A0A090N7Y5_HUMAN Loading...

Testis tissue sperm-binding protein Li 61n

AlphaFold DB , UniProt , Accession A0A090N7Y5, Species HUMAN (Homo sapiens, Human), Gene GALNT15, Length 443 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54	Low	58	Low	215 Å²	215	129.9 Å²	129.9	100%	1.059	65%	0.65	S	S	*	*				0	-21.9	0	-72.4	-167.4	-78.5	0	0	115.1
2	R	54	Low	58.6	Low	210 Å²	210	122.2 Å²	122.2	79%	0.792	63%	0.627	S	S	*	*	H	α-helix	trans	-74.9	-29.3	-177.3	-134.7	171.4	81.7	-174.7	5.9	115.7
3	N	53.2	Low	59.3	Low	127 Å²	127	118.2 Å²	118.2	68%	0.679	62%	0.617	S	S	*	*	H	α-helix	trans	-79.4	-28.4	-179.2	-80.5	1.8	0	0	0	114.5	Q7	N3-Q7 PolarHBondContact O-N 2.86Å
4	A	56.4	Low	60	Low	72 Å²	72	117.5 Å²	117.5	60%	0.595	61%	0.613	S	S	*	*	H	α-helix	trans	-71.1	-32.5	179.5	0	0	0	0	0	112.4	G8	A4-G8 PolarHBondContact O-N 3.01Å
5	I	61.3	Low	60.9	Low	112 Å²	112	114.7 Å²	114.7	57%	0.574	60%	0.604	S	S	*	*	H	α-helix	trans	-73.1	-37.7	179.7	-61.6	173.7	0	0	0	110.8	G8 L9	I5-G8 PolarHBondContact O-N 3.45Å; I5-L9 HydrophobicContact CG2-CD1 4.14Å; I5-L9 WeakPolarHBondContact O-CG 3.41Å; I5-L9 PolarHBondContact O-N 3.21Å
6	I	60.8	Low	61.8	Low	90 Å²	90	117 Å²	117	46%	0.462	61%	0.607	S	S	.	*	H	α-helix	trans	-70.8	-39.4	178.8	-63	172.1	0	0	0	110.9	L9 F10	I6-L9 PolarHBondContact O-N 3.34Å; I6-F10 PolarHBondContact O-N 3.18Å; I6-F10 VanDerWaalsContact O-N 3.14Å
7	Q	56.5	Low	62.8	Low	123 Å²	123	112.1 Å²	112.1	58%	0.575	59%	0.592	S	S	*	*	H	α-helix	trans	-64.2	-43.1	172.7	-78.5	179.3	-32.5	0	0	111.5	N3 L9 F10 Y11	N3-Q7 PolarHBondContact O-N 2.86Å; Q7-L9 VanDerWaalsContact C-N 3.34Å; Q7-L9 PolarHBondContact O-N 3.33Å; Q7-F10 PolarHBondContact O-N 2.75Å; Q7-Y11 HydrophobicContact CB-CE2 4.45Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.34Å; Q7-Y11 PolarHBondContact O-N 3.21Å
8	G	58	Low	63.9	Low	46 Å²	46	110.9 Å²	110.9	47%	0.474	59%	0.585	S	S	.	*	H	α-helix	trans	-59.9	-39.3	176.2	0	0	0	0	0	114	A4 I5 G12	A4-G8 PolarHBondContact O-N 3.01Å; I5-G8 PolarHBondContact O-N 3.45Å; G8-G12 PolarHBondContact O-N 2.88Å
9	L	59.8	Low	64.6	Low	123 Å²	123	115.1 Å²	115.1	64%	0.644	59%	0.592	S	S	*	*	H	α-helix	trans	-69.2	-34.8	176.7	-76.2	164.2	0	0	0	112.8	I5 I6 Q7 S13	I5-L9 HydrophobicContact CG2-CD1 4.14Å; I5-L9 WeakPolarHBondContact O-CG 3.41Å; I5-L9 PolarHBondContact O-N 3.21Å; I6-L9 PolarHBondContact O-N 3.34Å; Q7-L9 VanDerWaalsContact C-N 3.34Å; Q7-L9 PolarHBondContact O-N 3.33Å; L9-S13 PolarHBondContact O-N 3.38Å; L9-S13 VanDerWaalsContact O-N 3.12Å
10	F	61.5	Low	65.3	Low	152 Å²	152	112.5 Å²	112.5	67%	0.667	58%	0.582	S	S	*	*	H	α-helix	trans	-71.8	-39.8	176.4	-115.2	-88.5	0	0	0	112.6	I6 Q7 S13 L14	I6-F10 PolarHBondContact O-N 3.18Å; I6-F10 VanDerWaalsContact O-N 3.14Å; Q7-F10 PolarHBondContact O-N 2.75Å; F10-S13 PolarHBondContact O-OG 3.01Å; F10-L14 WeakPolarHBondContact O-CB 3.41Å; F10-L14 PolarHBondContact O-N 3.31Å
11	Y	63.1	Low	66	Low	159 Å²	159	109.6 Å²	109.6	62%	0.624	57%	0.574	S	S	*	*	H	α-helix	trans	-70.6	-32.3	174.7	-74.6	-70.5	0	0	0	112.3	Q7 T15	Q7-Y11 HydrophobicContact CB-CE2 4.45Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.34Å; Q7-Y11 PolarHBondContact O-N 3.21Å; Y11-T15 WeakPolarHBondContact O-CB 3.38Å; Y11-T15 VanDerWaalsContact O-CG2 3.29Å; Y11-T15 WeakPolarHBondContact O-CG2 3.5Å; Y11-T15 PolarHBondContact O-N 2.03Å; Y11-T15 VanDerWaalsContact O-N 3.1Å; Y11-T15 PolarHBondContact O-OG1 3.48Å
12	G	64.9	Low	67.5	Low	37 Å²	37	103.8 Å²	103.8	38%	0.381	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-40	174.8	0	0	0	0	0	113.3	G8 T15 F16	G8-G12 PolarHBondContact O-N 2.88Å; G12-T15 PolarHBondContact O-OG1 3.21Å; G12-T15 VanDerWaalsContact O-OG1 3.13Å; G12-F16 WeakPolarHBondContact O-CB 3.41Å; G12-F16 PolarHBondContact O-N 2.99Å; G12-F16 VanDerWaalsContact O-N 3.15Å
13	S	67.5	Low	68.8	Low	71 Å²	71	98.7 Å²	98.7	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-73.1	-36.4	178.6	72.1	0	0	0	0	112.5	L9 F10 G17	L9-S13 PolarHBondContact O-N 3.38Å; L9-S13 VanDerWaalsContact O-N 3.12Å; F10-S13 PolarHBondContact O-OG 3.01Å; S13-G17 PolarHBondContact O-N 2.93Å
14	L	69.5	Low	70.1	Confident	108 Å²	108	100.2 Å²	100.2	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-69	-41.5	178.4	-160.1	79.8	0	0	0	111.9	F10 G17 I18	F10-L14 WeakPolarHBondContact O-CB 3.41Å; F10-L14 PolarHBondContact O-N 3.31Å; L14-G17 PolarHBondContact O-N 2.98Å; L14-I18 HydrophobicContact CG-CD1 4.34Å; L14-I18 VanDerWaalsContact O-CG1 3.29Å; L14-I18 WeakPolarHBondContact O-CG1 3.49Å; L14-I18 PolarHBondContact O-N 3.07Å; L14-I18 VanDerWaalsContact O-N 3.08Å
15	T	72.8	Confident	71.4	Confident	76 Å²	76	102.2 Å²	102.2	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-67.9	-39.3	176.9	51.3	0	0	0	0	111.5	Y11 G12 I18 W19	Y11-T15 WeakPolarHBondContact O-CB 3.38Å; Y11-T15 VanDerWaalsContact O-CG2 3.29Å; Y11-T15 WeakPolarHBondContact O-CG2 3.5Å; Y11-T15 PolarHBondContact O-N 2.03Å; Y11-T15 VanDerWaalsContact O-N 3.1Å; Y11-T15 PolarHBondContact O-OG1 3.48Å; G12-T15 PolarHBondContact O-OG1 3.21Å; G12-T15 VanDerWaalsContact O-OG1 3.13Å; T15-I18 PolarHBondContact O-N 3.36Å; T15-W19 VanDerWaalsContact O-CD1 3.26Å; T15-W19 PolarHBondContact O-N 2.85Å; T15-W19 VanDerWaalsContact O-N 3.07Å
16	F	76.2	Confident	72.5	Confident	151 Å²	151	104 Å²	104	66%	0.662	54%	0.536	S	S	*	.	H	α-helix	trans	-62.6	-43.1	173.7	-171.2	-98.1	0	0	0	112.5	G12 I18 W19 T20	G12-F16 WeakPolarHBondContact O-CB 3.41Å; G12-F16 PolarHBondContact O-N 2.99Å; G12-F16 VanDerWaalsContact O-N 3.15Å; F16-I18 PolarHBondContact O-N 3.2Å; F16-W19 PolarHBondContact O-N 3.34Å; F16-T20 HydrophobicContact CD1-CG2 4.15Å; F16-T20 HydrophobicContact CE1-CG2 3.81Å; F16-T20 HydrophobicContact CE2-CG2 4.48Å; F16-T20 HydrophobicContact CZ-CG2 3.99Å; F16-T20 WeakPolarHBondContact O-CG2 3.22Å; F16-T20 PolarHBondContact O-N 3.18Å; F16-T20 PolarHBondContact O-OG1 3.32Å
17	G	77.6	Confident	73.2	Confident	34 Å²	34	104.5 Å²	104.5	35%	0.351	54%	0.539	S	S	.	.	H	α-helix	trans	-60.4	-42.8	175.5	0	0	0	0	0	113.3	S13 L14 T20 A21	S13-G17 PolarHBondContact O-N 2.93Å; L14-G17 PolarHBondContact O-N 2.98Å; G17-T20 PolarHBondContact O-OG1 3.04Å; G17-A21 PolarHBondContact O-N 3.29Å; G17-A21 VanDerWaalsContact O-N 3.13Å
18	I	83.1	Confident	74.1	Confident	91 Å²	91	104.4 Å²	104.4	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-43.3	179.1	-66.5	165.2	0	0	0	111.2	L14 T15 F16 A21 L22	L14-I18 HydrophobicContact CG-CD1 4.34Å; L14-I18 VanDerWaalsContact O-CG1 3.29Å; L14-I18 WeakPolarHBondContact O-CG1 3.49Å; L14-I18 PolarHBondContact O-N 3.07Å; L14-I18 VanDerWaalsContact O-N 3.08Å; T15-I18 PolarHBondContact O-N 3.36Å; F16-I18 PolarHBondContact O-N 3.2Å; I18-A21 PolarHBondContact O-N 3.24Å; I18-L22 HydrophobicContact CG2-CD1 4Å; I18-L22 WeakPolarHBondContact O-CG 3.41Å; I18-L22 PolarHBondContact O-N 2.87Å
19	W	76.9	Confident	74.8	Confident	190 Å²	190	108.6 Å²	108.6	72%	0.72	55%	0.545	S	S	*	.	H	α-helix	trans	-67.5	-37.7	179.3	-85.7	100	0	0	0	113.1	T15 F16 L22 L23	T15-W19 VanDerWaalsContact O-CD1 3.26Å; T15-W19 PolarHBondContact O-N 2.85Å; T15-W19 VanDerWaalsContact O-N 3.07Å; F16-W19 PolarHBondContact O-N 3.34Å; W19-L22 PolarHBondContact O-N 2.69Å; W19-L23 WeakPolarHBondContact O-CB 3.11Å; W19-L23 PolarHBondContact O-N 3.06Å
