondContact O-NH2 3.45Å
49	L	91.2	Very high	88.2	Confident	78 Å²	78	36.6 Å²	36.6	41%	0.408	17%	0.172	S	C	.	.	S	Bend	trans	-107.9	102.3	177.2	-61.5	177.6	0	0	0	108.6	F45 H46 Y464	F45-L49 PolarHBondContact O-N 3.22Å; H46-L49 CarbonylContact C-O 3.49Å; H46-L49 WeakPolarHBondContact CA-O 3.4Å; H46-L49 CarbonylContact O-C 3.45Å; L49-Y464 VanDerWaalsContact O-CE1 3.24Å; L49-Y464 WeakPolarHBondContact O-CE1 3.41Å; L49-Y464 PolarHBondContact O-OH 2.95Å
50	F	92.4	Very high	89	Confident	32 Å²	32	35.8 Å²	35.8	14%	0.14	17%	0.171	C	C	.	.			trans	-142.9	158.3	-175.8	47.6	-101.4	0	0	0	111.1	Q47 N52 Y464 K502 F503	Q47-F50 WeakPolarHBondContact O-CE1 3.37Å; F50-N52 HydrophobicContact CD2-CB 4Å; F50-N52 HydrophobicContact CE2-CB 3.91Å; F50-N52 PolarHBondContact O-N 3.15Å; F50-Y464 HydrophobicContact CB-CE1 4.07Å; F50-K502 HydrophobicContact CD1-CB 4.2Å; F50-K502 HydrophobicContact CD1-CD 4.48Å; F50-K502 HydrophobicContact CE1-CB 4.17Å; F50-K502 HydrophobicContact CE1-CD 3.92Å; F50-K502 WeakPolarHBondContact CE2-O 3.44Å; F50-K502 HydrophobicContact CZ-CB 4.45Å; F50-K502 HydrophobicContact CZ-CD 4.49Å; F50-K502 WeakPolarHBondContact CZ-O 3.26Å; F50-F503 HydrophobicContact CB-CB 4.5Å; F50-F503 HydrophobicContact CB-CD1 3.55Å; F50-F503 HydrophobicContact CB-CE1 3.96Å; F50-F503 HydrophobicContact CB-CG 4.12Å; F50-F503 HydrophobicContact CD2-CB 3.64Å; F50-F503 HydrophobicContact CD2-CD1 4.13Å; F50-F503 HydrophobicContact CD2-CG 4.19Å; F50-F503 HydrophobicContact CE2-CB 4.21Å; F50-F503 HydrophobicContact CG-CB 4.3Å; F50-F503 AromaticContact CG-CD1 3.91Å; F50-F503 HydrophobicContact CG-CD1 3.91Å; F50-F503 HydrophobicContact CG-CG 4.39Å
51	P	93.6	Very high	89.7	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.013	16%	0.162	C	C	.	.			trans	-71.8	111.8	174.8	28.2	-32.1	0	0	0	109.5	F503 H548 M549	P51-F503 HydrophobicContact CG-CD2 3.91Å; P51-F503 HydrophobicContact CG-CE2 3.83Å; P51-F503 HydrophobicContact CG-CZ 4.45Å; P51-F503 WeakPolarHBondContact O-CB 3.42Å; P51-F503 VanDerWaalsContact O-CD2 3.31Å; P51-F503 WeakPolarHBondContact O-CD2 3.5Å; P51-F503 WeakPolarHBondContact O-CG 3.43Å; P51-H548 HydrophobicContact CB-CB 4.19Å; P51-M549 CarbonylContact C-O 3.59Å; P51-M549 WeakPolarHBondContact CA-O 3.28Å
52	N	92.1	Very high	90.4	Very high	56 Å²	56	34.3 Å²	34.3	30%	0.299	18%	0.182	S	C	.	.			trans	-112.4	1.3	-176.6	65.5	-27.6	0	0	0	113.4	F50 M549 R550 H551	F50-N52 HydrophobicContact CD2-CB 4Å; F50-N52 HydrophobicContact CE2-CB 3.91Å; F50-N52 PolarHBondContact O-N 3.15Å; N52-M549 PolarHBondContact N-O 3.47Å; N52-R550 VanDerWaalsContact OD1-CA 3.3Å; N52-R550 WeakPolarHBondContact OD1-CA 3.24Å; N52-H551 PolarHBondContact ND2-O 2.96Å; N52-H551 PolarHBondContact OD1-N 3.16Å; N52-H551 PolarHBondContact OD1-O 3.4Å
53	F	92.8	Very high	91.1	Very high	4 Å²	4	32 Å²	32	2%	0.018	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	135.5	-178.4	-168.3	-103.8	0	0	0	110.9	V55 L100 Q103 G105 E106 L108 H548 M549 H551	F53-V55 HydrophobicContact CD1-CG2 4.03Å; F53-V55 HydrophobicContact CE1-CG2 3.62Å; F53-L100 HydrophobicContact CD1-CD1 4.2Å; F53-L100 HydrophobicContact CE1-CD1 4.27Å; F53-L100 HydrophobicContact CE1-CD2 3.83Å; F53-Q103 HydrophobicContact CZ-CB 4.18Å; F53-G105 WeakPolarHBondContact CD2-O 3.23Å; F53-E106 WeakPolarHBondContact CA-O 3.45Å; F53-L108 HydrophobicContact CE1-CB 4.13Å; F53-L108 HydrophobicContact CZ-CB 3.86Å; F53-H548 WeakPolarHBondContact O-CA 3.44Å; F53-M549 PolarHBondContact N-O 3.21Å; F53-M549 PolarHBondContact O-N 3.14Å; F53-H551 HydrophobicContact CB-CB 3.53Å; F53-H551 HydrophobicContact CD1-CB 4.26Å; F53-H551 HydrophobicContact CD2-CB 4.37Å; F53-H551 HydrophobicContact CG-CB 3.83Å
54	T	92.7	Very high	91.6	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.6	177.7	-62.1	0	0	0	0	110.8	V56 E106 T107 L108 Q506 N546 F547 H548	T54-V56 HydrophobicContact CG2-CG2 4.02Å; T54-E106 PolarHBondContact N-O 3.14Å; T54-T107 CarbonylContact O-C 3.56Å; T54-T107 VanDerWaalsContact O-CA 3.31Å; T54-T107 WeakPolarHBondContact O-CA 3.47Å; T54-L108 PolarHBondContact O-N 3.31Å; T54-Q506 HydrophobicContact CG2-CB 4.23Å; T54-N546 HydrophobicContact CG2-CB 4.38Å; T54-F547 WeakPolarHBondContact CA-O 3.39Å; T54-H548 VanDerWaalsContact CG2-CE1 3.49Å; T54-H548 WeakPolarHBondContact CG2-CE1 3.36Å; T54-H548 VanDerWaalsContact CG2-ND1 3.35Å; T54-H548 WeakPolarHBondContact CG2-ND1 3.4Å; T54-H548 PolarHBondContact OG1-ND1 2.96Å
55	V	92.1	Very high	92.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119.8	165.6	-177.2	0	0	0	0	108.3	F53 V58 L100 L108 R120 L123 N546 F547 M549	F53-V55 HydrophobicContact CD1-CG2 4.03Å; F53-V55 HydrophobicContact CE1-CG2 3.62Å; V55-V58 HydrophobicContact CB-CG2 4.1Å; V55-V58 HydrophobicContact CG1-CG2 3.85Å; V55-L100 HydrophobicContact CG2-CD2 4.45Å; V55-L108 HydrophobicContact CG1-CB 4.44Å; V55-L108 HydrophobicContact CG1-CD2 3.92Å; V55-L108 HydrophobicContact CG2-CB 4.21Å; V55-R120 HydrophobicContact CG1-CG 3.89Å; V55-L123 HydrophobicContact CB-CD2 3.7Å; V55-L123 HydrophobicContact CG1-CD2 3.83Å; V55-L123 HydrophobicContact CG2-CD2 3.87Å; V55-N546 VanDerWaalsContact O-CA 3.32Å; V55-N546 WeakPolarHBondContact O-CA 3.21Å; V55-F547 PolarHBondContact N-O 2.89Å; V55-F547 PolarHBondContact O-N 3.26Å; V55-M549 HydrophobicContact CG2-CE 4.37Å
56	V	90.3	Very high	92.4	Very high	8 Å²	8	32.4 Å²	32.4	5%	0.048	17%	0.168	C	C	.	.			trans	-90.2	142.5	-178	179.7	0	0	0	0	110.4	T54 T107 L108 R120 L509 N546	T54-V56 HydrophobicContact CG2-CG2 4.02Å; V56-T107 HydrophobicContact CG2-CG2 3.93Å; V56-L108 PolarHBondContact N-O 3.12Å; V56-R120 WeakPolarHBondContact O-CD 3.3Å; V56-L509 HydrophobicContact CG1-CD2 4.05Å; V56-L509 HydrophobicContact CG1-CG 4.37Å; V56-N546 VanDerWaalsContact CA-OD1 3.31Å; V56-N546 WeakPolarHBondContact CA-OD1 3.48Å; V56-N546 WeakPolarHBondContact CG1-OD1 3.46Å
57	N	89.9	Confident	92.6	Very high	58 Å²	58	31.8 Å²	31.8	31%	0.31	16%	0.164	S	C	.	.	S	Bend	trans	55.6	56	175.1	-166.8	32.2	0	0	0	112.9	T110 R120 V544 V545 N546	N57-T110 HydrophobicContact CB-CG2 4.16Å; N57-R120 PolarHBondContact ND2-NH1 2.95Å; N57-V544 HydrophobicContact CB-CG1 4.13Å; N57-V545 CarbonylContact C-O 3.45Å; N57-V545 VanDerWaalsContact CA-O 3.28Å; N57-V545 WeakPolarHBondContact CA-O 3.48Å; N57-V545 PolarHBondContact N-O 2.78Å; N57-V545 VanDerWaalsContact N-O 3.16Å; N57-N546 PolarHBondContact N-OD1 3.43Å
58	V	92.4	Very high	92.7	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.024	17%	0.165	C	C	.	.			trans	-67.6	131.6	174	179.7	0	0	0	0	109.2	V55 L123 F124 V545 F547	V55-V58 HydrophobicContact CB-CG2 4.1Å; V55-V58 HydrophobicContact CG1-CG2 3.85Å; V58-L123 HydrophobicContact CB-CD2 4.47Å; V58-L123 HydrophobicContact CG1-CB 3.93Å; V58-L123 HydrophobicContact CG1-CD2 4.04Å; V58-L123 HydrophobicContact CG2-CD2 3.55Å; V58-F124 HydrophobicContact CG1-CB 4.36Å; V58-V545 PolarHBondContact N-O 3.1Å; V58-F547 HydrophobicContact CG1-CD2 4.21Å; V58-F547 HydrophobicContact CG1-CE1 4.46Å; V58-F547 HydrophobicContact CG1-CE2 4Å; V58-F547 HydrophobicContact CG1-CZ 4.12Å; V58-F547 HydrophobicContact CG2-CB 4.16Å; V58-F547 HydrophobicContact CG2-CD1 4.26Å; V58-F547 HydrophobicContact CG2-CD2 4.25Å; V58-F547 HydrophobicContact CG2-CG 3.95Å
59	E	92.4	Very high	92.9	Very high	96 Å²	96	31.1 Å²	31.1	45%	0.449	16%	0.161	S	C	.	.			trans	-73.9	138.8	175.1	-62.3	178	-174.3	0	0	109.5	R120 S121 F124	E59-R120 PolarHBondContact N-O 2.84Å; E59-R120 IonicContact OE1-NH2 3.86Å; E59-S121 WeakPolarHBondContact OE2-CA 3.34Å; E59-S121 WeakPolarHBondContact OE2-CB 3.4Å; E59-F124 VanDerWaalsContact O-CB 3.24Å; E59-F124 WeakPolarHBondContact O-CB 3.31Å
60	K	92.7	Very high	92.8	Very high	59 Å²	59	28 Å²	28	26%	0.257	15%	0.145	S	C	.	.			trans	-138.5	161.1	-178.7	62.8	147.3	-171.4	77.5	0	110.8	C63 L65 F124 Y543 V545	K60-C63 WeakPolarHBondContact CE-O 3.01Å; K60-C63 PolarHBondContact NZ-O 3.36Å; K60-L65 HydrophobicContact CD-CD1 4.17Å; K60-L65 HydrophobicContact CD-CD2 4.11Å; K60-L65 HydrophobicContact CD-CG 4.02Å; K60-F124 HydrophobicContact CB-CD2 3.61Å; K60-F124 HydrophobicContact CB-CE2 3.91Å; K60-F124 HydrophobicContact CB-CG 4.18Å; K60-Y543 HydrophobicContact CD-CD1 4.38Å; K60-Y543 HydrophobicContact CD-CE1 4.02Å; K60-V545 HydrophobicContact CD-CG2 3.96Å; K60-V545 HydrophobicContact CG-CG2 4.29Å
61	P	93.2	Very high	92.7	Very high	41 Å²	41	28.5 Å²	28.5	27%	0.266	15%	0.149	S	C	.	.			trans	-55.2	163.1	168.4	-24.7	35.7	0	0	0	112.6	C63 F124	P61-C63 PolarHBondContact O-N 3.03Å; P61-F124 VanDerWaalsContact CD-CD1 3.42Å; P61-F124 HydrophobicContact CG-CD1 3.98Å; P61-F124 HydrophobicContact CG-CE1 3.69Å; P61-F124 HydrophobicContact CG-CZ 4.31Å
62	P	92.3	Very high	92.6	Very high	94 Å²	94	28.5 Å²	28.5	61%	0.61	15%	0.15	S	C	*	.	S	Bend	trans	-72.4	69.1	175.6	32.8	-35.9	0	0	0	111	S80	P62-S80 WeakPolarHBondContact O-CA 3.39Å; P62-S80 WeakPolarHBondContact O-CB 3.37Å; P62-S80 PolarHBondContact O-N 3.15Å; P62-S80 PolarHBondContact O-OG 3.44Å
63	C	94.3	Very high	92.7	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.6	178.6	65.1	0	0	0	0	112	K60 P61 A77 F78 E86	K60-C63 WeakPolarHBondContact CE-O 3.01Å; K60-C63 PolarHBondContact NZ-O 3.36Å; P61-C63 PolarHBondContact O-N 3.03Å; C63-A77 HydrophobicContact CB-CB 4.03Å; C63-F78 CarbonylContact C-O 3.54Å; C63-F78 WeakPolarHBondContact CA-O 3.48Å; C63-F78 VanDerWaalsContact CB-O 3.27Å; C63-F78 WeakPolarHBondContact CB-O 3.29Å; C63-E86 WeakPolarHBondContact CB-OE2 3.33Å; C63-E86 PolarHBondContact SG-OE2 3.15Å
64	F	94.7	Very high	92.9	Very high	38 Å²	38	34.5 Å²	34.5	17%	0.167	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	108.3	173.4	-59.2	-69.9	0	0	0	109.1	R66 A77 F78 Q82 R145 Y543	F64-R66 PolarHBondContact O-N 3.03Å; F64-A77 CarbonylContact O-C 3.48Å; F64-A77 VanDerWaalsContact O-CA 3.25Å; F64-A77 WeakPolarHBondContact O-CA 3.26Å; F64-A77 WeakPolarHBondContact O-CB 3.38Å; F64-F78 HydrophobicContact CB-CB 4.4Å; F64-F78 PolarHBondContact N-O 3.23Å; F64-F78 PolarHBondContact O-N 3.47Å; F64-Q82 HydrophobicContact CE2-CG 4.46Å; F64-R145 HydrophobicContact CB-CG 4.41Å; F64-R145 HydrophobicContact CD2-CG 4.27Å; F64-R145 VanDerWaalsContact CD2-CZ 3.45Å; F64-R145 HydrophobicContact CG-CG 4.44Å; F64-Y543 HydrophobicContact CD1-CD2 4.29Å; F64-Y543 AromaticContact CD1-CE2 3.8Å; F64-Y543 HydrophobicContact CD1-CE2 3.8Å; F64-Y543 HydrophobicContact CE1-CD2 4.42Å; F64-Y543 HydrophobicContact CE1-CE2 4.38Å
65	L	95.6	Very high	93.1	Very high	18 Å²	18	34.3 Å²	34.3	9%	0.094	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	130.7	179.4	-54.4	-173.6	0	0	0	109.9	K60 F75 A77 F124 I534 V536 Y543 V545	K60-L65 HydrophobicContact CD-CD1 4.17Å; K60-L65 HydrophobicContact CD-CD2 4.11Å; K60-L65 HydrophobicContact CD-CG 4.02Å; L65-F75 HydrophobicContact CB-CE1 3.98Å; L65-F75 HydrophobicContact CB-CZ 3.85Å; L65-F75 HydrophobicContact CD2-CE1 3.85Å; L65-F75 HydrophobicContact CG-CE1 4.39Å; L65-A77 HydrophobicContact CD2-CB 4.21Å; L65-F124 HydrophobicContact CD1-CE2 4.44Å; L65-F124 HydrophobicContact CD2-CE2 3.74Å; L65-F124 HydrophobicContact CD2-CZ 4.12Å; L65-I534 HydrophobicContact CD1-CG2 4.17Å; L65-V536 HydrophobicContact CB-CG2 4.47Å; L65-V536 HydrophobicContact CD1-CG2 4.43Å; L65-Y543 PolarHBondContact N-OH 2.63Å; L65-Y543 VanDerWaalsContact N-OH 3.09Å; L65-V545 HydrophobicContact CD1-CG1 3.72Å; L65-V545 HydrophobicContact CD1-CG2 3.95Å
66	R	94.3	Very high	93.4	Very high	35 Å²	35	34.3 Å²	34.3	13%	0.132	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-78.4	-175.4	177.3	55.3	173.7	127.8	-1.5	113.5	F64 I76 F78 R145 E146 S148 T525	F64-R66 PolarHBondContact O-N 3.03Å; R66-I76 HydrophobicContact CB-CD1 4.29Å; R66-I76 HydrophobicContact CB-CG1 4.1Å; R66-I76 WeakPolarHBondContact CB-O 3.3Å; R66-I76 HydrophobicContact CG-CD1 3.91Å; R66-I76 HydrophobicContact CG-CG1 4.19Å; R66-I76 PolarHBondContact N-O 3.24Å; R66-F78 HydrophobicContact CB-CD2 4.08Å; R66-F78 HydrophobicContact CB-CE2 3.77Å; R66-F78 HydrophobicContact CG-CE2 3.76Å; R66-R145 WeakPolarHBondContact CD-O 3.39Å; R66-R145 PolarHBondContact NE-O 2.93Å; R66-E146 PolarHBondContact NH2-O 3.05Å; R66-S148 PolarHBondContact NE-OG 2.99Å; R66-S148 PolarHBondContact NH2-OG 3.38Å; R66-T525 PolarHBondContact O-OG1 3.24Å
67	K	93.1	Very high	93.7	Very high	22 Å²	22	34 Å²	34	10%	0.096	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	153.7	-167.2	-162.7	175	170.6	158	0	111.6	I76 F150 Q457 E481	K67-I76 VanDerWaalsContact O-CG1 3.26Å; K67-I76 WeakPolarHBondContact O-CG1 3.37Å; K67-I76 PolarHBondContact O-N 3.38Å; K67-F150 HydrophobicContact CB-CE2 4.41Å; K67-F150 HydrophobicContact CD-CE2 4.19Å; K67-F150 HydrophobicContact CG-CE2 4.39Å; K67-Q457 PolarHBondContact NZ-O 3.19Å; K67-E481 WeakPolarHBondContact CD-OE2 3.49Å; K67-E481 WeakPolarHBondContact CE-OE1 3.49Å; K67-E481 VanDerWaalsContact CE-OE2 3.26Å; K67-E481 WeakPolarHBondContact CE-OE2 3.49Å; K67-E481 IonicContact NZ-OE1 3.6Å; K67-E481 PolarHBondContact NZ-OE1 3.43Å; K67-E481 IonicContact NZ-OE2 3.48Å; K67-E481 PolarHBondContact NZ-OE2 2.77Å
68	F	95.1	Very high	94	Very high	5 Å²	5	31.2 Å²	31.2	2%	0.022	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	149.3	166.1	-72.3	-81.2	0	0	0	111.1	Y74 F75 Y90 F128 F150 T525 H527 P528 F532 I534	F68-Y74 CarbonylContact C-O 3.55Å; F68-Y74 WeakPolarHBondContact CA-O 3.27Å; F68-F75 HydrophobicContact CD1-CB 4.09Å; F68-F75 AromaticContact CD1-CD2 3.68Å; F68-F75 HydrophobicContact CD1-CD2 3.68Å; F68-F75 HydrophobicContact CD1-CG 4.38Å; F68-F75 AromaticContact CD2-CD2 3.89Å; F68-F75 HydrophobicContact CD2-CD2 3.89Å; F68-F75 HydrophobicContact CD2-CE2 4.13Å; F68-F75 HydrophobicContact CE1-CB 4.06Å; F68-F75 AromaticContact CE1-CD2 3.62Å; F68-F75 HydrophobicContact CE1-CD2 3.62Å; F68-F75 HydrophobicContact CE1-CG 4.23Å; F68-F75 AromaticContact CE2-CD2 3.82Å; F68-F75 HydrophobicContact CE2-CD2 3.82Å; F68-F75 AromaticContact CE2-CE2 3.97Å; F68-F75 HydrophobicContact CE2-CE2 3.97Å; F68-F75 AromaticContact CG-CD2 3.8Å; F68-F75 HydrophobicContact CG-CD2 3.8Å; F68-F75 HydrophobicContact CG-CE2 4.46Å; F68-F75 AromaticContact CZ-CD2 3.68Å; F68-F75 HydrophobicContact CZ-CD2 3.68Å; F68-F75 HydrophobicContact CZ-CE2 4.18Å; F68-Y90 AromaticContact CE1-CD2 3.99Å; F68-Y90 HydrophobicContact CE1-CD2 3.99Å; F68-Y90 HydrophobicContact CE1-CE2 4.49Å; F68-Y90 HydrophobicContact CE1-CG 4.06Å; F68-Y90 HydrophobicContact CZ-CD2 4.48Å; F68-F128 AromaticContact CE1-CE1 3.86Å; F68-F128 HydrophobicContact CE1-CE1 3.86Å; F68-F128 HydrophobicContact CE1-CZ 4.27Å; F68-F128 HydrophobicContact CZ-CE1 4.06Å; F68-F128 AromaticContact CZ-CZ 3.98Å; F68-F128 HydrophobicContact CZ-CZ 3.98Å; F68-F150 WeakPolarHBondContact O-CE2 3.29Å; F68-T525 HydrophobicContact CD2-CG2 3.77Å; F68-T525 HydrophobicContact CE2-CG2 4.09Å; F68-H527 AromaticContact CD1-CD2 3.77Å; F68-H527 HydrophobicContact CD2-CB 4.36Å; F68-H527 AromaticContact CE1-CD2 3.65Å; F68-H527 HydrophobicContact CE2-CB 4.11Å; F68-H527 HydrophobicContact CZ-CB 4.31Å; F68-P528 HydrophobicContact CB-CG 4.27Å; F68-F532 HydrophobicContact CE2-CD1 4.31Å; F68-F532 AromaticContact CZ-CD1 3.83Å; F68-F532 HydrophobicContact CZ-CD1 3.83Å; F68-F532 AromaticContact CZ-CE1 3.92Å; F68-F532 HydrophobicContact CZ-CE1 3.92Å; F68-I534 HydrophobicContact CE2-CD1 4.43Å; F68-I534 HydrophobicContact CZ-CD1 4.45Å
69	S	93.8	Very high	94.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.152	C	C	.	.			trans	-60	156.3	161.6	58.2	0	0	0	0	110	D71 G72 R73 Y74	S69-D71 VanDerWaalsContact CB-OD1 3.23Å; S69-D71 WeakPolarHBondContact CB-OD1 3.47Å; S69-D71 PolarHBondContact O-N 2.91Å; S69-D71 PolarHBondContact OG-OD1 2.92Å; S69-G72 WeakPolarHBondContact O-CA 3.28Å; S69-G72 PolarHBondContact O-N 2.84Å; S69-R73 PolarHBondContact OG-N 3.27Å; S69-Y74 PolarHBondContact N-O 3.18Å; S69-Y74 PolarHBondContact OG-N 2.79Å; S69-Y74 PolarHBondContact OG-O 3.28Å
70	P	89.7	Confident	94.2	Very high	13 Å²	13	30 Å²	30	8%	0.084	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.7	-174.8	-17.7	28.7	0	0	0	113.8	G72 F150 C154 L405	P70-G72 VanDerWaalsContact C-N 3.33Å; P70-F150 HydrophobicContact CG-CB 3.61Å; P70-F150 HydrophobicContact CG-CD2 4.33Å; P70-F150 HydrophobicContact CG-CG 4.01Å; P70-C154 VanDerWaalsContact CB-SG 3.57Å; P70-L405 HydrophobicContact CB-CD1 3.56Å; P70-L405 HydrophobicContact CG-CD1 3.14Å
71	D	89.2	Confident	94.2	Very high	42 Å²	42	31 Å²	31	23%	0.225	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-6.6	173.1	70	-18.3	0	0	0	113.6	S69 R73 C154 F529	S69-D71 VanDerWaalsContact CB-OD1 3.23Å; S69-D71 WeakPolarHBondContact CB-OD1 3.47Å; S69-D71 PolarHBondContact O-N 2.91Å; S69-D71 PolarHBondContact OG-OD1 2.92Å; D71-R73 PolarHBondContact O-N 3.41Å; D71-R73 PolarHBondContact OD1-N 2.95Å; D71-R73 VanDerWaalsContact OD2-CD 3.24Å; D71-R73 WeakPolarHBondContact OD2-CD 3.32Å; D71-R73 WeakPolarHBondContact OD2-CG 3.27Å; D71-R73 IonicContact OD2-NE 2.97Å; D71-C154 HydrophobicContact CB-CB 4.28Å; D71-F529 WeakPolarHBondContact O-CE2 3.21Å
72	G	92.2	Very high	94.2	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.021	16%	0.158	C	C	.	.	S	Bend	trans	76.5	-2.7	178.1	0	0	0	0	0	115.4	S69 P70 H527	S69-G72 WeakPolarHBondContact O-CA 3.28Å; S69-G72 PolarHBondContact O-N 2.84Å; P70-G72 VanDerWaalsContact C-N 3.33Å; G72-H527 WeakPolarHBondContact CA-NE2 3.36Å; G72-H527 PolarHBondContact O-NE2 2.78Å
73	R	93.9	Very high	94.4	Very high	161 Å²	161	28 Å²	28	61%	0.608	14%	0.137	S	C	*	.	S	Bend	trans	-74.3	-38.3	-176	-66.1	-174.3	-179.1	178.5	-1.4	113	S69 D71 Y90	S69-R73 PolarHBondContact OG-N 3.27Å; D71-R73 PolarHBondContact O-N 3.41Å; D71-R73 PolarHBondContact OD1-N 2.95Å; D71-R73 VanDerWaalsContact OD2-CD 3.24Å; D71-R73 WeakPolarHBondContact OD2-CD 3.32Å; D71-R73 WeakPolarHBondContact OD2-CG 3.27Å; D71-R73 IonicContact OD2-NE 2.97Å; R73-Y90 PolarHBondContact O-N 3.16Å
74	Y	96.5	Very high	94.5	Very high	24 Å²	24	28.5 Å²	28.5	9%	0.094	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	149	-177.6	-57.6	-67	0	0	0	111.1	F68 S69 I87 Y88 L131 L201 H202	F68-Y74 CarbonylContact C-O 3.55Å; F68-Y74 WeakPolarHBondContact CA-O 3.27Å; S69-Y74 PolarHBondContact N-O 3.18Å; S69-Y74 PolarHBondContact OG-N 2.79Å; S69-Y74 PolarHBondContact OG-O 3.28Å; Y74-I87 HydrophobicContact CD1-CG2 4.13Å; Y74-I87 HydrophobicContact CG-CG2 4.49Å; Y74-Y88 CarbonylContact C-O 3.51Å; Y74-Y88 VanDerWaalsContact CA-O 3.25Å; Y74-Y88 WeakPolarHBondContact CA-O 3.25Å; Y74-L131 HydrophobicContact CD1-CD1 3.94Å; Y74-L131 HydrophobicContact CE1-CD1 3.49Å; Y74-L131 VanDerWaalsContact CE1-CD1 3.49Å; Y74-L201 HydrophobicContact CD2-CB 4.13Å; Y74-L201 HydrophobicContact CD2-CD1 4.42Å; Y74-L201 HydrophobicContact CE2-CB 4.38Å; Y74-H202 AromaticContact CE2-CD2 3.99Å; Y74-H202 AromaticContact CE2-NE2 3.96Å; Y74-H202 AromaticContact CZ-CD2 3.89Å; Y74-H202 PolarHBondContact OH-CD2 3.34Å
75	F	97.3	Very high	94.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125.7	171.2	-174.8	-94.5	0	0	0	109	L65 F68 Y88 F128 T525 I534	L65-F75 HydrophobicContact CB-CE1 3.98Å; L65-F75 HydrophobicContact CB-CZ 3.85Å; L65-F75 HydrophobicContact CD2-CE1 3.85Å; L65-F75 HydrophobicContact CG-CE1 4.39Å; F68-F75 HydrophobicContact CD1-CB 4.09Å; F68-F75 AromaticContact CD1-CD2 3.68Å; F68-F75 HydrophobicContact CD1-CD2 3.68Å; F68-F75 HydrophobicContact CD1-CG 4.38Å; F68-F75 AromaticContact CD2-CD2 3.89Å; F68-F75 HydrophobicContact CD2-CD2 3.89Å; F68-F75 HydrophobicContact CD2-CE2 4.13Å; F68-F75 HydrophobicContact CE1-CB 4.06Å; F68-F75 AromaticContact CE1-CD2 3.62Å; F68-F75 HydrophobicContact CE1-CD2 3.62Å; F68-F75 HydrophobicContact CE1-CG 4.23Å; F68-F75 AromaticContact CE2-CD2 3.82Å; F68-F75 HydrophobicContact CE2-CD2 3.82Å; F68-F75 AromaticContact CE2-CE2 3.97Å; F68-F75 HydrophobicContact CE2-CE2 3.97Å; F68-F75 AromaticContact CG-CD2 3.8Å; F68-F75 HydrophobicContact CG-CD2 3.8Å; F68-F75 HydrophobicContact CG-CE2 4.46Å; F68-F75 AromaticContact CZ-CD2 3.68Å; F68-F75 HydrophobicContact CZ-CD2 3.68Å; F68-F75 HydrophobicContact CZ-CE2 4.18Å; F75-Y88 HydrophobicContact CD1-CD2 4.35Å; F75-Y88 PolarHBondContact N-O 2.82Å; F75-Y88 PolarHBondContact O-N 2.79Å; F75-F128 HydrophobicContact CB-CD1 3.78Å; F75-F128 HydrophobicContact CB-CE1 3.54Å; F75-F128 HydrophobicContact CD1-CD1 4.26Å; F75-F128 HydrophobicContact CD1-CE1 4.06Å; F75-F128 HydrophobicContact CD2-CE1 4.1Å; F75-F128 HydrophobicContact CD2-CZ 4.46Å; F75-F128 HydrophobicContact CG-CD1 4.1Å; F75-F128 AromaticContact CG-CE1 3.62Å; F75-F128 HydrophobicContact CG-CE1 3.62Å; F75-F128 HydrophobicContact CG-CZ 4.26Å; F75-T525 HydrophobicContact CE2-CG2 4.05Å; F75-I534 HydrophobicContact CD2-CD1 4.5Å; F75-I534 HydrophobicContact CE2-CD1 3.74Å; F75-I534 HydrophobicContact CZ-CD1 3.76Å
76	I	97.6	Very high	94.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	142	180	59.8	161.8	0	0	0	111.3	R66 K67 L85 E86 F150 V157 L201	R66-I76 HydrophobicContact CB-CD1 4.29Å; R66-I76 HydrophobicContact CB-CG1 4.1Å; R66-I76 WeakPolarHBondContact CB-O 3.3Å; R66-I76 HydrophobicContact CG-CD1 3.91Å; R66-I76 HydrophobicContact CG-CG1 4.19Å; R66-I76 PolarHBondContact N-O 3.24Å; K67-I76 VanDerWaalsContact O-CG1 3.26Å; K67-I76 WeakPolarHBondContact O-CG1 3.37Å; K67-I76 PolarHBondContact O-N 3.38Å; I76-L85 HydrophobicContact CB-CD1 4.21Å; I76-L85 HydrophobicContact CG2-CD2 4.43Å; I76-E86 WeakPolarHBondContact CA-O 3.16Å; I76-F150 HydrophobicContact CD1-CE1 4.44Å; I76-F150 HydrophobicContact CD1-CE2 4.43Å; I76-F150 HydrophobicContact CD1-CZ 3.74Å; I76-F150 HydrophobicContact CG1-CZ 3.98Å; I76-F150 HydrophobicContact CG2-CE1 4.46Å; I76-F150 HydrophobicContact CG2-CZ 4.45Å; I76-V157 HydrophobicContact CD1-CG2 4.25Å; I76-L201 HydrophobicContact CG2-CD2 3.96Å
77	A	97.3	Very high	94.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.9	169.1	0	0	0	0	0	110.1	C63 F64 L65 E86 Y88	C63-A77 HydrophobicContact CB-CB 4.03Å; F64-A77 CarbonylContact O-C 3.48Å; F64-A77 VanDerWaalsContact O-CA 3.25Å; F64-A77 WeakPolarHBondContact O-CA 3.26Å; F64-A77 WeakPolarHBondContact O-CB 3.38Å; L65-A77 HydrophobicContact CD2-CB 4.21Å; A77-E86 HydrophobicContact CB-CB 4.4Å; A77-E86 PolarHBondContact N-O 3.44Å; A77-E86 PolarHBondContact O-N 3.33Å; A77-Y88 HydrophobicContact CB-CE2 3.94Å
78	F	96.8	Very high	95.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	136.8	173.1	-62.4	-87.2	0	0	0	109.3	C63 F64 R66 L85 L143 R145 V159	C63-F78 CarbonylContact C-O 3.54Å; C63-F78 WeakPolarHBondContact CA-O 3.48Å; C63-F78 VanDerWaalsContact CB-O 3.27Å; C63-F78 WeakPolarHBondContact CB-O 3.29Å; F64-F78 HydrophobicContact CB-CB 4.4Å; F64-F78 PolarHBondContact N-O 3.23Å; F64-F78 PolarHBondContact O-N 3.47Å; R66-F78 HydrophobicContact CB-CD2 4.08Å; R66-F78 HydrophobicContact CB-CE2 3.77Å; R66-F78 HydrophobicContact CG-CE2 3.76Å; F78-L85 HydrophobicContact CD1-CD1 4.01Å; F78-L85 HydrophobicContact CE1-CD1 3.82Å; F78-L85 HydrophobicContact CZ-CD1 4.23Å; F78-L143 HydrophobicContact CD1-CB 3.74Å; F78-L143 HydrophobicContact CD1-CD1 3.87Å; F78-L143 HydrophobicContact CD1-CG 4.39Å; F78-L143 HydrophobicContact CE1-CB 3.99Å; F78-L143 HydrophobicContact CE1-CD1 4.26Å; F78-R145 HydrophobicContact CB-CG 4.46Å; F78-R145 HydrophobicContact CD2-CB 4.11Å; F78-R145 HydrophobicContact CD2-CG 4.47Å; F78-R145 HydrophobicContact CE2-CB 4.45Å; F78-R145 WeakPolarHBondContact CE2-O 3.47Å; F78-V159 HydrophobicContact CE1-CB 4.48Å; F78-V159 HydrophobicContact CE1-CG1 4.19Å; F78-V159 HydrophobicContact CZ-CG1 4.28Å
79	S	95.4	Very high	95.2	Very high	8 Å²	8	28 Å²	28	6%	0.056	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	157.4	175.2	60.9	0	0	0	0	111.9	D81 Q82 T83 S84	S79-D81 WeakPolarHBondContact CB-OD1 3.45Å; S79-D81 PolarHBondContact O-N 3.12Å; S79-D81 PolarHBondContact OG-OD1 3.26Å; S79-Q82 WeakPolarHBondContact O-CA 3.45Å; S79-Q82 PolarHBondContact O-N 3.38Å; S79-T83 PolarHBondContact OG-N 2.76Å; S79-S84 PolarHBondContact N-O 2.67Å; S79-S84 PolarHBondContact OG-N 3.2Å; S79-S84 PolarHBondContact OG-O 3.3Å
80	S	92.5	Very high	95.4	Very high	66 Å²	66	29 Å²	29	46%	0.462	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-31.4	-177.8	49.8	0	0	0	0	114	P62 Q82	P62-S80 WeakPolarHBondContact O-CA 3.39Å; P62-S80 WeakPolarHBondContact O-CB 3.37Å; P62-S80 PolarHBondContact O-N 3.15Å; P62-S80 PolarHBondContact O-OG 3.44Å; S80-Q82 VanDerWaalsContact C-N 3.31Å
81	D	92.8	Very high	95.7	Very high	81 Å²	81	32.6 Å²	32.6	43%	0.433	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-6.2	176	66.1	-18.5	0	0	0	113	S79 T83 H142	S79-D81 WeakPolarHBondContact CB-OD1 3.45Å; S79-D81 PolarHBondContact O-N 3.12Å; S79-D81 PolarHBondContact OG-OD1 3.26Å; D81-T83 HydrophobicContact CB-CG2 4.24Å; D81-T83 PolarHBondContact O-N 2.91Å; D81-T83 PolarHBondContact OD1-N 2.94Å; D81-T83 PolarHBondContact OD1-OG1 2.88Å; D81-T83 VanDerWaalsContact OD1-OG1 3.13Å; D81-T83 VanDerWaalsContact OD2-CG2 3.28Å; D81-T83 WeakPolarHBondContact OD2-CG2 3.42Å; D81-T83 PolarHBondContact OD2-OG1 2.75Å; D81-H142 PolarHBondContact O-ND1 3.27Å
82	Q	94.1	Very high	95.9	Very high	43 Å²	43	31.1 Å²	31.1	20%	0.201	16%	0.155	C	C	.	.	S	Bend	trans	60.6	26.6	-179.3	-57.9	167.7	100.9	0	0	114.2	F64 S79 S80 H142 L143 R145	F64-Q82 HydrophobicContact CE2-CG 4.46Å; S79-Q82 WeakPolarHBondContact O-CA 3.45Å; S79-Q82 PolarHBondContact O-N 3.38Å; S80-Q82 VanDerWaalsContact C-N 3.31Å; Q82-H142 HydrophobicContact CB-CB 4.25Å; Q82-L143 HydrophobicContact CB-CB 4.46Å; Q82-L143 VanDerWaalsContact O-CB 3.31Å; Q82-L143 WeakPolarHBondContact O-CB 3.16Å; Q82-L143 WeakPolarHBondContact O-CG 3.29Å; Q82-L143 PolarHBondContact O-N 2.59Å; Q82-L143 PolarHBondContact OE1-O 3.17Å; Q82-R145 HydrophobicContact CG-CG 4.3Å
83	T	95.4	Very high	95.7	Very high	28 Å²	28	31.9 Å²	31.9	17%	0.172	16%	0.159	C	C	.	.	S	Bend	trans	-94.6	-26.5	177.3	63.2	0	0	0	0	112.3	S79 D81 N135 V136 A137	S79-T83 PolarHBondContact OG-N 2.76Å; D81-T83 HydrophobicContact CB-CG2 4.24Å; D81-T83 PolarHBondContact O-N 2.91Å; D81-T83 PolarHBondContact OD1-N 2.94Å; D81-T83 PolarHBondContact OD1-OG1 2.88Å; D81-T83 VanDerWaalsContact OD1-OG1 3.13Å; D81-T83 VanDerWaalsContact OD2-CG2 3.28Å; D81-T83 WeakPolarHBondContact OD2-CG2 3.42Å; D81-T83 PolarHBondContact OD2-OG1 2.75Å; T83-N135 PolarHBondContact O-OD1 2.67Å; T83-V136 PolarHBondContact O-N 3.28Å; T83-A137 PolarHBondContact O-N 2.88Å
84	S	96.4	Very high	95.4	Very high	12 Å²	12	31.7 Å²	31.7	8%	0.084	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.5	-167.6	-56.3	0	0	0	0	112.2	S79 T134	S79-S84 PolarHBondContact N-O 2.67Å; S79-S84 PolarHBondContact OG-N 3.2Å; S79-S84 PolarHBondContact OG-O 3.3Å; S84-T134 CarbonylContact C-O 3.45Å; S84-T134 WeakPolarHBondContact CA-O 3.38Å; S84-T134 WeakPolarHBondContact CB-O 3.46Å
85	L	97.4	Very high	95.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	122.4	169.2	-170.2	74.5	0	0	0	109.3	I76 F78 I87 V133 T134 V157 V159 I199	I76-L85 HydrophobicContact CB-CD1 4.21Å; I76-L85 HydrophobicContact CG2-CD2 4.43Å; F78-L85 HydrophobicContact CD1-CD1 4.01Å; F78-L85 HydrophobicContact CE1-CD1 3.82Å; F78-L85 HydrophobicContact CZ-CD1 4.23Å; L85-I87 HydrophobicContact CD2-CG1 4.25Å; L85-I87 HydrophobicContact CG-CG1 4.43Å; L85-V133 WeakPolarHBondContact O-CA 3.48Å; L85-T134 PolarHBondContact N-O 2.88Å; L85-T134 PolarHBondContact O-N 3.35Å; L85-V157 HydrophobicContact CD2-CG1 3.69Å; L85-V159 HydrophobicContact CD1-CG1 4.31Å; L85-V159 HydrophobicContact CD2-CG1 4.41Å; L85-I199 HydrophobicContact CB-CD1 4.1Å; L85-I199 HydrophobicContact CD2-CD1 3.65Å; L85-I199 HydrophobicContact CD2-CG2 4.47Å
86	E	97.8	Very high	94.9	Very high	23 Å²	23	31.8 Å²	31.8	11%	0.107	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.3	174.3	-62.1	173.5	-168.2	0	0	109	C63 I76 A77 Y88 L130 V133	C63-E86 WeakPolarHBondContact CB-OE2 3.33Å; C63-E86 PolarHBondContact SG-OE2 3.15Å; I76-E86 WeakPolarHBondContact CA-O 3.16Å; A77-E86 HydrophobicContact CB-CB 4.4Å; A77-E86 PolarHBondContact N-O 3.44Å; A77-E86 PolarHBondContact O-N 3.33Å; E86-Y88 HydrophobicContact CB-CD2 4.44Å; E86-Y88 HydrophobicContact CB-CE2 3.73Å; E86-Y88 PolarHBondContact OE2-OH 3.21Å; E86-L130 HydrophobicContact CB-CD1 4.23Å; E86-V133 HydrophobicContact CG-CG1 4.49Å; E86-V133 HydrophobicContact CG-CG2 4.35Å
87	I	98.2	Very high	94.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.5	-178.5	-57.5	162.8	0	0	0	108	Y74 L85 L131 H132 I199 L201	Y74-I87 HydrophobicContact CD1-CG2 4.13Å; Y74-I87 HydrophobicContact CG-CG2 4.49Å; L85-I87 HydrophobicContact CD2-CG1 4.25Å; L85-I87 HydrophobicContact CG-CG1 4.43Å; I87-L131 PolarHBondContact O-N 2.81Å; I87-H132 HydrophobicContact CB-CB 4.26Å; I87-H132 HydrophobicContact CD1-CB 4.17Å; I87-H132 PolarHBondContact N-O 3.21Å; I87-H132 PolarHBondContact O-N 2.97Å; I87-I199 HydrophobicContact CD1-CG2 4.19Å; I87-L201 HydrophobicContact CD1-CD2 4.11Å; I87-L201 HydrophobicContact CG1-CD2 4.18Å; I87-L201 HydrophobicContact CG2-CD2 4.23Å
88	Y	98.1	Very high	94.1	Very high	6 Å²	6	37.7 Å²	37.7	2%	0.024	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.4	178.8	-61.6	-90.3	0	0	0	111.3	Y74 F75 A77 E86 F124 F128 S129 L130	Y74-Y88 CarbonylContact C-O 3.51Å; Y74-Y88 VanDerWaalsContact CA-O 3.25Å; Y74-Y88 WeakPolarHBondContact CA-O 3.25Å; F75-Y88 HydrophobicContact CD1-CD2 4.35Å; F75-Y88 PolarHBondContact N-O 2.82Å; F75-Y88 PolarHBondContact O-N 2.79Å; A77-Y88 HydrophobicContact CB-CE2 3.94Å; E86-Y88 HydrophobicContact CB-CD2 4.44Å; E86-Y88 HydrophobicContact CB-CE2 3.73Å; E86-Y88 PolarHBondContact OE2-OH 3.21Å; Y88-F124 HydrophobicContact CD1-CE1 4.23Å; Y88-F124 AromaticContact CE1-CE1 3.69Å; Y88-F124 HydrophobicContact CE1-CE1 3.69Å; Y88-F124 HydrophobicContact CE1-CZ 4.15Å; Y88-F124 HydrophobicContact CE2-CZ 4.32Å; Y88-F124 AromaticContact CZ-CE1 3.9Å; Y88-F124 AromaticContact CZ-CZ 3.97Å; Y88-F128 HydrophobicContact CD1-CB 3.83Å; Y88-F128 HydrophobicContact CG-CB 4.05Å; Y88-S129 CarbonylContact C-O 3.57Å; Y88-S129 WeakPolarHBondContact CA-O 3.43Å; Y88-L130 HydrophobicContact CD1-CB 3.92Å; Y88-L130 HydrophobicContact CD1-CD1 3.99Å; Y88-L130 HydrophobicContact CE1-CB 3.77Å; Y88-L130 HydrophobicContact CE1-CD1 3.66Å; Y88-L130 HydrophobicContact CE1-CG 4.27Å; Y88-L130 HydrophobicContact CE2-CD1 4.38Å; Y88-L130 HydrophobicContact CG-CD1 4.47Å
89	E	97.6	Very high	93.6	Very high	79 Å²	79	39.2 Å²	39.2	37%	0.369	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.1	165	-168.6	179.1	-143	0	0	110.2	Q91 F128 S129 L131	E89-Q91 PolarHBondContact O-NE2 2.85Å; E89-Q91 PolarHBondContact OE2-NE2 2.82Å; E89-F128 WeakPolarHBondContact O-CA 3.21Å; E89-S129 PolarHBondContact N-O 3.02Å; E89-S129 PolarHBondContact O-N 2.98Å; E89-L131 HydrophobicContact CB-CD1 3.7Å; E89-L131 HydrophobicContact CB-CD2 4.13Å; E89-L131 HydrophobicContact CB-CG 3.79Å; E89-L131 HydrophobicContact CG-CD1 4.43Å
90	Y	97.2	Very high	93.2	Very high	20 Å²	20	39 Å²	39	8%	0.078	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119	174.7	-176.8	-118	0	0	0	111	F68 R73 G92 C93 F127 F128 H527 E530 F532	F68-Y90 AromaticContact CE1-CD2 3.99Å; F68-Y90 HydrophobicContact CE1-CD2 3.99Å; F68-Y90 HydrophobicContact CE1-CE2 4.49Å; F68-Y90 HydrophobicContact CE1-CG 4.06Å; F68-Y90 HydrophobicContact CZ-CD2 4.48Å; R73-Y90 PolarHBondContact O-N 3.16Å; Y90-G92 VanDerWaalsContact C-N 3.27Å; Y90-G92 VanDerWaalsContact CE1-CA 3.42Å; Y90-G92 PolarHBondContact O-N 2.81Å; Y90-C93 WeakPolarHBondContact OH-CA 3.31Å; Y90-C93 PolarHBondContact OH-N 3.32Å; Y90-F127 WeakPolarHBondContact CA-O 3.34Å; Y90-F127 WeakPolarHBondContact CD2-O 3.11Å; Y90-F127 HydrophobicContact CE2-CB 4.31Å; Y90-F127 AromaticContact CE2-CD1 3.86Å; Y90-F127 HydrophobicContact CE2-CD1 3.86Å; Y90-F127 HydrophobicContact CE2-CG 4.49Å; Y90-F128 HydrophobicContact CD2-CD1 4.23Å; Y90-F128 AromaticContact CD2-CE1 3.65Å; Y90-F128 HydrophobicContact CD2-CE1 3.65Å; Y90-F128 HydrophobicContact CD2-CZ 4.08Å; Y90-F128 HydrophobicContact CE2-CE1 4.38Å; Y90-F128 HydrophobicContact CE2-CZ 4.37Å; Y90-H527 AromaticContact CD1-CD2 3.6Å; Y90-H527 AromaticContact CD1-NE2 3.48Å; Y90-H527 WeakPolarHBondContact CD1-NE2 3.22Å; Y90-H527 AromaticContact CE1-CD2 3.52Å; Y90-H527 AromaticContact CE1-NE2 3.62Å; Y90-E530 HydrophobicContact CE1-CB 4.4Å; Y90-E530 HydrophobicContact CE1-CG 4.49Å; Y90-E530 WeakPolarHBondContact CE1-OE2 3.43Å; Y90-F532 HydrophobicContact CE2-CD1 4.01Å; Y90-F532 HydrophobicContact CE2-CD2 4.47Å; Y90-F532 HydrophobicContact CE2-CE1 4.19Å; Y90-F532 HydrophobicContact CE2-CG 4.17Å; Y90-F532 HydrophobicContact CE2-CZ 4.49Å; Y90-F532 WeakPolarHBondContact OH-CB 3.5Å; Y90-F532 VanDerWaalsContact OH-CG 3.23Å; Y90-F532 WeakPolarHBondContact OH-CG 3.17Å
91	Q	96.5	Very high	92.9	Very high	89 Å²	89	45 Å²	45	42%	0.416	22%	0.22	S	C	.	.			trans	-84.3	3.2	-175.4	-58.7	-60.2	-52.7	0	0	114	E89 A95 R126 F127	E89-Q91 PolarHBondContact O-NE2 2.85Å; E89-Q91 PolarHBondContact OE2-NE2 2.82Å; Q91-A95 HydrophobicContact CB-CB 3.79Å; Q91-R126 VanDerWaalsContact CB-O 3.31Å; Q91-R126 WeakPolarHBondContact CB-O 3.32Å; Q91-R126 WeakPolarHBondContact CG-O 3.26Å; Q91-F127 PolarHBondContact N-O 3.22Å
92	G	92.7	Very high	92.3	Very high	12 Å²	12	44.6 Å²	44.6	12%	0.124	23%	0.234	C	C	.	.			trans	92.3	160.7	179.3	0	0	0	0	0	114.6	Y90 Q94 A95 F127 E530	Y90-G92 VanDerWaalsContact C-N 3.27Å; Y90-G92 VanDerWaalsContact CE1-CA 3.42Å; Y90-G92 PolarHBondContact O-N 2.81Å; G92-Q94 PolarHBondContact O-N 3.36Å; G92-Q94 VanDerWaalsContact O-N 3.15Å; G92-A95 WeakPolarHBondContact O-CB 3.38Å; G92-A95 PolarHBondContact O-N 3.18Å; G92-F127 VanDerWaalsContact O-CD1 3.31Å; G92-F127 WeakPolarHBondContact O-CD1 3.46Å; G92-F127 VanDerWaalsContact O-CE1 3.29Å; G92-F127 WeakPolarHBondContact O-CE1 3.16Å; G92-E530 WeakPolarHBondContact CA-OE2 3.4Å
93	C	87.4	Confident	91.7	Very high	18 Å²	18	44.4 Å²	44.4	12%	0.122	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.7	-173.1	60	0	0	0	0	114.6	Y90 E530 P531	Y90-C93 WeakPolarHBondContact OH-CA 3.31Å; Y90-C93 PolarHBondContact OH-N 3.32Å; C93-E530 HydrophobicContact CB-CB 4.37Å; C93-E530 WeakPolarHBondContact CB-OE2 3.27Å; C93-E530 PolarHBondContact N-OE2 2.92Å; C93-E530 PolarHBondContact SG-OE2 3.14Å; C93-P531 HydrophobicContact CB-CG 4.15Å
94	Q	88.7	Confident	90.9	Very high	156 Å²	156	51.2 Å²	51.2	73%	0.729	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-4.8	179.4	-62.9	-177.6	-4.2	0	0	113.5	G92 A96 Q97	G92-Q94 PolarHBondContact O-N 3.36Å; G92-Q94 VanDerWaalsContact O-N 3.15Å; Q94-A96 PolarHBondContact O-N 3.09Å; Q94-Q97 VanDerWaalsContact O-CB 3.27Å; Q94-Q97 WeakPolarHBondContact O-CB 3.43Å; Q94-Q97 PolarHBondContact O-N 3.48Å
95	A	91.3	Very high	90.3	Very high	25 Å²	25	53.1 Å²	53.1	21%	0.207	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.3	-169.4	0	0	0	0	0	114.9	Q91 G92 R126 F127	Q91-A95 HydrophobicContact CB-CB 3.79Å; G92-A95 WeakPolarHBondContact O-CB 3.38Å; G92-A95 PolarHBondContact O-N 3.18Å; A95-R126 VanDerWaalsContact CB-O 3.26Å; A95-R126 WeakPolarHBondContact CB-O 3.33Å; A95-F127 HydrophobicContact CB-CD1 4.35Å; A95-F127 HydrophobicContact CB-CE1 4.45Å
96	A	90.9	Very high	89.6	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.008	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	11	178.4	0	0	0	0	0	113.9	Q94 D98 L99 L100 L123 R126 F127	Q94-A96 PolarHBondContact O-N 3.09Å; A96-D98 PolarHBondContact O-N 2.91Å; A96-L99 HydrophobicContact CB-CD1 4.48Å; A96-L99 WeakPolarHBondContact O-CB 3.45Å; A96-L99 PolarHBondContact O-N 3.21Å; A96-L99 VanDerWaalsContact O-N 3.09Å; A96-L100 WeakPolarHBondContact O-CG 3.35Å; A96-L100 PolarHBondContact O-N 3.47Å; A96-L123 HydrophobicContact CB-CD1 3.79Å; A96-R126 HydrophobicContact CB-CB 4.09Å; A96-F127 HydrophobicContact CB-CD2 4.37Å; A96-F127 HydrophobicContact CB-CE2 3.55Å; A96-F127 HydrophobicContact CB-CZ 3.7Å
97	Q	88.4	Confident	88.9	Confident	53 Å²	53	59.4 Å²	59.4	25%	0.248	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-28.6	-175.5	-176.5	62.1	15.1	0	0	112.8	Q94 L100 R101 H551 V552	Q94-Q97 VanDerWaalsContact O-CB 3.27Å; Q94-Q97 WeakPolarHBondContact O-CB 3.43Å; Q94-Q97 PolarHBondContact O-N 3.48Å; Q97-L100 PolarHBondContact O-N 3.29Å; Q97-R101 PolarHBondContact O-N 3.49Å; Q97-H551 PolarHBondContact NE2-ND1 3.48Å; Q97-H551 PolarHBondContact OE1-ND1 3.17Å; Q97-V552 PolarHBondContact NE2-O 3.17Å
98	D	89.5	Confident	88	Confident	71 Å²	71	59.7 Å²	59.7	38%	0.38	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-41.5	171.6	62.8	-36.1	0	0	0	112.1	A96 L100 R101 R126	A96-D98 PolarHBondContact O-N 2.91Å; D98-L100 VanDerWaalsContact C-N 3.3Å; D98-L100 PolarHBondContact O-N 2.89Å; D98-R101 WeakPolarHBondContact O-CG 3.39Å; D98-R101 PolarHBondContact O-N 3.29Å; D98-R126 IonicContact OD1-CZ 3.99Å; D98-R126 IonicContact OD1-NH1 3.24Å; D98-R126 PolarHBondContact OD1-NH1 3.03Å; D98-R126 IonicContact OD2-CZ 3.31Å; D98-R126 VanDerWaalsContact OD2-CZ 3.31Å; D98-R126 IonicContact OD2-NH1 2.81Å; D98-R126 PolarHBondContact OD2-NH1 3.24Å; D98-R126 IonicContact OD2-NH2 3.69Å; D98-R126 PolarHBondContact OD2-NH2 3.32Å
99	L	87.4	Confident	86.7	Confident	33 Å²	33	62.2 Å²	62.2	17%	0.173	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-28.2	177.8	-64.5	-178.5	0	0	0	113	A96 R122 R126	A96-L99 HydrophobicContact CB-CD1 4.48Å; A96-L99 WeakPolarHBondContact O-CB 3.45Å; A96-L99 PolarHBondContact O-N 3.21Å; A96-L99 VanDerWaalsContact O-N 3.09Å; L99-R122 HydrophobicContact CD1-CB 3.86Å; L99-R126 HydrophobicContact CD1-CG 3.52Å; L99-R126 HydrophobicContact CG-CG 4.45Å
100	L	87.1	Confident	85.1	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	4.7	-177.7	-62.6	177.4	0	0	0	113.5	F53 V55 A96 Q97 D98 G102 Q103 I119 M549 H551	F53-L100 HydrophobicContact CD1-CD1 4.2Å; F53-L100 HydrophobicContact CE1-CD1 4.27Å; F53-L100 HydrophobicContact CE1-CD2 3.83Å; V55-L100 HydrophobicContact CG2-CD2 4.45Å; A96-L100 WeakPolarHBondContact O-CG 3.35Å; A96-L100 PolarHBondContact O-N 3.47Å; Q97-L100 PolarHBondContact O-N 3.29Å; D98-L100 VanDerWaalsContact C-N 3.3Å; D98-L100 PolarHBondContact O-N 2.89Å; L100-G102 PolarHBondContact O-N 3Å; L100-Q103 WeakPolarHBondContact O-CB 3.4Å; L100-Q103 PolarHBondContact O-N 2.79Å; L100-Q103 VanDerWaalsContact O-N 3.15Å; L100-I119 HydrophobicContact CD2-CG2 3.77Å; L100-M549 HydrophobicContact CD1-SD 3.67Å; L100-H551 HydrophobicContact CD1-CB 4.43Å; L100-H551 PolarHBondContact O-CE1 3.4Å; L100-H551 PolarHBondContact O-NE2 3.47Å
101	R	85.1	Confident	83.6	Confident	193 Å²	193	62 Å²	62	73%	0.728	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	133.4	178.1	-72.7	-176.8	-179.1	-177.5	1.6	111.1	Q97 D98 Q103	Q97-R101 PolarHBondContact O-N 3.49Å; D98-R101 WeakPolarHBondContact O-CG 3.39Å; D98-R101 PolarHBondContact O-N 3.29Å; R101-Q103 VanDerWaalsContact C-N 3.25Å; R101-Q103 PolarHBondContact O-N 3.33Å
102	G	80.1	Confident	82.1	Confident	72 Å²	72	64.1 Å²	64.1	74%	0.742	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	3.7	-179.2	0	0	0	0	0	114.7	L100	L100-G102 PolarHBondContact O-N 3Å
103	Q	82.3	Confident	81.6	Confident	39 Å²	39	67.9 Å²	67.9	18%	0.182	38%	0.379	C	S	.	.			trans	-82.3	118.1	170.4	-63.4	-60.6	-35.9	0	0	109.8	F53 L100 R101 L108 I119 H551 S553	F53-Q103 HydrophobicContact CZ-CB 4.18Å; L100-Q103 WeakPolarHBondContact O-CB 3.4Å; L100-Q103 PolarHBondContact O-N 2.79Å; L100-Q103 VanDerWaalsContact O-N 3.15Å; R101-Q103 VanDerWaalsContact C-N 3.25Å; R101-Q103 PolarHBondContact O-N 3.33Å; Q103-L108 HydrophobicContact CG-CD1 4.17Å; Q103-I119 HydrophobicContact CG-CD1 3.97Å; Q103-H551 PolarHBondContact O-NE2 2.75Å; Q103-S553 PolarHBondContact O-OG 2.85Å
104	E	79.8	Confident	81.3	Confident	171 Å²	171	74.4 Å²	74.4	80%	0.799	41%	0.408	S	S	*	.			trans	-101.4	150	174.5	-66.1	-170.1	172.9	0	0	111
105	G	83.3	Confident	81.1	Confident	53 Å²	53	70.3 Å²	70.3	55%	0.546	40%	0.396	S	S	.	.	S	Bend	trans	99.9	-171.3	177.1	0	0	0	0	0	114.6	F53	F53-G105 WeakPolarHBondContact CD2-O 3.23Å
106	E	81.4	Confident	80.8	Confident	105 Å²	105	69.4 Å²	69.4	49%	0.491	39%	0.388	S	S	.	.	S	Bend	trans	-100.3	-15.4	-173.2	-62.4	-178	175.1	0	0	112.8	F53 T54 K504	F53-E106 WeakPolarHBondContact CA-O 3.45Å; T54-E106 PolarHBondContact N-O 3.14Å; E106-K504 IonicContact OE1-NZ 3.2Å; E106-K504 PolarHBondContact OE1-NZ 3.14Å; E106-K504 IonicContact OE2-NZ 2.75Å; E106-K504 PolarHBondContact OE2-NZ 3.35Å
107	T	82.9	Confident	80.6	Confident	50 Å²	50	71.7 Å²	71.7	31%	0.307	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	128.6	-173.1	-51.4	0	0	0	0	112	T54 V56 S109	T54-T107 CarbonylContact O-C 3.56Å; T54-T107 VanDerWaalsContact O-CA 3.31Å; T54-T107 WeakPolarHBondContact O-CA 3.47Å; V56-T107 HydrophobicContact CG2-CG2 3.93Å; T107-S109 PolarHBondContact O-N 3.14Å
108	L	80.6	Confident	80.6	Confident	6 Å²	6	72.3 Å²	72.3	3%	0.031	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	101.9	163.8	-164.9	125	0	0	0	108.4	F53 T54 V55 V56 Q103 I119 R120	F53-L108 HydrophobicContact CE1-CB 4.13Å; F53-L108 HydrophobicContact CZ-CB 3.86Å; T54-L108 PolarHBondContact O-N 3.31Å; V55-L108 HydrophobicContact CG1-CB 4.44Å; V55-L108 HydrophobicContact CG1-CD2 3.92Å; V55-L108 HydrophobicContact CG2-CB 4.21Å; V56-L108 PolarHBondContact N-O 3.12Å; Q103-L108 HydrophobicContact CG-CD1 4.17Å; L108-I119 HydrophobicContact CD1-CD1 3.87Å; L108-R120 HydrophobicContact CD2-CG 4.04Å