20	T	78.5	Confident	75	Confident	63 Å²	63	105.8 Å²	105.8	39%	0.387	53%	0.531	S	S	.	.	H	α-helix	trans	-66.2	-39.2	174.9	51.9	0	0	0	0	112.4	F16 G17 L23 F24	F16-T20 HydrophobicContact CD1-CG2 4.15Å; F16-T20 HydrophobicContact CE1-CG2 3.81Å; F16-T20 HydrophobicContact CE2-CG2 4.48Å; F16-T20 HydrophobicContact CZ-CG2 3.99Å; F16-T20 WeakPolarHBondContact O-CG2 3.22Å; F16-T20 PolarHBondContact O-N 3.18Å; F16-T20 PolarHBondContact O-OG1 3.32Å; G17-T20 PolarHBondContact O-OG1 3.04Å; T20-L23 PolarHBondContact O-N 2.9Å; T20-F24 PolarHBondContact O-N 2.81Å
21	A	81.3	Confident	75.1	Confident	51 Å²	51	104 Å²	104	42%	0.421	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-43.4	175	0	0	0	0	0	112.4	G17 I18 L23 F24 I25	G17-A21 PolarHBondContact O-N 3.29Å; G17-A21 VanDerWaalsContact O-N 3.13Å; I18-A21 PolarHBondContact O-N 3.24Å; A21-L23 VanDerWaalsContact C-N 3.34Å; A21-L23 PolarHBondContact O-N 2.82Å; A21-F24 PolarHBondContact O-N 3.42Å; A21-I25 WeakPolarHBondContact O-CG1 3.27Å; A21-I25 PolarHBondContact O-N 3.29Å
22	L	84	Confident	74.9	Confident	93 Å²	93	99.5 Å²	99.5	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-38	175.9	-72.1	172.3	0	0	0	112.2	I18 W19 I25 Y26	I18-L22 HydrophobicContact CG2-CD1 4Å; I18-L22 WeakPolarHBondContact O-CG 3.41Å; I18-L22 PolarHBondContact O-N 2.87Å; W19-L22 PolarHBondContact O-N 2.69Å; L22-I25 PolarHBondContact O-N 2.99Å; L22-Y26 WeakPolarHBondContact O-CB 3.48Å; L22-Y26 PolarHBondContact O-N 2.88Å
23	L	82.3	Confident	74.2	Confident	104 Å²	104	100 Å²	100	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-41.4	174	-167	80.2	0	0	0	111.3	W19 T20 A21 Y26 L27	W19-L23 WeakPolarHBondContact O-CB 3.11Å; W19-L23 PolarHBondContact O-N 3.06Å; T20-L23 PolarHBondContact O-N 2.9Å; A21-L23 VanDerWaalsContact C-N 3.34Å; A21-L23 PolarHBondContact O-N 2.82Å; L23-Y26 PolarHBondContact O-N 3.17Å; L23-L27 HydrophobicContact CD2-CD1 4.48Å; L23-L27 HydrophobicContact CG-CD1 4.22Å; L23-L27 WeakPolarHBondContact O-CB 3.49Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.49Å; L23-L27 PolarHBondContact O-N 2.98Å
24	F	80.7	Confident	73.1	Confident	159 Å²	159	99.6 Å²	99.6	70%	0.697	51%	0.508	S	S	*	.	H	α-helix	trans	-64.6	-42.1	177.2	-128.5	-88.1	0	0	0	112	T20 A21 L27 H28	T20-F24 PolarHBondContact O-N 2.81Å; A21-F24 PolarHBondContact O-N 3.42Å; F24-L27 PolarHBondContact O-N 3.46Å; F24-H28 VanDerWaalsContact O-CB 3.28Å; F24-H28 WeakPolarHBondContact O-CB 3.47Å; F24-H28 PolarHBondContact O-N 3.46Å
25	I	82.6	Confident	71.8	Confident	114 Å²	114	102.6 Å²	102.6	59%	0.585	51%	0.512	S	S	*	.	H	α-helix	trans	-63.8	-43.2	175.3	-67.4	166.2	0	0	0	110.5	A21 L22 H28 H29	A21-I25 WeakPolarHBondContact O-CG1 3.27Å; A21-I25 PolarHBondContact O-N 3.29Å; L22-I25 PolarHBondContact O-N 2.99Å; I25-H28 PolarHBondContact O-N 2.79Å; I25-H29 VanDerWaalsContact O-CB 3.29Å; I25-H29 WeakPolarHBondContact O-CB 3.37Å; I25-H29 PolarHBondContact O-N 3.44Å
26	Y	84.1	Confident	70.3	Confident	149 Å²	149	105.4 Å²	105.4	58%	0.584	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-45.7	177.7	-179.9	-100.5	0	0	0	112.5	L22 L23 H29 N30	L22-Y26 WeakPolarHBondContact O-CB 3.48Å; L22-Y26 PolarHBondContact O-N 2.88Å; L23-Y26 PolarHBondContact O-N 3.17Å; Y26-H29 PolarHBondContact O-N 3.27Å; Y26-N30 WeakPolarHBondContact CE1-ND2 3.49Å; Y26-N30 WeakPolarHBondContact O-CB 3.48Å; Y26-N30 PolarHBondContact O-N 3.14Å; Y26-N30 PolarHBondContact OH-ND2 3.37Å
27	L	76.2	Confident	68.6	Low	101 Å²	101	107 Å²	107	53%	0.529	53%	0.527	S	S	.	.	H	α-helix	trans	-65	-41	177.1	-71.5	172.2	0	0	0	111.7	L23 F24 N30 H31	L23-L27 HydrophobicContact CD2-CD1 4.48Å; L23-L27 HydrophobicContact CG-CD1 4.22Å; L23-L27 WeakPolarHBondContact O-CB 3.49Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.49Å; L23-L27 PolarHBondContact O-N 2.98Å; F24-L27 PolarHBondContact O-N 3.46Å; L27-N30 PolarHBondContact O-N 2.9Å; L27-H31 WeakPolarHBondContact O-CB 3.36Å; L27-H31 PolarHBondContact O-N 3.39Å
28	H	74.8	Confident	66.7	Low	120 Å²	120	114.4 Å²	114.4	56%	0.556	55%	0.549	S	S	*	.	H	α-helix	trans	-68.3	-38.3	177.6	-161.7	-38.7	0	0	0	111.9	F24 I25 H31 V32	F24-H28 VanDerWaalsContact O-CB 3.28Å; F24-H28 WeakPolarHBondContact O-CB 3.47Å; F24-H28 PolarHBondContact O-N 3.46Å; I25-H28 PolarHBondContact O-N 2.79Å; H28-H31 PolarHBondContact O-N 2.96Å; H28-V32 WeakPolarHBondContact ND1-CG2 3.43Å; H28-V32 VanDerWaalsContact O-CG2 3.3Å; H28-V32 WeakPolarHBondContact O-CG2 3.21Å; H28-V32 PolarHBondContact O-N 3.42Å
29	H	73.8	Confident	64.5	Low	134 Å²	134	114.5 Å²	114.5	62%	0.62	56%	0.558	S	S	*	*	H	α-helix	trans	-66.4	-41.2	176.6	-167.7	69.8	0	0	0	111.9	I25 Y26 V32 S33	I25-H29 VanDerWaalsContact O-CB 3.29Å; I25-H29 WeakPolarHBondContact O-CB 3.37Å; I25-H29 PolarHBondContact O-N 3.44Å; Y26-H29 PolarHBondContact O-N 3.27Å; H29-V32 PolarHBondContact O-N 3.34Å; H29-S33 WeakPolarHBondContact O-CB 3.46Å; H29-S33 PolarHBondContact O-N 3.23Å; H29-S33 PolarHBondContact O-OG 3.35Å
30	N	64.1	Low	62.3	Low	65 Å²	65	113.5 Å²	113.5	35%	0.348	56%	0.561	S	S	.	*	H	α-helix	trans	-68.7	-35.2	174.9	-81.9	-25.5	0	0	0	113.3	Y26 L27 S33 S34	Y26-N30 WeakPolarHBondContact CE1-ND2 3.49Å; Y26-N30 WeakPolarHBondContact O-CB 3.48Å; Y26-N30 PolarHBondContact O-N 3.14Å; Y26-N30 PolarHBondContact OH-ND2 3.37Å; L27-N30 PolarHBondContact O-N 2.9Å; N30-S33 WeakPolarHBondContact CA-OG 3.5Å; N30-S33 PolarHBondContact O-OG 2.82Å; N30-S33 VanDerWaalsContact O-OG 3.11Å; N30-S34 WeakPolarHBondContact O-CB 3.15Å; N30-S34 PolarHBondContact O-N 3.35Å; N30-S34 VanDerWaalsContact O-N 3.1Å
31	H	64.1	Low	60	Low	113 Å²	113	118.9 Å²	118.9	52%	0.523	58%	0.582	S	S	.	*	H	α-helix	trans	-65.2	-47.2	174.3	-168.6	-97.8	0	0	0	110.6	L27 H28 S33 S34 W35	L27-H31 WeakPolarHBondContact O-CB 3.36Å; L27-H31 PolarHBondContact O-N 3.39Å; H28-H31 PolarHBondContact O-N 2.96Å; H31-S33 PolarHBondContact O-N 2.82Å; H31-S34 PolarHBondContact O-N 2.93Å; H31-S34 PolarHBondContact O-OG 2.75Å; H31-W35 AromaticContact CE1-CD1 3.62Å; H31-W35 AromaticContact CE1-NE1 3.14Å; H31-W35 PolarHBondContact CE1-NE1 3.27Å; H31-W35 AromaticContact ND1-CD1 3.82Å; H31-W35 AromaticContact ND1-NE1 3.81Å; H31-W35 AromaticContact NE2-NE1 3.44Å; H31-W35 PolarHBondContact NE2-NE1 3.22Å; H31-W35 VanDerWaalsContact O-CD1 3.25Å; H31-W35 PolarHBondContact O-N 3.27Å
32	V	58.5	Low	57.3	Low	65 Å²	65	121.9 Å²	121.9	39%	0.394	60%	0.597	S	S	.	*	H	α-helix	trans	-65.3	-39	179.4	173.8	0	0	0	0	112.3	H28 H29 S34 W35 Q36	H28-V32 WeakPolarHBondContact ND1-CG2 3.43Å; H28-V32 VanDerWaalsContact O-CG2 3.3Å; H28-V32 WeakPolarHBondContact O-CG2 3.21Å; H28-V32 PolarHBondContact O-N 3.42Å; H29-V32 PolarHBondContact O-N 3.34Å; V32-S34 PolarHBondContact O-N 3.28Å; V32-W35 PolarHBondContact O-N 2.88Å; V32-Q36 PolarHBondContact O-N 3.09Å; V32-Q36 VanDerWaalsContact O-N 3.15Å
33	S	49.4	Very low	54.7	Low	49 Å²	49	126.1 Å²	126.1	34%	0.343	62%	0.619	S	S	.	*	H	α-helix	trans	-68.4	-32.7	177.5	70.3	0	0	0	0	112.8	H29 N30 H31 W35 K37	H29-S33 WeakPolarHBondContact O-CB 3.46Å; H29-S33 PolarHBondContact O-N 3.23Å; H29-S33 PolarHBondContact O-OG 3.35Å; N30-S33 WeakPolarHBondContact CA-OG 3.5Å; N30-S33 PolarHBondContact O-OG 2.82Å; N30-S33 VanDerWaalsContact O-OG 3.11Å; H31-S33 PolarHBondContact O-N 2.82Å; S33-W35 VanDerWaalsContact C-N 3.32Å; S33-W35 PolarHBondContact O-N 2.84Å; S33-K37 PolarHBondContact O-N 3.21Å
34	S	45.6	Very low	52.1	Low	61 Å²	61	126.1 Å²	126.1	43%	0.427	63%	0.628	S	S	.	*	H	α-helix	trans	-66.7	-32.8	173.5	79.7	0	0	0	0	112.9	N30 H31 V32 K38	N30-S34 WeakPolarHBondContact O-CB 3.15Å; N30-S34 PolarHBondContact O-N 3.35Å; N30-S34 VanDerWaalsContact O-N 3.1Å; H31-S34 PolarHBondContact O-N 2.93Å; H31-S34 PolarHBondContact O-OG 2.75Å; V32-S34 PolarHBondContact O-N 3.28Å; S34-K38 PolarHBondContact O-N 3.24Å
35	W	40.5	Very low	49.5	Very low	172 Å²	172	122.7 Å²	122.7	65%	0.652	63%	0.629	S	S	*	*	H	α-helix	trans	-73.3	-40	177.2	-87.1	76	0	0	0	112.2	H31 V32 S33 K37 K38 S39	H31-W35 AromaticContact CE1-CD1 3.62Å; H31-W35 AromaticContact CE1-NE1 3.14Å; H31-W35 PolarHBondContact CE1-NE1 3.27Å; H31-W35 AromaticContact ND1-CD1 3.82Å; H31-W35 AromaticContact ND1-NE1 3.81Å; H31-W35 AromaticContact NE2-NE1 3.44Å; H31-W35 PolarHBondContact NE2-NE1 3.22Å; H31-W35 VanDerWaalsContact O-CD1 3.25Å; H31-W35 PolarHBondContact O-N 3.27Å; V32-W35 PolarHBondContact O-N 2.88Å; S33-W35 VanDerWaalsContact C-N 3.32Å; S33-W35 PolarHBondContact O-N 2.84Å; W35-K37 VanDerWaalsContact C-N 3.35Å; W35-K37 PolarHBondContact O-N 3.5Å; W35-K38 PolarHBondContact O-N 3.44Å; W35-S39 PolarHBondContact O-N 2.67Å; W35-S39 PolarHBondContact O-OG 2.75Å
36	Q	41.8	Very low	46.7	Very low	134 Å²	134	129.3 Å²	129.3	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-66.4	-33	175.1	-81.7	-176.4	-49.1	0	0	113.2	V32 K38 S39	V32-Q36 PolarHBondContact O-N 3.09Å; V32-Q36 VanDerWaalsContact O-N 3.15Å; Q36-K38 VanDerWaalsContact C-N 3.31Å; Q36-K38 PolarHBondContact O-N 3.25Å; Q36-S39 PolarHBondContact O-OG 3.08Å
37	K	41.2	Very low	43.8	Very low	184 Å²	184	127.8 Å²	127.8	80%	0.8	66%	0.658	S	S	*	*	H	α-helix	trans	-68.8	-26.2	173.2	-97.4	-176.7	175.1	178.6	0	113.6	S33 W35	S33-K37 PolarHBondContact O-N 3.21Å; W35-K37 VanDerWaalsContact C-N 3.35Å; W35-K37 PolarHBondContact O-N 3.5Å
38	K	38.2	Very low	41.7	Very low	191 Å²	191	129.2 Å²	129.2	83%	0.83	67%	0.673	S	S	*	*	H	α-helix	trans	-85.5	-15.2	-178.4	-127.8	176.1	-176.4	179.2	0	113.7	S34 W35 Q36	S34-K38 PolarHBondContact O-N 3.24Å; W35-K38 PolarHBondContact O-N 3.44Å; Q36-K38 VanDerWaalsContact C-N 3.31Å; Q36-K38 PolarHBondContact O-N 3.25Å
39	S	36.2	Very low	39.3	Very low	92 Å²	92	127.1 Å²	127.1	64%	0.643	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	6.8	-177.3	58.6	0	0	0	0	114.7	W35 Q36	W35-S39 PolarHBondContact O-N 2.67Å; W35-S39 PolarHBondContact O-OG 2.75Å; Q36-S39 PolarHBondContact O-OG 3.08Å
40	Q	31.3	Very low	37.1	Very low	169 Å²	169	130.2 Å²	130.2	79%	0.79	70%	0.696	S	S	*	*			trans	-125.2	21.8	-176.9	-81.9	-166.4	-26.9	0	0	114.9	P42	Q40-P42 WeakPolarHBondContact O-CD 3.49Å
41	E	29.1	Very low	35.2	Very low	176 Å²	176	135.6 Å²	135.6	82%	0.822	72%	0.716	S	S	*	*			trans	-89.3	118.9	164.9	-80.5	-170	165	0	0	110.9
42	P	25.9	Very low	33.3	Very low	114 Å²	114	137.2 Å²	137.2	74%	0.74	73%	0.734	S	S	*	*			trans	-86.6	117.6	172.5	31.5	-26.8	0	0	0	109.9	Q40 S44	Q40-P42 WeakPolarHBondContact O-CD 3.49Å; P42-S44 PolarHBondContact O-N 2.77Å
43	L	28	Very low	31.6	Very low	182 Å²	182	142 Å²	142	95%	0.953	75%	0.752	S	S	*	*			trans	-78.8	90.3	167.1	-87.8	160.4	0	0	0	109.4
44	S	28.3	Very low	30.4	Very low	104 Å²	104	149 Å²	149	73%	0.727	78%	0.779	S	S	*	*			trans	-73.1	154.7	165.6	53.5	0	0	0	0	111.5	P42	P42-S44 PolarHBondContact O-N 2.77Å
45	A	26.7	Very low	29.3	Very low	87 Å²	87	153.5 Å²	153.5	72%	0.719	79%	0.793	S	S	*	*			trans	-46	149.6	-179.7	0	0	0	0	0	114.9
46	W	22.6	Very low	28.6	Very low	254 Å²	254	153.4 Å²	153.4	96%	0.962	80%	0.804	S	S	*	*			trans	-159	125.6	142.6	-104.6	25.1	0	0	0	112.2
47	S	23	Very low	27.7	Very low	116 Å²	116	153.1 Å²	153.1	81%	0.811	81%	0.805	S	S	*	*			trans	-138.9	139.5	152.3	-74.8	0	0	0	0	104
48	P	32.5	Very low	26.9	Very low	131 Å²	131	155.8 Å²	155.8	85%	0.851	81%	0.812	S	S	*	*				-154.5	166.7	81.5	36.4	-15.9	0	0	0	116.3
49	G	25.1	Very low	26.1	Very low	77 Å²	77	150 Å²	150	79%	0.794	81%	0.807	S	S	*	*			trans	141.1	98.8	145.5	0	0	0	0	0	119.4
50	K	26.4	Very low	25.6	Very low	199 Å²	199	151.4 Å²	151.4	87%	0.865	82%	0.817	S	S	*	*			trans	-42	156.2	152.3	-79.2	168.5	176.9	172.7	0	112.1
51	K	24.3	Very low	25.3	Very low	178 Å²	178	152.6 Å²	152.6	77%	0.774	82%	0.822	S	S	*	*			cis	179.1	143.2	36.6	-126	173.6	-171.8	-172.3	0	105.4
52	V	24.1	Very low	25.2	Very low	146 Å²	146	153.3 Å²	153.3	89%	0.885	83%	0.825	S	S	*	*			trans	-158.7	129.7	135.4	171	0	0	0	0	108.5
53	H	23	Very low	25.3	Very low	166 Å²	166	155.5 Å²	155.5	77%	0.769	83%	0.829	S	S	*	*			trans	-75.3	145.6	170.5	-78.8	-17.5	0	0	0	111.8
54	Q	25	Very low	25.2	Very low	196 Å²	196	152.5 Å²	152.5	92%	0.916	82%	0.821	S	S	*	*			trans	-152.6	126	132.2	-127.6	165.5	-5.2	0	0	111.4
55	Q	22.8	Very low	25.1	Very low	156 Å²	156	156.3 Å²	156.3	73%	0.729	82%	0.824	S	S	*	*			trans	-74.1	143.7	177	-68.3	161.3	-52.9	0	0	110.7
56	I	24.8	Very low	25.1	Very low	170 Å²	170	158 Å²	158	87%	0.872	83%	0.828	S	S	*	*			trans	-135.9	122.7	139.7	-61.5	-176.1	0	0	0	107.4
57	I	22.6	Very low	25.1	Very low	128 Å²	128	154.6 Å²	154.6	66%	0.656	82%	0.822	S	S	*	*			trans	-94.8	134.6	177.7	-67.6	163.9	0	0	0	107.7
58	Y	24.8	Very low	25.2	Very low	239 Å²	239	155 Å²	155	94%	0.937	82%	0.82	S	S	*	*			trans	-149.9	116.7	138.2	-106.4	-80	0	0	0	108.3
59	G	22.3	Very low	24.9	Very low	71 Å²	71	156 Å²	156	73%	0.732	82%	0.816	S	S	*	*			trans	-89.6	159.8	-178.5	0	0	0	0	0	113.2
60	S	25.9	Very low	24.9	Very low	121 Å²	121	158 Å²	158	85%	0.846	81%	0.812	S	S	*	*			trans	-144	131.8	146.5	67.2	0	0	0	0	107.8
61	E	24.6	Very low	24.9	Very low	194 Å²	194	156.5 Å²	156.5	91%	0.907	81%	0.806	S	S	*	*			trans	-71.9	136.8	-169.8	-64.8	166.7	138.5	0	0	112.2
62	Q	26.4	Very low	25.2	Very low	190 Å²	190	157.6 Å²	157.6	89%	0.888	81%	0.806	S	S	*	*			trans	-134	129.4	155.3	-76.8	-168.4	-7.2	0	0	109.9
63	I	27.6	Very low	25.5	Very low	160 Å²	160	154.9 Å²	154.9	82%	0.821	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-60.2	138	-176.5	-64	154.5	0	0	0	110.9
64	P	26.2	Very low	26.2	Very low	119 Å²	119	152.2 Å²	152.2	77%	0.773	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-79.4	127.4	-174.9	7	7.7	0	0	0	112.1
65	K	27.2	Very low	26.8	Very low	185 Å²	185	148.2 Å²	148.2	80%	0.804	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-76.1	143.6	163.4	-70.2	179.5	179.8	177.5	0	109.3	H67	K65-H67 PolarHBondContact O-N 2.69Å; K65-H67 VanDerWaalsContact O-N 3.13Å
66	P	25.1	Very low	27.2	Very low	123 Å²	123	146 Å²	146	80%	0.799	76%	0.755	S	S	*	*			trans	-67	115.3	-176	25.9	-31.9	0	0	0	110.7	V68	P66-V68 PolarHBondContact O-N 3.02Å
67	H	24.3	Very low	27.6	Very low	182 Å²	182	145 Å²	145	84%	0.843	74%	0.744	S	S	*	*			trans	-70	103.7	166.6	-78.5	-63.8	0	0	0	109.1	K65 I69	K65-H67 PolarHBondContact O-N 2.69Å; K65-H67 VanDerWaalsContact O-N 3.13Å; H67-I69 PolarHBondContact O-N 2.82Å; H67-I69 VanDerWaalsContact O-N 3.12Å
68	V	24.6	Very low	28.2	Very low	125 Å²	125	141.5 Å²	141.5	76%	0.758	74%	0.735	S	S	*	*			trans	-69.3	104.6	159.4	178.7	0	0	0	0	106.4	P66 V70	P66-V68 PolarHBondContact O-N 3.02Å; V68-V70 VanDerWaalsContact C-N 3.28Å; V68-V70 HydrophobicContact CG1-CG2 4.21Å; V68-V70 PolarHBondContact O-N 2.76Å
69	I	24.8	Very low	28.7	Very low	150 Å²	150	137.6 Å²	137.6	77%	0.769	72%	0.723	S	S	*	*			trans	-67.5	92.6	168.4	-61.2	171.2	0	0	0	106.5	H67 K71	H67-I69 PolarHBondContact O-N 2.82Å; H67-I69 VanDerWaalsContact O-N 3.12Å; I69-K71 PolarHBondContact O-N 2.64Å
70	V	26.3	Very low	29.3	Very low	119 Å²	119	138.9 Å²	138.9	72%	0.721	72%	0.72	S	S	*	*			trans	-70.3	114.9	161.2	-180	0	0	0	0	105.8	V68 R72	V68-V70 VanDerWaalsContact C-N 3.28Å; V68-V70 HydrophobicContact CG1-CG2 4.21Å; V68-V70 PolarHBondContact O-N 2.76Å; V70-R72 PolarHBondContact O-N 3.35Å
71	K	25.8	Very low	30	Very low	169 Å²	169	140.1 Å²	140.1	74%	0.735	72%	0.715	S	S	*	*			trans	-52.1	123.8	178.3	-82.5	177.3	172.7	176.7	0	109.8	I69 T73	I69-K71 PolarHBondContact O-N 2.64Å; K71-T73 PolarHBondContact O-N 3.3Å; K71-T73 PolarHBondContact O-OG1 3.03Å