109	S	71.5	Confident	80.6	Confident	59 Å²	59	69.2 Å²	69.2	41%	0.413	39%	0.388	S	S	.	.			trans	-79.8	173.5	-177.9	71.3	0	0	0	0	112	T107 A111	T107-S109 PolarHBondContact O-N 3.14Å; S109-A111 PolarHBondContact O-N 3.35Å
110	T	63.8	Low	80.8	Confident	58 Å²	58	68.6 Å²	68.6	36%	0.356	38%	0.384	S	S	.	.	S	Bend	trans	-70.2	24.3	176.3	37.2	0	0	0	0	114.2	N57 N112 L509	N57-T110 HydrophobicContact CB-CG2 4.16Å; T110-N112 PolarHBondContact O-N 2.99Å; T110-L509 HydrophobicContact CG2-CD2 4.15Å
111	A	63.8	Low	81	Confident	35 Å²	35	70.4 Å²	70.4	29%	0.289	40%	0.397	S	S	.	.			trans	-58.8	130.3	170.7	0	0	0	0	0	109	S109 D113 S116	S109-A111 PolarHBondContact O-N 3.35Å; A111-D113 WeakPolarHBondContact CB-OD2 3.34Å; A111-D113 PolarHBondContact O-N 2.92Å; A111-S116 WeakPolarHBondContact O-CB 3.49Å
112	N	66.1	Low	81.4	Confident	135 Å²	135	67.1 Å²	67.1	72%	0.722	38%	0.384	S	S	*	.			trans	-79.5	28.3	-172.1	-80	-15.7	0	0	0	113	T110	T110-N112 PolarHBondContact O-N 2.99Å
113	D	81.6	Confident	82.1	Confident	90 Å²	90	63.7 Å²	63.7	48%	0.481	35%	0.349	S	S	.	.			trans	-70.2	137.4	178.6	-21.7	-48.6	0	0	0	108.4	A111 C115 S116 L117	A111-D113 WeakPolarHBondContact CB-OD2 3.34Å; A111-D113 PolarHBondContact O-N 2.92Å; D113-C115 PolarHBondContact O-N 2.97Å; D113-S116 WeakPolarHBondContact O-CB 3.47Å; D113-S116 PolarHBondContact O-N 3.46Å; D113-S116 PolarHBondContact OD2-OG 2.87Å; D113-L117 PolarHBondContact O-N 2.92Å
114	Q	82.1	Confident	82.7	Confident	155 Å²	155	62 Å²	62	72%	0.724	34%	0.341	S	S	*	.	H	α-helix	trans	-55.7	-32	-176.7	-167.3	63.6	27.3	0	0	112.6	N118	Q114-N118 WeakPolarHBondContact O-CB 3.27Å; Q114-N118 PolarHBondContact O-N 3.25Å; Q114-N118 VanDerWaalsContact O-N 3.12Å
115	C	83.7	Confident	83.4	Confident	71 Å²	71	60.9 Å²	60.9	48%	0.48	34%	0.336	S	S	.	.	H	α-helix	trans	-65.3	-50.8	174.5	-173.7	0	0	0	0	111.7	D113 L117 N118 I119	D113-C115 PolarHBondContact O-N 2.97Å; C115-L117 VanDerWaalsContact C-N 3.32Å; C115-L117 PolarHBondContact O-N 3.36Å; C115-N118 WeakPolarHBondContact O-CB 3.05Å; C115-N118 PolarHBondContact O-N 2.92Å; C115-N118 VanDerWaalsContact O-N 3.14Å; C115-I119 WeakPolarHBondContact O-CG1 3.49Å; C115-I119 PolarHBondContact O-N 3.45Å
116	S	84.9	Confident	84	Confident	6 Å²	6	62.7 Å²	62.7	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-59.3	-41.1	178.3	-59.5	0	0	0	0	111.8	A111 D113 I119 R120	A111-S116 WeakPolarHBondContact O-CB 3.49Å; D113-S116 WeakPolarHBondContact O-CB 3.47Å; D113-S116 PolarHBondContact O-N 3.46Å; D113-S116 PolarHBondContact OD2-OG 2.87Å; S116-I119 PolarHBondContact O-N 2.9Å; S116-R120 VanDerWaalsContact O-CG 3.27Å; S116-R120 WeakPolarHBondContact O-CG 3.37Å; S116-R120 PolarHBondContact O-N 3.22Å; S116-R120 VanDerWaalsContact O-N 3.15Å
117	L	86.4	Confident	84.7	Confident	48 Å²	48	57.7 Å²	57.7	25%	0.251	30%	0.303	S	S	.	.	H	α-helix	trans	-61.8	-45.9	174.1	-62.7	178.4	0	0	0	112.1	D113 C115 I119 R120 S121	D113-L117 PolarHBondContact O-N 2.92Å; C115-L117 VanDerWaalsContact C-N 3.32Å; C115-L117 PolarHBondContact O-N 3.36Å; L117-I119 PolarHBondContact O-N 3.02Å; L117-R120 PolarHBondContact O-N 2.92Å; L117-S121 PolarHBondContact O-N 3.39Å; L117-S121 VanDerWaalsContact O-N 3.1Å; L117-S121 PolarHBondContact O-OG 2.88Å
118	N	89.3	Confident	85.4	Confident	67 Å²	67	55.6 Å²	55.6	36%	0.358	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-36.9	179.8	-169.7	9	0	0	0	112.7	Q114 C115 S121 R122	Q114-N118 WeakPolarHBondContact O-CB 3.27Å; Q114-N118 PolarHBondContact O-N 3.25Å; Q114-N118 VanDerWaalsContact O-N 3.12Å; C115-N118 WeakPolarHBondContact O-CB 3.05Å; C115-N118 PolarHBondContact O-N 2.92Å; C115-N118 VanDerWaalsContact O-N 3.14Å; N118-S121 PolarHBondContact O-OG 3.45Å; N118-S121 VanDerWaalsContact O-OG 3.09Å; N118-R122 WeakPolarHBondContact O-CG 3.48Å; N118-R122 PolarHBondContact O-N 2.99Å; N118-R122 WeakPolarHBondContact OD1-CD 3.47Å; N118-R122 PolarHBondContact OD1-NE 3.06Å
119	I	90.1	Very high	86.2	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-50.6	174.8	-69	168.4	0	0	0	109.8	L100 Q103 L108 C115 S116 L117 S121 R122 L123	L100-I119 HydrophobicContact CD2-CG2 3.77Å; Q103-I119 HydrophobicContact CG-CD1 3.97Å; L108-I119 HydrophobicContact CD1-CD1 3.87Å; C115-I119 WeakPolarHBondContact O-CG1 3.49Å; C115-I119 PolarHBondContact O-N 3.45Å; S116-I119 PolarHBondContact O-N 2.9Å; L117-I119 PolarHBondContact O-N 3.02Å; I119-S121 VanDerWaalsContact C-N 3.32Å; I119-S121 PolarHBondContact O-N 3.46Å; I119-R122 PolarHBondContact O-N 3.42Å; I119-L123 HydrophobicContact CG2-CD1 4.17Å; I119-L123 WeakPolarHBondContact O-CB 3.29Å; I119-L123 PolarHBondContact O-N 3.45Å
120	R	90.8	Very high	87.4	Confident	19 Å²	19	59 Å²	59	7%	0.072	31%	0.306	C	S	.	.	H	α-helix	trans	-62.6	-35.1	-177.2	-66.6	176.1	-38.9	132.1	24	113.3	V55 V56 N57 E59 L108 S116 L117	V55-R120 HydrophobicContact CG1-CG 3.89Å; V56-R120 WeakPolarHBondContact O-CD 3.3Å; N57-R120 PolarHBondContact ND2-NH1 2.95Å; E59-R120 PolarHBondContact N-O 2.84Å; E59-R120 IonicContact OE1-NH2 3.86Å; L108-R120 HydrophobicContact CD2-CG 4.04Å; S116-R120 VanDerWaalsContact O-CG 3.27Å; S116-R120 WeakPolarHBondContact O-CG 3.37Å; S116-R120 PolarHBondContact O-N 3.22Å; S116-R120 VanDerWaalsContact O-N 3.15Å; L117-R120 PolarHBondContact O-N 2.92Å
121	S	91.8	Very high	89	Confident	41 Å²	41	59.2 Å²	59.2	29%	0.287	31%	0.305	S	S	.	.	H	α-helix	trans	-72.8	-29.7	-179.2	66.4	0	0	0	0	113.5	E59 L117 N118 I119	E59-S121 WeakPolarHBondContact OE2-CA 3.34Å; E59-S121 WeakPolarHBondContact OE2-CB 3.4Å; L117-S121 PolarHBondContact O-N 3.39Å; L117-S121 VanDerWaalsContact O-N 3.1Å; L117-S121 PolarHBondContact O-OG 2.88Å; N118-S121 PolarHBondContact O-OG 3.45Å; N118-S121 VanDerWaalsContact O-OG 3.09Å; I119-S121 VanDerWaalsContact C-N 3.32Å; I119-S121 PolarHBondContact O-N 3.46Å
122	R	93.5	Very high	90.6	Very high	123 Å²	123	60.2 Å²	60.2	46%	0.464	30%	0.304	S	S	.	.	H	α-helix	trans	-96.5	-19.3	-177.9	-64.2	-177.3	-177.2	-165.2	-0.2	114.1	L99 N118 I119 F124 Q125 R126	L99-R122 HydrophobicContact CD1-CB 3.86Å; N118-R122 WeakPolarHBondContact O-CG 3.48Å; N118-R122 PolarHBondContact O-N 2.99Å; N118-R122 WeakPolarHBondContact OD1-CD 3.47Å; N118-R122 PolarHBondContact OD1-NE 3.06Å; I119-R122 PolarHBondContact O-N 3.42Å; R122-F124 VanDerWaalsContact C-N 3.34Å; R122-F124 PolarHBondContact O-N 3.22Å; R122-Q125 PolarHBondContact O-N 2.68Å; R122-R126 PolarHBondContact O-N 3.28Å; R122-R126 VanDerWaalsContact O-N 3.16Å
123	L	93.9	Very high	92.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-44.7	-170.7	-153.8	74.3	0	0	0	112.6	V55 V58 A96 I119 Q125 R126 F127 F547 M549	V55-L123 HydrophobicContact CB-CD2 3.7Å; V55-L123 HydrophobicContact CG1-CD2 3.83Å; V55-L123 HydrophobicContact CG2-CD2 3.87Å; V58-L123 HydrophobicContact CB-CD2 4.47Å; V58-L123 HydrophobicContact CG1-CB 3.93Å; V58-L123 HydrophobicContact CG1-CD2 4.04Å; V58-L123 HydrophobicContact CG2-CD2 3.55Å; A96-L123 HydrophobicContact CB-CD1 3.79Å; I119-L123 HydrophobicContact CG2-CD1 4.17Å; I119-L123 WeakPolarHBondContact O-CB 3.29Å; I119-L123 PolarHBondContact O-N 3.45Å; L123-Q125 PolarHBondContact O-N 3.37Å; L123-R126 PolarHBondContact O-N 2.88Å; L123-F127 HydrophobicContact CD1-CE2 4Å; L123-F127 HydrophobicContact CG-CD2 4.1Å; L123-F127 HydrophobicContact CG-CE2 3.88Å; L123-F127 VanDerWaalsContact O-CD2 3.29Å; L123-F127 WeakPolarHBondContact O-CD2 3.49Å; L123-F127 PolarHBondContact O-N 2.74Å; L123-F547 HydrophobicContact CD2-CB 4.14Å; L123-F547 HydrophobicContact CD2-CD2 3.6Å; L123-F547 HydrophobicContact CD2-CE2 4.4Å; L123-F547 HydrophobicContact CD2-CG 4.19Å; L123-F547 HydrophobicContact CG-CD2 3.99Å; L123-F547 HydrophobicContact CG-CE2 4.47Å; L123-M549 HydrophobicContact CD1-CE 4.25Å; L123-M549 HydrophobicContact CD2-CE 3.71Å; L123-M549 HydrophobicContact CG-CE 4.17Å
124	F	95.6	Very high	92.8	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-59.8	-50.1	-179.1	-172.6	-81.3	0	0	0	111.6	V58 E59 K60 P61 L65 Y88 R122 R126 F127 F128 F547	V58-F124 HydrophobicContact CG1-CB 4.36Å; E59-F124 VanDerWaalsContact O-CB 3.24Å; E59-F124 WeakPolarHBondContact O-CB 3.31Å; K60-F124 HydrophobicContact CB-CD2 3.61Å; K60-F124 HydrophobicContact CB-CE2 3.91Å; K60-F124 HydrophobicContact CB-CG 4.18Å; P61-F124 VanDerWaalsContact CD-CD1 3.42Å; P61-F124 HydrophobicContact CG-CD1 3.98Å; P61-F124 HydrophobicContact CG-CE1 3.69Å; P61-F124 HydrophobicContact CG-CZ 4.31Å; L65-F124 HydrophobicContact CD1-CE2 4.44Å; L65-F124 HydrophobicContact CD2-CE2 3.74Å; L65-F124 HydrophobicContact CD2-CZ 4.12Å; Y88-F124 HydrophobicContact CD1-CE1 4.23Å; Y88-F124 AromaticContact CE1-CE1 3.69Å; Y88-F124 HydrophobicContact CE1-CE1 3.69Å; Y88-F124 HydrophobicContact CE1-CZ 4.15Å; Y88-F124 HydrophobicContact CE2-CZ 4.32Å; Y88-F124 AromaticContact CZ-CE1 3.9Å; Y88-F124 AromaticContact CZ-CZ 3.97Å; R122-F124 VanDerWaalsContact C-N 3.34Å; R122-F124 PolarHBondContact O-N 3.22Å; F124-R126 PolarHBondContact O-N 3.47Å; F124-F127 PolarHBondContact O-N 3.03Å; F124-F128 HydrophobicContact CD1-CB 4.27Å; F124-F128 HydrophobicContact CD2-CD2 4.1Å; F124-F128 HydrophobicContact CE1-CB 3.88Å; F124-F128 HydrophobicContact CE1-CD2 4.42Å; F124-F128 HydrophobicContact CE1-CG 4.49Å; F124-F128 AromaticContact CE2-CD2 3.94Å; F124-F128 HydrophobicContact CE2-CD2 3.94Å; F124-F128 HydrophobicContact CG-CD2 4.38Å; F124-F128 HydrophobicContact CZ-CB 4.16Å; F124-F128 HydrophobicContact CZ-CD2 4.11Å; F124-F128 HydrophobicContact CZ-CG 4.33Å; F124-F128 PolarHBondContact O-N 3.21Å; F124-F547 AromaticContact CD2-CZ 3.75Å; F124-F547 HydrophobicContact CD2-CZ 3.75Å; F124-F547 HydrophobicContact CE2-CZ 4.41Å
125	Q	95.1	Very high	93.4	Very high	148 Å²	148	50.6 Å²	50.6	69%	0.692	26%	0.26	S	S	*	.	H	α-helix	trans	-64.4	-25.7	-179.6	-66.8	177.6	-10.1	0	0	112.9	R122 L123	R122-Q125 PolarHBondContact O-N 2.68Å; L123-Q125 PolarHBondContact O-N 3.37Å
126	R	95.1	Very high	93.7	Very high	90 Å²	90	47.6 Å²	47.6	34%	0.34	24%	0.24	S	C	.	.	H	α-helix	trans	-73.1	-40.2	174.1	-70.3	-50.9	-169.2	104	4.4	112.9	Q91 A95 A96 D98 L99 R122 L123 F124	Q91-R126 VanDerWaalsContact CB-O 3.31Å; Q91-R126 WeakPolarHBondContact CB-O 3.32Å; Q91-R126 WeakPolarHBondContact CG-O 3.26Å; A95-R126 VanDerWaalsContact CB-O 3.26Å; A95-R126 WeakPolarHBondContact CB-O 3.33Å; A96-R126 HydrophobicContact CB-CB 4.09Å; D98-R126 IonicContact OD1-CZ 3.99Å; D98-R126 IonicContact OD1-NH1 3.24Å; D98-R126 PolarHBondContact OD1-NH1 3.03Å; D98-R126 IonicContact OD2-CZ 3.31Å; D98-R126 VanDerWaalsContact OD2-CZ 3.31Å; D98-R126 IonicContact OD2-NH1 2.81Å; D98-R126 PolarHBondContact OD2-NH1 3.24Å; D98-R126 IonicContact OD2-NH2 3.69Å; D98-R126 PolarHBondContact OD2-NH2 3.32Å; L99-R126 HydrophobicContact CD1-CG 3.52Å; L99-R126 HydrophobicContact CG-CG 4.45Å; R122-R126 PolarHBondContact O-N 3.28Å; R122-R126 VanDerWaalsContact O-N 3.16Å; L123-R126 PolarHBondContact O-N 2.88Å; F124-R126 PolarHBondContact O-N 3.47Å
127	F	96.4	Very high	93.6	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-82.5	-29.8	179.9	-75.7	-69.6	0	0	0	113.3	Y90 Q91 G92 A95 A96 L123 F124 F532 F547 M549	Y90-F127 WeakPolarHBondContact CA-O 3.34Å; Y90-F127 WeakPolarHBondContact CD2-O 3.11Å; Y90-F127 HydrophobicContact CE2-CB 4.31Å; Y90-F127 AromaticContact CE2-CD1 3.86Å; Y90-F127 HydrophobicContact CE2-CD1 3.86Å; Y90-F127 HydrophobicContact CE2-CG 4.49Å; Q91-F127 PolarHBondContact N-O 3.22Å; G92-F127 VanDerWaalsContact O-CD1 3.31Å; G92-F127 WeakPolarHBondContact O-CD1 3.46Å; G92-F127 VanDerWaalsContact O-CE1 3.29Å; G92-F127 WeakPolarHBondContact O-CE1 3.16Å; A95-F127 HydrophobicContact CB-CD1 4.35Å; A95-F127 HydrophobicContact CB-CE1 4.45Å; A96-F127 HydrophobicContact CB-CD2 4.37Å; A96-F127 HydrophobicContact CB-CE2 3.55Å; A96-F127 HydrophobicContact CB-CZ 3.7Å; L123-F127 HydrophobicContact CD1-CE2 4Å; L123-F127 HydrophobicContact CG-CD2 4.1Å; L123-F127 HydrophobicContact CG-CE2 3.88Å; L123-F127 VanDerWaalsContact O-CD2 3.29Å; L123-F127 WeakPolarHBondContact O-CD2 3.49Å; L123-F127 PolarHBondContact O-N 2.74Å; F124-F127 PolarHBondContact O-N 3.03Å; F127-F532 HydrophobicContact CD1-CD2 4.29Å; F127-F532 AromaticContact CD1-CE2 3.89Å; F127-F532 HydrophobicContact CD1-CE2 3.89Å; F127-F532 HydrophobicContact CD1-CZ 4.48Å; F127-F532 HydrophobicContact CD2-CE2 4.09Å; F127-F532 HydrophobicContact CE1-CD2 4.14Å; F127-F532 AromaticContact CE1-CE2 3.97Å; F127-F532 HydrophobicContact CE1-CE2 3.97Å; F127-F532 HydrophobicContact CE2-CE2 4.18Å; F127-F532 AromaticContact CG-CE2 3.95Å; F127-F532 HydrophobicContact CG-CE2 3.95Å; F127-F532 HydrophobicContact CG-CZ 4.26Å; F127-F532 HydrophobicContact CZ-CD2 4.49Å; F127-F532 HydrophobicContact CZ-CE2 4.12Å; F127-F547 HydrophobicContact CB-CE2 4.41Å; F127-F547 AromaticContact CD2-CD2 3.81Å; F127-F547 HydrophobicContact CD2-CD2 3.81Å; F127-F547 AromaticContact CD2-CE2 3.9Å; F127-F547 HydrophobicContact CD2-CE2 3.9Å; F127-F547 HydrophobicContact CE2-CD2 4.25Å; F127-F547 HydrophobicContact CG-CE2 4.49Å; F127-M549 HydrophobicContact CD2-CE 4.38Å; F127-M549 HydrophobicContact CE2-CE 3.43Å; F127-M549 VanDerWaalsContact CE2-CE 3.43Å; F127-M549 HydrophobicContact CE2-SD 3.67Å; F127-M549 HydrophobicContact CZ-CB 4.46Å; F127-M549 HydrophobicContact CZ-CE 3.76Å; F127-M549 HydrophobicContact CZ-SD 3.47Å; F127-M549 WeakPolarHBondContact CZ-SD 2.94Å
128	F	97.6	Very high	92.9	Very high	5 Å²	5	49.1 Å²	49.1	2%	0.022	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	108.4	-170.7	-61.3	-68.1	0	0	0	110.5	F68 F75 Y88 E89 Y90 F124 F532 I534 F547	F68-F128 AromaticContact CE1-CE1 3.86Å; F68-F128 HydrophobicContact CE1-CE1 3.86Å; F68-F128 HydrophobicContact CE1-CZ 4.27Å; F68-F128 HydrophobicContact CZ-CE1 4.06Å; F68-F128 AromaticContact CZ-CZ 3.98Å; F68-F128 HydrophobicContact CZ-CZ 3.98Å; F75-F128 HydrophobicContact CB-CD1 3.78Å; F75-F128 HydrophobicContact CB-CE1 3.54Å; F75-F128 HydrophobicContact CD1-CD1 4.26Å; F75-F128 HydrophobicContact CD1-CE1 4.06Å; F75-F128 HydrophobicContact CD2-CE1 4.1Å; F75-F128 HydrophobicContact CD2-CZ 4.46Å; F75-F128 HydrophobicContact CG-CD1 4.1Å; F75-F128 AromaticContact CG-CE1 3.62Å; F75-F128 HydrophobicContact CG-CE1 3.62Å; F75-F128 HydrophobicContact CG-CZ 4.26Å; Y88-F128 HydrophobicContact CD1-CB 3.83Å; Y88-F128 HydrophobicContact CG-CB 4.05Å; E89-F128 WeakPolarHBondContact O-CA 3.21Å; Y90-F128 HydrophobicContact CD2-CD1 4.23Å; Y90-F128 AromaticContact CD2-CE1 3.65Å; Y90-F128 HydrophobicContact CD2-CE1 3.65Å; Y90-F128 HydrophobicContact CD2-CZ 4.08Å; Y90-F128 HydrophobicContact CE2-CE1 4.38Å; Y90-F128 HydrophobicContact CE2-CZ 4.37Å; F124-F128 HydrophobicContact CD1-CB 4.27Å; F124-F128 HydrophobicContact CD2-CD2 4.1Å; F124-F128 HydrophobicContact CE1-CB 3.88Å; F124-F128 HydrophobicContact CE1-CD2 4.42Å; F124-F128 HydrophobicContact CE1-CG 4.49Å; F124-F128 AromaticContact CE2-CD2 3.94Å; F124-F128 HydrophobicContact CE2-CD2 3.94Å; F124-F128 HydrophobicContact CG-CD2 4.38Å; F124-F128 HydrophobicContact CZ-CB 4.16Å; F124-F128 HydrophobicContact CZ-CD2 4.11Å; F124-F128 HydrophobicContact CZ-CG 4.33Å; F124-F128 PolarHBondContact O-N 3.21Å; F128-F532 HydrophobicContact CE2-CE1 4.28Å; F128-F532 HydrophobicContact CE2-CZ 4.12Å; F128-F532 AromaticContact CZ-CE1 3.82Å; F128-F532 HydrophobicContact CZ-CE1 3.82Å; F128-F532 HydrophobicContact CZ-CZ 4.11Å; F128-I534 HydrophobicContact CE2-CD1 4.21Å; F128-I534 HydrophobicContact CZ-CD1 3.91Å; F128-F547 HydrophobicContact CD2-CE2 4.38Å; F128-F547 HydrophobicContact CD2-CZ 4.08Å; F128-F547 HydrophobicContact CE2-CE1 4.35Å; F128-F547 AromaticContact CE2-CE2 3.97Å; F128-F547 HydrophobicContact CE2-CE2 3.97Å; F128-F547 AromaticContact CE2-CZ 3.59Å; F128-F547 HydrophobicContact CE2-CZ 3.59Å
129	S	97.1	Very high	92.3	Very high	49 Å²	49	52.7 Å²	52.7	34%	0.343	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123.6	169.7	-177.5	0	0	0	0	108.8	Y88 E89 L131	Y88-S129 CarbonylContact C-O 3.57Å; Y88-S129 WeakPolarHBondContact CA-O 3.43Å; E89-S129 PolarHBondContact N-O 3.02Å; E89-S129 PolarHBondContact O-N 2.98Å; S129-L131 PolarHBondContact O-N 3.24Å
130	L	97.6	Very high	91.9	Very high	88 Å²	88	54.9 Å²	54.9	46%	0.461	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	118	177.5	-179.3	65.4	0	0	0	109.3	E86 Y88 V133	E86-L130 HydrophobicContact CB-CD1 4.23Å; Y88-L130 HydrophobicContact CD1-CB 3.92Å; Y88-L130 HydrophobicContact CD1-CD1 3.99Å; Y88-L130 HydrophobicContact CE1-CB 3.77Å; Y88-L130 HydrophobicContact CE1-CD1 3.66Å; Y88-L130 HydrophobicContact CE1-CG 4.27Å; Y88-L130 HydrophobicContact CE2-CD1 4.38Å; Y88-L130 HydrophobicContact CG-CD1 4.47Å; L130-V133 HydrophobicContact CD1-CG2 4.02Å; L130-V133 HydrophobicContact CD2-CG2 3.92Å; L130-V133 HydrophobicContact CG-CG2 4.33Å
131	L	97.1	Very high	91.9	Very high	63 Å²	63	55 Å²	55	33%	0.33	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-51.5	176.3	-68.4	-179.5	0	0	0	111.5	Y74 I87 E89 S129	Y74-L131 HydrophobicContact CD1-CD1 3.94Å; Y74-L131 HydrophobicContact CE1-CD1 3.49Å; Y74-L131 VanDerWaalsContact CE1-CD1 3.49Å; I87-L131 PolarHBondContact O-N 2.81Å; E89-L131 HydrophobicContact CB-CD1 3.7Å; E89-L131 HydrophobicContact CB-CD2 4.13Å; E89-L131 HydrophobicContact CB-CG 3.79Å; E89-L131 HydrophobicContact CG-CD1 4.43Å; S129-L131 PolarHBondContact O-N 3.24Å
132	H	97.5	Very high	92	Very high	55 Å²	55	57.9 Å²	57.9	26%	0.255	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.4	-171.2	-56.2	-58.3	0	0	0	111.7	I87 H202	I87-H132 HydrophobicContact CB-CB 4.26Å; I87-H132 HydrophobicContact CD1-CB 4.17Å; I87-H132 PolarHBondContact N-O 3.21Å; I87-H132 PolarHBondContact O-N 2.97Å; H132-H202 PolarHBondContact NE2-O 3.44Å; H132-H202 VanDerWaalsContact NE2-O 3.13Å
133	V	97.1	Very high	92.1	Very high	83 Å²	83	52.1 Å²	52.1	50%	0.503	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	109	166.4	-177.6	0	0	0	0	106.4	L85 E86 L130	L85-V133 WeakPolarHBondContact O-CA 3.48Å; E86-V133 HydrophobicContact CG-CG1 4.49Å; E86-V133 HydrophobicContact CG-CG2 4.35Å; L130-V133 HydrophobicContact CD1-CG2 4.02Å; L130-V133 HydrophobicContact CD2-CG2 3.92Å; L130-V133 HydrophobicContact CG-CG2 4.33Å
134	T	96.3	Very high	92.2	Very high	7 Å²	7	53.9 Å²	53.9	4%	0.043	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	113.2	-179.3	-47.1	0	0	0	0	108	S84 L85 V136 I199 G204 L206	S84-T134 CarbonylContact C-O 3.45Å; S84-T134 WeakPolarHBondContact CA-O 3.38Å; S84-T134 WeakPolarHBondContact CB-O 3.46Å; L85-T134 PolarHBondContact N-O 2.88Å; L85-T134 PolarHBondContact O-N 3.35Å; T134-V136 HydrophobicContact CG2-CG2 4.22Å; T134-V136 PolarHBondContact O-N 3.44Å; T134-I199 HydrophobicContact CG2-CD1 4.41Å; T134-I199 HydrophobicContact CG2-CG1 4.35Å; T134-I199 HydrophobicContact CG2-CG2 4.04Å; T134-G204 WeakPolarHBondContact CG2-O 3.14Å; T134-G204 PolarHBondContact OG1-O 2.86Å; T134-L206 HydrophobicContact CG2-CB 4.08Å
135	N	94.7	Very high	92	Very high	88 Å²	88	56.1 Å²	56.1	47%	0.471	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	123.6	171	-172.2	-6.1	0	0	0	108.9	T83	T83-N135 PolarHBondContact O-OD1 2.67Å
136	V	90.8	Very high	91.9	Very high	8 Å²	8	52.2 Å²	52.2	5%	0.048	29%	0.286	C	S	.	.			trans	-116.7	-46.9	-173.3	-173.5	0	0	0	0	110.3	T83 T134 S138 L143 H197 I199 L206	T83-V136 PolarHBondContact O-N 3.28Å; T134-V136 HydrophobicContact CG2-CG2 4.22Å; T134-V136 PolarHBondContact O-N 3.44Å; V136-S138 PolarHBondContact O-N 3.37Å; V136-L143 HydrophobicContact CB-CD1 4.22Å; V136-L143 HydrophobicContact CB-CD2 4.16Å; V136-L143 HydrophobicContact CG1-CD2 4Å; V136-L143 HydrophobicContact CG2-CD1 4.34Å; V136-H197 HydrophobicContact CG1-CB 3.57Å; V136-H197 WeakPolarHBondContact CG1-CD2 3.46Å; V136-H197 WeakPolarHBondContact CG1-ND1 3.23Å; V136-I199 HydrophobicContact CG2-CD1 3.57Å; V136-I199 HydrophobicContact CG2-CG1 4.48Å; V136-L206 HydrophobicContact CG1-CD1 4.41Å
137	A	82.7	Confident	91.9	Very high	4 Å²	4	48 Å²	48	3%	0.033	27%	0.27	C	S	.	.			trans	-98.4	69.1	-170.7	0	0	0	0	0	110.1	T83 E141 L143	T83-A137 PolarHBondContact O-N 2.88Å; A137-E141 HydrophobicContact CB-CB 3.86Å; A137-E141 WeakPolarHBondContact CB-O 3.32Å; A137-L143 HydrophobicContact CB-CG 4.37Å
138	S	71.6	Confident	91.8	Very high	83 Å²	83	48 Å²	48	58%	0.58	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-18.3	-175.4	-50.7	0	0	0	0	114	V136	V136-S138 PolarHBondContact O-N 3.37Å
139	N	76.4	Confident	91.7	Very high	141 Å²	141	47.8 Å²	47.8	75%	0.754	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	33.9	-169.2	-64.7	-17.6	0	0	0	113.6	E141	N139-E141 PolarHBondContact O-N 3.09Å
140	G	81.4	Confident	91.6	Very high	52 Å²	52	45.5 Å²	45.5	54%	0.536	25%	0.253	S	S	.	.	S	Bend	trans	73.9	6.7	-176.3	0	0	0	0	0	114.3
141	E	90.4	Very high	91.3	Very high	23 Å²	23	41.7 Å²	41.7	11%	0.107	23%	0.234	C	C	.	.			trans	-69	154.3	168.7	-65.4	178.9	172	0	0	110.9	A137 N139 S161 V163 S195 H197	A137-E141 HydrophobicContact CB-CB 3.86Å; A137-E141 WeakPolarHBondContact CB-O 3.32Å; N139-E141 PolarHBondContact O-N 3.09Å; E141-S161 VanDerWaalsContact CD-OG 3.32Å; E141-S161 PolarHBondContact OE2-OG 3.39Å; E141-V163 HydrophobicContact CB-CB 4.49Å; E141-V163 HydrophobicContact CG-CB 3.98Å; E141-V163 HydrophobicContact CG-CG1 4.02Å; E141-S195 PolarHBondContact OE1-OG 3.29Å; E141-H197 IonicContact OE2-CE1 3.64Å; E141-H197 IonicContact OE2-NE2 3.64Å
142	H	93.9	Very high	90.9	Very high	101 Å²	101	40.6 Å²	40.6	47%	0.468	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128	172.5	-65.2	-59.3	0	0	0	110.9	D81 Q82 N144 S161 A162	D81-H142 PolarHBondContact O-ND1 3.27Å; Q82-H142 HydrophobicContact CB-CB 4.25Å; H142-N144 PolarHBondContact O-N 2.77Å; H142-S161 CarbonylContact O-C 3.54Å; H142-S161 VanDerWaalsContact O-CA 3.28Å; H142-S161 WeakPolarHBondContact O-CA 3.32Å; H142-A162 PolarHBondContact N-O 2.97Å; H142-A162 PolarHBondContact O-N 3Å
143	L	95.6	Very high	90.4	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	130.4	173	-70.7	169.5	0	0	0	110.9	F78 Q82 V136 A137 R145 V159	F78-L143 HydrophobicContact CD1-CB 3.74Å; F78-L143 HydrophobicContact CD1-CD1 3.87Å; F78-L143 HydrophobicContact CD1-CG 4.39Å; F78-L143 HydrophobicContact CE1-CB 3.99Å; F78-L143 HydrophobicContact CE1-CD1 4.26Å; Q82-L143 HydrophobicContact CB-CB 4.46Å; Q82-L143 VanDerWaalsContact O-CB 3.31Å; Q82-L143 WeakPolarHBondContact O-CB 3.16Å; Q82-L143 WeakPolarHBondContact O-CG 3.29Å; Q82-L143 PolarHBondContact O-N 2.59Å; Q82-L143 PolarHBondContact OE1-O 3.17Å; V136-L143 HydrophobicContact CB-CD1 4.22Å; V136-L143 HydrophobicContact CB-CD2 4.16Å; V136-L143 HydrophobicContact CG1-CD2 4Å; V136-L143 HydrophobicContact CG2-CD1 4.34Å; A137-L143 HydrophobicContact CB-CG 4.37Å; L143-R145 PolarHBondContact O-N 3.13Å; L143-V159 HydrophobicContact CD2-CB 4.32Å; L143-V159 HydrophobicContact CD2-CG2 3.83Å
144	N	94.9	Very high	90	Very high	37 Å²	37	39 Å²	39	20%	0.198	22%	0.22	C	C	.	.			trans	-76.1	112.2	172.4	-171.7	-53	0	0	0	109.7	H142 E146 C147 G160 L219 S220	H142-N144 PolarHBondContact O-N 2.77Å; N144-E146 PolarHBondContact O-N 3.28Å; N144-E146 PolarHBondContact OD1-N 2.84Å; N144-C147 HydrophobicContact CB-CB 3.88Å; N144-C147 WeakPolarHBondContact O-CB 3.35Å; N144-C147 PolarHBondContact O-N 2.89Å; N144-C147 PolarHBondContact OD1-N 2.77Å; N144-G160 PolarHBondContact N-O 3.15Å; N144-L219 HydrophobicContact CB-CB 3.98Å; N144-L219 HydrophobicContact CB-CD1 4.05Å; N144-S220 PolarHBondContact ND2-OG 3.25Å
145	R	92.7	Very high	89.8	Confident	51 Å²	51	43 Å²	43	19%	0.192	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.8	-175.8	-54.4	171.4	-162.9	-173.7	-2.9	114.5	F64 R66 F78 Q82 L143	F64-R145 HydrophobicContact CB-CG 4.41Å; F64-R145 HydrophobicContact CD2-CG 4.27Å; F64-R145 VanDerWaalsContact CD2-CZ 3.45Å; F64-R145 HydrophobicContact CG-CG 4.44Å; R66-R145 WeakPolarHBondContact CD-O 3.39Å; R66-R145 PolarHBondContact NE-O 2.93Å; F78-R145 HydrophobicContact CB-CG 4.46Å; F78-R145 HydrophobicContact CD2-CB 4.11Å; F78-R145 HydrophobicContact CD2-CG 4.47Å; F78-R145 HydrophobicContact CE2-CB 4.45Å; F78-R145 WeakPolarHBondContact CE2-O 3.47Å; Q82-R145 HydrophobicContact CG-CG 4.3Å; L143-R145 PolarHBondContact O-N 3.13Å
146	E	92.6	Very high	89.9	Confident	67 Å²	67	39 Å²	39	31%	0.313	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-2.7	-179	-60	-179.9	161.8	0	0	112.3	R66 N144 S220 H221 N222	R66-E146 PolarHBondContact NH2-O 3.05Å; N144-E146 PolarHBondContact O-N 3.28Å; N144-E146 PolarHBondContact OD1-N 2.84Å; E146-S220 WeakPolarHBondContact OE2-CB 2.91Å; E146-H221 VanDerWaalsContact CD-CE1 3.42Å; E146-H221 IonicContact OE1-CE1 3.84Å; E146-H221 PolarHBondContact OE1-CE1 3.37Å; E146-H221 IonicContact OE1-NE2 3.27Å; E146-H221 IonicContact OE2-CD2 3.6Å; E146-H221 IonicContact OE2-CE1 3.74Å; E146-H221 PolarHBondContact OE2-CE1 2.84Å; E146-H221 IonicContact OE2-CG 3.94Å; E146-H221 IonicContact OE2-ND1 2.74Å; E146-H221 IonicContact OE2-NE2 2.82Å; E146-H221 PolarHBondContact OE2-NE2 2.82Å; E146-N222 PolarHBondContact O-OD1 3.16Å
147	C	95.1	Very high	90.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.21	C	C	.	.			trans	-97.3	108.8	-179.4	-172.3	0	0	0	0	110.6	N144 G160 L219 N222 L225	N144-C147 HydrophobicContact CB-CB 3.88Å; N144-C147 WeakPolarHBondContact O-CB 3.35Å; N144-C147 PolarHBondContact O-N 2.89Å; N144-C147 PolarHBondContact OD1-N 2.77Å; C147-G160 PolarHBondContact SG-N 3.22Å; C147-L219 HydrophobicContact CB-CB 4.09Å; C147-N222 WeakPolarHBondContact CA-OD1 3.33Å; C147-L225 WeakPolarHBondContact SG-CD1 3.38Å
148	S	95	Very high	90.9	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.014	21%	0.208	C	C	.	.			trans	-158.5	122.8	176.6	59.6	0	0	0	0	110	R66 I158 N222	R66-S148 PolarHBondContact NE-OG 2.99Å; R66-S148 PolarHBondContact NH2-OG 3.38Å; S148-I158 WeakPolarHBondContact CA-O 3.21Å; S148-N222 PolarHBondContact N-OD1 3.38Å; S148-N222 PolarHBondContact O-ND2 3.37Å
149	L	95	Very high	92.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.5	175.4	-63.6	172.9	0	0	0	109.5	V157 I158 N222 L225 L227 L232 A456 Q457	L149-V157 CarbonylContact O-C 3.5Å; L149-V157 WeakPolarHBondContact O-CA 2.98Å; L149-I158 HydrophobicContact CB-CB 4.3Å; L149-I158 PolarHBondContact N-O 3.4Å; L149-I158 PolarHBondContact O-N 2.88Å; L149-N222 HydrophobicContact CD2-CB 4.04Å; L149-N222 VanDerWaalsContact CD2-ND2 3.31Å; L149-N222 WeakPolarHBondContact CD2-ND2 3.47Å; L149-L225 HydrophobicContact CD1-CB 3.78Å; L149-L225 HydrophobicContact CD1-CD1 4.34Å; L149-L227 HydrophobicContact CB-CB 4.42Å; L149-L227 HydrophobicContact CB-CD2 4.27Å; L149-L227 HydrophobicContact CD1-CB 4.07Å; L149-L232 HydrophobicContact CD1-CD1 4.12Å; L149-A456 HydrophobicContact CD2-CB 3.63Å; L149-Q457 HydrophobicContact CD2-CB 4.22Å; L149-Q457 HydrophobicContact CD2-CG 4.12Å
150	F	94.5	Very high	93.1	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	142.4	175.5	-65.1	-79.5	0	0	0	111.1	K67 F68 P70 I76 V157 L201 L227 L405 Q457	K67-F150 HydrophobicContact CB-CE2 4.41Å; K67-F150 HydrophobicContact CD-CE2 4.19Å; K67-F150 HydrophobicContact CG-CE2 4.39Å; F68-F150 WeakPolarHBondContact O-CE2 3.29Å; P70-F150 HydrophobicContact CG-CB 3.61Å; P70-F150 HydrophobicContact CG-CD2 4.33Å; P70-F150 HydrophobicContact CG-CG 4.01Å; I76-F150 HydrophobicContact CD1-CE1 4.44Å; I76-F150 HydrophobicContact CD1-CE2 4.43Å; I76-F150 HydrophobicContact CD1-CZ 3.74Å; I76-F150 HydrophobicContact CG1-CZ 3.98Å; I76-F150 HydrophobicContact CG2-CE1 4.46Å; I76-F150 HydrophobicContact CG2-CZ 4.45Å; F150-V157 HydrophobicContact CD1-CB 3.94Å; F150-V157 HydrophobicContact CD1-CG2 3.96Å; F150-V157 HydrophobicContact CE1-CB 3.94Å; F150-V157 HydrophobicContact CE1-CG2 3.79Å; F150-V157 HydrophobicContact CZ-CG2 4.27Å; F150-L201 HydrophobicContact CD1-CD1 3.93Å; F150-L201 HydrophobicContact CE1-CD1 3.88Å; F150-L227 WeakPolarHBondContact O-CD2 3.28Å; F150-L405 HydrophobicContact CB-CD1 4.32Å; F150-L405 WeakPolarHBondContact O-CD2 3.35Å; F150-Q457 PolarHBondContact O-NE2 2.86Å
151	T	92.6	Very high	93.8	Very high	9 Å²	9	25.3 Å²	25.3	6%	0.055	12%	0.119	C	C	.	.			trans	-70.8	155.4	168.1	43.4	0	0	0	0	111	D153 C154 Y156 L227 V247	T151-D153 VanDerWaalsContact CB-OD1 3.29Å; T151-D153 WeakPolarHBondContact CB-OD1 3.31Å; T151-D153 PolarHBondContact O-N 2.8Å; T151-D153 PolarHBondContact OG1-OD1 3.47Å; T151-C154 PolarHBondContact O-N 3.37Å; T151-Y156 PolarHBondContact N-O 3.2Å; T151-Y156 WeakPolarHBondContact OG1-CA 3.39Å; T151-Y156 PolarHBondContact OG1-N 3.43Å; T151-Y156 PolarHBondContact OG1-O 3.28Å; T151-L227 HydrophobicContact CG2-CD2 4.45Å; T151-V247 HydrophobicContact CG2-CG1 4.15Å
152	D	87.1	Confident	94	Very high	40 Å²	40	25 Å²	25	21%	0.214	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.6	-177	-84.1	-24.3	0	0	0	113.3	C154 R229 L405 H406	D152-C154 PolarHBondContact O-N 3.49Å; D152-R229 WeakPolarHBondContact OD2-CA 3.35Å; D152-L405 WeakPolarHBondContact OD1-CA 3.39Å; D152-L405 WeakPolarHBondContact OD1-CB 3.17Å; D152-L405 WeakPolarHBondContact OD1-CD2 3.42Å; D152-H406 PolarHBondContact OD1-N 3.24Å; D152-H406 VanDerWaalsContact OD1-N 3.1Å; D152-H406 IonicContact OD2-CD2 3.99Å; D152-H406 PolarHBondContact OD2-CD2 3.34Å
153	D	87.4	Confident	94	Very high	94 Å²	94	22.2 Å²	22.2	50%	0.503	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.8	177.3	68.5	-10.7	0	0	0	113.1	T151 R155	T151-D153 VanDerWaalsContact CB-OD1 3.29Å; T151-D153 WeakPolarHBondContact CB-OD1 3.31Å; T151-D153 PolarHBondContact O-N 2.8Å; T151-D153 PolarHBondContact OG1-OD1 3.47Å; D153-R155 PolarHBondContact O-N 3.49Å; D153-R155 VanDerWaalsContact O-N 3.13Å; D153-R155 WeakPolarHBondContact OD1-CB 3.41Å; D153-R155 PolarHBondContact OD1-N 2.95Å; D153-R155 WeakPolarHBondContact OD2-CB 3.42Å
154	C	89.5	Confident	93.6	Very high	11 Å²	11	27.2 Å²	27.2	7%	0.074	13%	0.13	C	C	.	.	S	Bend	trans	57.9	19	-177.2	-53.2	0	0	0	0	113.8	P70 D71 T151 D152	P70-C154 VanDerWaalsContact CB-SG 3.57Å; D71-C154 HydrophobicContact CB-CB 4.28Å; T151-C154 PolarHBondContact O-N 3.37Å; D152-C154 PolarHBondContact O-N 3.49Å
155	R	92.6	Very high	93.2	Very high	91 Å²	91	26.2 Å²	26.2	34%	0.343	13%	0.125	S	C	.	.	S	Bend	trans	-86.1	-40.7	-178.7	-177.5	171.4	179.5	-161.3	-1.9	112	D153 L201 P249	D153-R155 PolarHBondContact O-N 3.49Å; D153-R155 VanDerWaalsContact O-N 3.13Å; D153-R155 WeakPolarHBondContact OD1-CB 3.41Å; D153-R155 PolarHBondContact OD1-N 2.95Å; D153-R155 WeakPolarHBondContact OD2-CB 3.42Å; R155-L201 WeakPolarHBondContact O-CB 3.5Å; R155-L201 PolarHBondContact O-N 3.42Å; R155-P249 PolarHBondContact NH1-O 2.99Å; R155-P249 VanDerWaalsContact NH1-O 3.08Å
156	Y	96	Very high	92.7	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.016	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.8	-174.8	-56.9	-81.1	0	0	0	112.6	T151 I198 I199 D200 P249 D250 G251	T151-Y156 PolarHBondContact N-O 3.2Å; T151-Y156 WeakPolarHBondContact OG1-CA 3.39Å; T151-Y156 PolarHBondContact OG1-N 3.43Å; T151-Y156 PolarHBondContact OG1-O 3.28Å; Y156-I198 HydrophobicContact CD1-CD1 4.34Å; Y156-I198 HydrophobicContact CD1-CG1 4.07Å; Y156-I198 HydrophobicContact CG-CD1 4.12Å; Y156-I198 HydrophobicContact CG-CG1 4.19Å; Y156-I199 VanDerWaalsContact CA-O 3.29Å; Y156-I199 WeakPolarHBondContact CA-O 3.38Å; Y156-D200 HydrophobicContact CD1-CB 3.98Å; Y156-D200 HydrophobicContact CE1-CB 3.8Å; Y156-P249 WeakPolarHBondContact CE2-O 3.25Å; Y156-P249 PolarHBondContact OH-O 2.83Å; Y156-P249 VanDerWaalsContact OH-O 3.11Å; Y156-D250 WeakPolarHBondContact OH-CA 3.19Å; Y156-D250 PolarHBondContact OH-O 3.44Å; Y156-G251 PolarHBondContact OH-N 2.9Å
157	V	96.9	Very high	91.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.3	167.9	64.8	0	0	0	0	110.1	I76 L85 L149 F150 V159 I198 I199 L201	I76-V157 HydrophobicContact CD1-CG2 4.25Å; L85-V157 HydrophobicContact CD2-CG1 3.69Å; L149-V157 CarbonylContact O-C 3.5Å; L149-V157 WeakPolarHBondContact O-CA 2.98Å; F150-V157 HydrophobicContact CD1-CB 3.94Å; F150-V157 HydrophobicContact CD1-CG2 3.96Å; F150-V157 HydrophobicContact CE1-CB 3.94Å; F150-V157 HydrophobicContact CE1-CG2 3.79Å; F150-V157 HydrophobicContact CZ-CG2 4.27Å; V157-V159 HydrophobicContact CG2-CG1 4.21Å; V157-I198 WeakPolarHBondContact O-CA 3.24Å; V157-I199 HydrophobicContact CG1-CB 4.01Å; V157-I199 PolarHBondContact N-O 3.04Å; V157-I199 PolarHBondContact O-N 3.41Å; V157-L201 HydrophobicContact CB-CD1 4.5Å; V157-L201 HydrophobicContact CB-CD2 4.15Å; V157-L201 HydrophobicContact CB-CG 4.38Å; V157-L201 HydrophobicContact CG1-CD2 3.66Å; V157-L201 HydrophobicContact CG1-CG 4.19Å
158	I	97.4	Very high	91	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.9	173.4	-58.6	162.9	0	0	0	108.3	S148 L149 H197 I198 L227 L232 V247 F253	S148-I158 WeakPolarHBondContact CA-O 3.21Å; L149-I158 HydrophobicContact CB-CB 4.3Å; L149-I158 PolarHBondContact N-O 3.4Å; L149-I158 PolarHBondContact O-N 2.88Å; I158-H197 CarbonylContact C-O 3.54Å; I158-H197 VanDerWaalsContact CA-O 3.25Å; I158-H197 WeakPolarHBondContact CA-O 3.39Å; I158-I198 HydrophobicContact CG1-CB 4.28Å; I158-I198 HydrophobicContact CG1-CD1 4.29Å; I158-I198 HydrophobicContact CG1-CG1 4.27Å; I158-L227 HydrophobicContact CD1-CD1 4.45Å; I158-L227 HydrophobicContact CD1-CD2 4.25Å; I158-L232 HydrophobicContact CD1-CD2 4.29Å; I158-V247 HydrophobicContact CD1-CG2 4.07Å; I158-F253 HydrophobicContact CD1-CE1 4Å; I158-F253 HydrophobicContact CD1-CZ 4.46Å; I158-F253 HydrophobicContact CG1-CE1 4.21Å; I158-F253 HydrophobicContact CG1-CZ 4.19Å; I158-F253 HydrophobicContact CG2-CZ 4.09Å
159	V	97.3	Very high	90.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.8	176.7	-62.6	0	0	0	0	109.7	F78 L85 L143 V157 H197 I199	F78-V159 HydrophobicContact CE1-CB 4.48Å; F78-V159 HydrophobicContact CE1-CG1 4.19Å; F78-V159 HydrophobicContact CZ-CG1 4.28Å; L85-V159 HydrophobicContact CD1-CG1 4.31Å; L85-V159 HydrophobicContact CD2-CG1 4.41Å; L143-V159 HydrophobicContact CD2-CB 4.32Å; L143-V159 HydrophobicContact CD2-CG2 3.83Å; V157-V159 HydrophobicContact CG2-CG1 4.21Å; V159-H197 HydrophobicContact CG2-CB 4Å; V159-H197 PolarHBondContact N-O 3.24Å; V159-H197 PolarHBondContact O-N 3.2Å; V159-I199 HydrophobicContact CG2-CD1 3.74Å
160	G	96.7	Very high	89.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.4	177.6	0	0	0	0	0	111.5	N144 C147 S195	N144-G160 PolarHBondContact N-O 3.15Å; C147-G160 PolarHBondContact SG-N 3.22Å; G160-S195 CarbonylContact C-O 3.56Å; G160-S195 WeakPolarHBondContact CA-O 3.46Å
161	S	95.9	Very high	89.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	161.1	168	73.7	0	0	0	0	110.3	E141 H142 Y194 S195 H197	E141-S161 VanDerWaalsContact CD-OG 3.32Å; E141-S161 PolarHBondContact OE2-OG 3.39Å; H142-S161 CarbonylContact O-C 3.54Å; H142-S161 VanDerWaalsContact O-CA 3.28Å; H142-S161 WeakPolarHBondContact O-CA 3.32Å; S161-Y194 WeakPolarHBondContact O-CA 3.4Å; S161-S195 PolarHBondContact N-O 2.5Å; S161-S195 PolarHBondContact O-N 3.1Å; S161-S195 VanDerWaalsContact O-N 3.09Å; S161-S195 WeakPolarHBondContact OG-CB 3.35Å; S161-H197 PolarHBondContact OG-NE2 2.85Å
162	A	94.8	Very high	88.6	Confident	16 Å²	16	56.3 Å²	56.3	13%	0.132	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	148	172.5	0	0	0	0	0	110.4	H142 E192 D193 Y194	H142-A162 PolarHBondContact N-O 2.97Å; H142-A162 PolarHBondContact O-N 3Å; A162-E192 HydrophobicContact CB-CB 4.31Å; A162-D193 CarbonylContact C-O 3.52Å; A162-D193 WeakPolarHBondContact CA-O 3.45Å; A162-Y194 HydrophobicContact CB-CD1 3.66Å; A162-Y194 HydrophobicContact CB-CE1 3.64Å
163	V	93.6	Very high	88.5	Confident	42 Å²	42	59.2 Å²	59.2	26%	0.255	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.3	169.5	62	0	0	0	0	109.2	E141 V165 E192 D193	E141-V163 HydrophobicContact CB-CB 4.49Å; E141-V163 HydrophobicContact CG-CB 3.98Å; E141-V163 HydrophobicContact CG-CG1 4.02Å; V163-V165 PolarHBondContact O-N 3.05Å; V163-E192 CarbonylContact O-C 3.51Å; V163-E192 WeakPolarHBondContact O-CA 3.23Å; V163-E192 WeakPolarHBondContact O-CB 3.48Å; V163-D193 HydrophobicContact CG1-CB 3.68Å; V163-D193 PolarHBondContact N-O 2.6Å; V163-D193 PolarHBondContact O-N 3.33Å
164	Y	88.4	Confident	88.3	Confident	106 Å²	106	58.4 Å²	58.4	42%	0.416	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	131	178.1	-175	-82.6	0	0	0	109.7	P166 D167 P190	Y164-P166 WeakPolarHBondContact O-CD 3.49Å; Y164-D167 PolarHBondContact OH-OD1 2.85Å; Y164-D167 PolarHBondContact OH-OD2 3.14Å; Y164-P190 HydrophobicContact CD2-CB 3.73Å; Y164-P190 HydrophobicContact CD2-CG 3.66Å; Y164-P190 HydrophobicContact CE2-CB 3.06Å; Y164-P190 HydrophobicContact CE2-CG 3.29Å
165	V	85.7	Confident	87.9	Confident	16 Å²	16	60.8 Å²	60.8	10%	0.097	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-76.8	116.9	173.7	178.9	0	0	0	0	108.2	V163 P171 L191 D193	V163-V165 PolarHBondContact O-N 3.05Å; V165-P171 HydrophobicContact CG1-CB 4.06Å; V165-P171 HydrophobicContact CG1-CG 4.22Å; V165-L191 PolarHBondContact N-O 3.41Å; V165-D193 WeakPolarHBondContact CG2-OD1 3.46Å
166	P	82.3	Confident	87.6	Confident	81 Å²	81	56.9 Å²	56.9	53%	0.526	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-54	144.6	-178.9	-23.6	33	0	0	0	112.4	Y164 D168	Y164-P166 WeakPolarHBondContact O-CD 3.49Å; P166-D168 VanDerWaalsContact C-N 3.27Å; P166-D168 PolarHBondContact O-N 3.12Å
167	D	74.6	Confident	87.2	Confident	121 Å²	121	58.6 Å²	58.6	65%	0.647	30%	0.304	S	S	*	.	S	Bend	trans	-75.3	-20	176.5	-64.3	-22.3	0	0	0	112.2	Y164 P170	Y164-D167 PolarHBondContact OH-OD1 2.85Å; Y164-D167 PolarHBondContact OH-OD2 3.14Å; D167-P170 WeakPolarHBondContact O-CA 3.35Å
168	D	78.6	Confident	86.7	Confident	140 Å²	140	63.2 Å²	63.2	75%	0.749	32%	0.321	S	S	*	.	S	Bend	trans	-135.2	117.3	179.7	-167.9	11.3	0	0	0	111	P166	P166-D168 VanDerWaalsContact C-N 3.27Å; P166-D168 PolarHBondContact O-N 3.12Å
169	P	81.5	Confident	86.1	Confident	106 Å²	106	63.4 Å²	63.4	69%	0.688	32%	0.322	S	S	*	.	S	Bend	cis	-67.2	144.4	-4.9	29.5	-34.4	0	0	0	111.5
170	P	78.3	Confident	85.7	Confident	94 Å²	94	65 Å²	65	61%	0.61	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-62.3	145.5	178	26.2	-34.2	0	0	0	110.1	D167	D167-P170 WeakPolarHBondContact O-CA 3.35Å
171	P	83.5	Confident	85.4	Confident	46 Å²	46	65.8 Å²	65.8	30%	0.299	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-59.8	146.6	179.3	25.3	-34.2	0	0	0	110.7	V165 F173 V176 C214	V165-P171 HydrophobicContact CG1-CB 4.06Å; V165-P171 HydrophobicContact CG1-CG 4.22Å; P171-F173 PolarHBondContact O-N 3.12Å; P171-V176 HydrophobicContact CB-CG2 3.83Å; P171-V176 HydrophobicContact CG-CG2 3.73Å; P171-C214 VanDerWaalsContact CB-SG 3.57Å
172	Y	83.7	Confident	85.2	Confident	175 Å²	175	66 Å²	66	69%	0.686	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-62	137.5	-179.1	-67.7	-71.9	0	0	0	110.3	F174 E175 V176	Y172-F174 PolarHBondContact O-N 3.32Å; Y172-F174 VanDerWaalsContact O-N 3.13Å; Y172-E175 WeakPolarHBondContact O-CB 3.37Å; Y172-E175 PolarHBondContact O-N 2.89Å; Y172-V176 PolarHBondContact O-N 2.95Å
173	F	84.4	Confident	85.1	Confident	101 Å²	101	65.4 Å²	65.4	44%	0.443	33%	0.331	S	S	.	.	H	α-helix	trans	-51.3	-44.2	-175.7	-178.7	-90.2	0	0	0	112.8	P171 E175 V176 Y177 Y290	P171-F173 PolarHBondContact O-N 3.12Å; F173-E175 VanDerWaalsContact C-N 3.3Å; F173-E175 PolarHBondContact O-N 3.24Å; F173-V176 PolarHBondContact O-N 3.39Å; F173-Y177 HydrophobicContact CD1-CD2 4.35Å; F173-Y177 AromaticContact CD2-CD2 3.7Å; F173-Y177 HydrophobicContact CD2-CD2 3.7Å; F173-Y177 AromaticContact CD2-CE2 3.96Å; F173-Y177 HydrophobicContact CD2-CE2 3.96Å; F173-Y177 HydrophobicContact CE1-CD2 4.14Å; F173-Y177 HydrophobicContact CE1-CG 4.42Å; F173-Y177 AromaticContact CE2-CD2 3.46Å; F173-Y177 HydrophobicContact CE2-CD2 3.46Å; F173-Y177 VanDerWaalsContact CE2-CD2 3.46Å; F173-Y177 AromaticContact CE2-CE2 3.66Å; F173-Y177 HydrophobicContact CE2-CE2 3.66Å; F173-Y177 HydrophobicContact CE2-CG 4.31Å; F173-Y177 HydrophobicContact CG-CD2 4.13Å; F173-Y177 AromaticContact CZ-CD2 3.7Å; F173-Y177 HydrophobicContact CZ-CD2 3.7Å; F173-Y177 HydrophobicContact CZ-CE2 4.26Å; F173-Y177 HydrophobicContact CZ-CG 4.11Å; F173-Y177 WeakPolarHBondContact O-CB 3.32Å; F173-Y177 WeakPolarHBondContact O-CD2 3.31Å; F173-Y177 PolarHBondContact O-N 3.05Å; F173-Y290 AromaticContact CE1-CD1 3.9Å; F173-Y290 HydrophobicContact CE1-CD1 3.9Å; F173-Y290 HydrophobicContact CE1-CG 4.12Å; F173-Y290 AromaticContact CZ-CD1 3.7Å; F173-Y290 HydrophobicContact CZ-CD1 3.7Å; F173-Y290 HydrophobicContact CZ-CE1 4.01Å; F173-Y290 HydrophobicContact CZ-CG 4.18Å
174	F	82.8	Confident	84.9	Confident	76 Å²	76	66.2 Å²	66.2	33%	0.333	34%	0.336	S	S	.	.	H	α-helix	trans	-79.2	-8.2	-178.9	-62.4	-68.7	0	0	0	114.2	Y172 R288	Y172-F174 PolarHBondContact O-N 3.32Å; Y172-F174 VanDerWaalsContact O-N 3.13Å; F174-R288 HydrophobicContact CZ-CG 4.44Å
175	E	81.8	Confident	84.7	Confident	62 Å²	62	62.9 Å²	62.9	29%	0.29	33%	0.327	S	S	.	.	H	α-helix	trans	-80.4	-36.1	168.1	-69	-177	148.5	0	0	111.3	Y172 F173 R178 C214	Y172-E175 WeakPolarHBondContact O-CB 3.37Å; Y172-E175 PolarHBondContact O-N 2.89Å; F173-E175 VanDerWaalsContact C-N 3.3Å; F173-E175 PolarHBondContact O-N 3.24Å; E175-R178 PolarHBondContact O-NE 3.15Å; E175-C214 HydrophobicContact CB-CB 4.45Å
176	V	85.8	Confident	84.7	Confident	9 Å²	9	62.9 Å²	62.9	6%	0.055	33%	0.327	C	S	.	.	H	α-helix	trans	-79.1	-41.9	177.9	178.2	0	0	0	0	112.1	P171 Y172 F173 P185 L191 C214 Q238	P171-V176 HydrophobicContact CB-CG2 3.83Å; P171-V176 HydrophobicContact CG-CG2 3.73Å; Y172-V176 PolarHBondContact O-N 2.95Å; F173-V176 PolarHBondContact O-N 3.39Å; V176-P185 HydrophobicContact CG1-CG 3.83Å; V176-L191 HydrophobicContact CB-CD1 4.39Å; V176-L191 HydrophobicContact CG1-CD1 3.67Å; V176-L191 HydrophobicContact CG2-CD1 3.97Å; V176-C214 HydrophobicContact CG2-CB 4.11Å; V176-Q238 PolarHBondContact O-NE2 3.16Å
177	Y	88.1	Confident	84.6	Confident	40 Å²	40	64.8 Å²	64.8	16%	0.157	34%	0.339	C	S	.	.			trans	-111.1	82.9	-174.6	-63.2	-77.3	0	0	0	110.8	F173 P185 Y290	F173-Y177 HydrophobicContact CD1-CD2 4.35Å; F173-Y177 AromaticContact CD2-CD2 3.7Å; F173-Y177 HydrophobicContact CD2-CD2 3.7Å; F173-Y177 AromaticContact CD2-CE2 3.96Å; F173-Y177 HydrophobicContact CD2-CE2 3.96Å; F173-Y177 HydrophobicContact CE1-CD2 4.14Å; F173-Y177 HydrophobicContact CE1-CG 4.42Å; F173-Y177 AromaticContact CE2-CD2 3.46Å; F173-Y177 HydrophobicContact CE2-CD2 3.46Å; F173-Y177 VanDerWaalsContact CE2-CD2 3.46Å; F173-Y177 AromaticContact CE2-CE2 3.66Å; F173-Y177 HydrophobicContact CE2-CE2 3.66Å; F173-Y177 HydrophobicContact CE2-CG 4.31Å; F173-Y177 HydrophobicContact CG-CD2 4.13Å; F173-Y177 AromaticContact CZ-CD2 3.7Å; F173-Y177 HydrophobicContact CZ-CD2 3.7Å; F173-Y177 HydrophobicContact CZ-CE2 4.26Å; F173-Y177 HydrophobicContact CZ-CG 4.11Å; F173-Y177 WeakPolarHBondContact O-CB 3.32Å; F173-Y177 WeakPolarHBondContact O-CD2 3.31Å; F173-Y177 PolarHBondContact O-N 3.05Å; Y177-P185 WeakPolarHBondContact OH-CD 3.39Å; Y177-Y290 AromaticContact CD1-CD2 3.89Å; Y177-Y290 HydrophobicContact CD1-CD2 3.89Å; Y177-Y290 AromaticContact CD1-CE2 3.64Å; Y177-Y290 HydrophobicContact CD1-CE2 3.64Å; Y177-Y290 HydrophobicContact CE1-CE2 4.34Å; Y177-Y290 HydrophobicContact CG-CD2 4.02Å; Y177-Y290 HydrophobicContact CG-CE2 4.17Å; Y177-Y290 HydrophobicContact CG-CG 4.49Å
178	R	84.7	Confident	84.9	Confident	97 Å²	97	69.6 Å²	69.6	37%	0.366	35%	0.348	S	S	.	.			trans	-88.6	-1.1	-176	-64.6	-159.4	-178.7	-170.9	-8.4	115.1	E175 S182 Q239 L289	E175-R178 PolarHBondContact O-NE 3.15Å; R178-S182 PolarHBondContact N-OG 3.15Å; R178-Q239 HydrophobicContact CB-CB 4.44Å; R178-Q239 HydrophobicContact CB-CG 4.39Å; R178-Q239 HydrophobicContact CG-CG 4.34Å; R178-L289 HydrophobicContact CB-CD1 4.42Å; R178-L289 WeakPolarHBondContact O-CB 3.27Å; R178-L289 WeakPolarHBondContact O-CD1 3.33Å
179	N	86.7	Confident	85	Confident	4 Å²	4	64 Å²	64	2%	0.021	32%	0.319	C	S	.	.	S	Bend	trans	-167.1	165.8	169.8	57.1	67.6	0	0	0	109.6	E181 S182 Q239 R261 L289 Y290	N179-E181 PolarHBondContact O-N 3.36Å; N179-E181 VanDerWaalsContact O-N 3.11Å; N179-E181 WeakPolarHBondContact OD1-CA 3.33Å; N179-E181 WeakPolarHBondContact OD1-CB 3.45Å; N179-E181 PolarHBondContact OD1-N 3.46Å; N179-S182 PolarHBondContact N-OG 3.49Å; N179-S182 VanDerWaalsContact N-OG 3.17Å; N179-S182 VanDerWaalsContact O-CB 3.24Å; N179-S182 WeakPolarHBondContact O-CB 3.45Å; N179-S182 PolarHBondContact O-N 3.01Å; N179-S182 PolarHBondContact O-OG 3.03Å; N179-S182 PolarHBondContact OD1-N 2.98Å; N179-S182 PolarHBondContact OD1-OG 2.91Å; N179-Q239 PolarHBondContact ND2-O 3.05Å; N179-R261 HydrophobicContact CB-CB 4.43Å; N179-L289 WeakPolarHBondContact CA-O 3.38Å; N179-Y290 WeakPolarHBondContact O-CD2 3.49Å
180	N	87.9	Confident	85.2	Confident	33 Å²	33	60.6 Å²	60.6	18%	0.176	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-5.7	-179.5	69.4	-4.7	0	0	0	115.7	L289 Y290 D292 T294 N296	N180-L289 PolarHBondContact N-O 3.08Å; N180-Y290 WeakPolarHBondContact CB-O 3.46Å; N180-D292 HydrophobicContact CB-CB 4.31Å; N180-D292 PolarHBondContact ND2-O 3.06Å; N180-T294 PolarHBondContact ND2-O 3.13Å; N180-N296 PolarHBondContact OD1-ND2 3.03Å; N180-N296 PolarHBondContact OD1-OD1 2.74Å
181	E	90.9	Very high	85.8	Confident	16 Å²	16	57 Å²	57	8%	0.075	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-7.3	172	-70.9	-166.6	-165.1	0	0	113.1	N179 V183 Q240 N296 K299 R333	N179-E181 PolarHBondContact O-N 3.36Å; N179-E181 VanDerWaalsContact O-N 3.11Å; N179-E181 WeakPolarHBondContact OD1-CA 3.33Å; N179-E181 WeakPolarHBondContact OD1-CB 3.45Å; N179-E181 PolarHBondContact OD1-N 3.46Å; E181-V183 PolarHBondContact O-N 3.44Å; E181-Q240 HydrophobicContact CB-CB 4.14Å; E181-Q240 HydrophobicContact CB-CG 4.3Å; E181-Q240 WeakPolarHBondContact O-CG 3.15Å; E181-N296 HydrophobicContact CG-CB 4.4Å; E181-N296 WeakPolarHBondContact CG-ND2 3.25Å; E181-N296 WeakPolarHBondContact OE1-CB 3.15Å; E181-K299 WeakPolarHBondContact OE1-CB 3.35Å; E181-K299 VanDerWaalsContact OE1-CG 3.24Å; E181-K299 WeakPolarHBondContact OE1-CG 3.31Å; E181-K299 WeakPolarHBondContact OE2-CE 3.44Å; E181-K299 IonicContact OE2-NZ 3.79Å; E181-R333 WeakPolarHBondContact O-CD 3.48Å; E181-R333 PolarHBondContact O-NE 3.43Å
182	S	92.1	Very high	86.2	Confident	5 Å²	5	57.1 Å²	57.1	4%	0.035	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-50.9	136.6	176.8	-58.4	0	0	0	0	110.3	R178 N179 Q238	R178-S182 PolarHBondContact N-OG 3.15Å; N179-S182 PolarHBondContact N-OG 3.49Å; N179-S182 VanDerWaalsContact N-OG 3.17Å; N179-S182 VanDerWaalsContact O-CB 3.24Å; N179-S182 WeakPolarHBondContact O-CB 3.45Å; N179-S182 PolarHBondContact O-N 3.01Å; N179-S182 PolarHBondContact O-OG 3.03Å; N179-S182 PolarHBondContact OD1-N 2.98Å; N179-S182 PolarHBondContact OD1-OG 2.91Å; S182-Q238 CarbonylContact C-O 3.57Å; S182-Q238 VanDerWaalsContact CA-O 3.23Å; S182-Q238 WeakPolarHBondContact CA-O 3.46Å
183	V	91.9	Very high	86.7	Confident	4 Å²	4	51 Å²	51	2%	0.024	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-83.6	157.3	-174.7	-61.2	0	0	0	0	111.3	E181 P185 Q238 Q240 R333 E352 V355 T356	E181-V183 PolarHBondContact O-N 3.44Å; V183-P185 WeakPolarHBondContact O-CD 3.43Å; V183-Q238 PolarHBondContact N-O 2.69Å; V183-Q238 PolarHBondContact O-NE2 2.81Å; V183-Q238 PolarHBondContact O-OE1 3.35Å; V183-Q240 HydrophobicContact CG1-CG 4.19Å; V183-R333 HydrophobicContact CG1-CB 4.26Å; V183-R333 HydrophobicContact CG1-CG 3.78Å; V183-E352 HydrophobicContact CB-CG 4.25Å; V183-E352 HydrophobicContact CG1-CG 4.17Å; V183-V355 HydrophobicContact CG1-CG1 4.24Å; V183-T356 HydrophobicContact CB-CG2 3.88Å; V183-T356 HydrophobicContact CG2-CG2 4Å
184	T	88.6	Confident	87.2	Confident	59 Å²	59	46.4 Å²	46.4	36%	0.362	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-74.8	120.2	175.3	-46.1	0	0	0	0	109.4	N186 E352 T356 R358	T184-N186 PolarHBondContact O-N 2.89Å; T184-E352 WeakPolarHBondContact CB-OE1 3.48Å; T184-E352 PolarHBondContact N-OE1 3.26Å; T184-E352 PolarHBondContact OG1-OE1 2.94Å; T184-T356 VanDerWaalsContact O-CG2 3.27Å; T184-T356 WeakPolarHBondContact O-CG2 3.5Å; T184-R358 VanDerWaalsContact CG2-NH2 3.28Å; T184-R358 PolarHBondContact O-NH2 3.38Å
185	P	85.9	Confident	87.8	Confident	36 Å²	36	43 Å²	43	23%	0.234	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-54.8	141.8	178.2	-25.8	35.6	0	0	0	111.3	V176 Y177 V183 L191	V176-P185 HydrophobicContact CG1-CG 3.83Å; Y177-P185 WeakPolarHBondContact OH-CD 3.39Å; V183-P185 WeakPolarHBondContact O-CD 3.43Å; P185-L191 HydrophobicContact CB-CD1 4.3Å; P185-L191 HydrophobicContact CB-CD2 4.43Å; P185-L191 HydrophobicContact CB-CG 4.27Å; P185-L191 HydrophobicContact CG-CD1 3.92Å; P185-L191 HydrophobicContact CG-CG 4.39Å
186	N	84.6	Confident	88.6	Confident	15 Å²	15	40.1 Å²	40.1	8%	0.08	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-96	122.7	174.7	179.7	-2.1	0	0	0	108.6	T184 R188 S189 T356 R358	T184-N186 PolarHBondContact O-N 2.89Å; N186-R188 PolarHBondContact O-N 3.31Å; N186-R188 WeakPolarHBondContact OD1-CB 3.24Å; N186-R188 PolarHBondContact OD1-N 2.92Å; N186-S189 CarbonylContact O-C 3.1Å; N186-S189 WeakPolarHBondContact O-CA 3.37Å; N186-S189 PolarHBondContact O-N 2.95Å; N186-T356 VanDerWaalsContact CB-O 3.22Å; N186-T356 WeakPolarHBondContact CB-O 3.28Å; N186-T356 PolarHBondContact ND2-O 3.09Å; N186-R358 HydrophobicContact CB-CG 4.47Å
187	P	79.4	Confident	89.1	Confident	121 Å²	121	39.9 Å²	39.9	79%	0.786	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-25.7	176.8	-26	34.4	0	0	0	114.1	S189	P187-S189 VanDerWaalsContact C-N 3.29Å
188	R	81.3	Confident	89.6	Confident	223 Å²	223	38 Å²	38	84%	0.842	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.1	175.7	-62.2	-177.1	178.8	170.5	0.3	113.7	N186	N186-R188 PolarHBondContact O-N 3.31Å; N186-R188 WeakPolarHBondContact OD1-CB 3.24Å; N186-R188 PolarHBondContact OD1-N 2.92Å
189	S	81.3	Confident	90.2	Very high	21 Å²	21	33.3 Å²	33.3	15%	0.147	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-136.2	81.6	-178.2	169.4	0	0	0	0	108.1	N186 P187 K216	N186-S189 CarbonylContact O-C 3.1Å; N186-S189 WeakPolarHBondContact O-CA 3.37Å; N186-S189 PolarHBondContact O-N 2.95Å; P187-S189 VanDerWaalsContact C-N 3.29Å; S189-K216 WeakPolarHBondContact OG-CE 3.45Å; S189-K216 PolarHBondContact OG-NZ 3.49Å; S189-K216 VanDerWaalsContact OG-NZ 3.17Å
190	P	85.4	Confident	90.7	Very high	36 Å²	36	33.6 Å²	33.6	23%	0.234	18%	0.175	C	C	.	.			trans	-59	160.1	-176.1	31.1	-42.5	0	0	0	112.4	Y164 K216	Y164-P190 HydrophobicContact CD2-CB 3.73Å; Y164-P190 HydrophobicContact CD2-CG 3.66Å; Y164-P190 HydrophobicContact CE2-CB 3.06Å; Y164-P190 HydrophobicContact CE2-CG 3.29Å; P190-K216 PolarHBondContact O-NZ 3.3Å
191	L	90.6	Very high	91.1	Very high	18 Å²	18	32 Å²	32	9%	0.094	17%	0.167	C	C	.	.			trans	-78.6	147.2	169.2	-58.8	179.2	0	0	0	109.5	V165 V176 P185 K216 Q238	V165-L191 PolarHBondContact N-O 3.41Å; V176-L191 HydrophobicContact CB-CD1 4.39Å; V176-L191 HydrophobicContact CG1-CD1 3.67Å; V176-L191 HydrophobicContact CG2-CD1 3.97Å; P185-L191 HydrophobicContact CB-CD1 4.3Å; P185-L191 HydrophobicContact CB-CD2 4.43Å; P185-L191 HydrophobicContact CB-CG 4.27Å; P185-L191 HydrophobicContact CG-CD1 3.92Å; P185-L191 HydrophobicContact CG-CG 4.39Å; L191-K216 HydrophobicContact CD2-CB 4.45Å; L191-Q238 HydrophobicContact CD1-CG 4.46Å; L191-Q238 HydrophobicContact CD2-CB 4.14Å; L191-Q238 HydrophobicContact CD2-CG 3.84Å
192	E	92.6	Very high	91.2	Very high	49 Å²	49	35.2 Å²	35.2	23%	0.229	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.5	-178.5	-64.8	169.7	155.4	0	0	108	A162 V163 Y194 D215	A162-E192 HydrophobicContact CB-CB 4.31Å; V163-E192 CarbonylContact O-C 3.51Å; V163-E192 WeakPolarHBondContact O-CA 3.23Å; V163-E192 WeakPolarHBondContact O-CB 3.48Å; E192-Y194 HydrophobicContact CB-CD2 4.32Å; E192-Y194 HydrophobicContact CB-CE1 4.18Å; E192-Y194 HydrophobicContact CB-CE2 3.74Å; E192-Y194 WeakPolarHBondContact O-CD2 3.48Å; E192-Y194 WeakPolarHBondContact OE2-CE1 3.49Å; E192-Y194 PolarHBondContact OE2-OH 3.15Å; E192-D215 PolarHBondContact N-O 3.24Å; E192-D215 VanDerWaalsContact N-O 3.13Å; E192-D215 PolarHBondContact O-N 3.26Å; E192-D215 VanDerWaalsContact O-N 3.11Å
193	D	93.6	Very high	91.4	Very high	45 Å²	45	38.1 Å²	38.1	24%	0.241	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	123.7	162.5	-67.4	-16.1	0	0	0	106.9	A162 V163 V165 F212 K213 C214	A162-D193 CarbonylContact C-O 3.52Å; A162-D193 WeakPolarHBondContact CA-O 3.45Å; V163-D193 HydrophobicContact CG1-CB 3.68Å; V163-D193 PolarHBondContact N-O 2.6Å; V163-D193 PolarHBondContact O-N 3.33Å; V165-D193 WeakPolarHBondContact CG2-OD1 3.46Å; D193-F212 CarbonylContact C-O 3.41Å; D193-F212 VanDerWaalsContact CA-O 3.31Å; D193-F212 WeakPolarHBondContact CA-O 3.07Å; D193-K213 WeakPolarHBondContact OD1-CA 3.34Å; D193-C214 PolarHBondContact OD1-N 3.21Å
194	Y	95.3	Very high	91.6	Very high	6 Å²	6	38.6 Å²	38.6	2%	0.024	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.9	-178.4	-66.1	-82.3	0	0	0	109.9	S161 A162 E192 S211 F212 D215 I217 L219	S161-Y194 WeakPolarHBondContact O-CA 3.4Å; A162-Y194 HydrophobicContact CB-CD1 3.66Å; A162-Y194 HydrophobicContact CB-CE1 3.64Å; E192-Y194 HydrophobicContact CB-CD2 4.32Å; E192-Y194 HydrophobicContact CB-CE1 4.18Å; E192-Y194 HydrophobicContact CB-CE2 3.74Å; E192-Y194 WeakPolarHBondContact O-CD2 3.48Å; E192-Y194 WeakPolarHBondContact OE2-CE1 3.49Å; E192-Y194 PolarHBondContact OE2-OH 3.15Å; Y194-S211 CarbonylContact O-C 3.56Å; Y194-S211 VanDerWaalsContact O-CA 3.31Å; Y194-S211 WeakPolarHBondContact O-CA 3.39Å; Y194-F212 PolarHBondContact N-O 2.81Å; Y194-F212 PolarHBondContact O-N 3.1Å; Y194-D215 HydrophobicContact CD2-CB 4.25Å; Y194-D215 WeakPolarHBondContact CE2-O 3.31Å; Y194-I217 HydrophobicContact CD1-CB 4.33Å; Y194-I217 HydrophobicContact CD2-CB 3.91Å; Y194-I217 HydrophobicContact CD2-CD1 4.16Å; Y194-I217 HydrophobicContact CD2-CG1 4.03Å; Y194-I217 HydrophobicContact CE1-CB 4.48Å; Y194-I217 VanDerWaalsContact CE1-O 3.27Å; Y194-I217 WeakPolarHBondContact CE1-O 3.21Å; Y194-I217 HydrophobicContact CE2-CB 4.06Å; Y194-I217 HydrophobicContact CE2-CG1 4.42Å; Y194-I217 HydrophobicContact CG-CB 4.03Å; Y194-I217 HydrophobicContact CG-CD1 4.27Å; Y194-I217 HydrophobicContact CG-CG1 4.42Å; Y194-I217 VanDerWaalsContact CZ-O 3.26Å; Y194-I217 PolarHBondContact OH-O 3.32Å; Y194-L219 HydrophobicContact CD1-CD1 3.6Å; Y194-L219 HydrophobicContact CD1-CG 3.91Å; Y194-L219 HydrophobicContact CE1-CD1 4.04Å; Y194-L219 HydrophobicContact CE1-CG 4.1Å
195	S	96	Very high	91.9	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.8	169.7	-62.9	0	0	0	0	109.7	E141 G160 S161 H197 R210 S211	E141-S195 PolarHBondContact OE1-OG 3.29Å; G160-S195 CarbonylContact C-O 3.56Å; G160-S195 WeakPolarHBondContact CA-O 3.46Å; S161-S195 PolarHBondContact N-O 2.5Å; S161-S195 PolarHBondContact O-N 3.1Å; S161-S195 VanDerWaalsContact O-N 3.09Å; S161-S195 WeakPolarHBondContact OG-CB 3.35Å; S195-H197 WeakPolarHBondContact CB-NE2 3.21Å; S195-R210 CarbonylContact C-O 3.5Å; S195-R210 WeakPolarHBondContact CA-O 3.44Å; S195-S211 PolarHBondContact OG-OG 3.32Å
196	L	97.2	Very high	92.4	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.5	171.4	-62.8	-177.3	0	0	0	108.6	T209 R210 F212 L219 L225 L232 V234 F253	L196-T209 CarbonylContact O-C 3.49Å; L196-T209 VanDerWaalsContact O-CA 3.25Å; L196-T209 WeakPolarHBondContact O-CA 3.47Å; L196-R210 PolarHBondContact N-O 3.05Å; L196-R210 PolarHBondContact O-N 2.88Å; L196-F212 HydrophobicContact CD1-CE2 3.85Å; L196-F212 HydrophobicContact CD1-CZ 4.36Å; L196-F212 HydrophobicContact CG-CE2 3.95Å; L196-L219 HydrophobicContact CD2-CD2 3.97Å; L196-L225 HydrophobicContact CD1-CD2 3.76Å; L196-L225 HydrophobicContact CD2-CD1 3.71Å; L196-L225 HydrophobicContact CD2-CD2 3.99Å; L196-L232 HydrophobicContact CD1-CD2 4.29Å; L196-V234 HydrophobicContact CD1-CG1 4.31Å; L196-V234 HydrophobicContact CD1-CG2 3.47Å; L196-V234 VanDerWaalsContact CD1-CG2 3.47Å; L196-F253 HydrophobicContact CB-CZ 4.49Å
197	H	96.9	Very high	93	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.019	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	137.2	-174.2	-52.6	-83.1	0	0	0	109.4	V136 E141 I158 V159 S161 S195 L206 T209	V136-H197 HydrophobicContact CG1-CB 3.57Å; V136-H197 WeakPolarHBondContact CG1-CD2 3.46Å; V136-H197 WeakPolarHBondContact CG1-ND1 3.23Å; E141-H197 IonicContact OE2-CE1 3.64Å; E141-H197 IonicContact OE2-NE2 3.64Å; I158-H197 CarbonylContact C-O 3.54Å; I158-H197 VanDerWaalsContact CA-O 3.25Å; I158-H197 WeakPolarHBondContact CA-O 3.39Å; V159-H197 HydrophobicContact CG2-CB 4Å; V159-H197 PolarHBondContact N-O 3.24Å; V159-H197 PolarHBondContact O-N 3.2Å; S161-H197 PolarHBondContact OG-NE2 2.85Å; S195-H197 WeakPolarHBondContact CB-NE2 3.21Å; H197-L206 HydrophobicContact CB-CD1 3.72Å; H197-T209 VanDerWaalsContact CE1-CG2 3.44Å; H197-T209 WeakPolarHBondContact CE1-CG2 3.39Å; H197-T209 VanDerWaalsContact ND1-CG2 3.29Å; H197-T209 WeakPolarHBondContact ND1-CG2 3.48Å; H197-T209 PolarHBondContact ND1-OG1 2.98Å
198	I	97.6	Very high	93.8	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.9	174.1	-179.4	163.1	0	0	0	109.5	Y156 V157 I158 C207 D208 V247 G251 F253	Y156-I198 HydrophobicContact CD1-CD1 4.34Å; Y156-I198 HydrophobicContact CD1-CG1 4.07Å; Y156-I198 HydrophobicContact CG-CD1 4.12Å; Y156-I198 HydrophobicContact CG-CG1 4.19Å; V157-I198 WeakPolarHBondContact O-CA 3.24Å; I158-I198 HydrophobicContact CG1-CB 4.28Å; I158-I198 HydrophobicContact CG1-CD1 4.29Å; I158-I198 HydrophobicContact CG1-CG1 4.27Å; I198-C207 HydrophobicContact CG2-CB 4.16Å; I198-C207 PolarHBondContact O-N 2.88Å; I198-D208 HydrophobicContact CG2-CB 3.6Å; I198-D208 PolarHBondContact N-O 2.91Å; I198-D208 VanDerWaalsContact N-O 3.11Å; I198-V247 HydrophobicContact CD1-CG1 3.54Å; I198-G251 WeakPolarHBondContact CG2-O 3.39Å; I198-F253 HydrophobicContact CB-CE1 4.33Å; I198-F253 HydrophobicContact CB-CE2 3.9Å; I198-F253 HydrophobicContact CB-CZ 3.65Å; I198-F253 HydrophobicContact CG2-CD2 4.07Å; I198-F253 HydrophobicContact CG2-CE2 3.58Å; I198-F253 HydrophobicContact CG2-CZ 3.83Å
199	I	97.8	Very high	94.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132	-171.5	-58.9	162.1	0	0	0	108.7	L85 I87 T134 V136 Y156 V157 V159 R205 L206	L85-I199 HydrophobicContact CB-CD1 4.1Å; L85-I199 HydrophobicContact CD2-CD1 3.65Å; L85-I199 HydrophobicContact CD2-CG2 4.47Å; I87-I199 HydrophobicContact CD1-CG2 4.19Å; T134-I199 HydrophobicContact CG2-CD1 4.41Å; T134-I199 HydrophobicContact CG2-CG1 4.35Å; T134-I199 HydrophobicContact CG2-CG2 4.04Å; V136-I199 HydrophobicContact CG2-CD1 3.57Å; V136-I199 HydrophobicContact CG2-CG1 4.48Å; Y156-I199 VanDerWaalsContact CA-O 3.29Å; Y156-I199 WeakPolarHBondContact CA-O 3.38Å; V157-I199 HydrophobicContact CG1-CB 4.01Å; V157-I199 PolarHBondContact N-O 3.04Å; V157-I199 PolarHBondContact O-N 3.41Å; V159-I199 HydrophobicContact CG2-CD1 3.74Å; I199-R205 WeakPolarHBondContact CA-O 3.41Å; I199-L206 HydrophobicContact CG1-CD1 4.04Å
200	D	97.1	Very high	95.2	Very high	10 Å²	10	36.6 Å²	36.6	5%	0.053	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.5	172.5	-177.4	-5.6	0	0	0	110.1	Y156 H202 T203 G204 R205	Y156-D200 HydrophobicContact CD1-CB 3.98Å; Y156-D200 HydrophobicContact CE1-CB 3.8Å; D200-H202 VanDerWaalsContact C-N 3.3Å; D200-H202 PolarHBondContact O-N 3.36Å; D200-H202 WeakPolarHBondContact OD1-CB 3.48Å; D200-H202 IonicContact OD1-CG 3.37Å; D200-H202 PolarHBondContact OD1-N 2.95Å; D200-H202 IonicContact OD1-ND1 3.69Å; D200-T203 WeakPolarHBondContact CB-OG1 3.46Å; D200-T203 WeakPolarHBondContact OD2-CG2 3.39Å; D200-T203 PolarHBondContact OD2-OG1 3.01Å; D200-G204 VanDerWaalsContact O-CA 3.28Å; D200-G204 WeakPolarHBondContact O-CA 3.39Å; D200-G204 PolarHBondContact O-N 3.18Å; D200-R205 PolarHBondContact N-O 2.96Å
201	L	96.1	Very high	95.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-27.3	-178.7	-68.3	171.7	0	0	0	112.9	Y74 I76 I87 F150 R155 V157	Y74-L201 HydrophobicContact CD2-CB 4.13Å; Y74-L201 HydrophobicContact CD2-CD1 4.42Å; Y74-L201 HydrophobicContact CE2-CB 4.38Å; I76-L201 HydrophobicContact CG2-CD2 3.96Å; I87-L201 HydrophobicContact CD1-CD2 4.11Å; I87-L201 HydrophobicContact CG1-CD2 4.18Å; I87-L201 HydrophobicContact CG2-CD2 4.23Å; F150-L201 HydrophobicContact CD1-CD1 3.93Å; F150-L201 HydrophobicContact CE1-CD1 3.88Å; R155-L201 WeakPolarHBondContact O-CB 3.5Å; R155-L201 PolarHBondContact O-N 3.42Å; V157-L201 HydrophobicContact CB-CD1 4.5Å; V157-L201 HydrophobicContact CB-CD2 4.15Å; V157-L201 HydrophobicContact CB-CG 4.38Å; V157-L201 HydrophobicContact CG1-CD2 3.66Å; V157-L201 HydrophobicContact CG1-CG 4.19Å
202	H	94.6	Very high	95.8	Very high	83 Å²	83	38.7 Å²	38.7	38%	0.384	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-33.2	-177.6	-61.9	103.4	0	0	0	113	Y74 H132 D200	Y74-H202 AromaticContact CE2-CD2 3.99Å; Y74-H202 AromaticContact CE2-NE2 3.96Å; Y74-H202 AromaticContact CZ-CD2 3.89Å; Y74-H202 PolarHBondContact OH-CD2 3.34Å; H132-H202 PolarHBondContact NE2-O 3.44Å; H132-H202 VanDerWaalsContact NE2-O 3.13Å; D200-H202 VanDerWaalsContact C-N 3.3Å; D200-H202 PolarHBondContact O-N 3.36Å; D200-H202 WeakPolarHBondContact OD1-CB 3.48Å; D200-H202 IonicContact OD1-CG 3.37Å; D200-H202 PolarHBondContact OD1-N 2.95Å; D200-H202 IonicContact OD1-ND1 3.69Å
203	T	95.3	Very high	95.8	Very high	65 Å²	65	41.6 Å²	41.6	40%	0.399	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-14.9	-176.7	63.4	0	0	0	0	113.1	D200 R205	D200-T203 WeakPolarHBondContact CB-OG1 3.46Å; D200-T203 WeakPolarHBondContact OD2-CG2 3.39Å; D200-T203 PolarHBondContact OD2-OG1 3.01Å; T203-R205 PolarHBondContact O-N 3.33Å
204	G	95.6	Very high	95.6	Very high	14 Å²	14	39.6 Å²	39.6	14%	0.144	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	22.9	-174.9	0	0	0	0	0	113.3	T134 D200	T134-G204 WeakPolarHBondContact CG2-O 3.14Å; T134-G204 PolarHBondContact OG1-O 2.86Å; D200-G204 VanDerWaalsContact O-CA 3.28Å; D200-G204 WeakPolarHBondContact O-CA 3.39Å; D200-G204 PolarHBondContact O-N 3.18Å
205	R	96.1	Very high	95.5	Very high	180 Å²	180	39.3 Å²	39.3	68%	0.679	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	134.7	-178.5	-69	-177.6	173.4	-171.2	-1.7	110.6	I199 D200 T203 C207	I199-R205 WeakPolarHBondContact CA-O 3.41Å; D200-R205 PolarHBondContact N-O 2.96Å; T203-R205 PolarHBondContact O-N 3.33Å; R205-C207 PolarHBondContact O-N 3.38Å
206	L	96.5	Very high	95.4	Very high	69 Å²	69	41 Å²	41	36%	0.361	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	115	162.8	176.7	63.5	0	0	0	108.3	T134 V136 H197 I199	T134-L206 HydrophobicContact CG2-CB 4.08Å; V136-L206 HydrophobicContact CG1-CD1 4.41Å; H197-L206 HydrophobicContact CB-CD1 3.72Å; I199-L206 HydrophobicContact CG1-CD1 4.04Å
207	C	96.2	Very high	95.3	Very high	44 Å²	44	41 Å²	41	30%	0.297	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-44.9	-172.7	-63.3	0	0	0	0	112.7	I198 R205 G251	I198-C207 HydrophobicContact CG2-CB 4.16Å; I198-C207 PolarHBondContact O-N 2.88Å; R205-C207 PolarHBondContact O-N 3.38Å; C207-G251 WeakPolarHBondContact CB-O 3.26Å
208	D	96.6	Very high	95.1	Very high	31 Å²	31	42.4 Å²	42.4	17%	0.166	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	162.4	-179.1	-163.3	5.1	0	0	0	110.9	I198 R210 T252 F253	I198-D208 HydrophobicContact CG2-CB 3.6Å; I198-D208 PolarHBondContact N-O 2.91Å; I198-D208 VanDerWaalsContact N-O 3.11Å; D208-R210 VanDerWaalsContact CG-NH1 3.28Å; D208-R210 IonicContact OD1-CZ 3.47Å; D208-R210 IonicContact OD1-NH1 3.47Å; D208-R210 PolarHBondContact OD1-NH1 2.88Å; D208-R210 IonicContact OD1-NH2 3.84Å; D208-R210 IonicContact OD2-CZ 3.77Å; D208-R210 VanDerWaalsContact OD2-CZ 3.28Å; D208-R210 IonicContact OD2-NH1 3.37Å; D208-R210 PolarHBondContact OD2-NH1 3.23Å; D208-R210 VanDerWaalsContact OD2-NH1 3.13Å; D208-R210 IonicContact OD2-NH2 3.45Å; D208-R210 PolarHBondContact OD2-NH2 3.07Å; D208-T252 HydrophobicContact CB-CG2 4.29Å; D208-F253 HydrophobicContact CB-CD2 4.18Å; D208-F253 PolarHBondContact OD2-N 3.49Å
209	T	95.9	Very high	95	Very high	45 Å²	45	42.6 Å²	42.6	28%	0.276	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	136.2	178.4	-64.5	0	0	0	0	111.4	L196 H197	L196-T209 CarbonylContact O-C 3.49Å; L196-T209 VanDerWaalsContact O-CA 3.25Å; L196-T209 WeakPolarHBondContact O-CA 3.47Å; H197-T209 VanDerWaalsContact CE1-CG2 3.44Å; H197-T209 WeakPolarHBondContact CE1-CG2 3.39Å; H197-T209 VanDerWaalsContact ND1-CG2 3.29Å; H197-T209 WeakPolarHBondContact ND1-CG2 3.48Å; H197-T209 PolarHBondContact ND1-OG1 2.98Å
210	R	95.9	Very high	94.7	Very high	65 Å²	65	44.9 Å²	44.9	25%	0.245	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.2	173.7	-70.6	-71.9	172.3	-76	-7	110	S195 L196 D208 F212 F245 F253 D255	S195-R210 CarbonylContact C-O 3.5Å; S195-R210 WeakPolarHBondContact CA-O 3.44Å; L196-R210 PolarHBondContact N-O 3.05Å; L196-R210 PolarHBondContact O-N 2.88Å; D208-R210 VanDerWaalsContact CG-NH1 3.28Å; D208-R210 IonicContact OD1-CZ 3.47Å; D208-R210 IonicContact OD1-NH1 3.47Å; D208-R210 PolarHBondContact OD1-NH1 2.88Å; D208-R210 IonicContact OD1-NH2 3.84Å; D208-R210 IonicContact OD2-CZ 3.77Å; D208-R210 VanDerWaalsContact OD2-CZ 3.28Å; D208-R210 IonicContact OD2-NH1 3.37Å; D208-R210 PolarHBondContact OD2-NH1 3.23Å; D208-R210 VanDerWaalsContact OD2-NH1 3.13Å; D208-R210 IonicContact OD2-NH2 3.45Å; D208-R210 PolarHBondContact OD2-NH2 3.07Å; R210-F212 HydrophobicContact CB-CE2 4.42Å; R210-F245 HydrophobicContact CG-CE1 4.33Å; R210-F253 HydrophobicContact CB-CD2 4.28Å; R210-F253 HydrophobicContact CG-CB 3.69Å; R210-F253 HydrophobicContact CG-CD2 3.56Å; R210-F253 HydrophobicContact CG-CE2 4.44Å; R210-F253 HydrophobicContact CG-CG 3.87Å; R210-F253 PolarHBondContact NH2-O 3.13Å; R210-D255 IonicContact NE-OD1 3.65Å; R210-D255 PolarHBondContact NE-OD1 3.39Å
211	S	94.5	Very high	94.4	Very high	80 Å²	80	46.4 Å²	46.4	56%	0.559	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.5	-175.5	-56.7	0	0	0	0	112.1	Y194 S195	Y194-S211 CarbonylContact O-C 3.56Å; Y194-S211 VanDerWaalsContact O-CA 3.31Å; Y194-S211 WeakPolarHBondContact O-CA 3.39Å; S195-S211 PolarHBondContact OG-OG 3.32Å
212	F	94.4	Very high	94.2	Very high	17 Å²	17	46.6 Å²	46.6	8%	0.075	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.3	179.3	-55	-91.8	0	0	0	107.9	D193 Y194 L196 R210 D215 I217 V234 H243 F245	D193-F212 CarbonylContact C-O 3.41Å; D193-F212 VanDerWaalsContact CA-O 3.31Å; D193-F212 WeakPolarHBondContact CA-O 3.07Å; Y194-F212 PolarHBondContact N-O 2.81Å; Y194-F212 PolarHBondContact O-N 3.1Å; L196-F212 HydrophobicContact CD1-CE2 3.85Å; L196-F212 HydrophobicContact CD1-CZ 4.36Å; L196-F212 HydrophobicContact CG-CE2 3.95Å; R210-F212 HydrophobicContact CB-CE2 4.42Å; F212-D215 HydrophobicContact CB-CB 4.39Å; F212-I217 HydrophobicContact CB-CD1 3.76Å; F212-I217 HydrophobicContact CD1-CD1 4.07Å; F212-I217 HydrophobicContact CD2-CD1 3.72Å; F212-I217 HydrophobicContact CE2-CD1 4.35Å; F212-I217 HydrophobicContact CG-CD1 3.56Å; F212-V234 HydrophobicContact CE1-CG1 4.28Å; F212-V234 HydrophobicContact CE2-CG1 4.28Å; F212-V234 HydrophobicContact CZ-CB 4.29Å; F212-V234 HydrophobicContact CZ-CG1 3.96Å; F212-V234 HydrophobicContact CZ-CG2 4.3Å; F212-H243 HydrophobicContact CE1-CB 4.26Å; F212-H243 AromaticContact CE1-CD2 3.59Å; F212-H243 AromaticContact CE1-CG 3.85Å; F212-F245 HydrophobicContact CE1-CE2 4.35Å; F212-F245 HydrophobicContact CE1-CZ 4.01Å; F212-F245 AromaticContact CZ-CE2 3.79Å; F212-F245 HydrophobicContact CZ-CE2 3.79Å; F212-F245 AromaticContact CZ-CZ 3.63Å; F212-F245 HydrophobicContact CZ-CZ 3.63Å
213	K	91.8	Very high	94.1	Very high	110 Å²	110	44.5 Å²	44.5	48%	0.478	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	144.4	-175.4	-65.2	-171.5	175.2	-171.4	0	112.3	D193 D215 Q239	D193-K213 WeakPolarHBondContact OD1-CA 3.34Å; K213-D215 PolarHBondContact O-N 3.18Å; K213-Q239 PolarHBondContact O-NE2 2.61Å
214	C	90.4	Very high	94	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.027	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.9	47.1	173.3	-64.3	0	0	0	0	112	P171 E175 V176 D193	P171-C214 VanDerWaalsContact CB-SG 3.57Å; E175-C214 HydrophobicContact CB-CB 4.45Å; V176-C214 HydrophobicContact CG2-CB 4.11Å; D193-C214 PolarHBondContact OD1-N 3.21Å
215	D	92.9	Very high	94.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	176.9	-171.2	-152	-22.9	0	0	0	111.4	E192 Y194 F212 K213 I217 S236 Q238	E192-D215 PolarHBondContact N-O 3.24Å; E192-D215 VanDerWaalsContact N-O 3.13Å; E192-D215 PolarHBondContact O-N 3.26Å; E192-D215 VanDerWaalsContact O-N 3.11Å; Y194-D215 HydrophobicContact CD2-CB 4.25Å; Y194-D215 WeakPolarHBondContact CE2-O 3.31Å; F212-D215 HydrophobicContact CB-CB 4.39Å; K213-D215 PolarHBondContact O-N 3.18Å; D215-I217 HydrophobicContact CB-CG1 4.46Å; D215-S236 PolarHBondContact OD1-OG 2.85Å; D215-S236 WeakPolarHBondContact OD2-CB 3.43Å; D215-S236 PolarHBondContact OD2-OG 3.02Å; D215-Q238 WeakPolarHBondContact OD1-CB 3.49Å; D215-Q238 PolarHBondContact OD1-N 3.16Å
216	K	93.4	Very high	94	Very high	39 Å²	39	32.4 Å²	32.4	17%	0.17	17%	0.172	C	C	.	.			trans	-129.7	99.9	164.8	-164.6	72.1	-173	173.6	0	109.8	S189 P190 L191 V237 Q238	S189-K216 WeakPolarHBondContact OG-CE 3.45Å; S189-K216 PolarHBondContact OG-NZ 3.49Å; S189-K216 VanDerWaalsContact OG-NZ 3.17Å; P190-K216 PolarHBondContact O-NZ 3.3Å; L191-K216 HydrophobicContact CD2-CB 4.45Å; K216-V237 HydrophobicContact CB-CB 4.3Å; K216-V237 WeakPolarHBondContact O-CB 3.1Å; K216-V237 WeakPolarHBondContact O-CG2 3.44Å; K216-V237 PolarHBondContact O-N 2.96Å; K216-Q238 HydrophobicContact CB-CB 4.09Å
217	I	95.3	Very high	93.9	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.155	C	C	.	.			trans	-114.9	119.6	174.8	-59.1	172.8	0	0	0	108.2	Y194 F212 D215 L219 L225 V234	Y194-I217 HydrophobicContact CD1-CB 4.33Å; Y194-I217 HydrophobicContact CD2-CB 3.91Å; Y194-I217 HydrophobicContact CD2-CD1 4.16Å; Y194-I217 HydrophobicContact CD2-CG1 4.03Å; Y194-I217 HydrophobicContact CE1-CB 4.48Å; Y194-I217 VanDerWaalsContact CE1-O 3.27Å; Y194-I217 WeakPolarHBondContact CE1-O 3.21Å; Y194-I217 HydrophobicContact CE2-CB 4.06Å; Y194-I217 HydrophobicContact CE2-CG1 4.42Å; Y194-I217 HydrophobicContact CG-CB 4.03Å; Y194-I217 HydrophobicContact CG-CD1 4.27Å; Y194-I217 HydrophobicContact CG-CG1 4.42Å; Y194-I217 VanDerWaalsContact CZ-O 3.26Å; Y194-I217 PolarHBondContact OH-O 3.32Å; F212-I217 HydrophobicContact CB-CD1 3.76Å; F212-I217 HydrophobicContact CD1-CD1 4.07Å; F212-I217 HydrophobicContact CD2-CD1 3.72Å; F212-I217 HydrophobicContact CE2-CD1 4.35Å; F212-I217 HydrophobicContact CG-CD1 3.56Å; D215-I217 HydrophobicContact CB-CG1 4.46Å; I217-L219 HydrophobicContact CG2-CD2 3.93Å; I217-L219 PolarHBondContact O-N 2.88Å; I217-L225 HydrophobicContact CG2-CD2 4.1Å; I217-V234 HydrophobicContact CD1-CG1 3.76Å; I217-V234 HydrophobicContact CG1-CG1 4.4Å; I217-V234 HydrophobicContact CG2-CG1 4.12Å
218	I	94	Very high	93.7	Very high	33 Å²	33	28.6 Å²	28.6	17%	0.169	15%	0.147	C	C	.	.			trans	-80.6	84.6	-176	-51.5	175.9	0	0	0	110	S220 Q223 G224 W335	I218-S220 VanDerWaalsContact C-N 3.32Å; I218-S220 PolarHBondContact O-N 3.45Å; I218-Q223 HydrophobicContact CB-CB 4.12Å; I218-Q223 HydrophobicContact CG2-CB 3.79Å; I218-Q223 PolarHBondContact O-N 3.46Å; I218-G224 PolarHBondContact O-N 2.85Å; I218-W335 HydrophobicContact CD1-CE3 4.41Å; I218-W335 HydrophobicContact CD1-CH2 3.77Å; I218-W335 HydrophobicContact CD1-CZ2 4.46Å; I218-W335 HydrophobicContact CD1-CZ3 3.73Å
219	L	94.1	Very high	93.4	Very high	4 Å²	4	32 Å²	32	2%	0.021	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-28.6	179.4	-64	-176.2	0	0	0	113.6	N144 C147 Y194 L196 I217 H221 N222 L225	N144-L219 HydrophobicContact CB-CB 3.98Å; N144-L219 HydrophobicContact CB-CD1 4.05Å; C147-L219 HydrophobicContact CB-CB 4.09Å; Y194-L219 HydrophobicContact CD1-CD1 3.6Å; Y194-L219 HydrophobicContact CD1-CG 3.91Å; Y194-L219 HydrophobicContact CE1-CD1 4.04Å; Y194-L219 HydrophobicContact CE1-CG 4.1Å; L196-L219 HydrophobicContact CD2-CD2 3.97Å; I217-L219 HydrophobicContact CG2-CD2 3.93Å; I217-L219 PolarHBondContact O-N 2.88Å; L219-H221 PolarHBondContact O-N 3.38Å; L219-N222 PolarHBondContact O-N 3.21Å; L219-L225 HydrophobicContact CD2-CD1 3.76Å; L219-L225 HydrophobicContact CD2-CD2 4.28Å; L219-L225 HydrophobicContact CD2-CG 4.07Å
220	S	91.8	Very high	93.2	Very high	47 Å²	47	32.7 Å²	32.7	33%	0.329	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-59.1	123	-179.1	-70.1	0	0	0	0	112.2	N144 E146 I218 N222 Q223	N144-S220 PolarHBondContact ND2-OG 3.25Å; E146-S220 WeakPolarHBondContact OE2-CB 2.91Å; I218-S220 VanDerWaalsContact C-N 3.32Å; I218-S220 PolarHBondContact O-N 3.45Å; S220-N222 PolarHBondContact O-N 2.91Å; S220-Q223 WeakPolarHBondContact O-CG 3.41Å; S220-Q223 PolarHBondContact O-N 2.85Å; S220-Q223 PolarHBondContact O-NE2 3.05Å
221	H	90.3	Very high	93.2	Very high	42 Å²	42	30.8 Å²	30.8	19%	0.194	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	52.9	37.1	-173.9	-52.6	-60.8	0	0	0	113.7	E146 L219 Q223 S455	E146-H221 VanDerWaalsContact CD-CE1 3.42Å; E146-H221 IonicContact OE1-CE1 3.84Å; E146-H221 PolarHBondContact OE1-CE1 3.37Å; E146-H221 IonicContact OE1-NE2 3.27Å; E146-H221 IonicContact OE2-CD2 3.6Å; E146-H221 IonicContact OE2-CE1 3.74Å; E146-H221 PolarHBondContact OE2-CE1 2.84Å; E146-H221 IonicContact OE2-CG 3.94Å; E146-H221 IonicContact OE2-ND1 2.74Å; E146-H221 IonicContact OE2-NE2 2.82Å; E146-H221 PolarHBondContact OE2-NE2 2.82Å; L219-H221 PolarHBondContact O-N 3.38Å; H221-Q223 PolarHBondContact O-N 3.43Å; H221-Q223 VanDerWaalsContact O-N 3.14Å; H221-S455 WeakPolarHBondContact O-CB 3.29Å; H221-S455 PolarHBondContact O-OG 3.28Å
222	N	93.2	Very high	93.3	Very high	4 Å²	4	27 Å²	27	2%	0.021	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	53	35.9	176.5	-51.2	-27.9	0	0	0	113.1	E146 C147 S148 L149 L219 S220 A456	E146-N222 PolarHBondContact O-OD1 3.16Å; C147-N222 WeakPolarHBondContact CA-OD1 3.33Å; S148-N222 PolarHBondContact N-OD1 3.38Å; S148-N222 PolarHBondContact O-ND2 3.37Å; L149-N222 HydrophobicContact CD2-CB 4.04Å; L149-N222 VanDerWaalsContact CD2-ND2 3.31Å; L149-N222 WeakPolarHBondContact CD2-ND2 3.47Å; L219-N222 PolarHBondContact O-N 3.21Å; S220-N222 PolarHBondContact O-N 2.91Å; N222-A456 PolarHBondContact ND2-O 3.45Å
223	Q	91.9	Very high	93.4	Very high	39 Å²	39	26.2 Å²	26.2	18%	0.182	12%	0.124	C	C	.	.	S	Bend	trans	-77.9	-31.8	-173.4	-78.8	-179.2	71.6	0	0	113.7	I218 S220 H221 K336 S455	I218-Q223 HydrophobicContact CB-CB 4.12Å; I218-Q223 HydrophobicContact CG2-CB 3.79Å; I218-Q223 PolarHBondContact O-N 3.46Å; S220-Q223 WeakPolarHBondContact O-CG 3.41Å; S220-Q223 PolarHBondContact O-N 2.85Å; S220-Q223 PolarHBondContact O-NE2 3.05Å; H221-Q223 PolarHBondContact O-N 3.43Å; H221-Q223 VanDerWaalsContact O-N 3.14Å; Q223-K336 VanDerWaalsContact OE1-CE 3.27Å; Q223-S455 WeakPolarHBondContact CG-OG 3.35Å
224	G	93.8	Very high	93.7	Very high	1 Å²	1	21 Å²	21	1%	0.01	10%	0.101	C	C	.	.	S	Bend	trans	-91.9	-4.8	176.7	0	0	0	0	0	113.8	I218 L235	I218-G224 PolarHBondContact O-N 2.85Å; G224-L235 PolarHBondContact O-N 3.46Å
225	L	96.3	Very high	94.1	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.5	-176	-52	-178.9	0	0	0	110.1	C147 L149 L196 I217 L219 A233 V234	C147-L225 WeakPolarHBondContact SG-CD1 3.38Å; L149-L225 HydrophobicContact CD1-CB 3.78Å; L149-L225 HydrophobicContact CD1-CD1 4.34Å; L196-L225 HydrophobicContact CD1-CD2 3.76Å; L196-L225 HydrophobicContact CD2-CD1 3.71Å; L196-L225 HydrophobicContact CD2-CD2 3.99Å; I217-L225 HydrophobicContact CG2-CD2 4.1Å; L219-L225 HydrophobicContact CD2-CD1 3.76Å; L219-L225 HydrophobicContact CD2-CD2 4.28Å; L219-L225 HydrophobicContact CD2-CG 4.07Å; L225-A233 WeakPolarHBondContact CA-O 3.41Å; L225-V234 HydrophobicContact CD2-CB 4.14Å; L225-V234 HydrophobicContact CD2-CG1 3.74Å; L225-V234 HydrophobicContact CD2-CG2 3.78Å
226	Y	96	Very high	94.2	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.008	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	120.9	172.4	-155.9	-78.2	0	0	0	111.2	Y228 L232 A233 Q338 L339 N402 I454 A456	Y226-Y228 HydrophobicContact CE1-CD2 4.49Å; Y226-L232 WeakPolarHBondContact O-CA 3.28Å; Y226-A233 PolarHBondContact N-O 3.03Å; Y226-A233 PolarHBondContact O-N 2.9Å; Y226-Q338 HydrophobicContact CD2-CB 3.98Å; Y226-Q338 HydrophobicContact CD2-CG 4.01Å; Y226-Q338 HydrophobicContact CE1-CG 4.32Å; Y226-Q338 HydrophobicContact CE2-CB 3.93Å; Y226-Q338 HydrophobicContact CE2-CG 3.5Å; Y226-Q338 PolarHBondContact OH-NE2 3.31Å; Y226-Q338 VanDerWaalsContact OH-NE2 3.14Å; Y226-L339 HydrophobicContact CD1-CB 3.58Å; Y226-L339 HydrophobicContact CD1-CD1 4.12Å; Y226-L339 HydrophobicContact CD1-CG 4.08Å; Y226-L339 HydrophobicContact CE1-CB 3.86Å; Y226-L339 VanDerWaalsContact CE1-O 3.22Å; Y226-L339 WeakPolarHBondContact CE1-O 3.33Å; Y226-L339 HydrophobicContact CG-CB 4.44Å; Y226-N402 HydrophobicContact CE1-CB 4.42Å; Y226-N402 WeakPolarHBondContact OH-CB 3.25Å; Y226-I454 VanDerWaalsContact CE2-O 3.22Å; Y226-I454 WeakPolarHBondContact CE2-O 3.01Å; Y226-A456 HydrophobicContact CD1-CB 4.31Å; Y226-A456 HydrophobicContact CD2-CB 3.67Å; Y226-A456 HydrophobicContact CE2-CB 3.93Å; Y226-A456 HydrophobicContact CG-CB 3.89Å
227	L	94.3	Very high	94.3	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.016	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.9	173.9	-178.1	68.6	0	0	0	109.1	L149 F150 T151 I158 I231 L232 V247 N402	L149-L227 HydrophobicContact CB-CB 4.42Å; L149-L227 HydrophobicContact CB-CD2 4.27Å; L149-L227 HydrophobicContact CD1-CB 4.07Å; F150-L227 WeakPolarHBondContact O-CD2 3.28Å; T151-L227 HydrophobicContact CG2-CD2 4.45Å; I158-L227 HydrophobicContact CD1-CD1 4.45Å; I158-L227 HydrophobicContact CD1-CD2 4.25Å; L227-I231 WeakPolarHBondContact CA-O 3.33Å; L227-L232 HydrophobicContact CB-CD1 4.33Å; L227-L232 HydrophobicContact CD1-CB 4.08Å; L227-V247 HydrophobicContact CD1-CG2 4.13Å; L227-N402 PolarHBondContact O-ND2 2.94Å; L227-N402 VanDerWaalsContact O-ND2 3.15Å
228	Y	91.9	Very high	94.2	Very high	30 Å²	30	19.2 Å²	19.2	12%	0.118	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	115.2	170.8	-172.3	-84.2	0	0	0	108.5	Y226 N230 I231 D341 E342 N402 H406	Y226-Y228 HydrophobicContact CE1-CD2 4.49Å; Y228-N230 PolarHBondContact O-N 3.09Å; Y228-I231 PolarHBondContact N-O 3.38Å; Y228-I231 PolarHBondContact O-N 3.35Å; Y228-D341 HydrophobicContact CE1-CB 4.45Å; Y228-E342 HydrophobicContact CD1-CG 4.2Å; Y228-E342 HydrophobicContact CE1-CG 4.11Å; Y228-N402 HydrophobicContact CD2-CB 4.43Å; Y228-N402 WeakPolarHBondContact CD2-ND2 3.43Å; Y228-H406 AromaticContact CZ-NE2 3.83Å
229	R	89.3	Confident	94.2	Very high	104 Å²	104	18 Å²	18	39%	0.392	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	-108.9	-169.5	-63	173.9	178.6	-172.5	-0.4	111.1	D152 E342 H406	D152-R229 WeakPolarHBondContact OD2-CA 3.35Å; R229-E342 WeakPolarHBondContact CD-OE1 3.49Å; R229-E342 IonicContact CZ-OE1 2.9Å; R229-E342 IonicContact NE-OE1 3.09Å; R229-E342 IonicContact NH1-OE1 3.84Å; R229-E342 PolarHBondContact NH1-OE1 3.17Å; R229-H406 PolarHBondContact NE-NE2 3.1Å
230	N	92.4	Very high	94.2	Very high	58 Å²	58	17.8 Å²	17.8	31%	0.31	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	4	178	66	-29.9	0	0	0	113.1	Y228 Q246 V247	Y228-N230 PolarHBondContact O-N 3.09Å; N230-Q246 PolarHBondContact ND2-NE2 3.39Å; N230-Q246 CarbonylContact O-C 3.57Å; N230-Q246 WeakPolarHBondContact O-CA 3.4Å; N230-V247 PolarHBondContact O-N 3.06Å
231	I	95.1	Very high	94.4	Very high	26 Å²	26	16.1 Å²	16.1	13%	0.133	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	117.8	178.6	-59.1	176.4	0	0	0	109	L227 Y228 V244 F245 L339 E342	L227-I231 WeakPolarHBondContact CA-O 3.33Å; Y228-I231 PolarHBondContact N-O 3.38Å; Y228-I231 PolarHBondContact O-N 3.35Å; I231-V244 HydrophobicContact CG2-CG1 3.7Å; I231-F245 WeakPolarHBondContact CA-O 3.35Å; I231-L339 HydrophobicContact CB-CD1 4.38Å; I231-L339 HydrophobicContact CG2-CD1 3.97Å; I231-L339 WeakPolarHBondContact O-CD1 3.46Å; I231-E342 HydrophobicContact CD1-CB 3.78Å; I231-E342 HydrophobicContact CD1-CG 4.15Å; I231-E342 WeakPolarHBondContact CD1-O 3.47Å
232	L	96.8	Very high	94.7	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.6	175.3	175	69.9	0	0	0	109.3	L149 I158 L196 Y226 L227 V234 F245 V247 F253	L149-L232 HydrophobicContact CD1-CD1 4.12Å; I158-L232 HydrophobicContact CD1-CD2 4.29Å; L196-L232 HydrophobicContact CD1-CD2 4.29Å; Y226-L232 WeakPolarHBondContact O-CA 3.28Å; L227-L232 HydrophobicContact CB-CD1 4.33Å; L227-L232 HydrophobicContact CD1-CB 4.08Å; L232-V234 HydrophobicContact CD2-CG2 4.26Å; L232-V234 HydrophobicContact CG-CG2 4.17Å; L232-F245 HydrophobicContact CB-CB 4.31Å; L232-F245 HydrophobicContact CD2-CD2 4.25Å; L232-F245 HydrophobicContact CG-CD2 4.46Å; L232-F245 PolarHBondContact N-O 3.43Å; L232-F245 PolarHBondContact O-N 3.33Å; L232-V247 HydrophobicContact CB-CG2 4.32Å; L232-F253 HydrophobicContact CD2-CD1 4.05Å; L232-F253 HydrophobicContact CD2-CE1 3.61Å; L232-F253 HydrophobicContact CD2-CZ 4.44Å
233	A	97.3	Very high	94.9	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	136.8	168.6	0	0	0	0	0	110.3	L225 Y226 I242 H243 M337 L339 L345	L225-A233 WeakPolarHBondContact CA-O 3.41Å; Y226-A233 PolarHBondContact N-O 3.03Å; Y226-A233 PolarHBondContact O-N 2.9Å; A233-I242 HydrophobicContact CB-CG2 4.28Å; A233-H243 CarbonylContact C-O 3.54Å; A233-H243 WeakPolarHBondContact CA-O 3.16Å; A233-M337 HydrophobicContact CB-CE 3.46Å; A233-M337 VanDerWaalsContact CB-CE 3.46Å; A233-M337 HydrophobicContact CB-SD 3.97Å; A233-M337 WeakPolarHBondContact O-CE 3.37Å; A233-L339 HydrophobicContact CB-CD1 3.94Å; A233-L339 HydrophobicContact CB-CD2 4.42Å; A233-L339 HydrophobicContact CB-CG 4.1Å; A233-L345 HydrophobicContact CB-CD2 4.39Å
234	V	98.1	Very high	95.2	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.8	174.8	-176.3	0	0	0	0	110.3	L196 F212 I217 L225 L232 I242 H243 F245 M337	L196-V234 HydrophobicContact CD1-CG1 4.31Å; L196-V234 HydrophobicContact CD1-CG2 3.47Å; L196-V234 VanDerWaalsContact CD1-CG2 3.47Å; F212-V234 HydrophobicContact CE1-CG1 4.28Å; F212-V234 HydrophobicContact CE2-CG1 4.28Å; F212-V234 HydrophobicContact CZ-CB 4.29Å; F212-V234 HydrophobicContact CZ-CG1 3.96Å; F212-V234 HydrophobicContact CZ-CG2 4.3Å; I217-V234 HydrophobicContact CD1-CG1 3.76Å; I217-V234 HydrophobicContact CG1-CG1 4.4Å; I217-V234 HydrophobicContact CG2-CG1 4.12Å; L225-V234 HydrophobicContact CD2-CB 4.14Å; L225-V234 HydrophobicContact CD2-CG1 3.74Å; L225-V234 HydrophobicContact CD2-CG2 3.78Å; L232-V234 HydrophobicContact CD2-CG2 4.26Å; L232-V234 HydrophobicContact CG-CG2 4.17Å; V234-I242 CarbonylContact O-C 3.48Å; V234-I242 WeakPolarHBondContact O-CA 3.25Å; V234-H243 HydrophobicContact CB-CB 4.34Å; V234-H243 PolarHBondContact N-O 3.44Å; V234-H243 PolarHBondContact O-N 3.09Å; V234-F245 HydrophobicContact CB-CE2 4.15Å; V234-F245 HydrophobicContact CG2-CD2 3.94Å; V234-F245 HydrophobicContact CG2-CE2 3.62Å; V234-M337 VanDerWaalsContact N-CE 3.34Å