72	R	31.4	Very low	30.7	Very low	201 Å²	201	137 Å²	137	76%	0.758	70%	0.704	S	S	*	*	S	Bend	trans	-61	80	164.3	-84.7	179.4	160	147.2	2	110.3	V70 E75	V70-R72 PolarHBondContact O-N 3.35Å; R72-E75 IonicContact NE-OE2 3.62Å; R72-E75 PolarHBondContact NE-OE2 2.88Å; R72-E75 VanDerWaalsContact NE-OE2 3.12Å
73	T	30.1	Very low	31.2	Very low	89 Å²	89	130.3 Å²	130.3	55%	0.546	69%	0.685	S	S	.	*			trans	-116.4	-13.2	170	39.3	0	0	0	0	112.8	K71	K71-T73 PolarHBondContact O-N 3.3Å; K71-T73 PolarHBondContact O-OG1 3.03Å
74	D	37.5	Very low	31.7	Very low	109 Å²	109	129.1 Å²	129.1	58%	0.583	69%	0.686	S	S	*	*	H	α-helix	trans	-98.1	-24.5	-176.2	-64.4	-38	0	0	0	114.2	D76 K77 A78	D74-D76 VanDerWaalsContact C-N 3.31Å; D74-D76 PolarHBondContact O-N 3.21Å; D74-K77 PolarHBondContact O-N 3.45Å; D74-A78 PolarHBondContact O-N 2.78Å
75	E	36.5	Very low	32.3	Very low	112 Å²	112	130.5 Å²	130.5	52%	0.523	69%	0.687	S	S	.	*	H	α-helix	trans	-64	-36	174.2	-74.2	-173.9	141.4	0	0	112.1	R72 A78 K79	R72-E75 IonicContact NE-OE2 3.62Å; R72-E75 PolarHBondContact NE-OE2 2.88Å; R72-E75 VanDerWaalsContact NE-OE2 3.12Å; E75-A78 PolarHBondContact O-N 3.08Å; E75-K79 PolarHBondContact O-N 3.2Å; E75-K79 VanDerWaalsContact O-N 3.07Å
76	D	31.3	Very low	33.3	Very low	110 Å²	110	126 Å²	126	59%	0.588	67%	0.667	S	S	*	*	H	α-helix	trans	-77.6	-28	178.8	-68.3	-31	0	0	0	112.1	D74 S80	D74-D76 VanDerWaalsContact C-N 3.31Å; D74-D76 PolarHBondContact O-N 3.21Å; D76-S80 VanDerWaalsContact O-CB 3.32Å; D76-S80 WeakPolarHBondContact O-CB 3.28Å; D76-S80 PolarHBondContact O-N 3.22Å
77	K	33.6	Very low	34.2	Very low	148 Å²	148	126.3 Å²	126.3	64%	0.643	66%	0.662	S	S	*	*	H	α-helix	trans	-68.9	-40.1	168.7	-93.1	-178.9	176.2	176	0	111.9	D74 K79 S80 M81	D74-K77 PolarHBondContact O-N 3.45Å; K77-K79 VanDerWaalsContact C-N 3.35Å; K77-S80 PolarHBondContact O-N 3.47Å; K77-M81 WeakPolarHBondContact O-CG 3.14Å; K77-M81 PolarHBondContact O-N 3.3Å
78	A	36.6	Very low	35.4	Very low	55 Å²	55	125.6 Å²	125.6	46%	0.455	66%	0.659	S	S	.	*	H	α-helix	trans	-64.7	-38.9	176.2	0	0	0	0	0	111.9	D74 E75 M81	D74-A78 PolarHBondContact O-N 2.78Å; E75-A78 PolarHBondContact O-N 3.08Å; A78-M81 PolarHBondContact O-N 3.36Å
79	K	34.8	Very low	36.8	Very low	157 Å²	157	124.7 Å²	124.7	68%	0.683	65%	0.654	S	S	*	*	H	α-helix	trans	-72.2	-33.9	173.9	-78.4	178.6	179	171.8	0	113.7	E75 K77 M81 L82	E75-K79 PolarHBondContact O-N 3.2Å; E75-K79 VanDerWaalsContact O-N 3.07Å; K77-K79 VanDerWaalsContact C-N 3.35Å; K79-M81 PolarHBondContact O-N 2.83Å; K79-L82 WeakPolarHBondContact O-CB 3.35Å; K79-L82 PolarHBondContact O-N 3.33Å
80	S	34.7	Very low	39.1	Very low	98 Å²	98	121 Å²	121	69%	0.685	64%	0.636	S	S	*	*	H	α-helix	trans	-66.9	-24	174.3	177.6	0	0	0	0	113.1	D76 K77 L82	D76-S80 VanDerWaalsContact O-CB 3.32Å; D76-S80 WeakPolarHBondContact O-CB 3.28Å; D76-S80 PolarHBondContact O-N 3.22Å; K77-S80 PolarHBondContact O-N 3.47Å; S80-L82 VanDerWaalsContact C-N 3.32Å
81	M	39.8	Very low	41.5	Very low	148 Å²	148	120.3 Å²	120.3	73%	0.729	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-4.3	175.6	-69.4	-117.5	142	0	0	113.4	K77 A78 K79 G83	K77-M81 WeakPolarHBondContact O-CG 3.14Å; K77-M81 PolarHBondContact O-N 3.3Å; A78-M81 PolarHBondContact O-N 3.36Å; K79-M81 PolarHBondContact O-N 2.83Å; M81-G83 PolarHBondContact O-N 3.34Å
82	L	40.6	Very low	44	Very low	128 Å²	128	118.1 Å²	118.1	67%	0.67	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	8.7	176.8	-123.5	87.4	0	0	0	113.3	K79 S80	K79-L82 WeakPolarHBondContact O-CB 3.35Å; K79-L82 PolarHBondContact O-N 3.33Å; S80-L82 VanDerWaalsContact C-N 3.32Å
83	G	35.4	Very low	46.2	Very low	49 Å²	49	109.8 Å²	109.8	51%	0.505	60%	0.596	S	S	.	*			trans	-70.5	129.6	177.9	0	0	0	0	0	112.2	M81 D85	M81-G83 PolarHBondContact O-N 3.34Å; G83-D85 PolarHBondContact O-N 3.27Å
84	T	39.4	Very low	48.6	Very low	135 Å²	135	110.2 Å²	110.2	83%	0.828	59%	0.592	S	S	*	*	S	Bend	trans	-69.4	20.6	-172.4	39.2	0	0	0	0	116.7
85	D	39.1	Very low	50.8	Low	149 Å²	149	111.8 Å²	111.8	80%	0.797	59%	0.594	S	S	*	*			trans	-109.5	73.7	176.9	-75.8	-23.4	0	0	0	110.7	G83 N87	G83-D85 PolarHBondContact O-N 3.27Å; D85-N87 PolarHBondContact O-N 3.08Å
86	F	48.3	Very low	53	Low	89 Å²	89	107.5 Å²	107.5	39%	0.39	57%	0.574	S	S	.	*			trans	-74.3	78.2	170.2	-80.7	-85.5	0	0	0	109.9	H88 L93	F86-H88 PolarHBondContact O-N 3.39Å; F86-L93 HydrophobicContact CD1-CD2 4.24Å; F86-L93 HydrophobicContact CE1-CD2 4.41Å
87	N	43.8	Very low	55.6	Low	130 Å²	130	104.5 Å²	104.5	70%	0.695	56%	0.557	S	S	*	*			trans	-61.5	122	169.8	-117.9	-14.3	0	0	0	108.5	D85 T89	D85-N87 PolarHBondContact O-N 3.08Å; N87-T89 WeakPolarHBondContact CB-OG1 3.1Å; N87-T89 PolarHBondContact O-N 3.35Å
88	H	49.3	Very low	58	Low	168 Å²	168	101.4 Å²	101.4	78%	0.778	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	16.9	179	-83.1	-78.3	0	0	0	114.4	F86	F86-H88 PolarHBondContact O-N 3.39Å
89	T	54.6	Low	60.5	Low	106 Å²	106	104.5 Å²	104.5	65%	0.65	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-6.1	-166.1	-9.9	0	0	0	0	114.2	N87 P91	N87-T89 WeakPolarHBondContact CB-OG1 3.1Å; N87-T89 PolarHBondContact O-N 3.35Å; T89-P91 WeakPolarHBondContact O-CD 3.19Å
90	N	71.8	Confident	63.1	Low	72 Å²	72	98 Å²	98	39%	0.385	52%	0.522	S	S	.	.			trans	-90.2	104.5	173	-173.1	-21.9	0	0	0	110.2	E92 L93 H94	N90-E92 PolarHBondContact O-N 3.05Å; N90-E92 WeakPolarHBondContact OD1-CB 3.41Å; N90-E92 PolarHBondContact OD1-N 2.8Å; N90-L93 HydrophobicContact CB-CB 4.04Å; N90-L93 PolarHBondContact O-N 3.03Å; N90-L93 PolarHBondContact OD1-N 3.21Å; N90-H94 PolarHBondContact O-N 2.64Å; N90-H94 VanDerWaalsContact O-N 3.17Å
91	P	77.3	Confident	65.9	Low	105 Å²	105	93.5 Å²	93.5	68%	0.682	49%	0.491	S	S	*	.	H	α-helix	trans	-65.7	-27.9	-176	-18.9	34.4	0	0	0	112.9	T89 K95	T89-P91 WeakPolarHBondContact O-CD 3.19Å; P91-K95 WeakPolarHBondContact O-CB 3.1Å; P91-K95 PolarHBondContact O-N 2.64Å
92	E	78.1	Confident	68.5	Low	123 Å²	123	86.4 Å²	86.4	58%	0.575	46%	0.456	S	S	*	.	H	α-helix	trans	-70.7	-46.4	178.5	-170.5	176.4	-175	0	0	111	N90 H94 K95 E96	N90-E92 PolarHBondContact O-N 3.05Å; N90-E92 WeakPolarHBondContact OD1-CB 3.41Å; N90-E92 PolarHBondContact OD1-N 2.8Å; E92-H94 VanDerWaalsContact C-N 3.29Å; E92-H94 PolarHBondContact O-N 2.9Å; E92-K95 PolarHBondContact O-N 3.48Å; E92-E96 WeakPolarHBondContact O-CG 3.1Å; E92-E96 PolarHBondContact O-N 2.97Å
93	L	77.8	Confident	71	Confident	25 Å²	25	80.6 Å²	80.6	13%	0.131	43%	0.426	C	S	.	.	H	α-helix	trans	-58.9	-42.7	174.4	177.4	60.8	0	0	0	111.2	F86 N90 E96 L97 N103 I105	F86-L93 HydrophobicContact CD1-CD2 4.24Å; F86-L93 HydrophobicContact CE1-CD2 4.41Å; N90-L93 HydrophobicContact CB-CB 4.04Å; N90-L93 PolarHBondContact O-N 3.03Å; N90-L93 PolarHBondContact OD1-N 3.21Å; L93-E96 PolarHBondContact O-N 3.11Å; L93-L97 HydrophobicContact CD1-CD1 4.05Å; L93-L97 HydrophobicContact CD1-CG 4.25Å; L93-L97 HydrophobicContact CG-CD1 3.92Å; L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 2.88Å; L93-N103 HydrophobicContact CD1-CB 4.46Å; L93-N103 WeakPolarHBondContact CD1-OD1 3.41Å; L93-I105 HydrophobicContact CB-CD1 4.15Å; L93-I105 HydrophobicContact CD1-CD1 4.13Å; L93-I105 HydrophobicContact CD1-CG1 4.47Å
94	H	80.9	Confident	73.7	Confident	98 Å²	98	78.2 Å²	78.2	45%	0.454	40%	0.402	S	S	.	.	H	α-helix	trans	-62.7	-44.5	177.3	-172.3	64.8	0	0	0	112	N90 E92 L97 L98	N90-H94 PolarHBondContact O-N 2.64Å; N90-H94 VanDerWaalsContact O-N 3.17Å; E92-H94 VanDerWaalsContact C-N 3.29Å; E92-H94 PolarHBondContact O-N 2.9Å; H94-L97 PolarHBondContact O-N 3.38Å; H94-L98 WeakPolarHBondContact NE2-CD1 3.46Å; H94-L98 VanDerWaalsContact O-CG 3.31Å; H94-L98 WeakPolarHBondContact O-CG 3.46Å; H94-L98 PolarHBondContact O-N 2.9Å