235	L	97.7	Very high	95.3	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	110.1	178.4	176.5	63.6	0	0	0	109.8	G224 V237 I242 M334 M337	G224-L235 PolarHBondContact O-N 3.46Å; L235-V237 HydrophobicContact CD2-CG2 4.11Å; L235-V237 HydrophobicContact CG-CG2 4.07Å; L235-V237 PolarHBondContact O-N 3.18Å; L235-I242 HydrophobicContact CD1-CD1 4.43Å; L235-I242 HydrophobicContact CD1-CG1 3.69Å; L235-M334 HydrophobicContact CD1-CB 4.04Å; L235-M334 HydrophobicContact CD1-CE 4.15Å; L235-M334 HydrophobicContact CD1-SD 4.36Å; L235-M337 HydrophobicContact CB-CE 3.72Å; L235-M337 HydrophobicContact CB-CG 3.9Å; L235-M337 HydrophobicContact CB-SD 3.8Å; L235-M337 HydrophobicContact CD2-CG 4.35Å
236	S	96.4	Very high	95.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	103	163	174.8	0	0	0	0	108.9	D215 Q239 Q240 T241	D215-S236 PolarHBondContact OD1-OG 2.85Å; D215-S236 WeakPolarHBondContact OD2-CB 3.43Å; D215-S236 PolarHBondContact OD2-OG 3.02Å; S236-Q239 WeakPolarHBondContact OG-CB 3.47Å; S236-Q239 WeakPolarHBondContact OG-CG 3.09Å; S236-Q239 PolarHBondContact OG-N 2.88Å; S236-Q239 VanDerWaalsContact OG-N 3.14Å; S236-Q240 WeakPolarHBondContact O-CA 3.37Å; S236-Q240 PolarHBondContact O-N 2.97Å; S236-T241 WeakPolarHBondContact CA-O 3.37Å; S236-T241 VanDerWaalsContact CB-O 3.29Å; S236-T241 WeakPolarHBondContact CB-O 3.45Å; S236-T241 PolarHBondContact N-O 3.42Å; S236-T241 PolarHBondContact O-N 2.83Å; S236-T241 VanDerWaalsContact O-N 3.11Å
237	V	94.9	Very high	95.3	Very high	3 Å²	3	18 Å²	18	2%	0.018	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-38	178.3	-179.5	0	0	0	0	110.2	K216 L235 Q240 V355	K216-V237 HydrophobicContact CB-CB 4.3Å; K216-V237 WeakPolarHBondContact O-CB 3.1Å; K216-V237 WeakPolarHBondContact O-CG2 3.44Å; K216-V237 PolarHBondContact O-N 2.96Å; L235-V237 HydrophobicContact CD2-CG2 4.11Å; L235-V237 HydrophobicContact CG-CG2 4.07Å; L235-V237 PolarHBondContact O-N 3.18Å; V237-Q240 PolarHBondContact O-NE2 3.22Å; V237-V355 HydrophobicContact CG1-CG1 3.17Å
238	Q	93.7	Very high	95.4	Very high	3 Å²	3	19 Å²	19	1%	0.014	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-49	179.4	175.5	54.2	28.6	0	0	110.8	V176 S182 V183 L191 D215 K216	V176-Q238 PolarHBondContact O-NE2 3.16Å; S182-Q238 CarbonylContact C-O 3.57Å; S182-Q238 VanDerWaalsContact CA-O 3.23Å; S182-Q238 WeakPolarHBondContact CA-O 3.46Å; V183-Q238 PolarHBondContact N-O 2.69Å; V183-Q238 PolarHBondContact O-NE2 2.81Å; V183-Q238 PolarHBondContact O-OE1 3.35Å; L191-Q238 HydrophobicContact CD1-CG 4.46Å; L191-Q238 HydrophobicContact CD2-CB 4.14Å; L191-Q238 HydrophobicContact CD2-CG 3.84Å; D215-Q238 WeakPolarHBondContact OD1-CB 3.49Å; D215-Q238 PolarHBondContact OD1-N 3.16Å; K216-Q238 HydrophobicContact CB-CB 4.09Å
239	Q	92.3	Very high	95.4	Very high	7 Å²	7	22.3 Å²	22.3	3%	0.033	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	6.5	-173.4	-45.8	169.5	2.2	0	0	112.4	R178 N179 K213 S236 T241	R178-Q239 HydrophobicContact CB-CB 4.44Å; R178-Q239 HydrophobicContact CB-CG 4.39Å; R178-Q239 HydrophobicContact CG-CG 4.34Å; N179-Q239 PolarHBondContact ND2-O 3.05Å; K213-Q239 PolarHBondContact O-NE2 2.61Å; S236-Q239 WeakPolarHBondContact OG-CB 3.47Å; S236-Q239 WeakPolarHBondContact OG-CG 3.09Å; S236-Q239 PolarHBondContact OG-N 2.88Å; S236-Q239 VanDerWaalsContact OG-N 3.14Å; Q239-T241 VanDerWaalsContact C-N 3.27Å; Q239-T241 PolarHBondContact O-N 2.98Å; Q239-T241 PolarHBondContact O-OG1 3.36Å
240	Q	95.3	Very high	95.6	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	50.5	179.2	-67.7	-66.6	-67.2	0	0	112.9	E181 V183 S236 V237 R333 M334	E181-Q240 HydrophobicContact CB-CB 4.14Å; E181-Q240 HydrophobicContact CB-CG 4.3Å; E181-Q240 WeakPolarHBondContact O-CG 3.15Å; V183-Q240 HydrophobicContact CG1-CG 4.19Å; S236-Q240 WeakPolarHBondContact O-CA 3.37Å; S236-Q240 PolarHBondContact O-N 2.97Å; V237-Q240 PolarHBondContact O-NE2 3.22Å; Q240-R333 VanDerWaalsContact OE1-CA 3.31Å; Q240-M334 HydrophobicContact CB-CE 4.14Å; Q240-M334 PolarHBondContact NE2-O 2.86Å; Q240-M334 WeakPolarHBondContact O-CE 3.41Å
241	T	95.6	Very high	95.6	Very high	11 Å²	11	20.4 Å²	20.4	7%	0.067	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.2	-172.6	-65.1	0	0	0	0	110.2	S236 Q239 T258	S236-T241 WeakPolarHBondContact CA-O 3.37Å; S236-T241 VanDerWaalsContact CB-O 3.29Å; S236-T241 WeakPolarHBondContact CB-O 3.45Å; S236-T241 PolarHBondContact N-O 3.42Å; S236-T241 PolarHBondContact O-N 2.83Å; S236-T241 VanDerWaalsContact O-N 3.11Å; Q239-T241 VanDerWaalsContact C-N 3.27Å; Q239-T241 PolarHBondContact O-N 2.98Å; Q239-T241 PolarHBondContact O-OG1 3.36Å; T241-T258 HydrophobicContact CG2-CG2 3.11Å
242	I	97.4	Very high	95.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.2	173.1	-61.5	170.1	0	0	0	107.8	A233 V234 L235 V244 I259 M334 M337 L345 I347	A233-I242 HydrophobicContact CB-CG2 4.28Å; V234-I242 CarbonylContact O-C 3.48Å; V234-I242 WeakPolarHBondContact O-CA 3.25Å; L235-I242 HydrophobicContact CD1-CD1 4.43Å; L235-I242 HydrophobicContact CD1-CG1 3.69Å; I242-V244 HydrophobicContact CG2-CG2 4.17Å; I242-I259 HydrophobicContact CB-CB 4.31Å; I242-I259 PolarHBondContact N-O 3.15Å; I242-I259 PolarHBondContact O-N 2.94Å; I242-M334 HydrophobicContact CD1-SD 3.88Å; I242-M334 HydrophobicContact CG1-CE 4.36Å; I242-M334 HydrophobicContact CG1-SD 4.18Å; I242-M337 HydrophobicContact CB-SD 4.28Å; I242-M337 HydrophobicContact CD1-CB 4.46Å; I242-M337 HydrophobicContact CD1-SD 3.89Å; I242-M337 HydrophobicContact CG1-SD 3.81Å; I242-M337 HydrophobicContact CG2-CE 4.31Å; I242-M337 HydrophobicContact CG2-SD 3.54Å; I242-M337 VanDerWaalsContact CG2-SD 3.54Å; I242-L345 HydrophobicContact CD1-CD1 4.04Å; I242-L345 HydrophobicContact CG2-CD1 4.19Å; I242-I347 HydrophobicContact CD1-CD1 3.65Å; I242-I347 HydrophobicContact CD1-CG1 4Å
243	H	97	Very high	95.7	Very high	27 Å²	27	21.9 Å²	21.9	13%	0.125	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.7	173	-55.8	-81.7	0	0	0	109.1	F212 A233 V234 F245	F212-H243 HydrophobicContact CE1-CB 4.26Å; F212-H243 AromaticContact CE1-CD2 3.59Å; F212-H243 AromaticContact CE1-CG 3.85Å; A233-H243 CarbonylContact C-O 3.54Å; A233-H243 WeakPolarHBondContact CA-O 3.16Å; V234-H243 HydrophobicContact CB-CB 4.34Å; V234-H243 PolarHBondContact N-O 3.44Å; V234-H243 PolarHBondContact O-N 3.09Å; H243-F245 HydrophobicContact CB-CD2 4.43Å; H243-F245 HydrophobicContact CB-CE2 3.48Å; H243-F245 VanDerWaalsContact CB-CE2 3.48Å; H243-F245 HydrophobicContact CB-CZ 3.64Å
244	V	96.9	Very high	95.7	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.03	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.3	179.6	-175.8	0	0	0	0	108.4	I231 I242 V256 R257 I259 M373	I231-V244 HydrophobicContact CG2-CG1 3.7Å; I242-V244 HydrophobicContact CG2-CG2 4.17Å; V244-V256 HydrophobicContact CG1-CB 4.35Å; V244-V256 WeakPolarHBondContact O-CB 3.24Å; V244-V256 PolarHBondContact O-N 3.01Å; V244-R257 HydrophobicContact CB-CG 3.84Å; V244-R257 HydrophobicContact CG1-CG 4.48Å; V244-R257 HydrophobicContact CG2-CG 4.05Å; V244-R257 PolarHBondContact N-O 2.96Å; V244-R257 PolarHBondContact O-N 2.96Å; V244-I259 HydrophobicContact CG2-CD1 3.88Å; V244-M373 HydrophobicContact CG2-SD 3.93Å
245	F	96.9	Very high	95.5	Very high	12 Å²	12	31.3 Å²	31.3	5%	0.053	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150.2	177.9	-51.6	-85.6	0	0	0	109.9	R210 F212 I231 L232 V234 H243 F253 L254 D255	R210-F245 HydrophobicContact CG-CE1 4.33Å; F212-F245 HydrophobicContact CE1-CE2 4.35Å; F212-F245 HydrophobicContact CE1-CZ 4.01Å; F212-F245 AromaticContact CZ-CE2 3.79Å; F212-F245 HydrophobicContact CZ-CE2 3.79Å; F212-F245 AromaticContact CZ-CZ 3.63Å; F212-F245 HydrophobicContact CZ-CZ 3.63Å; I231-F245 WeakPolarHBondContact CA-O 3.35Å; L232-F245 HydrophobicContact CB-CB 4.31Å; L232-F245 HydrophobicContact CD2-CD2 4.25Å; L232-F245 HydrophobicContact CG-CD2 4.46Å; L232-F245 PolarHBondContact N-O 3.43Å; L232-F245 PolarHBondContact O-N 3.33Å; V234-F245 HydrophobicContact CB-CE2 4.15Å; V234-F245 HydrophobicContact CG2-CD2 3.94Å; V234-F245 HydrophobicContact CG2-CE2 3.62Å; H243-F245 HydrophobicContact CB-CD2 4.43Å; H243-F245 HydrophobicContact CB-CE2 3.48Å; H243-F245 VanDerWaalsContact CB-CE2 3.48Å; H243-F245 HydrophobicContact CB-CZ 3.64Å; F245-F253 HydrophobicContact CD1-CB 4.37Å; F245-L254 CarbonylContact C-O 3.52Å; F245-L254 WeakPolarHBondContact CA-O 3.07Å; F245-D255 WeakPolarHBondContact CD1-OD1 3.26Å; F245-D255 WeakPolarHBondContact CE1-OD1 3.34Å
246	Q	96.3	Very high	95.2	Very high	79 Å²	79	33.1 Å²	33.1	37%	0.369	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.6	166.2	-179.8	175.4	-10.4	0	0	108.8	N230 T248 L254 V256	N230-Q246 PolarHBondContact ND2-NE2 3.39Å; N230-Q246 CarbonylContact O-C 3.57Å; N230-Q246 WeakPolarHBondContact O-CA 3.4Å; Q246-T248 PolarHBondContact O-N 3.18Å; Q246-L254 HydrophobicContact CB-CB 4.36Å; Q246-L254 HydrophobicContact CB-CD2 4.43Å; Q246-L254 PolarHBondContact N-O 3.09Å; Q246-L254 WeakPolarHBondContact O-CB 3.35Å; Q246-L254 PolarHBondContact O-N 3.29Å; Q246-V256 HydrophobicContact CB-CG2 3.57Å
247	V	96.1	Very high	95.1	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.042	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	118	172.2	-177.6	0	0	0	0	108	T151 I158 I198 L227 N230 L232 T252 F253	T151-V247 HydrophobicContact CG2-CG1 4.15Å; I158-V247 HydrophobicContact CD1-CG2 4.07Å; I198-V247 HydrophobicContact CD1-CG1 3.54Å; L227-V247 HydrophobicContact CD1-CG2 4.13Å; N230-V247 PolarHBondContact O-N 3.06Å; L232-V247 HydrophobicContact CB-CG2 4.32Å; V247-T252 WeakPolarHBondContact CA-O 3.41Å; V247-F253 HydrophobicContact CG2-CD1 4.33Å; V247-F253 HydrophobicContact CG2-CE1 4.3Å
248	T	95.8	Very high	95	Very high	24 Å²	24	40.2 Å²	40.2	15%	0.147	22%	0.218	C	C	.	.			trans	-76.9	157.8	178.6	66.8	0	0	0	0	111	Q246 D250 G251 T252 L254	Q246-T248 PolarHBondContact O-N 3.18Å; T248-D250 PolarHBondContact O-N 3Å; T248-D250 VanDerWaalsContact O-N 3.11Å; T248-G251 PolarHBondContact O-N 3.38Å; T248-G251 PolarHBondContact OG1-N 2.86Å; T248-T252 WeakPolarHBondContact CG2-OG1 3.34Å; T248-T252 PolarHBondContact N-O 3.47Å; T248-T252 PolarHBondContact OG1-N 3.44Å; T248-T252 PolarHBondContact OG1-O 3.46Å; T248-T252 PolarHBondContact OG1-OG1 2.66Å; T248-L254 HydrophobicContact CG2-CB 4.21Å
249	P	93.1	Very high	95.1	Very high	99 Å²	99	40.1 Å²	40.1	64%	0.643	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.7	172.7	-24	35	0	0	0	114.4	R155 Y156	R155-P249 PolarHBondContact NH1-O 2.99Å; R155-P249 VanDerWaalsContact NH1-O 3.08Å; Y156-P249 WeakPolarHBondContact CE2-O 3.25Å; Y156-P249 PolarHBondContact OH-O 2.83Å; Y156-P249 VanDerWaalsContact OH-O 3.11Å
250	D	92.8	Very high	95.2	Very high	123 Å²	123	40 Å²	40	66%	0.658	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-5.1	177.4	-61.2	-44.6	0	0	0	112.9	Y156 T248	Y156-D250 WeakPolarHBondContact OH-CA 3.19Å; Y156-D250 PolarHBondContact OH-O 3.44Å; T248-D250 PolarHBondContact O-N 3Å; T248-D250 VanDerWaalsContact O-N 3.11Å
251	G	93.1	Very high	95	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	85.2	36.9	176.8	0	0	0	0	0	113.6	Y156 I198 C207 T248	Y156-G251 PolarHBondContact OH-N 2.9Å; I198-G251 WeakPolarHBondContact CG2-O 3.39Å; C207-G251 WeakPolarHBondContact CB-O 3.26Å; T248-G251 PolarHBondContact O-N 3.38Å; T248-G251 PolarHBondContact OG1-N 2.86Å
252	T	96.5	Very high	94.8	Very high	54 Å²	54	42.7 Å²	42.7	33%	0.331	23%	0.228	S	C	.	.			trans	-116.9	157.2	174.8	63.3	0	0	0	0	111.6	D208 V247 T248	D208-T252 HydrophobicContact CB-CG2 4.29Å; V247-T252 WeakPolarHBondContact CA-O 3.41Å; T248-T252 WeakPolarHBondContact CG2-OG1 3.34Å; T248-T252 PolarHBondContact N-O 3.47Å; T248-T252 PolarHBondContact OG1-N 3.44Å; T248-T252 PolarHBondContact OG1-O 3.46Å; T248-T252 PolarHBondContact OG1-OG1 2.66Å
253	F	97.1	Very high	94.5	Very high	4 Å²	4	43 Å²	43	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115	175.3	-62.6	-63.6	0	0	0	110	I158 L196 I198 D208 R210 L232 F245 V247	I158-F253 HydrophobicContact CD1-CE1 4Å; I158-F253 HydrophobicContact CD1-CZ 4.46Å; I158-F253 HydrophobicContact CG1-CE1 4.21Å; I158-F253 HydrophobicContact CG1-CZ 4.19Å; I158-F253 HydrophobicContact CG2-CZ 4.09Å; L196-F253 HydrophobicContact CB-CZ 4.49Å; I198-F253 HydrophobicContact CB-CE1 4.33Å; I198-F253 HydrophobicContact CB-CE2 3.9Å; I198-F253 HydrophobicContact CB-CZ 3.65Å; I198-F253 HydrophobicContact CG2-CD2 4.07Å; I198-F253 HydrophobicContact CG2-CE2 3.58Å; I198-F253 HydrophobicContact CG2-CZ 3.83Å; D208-F253 HydrophobicContact CB-CD2 4.18Å; D208-F253 PolarHBondContact OD2-N 3.49Å; R210-F253 HydrophobicContact CB-CD2 4.28Å; R210-F253 HydrophobicContact CG-CB 3.69Å; R210-F253 HydrophobicContact CG-CD2 3.56Å; R210-F253 HydrophobicContact CG-CE2 4.44Å; R210-F253 HydrophobicContact CG-CG 3.87Å; R210-F253 PolarHBondContact NH2-O 3.13Å; L232-F253 HydrophobicContact CD2-CD1 4.05Å; L232-F253 HydrophobicContact CD2-CE1 3.61Å; L232-F253 HydrophobicContact CD2-CZ 4.44Å; F245-F253 HydrophobicContact CD1-CB 4.37Å; V247-F253 HydrophobicContact CG2-CD1 4.33Å; V247-F253 HydrophobicContact CG2-CE1 4.3Å
254	L	96.8	Very high	94.1	Very high	88 Å²	88	46.5 Å²	46.5	46%	0.461	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.2	172.3	-174	136.1	0	0	0	109.4	F245 Q246 T248 V256	F245-L254 CarbonylContact C-O 3.52Å; F245-L254 WeakPolarHBondContact CA-O 3.07Å; Q246-L254 HydrophobicContact CB-CB 4.36Å; Q246-L254 HydrophobicContact CB-CD2 4.43Å; Q246-L254 PolarHBondContact N-O 3.09Å; Q246-L254 WeakPolarHBondContact O-CB 3.35Å; Q246-L254 PolarHBondContact O-N 3.29Å; T248-L254 HydrophobicContact CG2-CB 4.21Å; L254-V256 HydrophobicContact CD2-CG2 4.03Å; L254-V256 PolarHBondContact O-N 3.37Å
255	D	94.1	Very high	93.4	Very high	109 Å²	109	53 Å²	53	58%	0.583	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	114.1	179	-61.3	-10	0	0	0	108.7	R210 F245	R210-D255 IonicContact NE-OD1 3.65Å; R210-D255 PolarHBondContact NE-OD1 3.39Å; F245-D255 WeakPolarHBondContact CD1-OD1 3.26Å; F245-D255 WeakPolarHBondContact CE1-OD1 3.34Å
256	V	92.3	Very high	92.9	Very high	40 Å²	40	56.7 Å²	56.7	24%	0.242	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-52.6	-177.8	179.4	0	0	0	0	110.3	V244 Q246 L254	V244-V256 HydrophobicContact CG1-CB 4.35Å; V244-V256 WeakPolarHBondContact O-CB 3.24Å; V244-V256 PolarHBondContact O-N 3.01Å; Q246-V256 HydrophobicContact CB-CG2 3.57Å; L254-V256 HydrophobicContact CD2-CG2 4.03Å; L254-V256 PolarHBondContact O-N 3.37Å
257	R	93	Very high	92.5	Very high	73 Å²	73	54.4 Å²	54.4	28%	0.275	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	164.8	-179.8	60.2	-169.7	63.1	-178.7	-0.9	112.6	V244 I259 M373	V244-R257 HydrophobicContact CB-CG 3.84Å; V244-R257 HydrophobicContact CG1-CG 4.48Å; V244-R257 HydrophobicContact CG2-CG 4.05Å; V244-R257 PolarHBondContact N-O 2.96Å; V244-R257 PolarHBondContact O-N 2.96Å; R257-I259 HydrophobicContact CG-CD1 4.34Å; R257-I259 HydrophobicContact CG-CG1 4.29Å; R257-M373 VanDerWaalsContact NH1-C 3.34Å; R257-M373 PolarHBondContact NH1-O 3.21Å
258	T	94	Very high	91.9	Very high	78 Å²	78	57 Å²	57	48%	0.479	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.1	174.6	-63	0	0	0	0	109.3	T241	T241-T258 HydrophobicContact CG2-CG2 3.11Å
259	I	95.5	Very high	91.4	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.8	-173	-59	162.7	0	0	0	109.1	I242 V244 R257 L298 L345 Y371 M373	I242-I259 HydrophobicContact CB-CB 4.31Å; I242-I259 PolarHBondContact N-O 3.15Å; I242-I259 PolarHBondContact O-N 2.94Å; V244-I259 HydrophobicContact CG2-CD1 3.88Å; R257-I259 HydrophobicContact CG-CD1 4.34Å; R257-I259 HydrophobicContact CG-CG1 4.29Å; I259-L298 HydrophobicContact CG2-CD1 4.13Å; I259-L298 HydrophobicContact CG2-CD2 4.07Å; I259-L345 HydrophobicContact CD1-CD1 3.67Å; I259-Y371 HydrophobicContact CD1-CE1 4.14Å; I259-Y371 HydrophobicContact CG2-CD1 4.44Å; I259-Y371 HydrophobicContact CG2-CE1 3.78Å; I259-M373 HydrophobicContact CD1-CB 4.2Å; I259-M373 HydrophobicContact CD1-CG 3.66Å; I259-M373 HydrophobicContact CD1-SD 3.83Å
260	G	93.6	Very high	91	Very high	4 Å²	4	61 Å²	61	4%	0.041	31%	0.314	C	S	.	.	S	Bend	trans	167.6	-98.2	-177.8	0	0	0	0	0	112	F262 L298	G260-F262 VanDerWaalsContact C-N 3.26Å; G260-F262 PolarHBondContact N-O 2.65Å; G260-F262 PolarHBondContact O-N 2.82Å; G260-L298 WeakPolarHBondContact O-CB 3.39Å; G260-L298 PolarHBondContact O-N 2.86Å
261	R	91.1	Very high	90.4	Very high	34 Å²	34	58.1 Å²	58.1	13%	0.128	30%	0.299	C	S	.	.	S	Bend	trans	-50.2	-49.8	171.6	-173	-173.7	-173.5	-151.6	8.1	110.7	N179 E281 D292 S297	N179-R261 HydrophobicContact CB-CB 4.43Å; R261-E281 IonicContact CZ-OE2 4Å; R261-E281 IonicContact NH1-OE2 3.28Å; R261-E281 PolarHBondContact NH1-OE2 2.99Å; R261-E281 IonicContact NH2-OE1 2.86Å; R261-E281 PolarHBondContact NH2-OE1 2.85Å; R261-E281 IonicContact NH2-OE2 3.73Å; R261-E281 PolarHBondContact NH2-OE2 2.8Å; R261-D292 IonicContact CZ-OD2 3.06Å; R261-D292 IonicContact NE-OD2 3.06Å; R261-D292 PolarHBondContact NE-OD2 2.87Å; R261-D292 IonicContact NH2-OD1 3.9Å; R261-D292 PolarHBondContact NH2-OD1 2.78Å; R261-D292 IonicContact NH2-OD2 3.24Å; R261-D292 PolarHBondContact NH2-OD2 2.93Å; R261-S297 VanDerWaalsContact O-CB 3.32Å; R261-S297 WeakPolarHBondContact O-CB 3.46Å; R261-S297 PolarHBondContact O-N 2.91Å; R261-S297 PolarHBondContact O-OG 3.29Å
262	F	91.1	Very high	89.8	Confident	35 Å²	35	58.8 Å²	58.8	15%	0.154	30%	0.304	C	S	.	.			trans	-115.7	162.2	175.7	-59.3	-47.1	0	0	0	111.4	G260 D267 L268 L271	G260-F262 VanDerWaalsContact C-N 3.26Å; G260-F262 PolarHBondContact N-O 2.65Å; G260-F262 PolarHBondContact O-N 2.82Å; F262-D267 HydrophobicContact CB-CB 3.77Å; F262-D267 WeakPolarHBondContact CB-OD2 3.5Å; F262-D267 HydrophobicContact CD1-CB 3.62Å; F262-D267 HydrophobicContact CE1-CB 4.43Å; F262-D267 HydrophobicContact CG-CB 3.69Å; F262-L268 HydrophobicContact CD2-CB 4.16Å; F262-L268 HydrophobicContact CE2-CB 3.77Å; F262-L268 HydrophobicContact CE2-CD1 3.88Å; F262-L268 HydrophobicContact CE2-CG 4.29Å; F262-L268 HydrophobicContact CZ-CB 4.38Å; F262-L268 HydrophobicContact CZ-CD1 4.09Å; F262-L271 HydrophobicContact CD1-CD1 4.19Å; F262-L271 HydrophobicContact CE1-CD1 3.24Å; F262-L271 HydrophobicContact CZ-CD1 3.7Å
263	C	91	Very high	89.2	Confident	7 Å²	7	59.8 Å²	59.8	5%	0.047	32%	0.317	C	S	.	.	S	Bend	trans	-118	-29.3	177	-69.8	0	0	0	0	111.9	D267 L298 Y371 T376	C263-D267 PolarHBondContact N-OD2 3.11Å; C263-L298 PolarHBondContact SG-N 2.92Å; C263-L298 VanDerWaalsContact SG-N 3.42Å; C263-Y371 WeakPolarHBondContact CB-OH 3.49Å; C263-T376 HydrophobicContact CB-CG2 4.07Å
264	Y	89.1	Confident	88.3	Confident	101 Å²	101	64.6 Å²	64.6	40%	0.396	35%	0.346	S	S	.	.	S	Bend	trans	-105.4	155.1	168.7	-60.9	-76.3	0	0	0	111	D266 D267 R301 S375 T376	Y264-D266 VanDerWaalsContact C-N 3.33Å; Y264-D266 VanDerWaalsContact CB-OD1 3.31Å; Y264-D266 WeakPolarHBondContact CB-OD1 3.41Å; Y264-D267 PolarHBondContact N-OD2 2.75Å; Y264-D267 WeakPolarHBondContact O-CB 3.46Å; Y264-R301 VanDerWaalsContact CE2-NH2 3.32Å; Y264-S375 PolarHBondContact OH-O 2.92Å; Y264-T376 HydrophobicContact CD1-CG2 3.65Å; Y264-T376 HydrophobicContact CD2-CG2 4.3Å; Y264-T376 HydrophobicContact CE1-CG2 3.31Å; Y264-T376 HydrophobicContact CE2-CG2 4.02Å; Y264-T376 WeakPolarHBondContact CE2-OG1 3.42Å; Y264-T376 HydrophobicContact CG-CG2 4.13Å; Y264-T376 PolarHBondContact OH-OG1 2.94Å
265	E	83.1	Confident	87.2	Confident	141 Å²	141	66.8 Å²	66.8	66%	0.659	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.1	-178.6	-71.1	167.2	-147.5	0	0	112.5
266	D	86.4	Confident	85.9	Confident	90 Å²	90	65.2 Å²	65.2	48%	0.481	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	1.9	-179.9	62.9	-29	0	0	0	113.9	Y264 L268 L269 T270	Y264-D266 VanDerWaalsContact C-N 3.33Å; Y264-D266 VanDerWaalsContact CB-OD1 3.31Å; Y264-D266 WeakPolarHBondContact CB-OD1 3.41Å; D266-L268 VanDerWaalsContact C-N 3.27Å; D266-L268 PolarHBondContact O-N 3.46Å; D266-L269 WeakPolarHBondContact O-CB 3.46Å; D266-L269 PolarHBondContact O-N 3.39Å; D266-L269 VanDerWaalsContact O-N 3.13Å; D266-T270 PolarHBondContact O-N 2.83Å; D266-T270 PolarHBondContact O-OG1 2.88Å
267	D	86.9	Confident	84.6	Confident	30 Å²	30	71.2 Å²	71.2	16%	0.16	38%	0.377	C	S	.	.	H	α-helix	trans	-56.5	-42.7	176.8	-80.5	-22.2	0	0	0	111.1	F262 C263 Y264 L269 T270 L271	F262-D267 HydrophobicContact CB-CB 3.77Å; F262-D267 WeakPolarHBondContact CB-OD2 3.5Å; F262-D267 HydrophobicContact CD1-CB 3.62Å; F262-D267 HydrophobicContact CE1-CB 4.43Å; F262-D267 HydrophobicContact CG-CB 3.69Å; C263-D267 PolarHBondContact N-OD2 3.11Å; Y264-D267 PolarHBondContact N-OD2 2.75Å; Y264-D267 WeakPolarHBondContact O-CB 3.46Å; D267-L269 VanDerWaalsContact C-N 3.34Å; D267-L269 PolarHBondContact O-N 3.18Å; D267-T270 PolarHBondContact O-N 3.38Å; D267-L271 PolarHBondContact O-N 3.33Å
268	L	83.4	Confident	83.1	Confident	61 Å²	61	68.2 Å²	68.2	32%	0.319	37%	0.368	S	S	.	.	H	α-helix	trans	-65.3	-38.7	179.4	-179.9	59.1	0	0	0	111.9	F262 D266 T270 L271 S272	F262-L268 HydrophobicContact CD2-CB 4.16Å; F262-L268 HydrophobicContact CE2-CB 3.77Å; F262-L268 HydrophobicContact CE2-CD1 3.88Å; F262-L268 HydrophobicContact CE2-CG 4.29Å; F262-L268 HydrophobicContact CZ-CB 4.38Å; F262-L268 HydrophobicContact CZ-CD1 4.09Å; D266-L268 VanDerWaalsContact C-N 3.27Å; D266-L268 PolarHBondContact O-N 3.46Å; L268-T270 VanDerWaalsContact C-N 3.34Å; L268-L271 PolarHBondContact O-N 3.33Å; L268-S272 WeakPolarHBondContact O-CB 3.33Å; L268-S272 PolarHBondContact O-N 3.47Å; L268-S272 PolarHBondContact O-OG 2.83Å
269	L	84.9	Confident	81.4	Confident	125 Å²	125	69 Å²	69	65%	0.654	37%	0.366	S	S	*	.	H	α-helix	trans	-65.4	-40.8	176.6	-178.4	65.4	0	0	0	110.9	D266 D267 S272 A273	D266-L269 WeakPolarHBondContact O-CB 3.46Å; D266-L269 PolarHBondContact O-N 3.39Å; D266-L269 VanDerWaalsContact O-N 3.13Å; D267-L269 VanDerWaalsContact C-N 3.34Å; D267-L269 PolarHBondContact O-N 3.18Å; L269-S272 PolarHBondContact O-N 3.17Å; L269-S272 PolarHBondContact O-OG 3.42Å; L269-A273 PolarHBondContact O-N 3.48Å; L269-A273 VanDerWaalsContact O-N 3.08Å
270	T	84.4	Confident	79.6	Confident	83 Å²	83	71 Å²	71	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-66.1	-42.3	177.6	-57.4	0	0	0	0	111.5	D266 D267 L268 A273	D266-T270 PolarHBondContact O-N 2.83Å; D266-T270 PolarHBondContact O-OG1 2.88Å; D267-T270 PolarHBondContact O-N 3.38Å; L268-T270 VanDerWaalsContact C-N 3.34Å; T270-A273 PolarHBondContact O-N 3.39Å
271	L	81.3	Confident	77.9	Confident	62 Å²	62	72.5 Å²	72.5	33%	0.325	39%	0.389	S	S	.	.	H	α-helix	trans	-67.6	-40.5	177.2	-77.9	168.1	0	0	0	112.5	F262 D267 L268 A273 V274 Y275 A278	F262-L271 HydrophobicContact CD1-CD1 4.19Å; F262-L271 HydrophobicContact CE1-CD1 3.24Å; F262-L271 HydrophobicContact CZ-CD1 3.7Å; D267-L271 PolarHBondContact O-N 3.33Å; L268-L271 PolarHBondContact O-N 3.33Å; L271-A273 VanDerWaalsContact C-N 3.26Å; L271-A273 PolarHBondContact O-N 2.86Å; L271-V274 PolarHBondContact O-N 2.84Å; L271-V274 VanDerWaalsContact O-N 3.14Å; L271-Y275 HydrophobicContact CD2-CD2 3.89Å; L271-Y275 HydrophobicContact CD2-CE2 3.91Å; L271-Y275 PolarHBondContact O-N 3.45Å; L271-A278 HydrophobicContact CB-CB 4.5Å
272	S	81.3	Confident	76.1	Confident	15 Å²	15	74.8 Å²	74.8	11%	0.105	41%	0.41	C	S	.	.	H	α-helix	trans	-66	-29	176.3	69.8	0	0	0	0	111.9	L268 L269 V274 Q279	L268-S272 WeakPolarHBondContact O-CB 3.33Å; L268-S272 PolarHBondContact O-N 3.47Å; L268-S272 PolarHBondContact O-OG 2.83Å; L269-S272 PolarHBondContact O-N 3.17Å; L269-S272 PolarHBondContact O-OG 3.42Å; S272-V274 PolarHBondContact O-N 2.95Å; S272-Q279 VanDerWaalsContact O-CD 3.3Å; S272-Q279 WeakPolarHBondContact O-CG 3.42Å; S272-Q279 PolarHBondContact O-NE2 3.37Å
273	A	82.1	Confident	74.2	Confident	74 Å²	74	80.8 Å²	80.8	61%	0.612	44%	0.439	S	S	*	.	H	α-helix	trans	-64.2	-27.4	173.2	0	0	0	0	0	113.6	L269 T270 L271	L269-A273 PolarHBondContact O-N 3.48Å; L269-A273 VanDerWaalsContact O-N 3.08Å; T270-A273 PolarHBondContact O-N 3.39Å; L271-A273 VanDerWaalsContact C-N 3.26Å; L271-A273 PolarHBondContact O-N 2.86Å
274	V	79.8	Confident	72.2	Confident	105 Å²	105	84.6 Å²	84.6	64%	0.636	46%	0.462	S	S	*	.	H	α-helix	trans	-104.6	-38.1	-173.1	-179.1	0	0	0	0	112.7	L271 S272	L271-V274 PolarHBondContact O-N 2.84Å; L271-V274 VanDerWaalsContact O-N 3.14Å; S272-V274 PolarHBondContact O-N 2.95Å
275	Y	73.3	Confident	70.3	Confident	134 Å²	134	83 Å²	83	53%	0.525	48%	0.476	S	S	.	.			trans	-109.3	117.2	-174.8	-65.8	-76.8	0	0	0	111.1	L271 E277 A278 Q279	L271-Y275 HydrophobicContact CD2-CD2 3.89Å; L271-Y275 HydrophobicContact CD2-CE2 3.91Å; L271-Y275 PolarHBondContact O-N 3.45Å; Y275-E277 PolarHBondContact O-N 3.35Å; Y275-A278 WeakPolarHBondContact O-CB 3.32Å; Y275-A278 PolarHBondContact O-N 3.4Å; Y275-Q279 PolarHBondContact O-N 3.19Å; Y275-Q279 VanDerWaalsContact O-N 3.16Å
276	A	66.3	Low	68.7	Low	76 Å²	76	83.8 Å²	83.8	63%	0.628	48%	0.477	S	S	*	.	H	α-helix	trans	-58.2	-31.1	177.1	0	0	0	0	0	113	A278 Q279 A280	A276-A278 VanDerWaalsContact C-N 3.31Å; A276-A278 PolarHBondContact O-N 2.91Å; A276-Q279 WeakPolarHBondContact O-CB 3.24Å; A276-Q279 PolarHBondContact O-N 3.25Å; A276-A280 PolarHBondContact O-N 2.98Å; A276-A280 VanDerWaalsContact O-N 3.14Å
277	E	65.3	Low	67.3	Low	166 Å²	166	81.3 Å²	81.3	78%	0.776	47%	0.466	S	S	*	.	H	α-helix	trans	-61.5	-38.4	174.1	-64.1	178.9	173.5	0	0	111.7	Y275 A280 E281	Y275-E277 PolarHBondContact O-N 3.35Å; E277-A280 PolarHBondContact O-N 2.95Å; E277-E281 PolarHBondContact O-N 3.44Å
278	A	61.3	Low	66.2	Low	11 Å²	11	88.5 Å²	88.5	9%	0.091	49%	0.491	C	S	.	.	H	α-helix	trans	-78.1	-22.6	176	0	0	0	0	0	113.1	L271 Y275 A276 E281	L271-A278 HydrophobicContact CB-CB 4.5Å; Y275-A278 WeakPolarHBondContact O-CB 3.32Å; Y275-A278 PolarHBondContact O-N 3.4Å; A276-A278 VanDerWaalsContact C-N 3.31Å; A276-A278 PolarHBondContact O-N 2.91Å; A278-E281 WeakPolarHBondContact O-CB 3.5Å; A278-E281 PolarHBondContact O-N 3.36Å
279	Q	58.9	Low	65.4	Low	94 Å²	94	86.9 Å²	86.9	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-68.2	-39.8	169.1	-64.2	-171.9	-12	0	0	111.8	S272 Y275 A276 E281 S282	S272-Q279 VanDerWaalsContact O-CD 3.3Å; S272-Q279 WeakPolarHBondContact O-CG 3.42Å; S272-Q279 PolarHBondContact O-NE2 3.37Å; Y275-Q279 PolarHBondContact O-N 3.19Å; Y275-Q279 VanDerWaalsContact O-N 3.16Å; A276-Q279 WeakPolarHBondContact O-CB 3.24Å; A276-Q279 PolarHBondContact O-N 3.25Å; Q279-E281 VanDerWaalsContact C-N 3.26Å; Q279-E281 PolarHBondContact O-N 2.86Å; Q279-S282 PolarHBondContact O-N 3.4Å; Q279-S282 VanDerWaalsContact O-N 3.16Å
280	A	57.3	Low	64.7	Low	44 Å²	44	85.2 Å²	85.2	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-65	-30.2	176.3	0	0	0	0	0	112.4	A276 E277 S282 Q283 T284	A276-A280 PolarHBondContact O-N 2.98Å; A276-A280 VanDerWaalsContact O-N 3.14Å; E277-A280 PolarHBondContact O-N 2.95Å; A280-S282 VanDerWaalsContact C-N 3.28Å; A280-S282 PolarHBondContact O-N 2.92Å; A280-Q283 PolarHBondContact O-N 3Å; A280-T284 PolarHBondContact O-N 2.82Å; A280-T284 VanDerWaalsContact O-N 3.17Å; A280-T284 PolarHBondContact O-OG1 3.27Å
281	E	58.2	Low	64.1	Low	34 Å²	34	85.6 Å²	85.6	16%	0.159	47%	0.471	C	S	.	.	H	α-helix	trans	-60.3	-35.4	172.6	-68.5	-174.7	176.5	0	0	112.4	R261 E277 A278 Q279 Q283 P287	R261-E281 IonicContact CZ-OE2 4Å; R261-E281 IonicContact NH1-OE2 3.28Å; R261-E281 PolarHBondContact NH1-OE2 2.99Å; R261-E281 IonicContact NH2-OE1 2.86Å; R261-E281 PolarHBondContact NH2-OE1 2.85Å; R261-E281 IonicContact NH2-OE2 3.73Å; R261-E281 PolarHBondContact NH2-OE2 2.8Å; E277-E281 PolarHBondContact O-N 3.44Å; A278-E281 WeakPolarHBondContact O-CB 3.5Å; A278-E281 PolarHBondContact O-N 3.36Å; Q279-E281 VanDerWaalsContact C-N 3.26Å; Q279-E281 PolarHBondContact O-N 2.86Å; E281-Q283 VanDerWaalsContact C-N 3.29Å; E281-Q283 PolarHBondContact O-N 2.8Å; E281-P287 HydrophobicContact CB-CB 4.47Å; E281-P287 HydrophobicContact CG-CB 4.33Å
282	S	53.7	Low	63.9	Low	82 Å²	82	84.3 Å²	84.3	57%	0.573	46%	0.464	S	S	*	.	H	α-helix	trans	-75	-17.9	-179.4	-56.8	0	0	0	0	113.1	Q279 A280	Q279-S282 PolarHBondContact O-N 3.4Å; Q279-S282 VanDerWaalsContact O-N 3.16Å; A280-S282 VanDerWaalsContact C-N 3.28Å; A280-S282 PolarHBondContact O-N 2.92Å
283	Q	50.1	Low	63.8	Low	161 Å²	161	93 Å²	93	75%	0.752	50%	0.5	S	S	*	.	H	α-helix	trans	-110.5	-25.1	-169.7	-66.5	-176.6	1.3	0	0	114.5	A280 E281	A280-Q283 PolarHBondContact O-N 3Å; E281-Q283 VanDerWaalsContact C-N 3.29Å; E281-Q283 PolarHBondContact O-N 2.8Å
284	T	49.3	Very low	64	Low	88 Å²	88	94 Å²	94	54%	0.54	50%	0.499	S	S	.	.	S	Bend	trans	-110.5	3.4	-164.4	56.4	0	0	0	0	116.3	A280 F286	A280-T284 PolarHBondContact O-N 2.82Å; A280-T284 VanDerWaalsContact O-N 3.17Å; A280-T284 PolarHBondContact O-OG1 3.27Å; T284-F286 PolarHBondContact O-N 3.16Å
285	G	49.7	Very low	64.5	Low	66 Å²	66	91.1 Å²	91.1	68%	0.68	48%	0.479	S	S	*	.	S	Bend	trans	65.6	-7.3	172.4	0	0	0	0	0	116.4
286	F	49.6	Very low	65.4	Low	158 Å²	158	85 Å²	85	69%	0.693	46%	0.455	S	S	*	.			trans	-125.6	85.9	176.9	-69.5	-77.6	0	0	0	110.1	T284 R288	T284-F286 PolarHBondContact O-N 3.16Å; F286-R288 PolarHBondContact O-N 3.03Å
287	P	57.3	Low	66.6	Low	39 Å²	39	82.9 Å²	82.9	25%	0.253	44%	0.436	S	S	.	.			trans	-77.7	127.5	-173.9	35.1	-37.3	0	0	0	109.3	E281 L289	E281-P287 HydrophobicContact CB-CB 4.47Å; E281-P287 HydrophobicContact CG-CB 4.33Å; P287-L289 HydrophobicContact CB-CD1 3.94Å; P287-L289 HydrophobicContact CB-CD2 3.65Å; P287-L289 HydrophobicContact CB-CG 3.51Å; P287-L289 HydrophobicContact CG-CD1 3.51Å; P287-L289 HydrophobicContact CG-CD2 4.2Å; P287-L289 HydrophobicContact CG-CG 3.65Å; P287-L289 PolarHBondContact O-N 2.74Å
288	R	62.1	Low	68.1	Low	181 Å²	181	75.1 Å²	75.1	68%	0.683	40%	0.4	S	S	*	.			trans	-76.8	44	177.1	-65.9	-174	179.4	-176.2	1	111.8	F174 F286 Y290 T291	F174-R288 HydrophobicContact CZ-CG 4.44Å; F286-R288 PolarHBondContact O-N 3.03Å; R288-Y290 PolarHBondContact O-N 2.95Å; R288-Y290 VanDerWaalsContact O-N 3.1Å; R288-T291 PolarHBondContact O-N 2.89Å; R288-T291 PolarHBondContact O-OG1 3.42Å
289	L	68.1	Low	69.7	Low	27 Å²	27	74.7 Å²	74.7	14%	0.141	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-58.6	-30.6	-168.2	-57.2	171.5	0	0	0	113.6	R178 N179 N180 P287 T291	R178-L289 HydrophobicContact CB-CD1 4.42Å; R178-L289 WeakPolarHBondContact O-CB 3.27Å; R178-L289 WeakPolarHBondContact O-CD1 3.33Å; N179-L289 WeakPolarHBondContact CA-O 3.38Å; N180-L289 PolarHBondContact N-O 3.08Å; P287-L289 HydrophobicContact CB-CD1 3.94Å; P287-L289 HydrophobicContact CB-CD2 3.65Å; P287-L289 HydrophobicContact CB-CG 3.51Å; P287-L289 HydrophobicContact CG-CD1 3.51Å; P287-L289 HydrophobicContact CG-CD2 4.2Å; P287-L289 HydrophobicContact CG-CG 3.65Å; P287-L289 PolarHBondContact O-N 2.74Å; L289-T291 PolarHBondContact O-N 3.02Å
290	Y	70.1	Confident	71.4	Confident	90 Å²	90	74.9 Å²	74.9	35%	0.353	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-68.9	-21	178.8	-173.4	-106.9	0	0	0	113.4	F173 Y177 N179 N180 R288	F173-Y290 AromaticContact CE1-CD1 3.9Å; F173-Y290 HydrophobicContact CE1-CD1 3.9Å; F173-Y290 HydrophobicContact CE1-CG 4.12Å; F173-Y290 AromaticContact CZ-CD1 3.7Å; F173-Y290 HydrophobicContact CZ-CD1 3.7Å; F173-Y290 HydrophobicContact CZ-CE1 4.01Å; F173-Y290 HydrophobicContact CZ-CG 4.18Å; Y177-Y290 AromaticContact CD1-CD2 3.89Å; Y177-Y290 HydrophobicContact CD1-CD2 3.89Å; Y177-Y290 AromaticContact CD1-CE2 3.64Å; Y177-Y290 HydrophobicContact CD1-CE2 3.64Å; Y177-Y290 HydrophobicContact CE1-CE2 4.34Å; Y177-Y290 HydrophobicContact CG-CD2 4.02Å; Y177-Y290 HydrophobicContact CG-CE2 4.17Å; Y177-Y290 HydrophobicContact CG-CG 4.49Å; N179-Y290 WeakPolarHBondContact O-CD2 3.49Å; N180-Y290 WeakPolarHBondContact CB-O 3.46Å; R288-Y290 PolarHBondContact O-N 2.95Å; R288-Y290 VanDerWaalsContact O-N 3.1Å
291	T	70.4	Confident	73.3	Confident	90 Å²	90	76.1 Å²	76.1	55%	0.552	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-92.4	4.2	-173.7	62.4	0	0	0	0	114.5	R288 L289 K293	R288-T291 PolarHBondContact O-N 2.89Å; R288-T291 PolarHBondContact O-OG1 3.42Å; L289-T291 PolarHBondContact O-N 3.02Å; T291-K293 PolarHBondContact O-N 3.44Å
292	D	77.3	Confident	75.1	Confident	36 Å²	36	74.7 Å²	74.7	19%	0.193	39%	0.385	C	S	.	.			trans	-53.2	122.6	175.1	-77.2	-7.9	0	0	0	110.4	N180 R261 T294	N180-D292 HydrophobicContact CB-CB 4.31Å; N180-D292 PolarHBondContact ND2-O 3.06Å; R261-D292 IonicContact CZ-OD2 3.06Å; R261-D292 IonicContact NE-OD2 3.06Å; R261-D292 PolarHBondContact NE-OD2 2.87Å; R261-D292 IonicContact NH2-OD1 3.9Å; R261-D292 PolarHBondContact NH2-OD1 2.78Å; R261-D292 IonicContact NH2-OD2 3.24Å; R261-D292 PolarHBondContact NH2-OD2 2.93Å; D292-T294 VanDerWaalsContact C-N 3.33Å
293	K	80.6	Confident	77.2	Confident	197 Å²	197	71.1 Å²	71.1	86%	0.857	36%	0.36	S	S	*	.			trans	-78.4	-23	177.3	-66.2	178.5	-177.2	168.9	0	112.2	T291	T291-K293 PolarHBondContact O-N 3.44Å
294	T	84.9	Confident	79.4	Confident	95 Å²	95	65.3 Å²	65.3	58%	0.583	34%	0.336	S	S	*	.	S	Bend	trans	-81.3	151.9	-176.2	50.9	0	0	0	0	111.3	N180 D292	N180-T294 PolarHBondContact ND2-O 3.13Å; D292-T294 VanDerWaalsContact C-N 3.33Å
295	I	90.1	Very high	81.6	Confident	45 Å²	45	64.1 Å²	64.1	23%	0.231	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-73.8	137.7	172.9	-61.6	174.7	0	0	0	108.3	K299 H300 L303 F326 R330	I295-K299 HydrophobicContact CG2-CB 3.63Å; I295-K299 HydrophobicContact CG2-CG 3.51Å; I295-H300 HydrophobicContact CG2-CB 4.15Å; I295-L303 HydrophobicContact CD1-CD1 3.82Å; I295-L303 HydrophobicContact CG2-CD1 4.33Å; I295-F326 HydrophobicContact CD1-CZ 4.35Å; I295-R330 HydrophobicContact CD1-CG 4.42Å
296	N	91.8	Very high	83.8	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.021	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-58.5	151.3	177.7	-73.7	-15.2	0	0	0	111.9	N180 E181 L298 K299 H300	N180-N296 PolarHBondContact OD1-ND2 3.03Å; N180-N296 PolarHBondContact OD1-OD1 2.74Å; E181-N296 HydrophobicContact CG-CB 4.4Å; E181-N296 WeakPolarHBondContact CG-ND2 3.25Å; E181-N296 WeakPolarHBondContact OE1-CB 3.15Å; N296-L298 PolarHBondContact O-N 2.82Å; N296-K299 WeakPolarHBondContact O-CB 3.37Å; N296-K299 PolarHBondContact O-N 2.99Å; N296-K299 VanDerWaalsContact O-N 3.16Å; N296-H300 WeakPolarHBondContact O-CB 3.44Å; N296-H300 PolarHBondContact O-N 2.92Å
297	S	93	Very high	86	Confident	32 Å²	32	58 Å²	58	22%	0.224	28%	0.275	C	S	.	.	H	α-helix	trans	-59.5	-43.7	-170.4	-58.8	0	0	0	0	112.9	R261 H300 R301	R261-S297 VanDerWaalsContact O-CB 3.32Å; R261-S297 WeakPolarHBondContact O-CB 3.46Å; R261-S297 PolarHBondContact O-N 2.91Å; R261-S297 PolarHBondContact O-OG 3.29Å; S297-H300 PolarHBondContact O-N 2.75Å; S297-R301 VanDerWaalsContact O-CG 3.26Å; S297-R301 WeakPolarHBondContact O-CG 3.45Å; S297-R301 PolarHBondContact O-N 2.81Å
298	L	95.7	Very high	87.8	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-44.9	179.1	-178.1	66.7	0	0	0	111.5	I259 G260 C263 N296 R301 L302 M334 I347 Y349 Y371	I259-L298 HydrophobicContact CG2-CD1 4.13Å; I259-L298 HydrophobicContact CG2-CD2 4.07Å; G260-L298 WeakPolarHBondContact O-CB 3.39Å; G260-L298 PolarHBondContact O-N 2.86Å; C263-L298 PolarHBondContact SG-N 2.92Å; C263-L298 VanDerWaalsContact SG-N 3.42Å; N296-L298 PolarHBondContact O-N 2.82Å; L298-R301 PolarHBondContact O-N 2.72Å; L298-L302 PolarHBondContact O-N 3.21Å; L298-L302 VanDerWaalsContact O-N 3.07Å; L298-M334 HydrophobicContact CD2-CE 4.41Å; L298-M334 HydrophobicContact CD2-SD 3.79Å; L298-I347 HydrophobicContact CD2-CD1 4.41Å; L298-Y349 WeakPolarHBondContact CD2-OH 3.43Å; L298-Y371 HydrophobicContact CD1-CD1 4.33Å; L298-Y371 HydrophobicContact CD1-CD2 3.69Å; L298-Y371 HydrophobicContact CD1-CE1 4.29Å; L298-Y371 HydrophobicContact CD1-CE2 3.64Å; L298-Y371 HydrophobicContact CD1-CG 4.04Å
299	K	95.6	Very high	89.2	Confident	1 Å²	1	60.7 Å²	60.7	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-42.8	177.4	-175.1	67.7	57.9	177.1	0	111.7	E181 I295 N296 R301 L302 L303 L332 Y349	E181-K299 WeakPolarHBondContact OE1-CB 3.35Å; E181-K299 VanDerWaalsContact OE1-CG 3.24Å; E181-K299 WeakPolarHBondContact OE1-CG 3.31Å; E181-K299 WeakPolarHBondContact OE2-CE 3.44Å; E181-K299 IonicContact OE2-NZ 3.79Å; I295-K299 HydrophobicContact CG2-CB 3.63Å; I295-K299 HydrophobicContact CG2-CG 3.51Å; N296-K299 WeakPolarHBondContact O-CB 3.37Å; N296-K299 PolarHBondContact O-N 2.99Å; N296-K299 VanDerWaalsContact O-N 3.16Å; K299-R301 VanDerWaalsContact C-N 3.35Å; K299-R301 PolarHBondContact O-N 2.92Å; K299-L302 WeakPolarHBondContact O-CB 3.49Å; K299-L302 PolarHBondContact O-N 3.28Å; K299-L303 HydrophobicContact CG-CD1 4.29Å; K299-L303 WeakPolarHBondContact O-CG 3.29Å; K299-L303 PolarHBondContact O-N 2.92Å; K299-L332 PolarHBondContact NZ-O 2.94Å; K299-Y349 VanDerWaalsContact NZ-CD1 3.35Å
300	H	95.3	Very high	90.4	Very high	99 Å²	99	60 Å²	60	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-60.1	-46.5	177.2	179	-103.7	0	0	0	110.6	I295 N296 S297 L302 L303 V304	I295-H300 HydrophobicContact CG2-CB 4.15Å; N296-H300 WeakPolarHBondContact O-CB 3.44Å; N296-H300 PolarHBondContact O-N 2.92Å; S297-H300 PolarHBondContact O-N 2.75Å; H300-L302 VanDerWaalsContact C-N 3.31Å; H300-L302 PolarHBondContact O-N 2.91Å; H300-L303 PolarHBondContact O-N 3.14Å; H300-L303 VanDerWaalsContact O-N 3.14Å; H300-V304 VanDerWaalsContact CE1-CG2 3.49Å; H300-V304 WeakPolarHBondContact CE1-CG2 3.5Å; H300-V304 WeakPolarHBondContact O-CB 3.35Å; H300-V304 VanDerWaalsContact O-CG2 3.29Å; H300-V304 WeakPolarHBondContact O-CG2 3.42Å; H300-V304 PolarHBondContact O-N 2.94Å
301	R	96.1	Very high	91.5	Very high	69 Å²	69	60.2 Å²	60.2	26%	0.26	28%	0.282	S	S	.	.	H	α-helix	trans	-59.2	-40.2	175.8	-71.6	168.6	178.3	-81.4	-1.2	112.5	Y264 S297 L298 K299 Y305 T376 V378	Y264-R301 VanDerWaalsContact CE2-NH2 3.32Å; S297-R301 VanDerWaalsContact O-CG 3.26Å; S297-R301 WeakPolarHBondContact O-CG 3.45Å; S297-R301 PolarHBondContact O-N 2.81Å; L298-R301 PolarHBondContact O-N 2.72Å; K299-R301 VanDerWaalsContact C-N 3.35Å; K299-R301 PolarHBondContact O-N 2.92Å; R301-Y305 WeakPolarHBondContact O-CB 3.46Å; R301-Y305 PolarHBondContact O-N 3.05Å; R301-T376 WeakPolarHBondContact CD-O 3.46Å; R301-T376 VanDerWaalsContact CZ-O 3.25Å; R301-T376 PolarHBondContact NE-O 3.23Å; R301-T376 PolarHBondContact NH1-O 3.26Å; R301-T376 PolarHBondContact NH1-OG1 3.22Å; R301-T376 VanDerWaalsContact NH1-OG1 3.09Å; R301-T376 PolarHBondContact NH2-OG1 2.73Å; R301-V378 HydrophobicContact CB-CG2 4.06Å
302	L	96.8	Very high	92.5	Very high	4 Å²	4	63.6 Å²	63.6	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-49.3	172.4	171.1	61.3	0	0	0	112	L298 K299 H300 V304 Y305 L306 Y349 V369 V381	L298-L302 PolarHBondContact O-N 3.21Å; L298-L302 VanDerWaalsContact O-N 3.07Å; K299-L302 WeakPolarHBondContact O-CB 3.49Å; K299-L302 PolarHBondContact O-N 3.28Å; H300-L302 VanDerWaalsContact C-N 3.31Å; H300-L302 PolarHBondContact O-N 2.91Å; L302-V304 PolarHBondContact O-N 3.4Å; L302-Y305 PolarHBondContact O-N 2.72Å; L302-L306 HydrophobicContact CD1-CD1 4.21Å; L302-L306 HydrophobicContact CD1-CG 4.37Å; L302-L306 HydrophobicContact CG-CD1 4.43Å; L302-L306 WeakPolarHBondContact O-CG 3.4Å; L302-L306 PolarHBondContact O-N 3.17Å; L302-Y349 HydrophobicContact CD2-CD2 4.18Å; L302-Y349 HydrophobicContact CD2-CE1 4.49Å; L302-Y349 HydrophobicContact CD2-CE2 4.13Å; L302-Y349 HydrophobicContact CD2-CG 4.35Å; L302-V369 HydrophobicContact CD1-CG1 4.33Å; L302-V369 HydrophobicContact CD1-CG2 3.67Å; L302-V369 HydrophobicContact CD2-CG2 4.29Å; L302-V381 HydrophobicContact CD1-CG1 4.14Å; L302-V381 HydrophobicContact CD1-CG2 3.54Å
303	L	96.4	Very high	93.1	Very high	8 Å²	8	67.2 Å²	67.2	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-41.1	179.9	-67.4	174.1	0	0	0	111.8	I295 K299 H300 L306 W307 F326 L329	I295-L303 HydrophobicContact CD1-CD1 3.82Å; I295-L303 HydrophobicContact CG2-CD1 4.33Å; K299-L303 HydrophobicContact CG-CD1 4.29Å; K299-L303 WeakPolarHBondContact O-CG 3.29Å; K299-L303 PolarHBondContact O-N 2.92Å; H300-L303 PolarHBondContact O-N 3.14Å; H300-L303 VanDerWaalsContact O-N 3.14Å; L303-L306 PolarHBondContact O-N 3.46Å; L303-W307 WeakPolarHBondContact O-CB 3.48Å; L303-W307 PolarHBondContact O-N 2.79Å; L303-F326 HydrophobicContact CD1-CE2 4.13Å; L303-F326 HydrophobicContact CD1-CZ 4.38Å; L303-L329 HydrophobicContact CD2-CB 3.73Å
304	V	96.5	Very high	93	Very high	39 Å²	39	60.8 Å²	60.8	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-41.9	175.9	170.6	0	0	0	0	111	H300 L302 L306 W307 R308	H300-V304 VanDerWaalsContact CE1-CG2 3.49Å; H300-V304 WeakPolarHBondContact CE1-CG2 3.5Å; H300-V304 WeakPolarHBondContact O-CB 3.35Å; H300-V304 VanDerWaalsContact O-CG2 3.29Å; H300-V304 WeakPolarHBondContact O-CG2 3.42Å; H300-V304 PolarHBondContact O-N 2.94Å; L302-V304 PolarHBondContact O-N 3.4Å; V304-L306 PolarHBondContact O-N 2.85Å; V304-W307 PolarHBondContact O-N 2.91Å; V304-R308 HydrophobicContact CG1-CG 4.29Å; V304-R308 WeakPolarHBondContact O-CB 3.22Å; V304-R308 WeakPolarHBondContact O-CG 3.31Å; V304-R308 PolarHBondContact O-N 3.07Å