95	K	83.3	Confident	76.1	Confident	142 Å²	142	75.2 Å²	75.2	62%	0.617	38%	0.38	S	S	*	.	H	α-helix	trans	-61.3	-44.8	177.6	-177.3	-177.2	176.1	-173.8	0	112.1	P91 E92 L98 K99	P91-K95 WeakPolarHBondContact O-CB 3.1Å; P91-K95 PolarHBondContact O-N 2.64Å; E92-K95 PolarHBondContact O-N 3.48Å; K95-L98 PolarHBondContact O-N 2.82Å; K95-K99 WeakPolarHBondContact O-CB 3.41Å; K95-K99 PolarHBondContact O-N 2.81Å
96	E	83.4	Confident	78.6	Confident	22 Å²	22	69.4 Å²	69.4	10%	0.103	35%	0.348	C	S	.	.	H	α-helix	trans	-69.4	-39.5	179.5	-66.1	-64.2	110.5	0	0	111.8	E92 L93 L98 K99 Y100 V104 R108	E92-E96 WeakPolarHBondContact O-CG 3.1Å; E92-E96 PolarHBondContact O-N 2.97Å; L93-E96 PolarHBondContact O-N 3.11Å; E96-L98 VanDerWaalsContact C-N 3.31Å; E96-L98 PolarHBondContact O-N 2.74Å; E96-K99 PolarHBondContact O-N 2.83Å; E96-K99 VanDerWaalsContact O-N 3.15Å; E96-Y100 PolarHBondContact O-N 3.22Å; E96-Y100 VanDerWaalsContact OE2-CE2 3.28Å; E96-Y100 WeakPolarHBondContact OE2-CE2 3.45Å; E96-V104 HydrophobicContact CB-CB 4.21Å; E96-V104 HydrophobicContact CB-CG2 4.15Å; E96-R108 IonicContact OE2-NH2 3.92Å
97	L	85.1	Confident	80.8	Confident	47 Å²	47	65.2 Å²	65.2	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-59	-41.3	171.5	-82.8	165.1	0	0	0	111.8	L93 H94 K99 G101	L93-L97 HydrophobicContact CD1-CD1 4.05Å; L93-L97 HydrophobicContact CD1-CG 4.25Å; L93-L97 HydrophobicContact CG-CD1 3.92Å; L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 2.88Å; H94-L97 PolarHBondContact O-N 3.38Å; L97-K99 VanDerWaalsContact C-N 3.32Å; L97-G101 WeakPolarHBondContact O-CA 3.19Å; L97-G101 PolarHBondContact O-N 2.8Å
98	L	84.6	Confident	83.1	Confident	83 Å²	83	64.5 Å²	64.5	44%	0.435	32%	0.318	S	S	.	.	H	α-helix	trans	-67.3	-34.2	176.3	-73.1	175.7	0	0	0	112.6	H94 K95 E96 T366	H94-L98 WeakPolarHBondContact NE2-CD1 3.46Å; H94-L98 VanDerWaalsContact O-CG 3.31Å; H94-L98 WeakPolarHBondContact O-CG 3.46Å; H94-L98 PolarHBondContact O-N 2.9Å; K95-L98 PolarHBondContact O-N 2.82Å; E96-L98 VanDerWaalsContact C-N 3.31Å; E96-L98 PolarHBondContact O-N 2.74Å; L98-T366 HydrophobicContact CB-CG2 4.32Å; L98-T366 HydrophobicContact CD2-CG2 3.54Å; L98-T366 WeakPolarHBondContact O-CG2 3.24Å; L98-T366 PolarHBondContact O-OG1 2.92Å
99	K	88.2	Confident	85.2	Confident	120 Å²	120	60.8 Å²	60.8	52%	0.522	31%	0.31	S	S	.	.	H	α-helix	trans	-76.7	-49.3	-177	-178	178.1	172.9	-167.8	0	112.7	K95 E96 L97	K95-K99 WeakPolarHBondContact O-CB 3.41Å; K95-K99 PolarHBondContact O-N 2.81Å; E96-K99 PolarHBondContact O-N 2.83Å; E96-K99 VanDerWaalsContact O-N 3.15Å; L97-K99 VanDerWaalsContact C-N 3.32Å
100	Y	90.5	Very high	86.9	Confident	20 Å²	20	58.5 Å²	58.5	8%	0.078	29%	0.294	C	S	.	.	H	α-helix	trans	-107	-15.4	-172.4	-64.2	-73.5	0	0	0	113.7	E96 F102 V104 N144 E146 K363	E96-Y100 PolarHBondContact O-N 3.22Å; E96-Y100 VanDerWaalsContact OE2-CE2 3.28Å; E96-Y100 WeakPolarHBondContact OE2-CE2 3.45Å; Y100-F102 VanDerWaalsContact O-CD1 3.31Å; Y100-F102 WeakPolarHBondContact O-CD1 3.25Å; Y100-V104 HydrophobicContact CD2-CG2 3.52Å; Y100-V104 HydrophobicContact CE2-CG2 4.26Å; Y100-V104 HydrophobicContact CG-CG2 4.01Å; Y100-N144 WeakPolarHBondContact CE1-O 3.32Å; Y100-E146 HydrophobicContact CD1-CB 3.69Å; Y100-E146 HydrophobicContact CD1-CG 4.21Å; Y100-E146 HydrophobicContact CD2-CG 4.29Å; Y100-E146 HydrophobicContact CE1-CB 3.89Å; Y100-E146 HydrophobicContact CE1-CG 4.22Å; Y100-E146 HydrophobicContact CE2-CG 4.24Å; Y100-E146 HydrophobicContact CG-CB 4.06Å; Y100-E146 HydrophobicContact CG-CG 4.22Å; Y100-K363 WeakPolarHBondContact O-CD 3.41Å
101	G	92.4	Very high	87.9	Confident	4 Å²	4	56.3 Å²	56.3	4%	0.041	29%	0.289	C	S	.	.	S	Bend	trans	84	7.7	179.2	0	0	0	0	0	114.6	L97 K363 K364	L97-G101 WeakPolarHBondContact O-CA 3.19Å; L97-G101 PolarHBondContact O-N 2.8Å; G101-K363 CarbonylContact O-C 3.5Å; G101-K363 WeakPolarHBondContact O-CA 3.41Å; G101-K364 WeakPolarHBondContact CA-O 3.5Å; G101-K364 PolarHBondContact O-N 3.32Å
102	F	93.9	Very high	88.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-156.5	172.2	179.1	67.9	-85.8	0	0	0	112	Y100 V104 E146 A149 D261 L264 I361 K363	Y100-F102 VanDerWaalsContact O-CD1 3.31Å; Y100-F102 WeakPolarHBondContact O-CD1 3.25Å; F102-V104 HydrophobicContact CE2-CG2 4.29Å; F102-V104 PolarHBondContact O-N 3.43Å; F102-V104 VanDerWaalsContact O-N 3.09Å; F102-E146 HydrophobicContact CE1-CB 4.15Å; F102-E146 HydrophobicContact CZ-CB 3.6Å; F102-E146 HydrophobicContact CZ-CG 4.07Å; F102-A149 HydrophobicContact CE2-CB 4.39Å; F102-A149 HydrophobicContact CZ-CB 3.75Å; F102-D261 CarbonylContact C-O 3.59Å; F102-D261 WeakPolarHBondContact CA-O 3.45Å; F102-D261 HydrophobicContact CB-CB 3.99Å; F102-D261 VanDerWaalsContact CB-O 3.3Å; F102-D261 WeakPolarHBondContact CB-O 3.43Å; F102-L264 HydrophobicContact CB-CD2 4.45Å; F102-L264 HydrophobicContact CD2-CD1 4.42Å; F102-L264 HydrophobicContact CD2-CD2 4.03Å; F102-I361 HydrophobicContact CB-CG2 3.79Å; F102-I361 HydrophobicContact CD1-CG2 4.13Å; F102-I361 HydrophobicContact CD2-CD1 4.43Å; F102-I361 HydrophobicContact CD2-CG2 4.47Å; F102-I361 HydrophobicContact CE2-CD1 4.28Å; F102-I361 HydrophobicContact CG-CG2 3.9Å; F102-I361 HydrophobicContact CZ-CD1 4.41Å; F102-K363 HydrophobicContact CD1-CD 4.38Å; F102-K363 HydrophobicContact CD1-CG 4.07Å
103	N	93.4	Very high	89	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.027	27%	0.272	C	S	.	.			trans	-77.6	93.2	-175.5	-171.8	-14.5	0	0	0	112.1	L93 I105 I106 S107 D261 R262	L93-N103 HydrophobicContact CD1-CB 4.46Å; L93-N103 WeakPolarHBondContact CD1-OD1 3.41Å; N103-I105 VanDerWaalsContact C-N 3.31Å; N103-I105 PolarHBondContact O-N 3.37Å; N103-I105 PolarHBondContact OD1-N 3.21Å; N103-I106 WeakPolarHBondContact ND2-CD1 3.46Å; N103-I106 WeakPolarHBondContact ND2-CG1 3.46Å; N103-I106 PolarHBondContact O-N 3.42Å; N103-I106 PolarHBondContact OD1-N 2.84Å; N103-S107 PolarHBondContact O-N 3.47Å; N103-S107 VanDerWaalsContact O-N 3.1Å; N103-D261 PolarHBondContact N-O 3.23Å; N103-R262 WeakPolarHBondContact CB-O 3.29Å; N103-R262 PolarHBondContact ND2-O 3.46Å
104	V	91.8	Very high	89.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.8	-28.2	-179.3	-179.1	0	0	0	0	113.1	E96 Y100 F102 I106 S107 R108 E146	E96-V104 HydrophobicContact CB-CB 4.21Å; E96-V104 HydrophobicContact CB-CG2 4.15Å; Y100-V104 HydrophobicContact CD2-CG2 3.52Å; Y100-V104 HydrophobicContact CE2-CG2 4.26Å; Y100-V104 HydrophobicContact CG-CG2 4.01Å; F102-V104 HydrophobicContact CE2-CG2 4.29Å; F102-V104 PolarHBondContact O-N 3.43Å; F102-V104 VanDerWaalsContact O-N 3.09Å; V104-I106 VanDerWaalsContact C-N 3.33Å; V104-I106 PolarHBondContact O-N 2.86Å; V104-S107 WeakPolarHBondContact O-CB 3.39Å; V104-S107 PolarHBondContact O-N 3.39Å; V104-R108 HydrophobicContact CG1-CG 4.18Å; V104-R108 VanDerWaalsContact CG1-NE 3.33Å; V104-R108 VanDerWaalsContact CG1-NH2 3.33Å; V104-R108 WeakPolarHBondContact O-CB 3.47Å; V104-R108 VanDerWaalsContact O-CG 3.32Å; V104-R108 WeakPolarHBondContact O-CG 3.42Å; V104-R108 PolarHBondContact O-N 2.82Å; V104-E146 HydrophobicContact CB-CG 4.42Å; V104-E146 HydrophobicContact CG1-CG 3.7Å; V104-E146 HydrophobicContact CG2-CG 3.89Å