305	Y	96.8	Very high	93.2	Very high	63 Å²	63	58.2 Å²	58.2	25%	0.247	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-47.8	175	178.3	-84.7	0	0	0	111.4	R301 L302 W307 R308 R309 V378 L379 V381	R301-Y305 WeakPolarHBondContact O-CB 3.46Å; R301-Y305 PolarHBondContact O-N 3.05Å; L302-Y305 PolarHBondContact O-N 2.72Å; Y305-W307 VanDerWaalsContact C-N 3.34Å; Y305-W307 PolarHBondContact O-N 3.05Å; Y305-R308 PolarHBondContact O-N 3.44Å; Y305-R309 WeakPolarHBondContact O-CB 3.29Å; Y305-R309 PolarHBondContact O-N 2.98Å; Y305-V378 HydrophobicContact CD1-CG1 4.2Å; Y305-V378 HydrophobicContact CD2-CB 4.23Å; Y305-V378 HydrophobicContact CD2-CG1 3.92Å; Y305-V378 WeakPolarHBondContact CD2-O 3.41Å; Y305-V378 WeakPolarHBondContact CE2-O 3.18Å; Y305-V378 HydrophobicContact CG-CB 4.26Å; Y305-V378 HydrophobicContact CG-CG1 3.74Å; Y305-L379 WeakPolarHBondContact CE2-O 3.23Å; Y305-L379 PolarHBondContact OH-O 3.13Å; Y305-V381 HydrophobicContact CD1-CB 4Å; Y305-V381 HydrophobicContact CD1-CG2 3.36Å; Y305-V381 HydrophobicContact CE1-CB 3.81Å; Y305-V381 HydrophobicContact CE1-CG2 3.59Å; Y305-V381 HydrophobicContact CG-CG2 4.19Å
306	L	95.3	Very high	93.2	Very high	26 Å²	26	58.8 Å²	58.8	14%	0.136	30%	0.298	C	S	.	.	H	α-helix	trans	-63.5	-39.5	178.6	-70.2	174.9	0	0	0	112.2	L302 L303 V304 A310 F322 L329 V381	L302-L306 HydrophobicContact CD1-CD1 4.21Å; L302-L306 HydrophobicContact CD1-CG 4.37Å; L302-L306 HydrophobicContact CG-CD1 4.43Å; L302-L306 WeakPolarHBondContact O-CG 3.4Å; L302-L306 PolarHBondContact O-N 3.17Å; L303-L306 PolarHBondContact O-N 3.46Å; V304-L306 PolarHBondContact O-N 2.85Å; L306-A310 PolarHBondContact O-N 3.14Å; L306-F322 HydrophobicContact CB-CD2 4.14Å; L306-F322 HydrophobicContact CB-CE2 3.92Å; L306-L329 HydrophobicContact CD1-CD1 3.99Å; L306-L329 HydrophobicContact CD1-CD2 4.02Å; L306-V381 HydrophobicContact CD2-CB 4.09Å; L306-V381 HydrophobicContact CD2-CG1 3.89Å; L306-V381 HydrophobicContact CD2-CG2 4.44Å
307	W	95.2	Very high	93.1	Very high	69 Å²	69	63.2 Å²	63.2	26%	0.261	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-51.1	174	171.4	-107.4	0	0	0	112	L303 V304 Y305 R309 A310 E311 K319 F322 F323	L303-W307 WeakPolarHBondContact O-CB 3.48Å; L303-W307 PolarHBondContact O-N 2.79Å; V304-W307 PolarHBondContact O-N 2.91Å; Y305-W307 VanDerWaalsContact C-N 3.34Å; Y305-W307 PolarHBondContact O-N 3.05Å; W307-R309 PolarHBondContact O-N 2.84Å; W307-A310 CarbonylContact O-C 3.52Å; W307-A310 WeakPolarHBondContact O-CB 3.43Å; W307-A310 PolarHBondContact O-N 2.77Å; W307-E311 PolarHBondContact O-N 3.42Å; W307-K319 HydrophobicContact CH2-CB 4.31Å; W307-K319 HydrophobicContact CH2-CD 4Å; W307-K319 HydrophobicContact CH2-CG 4.04Å; W307-K319 HydrophobicContact CZ3-CB 4.07Å; W307-K319 HydrophobicContact CZ3-CD 4.5Å; W307-K319 HydrophobicContact CZ3-CG 4.03Å; W307-F322 HydrophobicContact CB-CE1 4.17Å; W307-F322 HydrophobicContact CB-CE2 4.17Å; W307-F322 HydrophobicContact CB-CZ 3.9Å; W307-F322 HydrophobicContact CD2-CE1 4.45Å; W307-F322 AromaticContact CE3-CD1 3.51Å; W307-F322 HydrophobicContact CE3-CD1 3.51Å; W307-F322 AromaticContact CE3-CE1 3.82Å; W307-F322 HydrophobicContact CE3-CE1 3.82Å; W307-F322 HydrophobicContact CE3-CG 4.08Å; W307-F322 HydrophobicContact CZ3-CD1 4.09Å; W307-F323 HydrophobicContact CE3-CE2 4.27Å; W307-F323 HydrophobicContact CE3-CZ 4.16Å; W307-F323 AromaticContact CH2-CE2 3.6Å; W307-F323 HydrophobicContact CH2-CE2 3.6Å; W307-F323 AromaticContact CH2-CZ 3.78Å; W307-F323 HydrophobicContact CH2-CZ 3.78Å; W307-F323 HydrophobicContact CZ3-CD2 4.14Å; W307-F323 AromaticContact CZ3-CE2 3.29Å; W307-F323 HydrophobicContact CZ3-CE2 3.29Å; W307-F323 AromaticContact CZ3-CZ 3.51Å; W307-F323 HydrophobicContact CZ3-CZ 3.51Å
308	R	95.1	Very high	92.9	Very high	154 Å²	154	62.7 Å²	62.7	58%	0.581	32%	0.323	S	S	*	.	H	α-helix	trans	-58.4	-39	178.6	-75.8	178.6	177.4	176.2	-0	111.5	V304 Y305 E311 Q312	V304-R308 HydrophobicContact CG1-CG 4.29Å; V304-R308 WeakPolarHBondContact O-CB 3.22Å; V304-R308 WeakPolarHBondContact O-CG 3.31Å; V304-R308 PolarHBondContact O-N 3.07Å; Y305-R308 PolarHBondContact O-N 3.44Å; R308-E311 PolarHBondContact O-N 2.75Å; R308-Q312 WeakPolarHBondContact O-CB 3.22Å; R308-Q312 VanDerWaalsContact O-CG 3.24Å; R308-Q312 WeakPolarHBondContact O-CG 3.36Å; R308-Q312 PolarHBondContact O-N 2.71Å
309	R	92.9	Very high	92.6	Very high	123 Å²	123	65.6 Å²	65.6	46%	0.464	34%	0.335	S	S	.	.	H	α-helix	trans	-62.3	-45	173.9	-175.7	179.2	178	169.9	3.1	112	Y305 W307 E311 Q312 D313 V381	Y305-R309 WeakPolarHBondContact O-CB 3.29Å; Y305-R309 PolarHBondContact O-N 2.98Å; W307-R309 PolarHBondContact O-N 2.84Å; R309-E311 VanDerWaalsContact C-N 3.26Å; R309-E311 PolarHBondContact O-N 2.96Å; R309-Q312 PolarHBondContact O-N 2.74Å; R309-D313 PolarHBondContact O-N 3.01Å; R309-D313 VanDerWaalsContact O-N 3.09Å; R309-V381 PolarHBondContact NH1-O 2.65Å
310	A	92.4	Very high	92.5	Very high	11 Å²	11	74.3 Å²	74.3	9%	0.091	37%	0.368	C	S	.	.	H	α-helix	trans	-66.2	-29.7	176	0	0	0	0	0	112.6	L306 W307 A318 F322	L306-A310 PolarHBondContact O-N 3.14Å; W307-A310 CarbonylContact O-C 3.52Å; W307-A310 WeakPolarHBondContact O-CB 3.43Å; W307-A310 PolarHBondContact O-N 2.77Å; A310-A318 HydrophobicContact CB-CB 4.17Å; A310-F322 HydrophobicContact CB-CB 4.42Å
311	E	93.2	Very high	92.3	Very high	95 Å²	95	76.6 Å²	76.6	44%	0.444	37%	0.373	S	S	.	.	H	α-helix	trans	-73.1	-42.7	174.6	-179.1	162.4	-131.1	0	0	112.8	W307 R308 R309 D313 G314 K319	W307-E311 PolarHBondContact O-N 3.42Å; R308-E311 PolarHBondContact O-N 2.75Å; R309-E311 VanDerWaalsContact C-N 3.26Å; R309-E311 PolarHBondContact O-N 2.96Å; E311-D313 VanDerWaalsContact C-N 3.33Å; E311-D313 PolarHBondContact O-N 3.47Å; E311-G314 PolarHBondContact O-N 3.09Å; E311-K319 IonicContact OE1-NZ 2.82Å
312	Q	92.4	Very high	92.1	Very high	162 Å²	162	74.3 Å²	74.3	76%	0.757	37%	0.365	S	S	*	.	H	α-helix	trans	-65	-33.7	176.1	-74.2	169.7	0.8	0	0	113	R308 R309 G314	R308-Q312 WeakPolarHBondContact O-CB 3.22Å; R308-Q312 VanDerWaalsContact O-CG 3.24Å; R308-Q312 WeakPolarHBondContact O-CG 3.36Å; R308-Q312 PolarHBondContact O-N 2.71Å; R309-Q312 PolarHBondContact O-N 2.74Å; Q312-G314 PolarHBondContact O-N 2.77Å
313	D	88.3	Confident	92	Very high	112 Å²	112	80.2 Å²	80.2	60%	0.599	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-18.8	173	-168	51.7	0	0	0	112.2	R309 E311 S315 A318	R309-D313 PolarHBondContact O-N 3.01Å; R309-D313 VanDerWaalsContact O-N 3.09Å; E311-D313 VanDerWaalsContact C-N 3.33Å; E311-D313 PolarHBondContact O-N 3.47Å; D313-S315 PolarHBondContact O-N 3.03Å; D313-A318 HydrophobicContact CB-CB 4.29Å; D313-A318 WeakPolarHBondContact OD2-CB 3.42Å
314	G	80.1	Confident	91.9	Very high	61 Å²	61	86.5 Å²	86.5	63%	0.629	42%	0.42	S	S	*	.			trans	69.3	-11.8	174.9	0	0	0	0	0	115	E311 Q312	E311-G314 PolarHBondContact O-N 3.09Å; Q312-G314 PolarHBondContact O-N 2.77Å
315	S	88.4	Confident	91.7	Very high	41 Å²	41	87.9 Å²	87.9	29%	0.287	42%	0.423	S	S	.	.			trans	-79.8	130.7	-178	-177.6	0	0	0	0	112.8	D313 T317 A318 K319	D313-S315 PolarHBondContact O-N 3.03Å; S315-T317 PolarHBondContact O-N 2.91Å; S315-T317 PolarHBondContact OG-N 3.1Å; S315-T317 PolarHBondContact OG-OG1 3.41Å; S315-A318 PolarHBondContact O-N 3.48Å; S315-A318 VanDerWaalsContact O-N 3.17Å; S315-K319 PolarHBondContact O-N 2.94Å
316	A	89.3	Confident	91.6	Very high	58 Å²	58	87.8 Å²	87.8	48%	0.479	42%	0.424	S	S	.	.	H	α-helix	trans	-59.5	-27.4	171.9	0	0	0	0	0	112.4	R320	A316-R320 WeakPolarHBondContact O-CB 3.45Å; A316-R320 VanDerWaalsContact O-CG 3.25Å; A316-R320 WeakPolarHBondContact O-CG 3.25Å; A316-R320 PolarHBondContact O-N 2.86Å; A316-R320 VanDerWaalsContact O-N 3.09Å
317	T	90.6	Very high	91.4	Very high	97 Å²	97	91 Å²	91	60%	0.595	44%	0.441	S	S	*	.	H	α-helix	trans	-70.5	-38.2	177.6	60	0	0	0	0	112	S315 R320 R321	S315-T317 PolarHBondContact O-N 2.91Å; S315-T317 PolarHBondContact OG-N 3.1Å; S315-T317 PolarHBondContact OG-OG1 3.41Å; T317-R320 PolarHBondContact O-N 3.06Å; T317-R321 VanDerWaalsContact O-CB 3.3Å; T317-R321 WeakPolarHBondContact O-CB 3.11Å; T317-R321 PolarHBondContact O-N 2.91Å
318	A	88.4	Confident	91.3	Very high	20 Å²	20	93.3 Å²	93.3	17%	0.165	46%	0.455	C	S	.	.	H	α-helix	trans	-64.5	-45.4	178	0	0	0	0	0	111.4	A310 D313 S315 R321 F322	A310-A318 HydrophobicContact CB-CB 4.17Å; D313-A318 HydrophobicContact CB-CB 4.29Å; D313-A318 WeakPolarHBondContact OD2-CB 3.42Å; S315-A318 PolarHBondContact O-N 3.48Å; S315-A318 VanDerWaalsContact O-N 3.17Å; A318-R321 PolarHBondContact O-N 3.42Å; A318-F322 PolarHBondContact O-N 3.45Å
319	K	90.8	Very high	91.2	Very high	65 Å²	65	86.8 Å²	86.8	28%	0.283	43%	0.431	S	S	.	.	H	α-helix	trans	-61.2	-46.1	175.1	-66.2	-176.3	177.4	-173.9	0	111.9	W307 E311 S315 R321 F322 F323	W307-K319 HydrophobicContact CH2-CB 4.31Å; W307-K319 HydrophobicContact CH2-CD 4Å; W307-K319 HydrophobicContact CH2-CG 4.04Å; W307-K319 HydrophobicContact CZ3-CB 4.07Å; W307-K319 HydrophobicContact CZ3-CD 4.5Å; W307-K319 HydrophobicContact CZ3-CG 4.03Å; E311-K319 IonicContact OE1-NZ 2.82Å; S315-K319 PolarHBondContact O-N 2.94Å; K319-R321 VanDerWaalsContact C-N 3.33Å; K319-R321 PolarHBondContact O-N 2.86Å; K319-F322 PolarHBondContact O-N 3.37Å; K319-F323 WeakPolarHBondContact O-CD2 3.44Å; K319-F323 PolarHBondContact O-N 3.47Å
320	R	92.8	Very high	91.2	Very high	184 Å²	184	86.3 Å²	86.3	69%	0.694	43%	0.429	S	S	*	.	H	α-helix	trans	-61.2	-41.4	176.2	-74.5	175.1	-173.7	175	3.1	112	A316 T317 F323 Q324	A316-R320 WeakPolarHBondContact O-CB 3.45Å; A316-R320 VanDerWaalsContact O-CG 3.25Å; A316-R320 WeakPolarHBondContact O-CG 3.25Å; A316-R320 PolarHBondContact O-N 2.86Å; A316-R320 VanDerWaalsContact O-N 3.09Å; T317-R320 PolarHBondContact O-N 3.06Å; R320-F323 PolarHBondContact O-N 3.02Å; R320-Q324 WeakPolarHBondContact O-CB 3.36Å; R320-Q324 PolarHBondContact O-N 3.49Å
321	R	90.5	Very high	91.2	Very high	148 Å²	148	94 Å²	94	56%	0.558	46%	0.456	S	S	*	.	H	α-helix	trans	-63.4	-41.7	177.7	-171.8	172.3	178.6	-179.2	-4.4	111.7	T317 A318 K319 Q324 F325	T317-R321 VanDerWaalsContact O-CB 3.3Å; T317-R321 WeakPolarHBondContact O-CB 3.11Å; T317-R321 PolarHBondContact O-N 2.91Å; A318-R321 PolarHBondContact O-N 3.42Å; K319-R321 VanDerWaalsContact C-N 3.33Å; K319-R321 PolarHBondContact O-N 2.86Å; R321-Q324 PolarHBondContact O-N 3.16Å; R321-F325 HydrophobicContact CG-CD2 3.63Å; R321-F325 HydrophobicContact CG-CE2 3.67Å; R321-F325 VanDerWaalsContact O-CD2 3.24Å; R321-F325 WeakPolarHBondContact O-CD2 3.32Å; R321-F325 PolarHBondContact O-N 3.19Å
322	F	93.1	Very high	91.2	Very high	21 Å²	21	90.1 Å²	90.1	9%	0.092	44%	0.438	C	S	.	.	H	α-helix	trans	-57.1	-50.7	173.9	173.5	-95.4	0	0	0	111.4	L306 W307 A310 A318 K319 Q324 F325 F326 L329	L306-F322 HydrophobicContact CB-CD2 4.14Å; L306-F322 HydrophobicContact CB-CE2 3.92Å; W307-F322 HydrophobicContact CB-CE1 4.17Å; W307-F322 HydrophobicContact CB-CE2 4.17Å; W307-F322 HydrophobicContact CB-CZ 3.9Å; W307-F322 HydrophobicContact CD2-CE1 4.45Å; W307-F322 AromaticContact CE3-CD1 3.51Å; W307-F322 HydrophobicContact CE3-CD1 3.51Å; W307-F322 AromaticContact CE3-CE1 3.82Å; W307-F322 HydrophobicContact CE3-CE1 3.82Å; W307-F322 HydrophobicContact CE3-CG 4.08Å; W307-F322 HydrophobicContact CZ3-CD1 4.09Å; A310-F322 HydrophobicContact CB-CB 4.42Å; A318-F322 PolarHBondContact O-N 3.45Å; K319-F322 PolarHBondContact O-N 3.37Å; F322-Q324 VanDerWaalsContact C-N 3.35Å; F322-Q324 PolarHBondContact O-N 3.37Å; F322-F325 CarbonylContact O-C 3.52Å; F322-F325 PolarHBondContact O-N 3.11Å; F322-F326 AromaticContact CE1-CD2 3.77Å; F322-F326 HydrophobicContact CE1-CD2 3.77Å; F322-F326 HydrophobicContact CE1-CE2 4.32Å; F322-F326 AromaticContact CZ-CD2 3.74Å; F322-F326 HydrophobicContact CZ-CD2 3.74Å; F322-F326 HydrophobicContact CZ-CE2 4.12Å; F322-F326 WeakPolarHBondContact O-CA 3.16Å; F322-F326 PolarHBondContact O-N 3.11Å; F322-L329 HydrophobicContact CD2-CD1 4.12Å; F322-L329 HydrophobicContact CE2-CD1 4.2Å
323	F	93.9	Very high	91.3	Very high	127 Å²	127	83.6 Å²	83.6	56%	0.557	41%	0.407	S	S	*	.	H	α-helix	trans	-66.2	-35.8	178.6	-71.3	-62.2	0	0	0	113	W307 K319 R320 F325 F326	W307-F323 HydrophobicContact CE3-CE2 4.27Å; W307-F323 HydrophobicContact CE3-CZ 4.16Å; W307-F323 AromaticContact CH2-CE2 3.6Å; W307-F323 HydrophobicContact CH2-CE2 3.6Å; W307-F323 AromaticContact CH2-CZ 3.78Å; W307-F323 HydrophobicContact CH2-CZ 3.78Å; W307-F323 HydrophobicContact CZ3-CD2 4.14Å; W307-F323 AromaticContact CZ3-CE2 3.29Å; W307-F323 HydrophobicContact CZ3-CE2 3.29Å; W307-F323 AromaticContact CZ3-CZ 3.51Å; W307-F323 HydrophobicContact CZ3-CZ 3.51Å; K319-F323 WeakPolarHBondContact O-CD2 3.44Å; K319-F323 PolarHBondContact O-N 3.47Å; R320-F323 PolarHBondContact O-N 3.02Å; F323-F325 VanDerWaalsContact C-N 3.29Å; F323-F325 PolarHBondContact O-N 3.39Å; F323-F326 WeakPolarHBondContact O-CB 3.16Å; F323-F326 PolarHBondContact O-N 3.48Å
324	Q	93.9	Very high	91.7	Very high	141 Å²	141	78.3 Å²	78.3	66%	0.659	38%	0.379	S	S	*	.	H	α-helix	trans	-59.8	-39.3	175.1	-177.1	-178	13.5	0	0	112.1	R320 R321 F322	R320-Q324 WeakPolarHBondContact O-CB 3.36Å; R320-Q324 PolarHBondContact O-N 3.49Å; R321-Q324 PolarHBondContact O-N 3.16Å; F322-Q324 VanDerWaalsContact C-N 3.35Å; F322-Q324 PolarHBondContact O-N 3.37Å
325	F	91.9	Very high	92.3	Very high	67 Å²	67	77.1 Å²	77.1	29%	0.294	36%	0.355	S	S	.	.	H	α-helix	trans	-100.2	5.9	-178.3	-66	-65.4	0	0	0	113.8	R321 F322 F323 D327 Q328 L329	R321-F325 HydrophobicContact CG-CD2 3.63Å; R321-F325 HydrophobicContact CG-CE2 3.67Å; R321-F325 VanDerWaalsContact O-CD2 3.24Å; R321-F325 WeakPolarHBondContact O-CD2 3.32Å; R321-F325 PolarHBondContact O-N 3.19Å; F322-F325 CarbonylContact O-C 3.52Å; F322-F325 PolarHBondContact O-N 3.11Å; F323-F325 VanDerWaalsContact C-N 3.29Å; F323-F325 PolarHBondContact O-N 3.39Å; F325-D327 PolarHBondContact O-N 2.97Å; F325-Q328 WeakPolarHBondContact O-CB 3.18Å; F325-Q328 PolarHBondContact O-N 2.99Å; F325-L329 WeakPolarHBondContact O-CG 3.19Å; F325-L329 PolarHBondContact O-N 2.95Å
326	F	94.1	Very high	92.6	Very high	62 Å²	62	77 Å²	77	27%	0.272	35%	0.349	S	S	.	.	H	α-helix	trans	-55.7	-48	-172.5	179.1	-98.1	0	0	0	112.7	I295 L303 F322 F323 Q328 L329 R330	I295-F326 HydrophobicContact CD1-CZ 4.35Å; L303-F326 HydrophobicContact CD1-CE2 4.13Å; L303-F326 HydrophobicContact CD1-CZ 4.38Å; F322-F326 AromaticContact CE1-CD2 3.77Å; F322-F326 HydrophobicContact CE1-CD2 3.77Å; F322-F326 HydrophobicContact CE1-CE2 4.32Å; F322-F326 AromaticContact CZ-CD2 3.74Å; F322-F326 HydrophobicContact CZ-CD2 3.74Å; F322-F326 HydrophobicContact CZ-CE2 4.12Å; F322-F326 WeakPolarHBondContact O-CA 3.16Å; F322-F326 PolarHBondContact O-N 3.11Å; F323-F326 WeakPolarHBondContact O-CB 3.16Å; F323-F326 PolarHBondContact O-N 3.48Å; F326-Q328 VanDerWaalsContact C-N 3.28Å; F326-Q328 PolarHBondContact O-N 3.38Å; F326-L329 PolarHBondContact O-N 3.39Å; F326-R330 WeakPolarHBondContact O-CB 3.27Å; F326-R330 PolarHBondContact O-N 2.74Å
327	D	92.7	Very high	92.9	Very high	93 Å²	93	74.6 Å²	74.6	50%	0.497	33%	0.328	S	S	.	.	H	α-helix	trans	-64.4	-34.4	179.4	-71.9	-39.2	0	0	0	112.4	F325 R331	F325-D327 PolarHBondContact O-N 2.97Å; D327-R331 WeakPolarHBondContact O-CB 3.21Å; D327-R331 WeakPolarHBondContact O-CG 3.31Å; D327-R331 PolarHBondContact O-N 3.46Å; D327-R331 VanDerWaalsContact O-N 3.09Å
328	Q	91.8	Very high	93.2	Very high	118 Å²	118	70 Å²	70	55%	0.551	30%	0.3	S	S	*	.	H	α-helix	trans	-68.7	-45.3	176.1	-61.2	-177.7	9	0	0	110.7	F325 F326 R330 R331 L332	F325-Q328 WeakPolarHBondContact O-CB 3.18Å; F325-Q328 PolarHBondContact O-N 2.99Å; F326-Q328 VanDerWaalsContact C-N 3.28Å; F326-Q328 PolarHBondContact O-N 3.38Å; Q328-R330 VanDerWaalsContact C-N 3.33Å; Q328-R330 PolarHBondContact O-N 2.85Å; Q328-R331 PolarHBondContact O-N 2.83Å; Q328-L332 PolarHBondContact O-N 2.8Å
329	L	92.8	Very high	93.5	Very high	17 Å²	17	69 Å²	69	9%	0.089	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-41.7	176.9	-66.8	172.3	0	0	0	111.7	L303 L306 F322 F325 F326 R331 L332 F367	L303-L329 HydrophobicContact CD2-CB 3.73Å; L306-L329 HydrophobicContact CD1-CD1 3.99Å; L306-L329 HydrophobicContact CD1-CD2 4.02Å; F322-L329 HydrophobicContact CD2-CD1 4.12Å; F322-L329 HydrophobicContact CE2-CD1 4.2Å; F325-L329 WeakPolarHBondContact O-CG 3.19Å; F325-L329 PolarHBondContact O-N 2.95Å; F326-L329 PolarHBondContact O-N 3.39Å; L329-R331 VanDerWaalsContact C-N 3.31Å; L329-R331 PolarHBondContact O-N 2.8Å; L329-L332 HydrophobicContact CD2-CD1 4.03Å; L329-L332 WeakPolarHBondContact O-CB 3.39Å; L329-L332 WeakPolarHBondContact O-CG 3.49Å; L329-L332 PolarHBondContact O-N 2.9Å; L329-F367 HydrophobicContact CD2-CD2 4.44Å; L329-F367 HydrophobicContact CD2-CE1 4.36Å; L329-F367 HydrophobicContact CD2-CE2 3.68Å; L329-F367 HydrophobicContact CD2-CZ 3.64Å
330	R	93.1	Very high	93.6	Very high	112 Å²	112	67.9 Å²	67.9	42%	0.423	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-36.4	175.8	-177.3	-178.6	171.7	-168.1	0.2	112.3	I295 F326 Q328 L332 R333	I295-R330 HydrophobicContact CD1-CG 4.42Å; F326-R330 WeakPolarHBondContact O-CB 3.27Å; F326-R330 PolarHBondContact O-N 2.74Å; Q328-R330 VanDerWaalsContact C-N 3.33Å; Q328-R330 PolarHBondContact O-N 2.85Å; R330-L332 VanDerWaalsContact C-N 3.31Å; R330-L332 PolarHBondContact O-N 2.83Å; R330-R333 PolarHBondContact O-NH1 3.44Å
331	R	92.6	Very high	93.5	Very high	173 Å²	173	61.5 Å²	61.5	65%	0.653	27%	0.268	S	S	*	.	H	α-helix	trans	-78.7	-8.1	179.5	-73.5	174.4	-171.8	179.6	4.3	114.5	D327 Q328 L329 R333	D327-R331 WeakPolarHBondContact O-CB 3.21Å; D327-R331 WeakPolarHBondContact O-CG 3.31Å; D327-R331 PolarHBondContact O-N 3.46Å; D327-R331 VanDerWaalsContact O-N 3.09Å; Q328-R331 PolarHBondContact O-N 2.83Å; L329-R331 VanDerWaalsContact C-N 3.31Å; L329-R331 PolarHBondContact O-N 2.8Å; R331-R333 PolarHBondContact O-NH1 2.88Å
332	L	93.9	Very high	93.5	Very high	13 Å²	13	57.4 Å²	57.4	7%	0.068	26%	0.256	C	S	.	.			trans	-59.1	150.7	176.3	-67.3	172.2	0	0	0	111.2	K299 Q328 L329 R330 Y349 T350 F367	K299-L332 PolarHBondContact NZ-O 2.94Å; Q328-L332 PolarHBondContact O-N 2.8Å; L329-L332 HydrophobicContact CD2-CD1 4.03Å; L329-L332 WeakPolarHBondContact O-CB 3.39Å; L329-L332 WeakPolarHBondContact O-CG 3.49Å; L329-L332 PolarHBondContact O-N 2.9Å; R330-L332 VanDerWaalsContact C-N 3.31Å; R330-L332 PolarHBondContact O-N 2.83Å; L332-Y349 HydrophobicContact CB-CD1 4.23Å; L332-T350 CarbonylContact C-O 3.57Å; L332-T350 WeakPolarHBondContact CA-O 3.45Å; L332-F367 HydrophobicContact CD1-CD2 3.44Å; L332-F367 VanDerWaalsContact CD1-CD2 3.44Å; L332-F367 HydrophobicContact CD1-CE2 3.83Å; L332-F367 HydrophobicContact CD1-CG 4.35Å; L332-F367 HydrophobicContact CD2-CD2 4.47Å
333	R	94.9	Very high	93.5	Very high	25 Å²	25	60.5 Å²	60.5	9%	0.094	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	143.2	179.7	-65	-65.6	-177.1	-94.4	5.1	110.1	E181 V183 Q240 R330 R331 W335 Y349 T350 E352 V355	E181-R333 WeakPolarHBondContact O-CD 3.48Å; E181-R333 PolarHBondContact O-NE 3.43Å; V183-R333 HydrophobicContact CG1-CB 4.26Å; V183-R333 HydrophobicContact CG1-CG 3.78Å; Q240-R333 VanDerWaalsContact OE1-CA 3.31Å; R330-R333 PolarHBondContact O-NH1 3.44Å; R331-R333 PolarHBondContact O-NH1 2.88Å; R333-W335 PolarHBondContact O-N 3.47Å; R333-Y349 CarbonylContact O-C 3.57Å; R333-Y349 VanDerWaalsContact O-CA 3.29Å; R333-Y349 WeakPolarHBondContact O-CA 3.42Å; R333-T350 PolarHBondContact N-O 3.41Å; R333-T350 PolarHBondContact O-N 2.84Å; R333-E352 HydrophobicContact CG-CB 4.1Å; R333-E352 HydrophobicContact CG-CG 4.44Å; R333-V355 HydrophobicContact CB-CB 4.22Å; R333-V355 HydrophobicContact CB-CG1 4.29Å; R333-V355 HydrophobicContact CB-CG2 3.7Å
334	M	96.4	Very high	93.6	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	127.8	172	-63.7	-170.7	-69.3	0	0	109.1	L235 Q240 I242 L298 I347 Y349	L235-M334 HydrophobicContact CD1-CB 4.04Å; L235-M334 HydrophobicContact CD1-CE 4.15Å; L235-M334 HydrophobicContact CD1-SD 4.36Å; Q240-M334 HydrophobicContact CB-CE 4.14Å; Q240-M334 PolarHBondContact NE2-O 2.86Å; Q240-M334 WeakPolarHBondContact O-CE 3.41Å; I242-M334 HydrophobicContact CD1-SD 3.88Å; I242-M334 HydrophobicContact CG1-CE 4.36Å; I242-M334 HydrophobicContact CG1-SD 4.18Å; L298-M334 HydrophobicContact CD2-CE 4.41Å; L298-M334 HydrophobicContact CD2-SD 3.79Å; M334-I347 HydrophobicContact CB-CG2 4.24Å; M334-I347 HydrophobicContact CG-CG2 3.73Å; M334-I347 HydrophobicContact SD-CD1 4.48Å; M334-I347 HydrophobicContact SD-CG2 3.86Å; M334-Y349 HydrophobicContact CB-CE1 4.36Å; M334-Y349 HydrophobicContact CG-CD1 3.97Å; M334-Y349 HydrophobicContact CG-CE1 3.26Å; M334-Y349 HydrophobicContact CG-CE2 4.18Å; M334-Y349 VanDerWaalsContact CG-CZ 3.41Å; M334-Y349 HydrophobicContact SD-CE1 4.39Å
335	W	93.1	Very high	93.7	Very high	36 Å²	36	49.6 Å²	49.6	14%	0.136	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-42.7	-178.4	178.9	-136.5	0	0	0	112.8	I218 R333 K348 T350 V355 L357	I218-W335 HydrophobicContact CD1-CE3 4.41Å; I218-W335 HydrophobicContact CD1-CH2 3.77Å; I218-W335 HydrophobicContact CD1-CZ2 4.46Å; I218-W335 HydrophobicContact CD1-CZ3 3.73Å; R333-W335 PolarHBondContact O-N 3.47Å; W335-K348 PolarHBondContact N-O 2.86Å; W335-T350 HydrophobicContact CB-CG2 3.66Å; W335-T350 HydrophobicContact CG-CG2 3.97Å; W335-V355 HydrophobicContact CB-CG2 3.96Å; W335-V355 HydrophobicContact CD2-CG2 4.45Å; W335-V355 VanDerWaalsContact CE3-CA 3.5Å; W335-V355 HydrophobicContact CE3-CB 4.09Å; W335-V355 HydrophobicContact CE3-CG1 4.06Å; W335-V355 HydrophobicContact CE3-CG2 4.08Å; W335-V355 HydrophobicContact CG-CG2 4.46Å; W335-V355 WeakPolarHBondContact CZ3-O 3.42Å; W335-L357 HydrophobicContact CH2-CD2 3.56Å; W335-L357 HydrophobicContact CH2-CG 4.01Å; W335-L357 HydrophobicContact CZ2-CD2 4.09Å
336	K	94.4	Very high	94	Very high	38 Å²	38	46.5 Å²	46.5	17%	0.165	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.2	-176.9	-69.4	-171.7	173	-162.5	0	109.3	Q223 K348 P453	Q223-K336 VanDerWaalsContact OE1-CE 3.27Å; K336-K348 HydrophobicContact CB-CB 4.3Å; K336-K348 PolarHBondContact O-N 3.48Å; K336-P453 HydrophobicContact CB-CG 3.8Å
337	M	95.8	Very high	94.2	Very high	7 Å²	7	43.5 Å²	43.5	3%	0.034	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	167.2	173.1	69.9	168.4	-175.1	0	0	111.6	A233 V234 L235 I242 L345 F346	A233-M337 HydrophobicContact CB-CE 3.46Å; A233-M337 VanDerWaalsContact CB-CE 3.46Å; A233-M337 HydrophobicContact CB-SD 3.97Å; A233-M337 WeakPolarHBondContact O-CE 3.37Å; V234-M337 VanDerWaalsContact N-CE 3.34Å; L235-M337 HydrophobicContact CB-CE 3.72Å; L235-M337 HydrophobicContact CB-CG 3.9Å; L235-M337 HydrophobicContact CB-SD 3.8Å; L235-M337 HydrophobicContact CD2-CG 4.35Å; I242-M337 HydrophobicContact CB-SD 4.28Å; I242-M337 HydrophobicContact CD1-CB 4.46Å; I242-M337 HydrophobicContact CD1-SD 3.89Å; I242-M337 HydrophobicContact CG1-SD 3.81Å; I242-M337 HydrophobicContact CG2-CE 4.31Å; I242-M337 HydrophobicContact CG2-SD 3.54Å; I242-M337 VanDerWaalsContact CG2-SD 3.54Å; M337-L345 HydrophobicContact SD-CD2 4.38Å; M337-F346 CarbonylContact C-O 3.54Å; M337-F346 VanDerWaalsContact CA-O 3.26Å; M337-F346 WeakPolarHBondContact CA-O 3.41Å
338	Q	95.4	Very high	94.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	147	175.1	158.8	168.5	8.6	0	0	108.6	Y226 L340 F346 F400 P453	Y226-Q338 HydrophobicContact CD2-CB 3.98Å; Y226-Q338 HydrophobicContact CD2-CG 4.01Å; Y226-Q338 HydrophobicContact CE1-CG 4.32Å; Y226-Q338 HydrophobicContact CE2-CB 3.93Å; Y226-Q338 HydrophobicContact CE2-CG 3.5Å; Y226-Q338 PolarHBondContact OH-NE2 3.31Å; Y226-Q338 VanDerWaalsContact OH-NE2 3.14Å; Q338-L340 HydrophobicContact CG-CD2 4.37Å; Q338-F346 HydrophobicContact CB-CB 4.34Å; Q338-F346 PolarHBondContact N-O 3.06Å; Q338-F346 PolarHBondContact O-N 3.17Å; Q338-F400 PolarHBondContact NE2-O 3.31Å; Q338-P453 HydrophobicContact CB-CB 3.58Å
339	L	94.8	Very high	94.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128.4	162.7	-67.3	162.7	0	0	0	108.9	Y226 I231 A233 L345 M373	Y226-L339 HydrophobicContact CD1-CB 3.58Å; Y226-L339 HydrophobicContact CD1-CD1 4.12Å; Y226-L339 HydrophobicContact CD1-CG 4.08Å; Y226-L339 HydrophobicContact CE1-CB 3.86Å; Y226-L339 VanDerWaalsContact CE1-O 3.22Å; Y226-L339 WeakPolarHBondContact CE1-O 3.33Å; Y226-L339 HydrophobicContact CG-CB 4.44Å; I231-L339 HydrophobicContact CB-CD1 4.38Å; I231-L339 HydrophobicContact CG2-CD1 3.97Å; I231-L339 WeakPolarHBondContact O-CD1 3.46Å; A233-L339 HydrophobicContact CB-CD1 3.94Å; A233-L339 HydrophobicContact CB-CD2 4.42Å; A233-L339 HydrophobicContact CB-CG 4.1Å; L339-L345 HydrophobicContact CD2-CD2 3.49Å; L339-L345 VanDerWaalsContact CD2-CD2 3.49Å; L339-L345 HydrophobicContact CD2-CG 4.12Å; L339-L345 HydrophobicContact CG-CD2 4.12Å; L339-M373 HydrophobicContact CD2-CE 3.58Å; L339-M373 HydrophobicContact CD2-SD 4.27Å
340	L	92.9	Very high	94.6	Very high	41 Å²	41	34.2 Å²	34.2	22%	0.215	15%	0.147	C	C	.	.	S	Bend	trans	-85.1	-34.4	172.1	-61.9	177.4	0	0	0	111	Q338 H344 F346 V370 F400	Q338-L340 HydrophobicContact CG-CD2 4.37Å; L340-H344 HydrophobicContact CB-CB 4.29Å; L340-H344 PolarHBondContact N-O 2.92Å; L340-F346 HydrophobicContact CD1-CB 4Å; L340-F346 HydrophobicContact CD1-CG 4.48Å; L340-F346 HydrophobicContact CD2-CB 3.88Å; L340-F346 HydrophobicContact CD2-CD1 4.48Å; L340-F346 HydrophobicContact CD2-CG 4.3Å; L340-F346 HydrophobicContact CG-CB 3.78Å; L340-V370 HydrophobicContact CD1-CG1 4.28Å; L340-F400 HydrophobicContact CD2-CD1 3.79Å; L340-F400 HydrophobicContact CD2-CE1 3.92Å
341	D	90.9	Very high	94.6	Very high	50 Å²	50	30.2 Å²	30.2	27%	0.267	14%	0.136	S	C	.	.	S	Bend	trans	-155.7	-161.1	174.4	59.8	29.7	0	0	0	109.5	Y228 H343 H344	Y228-D341 HydrophobicContact CE1-CB 4.45Å; D341-H343 PolarHBondContact O-N 2.9Å; D341-H343 WeakPolarHBondContact OD1-CA 3.48Å; D341-H343 PolarHBondContact OD1-N 2.82Å; D341-H344 WeakPolarHBondContact OD1-CB 3.39Å; D341-H344 IonicContact OD1-CG 3Å; D341-H344 PolarHBondContact OD1-N 2.83Å; D341-H344 IonicContact OD1-ND1 3.62Å; D341-H344 PolarHBondContact OD1-ND1 2.85Å; D341-H344 IonicContact OD2-CE1 2.75Å; D341-H344 IonicContact OD2-CG 3.33Å; D341-H344 IonicContact OD2-ND1 2.92Å; D341-H344 PolarHBondContact OD2-ND1 2.85Å
342	E	90.9	Very high	94.5	Very high	63 Å²	63	24.1 Å²	24.1	29%	0.294	12%	0.115	S	C	.	.	S	Bend	trans	-68.5	-15.5	-179.5	-63.7	178.2	171.5	0	0	114.3	Y228 R229 I231 M373	Y228-E342 HydrophobicContact CD1-CG 4.2Å; Y228-E342 HydrophobicContact CE1-CG 4.11Å; R229-E342 WeakPolarHBondContact CD-OE1 3.49Å; R229-E342 IonicContact CZ-OE1 2.9Å; R229-E342 IonicContact NE-OE1 3.09Å; R229-E342 IonicContact NH1-OE1 3.84Å; R229-E342 PolarHBondContact NH1-OE1 3.17Å; I231-E342 HydrophobicContact CD1-CB 3.78Å; I231-E342 HydrophobicContact CD1-CG 4.15Å; I231-E342 WeakPolarHBondContact CD1-O 3.47Å; E342-M373 WeakPolarHBondContact O-CE 3.5Å
343	H	94.1	Very high	94.3	Very high	86 Å²	86	27 Å²	27	40%	0.398	13%	0.131	S	C	.	.	S	Bend	trans	-124.8	-24	-170	-56	-34.6	0	0	0	113.5	D341 M373 V374	D341-H343 PolarHBondContact O-N 2.9Å; D341-H343 WeakPolarHBondContact OD1-CA 3.48Å; D341-H343 PolarHBondContact OD1-N 2.82Å; H343-M373 WeakPolarHBondContact O-CB 3.39Å; H343-M373 WeakPolarHBondContact O-CG 3.36Å; H343-M373 PolarHBondContact O-N 2.96Å; H343-V374 HydrophobicContact CB-CG2 4.19Å
344	H	95.4	Very high	94	Very high	38 Å²	38	26.7 Å²	26.7	18%	0.176	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.4	-170.2	-58.6	100.5	0	0	0	112.2	L340 D341 Y371 N372 L379	L340-H344 HydrophobicContact CB-CB 4.29Å; L340-H344 PolarHBondContact N-O 2.92Å; D341-H344 WeakPolarHBondContact OD1-CB 3.39Å; D341-H344 IonicContact OD1-CG 3Å; D341-H344 PolarHBondContact OD1-N 2.83Å; D341-H344 IonicContact OD1-ND1 3.62Å; D341-H344 PolarHBondContact OD1-ND1 2.85Å; D341-H344 IonicContact OD2-CE1 2.75Å; D341-H344 IonicContact OD2-CG 3.33Å; D341-H344 IonicContact OD2-ND1 2.92Å; D341-H344 PolarHBondContact OD2-ND1 2.85Å; H344-Y371 CarbonylContact C-O 3.53Å; H344-Y371 WeakPolarHBondContact CA-O 3.26Å; H344-N372 PolarHBondContact NE2-ND2 2.8Å; H344-L379 VanDerWaalsContact CD2-CD1 3.45Å; H344-L379 WeakPolarHBondContact CD2-CD1 3.35Å
345	L	96.5	Very high	93.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	139.7	169.5	-76.4	168.1	0	0	0	110.6	A233 I242 I259 M337 L339 I347 V370 Y371 M373	A233-L345 HydrophobicContact CB-CD2 4.39Å; I242-L345 HydrophobicContact CD1-CD1 4.04Å; I242-L345 HydrophobicContact CG2-CD1 4.19Å; I259-L345 HydrophobicContact CD1-CD1 3.67Å; M337-L345 HydrophobicContact SD-CD2 4.38Å; L339-L345 HydrophobicContact CD2-CD2 3.49Å; L339-L345 VanDerWaalsContact CD2-CD2 3.49Å; L339-L345 HydrophobicContact CD2-CG 4.12Å; L339-L345 HydrophobicContact CG-CD2 4.12Å; L345-I347 HydrophobicContact CB-CD1 4.17Å; L345-I347 HydrophobicContact CB-CG1 3.99Å; L345-I347 HydrophobicContact CD1-CD1 4.48Å; L345-V370 CarbonylContact O-C 3.57Å; L345-V370 WeakPolarHBondContact O-CA 3.38Å; L345-Y371 HydrophobicContact CD1-CD1 4.24Å; L345-Y371 PolarHBondContact N-O 3.47Å; L345-Y371 PolarHBondContact O-N 3.24Å; L345-M373 HydrophobicContact CD1-CG 3.61Å; L345-M373 HydrophobicContact CD1-SD 3.55Å; L345-M373 VanDerWaalsContact CD1-SD 3.55Å; L345-M373 HydrophobicContact CD2-SD 4.28Å; L345-M373 HydrophobicContact CG-CE 4.35Å; L345-M373 HydrophobicContact CG-CG 3.81Å; L345-M373 HydrophobicContact CG-SD 3.59Å; L345-M373 VanDerWaalsContact CG-SD 3.59Å
346	F	97.4	Very high	93.2	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.009	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	105.2	169.9	-171.4	-131.3	0	0	0	109.8	M337 Q338 L340 F368 V369 V370 L389 F400 L452 P453	M337-F346 CarbonylContact C-O 3.54Å; M337-F346 VanDerWaalsContact CA-O 3.26Å; M337-F346 WeakPolarHBondContact CA-O 3.41Å; Q338-F346 HydrophobicContact CB-CB 4.34Å; Q338-F346 PolarHBondContact N-O 3.06Å; Q338-F346 PolarHBondContact O-N 3.17Å; L340-F346 HydrophobicContact CD1-CB 4Å; L340-F346 HydrophobicContact CD1-CG 4.48Å; L340-F346 HydrophobicContact CD2-CB 3.88Å; L340-F346 HydrophobicContact CD2-CD1 4.48Å; L340-F346 HydrophobicContact CD2-CG 4.3Å; L340-F346 HydrophobicContact CG-CB 3.78Å; F346-F368 AromaticContact CE1-CD1 3.97Å; F346-F368 HydrophobicContact CE1-CD1 3.97Å; F346-F368 HydrophobicContact CE2-CB 3.59Å; F346-F368 HydrophobicContact CE2-CD1 4.24Å; F346-F368 HydrophobicContact CE2-CG 4.28Å; F346-F368 HydrophobicContact CZ-CB 3.69Å; F346-F368 AromaticContact CZ-CD1 3.58Å; F346-F368 HydrophobicContact CZ-CD1 3.58Å; F346-F368 HydrophobicContact CZ-CE1 4.44Å; F346-F368 AromaticContact CZ-CG 3.86Å; F346-F368 HydrophobicContact CZ-CG 3.86Å; F346-V369 WeakPolarHBondContact CA-O 3.43Å; F346-V370 HydrophobicContact CD2-CG2 3.89Å; F346-V370 HydrophobicContact CE2-CG2 4.19Å; F346-L389 HydrophobicContact CZ-CD1 4.17Å; F346-L389 HydrophobicContact CZ-CD2 4.12Å; F346-F400 HydrophobicContact CD1-CE1 4.37Å; F346-F400 HydrophobicContact CE1-CD1 4.42Å; F346-F400 HydrophobicContact CE1-CE1 4.06Å; F346-F400 HydrophobicContact CZ-CE1 4.37Å; F346-L452 HydrophobicContact CE1-CB 3.91Å; F346-L452 HydrophobicContact CE1-CD1 3.96Å; F346-L452 HydrophobicContact CE1-CD2 4.23Å; F346-L452 HydrophobicContact CE1-CG 4.25Å; F346-L452 HydrophobicContact CZ-CD1 4.2Å; F346-P453 HydrophobicContact CD1-CB 4.13Å; F346-P453 HydrophobicContact CD1-CG 4.24Å
347	I	97.5	Very high	92.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.5	-168.4	-52	171.6	0	0	0	109.1	I242 L298 M334 L345 Y349 F368 V369	I242-I347 HydrophobicContact CD1-CD1 3.65Å; I242-I347 HydrophobicContact CD1-CG1 4Å; L298-I347 HydrophobicContact CD2-CD1 4.41Å; M334-I347 HydrophobicContact CB-CG2 4.24Å; M334-I347 HydrophobicContact CG-CG2 3.73Å; M334-I347 HydrophobicContact SD-CD1 4.48Å; M334-I347 HydrophobicContact SD-CG2 3.86Å; L345-I347 HydrophobicContact CB-CD1 4.17Å; L345-I347 HydrophobicContact CB-CG1 3.99Å; L345-I347 HydrophobicContact CD1-CD1 4.48Å; I347-Y349 HydrophobicContact CB-CE2 4.06Å; I347-Y349 HydrophobicContact CG2-CD2 3.95Å; I347-Y349 HydrophobicContact CG2-CE2 3.53Å; I347-F368 CarbonylContact O-C 3.55Å; I347-F368 WeakPolarHBondContact O-CA 3.24Å; I347-V369 HydrophobicContact CB-CB 4.5Å; I347-V369 PolarHBondContact N-O 3.29Å; I347-V369 PolarHBondContact O-N 3Å
348	K	96.5	Very high	92.2	Very high	25 Å²	25	32.2 Å²	32.2	11%	0.109	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.5	172.5	-175.9	174.9	-172.4	168.5	0	110.5	W335 K336 F367 F368 P453	W335-K348 PolarHBondContact N-O 2.86Å; K336-K348 HydrophobicContact CB-CB 4.3Å; K336-K348 PolarHBondContact O-N 3.48Å; K348-F367 CarbonylContact C-O 3.58Å; K348-F367 WeakPolarHBondContact CA-O 3.5Å; K348-F368 HydrophobicContact CB-CD1 4.21Å; K348-F368 HydrophobicContact CB-CE1 4.25Å; K348-F368 HydrophobicContact CD-CD1 4.47Å; K348-F368 HydrophobicContact CD-CE1 3.75Å; K348-F368 HydrophobicContact CD-CZ 4.18Å; K348-F368 HydrophobicContact CG-CD1 4.25Å; K348-F368 HydrophobicContact CG-CE1 4.01Å; K348-P453 HydrophobicContact CB-CG 3.92Å
349	Y	96.2	Very high	91.6	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.2	173	-76	-89.1	0	0	0	110.9	L298 K299 L302 L332 R333 M334 I347 S366 F367 V369	L298-Y349 WeakPolarHBondContact CD2-OH 3.43Å; K299-Y349 VanDerWaalsContact NZ-CD1 3.35Å; L302-Y349 HydrophobicContact CD2-CD2 4.18Å; L302-Y349 HydrophobicContact CD2-CE1 4.49Å; L302-Y349 HydrophobicContact CD2-CE2 4.13Å; L302-Y349 HydrophobicContact CD2-CG 4.35Å; L332-Y349 HydrophobicContact CB-CD1 4.23Å; R333-Y349 CarbonylContact O-C 3.57Å; R333-Y349 VanDerWaalsContact O-CA 3.29Å; R333-Y349 WeakPolarHBondContact O-CA 3.42Å; M334-Y349 HydrophobicContact CB-CE1 4.36Å; M334-Y349 HydrophobicContact CG-CD1 3.97Å; M334-Y349 HydrophobicContact CG-CE1 3.26Å; M334-Y349 HydrophobicContact CG-CE2 4.18Å; M334-Y349 VanDerWaalsContact CG-CZ 3.41Å; M334-Y349 HydrophobicContact SD-CE1 4.39Å; I347-Y349 HydrophobicContact CB-CE2 4.06Å; I347-Y349 HydrophobicContact CG2-CD2 3.95Å; I347-Y349 HydrophobicContact CG2-CE2 3.53Å; Y349-S366 CarbonylContact O-C 3.59Å; Y349-S366 VanDerWaalsContact O-CA 3.23Å; Y349-S366 WeakPolarHBondContact O-CA 3.37Å; Y349-S366 WeakPolarHBondContact O-CB 3.25Å; Y349-F367 PolarHBondContact N-O 3.33Å; Y349-F367 PolarHBondContact O-N 3.24Å; Y349-V369 HydrophobicContact CD2-CB 4.23Å; Y349-V369 HydrophobicContact CD2-CG2 3.52Å; Y349-V369 HydrophobicContact CE2-CB 4.11Å; Y349-V369 HydrophobicContact CE2-CG2 3.76Å
350	T	94.1	Very high	90.3	Very high	5 Å²	5	41 Å²	41	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	178.3	177.7	-167.9	0	0	0	0	110.2	L332 R333 W335 V354 V355	L332-T350 CarbonylContact C-O 3.57Å; L332-T350 WeakPolarHBondContact CA-O 3.45Å; R333-T350 PolarHBondContact N-O 3.41Å; R333-T350 PolarHBondContact O-N 2.84Å; W335-T350 HydrophobicContact CB-CG2 3.66Å; W335-T350 HydrophobicContact CG-CG2 3.97Å; T350-V354 HydrophobicContact CG2-CB 3.92Å; T350-V354 HydrophobicContact CG2-CG1 3.87Å; T350-V355 HydrophobicContact CG2-CG2 3.38Å
351	S	92.6	Very high	88.7	Confident	28 Å²	28	42.7 Å²	42.7	20%	0.196	22%	0.222	C	C	.	.			trans	-63.5	149	174.4	58.8	0	0	0	0	112.9	D353 V354 V355	S351-D353 PolarHBondContact O-N 3.3Å; S351-V354 PolarHBondContact O-N 2.94Å; S351-V354 VanDerWaalsContact O-N 3.13Å; S351-V354 WeakPolarHBondContact OG-CG2 3.41Å; S351-V355 WeakPolarHBondContact O-CG2 3.5Å; S351-V355 PolarHBondContact O-N 3.48Å; S351-V355 VanDerWaalsContact O-N 3.14Å
352	E	91.5	Very high	87	Confident	45 Å²	45	45.5 Å²	45.5	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-56.6	-35.7	178.5	-175.6	176.5	163.9	0	0	112.7	V183 T184 R333 V354 V355 T356	V183-E352 HydrophobicContact CB-CG 4.25Å; V183-E352 HydrophobicContact CG1-CG 4.17Å; T184-E352 WeakPolarHBondContact CB-OE1 3.48Å; T184-E352 PolarHBondContact N-OE1 3.26Å; T184-E352 PolarHBondContact OG1-OE1 2.94Å; R333-E352 HydrophobicContact CG-CB 4.1Å; R333-E352 HydrophobicContact CG-CG 4.44Å; E352-V354 VanDerWaalsContact C-N 3.29Å; E352-V354 PolarHBondContact O-N 3.03Å; E352-V355 PolarHBondContact O-N 2.91Å; E352-V355 VanDerWaalsContact O-N 3.16Å; E352-T356 HydrophobicContact CG-CG2 3.94Å; E352-T356 WeakPolarHBondContact O-CB 3.48Å; E352-T356 WeakPolarHBondContact O-CG2 3.47Å; E352-T356 PolarHBondContact O-N 3.22Å; E352-T356 PolarHBondContact O-OG1 3.04Å
353	D	89.2	Confident	85.7	Confident	74 Å²	74	44.9 Å²	44.9	40%	0.396	25%	0.245	S	C	.	.	H	α-helix	trans	-64.5	-32.7	179.4	-65.1	-41.9	0	0	0	113.3	S351 L357 R358 V359	S351-D353 PolarHBondContact O-N 3.3Å; D353-L357 PolarHBondContact O-N 2.87Å; D353-R358 HydrophobicContact CB-CB 4.34Å; D353-R358 PolarHBondContact O-N 2.84Å; D353-R358 IonicContact OD1-NH1 3.24Å; D353-V359 HydrophobicContact CB-CB 4.33Å; D353-V359 HydrophobicContact CB-CG2 3.99Å; D353-V359 PolarHBondContact O-N 2.77Å
354	V	87.8	Confident	84.8	Confident	18 Å²	18	44.2 Å²	44.2	11%	0.109	24%	0.242	C	C	.	.	H	α-helix	trans	-75.2	-41.6	173.7	174.4	0	0	0	0	109.9	T350 S351 E352 T356 L357 Q364	T350-V354 HydrophobicContact CG2-CB 3.92Å; T350-V354 HydrophobicContact CG2-CG1 3.87Å; S351-V354 PolarHBondContact O-N 2.94Å; S351-V354 VanDerWaalsContact O-N 3.13Å; S351-V354 WeakPolarHBondContact OG-CG2 3.41Å; E352-V354 VanDerWaalsContact C-N 3.29Å; E352-V354 PolarHBondContact O-N 3.03Å; V354-T356 VanDerWaalsContact C-N 3.31Å; V354-T356 PolarHBondContact O-N 2.88Å; V354-L357 PolarHBondContact O-N 3.5Å; V354-L357 VanDerWaalsContact O-N 3.14Å; V354-Q364 HydrophobicContact CG2-CB 4.15Å; V354-Q364 HydrophobicContact CG2-CG 3.83Å
355	V	87.1	Confident	84.3	Confident	6 Å²	6	46 Å²	46	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-62.6	-38.9	178.7	175.5	0	0	0	0	112.4	V183 V237 R333 W335 T350 S351 E352 L357	V183-V355 HydrophobicContact CG1-CG1 4.24Å; V237-V355 HydrophobicContact CG1-CG1 3.17Å; R333-V355 HydrophobicContact CB-CB 4.22Å; R333-V355 HydrophobicContact CB-CG1 4.29Å; R333-V355 HydrophobicContact CB-CG2 3.7Å; W335-V355 HydrophobicContact CB-CG2 3.96Å; W335-V355 HydrophobicContact CD2-CG2 4.45Å; W335-V355 VanDerWaalsContact CE3-CA 3.5Å; W335-V355 HydrophobicContact CE3-CB 4.09Å; W335-V355 HydrophobicContact CE3-CG1 4.06Å; W335-V355 HydrophobicContact CE3-CG2 4.08Å; W335-V355 HydrophobicContact CG-CG2 4.46Å; W335-V355 WeakPolarHBondContact CZ3-O 3.42Å; T350-V355 HydrophobicContact CG2-CG2 3.38Å; S351-V355 WeakPolarHBondContact O-CG2 3.5Å; S351-V355 PolarHBondContact O-N 3.48Å; S351-V355 VanDerWaalsContact O-N 3.14Å; E352-V355 PolarHBondContact O-N 2.91Å; E352-V355 VanDerWaalsContact O-N 3.16Å; V355-L357 PolarHBondContact O-N 2.97Å
356	T	87.1	Confident	84	Confident	10 Å²	10	46.3 Å²	46.3	6%	0.061	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	7.1	179.3	57.1	0	0	0	0	112.5	V183 T184 N186 E352 V354 R358	V183-T356 HydrophobicContact CB-CG2 3.88Å; V183-T356 HydrophobicContact CG2-CG2 4Å; T184-T356 VanDerWaalsContact O-CG2 3.27Å; T184-T356 WeakPolarHBondContact O-CG2 3.5Å; N186-T356 VanDerWaalsContact CB-O 3.22Å; N186-T356 WeakPolarHBondContact CB-O 3.28Å; N186-T356 PolarHBondContact ND2-O 3.09Å; E352-T356 HydrophobicContact CG-CG2 3.94Å; E352-T356 WeakPolarHBondContact O-CB 3.48Å; E352-T356 WeakPolarHBondContact O-CG2 3.47Å; E352-T356 PolarHBondContact O-N 3.22Å; E352-T356 PolarHBondContact O-OG1 3.04Å; V354-T356 VanDerWaalsContact C-N 3.31Å; V354-T356 PolarHBondContact O-N 2.88Å; T356-R358 PolarHBondContact O-N 3.05Å; T356-R358 VanDerWaalsContact O-N 3.13Å; T356-R358 WeakPolarHBondContact OG1-CD 3.5Å; T356-R358 WeakPolarHBondContact OG1-CG 3.14Å
357	L	84.1	Confident	83.9	Confident	84 Å²	84	47.5 Å²	47.5	44%	0.44	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	23.8	-178.6	-62.7	171.7	0	0	0	114	W335 D353 V354 V355 V359	W335-L357 HydrophobicContact CH2-CD2 3.56Å; W335-L357 HydrophobicContact CH2-CG 4.01Å; W335-L357 HydrophobicContact CZ2-CD2 4.09Å; D353-L357 PolarHBondContact O-N 2.87Å; V354-L357 PolarHBondContact O-N 3.5Å; V354-L357 VanDerWaalsContact O-N 3.14Å; V355-L357 PolarHBondContact O-N 2.97Å; L357-V359 VanDerWaalsContact C-N 3.32Å
358	R	83.6	Confident	83.9	Confident	100 Å²	100	47.5 Å²	47.5	38%	0.377	27%	0.265	S	S	.	.	S	Bend	trans	-72.6	-32.7	172.2	-67.7	175.3	-178.7	172.9	0.8	110.9	T184 N186 D353 T356	T184-R358 VanDerWaalsContact CG2-NH2 3.28Å; T184-R358 PolarHBondContact O-NH2 3.38Å; N186-R358 HydrophobicContact CB-CG 4.47Å; D353-R358 HydrophobicContact CB-CB 4.34Å; D353-R358 PolarHBondContact O-N 2.84Å; D353-R358 IonicContact OD1-NH1 3.24Å; T356-R358 PolarHBondContact O-N 3.05Å; T356-R358 VanDerWaalsContact O-N 3.13Å; T356-R358 WeakPolarHBondContact OG1-CD 3.5Å; T356-R358 WeakPolarHBondContact OG1-CG 3.14Å
359	V	82.6	Confident	84	Confident	54 Å²	54	46.4 Å²	46.4	33%	0.327	26%	0.26	S	S	.	.			trans	-124.1	130.3	175.6	176.4	0	0	0	0	109.1	D353 L357 D361	D353-V359 HydrophobicContact CB-CB 4.33Å; D353-V359 HydrophobicContact CB-CG2 3.99Å; D353-V359 PolarHBondContact O-N 2.77Å; L357-V359 VanDerWaalsContact C-N 3.32Å; V359-D361 HydrophobicContact CG1-CB 3.83Å
360	T	67.9	Low	84.1	Confident	129 Å²	129	47.4 Å²	47.4	79%	0.791	27%	0.266	S	S	*	.			trans	-96.1	-3.4	177.4	52.2	0	0	0	0	113.3	P362	T360-P362 VanDerWaalsContact O-CD 3.25Å; T360-P362 WeakPolarHBondContact O-CD 3.39Å
361	D	59.3	Low	84.3	Confident	78 Å²	78	47.1 Å²	47.1	42%	0.417	26%	0.264	S	S	.	.			trans	-72.6	115.6	-173.8	-170.8	1	0	0	0	112	V359 S363	V359-D361 HydrophobicContact CG1-CB 3.83Å; D361-S363 PolarHBondContact O-N 2.77Å; D361-S363 VanDerWaalsContact OD1-CB 3.27Å; D361-S363 WeakPolarHBondContact OD1-CB 3.38Å; D361-S363 PolarHBondContact OD1-N 2.79Å; D361-S363 PolarHBondContact OD1-OG 2.79Å; D361-S363 PolarHBondContact OD2-OG 2.84Å
362	P	56.4	Low	84.5	Confident	108 Å²	108	47 Å²	47	70%	0.701	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-0.9	177.1	31.9	-37.2	0	0	0	114	T360 Q364	T360-P362 VanDerWaalsContact O-CD 3.25Å; T360-P362 WeakPolarHBondContact O-CD 3.39Å; P362-Q364 PolarHBondContact O-N 3.43Å
363	S	63.7	Low	84.6	Confident	50 Å²	50	45.2 Å²	45.2	35%	0.35	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.2	-179.6	74	0	0	0	0	114.3	D361	D361-S363 PolarHBondContact O-N 2.77Å; D361-S363 VanDerWaalsContact OD1-CB 3.27Å; D361-S363 WeakPolarHBondContact OD1-CB 3.38Å; D361-S363 PolarHBondContact OD1-N 2.79Å; D361-S363 PolarHBondContact OD1-OG 2.79Å; D361-S363 PolarHBondContact OD2-OG 2.84Å
364	Q	74.7	Confident	84.8	Confident	72 Å²	72	45.7 Å²	45.7	34%	0.336	26%	0.259	S	S	.	.	S	Bend	trans	-64.9	143.5	-177.4	-66.4	-66.9	-36.2	0	0	112.4	V354 P362 S366 N384	V354-Q364 HydrophobicContact CG2-CB 4.15Å; V354-Q364 HydrophobicContact CG2-CG 3.83Å; P362-Q364 PolarHBondContact O-N 3.43Å; Q364-S366 PolarHBondContact O-N 2.78Å; Q364-N384 PolarHBondContact O-ND2 2.72Å; Q364-N384 VanDerWaalsContact O-ND2 3.13Å
365	P	83.7	Confident	85.2	Confident	75 Å²	75	46.7 Å²	46.7	49%	0.487	27%	0.267	S	S	.	.			trans	-62	130.7	174.5	26.5	-32.8	0	0	0	109.7
366	S	91.8	Very high	85.6	Confident	7 Å²	7	46.5 Å²	46.5	5%	0.049	27%	0.265	C	S	.	.			trans	-135.6	153.2	177	45.3	0	0	0	0	110.6	Y349 Q364 N384	Y349-S366 CarbonylContact O-C 3.59Å; Y349-S366 VanDerWaalsContact O-CA 3.23Å; Y349-S366 WeakPolarHBondContact O-CA 3.37Å; Y349-S366 WeakPolarHBondContact O-CB 3.25Å; Q364-S366 PolarHBondContact O-N 2.78Å; S366-N384 PolarHBondContact O-N 3.22Å; S366-N384 VanDerWaalsContact OG-CB 3.31Å; S366-N384 WeakPolarHBondContact OG-CB 3.37Å; S366-N384 PolarHBondContact OG-ND2 3.48Å
367	F	95.6	Very high	86	Confident	28 Å²	28	51.2 Å²	51.2	12%	0.123	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.1	-178.5	-67	-92.4	0	0	0	110	L329 L332 K348 Y349 V381 F382 E383	L329-F367 HydrophobicContact CD2-CD2 4.44Å; L329-F367 HydrophobicContact CD2-CE1 4.36Å; L329-F367 HydrophobicContact CD2-CE2 3.68Å; L329-F367 HydrophobicContact CD2-CZ 3.64Å; L332-F367 HydrophobicContact CD1-CD2 3.44Å; L332-F367 VanDerWaalsContact CD1-CD2 3.44Å; L332-F367 HydrophobicContact CD1-CE2 3.83Å; L332-F367 HydrophobicContact CD1-CG 4.35Å; L332-F367 HydrophobicContact CD2-CD2 4.47Å; K348-F367 CarbonylContact C-O 3.58Å; K348-F367 WeakPolarHBondContact CA-O 3.5Å; Y349-F367 PolarHBondContact N-O 3.33Å; Y349-F367 PolarHBondContact O-N 3.24Å; F367-V381 HydrophobicContact CB-CG1 4.3Å; F367-V381 HydrophobicContact CD1-CG1 3.9Å; F367-F382 CarbonylContact C-O 3.55Å; F367-F382 VanDerWaalsContact CA-O 3.3Å; F367-F382 WeakPolarHBondContact CA-O 3.25Å; F367-E383 HydrophobicContact CD1-CG 3.99Å; F367-E383 HydrophobicContact CE1-CG 3.53Å; F367-E383 HydrophobicContact CZ-CG 4.28Å
368	F	97.3	Very high	86.7	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.6	172.1	-63.1	-80.8	0	0	0	108.7	F346 I347 K348 V381 F382 N384 L389 L449 L452	F346-F368 AromaticContact CE1-CD1 3.97Å; F346-F368 HydrophobicContact CE1-CD1 3.97Å; F346-F368 HydrophobicContact CE2-CB 3.59Å; F346-F368 HydrophobicContact CE2-CD1 4.24Å; F346-F368 HydrophobicContact CE2-CG 4.28Å; F346-F368 HydrophobicContact CZ-CB 3.69Å; F346-F368 AromaticContact CZ-CD1 3.58Å; F346-F368 HydrophobicContact CZ-CD1 3.58Å; F346-F368 HydrophobicContact CZ-CE1 4.44Å; F346-F368 AromaticContact CZ-CG 3.86Å; F346-F368 HydrophobicContact CZ-CG 3.86Å; I347-F368 CarbonylContact O-C 3.55Å; I347-F368 WeakPolarHBondContact O-CA 3.24Å; K348-F368 HydrophobicContact CB-CD1 4.21Å; K348-F368 HydrophobicContact CB-CE1 4.25Å; K348-F368 HydrophobicContact CD-CD1 4.47Å; K348-F368 HydrophobicContact CD-CE1 3.75Å; K348-F368 HydrophobicContact CD-CZ 4.18Å; K348-F368 HydrophobicContact CG-CD1 4.25Å; K348-F368 HydrophobicContact CG-CE1 4.01Å; F368-V381 CarbonylContact O-C 3.54Å; F368-V381 VanDerWaalsContact O-CA 3.3Å; F368-V381 WeakPolarHBondContact O-CA 3.27Å; F368-F382 HydrophobicContact CB-CB 4.29Å; F368-F382 PolarHBondContact N-O 2.99Å; F368-F382 PolarHBondContact O-N 3.19Å; F368-N384 HydrophobicContact CE2-CB 4.11Å; F368-L389 HydrophobicContact CB-CD2 3.91Å; F368-L389 HydrophobicContact CD2-CD2 3.48Å; F368-L389 VanDerWaalsContact CD2-CD2 3.48Å; F368-L389 HydrophobicContact CE2-CD2 4.08Å; F368-L389 HydrophobicContact CG-CD2 3.73Å; F368-L449 HydrophobicContact CE2-CB 4.15Å; F368-L449 HydrophobicContact CZ-CB 4.29Å; F368-L449 WeakPolarHBondContact CZ-O 3.45Å; F368-L452 HydrophobicContact CD1-CB 4.44Å; F368-L452 HydrophobicContact CE1-CB 3.71Å; F368-L452 WeakPolarHBondContact CE1-O 3.43Å; F368-L452 HydrophobicContact CZ-CB 4.19Å
369	V	98	Very high	87.3	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	125.4	-173.2	-178.1	0	0	0	0	108.6	L302 F346 I347 Y349 V378 A380 V381	L302-V369 HydrophobicContact CD1-CG1 4.33Å; L302-V369 HydrophobicContact CD1-CG2 3.67Å; L302-V369 HydrophobicContact CD2-CG2 4.29Å; F346-V369 WeakPolarHBondContact CA-O 3.43Å; I347-V369 HydrophobicContact CB-CB 4.5Å; I347-V369 PolarHBondContact N-O 3.29Å; I347-V369 PolarHBondContact O-N 3Å; Y349-V369 HydrophobicContact CD2-CB 4.23Å; Y349-V369 HydrophobicContact CD2-CG2 3.52Å; Y349-V369 HydrophobicContact CE2-CB 4.11Å; Y349-V369 HydrophobicContact CE2-CG2 3.76Å; V369-V378 HydrophobicContact CG1-CG1 3.78Å; V369-V378 HydrophobicContact CG1-CG2 4.25Å; V369-A380 WeakPolarHBondContact CA-O 3.47Å; V369-V381 HydrophobicContact CG1-CG2 4.37Å; V369-V381 HydrophobicContact CG2-CG1 4.26Å; V369-V381 HydrophobicContact CG2-CG2 4.25Å
370	V	97.8	Very high	88	Confident	22 Å²	22	45 Å²	45	13%	0.133	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.3	170.6	-176.3	0	0	0	0	107.7	L340 L345 F346 L379 A380 F382	L340-V370 HydrophobicContact CD1-CG1 4.28Å; L345-V370 CarbonylContact O-C 3.57Å; L345-V370 WeakPolarHBondContact O-CA 3.38Å; F346-V370 HydrophobicContact CD2-CG2 3.89Å; F346-V370 HydrophobicContact CE2-CG2 4.19Å; V370-L379 HydrophobicContact CB-CB 4.47Å; V370-L379 HydrophobicContact CG1-CB 4.28Å; V370-L379 HydrophobicContact CG1-CD1 4.34Å; V370-L379 PolarHBondContact O-N 3.35Å; V370-A380 HydrophobicContact CB-CB 4.18Å; V370-A380 HydrophobicContact CG2-CB 4.16Å; V370-A380 PolarHBondContact N-O 3.29Å; V370-F382 HydrophobicContact CG2-CE2 4.28Å
371	Y	98.1	Very high	89.4	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.4	-175.7	175.5	-102.6	0	0	0	110.4	I259 C263 L298 H344 L345 M373 T376 E377 V378	I259-Y371 HydrophobicContact CD1-CE1 4.14Å; I259-Y371 HydrophobicContact CG2-CD1 4.44Å; I259-Y371 HydrophobicContact CG2-CE1 3.78Å; C263-Y371 WeakPolarHBondContact CB-OH 3.49Å; L298-Y371 HydrophobicContact CD1-CD1 4.33Å; L298-Y371 HydrophobicContact CD1-CD2 3.69Å; L298-Y371 HydrophobicContact CD1-CE1 4.29Å; L298-Y371 HydrophobicContact CD1-CE2 3.64Å; L298-Y371 HydrophobicContact CD1-CG 4.04Å; H344-Y371 CarbonylContact C-O 3.53Å; H344-Y371 WeakPolarHBondContact CA-O 3.26Å; L345-Y371 HydrophobicContact CD1-CD1 4.24Å; L345-Y371 PolarHBondContact N-O 3.47Å; L345-Y371 PolarHBondContact O-N 3.24Å; Y371-M373 HydrophobicContact CD1-CG 4.24Å; Y371-M373 HydrophobicContact CE1-CG 4.28Å; Y371-T376 VanDerWaalsContact CE2-C 3.47Å; Y371-T376 WeakPolarHBondContact CE2-O 3.09Å; Y371-T376 WeakPolarHBondContact OH-CA 3.3Å; Y371-T376 WeakPolarHBondContact OH-CB 3.36Å; Y371-E377 WeakPolarHBondContact CD2-O 3.49Å; Y371-V378 HydrophobicContact CD2-CG2 4.08Å
372	N	97.1	Very high	91.2	Very high	25 Å²	25	36.2 Å²	36.2	13%	0.134	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	117.2	173.3	-174	-50.7	0	0	0	109.3	H344 V374 S375 T376 E377 L379	H344-N372 PolarHBondContact NE2-ND2 2.8Å; N372-V374 VanDerWaalsContact C-N 3.3Å; N372-V374 PolarHBondContact O-N 3.47Å; N372-V374 WeakPolarHBondContact OD1-CA 3.21Å; N372-V374 WeakPolarHBondContact OD1-CB 3.14Å; N372-V374 PolarHBondContact OD1-N 3Å; N372-S375 WeakPolarHBondContact CB-OG 3.3Å; N372-S375 VanDerWaalsContact CG-OG 3.3Å; N372-S375 PolarHBondContact OD1-N 3.26Å; N372-S375 PolarHBondContact OD1-OG 2.9Å; N372-T376 CarbonylContact O-C 3.53Å; N372-T376 WeakPolarHBondContact O-CA 3.45Å; N372-T376 PolarHBondContact O-N 2.93Å; N372-E377 PolarHBondContact N-O 3.17Å; N372-E377 PolarHBondContact O-N 3.19Å; N372-L379 HydrophobicContact CB-CD1 4.14Å; N372-L379 HydrophobicContact CB-CD2 4.47Å; N372-L379 HydrophobicContact CB-CG 4.24Å
373	M	94.8	Very high	92.9	Very high	7 Å²	7	35.2 Å²	35.2	3%	0.034	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-28	-177.8	-61.3	-175.1	-75.9	0	0	112.9	V244 R257 I259 L339 E342 H343 L345 Y371	V244-M373 HydrophobicContact CG2-SD 3.93Å; R257-M373 VanDerWaalsContact NH1-C 3.34Å; R257-M373 PolarHBondContact NH1-O 3.21Å; I259-M373 HydrophobicContact CD1-CB 4.2Å; I259-M373 HydrophobicContact CD1-CG 3.66Å; I259-M373 HydrophobicContact CD1-SD 3.83Å; L339-M373 HydrophobicContact CD2-CE 3.58Å; L339-M373 HydrophobicContact CD2-SD 4.27Å; E342-M373 WeakPolarHBondContact O-CE 3.5Å; H343-M373 WeakPolarHBondContact O-CB 3.39Å; H343-M373 WeakPolarHBondContact O-CG 3.36Å; H343-M373 PolarHBondContact O-N 2.96Å; L345-M373 HydrophobicContact CD1-CG 3.61Å; L345-M373 HydrophobicContact CD1-SD 3.55Å; L345-M373 VanDerWaalsContact CD1-SD 3.55Å; L345-M373 HydrophobicContact CD2-SD 4.28Å; L345-M373 HydrophobicContact CG-CE 4.35Å; L345-M373 HydrophobicContact CG-CG 3.81Å; L345-M373 HydrophobicContact CG-SD 3.59Å; L345-M373 VanDerWaalsContact CG-SD 3.59Å; Y371-M373 HydrophobicContact CD1-CG 4.24Å; Y371-M373 HydrophobicContact CE1-CG 4.28Å
374	V	93.4	Very high	94.3	Very high	84 Å²	84	33.5 Å²	33.5	51%	0.509	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-53.7	-175.9	-177.3	0	0	0	0	111	H343 N372 T376	H343-V374 HydrophobicContact CB-CG2 4.19Å; N372-V374 VanDerWaalsContact C-N 3.3Å; N372-V374 PolarHBondContact O-N 3.47Å; N372-V374 WeakPolarHBondContact OD1-CA 3.21Å; N372-V374 WeakPolarHBondContact OD1-CB 3.14Å; N372-V374 PolarHBondContact OD1-N 3Å; V374-T376 VanDerWaalsContact C-N 3.26Å; V374-T376 PolarHBondContact O-N 3.02Å
375	S	94.8	Very high	95.2	Very high	40 Å²	40	31.8 Å²	31.8	28%	0.28	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.1	177.1	66.4	0	0	0	0	112.9	Y264 N372 E377	Y264-S375 PolarHBondContact OH-O 2.92Å; N372-S375 WeakPolarHBondContact CB-OG 3.3Å; N372-S375 VanDerWaalsContact CG-OG 3.3Å; N372-S375 PolarHBondContact OD1-N 3.26Å; N372-S375 PolarHBondContact OD1-OG 2.9Å; S375-E377 VanDerWaalsContact C-N 3.25Å; S375-E377 PolarHBondContact O-N 3.39Å; S375-E377 PolarHBondContact OG-OE2 2.9Å
376	T	95.3	Very high	95.8	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	26.9	-172.9	74.1	0	0	0	0	114.1	C263 Y264 R301 Y371 N372 V374	C263-T376 HydrophobicContact CB-CG2 4.07Å; Y264-T376 HydrophobicContact CD1-CG2 3.65Å; Y264-T376 HydrophobicContact CD2-CG2 4.3Å; Y264-T376 HydrophobicContact CE1-CG2 3.31Å; Y264-T376 HydrophobicContact CE2-CG2 4.02Å; Y264-T376 WeakPolarHBondContact CE2-OG1 3.42Å; Y264-T376 HydrophobicContact CG-CG2 4.13Å; Y264-T376 PolarHBondContact OH-OG1 2.94Å; R301-T376 WeakPolarHBondContact CD-O 3.46Å; R301-T376 VanDerWaalsContact CZ-O 3.25Å; R301-T376 PolarHBondContact NE-O 3.23Å; R301-T376 PolarHBondContact NH1-O 3.26Å; R301-T376 PolarHBondContact NH1-OG1 3.22Å; R301-T376 VanDerWaalsContact NH1-OG1 3.09Å; R301-T376 PolarHBondContact NH2-OG1 2.73Å; Y371-T376 VanDerWaalsContact CE2-C 3.47Å; Y371-T376 WeakPolarHBondContact CE2-O 3.09Å; Y371-T376 WeakPolarHBondContact OH-CA 3.3Å; Y371-T376 WeakPolarHBondContact OH-CB 3.36Å; N372-T376 CarbonylContact O-C 3.53Å; N372-T376 WeakPolarHBondContact O-CA 3.45Å; N372-T376 PolarHBondContact O-N 2.93Å; V374-T376 VanDerWaalsContact C-N 3.26Å; V374-T376 PolarHBondContact O-N 3.02Å
377	E	96.4	Very high	96	Very high	110 Å²	110	33 Å²	33	51%	0.514	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	142	-176.4	-63.3	179.2	142.3	0	0	112.1	Y371 N372 S375 L379	Y371-E377 WeakPolarHBondContact CD2-O 3.49Å; N372-E377 PolarHBondContact N-O 3.17Å; N372-E377 PolarHBondContact O-N 3.19Å; S375-E377 VanDerWaalsContact C-N 3.25Å; S375-E377 PolarHBondContact O-N 3.39Å; S375-E377 PolarHBondContact OG-OE2 2.9Å; E377-L379 HydrophobicContact CB-CD2 4.27Å; E377-L379 PolarHBondContact O-N 3.34Å
378	V	97.8	Very high	96	Very high	15 Å²	15	37 Å²	37	9%	0.091	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	114.4	165.1	175	0	0	0	0	107.4	R301 Y305 V369 Y371 V381	R301-V378 HydrophobicContact CB-CG2 4.06Å; Y305-V378 HydrophobicContact CD1-CG1 4.2Å; Y305-V378 HydrophobicContact CD2-CB 4.23Å; Y305-V378 HydrophobicContact CD2-CG1 3.92Å; Y305-V378 WeakPolarHBondContact CD2-O 3.41Å; Y305-V378 WeakPolarHBondContact CE2-O 3.18Å; Y305-V378 HydrophobicContact CG-CB 4.26Å; Y305-V378 HydrophobicContact CG-CG1 3.74Å; V369-V378 HydrophobicContact CG1-CG1 3.78Å; V369-V378 HydrophobicContact CG1-CG2 4.25Å; Y371-V378 HydrophobicContact CD2-CG2 4.08Å; V378-V381 HydrophobicContact CG1-CG2 3.64Å
379	L	97.2	Very high	95.9	Very high	75 Å²	75	37.1 Å²	37.1	39%	0.393	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-38	-175.9	-59.3	-176.3	0	0	0	112.3	Y305 H344 V370 N372 E377	Y305-L379 WeakPolarHBondContact CE2-O 3.23Å; Y305-L379 PolarHBondContact OH-O 3.13Å; H344-L379 VanDerWaalsContact CD2-CD1 3.45Å; H344-L379 WeakPolarHBondContact CD2-CD1 3.35Å; V370-L379 HydrophobicContact CB-CB 4.47Å; V370-L379 HydrophobicContact CG1-CB 4.28Å; V370-L379 HydrophobicContact CG1-CD1 4.34Å; V370-L379 PolarHBondContact O-N 3.35Å; N372-L379 HydrophobicContact CB-CD1 4.14Å; N372-L379 HydrophobicContact CB-CD2 4.47Å; N372-L379 HydrophobicContact CB-CG 4.24Å; E377-L379 HydrophobicContact CB-CD2 4.27Å; E377-L379 PolarHBondContact O-N 3.34Å
380	A	96.8	Very high	95.7	Very high	18 Å²	18	37.1 Å²	37.1	15%	0.149	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	147.8	-178	0	0	0	0	0	112	V369 V370 F382	V369-A380 WeakPolarHBondContact CA-O 3.47Å; V370-A380 HydrophobicContact CB-CB 4.18Å; V370-A380 HydrophobicContact CG2-CB 4.16Å; V370-A380 PolarHBondContact N-O 3.29Å; A380-F382 HydrophobicContact CB-CD2 4.42Å; A380-F382 HydrophobicContact CB-CE2 3.58Å; A380-F382 HydrophobicContact CB-CZ 3.77Å
381	V	97.3	Very high	95.6	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	125.2	173	-175.4	0	0	0	0	109.5	L302 Y305 L306 R309 F367 F368 V369 V378	L302-V381 HydrophobicContact CD1-CG1 4.14Å; L302-V381 HydrophobicContact CD1-CG2 3.54Å; Y305-V381 HydrophobicContact CD1-CB 4Å; Y305-V381 HydrophobicContact CD1-CG2 3.36Å; Y305-V381 HydrophobicContact CE1-CB 3.81Å; Y305-V381 HydrophobicContact CE1-CG2 3.59Å; Y305-V381 HydrophobicContact CG-CG2 4.19Å; L306-V381 HydrophobicContact CD2-CB 4.09Å; L306-V381 HydrophobicContact CD2-CG1 3.89Å; L306-V381 HydrophobicContact CD2-CG2 4.44Å; R309-V381 PolarHBondContact NH1-O 2.65Å; F367-V381 HydrophobicContact CB-CG1 4.3Å; F367-V381 HydrophobicContact CD1-CG1 3.9Å; F368-V381 CarbonylContact O-C 3.54Å; F368-V381 VanDerWaalsContact O-CA 3.3Å; F368-V381 WeakPolarHBondContact O-CA 3.27Å; V369-V381 HydrophobicContact CG1-CG2 4.37Å; V369-V381 HydrophobicContact CG2-CG1 4.26Å; V369-V381 HydrophobicContact CG2-CG2 4.25Å; V378-V381 HydrophobicContact CG1-CG2 3.64Å
382	F	96.5	Very high	95.3	Very high	19 Å²	19	44.9 Å²	44.9	8%	0.083	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.8	-179.7	-53.9	-80.6	0	0	0	110.7	F367 F368 V370 A380 Q388 L389 L392	F367-F382 CarbonylContact C-O 3.55Å; F367-F382 VanDerWaalsContact CA-O 3.3Å; F367-F382 WeakPolarHBondContact CA-O 3.25Å; F368-F382 HydrophobicContact CB-CB 4.29Å; F368-F382 PolarHBondContact N-O 2.99Å; F368-F382 PolarHBondContact O-N 3.19Å; V370-F382 HydrophobicContact CG2-CE2 4.28Å; A380-F382 HydrophobicContact CB-CD2 4.42Å; A380-F382 HydrophobicContact CB-CE2 3.58Å; A380-F382 HydrophobicContact CB-CZ 3.77Å; F382-Q388 HydrophobicContact CE1-CG 4.26Å; F382-L389 HydrophobicContact CB-CB 4.03Å; F382-L389 HydrophobicContact CB-CD2 3.81Å; F382-L389 HydrophobicContact CB-CG 4.45Å; F382-L389 HydrophobicContact CD1-CB 3.99Å; F382-L389 HydrophobicContact CD2-CB 4.37Å; F382-L389 HydrophobicContact CD2-CD1 4.04Å; F382-L389 HydrophobicContact CD2-CD2 4.23Å; F382-L389 HydrophobicContact CD2-CG 4.44Å; F382-L389 HydrophobicContact CE2-CD1 4.24Å; F382-L389 HydrophobicContact CG-CB 3.87Å; F382-L389 HydrophobicContact CG-CD1 4.41Å; F382-L389 HydrophobicContact CG-CD2 4.15Å; F382-L389 HydrophobicContact CG-CG 4.36Å; F382-L392 HydrophobicContact CZ-CD1 4.37Å
383	E	93.9	Very high	95.1	Very high	87 Å²	87	43.7 Å²	43.7	41%	0.407	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	158.9	168.2	-67.1	177.9	172.7	0	0	110.4	F367 T385 S386	F367-E383 HydrophobicContact CD1-CG 3.99Å; F367-E383 HydrophobicContact CE1-CG 3.53Å; F367-E383 HydrophobicContact CZ-CG 4.28Å; E383-T385 PolarHBondContact O-N 3.4Å; E383-S386 WeakPolarHBondContact O-CB 3.41Å; E383-S386 PolarHBondContact O-N 2.97Å
384	N	92.6	Very high	94.9	Very high	13 Å²	13	45.4 Å²	45.4	7%	0.07	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-2.8	175.1	66.7	-22.7	0	0	0	115.1	Q364 S366 F368 R446	Q364-N384 PolarHBondContact O-ND2 2.72Å; Q364-N384 VanDerWaalsContact O-ND2 3.13Å; S366-N384 PolarHBondContact O-N 3.22Å; S366-N384 VanDerWaalsContact OG-CB 3.31Å; S366-N384 WeakPolarHBondContact OG-CB 3.37Å; S366-N384 PolarHBondContact OG-ND2 3.48Å; F368-N384 HydrophobicContact CE2-CB 4.11Å; N384-R446 WeakPolarHBondContact O-CA 3.36Å
385	T	93.9	Very high	94.7	Very high	37 Å²	37	45.4 Å²	45.4	23%	0.227	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	16	173.4	53.4	0	0	0	0	112.5	E383 D387 T442	E383-T385 PolarHBondContact O-N 3.4Å; T385-D387 PolarHBondContact O-N 2.92Å; T385-T442 HydrophobicContact CG2-CG2 3.46Å; T385-T442 VanDerWaalsContact CG2-CG2 3.46Å
386	S	95.3	Very high	94.4	Very high	22 Å²	22	48.7 Å²	48.7	15%	0.154	25%	0.245	C	C	.	.			trans	-76.1	115.3	-177.4	-178.8	0	0	0	0	112.8	E383 Q388 L389 L390	E383-S386 WeakPolarHBondContact O-CB 3.41Å; E383-S386 PolarHBondContact O-N 2.97Å; S386-Q388 VanDerWaalsContact C-N 3.3Å; S386-Q388 PolarHBondContact O-N 2.81Å; S386-L389 PolarHBondContact O-N 3.21Å; S386-L389 PolarHBondContact OG-N 3.41Å; S386-L390 PolarHBondContact O-N 2.88Å
387	D	95.5	Very high	94	Very high	84 Å²	84	48.6 Å²	48.6	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-64.8	-34.4	173.1	-66.3	-55.9	0	0	0	112.6	T385 L389 L390 E391 H441 V445	T385-D387 PolarHBondContact O-N 2.92Å; D387-L389 PolarHBondContact O-N 2.81Å; D387-L390 WeakPolarHBondContact O-CB 3.5Å; D387-L390 PolarHBondContact O-N 2.83Å; D387-L390 VanDerWaalsContact O-N 3.17Å; D387-E391 PolarHBondContact O-N 3.4Å; D387-H441 IonicContact OD1-CE1 3.78Å; D387-H441 PolarHBondContact OD1-CE1 3.47Å; D387-H441 IonicContact OD1-ND1 3.13Å; D387-H441 IonicContact OD1-NE2 2.76Å; D387-H441 PolarHBondContact OD1-NE2 2.7Å; D387-V445 WeakPolarHBondContact OD1-CG2 3.42Å
388	Q	96	Very high	93.4	Very high	113 Å²	113	45.6 Å²	45.6	53%	0.528	23%	0.232	S	C	.	.	H	α-helix	trans	-61.2	-45.8	177.1	-173.6	-176.8	11.4	0	0	111.6	F382 S386 L390 E391 L392	F382-Q388 HydrophobicContact CE1-CG 4.26Å; S386-Q388 VanDerWaalsContact C-N 3.3Å; S386-Q388 PolarHBondContact O-N 2.81Å; Q388-L390 VanDerWaalsContact C-N 3.29Å; Q388-L390 PolarHBondContact O-N 3.45Å; Q388-E391 PolarHBondContact O-N 3.05Å; Q388-L392 WeakPolarHBondContact O-CG 3.05Å; Q388-L392 PolarHBondContact O-N 2.72Å
389	L	95.7	Very high	92.7	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-66.2	-36.1	176.4	-178.5	60.6	0	0	0	111.2	F346 F368 F382 S386 D387 L392 F393 L449 L452	F346-L389 HydrophobicContact CZ-CD1 4.17Å; F346-L389 HydrophobicContact CZ-CD2 4.12Å; F368-L389 HydrophobicContact CB-CD2 3.91Å; F368-L389 HydrophobicContact CD2-CD2 3.48Å; F368-L389 VanDerWaalsContact CD2-CD2 3.48Å; F368-L389 HydrophobicContact CE2-CD2 4.08Å; F368-L389 HydrophobicContact CG-CD2 3.73Å; F382-L389 HydrophobicContact CB-CB 4.03Å; F382-L389 HydrophobicContact CB-CD2 3.81Å; F382-L389 HydrophobicContact CB-CG 4.45Å; F382-L389 HydrophobicContact CD1-CB 3.99Å; F382-L389 HydrophobicContact CD2-CB 4.37Å; F382-L389 HydrophobicContact CD2-CD1 4.04Å; F382-L389 HydrophobicContact CD2-CD2 4.23Å; F382-L389 HydrophobicContact CD2-CG 4.44Å; F382-L389 HydrophobicContact CE2-CD1 4.24Å; F382-L389 HydrophobicContact CG-CB 3.87Å; F382-L389 HydrophobicContact CG-CD1 4.41Å; F382-L389 HydrophobicContact CG-CD2 4.15Å; F382-L389 HydrophobicContact CG-CG 4.36Å; S386-L389 PolarHBondContact O-N 3.21Å; S386-L389 PolarHBondContact OG-N 3.41Å; D387-L389 PolarHBondContact O-N 2.81Å; L389-L392 PolarHBondContact O-N 2.94Å; L389-F393 WeakPolarHBondContact O-CB 3.22Å; L389-F393 PolarHBondContact O-N 3.43Å; L389-L449 HydrophobicContact CB-CD1 4.31Å; L389-L449 HydrophobicContact CB-CD2 4.32Å; L389-L449 HydrophobicContact CD2-CD1 4.16Å; L389-L449 HydrophobicContact CD2-CD2 4.01Å; L389-L449 HydrophobicContact CG-CD1 4.38Å; L389-L449 HydrophobicContact CG-CD2 3.78Å; L389-L452 HydrophobicContact CD2-CD1 4.5Å
390	L	94.5	Very high	92.2	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-43.8	175.7	179.1	63.5	0	0	0	111.7	S386 D387 Q388 F393 E394 V445 L448 L449	S386-L390 PolarHBondContact O-N 2.88Å; D387-L390 WeakPolarHBondContact O-CB 3.5Å; D387-L390 PolarHBondContact O-N 2.83Å; D387-L390 VanDerWaalsContact O-N 3.17Å; Q388-L390 VanDerWaalsContact C-N 3.29Å; Q388-L390 PolarHBondContact O-N 3.45Å; L390-F393 PolarHBondContact O-N 2.78Å; L390-E394 HydrophobicContact CD1-CG 4.01Å; L390-E394 HydrophobicContact CG-CG 4.28Å; L390-E394 WeakPolarHBondContact O-CB 3.21Å; L390-E394 WeakPolarHBondContact O-CG 3.03Å; L390-E394 PolarHBondContact O-N 3.23Å; L390-V445 HydrophobicContact CB-CG1 4.3Å; L390-V445 HydrophobicContact CD2-CB 4.2Å; L390-V445 HydrophobicContact CD2-CG1 4.3Å; L390-V445 HydrophobicContact CD2-CG2 3.6Å; L390-L448 HydrophobicContact CD1-CB 3.67Å; L390-L448 HydrophobicContact CD1-CD1 3.78Å; L390-L448 HydrophobicContact CD1-CG 4.36Å; L390-L448 HydrophobicContact CD2-CD1 4.24Å; L390-L449 HydrophobicContact CB-CD2 4.3Å; L390-L449 HydrophobicContact CB-CG 4.48Å; L390-L449 HydrophobicContact CD1-CD2 4.42Å
391	E	93.9	Very high	91.4	Very high	119 Å²	119	48.9 Å²	48.9	56%	0.556	24%	0.243	S	C	*	.	H	α-helix	trans	-60.6	-45.6	176.7	-176.7	179.1	-173.4	0	0	111.2	D387 Q388 F393 E394 N395	D387-E391 PolarHBondContact O-N 3.4Å; Q388-E391 PolarHBondContact O-N 3.05Å; E391-F393 VanDerWaalsContact C-N 3.31Å; E391-F393 PolarHBondContact O-N 3.09Å; E391-E394 PolarHBondContact O-N 3.41Å; E391-N395 WeakPolarHBondContact CG-ND2 3.12Å; E391-N395 WeakPolarHBondContact O-CB 3.41Å; E391-N395 PolarHBondContact O-N 3.11Å; E391-N395 PolarHBondContact O-ND2 2.8Å
392	L	93.6	Very high	90.1	Very high	66 Å²	66	49.2 Å²	49.2	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-59	-44	174.3	-70.9	174	0	0	0	111.4	F382 Q388 L389 F396	F382-L392 HydrophobicContact CZ-CD1 4.37Å; Q388-L392 WeakPolarHBondContact O-CG 3.05Å; Q388-L392 PolarHBondContact O-N 2.72Å; L389-L392 PolarHBondContact O-N 2.94Å; L392-F396 HydrophobicContact CD2-CD2 4.17Å; L392-F396 HydrophobicContact CD2-CE2 4.28Å; L392-F396 WeakPolarHBondContact O-CA 3.33Å; L392-F396 WeakPolarHBondContact O-CB 3.46Å; L392-F396 PolarHBondContact O-N 2.84Å
393	F	92.1	Very high	88.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-40.3	179.6	179.8	-118.6	0	0	0	113.1	L389 L390 E391 C397 F400 L452 I454	L389-F393 WeakPolarHBondContact O-CB 3.22Å; L389-F393 PolarHBondContact O-N 3.43Å; L390-F393 PolarHBondContact O-N 2.78Å; E391-F393 VanDerWaalsContact C-N 3.31Å; E391-F393 PolarHBondContact O-N 3.09Å; F393-C397 WeakPolarHBondContact CE2-SG 3.15Å; F393-C397 WeakPolarHBondContact O-CA 3.37Å; F393-C397 WeakPolarHBondContact O-CB 3.36Å; F393-C397 PolarHBondContact O-N 2.95Å; F393-C397 VanDerWaalsContact O-N 3.1Å; F393-F400 HydrophobicContact CD2-CB 4.49Å; F393-F400 HydrophobicContact CD2-CD2 4.06Å; F393-F400 HydrophobicContact CD2-CE2 4.47Å; F393-F400 HydrophobicContact CD2-CG 4.21Å; F393-F400 HydrophobicContact CE2-CB 4.46Å; F393-L452 HydrophobicContact CB-CD1 4.42Å; F393-L452 HydrophobicContact CD2-CD1 4.09Å; F393-L452 HydrophobicContact CD2-CD2 3.96Å; F393-L452 HydrophobicContact CD2-CG 4.31Å; F393-L452 HydrophobicContact CE2-CD2 3.81Å; F393-L452 HydrophobicContact CE2-CG 4.33Å; F393-L452 HydrophobicContact CG-CD1 4.2Å; F393-I454 HydrophobicContact CE2-CD1 4Å
394	E	90.4	Very high	86.2	Confident	42 Å²	42	46.5 Å²	46.5	20%	0.196	24%	0.237	C	C	.	.	H	α-helix	trans	-67.7	-40.2	178.3	-75.4	-178.5	168.5	0	0	111.5	L390 E391 K430	L390-E394 HydrophobicContact CD1-CG 4.01Å; L390-E394 HydrophobicContact CG-CG 4.28Å; L390-E394 WeakPolarHBondContact O-CB 3.21Å; L390-E394 WeakPolarHBondContact O-CG 3.03Å; L390-E394 PolarHBondContact O-N 3.23Å; E391-E394 PolarHBondContact O-N 3.41Å; E394-K430 IonicContact OE1-NZ 3.37Å; E394-K430 PolarHBondContact OE1-NZ 2.81Å; E394-K430 IonicContact OE2-NZ 2.85Å; E394-K430 PolarHBondContact OE2-NZ 2.86Å
395	N	89.3	Confident	84.6	Confident	84 Å²	84	47 Å²	47	45%	0.449	24%	0.24	S	C	.	.	H	α-helix	trans	-85.2	-30.9	-176.1	-69.3	-34.8	0	0	0	113.8	E391 S417	E391-N395 WeakPolarHBondContact CG-ND2 3.12Å; E391-N395 WeakPolarHBondContact O-CB 3.41Å; E391-N395 PolarHBondContact O-N 3.11Å; E391-N395 PolarHBondContact O-ND2 2.8Å; N395-S417 WeakPolarHBondContact O-CB 3.32Å
396	F	88.3	Confident	82.7	Confident	109 Å²	109	49 Å²	49	48%	0.478	25%	0.246	S	C	.	.	S	Bend	trans	-124.6	29.5	-174.1	-54.6	-77.4	0	0	0	113.2	L392 D398 L399	L392-F396 HydrophobicContact CD2-CD2 4.17Å; L392-F396 HydrophobicContact CD2-CE2 4.28Å; L392-F396 WeakPolarHBondContact O-CA 3.33Å; L392-F396 WeakPolarHBondContact O-CB 3.46Å; L392-F396 PolarHBondContact O-N 2.84Å; F396-D398 PolarHBondContact O-N 2.86Å; F396-L399 HydrophobicContact CB-CD1 4.08Å; F396-L399 HydrophobicContact CB-CG 4.45Å; F396-L399 HydrophobicContact CD1-CD1 4.48Å; F396-L399 WeakPolarHBondContact O-CB 3.46Å; F396-L399 PolarHBondContact O-N 3.06Å
397	C	86.9	Confident	80.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-49.9	-36.3	-176.6	-159.5	0	0	0	0	113.9	F393 L399 F400 R401 S417	F393-C397 WeakPolarHBondContact CE2-SG 3.15Å; F393-C397 WeakPolarHBondContact O-CA 3.37Å; F393-C397 WeakPolarHBondContact O-CB 3.36Å; F393-C397 PolarHBondContact O-N 2.95Å; F393-C397 VanDerWaalsContact O-N 3.1Å; C397-L399 VanDerWaalsContact C-N 3.28Å; C397-L399 PolarHBondContact O-N 3.32Å; C397-F400 PolarHBondContact O-N 3.5Å; C397-F400 VanDerWaalsContact O-N 3.07Å; C397-R401 WeakPolarHBondContact O-CG 3.37Å; C397-R401 PolarHBondContact O-N 3.37Å; C397-R401 VanDerWaalsContact SG-CZ 3.56Å; C397-R401 PolarHBondContact SG-NE 2.86Å; C397-R401 PolarHBondContact SG-NH2 3.46Å; C397-R401 VanDerWaalsContact SG-NH2 3.37Å; C397-S417 PolarHBondContact N-OG 3.43Å
398	D	83.8	Confident	78.6	Confident	46 Å²	46	52.5 Å²	52.5	25%	0.246	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-35.4	-179.8	-66.5	-45.7	0	0	0	113.5	F396 F400 R401 S415 S417 S418	F396-D398 PolarHBondContact O-N 2.86Å; D398-F400 PolarHBondContact O-N 3.34Å; D398-R401 PolarHBondContact O-N 3.5Å; D398-S415 WeakPolarHBondContact OD1-CB 3.42Å; D398-S415 PolarHBondContact OD1-OG 2.85Å; D398-S415 PolarHBondContact OD2-OG 2.83Å; D398-S417 PolarHBondContact N-OG 3.47Å; D398-S417 PolarHBondContact OD2-OG 3.45Å; D398-S418 WeakPolarHBondContact OD2-CB 3.45Å
399	L	84.1	Confident	76.4	Confident	123 Å²	123	49.1 Å²	49.1	64%	0.644	25%	0.253	S	S	*	.	H	α-helix	trans	-66.3	-26.8	177.4	-59.8	-178.5	0	0	0	111.8	F396 C397	F396-L399 HydrophobicContact CB-CD1 4.08Å; F396-L399 HydrophobicContact CB-CG 4.45Å; F396-L399 HydrophobicContact CD1-CD1 4.48Å; F396-L399 WeakPolarHBondContact O-CB 3.46Å; F396-L399 PolarHBondContact O-N 3.06Å; C397-L399 VanDerWaalsContact C-N 3.28Å; C397-L399 PolarHBondContact O-N 3.32Å
400	F	85.6	Confident	74.5	Confident	21 Å²	21	49.5 Å²	49.5	9%	0.092	26%	0.256	C	S	.	.	H	α-helix	trans	-86.1	-19.3	175.6	-67.3	-94	0	0	0	113.5	Q338 L340 F346 F393 C397 D398 L452 I454	Q338-F400 PolarHBondContact NE2-O 3.31Å; L340-F400 HydrophobicContact CD2-CD1 3.79Å; L340-F400 HydrophobicContact CD2-CE1 3.92Å; F346-F400 HydrophobicContact CD1-CE1 4.37Å; F346-F400 HydrophobicContact CE1-CD1 4.42Å; F346-F400 HydrophobicContact CE1-CE1 4.06Å; F346-F400 HydrophobicContact CZ-CE1 4.37Å; F393-F400 HydrophobicContact CD2-CB 4.49Å; F393-F400 HydrophobicContact CD2-CD2 4.06Å; F393-F400 HydrophobicContact CD2-CE2 4.47Å; F393-F400 HydrophobicContact CD2-CG 4.21Å; F393-F400 HydrophobicContact CE2-CB 4.46Å; C397-F400 PolarHBondContact O-N 3.5Å; C397-F400 VanDerWaalsContact O-N 3.07Å; D398-F400 PolarHBondContact O-N 3.34Å; F400-L452 HydrophobicContact CB-CD2 4.41Å; F400-L452 HydrophobicContact CD1-CD2 3.83Å; F400-L452 HydrophobicContact CE1-CD1 4.47Å; F400-L452 HydrophobicContact CE1-CD2 4.42Å; F400-L452 HydrophobicContact CG-CD2 4.31Å; F400-I454 HydrophobicContact CB-CD1 3.94Å
401	R	79.3	Confident	72.7	Confident	33 Å²	33	53.6 Å²	53.6	13%	0.125	28%	0.275	C	S	.	.	H	α-helix	trans	-84.9	-21.2	-171.9	-71.3	179.2	-178.2	-169.2	-0.6	113.5	C397 D398 A403 C414 I454 Y459	C397-R401 WeakPolarHBondContact O-CG 3.37Å; C397-R401 PolarHBondContact O-N 3.37Å; C397-R401 VanDerWaalsContact SG-CZ 3.56Å; C397-R401 PolarHBondContact SG-NE 2.86Å; C397-R401 PolarHBondContact SG-NH2 3.46Å; C397-R401 VanDerWaalsContact SG-NH2 3.37Å; D398-R401 PolarHBondContact O-N 3.5Å; R401-A403 HydrophobicContact CB-CB 3.77Å; R401-A403 PolarHBondContact O-N 3.49Å; R401-C414 PolarHBondContact NH1-O 3.34Å; R401-I454 HydrophobicContact CG-CD1 3.93Å; R401-Y459 HydrophobicContact CB-CD2 4.13Å; R401-Y459 HydrophobicContact CB-CE2 4.01Å; R401-Y459 HydrophobicContact CG-CD2 4.22Å; R401-Y459 HydrophobicContact CG-CE2 3.67Å
402	N	70.7	Confident	71.3	Confident	11 Å²	11	53 Å²	53	6%	0.059	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	39.6	38.8	-166.1	-163.2	22.5	0	0	0	110.9	Y226 L227 Y228 T404	Y226-N402 HydrophobicContact CE1-CB 4.42Å; Y226-N402 WeakPolarHBondContact OH-CB 3.25Å; L227-N402 PolarHBondContact O-ND2 2.94Å; L227-N402 VanDerWaalsContact O-ND2 3.15Å; Y228-N402 HydrophobicContact CD2-CB 4.43Å; Y228-N402 WeakPolarHBondContact CD2-ND2 3.43Å; N402-T404 PolarHBondContact O-N 3.36Å
403	A	54	Low	70.1	Confident	19 Å²	19	51.2 Å²	51.2	16%	0.157	26%	0.263	C	S	.	.			trans	-77.3	-14.6	-167.1	0	0	0	0	0	112.3	R401 P413	R401-A403 HydrophobicContact CB-CB 3.77Å; R401-A403 PolarHBondContact O-N 3.49Å; A403-P413 HydrophobicContact CB-CB 3.82Å; A403-P413 HydrophobicContact CB-CG 4.25Å
404	T	54.7	Low	69.4	Low	30 Å²	30	52 Å²	52	18%	0.184	27%	0.268	C	S	.	.	S	Bend	trans	-103.1	100.4	167.2	57.2	0	0	0	0	106.4	N402 H406 V410 P413	N402-T404 PolarHBondContact O-N 3.36Å; T404-H406 PolarHBondContact O-N 3.07Å; T404-H406 VanDerWaalsContact O-N 3.15Å; T404-V410 HydrophobicContact CG2-CB 4.34Å; T404-V410 HydrophobicContact CG2-CG1 4.13Å; T404-V410 VanDerWaalsContact CG2-O 3.27Å; T404-V410 WeakPolarHBondContact CG2-O 3.47Å; T404-P413 HydrophobicContact CG2-CG 4.03Å
405	L	58.1	Low	69	Low	23 Å²	23	50 Å²	50	12%	0.12	26%	0.259	C	S	.	.			trans	-49	124.6	143.6	-71.2	162.2	0	0	0	104.3	P70 F150 D152 S407 Q457	P70-L405 HydrophobicContact CB-CD1 3.56Å; P70-L405 HydrophobicContact CG-CD1 3.14Å; F150-L405 HydrophobicContact CB-CD1 4.32Å; F150-L405 WeakPolarHBondContact O-CD2 3.35Å; D152-L405 WeakPolarHBondContact OD1-CA 3.39Å; D152-L405 WeakPolarHBondContact OD1-CB 3.17Å; D152-L405 WeakPolarHBondContact OD1-CD2 3.42Å; L405-S407 PolarHBondContact O-N 2.89Å; L405-Q457 HydrophobicContact CD2-CG 4.42Å
406	H	55.3	Low	68.8	Low	79 Å²	79	46.1 Å²	46.1	37%	0.366	24%	0.239	S	C	.	.	S	Bend	trans	-64.4	21.8	-157.6	-67.6	-79.6	0	0	0	115.2	D152 Y228 R229 T404	D152-H406 PolarHBondContact OD1-N 3.24Å; D152-H406 VanDerWaalsContact OD1-N 3.1Å; D152-H406 IonicContact OD2-CD2 3.99Å; D152-H406 PolarHBondContact OD2-CD2 3.34Å; Y228-H406 AromaticContact CZ-NE2 3.83Å; R229-H406 PolarHBondContact NE-NE2 3.1Å; T404-H406 PolarHBondContact O-N 3.07Å; T404-H406 VanDerWaalsContact O-N 3.15Å
407	S	52.7	Low	68.6	Low	39 Å²	39	41.8 Å²	41.8	27%	0.273	22%	0.222	S	C	.	.			trans	-55.1	131.2	164.8	-179.4	0	0	0	0	112.8	L405 A409 V410	L405-S407 PolarHBondContact O-N 2.89Å; S407-A409 PolarHBondContact O-N 2.83Å; S407-A409 PolarHBondContact OG-N 2.81Å; S407-V410 PolarHBondContact O-N 3.03Å
408	Q	51.3	Low	68.4	Low	140 Å²	140	45 Å²	45	65%	0.654	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-56.9	-23.9	177	-63.1	-178.2	0.5	0	0	112.9	V410	Q408-V410 VanDerWaalsContact C-N 3.34Å; Q408-V410 PolarHBondContact O-N 2.68Å
409	A	49.2	Very low	68.6	Low	42 Å²	42	43.4 Å²	43.4	35%	0.347	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-73.1	-20.8	-177	0	0	0	0	0	114.2	S407 F529	S407-A409 PolarHBondContact O-N 2.83Å; S407-A409 PolarHBondContact OG-N 2.81Å; A409-F529 HydrophobicContact CB-CE1 3.61Å; A409-F529 HydrophobicContact CB-CZ 3.7Å
410	V	57.3	Low	68.9	Low	11 Å²	11	43.2 Å²	43.2	7%	0.067	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-112.2	4.8	-169.2	-167.9	0	0	0	0	113.3	R43 T404 S407 Q408 F412	R43-V410 PolarHBondContact NH2-O 3.13Å; T404-V410 HydrophobicContact CG2-CB 4.34Å; T404-V410 HydrophobicContact CG2-CG1 4.13Å; T404-V410 VanDerWaalsContact CG2-O 3.27Å; T404-V410 WeakPolarHBondContact CG2-O 3.47Å; S407-V410 PolarHBondContact O-N 3.03Å; Q408-V410 VanDerWaalsContact C-N 3.34Å; Q408-V410 PolarHBondContact O-N 2.68Å; V410-F412 PolarHBondContact O-N 3.39Å
411	Q	57	Low	69.1	Low	89 Å²	89	45.7 Å²	45.7	42%	0.416	25%	0.246	S	C	.	.			trans	-48.6	-7.5	-165.5	-78.9	-176.9	-7.9	0	0	120.1
412	F	64.3	Low	69.6	Low	105 Å²	105	44.7 Å²	44.7	46%	0.461	25%	0.246	S	C	.	.	S	Bend	trans	-132.9	77	178.2	-56.6	-79	0	0	0	111.7	W39 R43 V410	W39-F412 HydrophobicContact CB-CD2 3.88Å; W39-F412 HydrophobicContact CB-CE2 3.64Å; W39-F412 AromaticContact CD1-CE2 3.32Å; W39-F412 AromaticContact CD1-CZ 3.93Å; W39-F412 HydrophobicContact CD2-CE2 4.5Å; W39-F412 HydrophobicContact CG-CD2 4.2Å; W39-F412 AromaticContact CG-CE2 3.56Å; W39-F412 HydrophobicContact CG-CE2 3.56Å; R43-F412 PolarHBondContact NH1-O 3.44Å; R43-F412 PolarHBondContact NH2-O 3.3Å; V410-F412 PolarHBondContact O-N 3.39Å
413	P	67.7	Low	70.6	Confident	30 Å²	30	48 Å²	48	20%	0.195	26%	0.257	C	S	.	.			trans	-62.2	143.8	176.5	27	-32.6	0	0	0	110.2	A403 T404 S415 S418	A403-P413 HydrophobicContact CB-CB 3.82Å; A403-P413 HydrophobicContact CB-CG 4.25Å; T404-P413 HydrophobicContact CG2-CG 4.03Å; P413-S415 PolarHBondContact O-N 2.5Å; P413-S418 PolarHBondContact O-OG 3.45Å
414	C	76.9	Confident	72.4	Confident	15 Å²	15	51.5 Å²	51.5	10%	0.101	27%	0.27	C	S	.	.			trans	-77.3	106.3	175.4	174.4	0	0	0	0	109.7	R401 N419 D466 L467	R401-C414 PolarHBondContact NH1-O 3.34Å; C414-N419 PolarHBondContact SG-ND2 2.97Å; C414-D466 HydrophobicContact CB-CB 4.49Å; C414-L467 VanDerWaalsContact SG-CB 3.56Å; C414-L467 PolarHBondContact SG-N 2.75Å
415	S	83.4	Confident	74.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.281	C	S	.	.			trans	-137	170.7	179.2	74.9	0	0	0	0	112.1	D398 P413 S417 S418 N419 A422	D398-S415 WeakPolarHBondContact OD1-CB 3.42Å; D398-S415 PolarHBondContact OD1-OG 2.85Å; D398-S415 PolarHBondContact OD2-OG 2.83Å; P413-S415 PolarHBondContact O-N 2.5Å; S415-S417 PolarHBondContact O-N 3.18Å; S415-S417 PolarHBondContact OG-N 2.92Å; S415-S417 PolarHBondContact OG-OG 3.31Å; S415-S418 PolarHBondContact N-OG 3.29Å; S415-S418 PolarHBondContact O-N 3.46Å; S415-S418 PolarHBondContact OG-N 3.09Å; S415-S418 PolarHBondContact OG-OG 3.45Å; S415-S418 VanDerWaalsContact OG-OG 3.09Å; S415-N419 WeakPolarHBondContact O-CA 3.4Å; S415-N419 WeakPolarHBondContact O-CB 3.18Å; S415-N419 PolarHBondContact O-N 2.88Å; S415-A422 VanDerWaalsContact C-CB 3.5Å; S415-A422 WeakPolarHBondContact O-CB 3.4Å
416	A	84.1	Confident	75.6	Confident	3 Å²	3	53.5 Å²	53.5	3%	0.025	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-24.5	177.4	0	0	0	0	0	113.6	R423 Q426	A416-R423 HydrophobicContact CB-CB 4.45Å; A416-R423 WeakPolarHBondContact O-CB 3.28Å; A416-R423 PolarHBondContact O-NE 2.92Å; A416-Q426 HydrophobicContact CB-CB 4.34Å
417	S	84.6	Confident	77.3	Confident	19 Å²	19	56.9 Å²	56.9	13%	0.133	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-43.4	173.4	42	0	0	0	0	111.2	N395 C397 D398 S415 R423	N395-S417 WeakPolarHBondContact O-CB 3.32Å; C397-S417 PolarHBondContact N-OG 3.43Å; D398-S417 PolarHBondContact N-OG 3.47Å; D398-S417 PolarHBondContact OD2-OG 3.45Å; S415-S417 PolarHBondContact O-N 3.18Å; S415-S417 PolarHBondContact OG-N 2.92Å; S415-S417 PolarHBondContact OG-OG 3.31Å; S417-R423 PolarHBondContact O-NH2 2.95Å
418	S	82.9	Confident	79.2	Confident	68 Å²	68	62 Å²	62	48%	0.476	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-20	-173.9	68.2	0	0	0	0	115.4	D398 P413 S415	D398-S418 WeakPolarHBondContact OD2-CB 3.45Å; P413-S418 PolarHBondContact O-OG 3.45Å; S415-S418 PolarHBondContact N-OG 3.29Å; S415-S418 PolarHBondContact O-N 3.46Å; S415-S418 PolarHBondContact OG-N 3.09Å; S415-S418 PolarHBondContact OG-OG 3.45Å; S415-S418 VanDerWaalsContact OG-OG 3.09Å
419	N	87.1	Confident	81.1	Confident	12 Å²	12	60 Å²	60	6%	0.064	29%	0.293	C	S	.	.			trans	-130.5	123.1	-168.6	-176.3	-44.6	0	0	0	112.6	C414 S415 F421 A422 R423 S468	C414-N419 PolarHBondContact SG-ND2 2.97Å; S415-N419 WeakPolarHBondContact O-CA 3.4Å; S415-N419 WeakPolarHBondContact O-CB 3.18Å; S415-N419 PolarHBondContact O-N 2.88Å; N419-F421 VanDerWaalsContact C-N 3.32Å; N419-F421 PolarHBondContact O-N 3.4Å; N419-F421 WeakPolarHBondContact OD1-CA 3.28Å; N419-F421 WeakPolarHBondContact OD1-CB 3.41Å; N419-F421 PolarHBondContact OD1-N 3.32Å; N419-A422 HydrophobicContact CB-CB 3.97Å; N419-A422 PolarHBondContact O-N 3.17Å; N419-A422 PolarHBondContact OD1-N 2.79Å; N419-R423 WeakPolarHBondContact O-CB 3.47Å; N419-R423 PolarHBondContact O-N 3.31Å; N419-S468 WeakPolarHBondContact ND2-CA 3.46Å; N419-S468 VanDerWaalsContact ND2-CB 3.28Å; N419-S468 WeakPolarHBondContact ND2-CB 3.44Å; N419-S468 PolarHBondContact ND2-N 3.06Å
420	N	90	Very high	83.1	Confident	119 Å²	119	60 Å²	60	64%	0.636	29%	0.286	S	S	*	.	H	α-helix	trans	-60.4	-36.5	-179.4	-70.8	-26.3	0	0	0	113.8	Q424	N420-Q424 WeakPolarHBondContact O-CB 3.29Å; N420-Q424 PolarHBondContact O-N 2.65Å
421	F	90.7	Very high	84.8	Confident	72 Å²	72	63.5 Å²	63.5	32%	0.316	30%	0.304	S	S	.	.	H	α-helix	trans	-71.4	-44.2	178.8	-57.7	-70.1	0	0	0	111.1	N419 R423 Q424 V425 L467 R496	N419-F421 VanDerWaalsContact C-N 3.32Å; N419-F421 PolarHBondContact O-N 3.4Å; N419-F421 WeakPolarHBondContact OD1-CA 3.28Å; N419-F421 WeakPolarHBondContact OD1-CB 3.41Å; N419-F421 PolarHBondContact OD1-N 3.32Å; F421-R423 VanDerWaalsContact C-N 3.3Å; F421-R423 PolarHBondContact O-N 3.14Å; F421-Q424 PolarHBondContact O-N 2.85Å; F421-V425 WeakPolarHBondContact O-CG2 3.27Å; F421-V425 PolarHBondContact O-N 2.86Å; F421-L467 HydrophobicContact CB-CB 4.16Å; F421-L467 WeakPolarHBondContact CD2-O 3.31Å; F421-R496 HydrophobicContact CE2-CG 4.29Å
422	A	89.8	Confident	86.5	Confident	13 Å²	13	64 Å²	64	11%	0.107	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-42.2	174.3	0	0	0	0	0	111.2	S415 N419 Q424 V425 Q426 L467	S415-A422 VanDerWaalsContact C-CB 3.5Å; S415-A422 WeakPolarHBondContact O-CB 3.4Å; N419-A422 HydrophobicContact CB-CB 3.97Å; N419-A422 PolarHBondContact O-N 3.17Å; N419-A422 PolarHBondContact OD1-N 2.79Å; A422-Q424 VanDerWaalsContact C-N 3.34Å; A422-Q424 PolarHBondContact O-N 3.13Å; A422-V425 PolarHBondContact O-N 2.91Å; A422-Q426 PolarHBondContact O-N 3.48Å; A422-L467 HydrophobicContact CB-CD1 3.86Å
423	R	91.3	Very high	87.8	Confident	81 Å²	81	59.2 Å²	59.2	31%	0.306	29%	0.292	S	S	.	.	H	α-helix	trans	-59.7	-43.6	174.4	-165.2	-179.9	-62.6	176	-1.4	112	A416 S417 N419 F421 Q426 R427	A416-R423 HydrophobicContact CB-CB 4.45Å; A416-R423 WeakPolarHBondContact O-CB 3.28Å; A416-R423 PolarHBondContact O-NE 2.92Å; S417-R423 PolarHBondContact O-NH2 2.95Å; N419-R423 WeakPolarHBondContact O-CB 3.47Å; N419-R423 PolarHBondContact O-N 3.31Å; F421-R423 VanDerWaalsContact C-N 3.3Å; F421-R423 PolarHBondContact O-N 3.14Å; R423-Q426 PolarHBondContact O-N 2.88Å; R423-R427 WeakPolarHBondContact O-CG 3.25Å; R423-R427 PolarHBondContact O-N 3.26Å
424	Q	92.1	Very high	89	Confident	92 Å²	92	60.3 Å²	60.3	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-39.9	177.8	-170.2	178.4	33.7	0	0	111.8	N420 F421 A422 R427 R428	N420-Q424 WeakPolarHBondContact O-CB 3.29Å; N420-Q424 PolarHBondContact O-N 2.65Å; F421-Q424 PolarHBondContact O-N 2.85Å; A422-Q424 VanDerWaalsContact C-N 3.34Å; A422-Q424 PolarHBondContact O-N 3.13Å; Q424-R427 PolarHBondContact O-N 2.86Å; Q424-R428 VanDerWaalsContact NE2-NH2 3.18Å; Q424-R428 WeakPolarHBondContact O-CG 3.46Å; Q424-R428 PolarHBondContact O-N 2.76Å
425	V	90.1	Very high	89.7	Confident	67 Å²	67	66 Å²	66	41%	0.406	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-46.2	175.1	171.7	0	0	0	0	110.8	F421 A422 R427 R428 F429	F421-V425 WeakPolarHBondContact O-CG2 3.27Å; F421-V425 PolarHBondContact O-N 2.86Å; A422-V425 PolarHBondContact O-N 2.91Å; V425-R427 PolarHBondContact O-N 2.88Å; V425-R428 PolarHBondContact O-N 3.38Å; V425-F429 WeakPolarHBondContact O-CB 3.19Å; V425-F429 PolarHBondContact O-N 2.95Å
426	Q	89.9	Confident	90.2	Very high	27 Å²	27	68.3 Å²	68.3	13%	0.126	35%	0.347	C	S	.	.	H	α-helix	trans	-62.8	-42.8	177.2	-173.3	179	13.1	0	0	112.2	A416 A422 R423 F429 K430 L448	A416-Q426 HydrophobicContact CB-CB 4.34Å; A422-Q426 PolarHBondContact O-N 3.48Å; R423-Q426 PolarHBondContact O-N 2.88Å; Q426-F429 WeakPolarHBondContact O-CB 3.3Å; Q426-F429 PolarHBondContact O-N 2.99Å; Q426-K430 PolarHBondContact O-N 3.39Å; Q426-L448 HydrophobicContact CG-CD2 4.16Å