105	I	91.6	Very high	90.3	Very high	72 Å²	72	59.8 Å²	59.8	37%	0.369	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-44.9	178.1	-60.2	177.9	0	0	0	109.7	L93 N103 R108 S109	L93-I105 HydrophobicContact CB-CD1 4.15Å; L93-I105 HydrophobicContact CD1-CD1 4.13Å; L93-I105 HydrophobicContact CD1-CG1 4.47Å; N103-I105 VanDerWaalsContact C-N 3.31Å; N103-I105 PolarHBondContact O-N 3.37Å; N103-I105 PolarHBondContact OD1-N 3.21Å; I105-R108 PolarHBondContact O-N 3.34Å; I105-S109 PolarHBondContact O-N 2.87Å; I105-S109 VanDerWaalsContact O-N 3.07Å
106	I	91.8	Very high	90.8	Very high	27 Å²	27	54.2 Å²	54.2	14%	0.138	27%	0.271	C	S	.	.	H	α-helix	trans	-70.1	-41.2	176	-65.1	-176.9	0	0	0	111	N103 V104 R108 S109 L110 R262 L264	N103-I106 WeakPolarHBondContact ND2-CD1 3.46Å; N103-I106 WeakPolarHBondContact ND2-CG1 3.46Å; N103-I106 PolarHBondContact O-N 3.42Å; N103-I106 PolarHBondContact OD1-N 2.84Å; V104-I106 VanDerWaalsContact C-N 3.33Å; V104-I106 PolarHBondContact O-N 2.86Å; I106-R108 PolarHBondContact O-N 2.95Å; I106-S109 WeakPolarHBondContact CA-OG 3.36Å; I106-S109 PolarHBondContact O-N 2.9Å; I106-S109 PolarHBondContact O-OG 3.28Å; I106-L110 HydrophobicContact CG2-CD1 3.72Å; I106-L110 HydrophobicContact CG2-CG 4.13Å; I106-L110 WeakPolarHBondContact O-CB 3.5Å; I106-L110 WeakPolarHBondContact O-CD1 3.27Å; I106-L110 VanDerWaalsContact O-CG 3.25Å; I106-L110 WeakPolarHBondContact O-CG 3.48Å; I106-L110 PolarHBondContact O-N 3.4Å; I106-R262 WeakPolarHBondContact CD1-O 3.42Å; I106-L264 HydrophobicContact CB-CG 4.46Å; I106-L264 HydrophobicContact CG2-CB 4.1Å; I106-L264 HydrophobicContact CG2-CD1 4.5Å; I106-L264 HydrophobicContact CG2-CG 4.06Å
107	S	93.6	Very high	91.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54.2	-41.6	174.5	-169.9	0	0	0	0	112.4	N103 V104 N148 Q152	N103-S107 PolarHBondContact O-N 3.47Å; N103-S107 VanDerWaalsContact O-N 3.1Å; V104-S107 WeakPolarHBondContact O-CB 3.39Å; V104-S107 PolarHBondContact O-N 3.39Å; S107-N148 PolarHBondContact O-ND2 2.9Å; S107-Q152 PolarHBondContact O-NE2 3.38Å
108	R	92.1	Very high	91.8	Very high	116 Å²	116	58.1 Å²	58.1	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-70.8	-40.6	178	-70.8	176.1	-172.7	157.4	8.7	113.1	E96 V104 I105 I106 L110 G111 E146 N148	E96-R108 IonicContact OE2-NH2 3.92Å; V104-R108 HydrophobicContact CG1-CG 4.18Å; V104-R108 VanDerWaalsContact CG1-NE 3.33Å; V104-R108 VanDerWaalsContact CG1-NH2 3.33Å; V104-R108 WeakPolarHBondContact O-CB 3.47Å; V104-R108 VanDerWaalsContact O-CG 3.32Å; V104-R108 WeakPolarHBondContact O-CG 3.42Å; V104-R108 PolarHBondContact O-N 2.82Å; I105-R108 PolarHBondContact O-N 3.34Å; I106-R108 PolarHBondContact O-N 2.95Å; R108-L110 VanDerWaalsContact C-N 3.31Å; R108-L110 PolarHBondContact O-N 2.97Å; R108-G111 PolarHBondContact O-N 3.43Å; R108-E146 IonicContact NE-OE1 3.36Å; R108-E146 IonicContact NH2-OE1 3.25Å; R108-N148 WeakPolarHBondContact CA-ND2 3.28Å
109	S	92.8	Very high	92.2	Very high	89 Å²	89	55.1 Å²	55.1	62%	0.622	28%	0.283	S	S	*	.	H	α-helix	trans	-69.8	-27.9	179.8	68.8	0	0	0	0	113.5	I105 I106 G111	I105-S109 PolarHBondContact O-N 2.87Å; I105-S109 VanDerWaalsContact O-N 3.07Å; I106-S109 WeakPolarHBondContact CA-OG 3.36Å; I106-S109 PolarHBondContact O-N 2.9Å; I106-S109 PolarHBondContact O-OG 3.28Å; S109-G111 PolarHBondContact O-N 3.32Å
110	L	91.9	Very high	92.3	Very high	58 Å²	58	51.8 Å²	51.8	30%	0.304	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-15.9	175.4	-71.9	166.5	0	0	0	113.5	I106 R108 L264	I106-L110 HydrophobicContact CG2-CD1 3.72Å; I106-L110 HydrophobicContact CG2-CG 4.13Å; I106-L110 WeakPolarHBondContact O-CB 3.5Å; I106-L110 WeakPolarHBondContact O-CD1 3.27Å; I106-L110 VanDerWaalsContact O-CG 3.25Å; I106-L110 WeakPolarHBondContact O-CG 3.48Å; I106-L110 PolarHBondContact O-N 3.4Å; R108-L110 VanDerWaalsContact C-N 3.31Å; R108-L110 PolarHBondContact O-N 2.97Å; L110-L264 HydrophobicContact CD1-CB 3.9Å; L110-L264 HydrophobicContact CD1-CD1 4.09Å; L110-L264 HydrophobicContact CD1-CG 4.48Å
111	G	90.9	Very high	92.1	Very high	27 Å²	27	52.8 Å²	52.8	28%	0.278	28%	0.276	S	S	.	.			trans	73.5	-174.2	-176.4	0	0	0	0	0	113.7	R108 S109 Q152	R108-G111 PolarHBondContact O-N 3.43Å; S109-G111 PolarHBondContact O-N 3.32Å; G111-Q152 WeakPolarHBondContact O-CG 3.17Å; G111-Q152 PolarHBondContact O-NE2 3.09Å
112	I	89.2	Confident	91.6	Very high	69 Å²	69	61.4 Å²	61.4	35%	0.354	31%	0.313	S	S	.	.	S	Bend	trans	-82.3	-17.9	-178.7	58.8	167.6	0	0	0	113.3	F151 Q152 S155	I112-F151 HydrophobicContact CB-CB 3.98Å; I112-F151 HydrophobicContact CG2-CB 3.67Å; I112-F151 HydrophobicContact CG2-CD2 4.06Å; I112-F151 HydrophobicContact CG2-CG 4.18Å; I112-Q152 WeakPolarHBondContact O-CA 3.05Å; I112-S155 WeakPolarHBondContact O-CB 3.19Å; I112-S155 PolarHBondContact O-OG 3.37Å
113	E	90	Very high	90.5	Very high	119 Å²	119	65.4 Å²	65.4	56%	0.556	33%	0.332	S	S	*	.			trans	-129.7	128.9	-179	-74	-174.1	166.2	0	0	109.4	N159	E113-N159 PolarHBondContact OE1-ND2 2.9Å; E113-N159 VanDerWaalsContact OE1-ND2 3.1Å
114	R	92.9	Very high	89.4	Confident	68 Å²	68	66 Å²	66	26%	0.257	33%	0.334	S	S	.	.			trans	-147.1	156.1	170	69	178.5	-174	160.5	-1.6	110.5	E231 L264	R114-E231 WeakPolarHBondContact CG-OE2 3.46Å; R114-E231 IonicContact CZ-OE1 3.94Å; R114-E231 IonicContact CZ-OE2 2.65Å; R114-E231 IonicContact NE-OE1 3.57Å; R114-E231 PolarHBondContact NE-OE1 2.82Å; R114-E231 IonicContact NE-OE2 3.5Å; R114-E231 PolarHBondContact NE-OE2 3.21Å; R114-E231 IonicContact NH2-OE1 3.59Å; R114-E231 PolarHBondContact NH2-OE1 3.35Å; R114-E231 IonicContact NH2-OE2 3.25Å; R114-L264 VanDerWaalsContact CZ-O 3.3Å; R114-L264 PolarHBondContact NH1-O 3.13Å; R114-L264 PolarHBondContact NH2-O 3.16Å
115	E	92.4	Very high	88.2	Confident	168 Å²	168	72.5 Å²	72.5	79%	0.785	37%	0.368	S	S	*	.			trans	-83.2	137.9	168.7	-63.8	-160.6	144.7	0	0	110.5	R234	E115-R234 IonicContact OE1-NH2 2.75Å
116	V	95	Very high	87.2	Confident	24 Å²	24	76.4 Å²	76.4	15%	0.145	39%	0.385	C	S	.	.			trans	-109.2	148.2	172.9	-63.1	0	0	0	0	110.3	E231 Y266	V116-E231 HydrophobicContact CG1-CB 4.26Å; V116-E231 VanDerWaalsContact CG1-OE2 3.25Å; V116-E231 WeakPolarHBondContact CG1-OE2 3.12Å; V116-Y266 HydrophobicContact CB-CD2 3.84Å; V116-Y266 HydrophobicContact CB-CE2 4.27Å; V116-Y266 HydrophobicContact CB-CG 4.14Å; V116-Y266 HydrophobicContact CG1-CD2 3.76Å; V116-Y266 HydrophobicContact CG1-CE2 4.4Å; V116-Y266 HydrophobicContact CG1-CG 4.32Å; V116-Y266 HydrophobicContact CG2-CD2 4.36Å; V116-Y266 HydrophobicContact CG2-CE2 4.29Å
117	P	95.3	Very high	86.6	Confident	72 Å²	72	78 Å²	78	47%	0.468	39%	0.391	S	S	.	.			trans	-61.2	144.7	177.3	26.2	-34.8	0	0	0	111.4	T119 N233 Y266	P117-T119 HydrophobicContact CG-CG2 4.34Å; P117-T119 PolarHBondContact O-N 2.65Å; P117-N233 PolarHBondContact O-ND2 3.22Å; P117-Y266 HydrophobicContact CG-CD1 4.04Å; P117-Y266 HydrophobicContact CG-CG 4.41Å
118	D	93.9	Very high	86.3	Confident	80 Å²	80	86 Å²	86	43%	0.428	43%	0.428	S	S	.	.			trans	-74.9	95.3	171.7	-169.8	-14	0	0	0	109.6	R120	D118-R120 PolarHBondContact O-N 3.37Å; D118-R120 WeakPolarHBondContact OD1-CB 3.16Å; D118-R120 WeakPolarHBondContact OD1-CD 3.48Å; D118-R120 WeakPolarHBondContact OD1-CG 3.32Å; D118-R120 IonicContact OD1-CZ 2.79Å; D118-R120 PolarHBondContact OD1-N 2.99Å; D118-R120 IonicContact OD1-NE 2.95Å; D118-R120 PolarHBondContact OD1-NE 3.43Å; D118-R120 IonicContact OD1-NH2 2.87Å; D118-R120 IonicContact OD2-CZ 3.38Å; D118-R120 IonicContact OD2-NE 3.3Å; D118-R120 PolarHBondContact OD2-NE 3.48Å; D118-R120 IonicContact OD2-NH2 3.72Å; D118-R120 PolarHBondContact OD2-NH2 3.38Å