427	R	92	Very high	89.9	Confident	150 Å²	150	77.1 Å²	77.1	57%	0.566	39%	0.385	S	S	*	.	H	α-helix	trans	-61	-47.7	176.3	-74.9	177.9	-179.8	-175.6	-2.1	111.8	R423 Q424 V425 F429 K430 D431	R423-R427 WeakPolarHBondContact O-CG 3.25Å; R423-R427 PolarHBondContact O-N 3.26Å; Q424-R427 PolarHBondContact O-N 2.86Å; V425-R427 PolarHBondContact O-N 2.88Å; R427-F429 VanDerWaalsContact C-N 3.27Å; R427-F429 PolarHBondContact O-N 3.42Å; R427-K430 WeakPolarHBondContact O-CB 3.24Å; R427-K430 PolarHBondContact O-N 3.3Å; R427-K430 VanDerWaalsContact O-N 3.12Å; R427-D431 PolarHBondContact O-N 3.33Å
428	R	92.2	Very high	89.8	Confident	147 Å²	147	86 Å²	86	56%	0.555	42%	0.416	S	S	*	.	H	α-helix	trans	-59.1	-40.4	175.4	-72.6	176.9	-176.5	178.8	2.6	111.9	Q424 V425 D431 T432	Q424-R428 VanDerWaalsContact NE2-NH2 3.18Å; Q424-R428 WeakPolarHBondContact O-CG 3.46Å; Q424-R428 PolarHBondContact O-N 2.76Å; V425-R428 PolarHBondContact O-N 3.38Å; R428-D431 PolarHBondContact O-N 2.84Å; R428-T432 WeakPolarHBondContact O-CB 3.47Å; R428-T432 PolarHBondContact O-N 2.9Å; R428-T432 PolarHBondContact O-OG1 3.39Å
429	F	90.2	Very high	89.9	Confident	98 Å²	98	84.1 Å²	84.1	43%	0.43	41%	0.408	S	S	.	.	H	α-helix	trans	-62.7	-44.2	175.9	178.4	-108.7	0	0	0	111.8	V425 Q426 R427 T432 I433 L448	V425-F429 WeakPolarHBondContact O-CB 3.19Å; V425-F429 PolarHBondContact O-N 2.95Å; Q426-F429 WeakPolarHBondContact O-CB 3.3Å; Q426-F429 PolarHBondContact O-N 2.99Å; R427-F429 VanDerWaalsContact C-N 3.27Å; R427-F429 PolarHBondContact O-N 3.42Å; F429-T432 PolarHBondContact O-N 3.29Å; F429-I433 HydrophobicContact CD1-CD1 3.94Å; F429-I433 HydrophobicContact CD2-CD1 4.47Å; F429-I433 HydrophobicContact CE1-CD1 3.48Å; F429-I433 VanDerWaalsContact CE1-CD1 3.48Å; F429-I433 HydrophobicContact CE2-CD1 4.06Å; F429-I433 HydrophobicContact CG-CD1 4.43Å; F429-I433 HydrophobicContact CZ-CD1 3.55Å; F429-I433 HydrophobicContact CZ-CG1 4.48Å; F429-I433 WeakPolarHBondContact O-CG1 3.07Å; F429-I433 PolarHBondContact O-N 2.9Å; F429-L448 HydrophobicContact CD1-CD2 3.82Å; F429-L448 HydrophobicContact CE1-CD2 4Å
430	K	91.9	Very high	90.1	Very high	42 Å²	42	84.7 Å²	84.7	18%	0.183	42%	0.417	C	S	.	.	H	α-helix	trans	-57.7	-53.1	173.1	-172.7	178.4	-173.3	166.8	0	111.1	E394 Q426 R427 T432 I433 V434 A444 L448	E394-K430 IonicContact OE1-NZ 3.37Å; E394-K430 PolarHBondContact OE1-NZ 2.81Å; E394-K430 IonicContact OE2-NZ 2.85Å; E394-K430 PolarHBondContact OE2-NZ 2.86Å; Q426-K430 PolarHBondContact O-N 3.39Å; R427-K430 WeakPolarHBondContact O-CB 3.24Å; R427-K430 PolarHBondContact O-N 3.3Å; R427-K430 VanDerWaalsContact O-N 3.12Å; K430-T432 VanDerWaalsContact C-N 3.28Å; K430-T432 PolarHBondContact O-N 2.9Å; K430-I433 PolarHBondContact O-N 2.83Å; K430-V434 WeakPolarHBondContact O-CG2 3.43Å; K430-V434 PolarHBondContact O-N 3.5Å; K430-A444 HydrophobicContact CG-CB 4.27Å; K430-L448 HydrophobicContact CB-CD1 4.1Å; K430-L448 HydrophobicContact CD-CD1 4.05Å; K430-L448 HydrophobicContact CG-CD1 3.94Å
431	D	93.1	Very high	90.2	Very high	85 Å²	85	83.5 Å²	83.5	46%	0.455	41%	0.407	S	S	.	.	H	α-helix	trans	-59.8	-38.2	179.9	-61.2	-23.5	0	0	0	112.1	R427 R428 I433 V434 N435	R427-D431 PolarHBondContact O-N 3.33Å; R428-D431 PolarHBondContact O-N 2.84Å; D431-I433 VanDerWaalsContact C-N 3.31Å; D431-I433 PolarHBondContact O-N 2.79Å; D431-V434 PolarHBondContact O-N 2.83Å; D431-N435 WeakPolarHBondContact O-CB 3.4Å; D431-N435 PolarHBondContact O-N 3.05Å; D431-N435 PolarHBondContact O-ND2 2.85Å
432	T	92.8	Very high	90.2	Very high	98 Å²	98	84 Å²	84	60%	0.601	42%	0.417	S	S	*	.	H	α-helix	trans	-61.4	-40.5	176	-56.5	0	0	0	0	111.6	R428 F429 K430 A436	R428-T432 WeakPolarHBondContact O-CB 3.47Å; R428-T432 PolarHBondContact O-N 2.9Å; R428-T432 PolarHBondContact O-OG1 3.39Å; F429-T432 PolarHBondContact O-N 3.29Å; K430-T432 VanDerWaalsContact C-N 3.28Å; K430-T432 PolarHBondContact O-N 2.9Å; T432-A436 PolarHBondContact O-N 2.8Å
433	I	90.4	Very high	90.2	Very high	6 Å²	6	85.6 Å²	85.6	3%	0.031	42%	0.421	C	S	.	.	H	α-helix	trans	-72.3	-42.4	178.4	-63.9	161.5	0	0	0	110.7	F429 K430 D431 N435 A436 G439 E443 A444 R447	F429-I433 HydrophobicContact CD1-CD1 3.94Å; F429-I433 HydrophobicContact CD2-CD1 4.47Å; F429-I433 HydrophobicContact CE1-CD1 3.48Å; F429-I433 VanDerWaalsContact CE1-CD1 3.48Å; F429-I433 HydrophobicContact CE2-CD1 4.06Å; F429-I433 HydrophobicContact CG-CD1 4.43Å; F429-I433 HydrophobicContact CZ-CD1 3.55Å; F429-I433 HydrophobicContact CZ-CG1 4.48Å; F429-I433 WeakPolarHBondContact O-CG1 3.07Å; F429-I433 PolarHBondContact O-N 2.9Å; K430-I433 PolarHBondContact O-N 2.83Å; D431-I433 VanDerWaalsContact C-N 3.31Å; D431-I433 PolarHBondContact O-N 2.79Å; I433-N435 VanDerWaalsContact C-N 3.29Å; I433-N435 PolarHBondContact O-N 3.14Å; I433-A436 PolarHBondContact O-N 2.94Å; I433-G439 VanDerWaalsContact O-CA 3.25Å; I433-G439 WeakPolarHBondContact O-CA 3.38Å; I433-E443 HydrophobicContact CG2-CG 4.31Å; I433-A444 HydrophobicContact CB-CB 4.07Å; I433-A444 HydrophobicContact CG2-CB 3.85Å; I433-R447 HydrophobicContact CD1-CB 4.03Å
434	V	92.9	Very high	90.2	Very high	52 Å²	52	81.7 Å²	81.7	32%	0.315	41%	0.407	S	S	.	.	H	α-helix	trans	-59.4	-42.5	-180	172.8	0	0	0	0	111	K430 D431 A436 G440 A444	K430-V434 WeakPolarHBondContact O-CG2 3.43Å; K430-V434 PolarHBondContact O-N 3.5Å; D431-V434 PolarHBondContact O-N 2.83Å; V434-A436 PolarHBondContact O-N 3.38Å; V434-G440 PolarHBondContact O-N 3.21Å; V434-A444 HydrophobicContact CG2-CB 3.67Å
435	N	93.3	Very high	90.2	Very high	136 Å²	136	77.3 Å²	77.3	73%	0.727	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	2.4	-175.7	-64.2	-41.4	0	0	0	114.6	D431 I433	D431-N435 WeakPolarHBondContact O-CB 3.4Å; D431-N435 PolarHBondContact O-N 3.05Å; D431-N435 PolarHBondContact O-ND2 2.85Å; I433-N435 VanDerWaalsContact C-N 3.29Å; I433-N435 PolarHBondContact O-N 3.14Å
436	A	92.5	Very high	90.3	Very high	48 Å²	48	77.5 Å²	77.5	40%	0.397	38%	0.38	S	S	.	.	S	Bend	trans	-75.1	156.7	-179.4	0	0	0	0	0	112.9	T432 I433 V434 Y438 G439	T432-A436 PolarHBondContact O-N 2.8Å; I433-A436 PolarHBondContact O-N 2.94Å; V434-A436 PolarHBondContact O-N 3.38Å; A436-Y438 PolarHBondContact O-N 3.16Å; A436-G439 WeakPolarHBondContact O-CA 3.31Å; A436-G439 PolarHBondContact O-N 2.8Å
437	K	78.9	Confident	90.2	Very high	188 Å²	188	82 Å²	82	82%	0.817	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-14.1	-173.4	-169.9	171.9	177.8	179.3	0	116
438	Y	82.3	Confident	90.2	Very high	204 Å²	204	74.9 Å²	74.9	80%	0.8	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.5	31.8	169.1	-59.2	-74.3	0	0	0	110.1	A436	A436-Y438 PolarHBondContact O-N 3.16Å
439	G	84.8	Confident	90.2	Very high	30 Å²	30	67.9 Å²	67.9	31%	0.309	34%	0.342	S	S	.	.			trans	-86.8	-165.8	179.4	0	0	0	0	0	112.1	I433 A436	I433-G439 VanDerWaalsContact O-CA 3.25Å; I433-G439 WeakPolarHBondContact O-CA 3.38Å; A436-G439 WeakPolarHBondContact O-CA 3.31Å; A436-G439 PolarHBondContact O-N 2.8Å
440	G	91.4	Very high	90.2	Very high	23 Å²	23	65.3 Å²	65.3	24%	0.237	34%	0.343	C	S	.	.			trans	151.7	168.7	177.1	0	0	0	0	0	111	V434 T442 E443 A444	V434-G440 PolarHBondContact O-N 3.21Å; G440-T442 PolarHBondContact O-N 3.11Å; G440-E443 PolarHBondContact O-N 2.71Å; G440-A444 WeakPolarHBondContact O-CB 3.25Å; G440-A444 PolarHBondContact O-N 3.14Å
441	H	92	Very high	90.1	Very high	95 Å²	95	67.4 Å²	67.4	44%	0.44	35%	0.354	S	S	.	.	H	α-helix	trans	-59.9	-46.4	-179.4	-174.1	-4.5	0	0	0	111.7	D387 E443 A444 V445	D387-H441 IonicContact OD1-CE1 3.78Å; D387-H441 PolarHBondContact OD1-CE1 3.47Å; D387-H441 IonicContact OD1-ND1 3.13Å; D387-H441 IonicContact OD1-NE2 2.76Å; D387-H441 PolarHBondContact OD1-NE2 2.7Å; H441-E443 VanDerWaalsContact C-N 3.33Å; H441-E443 PolarHBondContact O-N 2.65Å; H441-A444 WeakPolarHBondContact O-CB 3.26Å; H441-A444 PolarHBondContact O-N 3.03Å; H441-V445 WeakPolarHBondContact CE1-CG2 3.1Å; H441-V445 VanDerWaalsContact ND1-CG2 3.35Å; H441-V445 WeakPolarHBondContact ND1-CG2 3.04Å; H441-V445 VanDerWaalsContact O-CG2 3.24Å; H441-V445 WeakPolarHBondContact O-CG2 3.45Å; H441-V445 PolarHBondContact O-N 3.09Å
442	T	91.1	Very high	90.1	Very high	83 Å²	83	63.4 Å²	63.4	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-39.8	-179.1	-48.4	0	0	0	0	112.2	T385 G440 V445 R446	T385-T442 HydrophobicContact CG2-CG2 3.46Å; T385-T442 VanDerWaalsContact CG2-CG2 3.46Å; G440-T442 PolarHBondContact O-N 3.11Å; T442-V445 PolarHBondContact O-N 2.96Å; T442-R446 WeakPolarHBondContact O-CB 3.44Å; T442-R446 PolarHBondContact O-N 2.64Å
443	E	89.6	Confident	90.1	Very high	45 Å²	45	59 Å²	59	21%	0.21	31%	0.305	C	S	.	.	H	α-helix	trans	-71	-35.8	177.1	-178.7	60.4	-168	0	0	111.5	I433 G440 H441 R446 R447	I433-E443 HydrophobicContact CG2-CG 4.31Å; G440-E443 PolarHBondContact O-N 2.71Å; H441-E443 VanDerWaalsContact C-N 3.33Å; H441-E443 PolarHBondContact O-N 2.65Å; E443-R446 PolarHBondContact O-N 2.65Å; E443-R446 IonicContact OE2-CZ 2.74Å; E443-R446 IonicContact OE2-NE 3.59Å; E443-R446 IonicContact OE2-NH1 2.91Å; E443-R446 PolarHBondContact OE2-NH1 2.79Å; E443-R447 WeakPolarHBondContact O-CB 3.33Å; E443-R447 WeakPolarHBondContact O-CG 3.29Å; E443-R447 PolarHBondContact O-N 3Å; E443-R447 IonicContact OE1-CZ 3.46Å; E443-R447 IonicContact OE1-NE 3.52Å; E443-R447 PolarHBondContact OE1-NE 3.39Å; E443-R447 IonicContact OE1-NH2 2.66Å; E443-R447 PolarHBondContact OE1-NH2 3.35Å
444	A	91.3	Very high	90.2	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-44.9	172.5	0	0	0	0	0	111.9	K430 I433 V434 G440 H441 R447 L448	K430-A444 HydrophobicContact CG-CB 4.27Å; I433-A444 HydrophobicContact CB-CB 4.07Å; I433-A444 HydrophobicContact CG2-CB 3.85Å; V434-A444 HydrophobicContact CG2-CB 3.67Å; G440-A444 WeakPolarHBondContact O-CB 3.25Å; G440-A444 PolarHBondContact O-N 3.14Å; H441-A444 WeakPolarHBondContact O-CB 3.26Å; H441-A444 PolarHBondContact O-N 3.03Å; A444-R447 PolarHBondContact O-N 2.54Å; A444-L448 WeakPolarHBondContact O-CB 3.36Å; A444-L448 WeakPolarHBondContact O-CG 3.38Å; A444-L448 PolarHBondContact O-N 3.33Å
445	V	92.5	Very high	90.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-50.5	175	173.9	0	0	0	0	110	D387 L390 H441 T442 R447 L448 L449	D387-V445 WeakPolarHBondContact OD1-CG2 3.42Å; L390-V445 HydrophobicContact CB-CG1 4.3Å; L390-V445 HydrophobicContact CD2-CB 4.2Å; L390-V445 HydrophobicContact CD2-CG1 4.3Å; L390-V445 HydrophobicContact CD2-CG2 3.6Å; H441-V445 WeakPolarHBondContact CE1-CG2 3.1Å; H441-V445 VanDerWaalsContact ND1-CG2 3.35Å; H441-V445 WeakPolarHBondContact ND1-CG2 3.04Å; H441-V445 VanDerWaalsContact O-CG2 3.24Å; H441-V445 WeakPolarHBondContact O-CG2 3.45Å; H441-V445 PolarHBondContact O-N 3.09Å; T442-V445 PolarHBondContact O-N 2.96Å; V445-R447 VanDerWaalsContact C-N 3.34Å; V445-R447 PolarHBondContact O-N 2.93Å; V445-L448 PolarHBondContact O-N 3.27Å; V445-L449 HydrophobicContact CG1-CD1 3.73Å; V445-L449 HydrophobicContact CG1-CG 4.26Å; V445-L449 WeakPolarHBondContact O-CB 3.29Å; V445-L449 WeakPolarHBondContact O-CG 3.46Å; V445-L449 PolarHBondContact O-N 3.26Å
446	R	90.6	Very high	90	Very high	71 Å²	71	50.7 Å²	50.7	27%	0.268	26%	0.26	S	S	.	.	H	α-helix	trans	-57.1	-44.2	178.9	-173.1	-172.5	-67	157.9	-12.6	112.6	N384 T442 E443 G450	N384-R446 WeakPolarHBondContact O-CA 3.36Å; T442-R446 WeakPolarHBondContact O-CB 3.44Å; T442-R446 PolarHBondContact O-N 2.64Å; E443-R446 PolarHBondContact O-N 2.65Å; E443-R446 IonicContact OE2-CZ 2.74Å; E443-R446 IonicContact OE2-NE 3.59Å; E443-R446 IonicContact OE2-NH1 2.91Å; E443-R446 PolarHBondContact OE2-NH1 2.79Å; R446-G450 PolarHBondContact O-N 2.93Å
447	R	89.6	Confident	89.8	Confident	120 Å²	120	49 Å²	49	45%	0.453	24%	0.244	S	C	.	.	H	α-helix	trans	-69.3	-38.4	179.2	-73.8	-174.7	-168.6	172.4	5.1	113.1	I433 E443 A444 V445 G450	I433-R447 HydrophobicContact CD1-CB 4.03Å; E443-R447 WeakPolarHBondContact O-CB 3.33Å; E443-R447 WeakPolarHBondContact O-CG 3.29Å; E443-R447 PolarHBondContact O-N 3Å; E443-R447 IonicContact OE1-CZ 3.46Å; E443-R447 IonicContact OE1-NE 3.52Å; E443-R447 PolarHBondContact OE1-NE 3.39Å; E443-R447 IonicContact OE1-NH2 2.66Å; E443-R447 PolarHBondContact OE1-NH2 3.35Å; A444-R447 PolarHBondContact O-N 2.54Å; V445-R447 VanDerWaalsContact C-N 3.34Å; V445-R447 PolarHBondContact O-N 2.93Å; R447-G450 PolarHBondContact O-N 3.36Å
448	L	91.3	Very high	90.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-47.9	176.7	-73.4	170.8	0	0	0	110.9	L390 Q426 F429 K430 A444 V445 G450 Q451	L390-L448 HydrophobicContact CD1-CB 3.67Å; L390-L448 HydrophobicContact CD1-CD1 3.78Å; L390-L448 HydrophobicContact CD1-CG 4.36Å; L390-L448 HydrophobicContact CD2-CD1 4.24Å; Q426-L448 HydrophobicContact CG-CD2 4.16Å; F429-L448 HydrophobicContact CD1-CD2 3.82Å; F429-L448 HydrophobicContact CE1-CD2 4Å; K430-L448 HydrophobicContact CB-CD1 4.1Å; K430-L448 HydrophobicContact CD-CD1 4.05Å; K430-L448 HydrophobicContact CG-CD1 3.94Å; A444-L448 WeakPolarHBondContact O-CB 3.36Å; A444-L448 WeakPolarHBondContact O-CG 3.38Å; A444-L448 PolarHBondContact O-N 3.33Å; V445-L448 PolarHBondContact O-N 3.27Å; L448-G450 PolarHBondContact O-N 3.46Å; L448-Q451 WeakPolarHBondContact O-CB 3.37Å; L448-Q451 WeakPolarHBondContact O-CG 3.5Å; L448-Q451 PolarHBondContact O-N 2.91Å
449	L	92.9	Very high	90.6	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-69	-19.5	175.6	-65.2	-177.5	0	0	0	113.1	F368 L389 L390 V445 Q451 L452	F368-L449 HydrophobicContact CE2-CB 4.15Å; F368-L449 HydrophobicContact CZ-CB 4.29Å; F368-L449 WeakPolarHBondContact CZ-O 3.45Å; L389-L449 HydrophobicContact CB-CD1 4.31Å; L389-L449 HydrophobicContact CB-CD2 4.32Å; L389-L449 HydrophobicContact CD2-CD1 4.16Å; L389-L449 HydrophobicContact CD2-CD2 4.01Å; L389-L449 HydrophobicContact CG-CD1 4.38Å; L389-L449 HydrophobicContact CG-CD2 3.78Å; L390-L449 HydrophobicContact CB-CD2 4.3Å; L390-L449 HydrophobicContact CB-CG 4.48Å; L390-L449 HydrophobicContact CD1-CD2 4.42Å; V445-L449 HydrophobicContact CG1-CD1 3.73Å; V445-L449 HydrophobicContact CG1-CG 4.26Å; V445-L449 WeakPolarHBondContact O-CB 3.29Å; V445-L449 WeakPolarHBondContact O-CG 3.46Å; V445-L449 PolarHBondContact O-N 3.26Å; L449-Q451 PolarHBondContact O-N 3.04Å; L449-Q451 VanDerWaalsContact O-N 3.1Å; L449-L452 HydrophobicContact CD2-CD1 3.97Å; L449-L452 WeakPolarHBondContact O-CB 2.93Å; L449-L452 PolarHBondContact O-N 2.88Å
450	G	89.7	Confident	90.7	Very high	43 Å²	43	31.7 Å²	31.7	44%	0.443	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.9	173.8	0	0	0	0	0	114.2	R446 R447 L448 L452	R446-G450 PolarHBondContact O-N 2.93Å; R447-G450 PolarHBondContact O-N 3.36Å; L448-G450 PolarHBondContact O-N 3.46Å; G450-L452 PolarHBondContact O-N 3.31Å
451	Q	88.9	Confident	90.4	Very high	86 Å²	86	32.3 Å²	32.3	40%	0.402	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-19.3	173.9	-59.6	179.9	23.1	0	0	113.1	L448 L449 P453	L448-Q451 WeakPolarHBondContact O-CB 3.37Å; L448-Q451 WeakPolarHBondContact O-CG 3.5Å; L448-Q451 PolarHBondContact O-N 2.91Å; L449-Q451 PolarHBondContact O-N 3.04Å; L449-Q451 VanDerWaalsContact O-N 3.1Å; Q451-P453 CarbonylContact O-C 3.59Å
452	L	92.6	Very high	90.3	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-90.7	148.4	179.5	-66.7	176.4	0	0	0	111.5	F346 F368 L389 F393 F400 L449 G450 I454	F346-L452 HydrophobicContact CE1-CB 3.91Å; F346-L452 HydrophobicContact CE1-CD1 3.96Å; F346-L452 HydrophobicContact CE1-CD2 4.23Å; F346-L452 HydrophobicContact CE1-CG 4.25Å; F346-L452 HydrophobicContact CZ-CD1 4.2Å; F368-L452 HydrophobicContact CD1-CB 4.44Å; F368-L452 HydrophobicContact CE1-CB 3.71Å; F368-L452 WeakPolarHBondContact CE1-O 3.43Å; F368-L452 HydrophobicContact CZ-CB 4.19Å; L389-L452 HydrophobicContact CD2-CD1 4.5Å; F393-L452 HydrophobicContact CB-CD1 4.42Å; F393-L452 HydrophobicContact CD2-CD1 4.09Å; F393-L452 HydrophobicContact CD2-CD2 3.96Å; F393-L452 HydrophobicContact CD2-CG 4.31Å; F393-L452 HydrophobicContact CE2-CD2 3.81Å; F393-L452 HydrophobicContact CE2-CG 4.33Å; F393-L452 HydrophobicContact CG-CD1 4.2Å; F400-L452 HydrophobicContact CB-CD2 4.41Å; F400-L452 HydrophobicContact CD1-CD2 3.83Å; F400-L452 HydrophobicContact CE1-CD1 4.47Å; F400-L452 HydrophobicContact CE1-CD2 4.42Å; F400-L452 HydrophobicContact CG-CD2 4.31Å; L449-L452 HydrophobicContact CD2-CD1 3.97Å; L449-L452 WeakPolarHBondContact O-CB 2.93Å; L449-L452 PolarHBondContact O-N 2.88Å; G450-L452 PolarHBondContact O-N 3.31Å; L452-I454 HydrophobicContact CD2-CD1 3.97Å; L452-I454 HydrophobicContact CD2-CG1 4.08Å
453	P	93.9	Very high	90.2	Very high	6 Å²	6	24.5 Å²	24.5	4%	0.039	13%	0.128	C	C	.	.	S	Bend	cis	-67.7	151.9	-12.7	-16.3	32.5	0	0	0	111.9	K336 Q338 F346 K348 Q451	K336-P453 HydrophobicContact CB-CG 3.8Å; Q338-P453 HydrophobicContact CB-CB 3.58Å; F346-P453 HydrophobicContact CD1-CB 4.13Å; F346-P453 HydrophobicContact CD1-CG 4.24Å; K348-P453 HydrophobicContact CB-CG 3.92Å; Q451-P453 CarbonylContact O-C 3.59Å
454	I	92.3	Very high	90.3	Very high	6 Å²	6	22.4 Å²	22.4	3%	0.031	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-81.9	138	-178.6	-78.3	161	0	0	0	109.8	Y226 F393 F400 R401 L452 Y459	Y226-I454 VanDerWaalsContact CE2-O 3.22Å; Y226-I454 WeakPolarHBondContact CE2-O 3.01Å; F393-I454 HydrophobicContact CE2-CD1 4Å; F400-I454 HydrophobicContact CB-CD1 3.94Å; R401-I454 HydrophobicContact CG-CD1 3.93Å; L452-I454 HydrophobicContact CD2-CD1 3.97Å; L452-I454 HydrophobicContact CD2-CG1 4.08Å; I454-Y459 HydrophobicContact CG2-CE2 3.72Å
455	S	91.6	Very high	90.4	Very high	13 Å²	13	22.6 Å²	22.6	9%	0.091	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-67.1	140.6	172.2	-66	0	0	0	0	111.8	H221 Q223 S458	H221-S455 WeakPolarHBondContact O-CB 3.29Å; H221-S455 PolarHBondContact O-OG 3.28Å; Q223-S455 WeakPolarHBondContact CG-OG 3.35Å; S455-S458 WeakPolarHBondContact O-CB 3.47Å; S455-S458 PolarHBondContact O-OG 3.3Å
456	A	89.6	Confident	90.2	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	139.1	177.4	0	0	0	0	0	112.5	L149 N222 Y226 S458	L149-A456 HydrophobicContact CD2-CB 3.63Å; N222-A456 PolarHBondContact ND2-O 3.45Å; Y226-A456 HydrophobicContact CD1-CB 4.31Å; Y226-A456 HydrophobicContact CD2-CB 3.67Å; Y226-A456 HydrophobicContact CE2-CB 3.93Å; Y226-A456 HydrophobicContact CG-CB 3.89Å; A456-S458 PolarHBondContact O-N 3.09Å; A456-S458 VanDerWaalsContact O-N 3.11Å
457	Q	89.6	Confident	90.3	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.056	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	33.1	175.9	-55.9	-179.1	29.4	0	0	114.5	K67 L149 F150 L405	K67-Q457 PolarHBondContact NZ-O 3.19Å; L149-Q457 HydrophobicContact CD2-CB 4.22Å; L149-Q457 HydrophobicContact CD2-CG 4.12Å; F150-Q457 PolarHBondContact O-NE2 2.86Å; L405-Q457 HydrophobicContact CD2-CG 4.42Å
458	S	88.8	Confident	90.3	Very high	19 Å²	19	15.7 Å²	15.7	13%	0.133	10%	0.098	C	C	.	.			trans	-86.7	-1.6	-177	57	0	0	0	0	114.6	S455 A456 M480 E481	S455-S458 WeakPolarHBondContact O-CB 3.47Å; S455-S458 PolarHBondContact O-OG 3.3Å; A456-S458 PolarHBondContact O-N 3.09Å; A456-S458 VanDerWaalsContact O-N 3.11Å; S458-M480 WeakPolarHBondContact O-CA 3.46Å; S458-E481 PolarHBondContact O-N 3.46Å
459	Y	88.8	Confident	90.2	Very high	25 Å²	25	15.6 Å²	15.6	10%	0.098	10%	0.098	C	C	.	.	B	Isolated β-bridge	trans	-112.1	140	179.8	-65.4	-89	0	0	0	110.9	R401 I454 V479 M480	R401-Y459 HydrophobicContact CB-CD2 4.13Å; R401-Y459 HydrophobicContact CB-CE2 4.01Å; R401-Y459 HydrophobicContact CG-CD2 4.22Å; R401-Y459 HydrophobicContact CG-CE2 3.67Å; I454-Y459 HydrophobicContact CG2-CE2 3.72Å; Y459-V479 WeakPolarHBondContact CA-O 3.41Å; Y459-V479 HydrophobicContact CD1-CB 4.49Å; Y459-V479 HydrophobicContact CD1-CG1 4.07Å; Y459-M480 HydrophobicContact CD1-CB 4.28Å; Y459-M480 HydrophobicContact CE1-CB 4.14Å
460	S	87.4	Confident	90.3	Very high	15 Å²	15	15.6 Å²	15.6	11%	0.105	10%	0.098	C	C	.	.			trans	-76.9	137.6	171.6	-176.9	0	0	0	0	110.5	S462 V479	S460-S462 VanDerWaalsContact C-N 3.32Å; S460-S462 WeakPolarHBondContact OG-CB 3.11Å; S460-S462 PolarHBondContact OG-N 3.14Å; S460-V479 PolarHBondContact N-O 3.16Å; S460-V479 WeakPolarHBondContact O-CG1 3.17Å
461	S	84.2	Confident	90.5	Very high	37 Å²	37	15.2 Å²	15.2	26%	0.259	9%	0.088	S	C	.	.			trans	-86.1	-1.5	173.6	52.3	0	0	0	0	113.6
462	S	89.6	Confident	90.8	Very high	4 Å²	4	12.1 Å²	12.1	3%	0.028	7%	0.073	C	C	.	.			trans	-67.6	132.7	-169	-170	0	0	0	0	112.9	S460 Y464 L465 F526 H527	S460-S462 VanDerWaalsContact C-N 3.32Å; S460-S462 WeakPolarHBondContact OG-CB 3.11Å; S460-S462 PolarHBondContact OG-N 3.14Å; S462-Y464 PolarHBondContact O-N 3.17Å; S462-Y464 WeakPolarHBondContact OG-CD2 3.43Å; S462-L465 PolarHBondContact O-N 3.43Å; S462-L465 VanDerWaalsContact O-N 3.13Å; S462-F526 VanDerWaalsContact CB-CB 3.45Å; S462-F526 WeakPolarHBondContact OG-CB 3.4Å; S462-H527 WeakPolarHBondContact CB-O 3.4Å; S462-H527 PolarHBondContact OG-O 2.71Å
463	P	89.6	Confident	90.7	Very high	9 Å²	9	16 Å²	16	6%	0.058	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-65.2	-20.3	178.9	25.7	-34.2	0	0	0	113	H46 L465 D466 L469 P528	H46-P463 HydrophobicContact CB-CB 4.18Å; H46-P463 HydrophobicContact CB-CG 4.32Å; H46-P463 WeakPolarHBondContact CD2-CG 3.13Å; H46-P463 WeakPolarHBondContact NE2-CG 3.33Å; P463-L465 PolarHBondContact O-N 2.8Å; P463-D466 VanDerWaalsContact O-CB 3.32Å; P463-D466 WeakPolarHBondContact O-CB 3.43Å; P463-D466 PolarHBondContact O-N 3.41Å; P463-D466 VanDerWaalsContact O-N 3.14Å; P463-L469 HydrophobicContact CB-CD1 4.06Å; P463-P528 WeakPolarHBondContact CD-O 3.37Å
464	Y	92.1	Very high	90.4	Very high	1 Å²	1	18.7 Å²	18.7	0%	0.004	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-69.5	-18.9	176.9	-58.3	-69.8	0	0	0	113.3	H46 L49 F50 S462 F470 F493 F503 F526 E530 P531	H46-Y464 HydrophobicContact CB-CE1 4.07Å; H46-Y464 AromaticContact CD2-CZ 3.94Å; L49-Y464 VanDerWaalsContact O-CE1 3.24Å; L49-Y464 WeakPolarHBondContact O-CE1 3.41Å; L49-Y464 PolarHBondContact O-OH 2.95Å; F50-Y464 HydrophobicContact CB-CE1 4.07Å; S462-Y464 PolarHBondContact O-N 3.17Å; S462-Y464 WeakPolarHBondContact OG-CD2 3.43Å; Y464-F470 HydrophobicContact CD1-CE2 4.04Å; Y464-F470 HydrophobicContact CD1-CZ 4.27Å; Y464-F493 WeakPolarHBondContact O-CE1 3.11Å; Y464-F503 HydrophobicContact CD1-CE1 4.27Å; Y464-F503 HydrophobicContact CD1-CZ 4.13Å; Y464-F526 HydrophobicContact CD2-CD1 4.37Å; Y464-F526 HydrophobicContact CG-CD1 4.5Å; Y464-E530 VanDerWaalsContact CE2-O 3.26Å; Y464-E530 WeakPolarHBondContact CE2-O 3.2Å; Y464-P531 WeakPolarHBondContact OH-CA 3.48Å; Y464-P531 VanDerWaalsContact OH-CB 3.25Å; Y464-P531 WeakPolarHBondContact OH-CB 3.19Å
465	L	92.1	Very high	90.2	Very high	5 Å²	5	24.5 Å²	24.5	3%	0.026	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-101	7.6	174.3	-59.4	178	0	0	0	112.3	S462 P463 L467 Y472 V477 V479 F493 F526	S462-L465 PolarHBondContact O-N 3.43Å; S462-L465 VanDerWaalsContact O-N 3.13Å; P463-L465 PolarHBondContact O-N 2.8Å; L465-L467 PolarHBondContact O-N 3.34Å; L465-Y472 PolarHBondContact O-OH 3.03Å; L465-V477 HydrophobicContact CD2-CG2 3.7Å; L465-V479 HydrophobicContact CB-CG2 4.07Å; L465-V479 VanDerWaalsContact O-CG2 3.31Å; L465-V479 WeakPolarHBondContact O-CG2 3.22Å; L465-F493 HydrophobicContact CD2-CE1 4.41Å; L465-F526 HydrophobicContact CD1-CD2 3.67Å; L465-F526 HydrophobicContact CD1-CE2 3.93Å; L465-F526 HydrophobicContact CD1-CG 4.18Å; L465-F526 HydrophobicContact CD2-CD2 4.27Å; L465-F526 HydrophobicContact CD2-CE1 4.35Å; L465-F526 HydrophobicContact CD2-CE2 3.75Å; L465-F526 HydrophobicContact CD2-CZ 3.79Å; L465-F526 HydrophobicContact CG-CD2 4.06Å; L465-F526 HydrophobicContact CG-CE2 4.05Å; L465-F526 HydrophobicContact CG-CG 4.29Å; L465-F526 HydrophobicContact CG-CZ 4.29Å
466	D	89.9	Confident	90.1	Very high	8 Å²	8	27.2 Å²	27.2	4%	0.043	14%	0.141	C	C	.	.			trans	-76.9	114.2	176.6	-170.2	-25.7	0	0	0	110.3	R43 C414 P463 S468 L469 F470	R43-D466 IonicContact NH1-OD2 3.3Å; R43-D466 PolarHBondContact NH1-OD2 2.93Å; C414-D466 HydrophobicContact CB-CB 4.49Å; P463-D466 VanDerWaalsContact O-CB 3.32Å; P463-D466 WeakPolarHBondContact O-CB 3.43Å; P463-D466 PolarHBondContact O-N 3.41Å; P463-D466 VanDerWaalsContact O-N 3.14Å; D466-S468 PolarHBondContact O-N 3.04Å; D466-S468 VanDerWaalsContact O-N 3.14Å; D466-S468 VanDerWaalsContact OD1-CB 3.26Å; D466-S468 WeakPolarHBondContact OD1-CB 3.36Å; D466-S468 PolarHBondContact OD1-N 2.85Å; D466-S468 PolarHBondContact OD1-OG 2.86Å; D466-S468 PolarHBondContact OD2-OG 3.41Å; D466-L469 HydrophobicContact CB-CB 4.31Å; D466-L469 HydrophobicContact CB-CD1 4.15Å; D466-L469 HydrophobicContact CB-CG 4.11Å; D466-L469 PolarHBondContact O-N 3.25Å; D466-F470 PolarHBondContact O-N 2.78Å
467	L	91.4	Very high	90.2	Very high	17 Å²	17	27.2 Å²	27.2	9%	0.089	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-14	-179.6	-63.4	171.3	0	0	0	113.4	C414 F421 A422 L465 F470 Y472 R496	C414-L467 VanDerWaalsContact SG-CB 3.56Å; C414-L467 PolarHBondContact SG-N 2.75Å; F421-L467 HydrophobicContact CB-CB 4.16Å; F421-L467 WeakPolarHBondContact CD2-O 3.31Å; A422-L467 HydrophobicContact CB-CD1 3.86Å; L465-L467 PolarHBondContact O-N 3.34Å; L467-F470 CarbonylContact C-O 3.6Å; L467-F470 WeakPolarHBondContact CA-O 3.36Å; L467-Y472 HydrophobicContact CD2-CD1 4.28Å; L467-Y472 HydrophobicContact CD2-CE1 3.62Å; L467-Y472 HydrophobicContact CD2-CE2 4.15Å; L467-Y472 HydrophobicContact CG-CE1 4.5Å; L467-R496 WeakPolarHBondContact O-CG 3.4Å; L467-R496 PolarHBondContact O-NE 3.13Å; L467-R496 VanDerWaalsContact O-NE 3.14Å
468	S	89.3	Confident	90.2	Very high	20 Å²	20	27.3 Å²	27.3	14%	0.14	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-26	171	71.2	0	0	0	0	112.4	N419 D466 R496	N419-S468 WeakPolarHBondContact ND2-CA 3.46Å; N419-S468 VanDerWaalsContact ND2-CB 3.28Å; N419-S468 WeakPolarHBondContact ND2-CB 3.44Å; N419-S468 PolarHBondContact ND2-N 3.06Å; D466-S468 PolarHBondContact O-N 3.04Å; D466-S468 VanDerWaalsContact O-N 3.14Å; D466-S468 VanDerWaalsContact OD1-CB 3.26Å; D466-S468 WeakPolarHBondContact OD1-CB 3.36Å; D466-S468 PolarHBondContact OD1-N 2.85Å; D466-S468 PolarHBondContact OD1-OG 2.86Å; D466-S468 PolarHBondContact OD2-OG 3.41Å; S468-R496 VanDerWaalsContact O-CB 3.3Å; S468-R496 WeakPolarHBondContact O-CB 3.45Å
469	L	90.5	Very high	90.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-42.6	-179.7	-64	-176	0	0	0	111.5	Y40 R43 H46 Q47 P463 D466 R496	Y40-L469 HydrophobicContact CE2-CD2 4.44Å; R43-L469 HydrophobicContact CB-CD1 4.16Å; R43-L469 WeakPolarHBondContact O-CD1 3.44Å; H46-L469 HydrophobicContact CB-CD1 4.42Å; Q47-L469 HydrophobicContact CG-CB 4.37Å; Q47-L469 HydrophobicContact CG-CD2 4.42Å; Q47-L469 PolarHBondContact NE2-O 3.13Å; P463-L469 HydrophobicContact CB-CD1 4.06Å; D466-L469 HydrophobicContact CB-CB 4.31Å; D466-L469 HydrophobicContact CB-CD1 4.15Å; D466-L469 HydrophobicContact CB-CG 4.11Å; D466-L469 PolarHBondContact O-N 3.25Å; L469-R496 PolarHBondContact O-N 3.03Å
470	F	93.9	Very high	90.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.6	-173.6	-60.6	-76.6	0	0	0	112.6	H46 Q47 Y464 D466 L467 Y472 F493 Y494 K502 F503	H46-F470 WeakPolarHBondContact O-CZ 3.36Å; Q47-F470 HydrophobicContact CG-CE1 4.23Å; Q47-F470 HydrophobicContact CG-CZ 4.08Å; Y464-F470 HydrophobicContact CD1-CE2 4.04Å; Y464-F470 HydrophobicContact CD1-CZ 4.27Å; D466-F470 PolarHBondContact O-N 2.78Å; L467-F470 CarbonylContact C-O 3.6Å; L467-F470 WeakPolarHBondContact CA-O 3.36Å; F470-Y472 HydrophobicContact CB-CD1 4.12Å; F470-F493 HydrophobicContact CB-CD1 4.09Å; F470-F493 HydrophobicContact CD1-CB 4.26Å; F470-F493 HydrophobicContact CG-CD1 4.38Å; F470-Y494 CarbonylContact C-O 3.59Å; F470-Y494 VanDerWaalsContact CA-O 3.29Å; F470-Y494 WeakPolarHBondContact CA-O 3.4Å; F470-K502 HydrophobicContact CE1-CB 4.19Å; F470-K502 HydrophobicContact CE1-CG 4.21Å; F470-F503 HydrophobicContact CD1-CE1 4.04Å; F470-F503 HydrophobicContact CE1-CD1 4.31Å; F470-F503 AromaticContact CE1-CE1 3.68Å; F470-F503 HydrophobicContact CE1-CE1 3.68Å; F470-F503 AromaticContact CZ-CE1 3.93Å; F470-F503 HydrophobicContact CZ-CE1 3.93Å
471	S	95	Very high	90.2	Very high	36 Å²	36	30.2 Å²	30.2	25%	0.252	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.9	165.3	-167.9	0	0	0	0	107.8	Y494 R496	S471-Y494 PolarHBondContact N-O 3Å; S471-Y494 PolarHBondContact O-N 2.98Å; S471-R496 VanDerWaalsContact OG-CZ 3.32Å; S471-R496 PolarHBondContact OG-NH1 2.84Å; S471-R496 PolarHBondContact OG-NH2 3.13Å
472	Y	94.2	Very high	90.4	Very high	21 Å²	21	33.2 Å²	33.2	8%	0.082	16%	0.162	C	C	.	.			trans	-143.4	170.1	175.8	58.8	-96.5	0	0	0	109	L465 L467 F470 V477 F493	L465-Y472 PolarHBondContact O-OH 3.03Å; L467-Y472 HydrophobicContact CD2-CD1 4.28Å; L467-Y472 HydrophobicContact CD2-CE1 3.62Å; L467-Y472 HydrophobicContact CD2-CE2 4.15Å; L467-Y472 HydrophobicContact CG-CE1 4.5Å; F470-Y472 HydrophobicContact CB-CD1 4.12Å; Y472-V477 HydrophobicContact CD2-CG1 3.64Å; Y472-V477 HydrophobicContact CE2-CG1 4.03Å; Y472-V477 WeakPolarHBondContact CE2-O 3.38Å; Y472-V477 HydrophobicContact CG-CG1 4.36Å; Y472-F493 AromaticContact CD1-CD1 3.67Å; Y472-F493 HydrophobicContact CD1-CD1 3.67Å; Y472-F493 AromaticContact CD1-CE1 3.5Å; Y472-F493 HydrophobicContact CD1-CE1 3.5Å; Y472-F493 VanDerWaalsContact CD1-CE1 3.5Å; Y472-F493 HydrophobicContact CD2-CE1 4.47Å; Y472-F493 HydrophobicContact CE1-CE1 4.17Å; Y472-F493 AromaticContact CG-CD1 4Å; Y472-F493 HydrophobicContact CG-CD1 4Å; Y472-F493 AromaticContact CG-CE1 3.68Å; Y472-F493 HydrophobicContact CG-CE1 3.68Å; Y472-F493 HydrophobicContact CG-CZ 4.29Å
473	D	90.6	Very high	90.4	Very high	82 Å²	82	35.6 Å²	35.6	44%	0.439	18%	0.177	S	C	.	.			trans	-91.1	111	179.8	-179.8	-2.8	0	0	0	110.7	K475 W476	D473-K475 PolarHBondContact O-N 2.9Å; D473-K475 VanDerWaalsContact O-N 3.15Å; D473-K475 WeakPolarHBondContact OD1-CB 3.49Å; D473-K475 PolarHBondContact OD1-N 2.75Å; D473-W476 VanDerWaalsContact CG-CD1 3.47Å; D473-W476 PolarHBondContact O-N 3.04Å; D473-W476 VanDerWaalsContact O-N 3.15Å; D473-W476 PolarHBondContact OD2-NE1 2.85Å
474	D	87.4	Confident	90.5	Very high	63 Å²	63	37 Å²	37	34%	0.337	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.8	-175.3	-165	63.8	0	0	0	113.8	W476 V477 S478 K484	D474-W476 VanDerWaalsContact C-N 3.29Å; D474-W476 PolarHBondContact O-N 3.41Å; D474-V477 CarbonylContact C-O 3.49Å; D474-V477 WeakPolarHBondContact CA-O 3.39Å; D474-S478 VanDerWaalsContact OD1-CA 3.24Å; D474-S478 WeakPolarHBondContact OD1-CA 3.08Å; D474-S478 WeakPolarHBondContact OD1-CB 3.34Å; D474-K484 PolarHBondContact O-NZ 3.28Å
475	K	88.8	Confident	90.2	Very high	127 Å²	127	39.4 Å²	39.4	55%	0.552	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-37.3	173.2	-175.5	-179.6	173.8	-176.7	0	111.6	D473	D473-K475 PolarHBondContact O-N 2.9Å; D473-K475 VanDerWaalsContact O-N 3.15Å; D473-K475 WeakPolarHBondContact OD1-CB 3.49Å; D473-K475 PolarHBondContact OD1-N 2.75Å
476	W	89.5	Confident	89.8	Confident	70 Å²	70	40.4 Å²	40.4	27%	0.265	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-28.5	-173.4	-51.8	110.6	0	0	0	113.1	D473 D474 K484 T485 G487 I491 F524	D473-W476 VanDerWaalsContact CG-CD1 3.47Å; D473-W476 PolarHBondContact O-N 3.04Å; D473-W476 VanDerWaalsContact O-N 3.15Å; D473-W476 PolarHBondContact OD2-NE1 2.85Å; D474-W476 VanDerWaalsContact C-N 3.29Å; D474-W476 PolarHBondContact O-N 3.41Å; W476-K484 VanDerWaalsContact O-CB 3.28Å; W476-K484 WeakPolarHBondContact O-CB 3.31Å; W476-T485 VanDerWaalsContact CE3-O 3.27Å; W476-G487 VanDerWaalsContact CZ3-CA 3.5Å; W476-I491 HydrophobicContact CB-CD1 3.64Å; W476-I491 HydrophobicContact CB-CG1 3.84Å; W476-F524 WeakPolarHBondContact O-CE2 3.23Å
477	V	92.2	Very high	89.3	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.209	C	C	.	.			trans	-150.1	139.1	178.9	62.2	0	0	0	0	109.1	L465 Y472 D474 I491 F493 F524 F526	L465-V477 HydrophobicContact CD2-CG2 3.7Å; Y472-V477 HydrophobicContact CD2-CG1 3.64Å; Y472-V477 HydrophobicContact CE2-CG1 4.03Å; Y472-V477 WeakPolarHBondContact CE2-O 3.38Å; Y472-V477 HydrophobicContact CG-CG1 4.36Å; D474-V477 CarbonylContact C-O 3.49Å; D474-V477 WeakPolarHBondContact CA-O 3.39Å; V477-I491 HydrophobicContact CB-CD1 4.05Å; V477-I491 HydrophobicContact CG1-CD1 4.19Å; V477-I491 HydrophobicContact CG1-CG2 3.83Å; V477-F493 HydrophobicContact CG1-CZ 3.88Å; V477-F524 HydrophobicContact CB-CD2 4.26Å; V477-F524 HydrophobicContact CB-CE2 4.11Å; V477-F524 HydrophobicContact CG2-CD2 3.88Å; V477-F524 HydrophobicContact CG2-CE2 4.21Å; V477-F524 HydrophobicContact CG2-CG 4.12Å; V477-F526 HydrophobicContact CG2-CE2 3.9Å; V477-F526 HydrophobicContact CG2-CZ 4.24Å
478	S	89.7	Confident	88.5	Confident	13 Å²	13	45 Å²	45	9%	0.091	23%	0.233	C	C	.	.			trans	-140.1	163	179	65.6	0	0	0	0	112.8	D474 M480 K484	D474-S478 VanDerWaalsContact OD1-CA 3.24Å; D474-S478 WeakPolarHBondContact OD1-CA 3.08Å; D474-S478 WeakPolarHBondContact OD1-CB 3.34Å; S478-M480 PolarHBondContact O-N 2.95Å; S478-M480 PolarHBondContact OG-O 2.74Å; S478-K484 WeakPolarHBondContact OG-CE 3.4Å; S478-K484 PolarHBondContact OG-NZ 3.48Å
479	V	88.8	Confident	88.3	Confident	23 Å²	23	50.8 Å²	50.8	14%	0.139	26%	0.257	C	S	.	.	S	Bend	trans	-60.5	-34.8	172.6	-173.1	0	0	0	0	111.6	Y459 S460 L465 E481	Y459-V479 WeakPolarHBondContact CA-O 3.41Å; Y459-V479 HydrophobicContact CD1-CB 4.49Å; Y459-V479 HydrophobicContact CD1-CG1 4.07Å; S460-V479 PolarHBondContact N-O 3.16Å; S460-V479 WeakPolarHBondContact O-CG1 3.17Å; L465-V479 HydrophobicContact CB-CG2 4.07Å; L465-V479 VanDerWaalsContact O-CG2 3.31Å; L465-V479 WeakPolarHBondContact O-CG2 3.22Å; V479-E481 PolarHBondContact O-N 3.01Å
480	M	88.6	Confident	88.3	Confident	60 Å²	60	52.4 Å²	52.4	30%	0.296	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-71.6	126.4	174.5	-174.1	177	59.3	0	0	109.9	S458 Y459 S478 R482	S458-M480 WeakPolarHBondContact O-CA 3.46Å; Y459-M480 HydrophobicContact CD1-CB 4.28Å; Y459-M480 HydrophobicContact CE1-CB 4.14Å; S478-M480 PolarHBondContact O-N 2.95Å; S478-M480 PolarHBondContact OG-O 2.74Å; M480-R482 HydrophobicContact CE-CB 4.36Å; M480-R482 HydrophobicContact CE-CG 4.2Å; M480-R482 HydrophobicContact CG-CG 4.2Å; M480-R482 PolarHBondContact O-N 3.21Å; M480-R482 HydrophobicContact SD-CG 4.37Å
481	E	87.3	Confident	88.3	Confident	38 Å²	38	53.1 Å²	53.1	18%	0.178	27%	0.271	C	S	.	.			trans	-77	65.4	-177	-64.9	-179.2	177.3	0	0	111.5	K67 S458 V479	K67-E481 WeakPolarHBondContact CD-OE2 3.49Å; K67-E481 WeakPolarHBondContact CE-OE1 3.49Å; K67-E481 VanDerWaalsContact CE-OE2 3.26Å; K67-E481 WeakPolarHBondContact CE-OE2 3.49Å; K67-E481 IonicContact NZ-OE1 3.6Å; K67-E481 PolarHBondContact NZ-OE1 3.43Å; K67-E481 IonicContact NZ-OE2 3.48Å; K67-E481 PolarHBondContact NZ-OE2 2.77Å; S458-E481 PolarHBondContact O-N 3.46Å; V479-E481 PolarHBondContact O-N 3.01Å
482	R	87.7	Confident	88.3	Confident	99 Å²	99	57.1 Å²	57.1	37%	0.374	28%	0.28	S	S	.	.	S	Bend	trans	-122.3	146.4	172.4	-74	-164.3	179.6	171.7	2.2	111.2	M480 K484	M480-R482 HydrophobicContact CE-CB 4.36Å; M480-R482 HydrophobicContact CE-CG 4.2Å; M480-R482 HydrophobicContact CG-CG 4.2Å; M480-R482 PolarHBondContact O-N 3.21Å; M480-R482 HydrophobicContact SD-CG 4.37Å; R482-K484 PolarHBondContact O-N 3.25Å
483	P	89.8	Confident	88.4	Confident	54 Å²	54	56.1 Å²	56.1	35%	0.351	28%	0.277	S	S	.	.			trans	-55.7	133.8	173.7	-23.9	33.4	0	0	0	111.6	L521 V522 A523	P483-L521 HydrophobicContact CB-CB 4.05Å; P483-L521 HydrophobicContact CB-CD1 4.33Å; P483-V522 CarbonylContact C-O 3.56Å; P483-V522 WeakPolarHBondContact CA-O 3.32Å; P483-A523 HydrophobicContact CG-CB 4.47Å
484	K	90.9	Very high	88.6	Confident	40 Å²	40	56.3 Å²	56.3	17%	0.174	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	160.5	176.7	-66.2	-69.1	-177.7	145	0	110.1	D474 W476 S478 R482 C486 L521 V522	D474-K484 PolarHBondContact O-NZ 3.28Å; W476-K484 VanDerWaalsContact O-CB 3.28Å; W476-K484 WeakPolarHBondContact O-CB 3.31Å; S478-K484 WeakPolarHBondContact OG-CE 3.4Å; S478-K484 PolarHBondContact OG-NZ 3.48Å; R482-K484 PolarHBondContact O-N 3.25Å; K484-C486 PolarHBondContact O-N 2.89Å; K484-L521 CarbonylContact O-C 3.56Å; K484-L521 VanDerWaalsContact O-CA 3.25Å; K484-L521 WeakPolarHBondContact O-CA 3.34Å; K484-V522 PolarHBondContact N-O 2.86Å; K484-V522 PolarHBondContact O-N 2.78Å
485	T	87.6	Confident	88.9	Confident	51 Å²	51	53.4 Å²	53.4	31%	0.313	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	132.9	171.1	48.5	0	0	0	0	109.6	W476 G487 L521	W476-T485 VanDerWaalsContact CE3-O 3.27Å; T485-G487 PolarHBondContact O-N 3.45Å; T485-L521 HydrophobicContact CG2-CD2 4.34Å
486	C	83.7	Confident	89	Confident	25 Å²	25	50.1 Å²	50.1	17%	0.169	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-75.3	123.7	173.1	-173.6	0	0	0	0	109.4	K484 R520 V522 Q537	K484-C486 PolarHBondContact O-N 2.89Å; C486-R520 HydrophobicContact CB-CB 4.01Å; C486-R520 PolarHBondContact N-O 3.48Å; C486-V522 HydrophobicContact CB-CB 4.41Å; C486-V522 HydrophobicContact CB-CG1 4.27Å; C486-Q537 PolarHBondContact SG-NE2 3.23Å
487	G	77.7	Confident	88.9	Confident	14 Å²	14	48.2 Å²	48.2	14%	0.144	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-87.9	159.2	170.8	0	0	0	0	0	112	W476 T485	W476-G487 VanDerWaalsContact CZ3-CA 3.5Å; T485-G487 PolarHBondContact O-N 3.45Å
488	D	75.6	Confident	88.7	Confident	109 Å²	109	48.6 Å²	48.6	58%	0.583	24%	0.239	S	C	*	.	S	Bend	trans	-77.9	-26.2	176.9	-56.8	-43.2	0	0	0	112.4
489	H	85.3	Confident	88.8	Confident	140 Å²	140	50 Å²	50	65%	0.648	26%	0.256	S	S	*	.	S	Bend	trans	-97.8	148.8	-176.1	-63.5	87.9	0	0	0	111.4	I491	H489-I491 PolarHBondContact O-N 3.27Å
490	P	89.5	Confident	88.9	Confident	34 Å²	34	52.5 Å²	52.5	22%	0.221	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-58.9	137.7	173.2	19	-28.5	0	0	0	111.2	R492 K504 I505 Q506	P490-R492 PolarHBondContact O-N 3.4Å; P490-K504 HydrophobicContact CB-CB 4.01Å; P490-K504 HydrophobicContact CB-CD 4.24Å; P490-K504 HydrophobicContact CB-CG 4.47Å; P490-K504 HydrophobicContact CG-CD 4.25Å; P490-I505 WeakPolarHBondContact CA-O 3.35Å; P490-Q506 VanDerWaalsContact CB-OE1 3.25Å
491	I	93.6	Very high	89.2	Confident	15 Å²	15	53.1 Å²	53.1	8%	0.077	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.2	174.6	-53.4	173	0	0	0	107.8	W476 V477 H489 F493 K504 I505 F524	W476-I491 HydrophobicContact CB-CD1 3.64Å; W476-I491 HydrophobicContact CB-CG1 3.84Å; V477-I491 HydrophobicContact CB-CD1 4.05Å; V477-I491 HydrophobicContact CG1-CD1 4.19Å; V477-I491 HydrophobicContact CG1-CG2 3.83Å; H489-I491 PolarHBondContact O-N 3.27Å; I491-F493 HydrophobicContact CB-CE2 4.17Å; I491-F493 HydrophobicContact CG2-CD2 4.33Å; I491-F493 HydrophobicContact CG2-CE2 3.68Å; I491-F493 HydrophobicContact CG2-CZ 4.24Å; I491-K504 CarbonylContact O-C 3.57Å; I491-K504 VanDerWaalsContact O-CA 3.23Å; I491-K504 WeakPolarHBondContact O-CA 3.34Å; I491-I505 HydrophobicContact CB-CB 4.44Å; I491-I505 PolarHBondContact N-O 3.11Å; I491-I505 PolarHBondContact O-N 2.99Å; I491-F524 HydrophobicContact CD1-CE2 4.28Å; I491-F524 HydrophobicContact CD1-CZ 3.72Å
492	R	95.1	Very high	89.5	Confident	120 Å²	120	52.8 Å²	52.8	45%	0.453	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.7	-175.3	-64.4	-175.4	-178	111	-3.7	111.2	P490 Y494 L501 K504	P490-R492 PolarHBondContact O-N 3.4Å; R492-Y494 HydrophobicContact CB-CD2 4.39Å; R492-Y494 HydrophobicContact CB-CE2 3.63Å; R492-Y494 VanDerWaalsContact CD-OH 3.27Å; R492-Y494 WeakPolarHBondContact CD-OH 3.24Å; R492-L501 HydrophobicContact CB-CD1 3.72Å; R492-L501 HydrophobicContact CG-CD1 4.16Å; R492-K504 HydrophobicContact CG-CG 4.31Å
493	F	96.5	Very high	89.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.2	177.4	-71.5	-104.1	0	0	0	110.3	Y464 L465 F470 Y472 V477 I491 K502 F503 I505	Y464-F493 WeakPolarHBondContact O-CE1 3.11Å; L465-F493 HydrophobicContact CD2-CE1 4.41Å; F470-F493 HydrophobicContact CB-CD1 4.09Å; F470-F493 HydrophobicContact CD1-CB 4.26Å; F470-F493 HydrophobicContact CG-CD1 4.38Å; Y472-F493 AromaticContact CD1-CD1 3.67Å; Y472-F493 HydrophobicContact CD1-CD1 3.67Å; Y472-F493 AromaticContact CD1-CE1 3.5Å; Y472-F493 HydrophobicContact CD1-CE1 3.5Å; Y472-F493 VanDerWaalsContact CD1-CE1 3.5Å; Y472-F493 HydrophobicContact CD2-CE1 4.47Å; Y472-F493 HydrophobicContact CE1-CE1 4.17Å; Y472-F493 AromaticContact CG-CD1 4Å; Y472-F493 HydrophobicContact CG-CD1 4Å; Y472-F493 AromaticContact CG-CE1 3.68Å; Y472-F493 HydrophobicContact CG-CE1 3.68Å; Y472-F493 HydrophobicContact CG-CZ 4.29Å; V477-F493 HydrophobicContact CG1-CZ 3.88Å; I491-F493 HydrophobicContact CB-CE2 4.17Å; I491-F493 HydrophobicContact CG2-CD2 4.33Å; I491-F493 HydrophobicContact CG2-CE2 3.68Å; I491-F493 HydrophobicContact CG2-CZ 4.24Å; F493-K502 PolarHBondContact O-N 2.84Å; F493-F503 HydrophobicContact CB-CD1 3.78Å; F493-F503 HydrophobicContact CB-CD2 4.28Å; F493-F503 HydrophobicContact CB-CE1 3.47Å; F493-F503 VanDerWaalsContact CB-CE1 3.47Å; F493-F503 HydrophobicContact CB-CE2 4.01Å; F493-F503 HydrophobicContact CB-CG 4.17Å; F493-F503 HydrophobicContact CB-CZ 3.59Å; F493-F503 HydrophobicContact CD1-CE1 4.09Å; F493-F503 HydrophobicContact CD1-CE2 4.04Å; F493-F503 AromaticContact CD1-CZ 3.48Å; F493-F503 HydrophobicContact CD1-CZ 3.48Å; F493-F503 VanDerWaalsContact CD1-CZ 3.48Å; F493-F503 AromaticContact CD2-CD2 3.95Å; F493-F503 HydrophobicContact CD2-CD2 3.95Å; F493-F503 HydrophobicContact CD2-CE1 4.48Å; F493-F503 AromaticContact CD2-CE2 3.46Å; F493-F503 HydrophobicContact CD2-CE2 3.46Å; F493-F503 VanDerWaalsContact CD2-CE2 3.46Å; F493-F503 AromaticContact CD2-CZ 3.76Å; F493-F503 HydrophobicContact CD2-CZ 3.76Å; F493-F503 HydrophobicContact CE1-CE2 4.38Å; F493-F503 HydrophobicContact CE1-CZ 4.04Å; F493-F503 AromaticContact CE2-CE2 3.86Å; F493-F503 HydrophobicContact CE2-CE2 3.86Å; F493-F503 HydrophobicContact CE2-CZ 4.29Å; F493-F503 HydrophobicContact CG-CD1 4.39Å; F493-F503 HydrophobicContact CG-CD2 4.21Å; F493-F503 AromaticContact CG-CE1 3.79Å; F493-F503 HydrophobicContact CG-CE1 3.79Å; F493-F503 AromaticContact CG-CE2 3.57Å; F493-F503 HydrophobicContact CG-CE2 3.57Å; F493-F503 AromaticContact CG-CZ 3.32Å; F493-F503 HydrophobicContact CG-CZ 3.32Å; F493-F503 HydrophobicContact CZ-CE2 4.29Å; F493-F503 HydrophobicContact CZ-CZ 4.41Å; F493-F503 PolarHBondContact N-O 3.06Å; F493-I505 HydrophobicContact CD2-CG1 4.38Å; F493-I505 HydrophobicContact CE2-CB 4.2Å; F493-I505 HydrophobicContact CE2-CD1 3.66Å; F493-I505 HydrophobicContact CE2-CG1 3.8Å; F493-I505 HydrophobicContact CZ-CD1 3.9Å
494	Y	96	Very high	90.1	Very high	87 Å²	87	48.8 Å²	48.8	34%	0.341	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.4	179	-59.3	-92.8	0	0	0	110.8	F470 S471 R492 R496 L500 L501	F470-Y494 CarbonylContact C-O 3.59Å; F470-Y494 VanDerWaalsContact CA-O 3.29Å; F470-Y494 WeakPolarHBondContact CA-O 3.4Å; S471-Y494 PolarHBondContact N-O 3Å; S471-Y494 PolarHBondContact O-N 2.98Å; R492-Y494 HydrophobicContact CB-CD2 4.39Å; R492-Y494 HydrophobicContact CB-CE2 3.63Å; R492-Y494 VanDerWaalsContact CD-OH 3.27Å; R492-Y494 WeakPolarHBondContact CD-OH 3.24Å; Y494-R496 PolarHBondContact O-N 2.88Å; Y494-L500 CarbonylContact C-O 3.53Å; Y494-L500 WeakPolarHBondContact CA-O 3.34Å; Y494-L501 HydrophobicContact CD1-CB 3.94Å; Y494-L501 HydrophobicContact CD1-CD1 4.17Å; Y494-L501 HydrophobicContact CE1-CB 3.83Å; Y494-L501 HydrophobicContact CE1-CD1 3.92Å; Y494-L501 HydrophobicContact CE1-CG 4.41Å; Y494-L501 HydrophobicContact CE2-CD1 4.4Å
495	A	93.8	Very high	90.1	Very high	2 Å²	2	46.9 Å²	46.9	2%	0.017	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	128.4	176.1	0	0	0	0	0	110.5	D497 G499 L500 K502	A495-D497 VanDerWaalsContact C-N 3.25Å; A495-D497 WeakPolarHBondContact CB-OD1 3.47Å; A495-D497 PolarHBondContact O-N 3.11Å; A495-G499 VanDerWaalsContact O-CA 3.22Å; A495-G499 WeakPolarHBondContact O-CA 3.37Å; A495-G499 PolarHBondContact O-N 2.91Å; A495-L500 PolarHBondContact N-O 3.48Å; A495-K502 HydrophobicContact CB-CD 4.13Å; A495-K502 HydrophobicContact CB-CG 3.63Å
496	R	90.9	Very high	90.2	Very high	57 Å²	57	45 Å²	45	22%	0.215	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-25.8	178.6	-76.8	-70.3	-170.2	-162.8	-4.9	113.4	R14 F421 L467 S468 L469 S471 Y494	R14-R496 PolarHBondContact NH1-O 3.3Å; R14-R496 PolarHBondContact NH2-O 3.2Å; F421-R496 HydrophobicContact CE2-CG 4.29Å; L467-R496 WeakPolarHBondContact O-CG 3.4Å; L467-R496 PolarHBondContact O-NE 3.13Å; L467-R496 VanDerWaalsContact O-NE 3.14Å; S468-R496 VanDerWaalsContact O-CB 3.3Å; S468-R496 WeakPolarHBondContact O-CB 3.45Å; L469-R496 PolarHBondContact O-N 3.03Å; S471-R496 VanDerWaalsContact OG-CZ 3.32Å; S471-R496 PolarHBondContact OG-NH1 2.84Å; S471-R496 PolarHBondContact OG-NH2 3.13Å; Y494-R496 PolarHBondContact O-N 2.88Å
497	D	87.5	Confident	90.2	Very high	31 Å²	31	44.1 Å²	44.1	17%	0.166	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-35.4	-177.2	69.1	-37.3	0	0	0	113.2	R14 Q19 R24 Q47 A495	R14-D497 PolarHBondContact NE-O 2.86Å; R14-D497 PolarHBondContact NH2-O 3.34Å; Q19-D497 PolarHBondContact NE2-OD2 3.02Å; Q19-D497 VanDerWaalsContact NE2-OD2 3.07Å; R24-D497 IonicContact CZ-OD2 3.67Å; R24-D497 IonicContact NH1-OD2 3.79Å; R24-D497 IonicContact NH2-OD2 2.66Å; R24-D497 PolarHBondContact NH2-OD2 3.47Å; Q47-D497 PolarHBondContact NE2-OD1 3.43Å; A495-D497 VanDerWaalsContact C-N 3.25Å; A495-D497 WeakPolarHBondContact CB-OD1 3.47Å; A495-D497 PolarHBondContact O-N 3.11Å
498	A	88.1	Confident	89.9	Confident	8 Å²	8	43.8 Å²	43.8	7%	0.066	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-22.4	-175.8	0	0	0	0	0	114	I16 L500	I16-A498 HydrophobicContact CG2-CB 3.89Å; A498-L500 HydrophobicContact CB-CB 4.26Å; A498-L500 HydrophobicContact CB-CD1 3.85Å; A498-L500 HydrophobicContact CB-CG 3.78Å; A498-L500 PolarHBondContact O-N 2.96Å
499	G	89.9	Confident	89.5	Confident	44 Å²	44	40 Å²	40	45%	0.454	20%	0.2	S	C	.	.			trans	76.5	0.5	-169.2	0	0	0	0	0	114	A495	A495-G499 VanDerWaalsContact O-CA 3.22Å; A495-G499 WeakPolarHBondContact O-CA 3.37Å; A495-G499 PolarHBondContact O-N 2.91Å
500	L	92.7	Very high	88.2	Confident	75 Å²	75	38.7 Å²	38.7	39%	0.393	20%	0.197	S	C	.	.			trans	-74.8	141.1	-178.3	-62.7	173.4	0	0	0	111.1	I16 Q19 Y494 A495 A498 K502	I16-L500 HydrophobicContact CD1-CD2 4.37Å; I16-L500 HydrophobicContact CG2-CD1 4.45Å; Q19-L500 HydrophobicContact CG-CD1 4.12Å; Y494-L500 CarbonylContact C-O 3.53Å; Y494-L500 WeakPolarHBondContact CA-O 3.34Å; A495-L500 PolarHBondContact N-O 3.48Å; A498-L500 HydrophobicContact CB-CB 4.26Å; A498-L500 HydrophobicContact CB-CD1 3.85Å; A498-L500 HydrophobicContact CB-CG 3.78Å; A498-L500 PolarHBondContact O-N 2.96Å; L500-K502 PolarHBondContact O-N 3.46Å
501	L	94.5	Very high	86.4	Confident	72 Å²	72	41 Å²	41	38%	0.377	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	121.2	168	-178.3	63.3	0	0	0	108.9	R492 Y494 K504	R492-L501 HydrophobicContact CB-CD1 3.72Å; R492-L501 HydrophobicContact CG-CD1 4.16Å; Y494-L501 HydrophobicContact CD1-CB 3.94Å; Y494-L501 HydrophobicContact CD1-CD1 4.17Å; Y494-L501 HydrophobicContact CE1-CB 3.83Å; Y494-L501 HydrophobicContact CE1-CD1 3.92Å; Y494-L501 HydrophobicContact CE1-CG 4.41Å; Y494-L501 HydrophobicContact CE2-CD1 4.4Å; L501-K504 HydrophobicContact CD2-CG 4.47Å
502	K	93.9	Very high	84.6	Confident	32 Å²	32	46.8 Å²	46.8	14%	0.139	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-51	-179.6	-68.6	-67	-172.2	160.9	0	111.4	Q47 F50 F470 F493 A495 L500	Q47-K502 VanDerWaalsContact O-CD 3.31Å; Q47-K502 WeakPolarHBondContact O-CD 3.21Å; Q47-K502 WeakPolarHBondContact O-CE 3.31Å; Q47-K502 PolarHBondContact O-NZ 3Å; F50-K502 HydrophobicContact CD1-CB 4.2Å; F50-K502 HydrophobicContact CD1-CD 4.48Å; F50-K502 HydrophobicContact CE1-CB 4.17Å; F50-K502 HydrophobicContact CE1-CD 3.92Å; F50-K502 WeakPolarHBondContact CE2-O 3.44Å; F50-K502 HydrophobicContact CZ-CB 4.45Å; F50-K502 HydrophobicContact CZ-CD 4.49Å; F50-K502 WeakPolarHBondContact CZ-O 3.26Å; F470-K502 HydrophobicContact CE1-CB 4.19Å; F470-K502 HydrophobicContact CE1-CG 4.21Å; F493-K502 PolarHBondContact O-N 2.84Å; A495-K502 HydrophobicContact CB-CD 4.13Å; A495-K502 HydrophobicContact CB-CG 3.63Å; L500-K502 PolarHBondContact O-N 3.46Å
503	F	94.7	Very high	82.4	Confident	7 Å²	7	46.7 Å²	46.7	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	171.2	-179.9	66.7	-79.9	0	0	0	112.3	F50 P51 Y464 F470 F493 I505	F50-F503 HydrophobicContact CB-CB 4.5Å; F50-F503 HydrophobicContact CB-CD1 3.55Å; F50-F503 HydrophobicContact CB-CE1 3.96Å; F50-F503 HydrophobicContact CB-CG 4.12Å; F50-F503 HydrophobicContact CD2-CB 3.64Å; F50-F503 HydrophobicContact CD2-CD1 4.13Å; F50-F503 HydrophobicContact CD2-CG 4.19Å; F50-F503 HydrophobicContact CE2-CB 4.21Å; F50-F503 HydrophobicContact CG-CB 4.3Å; F50-F503 AromaticContact CG-CD1 3.91Å; F50-F503 HydrophobicContact CG-CD1 3.91Å; F50-F503 HydrophobicContact CG-CG 4.39Å; P51-F503 HydrophobicContact CG-CD2 3.91Å; P51-F503 HydrophobicContact CG-CE2 3.83Å; P51-F503 HydrophobicContact CG-CZ 4.45Å; P51-F503 WeakPolarHBondContact O-CB 3.42Å; P51-F503 VanDerWaalsContact O-CD2 3.31Å; P51-F503 WeakPolarHBondContact O-CD2 3.5Å; P51-F503 WeakPolarHBondContact O-CG 3.43Å; Y464-F503 HydrophobicContact CD1-CE1 4.27Å; Y464-F503 HydrophobicContact CD1-CZ 4.13Å; F470-F503 HydrophobicContact CD1-CE1 4.04Å; F470-F503 HydrophobicContact CE1-CD1 4.31Å; F470-F503 AromaticContact CE1-CE1 3.68Å; F470-F503 HydrophobicContact CE1-CE1 3.68Å; F470-F503 AromaticContact CZ-CE1 3.93Å; F470-F503 HydrophobicContact CZ-CE1 3.93Å; F493-F503 HydrophobicContact CB-CD1 3.78Å; F493-F503 HydrophobicContact CB-CD2 4.28Å; F493-F503 HydrophobicContact CB-CE1 3.47Å; F493-F503 VanDerWaalsContact CB-CE1 3.47Å; F493-F503 HydrophobicContact CB-CE2 4.01Å; F493-F503 HydrophobicContact CB-CG 4.17Å; F493-F503 HydrophobicContact CB-CZ 3.59Å; F493-F503 HydrophobicContact CD1-CE1 4.09Å; F493-F503 HydrophobicContact CD1-CE2 4.04Å; F493-F503 AromaticContact CD1-CZ 3.48Å; F493-F503 HydrophobicContact CD1-CZ 3.48Å; F493-F503 VanDerWaalsContact CD1-CZ 3.48Å; F493-F503 AromaticContact CD2-CD2 3.95Å; F493-F503 HydrophobicContact CD2-CD2 3.95Å; F493-F503 HydrophobicContact CD2-CE1 4.48Å; F493-F503 AromaticContact CD2-CE2 3.46Å; F493-F503 HydrophobicContact CD2-CE2 3.46Å; F493-F503 VanDerWaalsContact CD2-CE2 3.46Å; F493-F503 AromaticContact CD2-CZ 3.76Å; F493-F503 HydrophobicContact CD2-CZ 3.76Å; F493-F503 HydrophobicContact CE1-CE2 4.38Å; F493-F503 HydrophobicContact CE1-CZ 4.04Å; F493-F503 AromaticContact CE2-CE2 3.86Å; F493-F503 HydrophobicContact CE2-CE2 3.86Å; F493-F503 HydrophobicContact CE2-CZ 4.29Å; F493-F503 HydrophobicContact CG-CD1 4.39Å; F493-F503 HydrophobicContact CG-CD2 4.21Å; F493-F503 AromaticContact CG-CE1 3.79Å; F493-F503 HydrophobicContact CG-CE1 3.79Å; F493-F503 AromaticContact CG-CE2 3.57Å; F493-F503 HydrophobicContact CG-CE2 3.57Å; F493-F503 AromaticContact CG-CZ 3.32Å; F493-F503 HydrophobicContact CG-CZ 3.32Å; F493-F503 HydrophobicContact CZ-CE2 4.29Å; F493-F503 HydrophobicContact CZ-CZ 4.41Å; F493-F503 PolarHBondContact N-O 3.06Å; F503-I505 HydrophobicContact CD2-CG1 4.06Å; F503-I505 HydrophobicContact CE2-CD1 3.95Å; F503-I505 HydrophobicContact CE2-CG1 3.86Å
504	K	93.9	Very high	80.2	Confident	61 Å²	61	49.2 Å²	49.2	27%	0.265	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.7	179.5	-63.2	178.6	-150.6	139.8	0	108.9	E106 P490 I491 R492 L501	E106-K504 IonicContact OE1-NZ 3.2Å; E106-K504 PolarHBondContact OE1-NZ 3.14Å; E106-K504 IonicContact OE2-NZ 2.75Å; E106-K504 PolarHBondContact OE2-NZ 3.35Å; P490-K504 HydrophobicContact CB-CB 4.01Å; P490-K504 HydrophobicContact CB-CD 4.24Å; P490-K504 HydrophobicContact CB-CG 4.47Å; P490-K504 HydrophobicContact CG-CD 4.25Å; I491-K504 CarbonylContact O-C 3.57Å; I491-K504 VanDerWaalsContact O-CA 3.23Å; I491-K504 WeakPolarHBondContact O-CA 3.34Å; R492-K504 HydrophobicContact CG-CG 4.31Å; L501-K504 HydrophobicContact CD2-CG 4.47Å
505	I	92.5	Very high	78.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.2	171	-66.6	-175.4	0	0	0	108.2	P490 I491 F493 F503 A507 F524 F526	P490-I505 WeakPolarHBondContact CA-O 3.35Å; I491-I505 HydrophobicContact CB-CB 4.44Å; I491-I505 PolarHBondContact N-O 3.11Å; I491-I505 PolarHBondContact O-N 2.99Å; F493-I505 HydrophobicContact CD2-CG1 4.38Å; F493-I505 HydrophobicContact CE2-CB 4.2Å; F493-I505 HydrophobicContact CE2-CD1 3.66Å; F493-I505 HydrophobicContact CE2-CG1 3.8Å; F493-I505 HydrophobicContact CZ-CD1 3.9Å; F503-I505 HydrophobicContact CD2-CG1 4.06Å; F503-I505 HydrophobicContact CE2-CD1 3.95Å; F503-I505 HydrophobicContact CE2-CG1 3.86Å; I505-A507 PolarHBondContact O-N 3.08Å; I505-F524 HydrophobicContact CG2-CE1 3.78Å; I505-F526 HydrophobicContact CD1-CE1 3.7Å; I505-F526 HydrophobicContact CD1-CZ 3.44Å; I505-F526 VanDerWaalsContact CD1-CZ 3.44Å
506	Q	88.4	Confident	76.3	Confident	11 Å²	11	59.8 Å²	59.8	5%	0.051	34%	0.335	C	S	.	.			trans	-93.7	92.7	175.8	-174.5	63.8	26.5	0	0	109.5	T54 P490 G508 H548	T54-Q506 HydrophobicContact CG2-CB 4.23Å; P490-Q506 VanDerWaalsContact CB-OE1 3.25Å; Q506-G508 PolarHBondContact NE2-O 3.29Å; Q506-H548 PolarHBondContact O-CE1 3.41Å; Q506-H548 VanDerWaalsContact O-CE1 3.28Å
507	A	83.4	Confident	74.5	Confident	6 Å²	6	61.7 Å²	61.7	5%	0.05	36%	0.362	C	S	.	.			trans	-74.7	-47.7	174.9	0	0	0	0	0	111.3	I505 V522 F524 Q537 N546	I505-A507 PolarHBondContact O-N 3.08Å; A507-V522 HydrophobicContact CB-CG1 4.36Å; A507-V522 HydrophobicContact CB-CG2 4.15Å; A507-F524 HydrophobicContact CB-CE1 4.1Å; A507-F524 HydrophobicContact CB-CZ 3.78Å; A507-Q537 PolarHBondContact O-NE2 2.88Å; A507-N546 PolarHBondContact O-ND2 3.49Å
508	G	72.8	Confident	73.2	Confident	7 Å²	7	64.1 Å²	64.1	7%	0.072	38%	0.379	C	S	.	.	S	Bend	trans	-74	146.9	-172.2	0	0	0	0	0	115.9	Q506 L510	Q506-G508 PolarHBondContact NE2-O 3.29Å; G508-L510 PolarHBondContact O-N 2.97Å
509	L	66.2	Low	72.2	Confident	29 Å²	29	74.1 Å²	74.1	15%	0.152	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-69.6	116.9	163.8	-85.5	144.1	0	0	0	109.6	V56 T110 V544	V56-L509 HydrophobicContact CG1-CD2 4.05Å; V56-L509 HydrophobicContact CG1-CG 4.37Å; T110-L509 HydrophobicContact CG2-CD2 4.15Å; L509-V544 HydrophobicContact CD1-CG1 4.23Å; L509-V544 HydrophobicContact CD1-CG2 4.1Å
510	L	57.5	Low	71.7	Confident	113 Å²	113	75.3 Å²	75.3	59%	0.592	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	133.5	175.3	-68.7	164.9	0	0	0	110.1	G508	G508-L510 PolarHBondContact O-N 2.97Å
511	G	52.4	Low	71.4	Confident	84 Å²	84	75.5 Å²	75.5	87%	0.866	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	0.8	165.1	0	0	0	0	0	118
512	R	56.1	Low	71.3	Confident	135 Å²	135	72.1 Å²	72.1	51%	0.509	39%	0.389	S	S	.	.			trans	-90.7	127.6	169.3	-82	-170.5	176.5	-172.3	-0.9	110.8	V514 E542	R512-V514 PolarHBondContact O-N 3.32Å; R512-E542 IonicContact CZ-OE1 3.95Å; R512-E542 IonicContact NH1-OE1 2.78Å; R512-E542 PolarHBondContact NH1-OE1 2.86Å; R512-E542 IonicContact NH1-OE2 3.95Å; R512-E542 PolarHBondContact NH1-OE2 3.19Å; R512-E542 IonicContact NH2-OE1 3.2Å
513	P	48	Very low	71.2	Confident	119 Å²	119	72.2 Å²	72.2	77%	0.773	40%	0.396	S	S	*	.			trans	-58.2	135.3	176	23.1	-30.9	0	0	0	110.2	N515	P513-N515 PolarHBondContact O-N 3.13Å
514	V	51.6	Low	71.2	Confident	53 Å²	53	73.1 Å²	73.1	32%	0.321	40%	0.399	S	S	.	.			trans	-80	115.7	-179.8	-179.2	0	0	0	0	108	R512 H516	R512-V514 PolarHBondContact O-N 3.32Å; V514-H516 PolarHBondContact O-N 2.95Å
515	N	51.8	Low	71.3	Confident	131 Å²	131	71 Å²	71	70%	0.701	39%	0.392	S	S	*	.			trans	-67.6	101.8	158	-95.2	-20.1	0	0	0	107.5	P513 A517 V518	P513-N515 PolarHBondContact O-N 3.13Å; N515-A517 PolarHBondContact O-N 3.48Å; N515-V518 PolarHBondContact O-N 3.45Å
516	H	54.9	Low	71.4	Confident	179 Å²	179	71.4 Å²	71.4	83%	0.829	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-11.4	179	-65.7	-66.9	0	0	0	113.9	V514	V514-H516 PolarHBondContact O-N 2.95Å
517	A	53.6	Low	71.7	Confident	97 Å²	97	71.1 Å²	71.1	80%	0.802	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-25.1	177	0	0	0	0	0	114.2	N515	N515-A517 PolarHBondContact O-N 3.48Å
518	V	60.5	Low	72	Confident	83 Å²	83	71.2 Å²	71.2	50%	0.503	39%	0.392	S	S	.	.	S	Bend	trans	-123.5	113.6	-175.8	-173.7	0	0	0	0	111	N515 R520	N515-V518 PolarHBondContact O-N 3.45Å; V518-R520 PolarHBondContact O-N 2.93Å; V518-R520 VanDerWaalsContact O-N 3.16Å
519	R	66.9	Low	72.8	Confident	218 Å²	218	74 Å²	74	82%	0.823	40%	0.403	S	S	*	.			trans	-66	111.6	173.2	-72.1	-177.7	179.1	179.2	0.9	109.6
520	R	78.4	Confident	74	Confident	68 Å²	68	75.9 Å²	75.9	26%	0.257	41%	0.41	S	S	.	.			trans	-73.7	127.3	171.4	-65.3	-174.7	-172.7	162.7	5.7	109.6	C486 V518 T539	C486-R520 HydrophobicContact CB-CB 4.01Å; C486-R520 PolarHBondContact N-O 3.48Å; V518-R520 PolarHBondContact O-N 2.93Å; V518-R520 VanDerWaalsContact O-N 3.16Å; R520-T539 HydrophobicContact CG-CG2 4.04Å
521	L	88.1	Confident	75.8	Confident	79 Å²	79	71 Å²	71	41%	0.414	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	144.2	174.8	-62.5	178	0	0	0	110.1	P483 K484 T485	P483-L521 HydrophobicContact CB-CB 4.05Å; P483-L521 HydrophobicContact CB-CD1 4.33Å; K484-L521 CarbonylContact O-C 3.56Å; K484-L521 VanDerWaalsContact O-CA 3.25Å; K484-L521 WeakPolarHBondContact O-CA 3.34Å; T485-L521 HydrophobicContact CG2-CD2 4.34Å
522	V	91.3	Very high	77.9	Confident	1 Å²	1	67 Å²	67	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130	174.8	63.4	0	0	0	0	109.7	P483 K484 C486 A507 F524 V536 Q537	P483-V522 CarbonylContact C-O 3.56Å; P483-V522 WeakPolarHBondContact CA-O 3.32Å; K484-V522 PolarHBondContact N-O 2.86Å; K484-V522 PolarHBondContact O-N 2.78Å; C486-V522 HydrophobicContact CB-CB 4.41Å; C486-V522 HydrophobicContact CB-CG1 4.27Å; A507-V522 HydrophobicContact CB-CG1 4.36Å; A507-V522 HydrophobicContact CB-CG2 4.15Å; V522-F524 HydrophobicContact CB-CE2 4.41Å; V522-F524 HydrophobicContact CG1-CD2 4.31Å; V522-F524 HydrophobicContact CG1-CE2 3.45Å; V522-F524 VanDerWaalsContact CG1-CE2 3.45Å; V522-F524 HydrophobicContact CG1-CZ 3.75Å; V522-F524 HydrophobicContact CG2-CE1 4.31Å; V522-F524 HydrophobicContact CG2-CE2 4.15Å; V522-F524 HydrophobicContact CG2-CZ 4.01Å; V522-V536 CarbonylContact C-O 3.53Å; V522-V536 WeakPolarHBondContact CA-O 3.14Å; V522-Q537 HydrophobicContact CB-CG 4.08Å; V522-Q537 HydrophobicContact CG2-CG 3.97Å
523	A	92.8	Very high	79.8	Confident	35 Å²	35	60.6 Å²	60.6	29%	0.289	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	137.7	169.5	0	0	0	0	0	109.1	P483 S535 V536	P483-A523 HydrophobicContact CG-CB 4.47Å; A523-S535 CarbonylContact O-C 3.57Å; A523-S535 WeakPolarHBondContact O-CA 3.39Å; A523-V536 PolarHBondContact N-O 2.82Å; A523-V536 PolarHBondContact O-N 3.24Å
524	F	94.6	Very high	82.1	Confident	25 Å²	25	55 Å²	55	11%	0.11	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	132.4	176.7	-66.5	-83.7	0	0	0	110.4	W476 V477 I491 I505 A507 V522 F526 I534	W476-F524 WeakPolarHBondContact O-CE2 3.23Å; V477-F524 HydrophobicContact CB-CD2 4.26Å; V477-F524 HydrophobicContact CB-CE2 4.11Å; V477-F524 HydrophobicContact CG2-CD2 3.88Å; V477-F524 HydrophobicContact CG2-CE2 4.21Å; V477-F524 HydrophobicContact CG2-CG 4.12Å; I491-F524 HydrophobicContact CD1-CE2 4.28Å; I491-F524 HydrophobicContact CD1-CZ 3.72Å; I505-F524 HydrophobicContact CG2-CE1 3.78Å; A507-F524 HydrophobicContact CB-CE1 4.1Å; A507-F524 HydrophobicContact CB-CZ 3.78Å; V522-F524 HydrophobicContact CB-CE2 4.41Å; V522-F524 HydrophobicContact CG1-CD2 4.31Å; V522-F524 HydrophobicContact CG1-CE2 3.45Å; V522-F524 VanDerWaalsContact CG1-CE2 3.45Å; V522-F524 HydrophobicContact CG1-CZ 3.75Å; V522-F524 HydrophobicContact CG2-CE1 4.31Å; V522-F524 HydrophobicContact CG2-CE2 4.15Å; V522-F524 HydrophobicContact CG2-CZ 4.01Å; F524-F526 HydrophobicContact CB-CD2 4.07Å; F524-F526 HydrophobicContact CB-CE2 3.73Å; F524-F526 HydrophobicContact CD1-CE2 4.3Å; F524-F526 HydrophobicContact CG-CE2 4.21Å; F524-I534 WeakPolarHBondContact CA-O 3.44Å
525	T	95.2	Very high	84.1	Confident	17 Å²	17	52.5 Å²	52.5	10%	0.104	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	100	173.7	-55	0	0	0	0	108	R66 F68 F75 A533 I534	R66-T525 PolarHBondContact O-OG1 3.24Å; F68-T525 HydrophobicContact CD2-CG2 3.77Å; F68-T525 HydrophobicContact CE2-CG2 4.09Å; F75-T525 HydrophobicContact CE2-CG2 4.05Å; T525-A533 WeakPolarHBondContact O-CA 3.43Å; T525-I534 PolarHBondContact N-O 3.06Å; T525-I534 PolarHBondContact O-N 3.41Å
526	F	94.8	Very high	86.1	Confident	9 Å²	9	46.9 Å²	46.9	4%	0.039	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	141.2	176.2	-75.2	-103	0	0	0	110.2	S462 Y464 L465 V477 I505 F524 A533	S462-F526 VanDerWaalsContact CB-CB 3.45Å; S462-F526 WeakPolarHBondContact OG-CB 3.4Å; Y464-F526 HydrophobicContact CD2-CD1 4.37Å; Y464-F526 HydrophobicContact CG-CD1 4.5Å; L465-F526 HydrophobicContact CD1-CD2 3.67Å; L465-F526 HydrophobicContact CD1-CE2 3.93Å; L465-F526 HydrophobicContact CD1-CG 4.18Å; L465-F526 HydrophobicContact CD2-CD2 4.27Å; L465-F526 HydrophobicContact CD2-CE1 4.35Å; L465-F526 HydrophobicContact CD2-CE2 3.75Å; L465-F526 HydrophobicContact CD2-CZ 3.79Å; L465-F526 HydrophobicContact CG-CD2 4.06Å; L465-F526 HydrophobicContact CG-CE2 4.05Å; L465-F526 HydrophobicContact CG-CG 4.29Å; L465-F526 HydrophobicContact CG-CZ 4.29Å; V477-F526 HydrophobicContact CG2-CE2 3.9Å; V477-F526 HydrophobicContact CG2-CZ 4.24Å; I505-F526 HydrophobicContact CD1-CE1 3.7Å; I505-F526 HydrophobicContact CD1-CZ 3.44Å; I505-F526 VanDerWaalsContact CD1-CZ 3.44Å; F524-F526 HydrophobicContact CB-CD2 4.07Å; F524-F526 HydrophobicContact CB-CE2 3.73Å; F524-F526 HydrophobicContact CD1-CE2 4.3Å; F524-F526 HydrophobicContact CG-CE2 4.21Å; F526-A533 HydrophobicContact CB-CB 4.46Å; F526-A533 HydrophobicContact CD1-CB 3.53Å; F526-A533 HydrophobicContact CD2-CB 4.3Å; F526-A533 HydrophobicContact CE1-CB 3.73Å; F526-A533 HydrophobicContact CE2-CB 4.46Å; F526-A533 HydrophobicContact CG-CB 3.85Å; F526-A533 HydrophobicContact CZ-CB 4.2Å
527	H	94.7	Very high	87.7	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.028	20%	0.201	C	C	.	.			trans	-66	140.4	169.9	-174.9	-77.8	0	0	0	109.6	F68 G72 Y90 S462 F529 E530 F532	F68-H527 AromaticContact CD1-CD2 3.77Å; F68-H527 HydrophobicContact CD2-CB 4.36Å; F68-H527 AromaticContact CE1-CD2 3.65Å; F68-H527 HydrophobicContact CE2-CB 4.11Å; F68-H527 HydrophobicContact CZ-CB 4.31Å; G72-H527 WeakPolarHBondContact CA-NE2 3.36Å; G72-H527 PolarHBondContact O-NE2 2.78Å; Y90-H527 AromaticContact CD1-CD2 3.6Å; Y90-H527 AromaticContact CD1-NE2 3.48Å; Y90-H527 WeakPolarHBondContact CD1-NE2 3.22Å; Y90-H527 AromaticContact CE1-CD2 3.52Å; Y90-H527 AromaticContact CE1-NE2 3.62Å; S462-H527 WeakPolarHBondContact CB-O 3.4Å; S462-H527 PolarHBondContact OG-O 2.71Å; H527-F529 VanDerWaalsContact C-N 3.26Å; H527-F529 PolarHBondContact ND1-N 3.36Å; H527-F529 PolarHBondContact O-N 3.42Å; H527-E530 PolarHBondContact CE1-N 2.8Å; H527-E530 PolarHBondContact ND1-N 3.48Å; H527-F532 HydrophobicContact CB-CB 4.11Å; H527-F532 WeakPolarHBondContact CB-O 3.46Å; H527-F532 PolarHBondContact N-O 3.06Å
528	P	90.6	Very high	88.9	Confident	7 Å²	7	41.5 Å²	41.5	5%	0.045	19%	0.191	C	C	.	.	S	Bend	trans	-60.1	-29.7	-176.8	-27.2	35.4	0	0	0	114.9	F68 P463	F68-P528 HydrophobicContact CB-CG 4.27Å; P463-P528 WeakPolarHBondContact CD-O 3.37Å
529	F	88.1	Confident	89.2	Confident	67 Å²	67	39.3 Å²	39.3	29%	0.294	18%	0.178	S	C	.	.	S	Bend	trans	-128.6	-54.7	-174.9	-48.8	-64.9	0	0	0	114.5	H46 D71 A409 H527	H46-F529 PolarHBondContact CD2-O 3.17Å; H46-F529 PolarHBondContact NE2-O 3.25Å; D71-F529 WeakPolarHBondContact O-CE2 3.21Å; A409-F529 HydrophobicContact CB-CE1 3.61Å; A409-F529 HydrophobicContact CB-CZ 3.7Å; H527-F529 VanDerWaalsContact C-N 3.26Å; H527-F529 PolarHBondContact ND1-N 3.36Å; H527-F529 PolarHBondContact O-N 3.42Å
530	E	92.6	Very high	88.9	Confident	67 Å²	67	37.1 Å²	37.1	31%	0.313	18%	0.182	S	C	.	.	S	Bend	trans	-71.1	153.7	-176.5	-62.2	-153.4	175.3	0	0	115.6	Y90 G92 C93 Y464 H527 F532	Y90-E530 HydrophobicContact CE1-CB 4.4Å; Y90-E530 HydrophobicContact CE1-CG 4.49Å; Y90-E530 WeakPolarHBondContact CE1-OE2 3.43Å; G92-E530 WeakPolarHBondContact CA-OE2 3.4Å; C93-E530 HydrophobicContact CB-CB 4.37Å; C93-E530 WeakPolarHBondContact CB-OE2 3.27Å; C93-E530 PolarHBondContact N-OE2 2.92Å; C93-E530 PolarHBondContact SG-OE2 3.14Å; Y464-E530 VanDerWaalsContact CE2-O 3.26Å; Y464-E530 WeakPolarHBondContact CE2-O 3.2Å; H527-E530 PolarHBondContact CE1-N 2.8Å; H527-E530 PolarHBondContact ND1-N 3.48Å; E530-F532 PolarHBondContact O-N 3.3Å
531	P	94.4	Very high	88.2	Confident	12 Å²	12	38.6 Å²	38.6	8%	0.078	21%	0.209	C	C	.	.	S	Bend	trans	-71.5	63	178.3	32.1	-37.7	0	0	0	112.6	C93 Y464 M549 R550	C93-P531 HydrophobicContact CB-CG 4.15Å; Y464-P531 WeakPolarHBondContact OH-CA 3.48Å; Y464-P531 VanDerWaalsContact OH-CB 3.25Å; Y464-P531 WeakPolarHBondContact OH-CB 3.19Å; P531-M549 WeakPolarHBondContact O-CA 3.37Å; P531-R550 HydrophobicContact CB-CB 4.1Å; P531-R550 HydrophobicContact CG-CB 3.81Å; P531-R550 PolarHBondContact O-N 3.33Å
532	F	96.1	Very high	87.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	136.1	-178.4	-172.8	-94.6	0	0	0	110.8	F68 Y90 F127 F128 H527 E530 I534 F547 H548 M549	F68-F532 HydrophobicContact CE2-CD1 4.31Å; F68-F532 AromaticContact CZ-CD1 3.83Å; F68-F532 HydrophobicContact CZ-CD1 3.83Å; F68-F532 AromaticContact CZ-CE1 3.92Å; F68-F532 HydrophobicContact CZ-CE1 3.92Å; Y90-F532 HydrophobicContact CE2-CD1 4.01Å; Y90-F532 HydrophobicContact CE2-CD2 4.47Å; Y90-F532 HydrophobicContact CE2-CE1 4.19Å; Y90-F532 HydrophobicContact CE2-CG 4.17Å; Y90-F532 HydrophobicContact CE2-CZ 4.49Å; Y90-F532 WeakPolarHBondContact OH-CB 3.5Å; Y90-F532 VanDerWaalsContact OH-CG 3.23Å; Y90-F532 WeakPolarHBondContact OH-CG 3.17Å; F127-F532 HydrophobicContact CD1-CD2 4.29Å; F127-F532 AromaticContact CD1-CE2 3.89Å; F127-F532 HydrophobicContact CD1-CE2 3.89Å; F127-F532 HydrophobicContact CD1-CZ 4.48Å; F127-F532 HydrophobicContact CD2-CE2 4.09Å; F127-F532 HydrophobicContact CE1-CD2 4.14Å; F127-F532 AromaticContact CE1-CE2 3.97Å; F127-F532 HydrophobicContact CE1-CE2 3.97Å; F127-F532 HydrophobicContact CE2-CE2 4.18Å; F127-F532 AromaticContact CG-CE2 3.95Å; F127-F532 HydrophobicContact CG-CE2 3.95Å; F127-F532 HydrophobicContact CG-CZ 4.26Å; F127-F532 HydrophobicContact CZ-CD2 4.49Å; F127-F532 HydrophobicContact CZ-CE2 4.12Å; F128-F532 HydrophobicContact CE2-CE1 4.28Å; F128-F532 HydrophobicContact CE2-CZ 4.12Å; F128-F532 AromaticContact CZ-CE1 3.82Å; F128-F532 HydrophobicContact CZ-CE1 3.82Å; F128-F532 HydrophobicContact CZ-CZ 4.11Å; H527-F532 HydrophobicContact CB-CB 4.11Å; H527-F532 WeakPolarHBondContact CB-O 3.46Å; H527-F532 PolarHBondContact N-O 3.06Å; E530-F532 PolarHBondContact O-N 3.3Å; F532-I534 HydrophobicContact CD1-CG1 4.45Å; F532-I534 HydrophobicContact CE1-CD1 3.96Å; F532-I534 HydrophobicContact CE1-CG1 3.54Å; F532-I534 HydrophobicContact CZ-CG1 4.06Å; F532-F547 HydrophobicContact CE2-CB 4.19Å; F532-F547 HydrophobicContact CE2-CD2 4.04Å; F532-F547 HydrophobicContact CE2-CG 4.17Å; F532-F547 HydrophobicContact CZ-CB 4.3Å; F532-F547 HydrophobicContact CZ-CD1 4.18Å; F532-F547 AromaticContact CZ-CD2 3.82Å; F532-F547 HydrophobicContact CZ-CD2 3.82Å; F532-F547 HydrophobicContact CZ-CE1 4.46Å; F532-F547 HydrophobicContact CZ-CE2 4.13Å; F532-F547 AromaticContact CZ-CG 3.86Å; F532-F547 HydrophobicContact CZ-CG 3.86Å; F532-F547 HydrophobicContact CZ-CZ 4.44Å; F532-H548 CarbonylContact C-O 3.47Å; F532-H548 VanDerWaalsContact CA-O 3.29Å; F532-H548 WeakPolarHBondContact CA-O 3.33Å; F532-M549 HydrophobicContact CD2-CB 3.94Å; F532-M549 HydrophobicContact CE2-CB 4.37Å; F532-M549 HydrophobicContact CE2-CE 4.3Å
533	A	96.4	Very high	87.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	149.3	173.4	0	0	0	0	0	110.7	T525 F526 H548	T525-A533 WeakPolarHBondContact O-CA 3.43Å; F526-A533 HydrophobicContact CB-CB 4.46Å; F526-A533 HydrophobicContact CD1-CB 3.53Å; F526-A533 HydrophobicContact CD2-CB 4.3Å; F526-A533 HydrophobicContact CE1-CB 3.73Å; F526-A533 HydrophobicContact CE2-CB 4.46Å; F526-A533 HydrophobicContact CG-CB 3.85Å; F526-A533 HydrophobicContact CZ-CB 4.2Å; A533-H548 HydrophobicContact CB-CB 4.27Å; A533-H548 PolarHBondContact N-O 3.13Å; A533-H548 PolarHBondContact O-CD2 3.5Å; A533-H548 PolarHBondContact O-N 2.8Å
534	I	95.9	Very high	87.2	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.5	174.1	-55.6	170.1	0	0	0	107.5	L65 F68 F75 F128 F524 T525 F532 V536 V545 N546 F547	L65-I534 HydrophobicContact CD1-CG2 4.17Å; F68-I534 HydrophobicContact CE2-CD1 4.43Å; F68-I534 HydrophobicContact CZ-CD1 4.45Å; F75-I534 HydrophobicContact CD2-CD1 4.5Å; F75-I534 HydrophobicContact CE2-CD1 3.74Å; F75-I534 HydrophobicContact CZ-CD1 3.76Å; F128-I534 HydrophobicContact CE2-CD1 4.21Å; F128-I534 HydrophobicContact CZ-CD1 3.91Å; F524-I534 WeakPolarHBondContact CA-O 3.44Å; T525-I534 PolarHBondContact N-O 3.06Å; T525-I534 PolarHBondContact O-N 3.41Å; F532-I534 HydrophobicContact CD1-CG1 4.45Å; F532-I534 HydrophobicContact CE1-CD1 3.96Å; F532-I534 HydrophobicContact CE1-CG1 3.54Å; F532-I534 HydrophobicContact CZ-CG1 4.06Å; I534-V536 HydrophobicContact CG2-CG2 3.86Å; I534-V545 HydrophobicContact CG2-CG1 3.7Å; I534-N546 WeakPolarHBondContact CA-O 3.07Å; I534-F547 HydrophobicContact CD1-CE1 4.19Å; I534-F547 HydrophobicContact CG1-CD1 3.99Å; I534-F547 HydrophobicContact CG1-CE1 3.95Å; I534-F547 HydrophobicContact CG2-CD1 4.2Å; I534-F547 HydrophobicContact CG2-CE1 4.14Å
535	S	94.7	Very high	87.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.7	164.7	80.8	0	0	0	0	109.4	A523 N546 H548	A523-S535 CarbonylContact O-C 3.57Å; A523-S535 WeakPolarHBondContact O-CA 3.39Å; S535-N546 PolarHBondContact N-O 3.14Å; S535-N546 PolarHBondContact O-N 3.29Å; S535-N546 WeakPolarHBondContact OG-CB 3.24Å; S535-N546 PolarHBondContact OG-ND2 3.4Å; S535-H548 VanDerWaalsContact CB-NE2 3.32Å; S535-H548 WeakPolarHBondContact CB-NE2 3.48Å; S535-H548 PolarHBondContact OG-NE2 3.2Å
536	V	93	Very high	87.1	Confident	13 Å²	13	38 Å²	38	8%	0.079	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.4	179.3	179.4	0	0	0	0	108.8	L65 V522 A523 I534 Y543 V544 V545	L65-V536 HydrophobicContact CB-CG2 4.47Å; L65-V536 HydrophobicContact CD1-CG2 4.43Å; V522-V536 CarbonylContact C-O 3.53Å; V522-V536 WeakPolarHBondContact CA-O 3.14Å; A523-V536 PolarHBondContact N-O 2.82Å; A523-V536 PolarHBondContact O-N 3.24Å; I534-V536 HydrophobicContact CG2-CG2 3.86Å; V536-Y543 HydrophobicContact CG1-CD1 4.34Å; V536-Y543 HydrophobicContact CG1-CD2 4.25Å; V536-Y543 HydrophobicContact CG1-CE1 3.67Å; V536-Y543 HydrophobicContact CG1-CE2 3.58Å; V536-Y543 WeakPolarHBondContact CG1-OH 2.83Å; V536-V544 WeakPolarHBondContact CA-O 3.5Å; V536-V545 HydrophobicContact CG2-CG2 4.48Å
537	Q	89.4	Confident	87.1	Confident	6 Å²	6	37.6 Å²	37.6	3%	0.028	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132	169.6	-62.9	-174.2	7.4	0	0	110	C486 A507 V522 Y543 V544	C486-Q537 PolarHBondContact SG-NE2 3.23Å; A507-Q537 PolarHBondContact O-NE2 2.88Å; V522-Q537 HydrophobicContact CB-CG 4.08Å; V522-Q537 HydrophobicContact CG2-CG 3.97Å; Q537-Y543 WeakPolarHBondContact O-CA 3.4Å; Q537-V544 HydrophobicContact CB-CB 4.31Å; Q537-V544 PolarHBondContact N-O 2.95Å; Q537-V544 PolarHBondContact O-N 2.88Å
538	R	77.4	Confident	87.1	Confident	158 Å²	158	37.4 Å²	37.4	60%	0.596	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	119.8	172.4	-170	177.1	175.6	-169.9	-2.4	109.2	Y543	R538-Y543 HydrophobicContact CG-CD2 4.43Å
539	T	68.4	Low	87.3	Confident	37 Å²	37	37.1 Å²	37.1	23%	0.227	19%	0.191	C	C	.	.			trans	-114.2	170.6	162.6	65.7	0	0	0	0	108.5	R520 A541 E542	R520-T539 HydrophobicContact CG-CG2 4.04Å; T539-A541 PolarHBondContact O-N 3.42Å; T539-E542 PolarHBondContact N-O 3.48Å; T539-E542 PolarHBondContact O-N 3.16Å; T539-E542 PolarHBondContact OG1-N 3.43Å; T539-E542 VanDerWaalsContact OG1-N 3.16Å; T539-E542 PolarHBondContact OG1-O 3.43Å
540	N	60	Low	87.4	Confident	171 Å²	171	37 Å²	37	91%	0.914	19%	0.189	S	C	*	.	S	Bend	trans	-59	-21.7	-178.2	-69.5	-9.1	0	0	0	113.5
541	A	64.6	Low	87.3	Confident	99 Å²	99	34 Å²	34	82%	0.818	18%	0.175	S	C	*	.	S	Bend	trans	-116.3	-19.8	-177.9	0	0	0	0	0	114.5	T539	T539-A541 PolarHBondContact O-N 3.42Å
542	E	74.4	Confident	86.8	Confident	74 Å²	74	37.6 Å²	37.6	35%	0.346	20%	0.196	S	C	.	.			trans	-131.3	134.2	-171.6	-60.6	179.8	164	0	0	111.8	R512 T539 V544	R512-E542 IonicContact CZ-OE1 3.95Å; R512-E542 IonicContact NH1-OE1 2.78Å; R512-E542 PolarHBondContact NH1-OE1 2.86Å; R512-E542 IonicContact NH1-OE2 3.95Å; R512-E542 PolarHBondContact NH1-OE2 3.19Å; R512-E542 IonicContact NH2-OE1 3.2Å; T539-E542 PolarHBondContact N-O 3.48Å; T539-E542 PolarHBondContact O-N 3.16Å; T539-E542 PolarHBondContact OG1-N 3.43Å; T539-E542 VanDerWaalsContact OG1-N 3.16Å; T539-E542 PolarHBondContact OG1-O 3.43Å; E542-V544 HydrophobicContact CB-CG2 4.08Å
543	Y	86.4	Confident	85.6	Confident	62 Å²	62	40.9 Å²	40.9	24%	0.243	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	93.4	168.9	-170.2	-81.5	0	0	0	108.2	K60 F64 L65 V536 Q537 R538 V545	K60-Y543 HydrophobicContact CD-CD1 4.38Å; K60-Y543 HydrophobicContact CD-CE1 4.02Å; F64-Y543 HydrophobicContact CD1-CD2 4.29Å; F64-Y543 AromaticContact CD1-CE2 3.8Å; F64-Y543 HydrophobicContact CD1-CE2 3.8Å; F64-Y543 HydrophobicContact CE1-CD2 4.42Å; F64-Y543 HydrophobicContact CE1-CE2 4.38Å; L65-Y543 PolarHBondContact N-OH 2.63Å; L65-Y543 VanDerWaalsContact N-OH 3.09Å; V536-Y543 HydrophobicContact CG1-CD1 4.34Å; V536-Y543 HydrophobicContact CG1-CD2 4.25Å; V536-Y543 HydrophobicContact CG1-CE1 3.67Å; V536-Y543 HydrophobicContact CG1-CE2 3.58Å; V536-Y543 WeakPolarHBondContact CG1-OH 2.83Å; Q537-Y543 WeakPolarHBondContact O-CA 3.4Å; R538-Y543 HydrophobicContact CG-CD2 4.43Å; Y543-V545 HydrophobicContact CD1-CG2 3.72Å; Y543-V545 HydrophobicContact CE1-CG2 3.44Å; Y543-V545 VanDerWaalsContact CE1-CG2 3.44Å
544	V	89.4	Confident	83.7	Confident	8 Å²	8	48.5 Å²	48.5	5%	0.048	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.2	-174.4	-176.9	0	0	0	0	109.2	N57 L509 V536 Q537 E542	N57-V544 HydrophobicContact CB-CG1 4.13Å; L509-V544 HydrophobicContact CD1-CG1 4.23Å; L509-V544 HydrophobicContact CD1-CG2 4.1Å; V536-V544 WeakPolarHBondContact CA-O 3.5Å; Q537-V544 HydrophobicContact CB-CB 4.31Å; Q537-V544 PolarHBondContact N-O 2.95Å; Q537-V544 PolarHBondContact O-N 2.88Å; E542-V544 HydrophobicContact CB-CG2 4.08Å
545	V	93.1	Very high	83	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.7	179.1	-177	0	0	0	0	109.1	N57 V58 K60 L65 I534 V536 Y543 F547	N57-V545 CarbonylContact C-O 3.45Å; N57-V545 VanDerWaalsContact CA-O 3.28Å; N57-V545 WeakPolarHBondContact CA-O 3.48Å; N57-V545 PolarHBondContact N-O 2.78Å; N57-V545 VanDerWaalsContact N-O 3.16Å; V58-V545 PolarHBondContact N-O 3.1Å; K60-V545 HydrophobicContact CD-CG2 3.96Å; K60-V545 HydrophobicContact CG-CG2 4.29Å; L65-V545 HydrophobicContact CD1-CG1 3.72Å; L65-V545 HydrophobicContact CD1-CG2 3.95Å; I534-V545 HydrophobicContact CG2-CG1 3.7Å; V536-V545 HydrophobicContact CG2-CG2 4.48Å; Y543-V545 HydrophobicContact CD1-CG2 3.72Å; Y543-V545 HydrophobicContact CE1-CG2 3.44Å; Y543-V545 VanDerWaalsContact CE1-CG2 3.44Å; V545-F547 HydrophobicContact CG1-CD1 3.96Å; V545-F547 HydrophobicContact CG1-CE1 3.62Å
546	N	93.9	Very high	82.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.3	171.4	-45.3	-46.3	0	0	0	109.4	T54 V55 V56 N57 A507 I534 S535	T54-N546 HydrophobicContact CG2-CB 4.38Å; V55-N546 VanDerWaalsContact O-CA 3.32Å; V55-N546 WeakPolarHBondContact O-CA 3.21Å; V56-N546 VanDerWaalsContact CA-OD1 3.31Å; V56-N546 WeakPolarHBondContact CA-OD1 3.48Å; V56-N546 WeakPolarHBondContact CG1-OD1 3.46Å; N57-N546 PolarHBondContact N-OD1 3.43Å; A507-N546 PolarHBondContact O-ND2 3.49Å; I534-N546 WeakPolarHBondContact CA-O 3.07Å; S535-N546 PolarHBondContact N-O 3.14Å; S535-N546 PolarHBondContact O-N 3.29Å; S535-N546 WeakPolarHBondContact OG-CB 3.24Å; S535-N546 PolarHBondContact OG-ND2 3.4Å
547	F	95.4	Very high	81.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	130.6	172	-71	-0	0	0	0	109.6	T54 V55 V58 L123 F124 F127 F128 F532 I534 V545 M549	T54-F547 WeakPolarHBondContact CA-O 3.39Å; V55-F547 PolarHBondContact N-O 2.89Å; V55-F547 PolarHBondContact O-N 3.26Å; V58-F547 HydrophobicContact CG1-CD2 4.21Å; V58-F547 HydrophobicContact CG1-CE1 4.46Å; V58-F547 HydrophobicContact CG1-CE2 4Å; V58-F547 HydrophobicContact CG1-CZ 4.12Å; V58-F547 HydrophobicContact CG2-CB 4.16Å; V58-F547 HydrophobicContact CG2-CD1 4.26Å; V58-F547 HydrophobicContact CG2-CD2 4.25Å; V58-F547 HydrophobicContact CG2-CG 3.95Å; L123-F547 HydrophobicContact CD2-CB 4.14Å; L123-F547 HydrophobicContact CD2-CD2 3.6Å; L123-F547 HydrophobicContact CD2-CE2 4.4Å; L123-F547 HydrophobicContact CD2-CG 4.19Å; L123-F547 HydrophobicContact CG-CD2 3.99Å; L123-F547 HydrophobicContact CG-CE2 4.47Å; F124-F547 AromaticContact CD2-CZ 3.75Å; F124-F547 HydrophobicContact CD2-CZ 3.75Å; F124-F547 HydrophobicContact CE2-CZ 4.41Å; F127-F547 HydrophobicContact CB-CE2 4.41Å; F127-F547 AromaticContact CD2-CD2 3.81Å; F127-F547 HydrophobicContact CD2-CD2 3.81Å; F127-F547 AromaticContact CD2-CE2 3.9Å; F127-F547 HydrophobicContact CD2-CE2 3.9Å; F127-F547 HydrophobicContact CE2-CD2 4.25Å; F127-F547 HydrophobicContact CG-CE2 4.49Å; F128-F547 HydrophobicContact CD2-CE2 4.38Å; F128-F547 HydrophobicContact CD2-CZ 4.08Å; F128-F547 HydrophobicContact CE2-CE1 4.35Å; F128-F547 AromaticContact CE2-CE2 3.97Å; F128-F547 HydrophobicContact CE2-CE2 3.97Å; F128-F547 AromaticContact CE2-CZ 3.59Å; F128-F547 HydrophobicContact CE2-CZ 3.59Å; F532-F547 HydrophobicContact CE2-CB 4.19Å; F532-F547 HydrophobicContact CE2-CD2 4.04Å; F532-F547 HydrophobicContact CE2-CG 4.17Å; F532-F547 HydrophobicContact CZ-CB 4.3Å; F532-F547 HydrophobicContact CZ-CD1 4.18Å; F532-F547 AromaticContact CZ-CD2 3.82Å; F532-F547 HydrophobicContact CZ-CD2 3.82Å; F532-F547 HydrophobicContact CZ-CE1 4.46Å; F532-F547 HydrophobicContact CZ-CE2 4.13Å; F532-F547 AromaticContact CZ-CG 3.86Å; F532-F547 HydrophobicContact CZ-CG 3.86Å; F532-F547 HydrophobicContact CZ-CZ 4.44Å; I534-F547 HydrophobicContact CD1-CE1 4.19Å; I534-F547 HydrophobicContact CG1-CD1 3.99Å; I534-F547 HydrophobicContact CG1-CE1 3.95Å; I534-F547 HydrophobicContact CG2-CD1 4.2Å; I534-F547 HydrophobicContact CG2-CE1 4.14Å; V545-F547 HydrophobicContact CG1-CD1 3.96Å; V545-F547 HydrophobicContact CG1-CE1 3.62Å; F547-M549 HydrophobicContact CB-CE 3.4Å; F547-M549 VanDerWaalsContact CB-CE 3.4Å; F547-M549 HydrophobicContact CD2-CE 4.08Å; F547-M549 HydrophobicContact CG-CE 4.27Å
548	H	95.1	Very high	81.4	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	115.7	173.7	-48	-68	0	0	0	107.4	P51 F53 T54 Q506 F532 A533 S535	P51-H548 HydrophobicContact CB-CB 4.19Å; F53-H548 WeakPolarHBondContact O-CA 3.44Å; T54-H548 VanDerWaalsContact CG2-CE1 3.49Å; T54-H548 WeakPolarHBondContact CG2-CE1 3.36Å; T54-H548 VanDerWaalsContact CG2-ND1 3.35Å; T54-H548 WeakPolarHBondContact CG2-ND1 3.4Å; T54-H548 PolarHBondContact OG1-ND1 2.96Å; Q506-H548 PolarHBondContact O-CE1 3.41Å; Q506-H548 VanDerWaalsContact O-CE1 3.28Å; F532-H548 CarbonylContact C-O 3.47Å; F532-H548 VanDerWaalsContact CA-O 3.29Å; F532-H548 WeakPolarHBondContact CA-O 3.33Å; A533-H548 HydrophobicContact CB-CB 4.27Å; A533-H548 PolarHBondContact N-O 3.13Å; A533-H548 PolarHBondContact O-CD2 3.5Å; A533-H548 PolarHBondContact O-N 2.8Å; S535-H548 VanDerWaalsContact CB-NE2 3.32Å; S535-H548 WeakPolarHBondContact CB-NE2 3.48Å; S535-H548 PolarHBondContact OG-NE2 3.2Å
549	M	94	Very high	81.6	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	168.8	-171.4	64.7	-169.2	71.7	0	0	111.1	P51 N52 F53 V55 L100 L123 F127 P531 F532 F547	P51-M549 CarbonylContact C-O 3.59Å; P51-M549 WeakPolarHBondContact CA-O 3.28Å; N52-M549 PolarHBondContact N-O 3.47Å; F53-M549 PolarHBondContact N-O 3.21Å; F53-M549 PolarHBondContact O-N 3.14Å; V55-M549 HydrophobicContact CG2-CE 4.37Å; L100-M549 HydrophobicContact CD1-SD 3.67Å; L123-M549 HydrophobicContact CD1-CE 4.25Å; L123-M549 HydrophobicContact CD2-CE 3.71Å; L123-M549 HydrophobicContact CG-CE 4.17Å; F127-M549 HydrophobicContact CD2-CE 4.38Å; F127-M549 HydrophobicContact CE2-CE 3.43Å; F127-M549 VanDerWaalsContact CE2-CE 3.43Å; F127-M549 HydrophobicContact CE2-SD 3.67Å; F127-M549 HydrophobicContact CZ-CB 4.46Å; F127-M549 HydrophobicContact CZ-CE 3.76Å; F127-M549 HydrophobicContact CZ-SD 3.47Å; F127-M549 WeakPolarHBondContact CZ-SD 2.94Å; P531-M549 WeakPolarHBondContact O-CA 3.37Å; F532-M549 HydrophobicContact CD2-CB 3.94Å; F532-M549 HydrophobicContact CE2-CB 4.37Å; F532-M549 HydrophobicContact CE2-CE 4.3Å; F547-M549 HydrophobicContact CB-CE 3.4Å; F547-M549 VanDerWaalsContact CB-CE 3.4Å; F547-M549 HydrophobicContact CD2-CE 4.08Å; F547-M549 HydrophobicContact CG-CE 4.27Å
550	R	91.8	Very high	82.5	Confident	66 Å²	66	53.5 Å²	53.5	25%	0.249	33%	0.332	C	S	.	.			trans	-84.2	125.2	170.3	-173.6	176.4	-177.6	85.9	-7.3	109.8	N48 N52 P531	N48-R550 PolarHBondContact O-NH1 3.38Å; N48-R550 VanDerWaalsContact O-NH1 3.14Å; N48-R550 PolarHBondContact O-NH2 3.45Å; N52-R550 VanDerWaalsContact OD1-CA 3.3Å; N52-R550 WeakPolarHBondContact OD1-CA 3.24Å; P531-R550 HydrophobicContact CB-CB 4.1Å; P531-R550 HydrophobicContact CG-CB 3.81Å; P531-R550 PolarHBondContact O-N 3.33Å
551	H	90.1	Very high	84.1	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.019	29%	0.291	C	S	.	.			trans	-124.5	135.6	169.9	179.3	56	0	0	0	109.4	N52 F53 Q97 L100 Q103	N52-H551 PolarHBondContact ND2-O 2.96Å; N52-H551 PolarHBondContact OD1-N 3.16Å; N52-H551 PolarHBondContact OD1-O 3.4Å; F53-H551 HydrophobicContact CB-CB 3.53Å; F53-H551 HydrophobicContact CD1-CB 4.26Å; F53-H551 HydrophobicContact CD2-CB 4.37Å; F53-H551 HydrophobicContact CG-CB 3.83Å; Q97-H551 PolarHBondContact NE2-ND1 3.48Å; Q97-H551 PolarHBondContact OE1-ND1 3.17Å; L100-H551 HydrophobicContact CD1-CB 4.43Å; L100-H551 PolarHBondContact O-CE1 3.4Å; L100-H551 PolarHBondContact O-NE2 3.47Å; Q103-H551 PolarHBondContact O-NE2 2.75Å
552	V	84.1	Confident	85.6	Confident	86 Å²	86	41 Å²	41	52%	0.521	25%	0.25	S	S	.	.			trans	-111.1	109.2	171.1	-177.2	0	0	0	0	106.8	Q97 A554	Q97-V552 PolarHBondContact NE2-O 3.17Å; V552-A554 PolarHBondContact O-N 3.25Å
553	S	69.3	Low	86.6	Confident	70 Å²	70	38.3 Å²	38.3	49%	0.49	24%	0.242	S	C	.	.			trans	-64.2	122.3	170.9	-52.4	0	0	0	0	107.5	Q103	Q103-S553 PolarHBondContact O-OG 2.85Å
554	A	56.5	Low	86.6	Confident	159 Å²	159	36.1 Å²	36.1	100%	1.314	24%	0.242	S	C	*	.			trans	-98.9	0	-179.1	0	0	0	0	0	110.2	V552	V552-A554 PolarHBondContact O-N 3.25Å

Retrieved 554 of 554 residues in 284.2 ms (Link to these results)

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