119	T	93.4	Very high	86.2	Confident	20 Å²	20	83.2 Å²	83.2	12%	0.123	42%	0.418	C	S	.	.			trans	-84.5	11.1	-177.3	50.6	0	0	0	0	113.7	P117 N233 D257 Y266 P268 R357	P117-T119 HydrophobicContact CG-CG2 4.34Å; P117-T119 PolarHBondContact O-N 2.65Å; T119-N233 PolarHBondContact OG1-ND2 3.31Å; T119-D257 WeakPolarHBondContact CB-OD2 3.38Å; T119-D257 PolarHBondContact OG1-OD2 2.73Å; T119-Y266 HydrophobicContact CG2-CD1 3.73Å; T119-Y266 HydrophobicContact CG2-CE1 3.46Å; T119-Y266 VanDerWaalsContact CG2-CE1 3.46Å; T119-P268 HydrophobicContact CG2-CB 3.83Å; T119-P268 HydrophobicContact CG2-CG 4.28Å; T119-R357 WeakPolarHBondContact O-CD 3.45Å; T119-R357 PolarHBondContact O-NE 2.92Å; T119-R357 WeakPolarHBondContact OG1-CD 3.43Å; T119-R357 PolarHBondContact OG1-NE 2.85Å
120	R	90.6	Very high	86.1	Confident	49 Å²	49	81.7 Å²	81.7	19%	0.185	41%	0.406	C	S	.	.	S	Bend	trans	-82.2	147.7	-174.3	-56.8	-170.7	-63.1	158.2	5.7	110.9	D118 R124 R234 V235 R357	D118-R120 PolarHBondContact O-N 3.37Å; D118-R120 WeakPolarHBondContact OD1-CB 3.16Å; D118-R120 WeakPolarHBondContact OD1-CD 3.48Å; D118-R120 WeakPolarHBondContact OD1-CG 3.32Å; D118-R120 IonicContact OD1-CZ 2.79Å; D118-R120 PolarHBondContact OD1-N 2.99Å; D118-R120 IonicContact OD1-NE 2.95Å; D118-R120 PolarHBondContact OD1-NE 3.43Å; D118-R120 IonicContact OD1-NH2 2.87Å; D118-R120 IonicContact OD2-CZ 3.38Å; D118-R120 IonicContact OD2-NE 3.3Å; D118-R120 PolarHBondContact OD2-NE 3.48Å; D118-R120 IonicContact OD2-NH2 3.72Å; D118-R120 PolarHBondContact OD2-NH2 3.38Å; R120-R124 VanDerWaalsContact CA-CZ 3.5Å; R120-R234 VanDerWaalsContact CD-O 3.22Å; R120-R234 WeakPolarHBondContact CD-O 3.5Å; R120-R234 VanDerWaalsContact CZ-O 3.27Å; R120-R234 PolarHBondContact NE-O 2.78Å; R120-R234 PolarHBondContact NH1-O 2.9Å; R120-V235 VanDerWaalsContact NH1-CB 3.27Å; R120-V235 VanDerWaalsContact NH1-CG2 3.25Å; R120-R357 HydrophobicContact CG-CG 4.46Å
121	S	85.6	Confident	85.8	Confident	41 Å²	41	82.8 Å²	82.8	29%	0.287	42%	0.424	S	S	.	.			trans	-63.4	139.7	175.4	172.1	0	0	0	0	111.4	M123 R124 S298	S121-M123 PolarHBondContact O-N 3.48Å; S121-M123 PolarHBondContact OG-N 3.03Å; S121-R124 WeakPolarHBondContact O-CB 3.37Å; S121-R124 VanDerWaalsContact O-CG 3.24Å; S121-R124 WeakPolarHBondContact O-CG 3.43Å; S121-R124 PolarHBondContact O-N 2.93Å; S121-S298 PolarHBondContact OG-OG 3.01Å
122	K	81.7	Confident	85.9	Confident	186 Å²	186	93 Å²	93	81%	0.809	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-60	-29.6	178.6	-67	-175	179.4	-179.8	0	113.3	R124 L125	K122-R124 PolarHBondContact O-N 3.02Å; K122-L125 PolarHBondContact O-N 3.1Å
123	M	71.3	Confident	86.2	Confident	83 Å²	83	90.7 Å²	90.7	41%	0.409	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-60.4	-17.6	176.2	-67	-178	73.1	0	0	112.7	S121 L125 Q126 T299	S121-M123 PolarHBondContact O-N 3.48Å; S121-M123 PolarHBondContact OG-N 3.03Å; M123-L125 VanDerWaalsContact C-N 3.31Å; M123-L125 PolarHBondContact O-N 3.5Å; M123-Q126 PolarHBondContact O-N 2.87Å; M123-T299 HydrophobicContact CB-CG2 3.86Å
124	R	70.3	Confident	86.6	Confident	17 Å²	17	86.4 Å²	86.4	6%	0.064	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-72.1	-21.9	178.9	-62.6	-140.9	-74.3	-104.4	31	115	R120 S121 K122 Q126 K127 T299 P354 C355	R120-R124 VanDerWaalsContact CA-CZ 3.5Å; S121-R124 WeakPolarHBondContact O-CB 3.37Å; S121-R124 VanDerWaalsContact O-CG 3.24Å; S121-R124 WeakPolarHBondContact O-CG 3.43Å; S121-R124 PolarHBondContact O-N 2.93Å; K122-R124 PolarHBondContact O-N 3.02Å; R124-Q126 PolarHBondContact O-N 2.8Å; R124-K127 PolarHBondContact O-N 3.48Å; R124-T299 HydrophobicContact CG-CG2 3.81Å; R124-P354 PolarHBondContact NH1-O 2.95Å; R124-P354 PolarHBondContact NH2-O 3.21Å; R124-C355 VanDerWaalsContact CD-CB 3.44Å; R124-C355 WeakPolarHBondContact CD-SG 3.3Å; R124-C355 VanDerWaalsContact CZ-O 3.29Å; R124-C355 PolarHBondContact NE-O 3.17Å; R124-C355 PolarHBondContact NH2-O 2.9Å
125	L	67	Low	86.9	Confident	137 Å²	137	84.8 Å²	84.8	72%	0.717	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-60.4	-14.5	175.9	-63.6	173.9	0	0	0	112.3	K122 M123	K122-L125 PolarHBondContact O-N 3.1Å; M123-L125 VanDerWaalsContact C-N 3.31Å; M123-L125 PolarHBondContact O-N 3.5Å
126	Q	69.3	Low	87.2	Confident	154 Å²	154	76.8 Å²	76.8	72%	0.72	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-92.4	-8.6	176.7	-57.9	176.5	-1.1	0	0	113.4	M123 R124	M123-Q126 PolarHBondContact O-N 2.87Å; R124-Q126 PolarHBondContact O-N 2.8Å
127	K	80.3	Confident	87.3	Confident	61 Å²	61	75.6 Å²	75.6	27%	0.265	38%	0.378	S	S	.	.			trans	-89.3	121.4	178.4	-74.8	-164.2	168	-174.4	0	110.2	R124 E296 T299	R124-K127 PolarHBondContact O-N 3.48Å; K127-E296 IonicContact NZ-OE2 3.65Å; K127-E296 PolarHBondContact NZ-OE2 3.13Å; K127-T299 WeakPolarHBondContact CE-OG1 3.33Å; K127-T299 PolarHBondContact NZ-O 3.45Å; K127-T299 PolarHBondContact NZ-OG1 2.95Å; K127-T299 VanDerWaalsContact NZ-OG1 3.12Å
128	H	86.2	Confident	87.5	Confident	168 Å²	168	72.2 Å²	72.2	78%	0.778	36%	0.355	S	S	*	.			trans	-103.3	135.1	172.1	-65.1	-75.6	0	0	0	110.4
129	Y	90.8	Very high	87.7	Confident	58 Å²	58	68.4 Å²	68.4	23%	0.227	34%	0.335	C	S	.	.			trans	-106.2	142.3	175.5	-59	-71.4	0	0	0	109.6	V235 E238 P239 H242 C355	Y129-V235 HydrophobicContact CD2-CG1 4.04Å; Y129-V235 HydrophobicContact CE2-CG1 3.97Å; Y129-E238 HydrophobicContact CD2-CB 3.93Å; Y129-E238 HydrophobicContact CG-CB 3.97Å; Y129-P239 HydrophobicContact CE1-CB 4Å; Y129-P239 HydrophobicContact CE1-CG 4.23Å; Y129-P239 HydrophobicContact CE2-CG 3.92Å; Y129-P239 WeakPolarHBondContact OH-CB 3.4Å; Y129-P239 WeakPolarHBondContact OH-CG 3.47Å; Y129-H242 HydrophobicContact CD1-CB 3.74Å; Y129-H242 AromaticContact CD1-CD2 3.81Å; Y129-H242 AromaticContact CD1-CG 3.85Å; Y129-H242 HydrophobicContact CE1-CB 4.22Å; Y129-C355 WeakPolarHBondContact OH-CB 3.16Å
130	P	90.6	Very high	88	Confident	57 Å²	57	67.5 Å²	67.5	37%	0.37	33%	0.329	S	S	.	.			trans	-66.2	147.7	178.8	27.9	-32.7	0	0	0	110.5	R132 L133 H242	P130-R132 PolarHBondContact O-N 2.89Å; P130-L133 HydrophobicContact CG-CD2 3.65Å; P130-L133 HydrophobicContact CG-CG 4.07Å; P130-H242 WeakPolarHBondContact CD-ND1 3.31Å
131	A	86	Confident	88.4	Confident	81 Å²	81	65.6 Å²	65.6	67%	0.669	32%	0.324	S	S	*	.	S	Bend	trans	-67.8	-25.3	178.3	0	0	0	0	0	112.9
132	R	91.7	Very high	88.9	Confident	240 Å²	240	64 Å²	64	91%	0.906	31%	0.311	S	S	*	.			trans	-100.2	100.5	176.8	-65.6	-175.8	-177	179.1	0.9	109.4	P130	P130-R132 PolarHBondContact O-N 2.89Å
133	L	96.8	Very high	89.6	Confident	21 Å²	21	58.8 Å²	58.8	11%	0.11	29%	0.288	C	S	.	.			trans	-124.6	160.6	170.4	-67.6	170.8	0	0	0	108.9	P130 F165 E238 L241 H242 A245	P130-L133 HydrophobicContact CG-CD2 3.65Å; P130-L133 HydrophobicContact CG-CG 4.07Å; L133-F165 HydrophobicContact CB-CD1 4.08Å; L133-F165 HydrophobicContact CB-CE1 3.54Å; L133-F165 HydrophobicContact CB-CZ 4.1Å; L133-F165 HydrophobicContact CD1-CE1 4.15Å; L133-F165 HydrophobicContact CD1-CE2 4.47Å; L133-F165 HydrophobicContact CD1-CZ 3.82Å; L133-F165 HydrophobicContact CG-CE1 4.12Å; L133-F165 HydrophobicContact CG-CZ 4.2Å; L133-E238 HydrophobicContact CD1-CB 4.32Å; L133-L241 HydrophobicContact CB-CB 4.03Å; L133-L241 HydrophobicContact CB-CD1 4.32Å; L133-L241 HydrophobicContact CD1-CB 4.01Å; L133-L241 HydrophobicContact CG-CB 4.44Å; L133-H242 HydrophobicContact CD1-CB 4.37Å; L133-H242 HydrophobicContact CD2-CB 4.05Å; L133-A245 HydrophobicContact CD2-CB 4.05Å
134	P	97.9	Very high	90.7	Very high	30 Å²	30	56.9 Å²	56.9	20%	0.195	28%	0.279	C	S	.	.			trans	-58.6	151.1	176.3	-20.4	31.7	0	0	0	112.1	D221 V222 L241 A245	P134-D221 WeakPolarHBondContact CA-OD2 3.45Å; P134-D221 HydrophobicContact CB-CB 3.55Å; P134-V222 HydrophobicContact CB-CG2 3.98Å; P134-L241 WeakPolarHBondContact O-CD1 3.25Å; P134-A245 HydrophobicContact CG-CB 4.18Å
135	T	98.3	Very high	91.8	Very high	33 Å²	33	56.4 Å²	56.4	20%	0.202	28%	0.278	C	S	.	.			trans	-77.2	156.5	175.3	65.7	0	0	0	0	111.6	F165 G220 D221 V222	T135-F165 CarbonylContact C-O 3.56Å; T135-F165 WeakPolarHBondContact CA-O 3.25Å; T135-G220 WeakPolarHBondContact OG1-CA 3.28Å; T135-D221 PolarHBondContact N-OD2 2.75Å; T135-D221 WeakPolarHBondContact O-CB 3.44Å; T135-D221 PolarHBondContact O-N 2.77Å; T135-D221 PolarHBondContact OG1-N 3.2Å; T135-V222 PolarHBondContact O-N 3.29Å
136	A	98.6	Very high	93.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.2	-179.4	0	0	0	0	0	112.7	F165 E167 V222 V224 L237 L241	A136-F165 PolarHBondContact N-O 2.48Å; A136-E167 WeakPolarHBondContact O-CB 3.14Å; A136-E167 PolarHBondContact O-N 3.36Å; A136-V222 CarbonylContact C-O 3.44Å; A136-V222 VanDerWaalsContact CA-O 3.3Å; A136-V222 WeakPolarHBondContact CA-O 3.39Å; A136-V224 HydrophobicContact CB-CG2 3.89Å; A136-L237 HydrophobicContact CB-CD1 4.3Å; A136-L237 HydrophobicContact CB-CD2 4.05Å; A136-L241 HydrophobicContact CB-CD2 4.26Å
137	S	98.8	Very high	94.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.5	160.6	-60.5	0	0	0	0	108.7	E168 S219 G220 V222 V224	S137-E168 WeakPolarHBondContact CA-O 3.33Å; S137-E168 WeakPolarHBondContact OG-CG 3.19Å; S137-E168 PolarHBondContact OG-OE1 2.84Å; S137-S219 PolarHBondContact OG-N 2.88Å; S137-G220 WeakPolarHBondContact OG-CA 3.33Å; S137-G220 PolarHBondContact OG-N 3.4Å; S137-V222 PolarHBondContact N-O 3.06Å; S137-V224 PolarHBondContact O-N 2.88Å
138	I	98.8	Very high	94.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	117.9	179.5	-62.8	177.2	0	0	0	108.6	I140 V157 L166 E168 I169 I170 V224 L226 W236	I138-I140 HydrophobicContact CG2-CD1 4.15Å; I138-I140 HydrophobicContact CG2-CG1 4.08Å; I138-V157 HydrophobicContact CD1-CG1 3.26Å; I138-L166 HydrophobicContact CD1-CD1 3.55Å; I138-L166 HydrophobicContact CG1-CD1 3.97Å; I138-E168 PolarHBondContact N-O 3.02Å; I138-I169 HydrophobicContact CB-CG1 4.48Å; I138-I169 CarbonylContact O-C 3.55Å; I138-I169 WeakPolarHBondContact O-CA 3.36Å; I138-I170 PolarHBondContact O-N 2.82Å; I138-V224 CarbonylContact C-O 3.5Å; I138-V224 WeakPolarHBondContact CA-O 3.37Å; I138-V224 HydrophobicContact CG1-CB 4.2Å; I138-L226 HydrophobicContact CG2-CD1 3.76Å; I138-L226 HydrophobicContact CG2-CG 4.45Å; I138-W236 HydrophobicContact CD1-CH2 4.13Å; I138-W236 HydrophobicContact CD1-CZ2 3.83Å
139	V	98.8	Very high	95.2	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117	-178.3	-178.3	0	0	0	0	109.5	I170 V172 V224 F225 L226	V139-I170 WeakPolarHBondContact CA-O 3.49Å; V139-I170 HydrophobicContact CG2-CB 4.45Å; V139-V172 HydrophobicContact CG1-CG2 4.35Å; V139-V224 PolarHBondContact N-O 2.81Å; V139-F225 HydrophobicContact CB-CD1 3.84Å; V139-F225 HydrophobicContact CB-CE1 4.01Å; V139-F225 HydrophobicContact CG1-CD1 4.03Å; V139-F225 HydrophobicContact CG1-CE1 4.04Å; V139-F225 HydrophobicContact CG2-CE1 4.35Å; V139-F225 WeakPolarHBondContact O-CA 3.35Å; V139-L226 PolarHBondContact O-N 3.23Å
140	I	98.6	Very high	95.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	112.8	178.5	-60	162	0	0	0	108.4	I138 L150 T153 I169 I170 L171 V172 L226	I138-I140 HydrophobicContact CG2-CD1 4.15Å; I138-I140 HydrophobicContact CG2-CG1 4.08Å; I140-L150 HydrophobicContact CG2-CD1 4.18Å; I140-T153 HydrophobicContact CD1-CG2 4.1Å; I140-I169 HydrophobicContact CD1-CG2 3.99Å; I140-I170 PolarHBondContact N-O 2.84Å; I140-L171 HydrophobicContact CB-CD2 3.87Å; I140-L171 HydrophobicContact CD1-CD2 4.04Å; I140-L171 HydrophobicContact CG2-CD2 4.29Å; I140-L171 CarbonylContact O-C 3.52Å; I140-L171 WeakPolarHBondContact O-CA 3.44Å; I140-V172 PolarHBondContact O-N 3.41Å; I140-L226 WeakPolarHBondContact CA-O 3.19Å; I140-L226 HydrophobicContact CG1-CB 3.91Å
141	C	98.1	Very high	95.6	Very high	10 Å²	10	28.6 Å²	28.6	7%	0.068	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	139.6	175.8	-56	0	0	0	0	109.9	V172 L207 A210 R211	C141-V172 WeakPolarHBondContact CA-O 3.31Å; C141-V172 HydrophobicContact CB-CB 4.44Å; C141-L207 HydrophobicContact CB-CD1 3.84Å; C141-A210 HydrophobicContact CB-CB 4.04Å; C141-A210 VanDerWaalsContact SG-C 3.54Å; C141-R211 VanDerWaalsContact SG-CG 3.55Å
142	F	97.3	Very high	96	Very high	6 Å²	6	25 Å²	25	3%	0.026	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	153.1	-179.8	68.4	-83.8	0	0	0	112.4	E145 L150 L171 V172 D173 D174 L181 L185 I198	F142-E145 HydrophobicContact CB-CB 3.99Å; F142-E145 HydrophobicContact CD2-CB 4.47Å; F142-L150 HydrophobicContact CD1-CD2 4.4Å; F142-L150 HydrophobicContact CD2-CD2 4.3Å; F142-L150 HydrophobicContact CE1-CD2 4.42Å; F142-L150 HydrophobicContact CE2-CD2 4.3Å; F142-L150 HydrophobicContact CG-CD2 4.33Å; F142-L150 HydrophobicContact CZ-CD2 4.34Å; F142-L171 HydrophobicContact CE1-CB 4.04Å; F142-V172 WeakPolarHBondContact CD1-O 3.25Å; F142-V172 PolarHBondContact N-O 2.91Å; F142-D173 HydrophobicContact CE1-CB 3.89Å; F142-D173 HydrophobicContact CE2-CB 3.86Å; F142-D173 HydrophobicContact CZ-CB 3.43Å; F142-D173 VanDerWaalsContact CZ-CB 3.43Å; F142-D174 PolarHBondContact O-N 2.63Å; F142-L181 HydrophobicContact CD2-CD1 4.08Å; F142-L181 HydrophobicContact CE2-CB 4.25Å; F142-L181 HydrophobicContact CE2-CD1 4.06Å; F142-L181 HydrophobicContact CE2-CD2 4.21Å; F142-L181 HydrophobicContact CE2-CG 4.42Å; F142-L185 HydrophobicContact CE2-CD2 4.16Å; F142-L185 HydrophobicContact CZ-CD2 3.68Å; F142-I198 HydrophobicContact CZ-CD1 4.41Å
143	Y	95.3	Very high	96.2	Very high	78 Å²	78	13.5 Å²	13.5	31%	0.306	7%	0.07	S	C	.	.	S	Bend	trans	-147.7	115.2	173.3	169.6	-105.3	0	0	0	108.9	E145 D174 M175 S176 R204	Y143-E145 PolarHBondContact O-N 3.45Å; Y143-E145 VanDerWaalsContact O-N 3.16Å; Y143-D174 VanDerWaalsContact CD2-O 3.23Å; Y143-D174 WeakPolarHBondContact CD2-O 3.33Å; Y143-M175 WeakPolarHBondContact CE2-O 3.43Å; Y143-S176 WeakPolarHBondContact CA-OG 3.39Å; Y143-R204 HydrophobicContact CD2-CG 4.5Å; Y143-R204 HydrophobicContact CE2-CG 4.37Å
144	N	94.3	Very high	96.1	Very high	43 Å²	43	12.5 Å²	12.5	23%	0.23	7%	0.065	C	C	.	.	S	Bend	trans	50.3	35.8	-176.2	-62.7	-20.6	0	0	0	113.2	Y100 S176 K177 V178	Y100-N144 WeakPolarHBondContact CE1-O 3.32Å; N144-S176 PolarHBondContact N-OG 3.18Å; N144-S176 WeakPolarHBondContact OD1-CA 3.23Å; N144-K177 PolarHBondContact OD1-N 3.22Å; N144-V178 HydrophobicContact CB-CG2 4.01Å
145	E	95.4	Very high	95.9	Very high	7 Å²	7	11.2 Å²	11.2	3%	0.033	6%	0.056	C	C	.	.			trans	-66.6	150.3	176.6	-171.1	58.6	-96	0	0	110.9	F142 Y143 C147 L150 L181 S228 H229 K363	F142-E145 HydrophobicContact CB-CB 3.99Å; F142-E145 HydrophobicContact CD2-CB 4.47Å; Y143-E145 PolarHBondContact O-N 3.45Å; Y143-E145 VanDerWaalsContact O-N 3.16Å; E145-C147 PolarHBondContact O-N 3.5Å; E145-L150 HydrophobicContact CG-CB 4.16Å; E145-L181 WeakPolarHBondContact O-CD1 3.29Å; E145-S228 PolarHBondContact OE2-OG 3.38Å; E145-H229 IonicContact OE1-ND1 2.98Å; E145-H229 IonicContact OE2-CE1 3.6Å; E145-H229 IonicContact OE2-CG 3.95Å; E145-H229 IonicContact OE2-ND1 3.61Å; E145-H229 PolarHBondContact OE2-ND1 2.99Å; E145-K363 IonicContact OE1-NZ 3.33Å; E145-K363 PolarHBondContact OE1-NZ 2.98Å; E145-K363 IonicContact OE2-NZ 2.64Å; E145-K363 PolarHBondContact OE2-NZ 2.88Å
146	E	93.8	Very high	95.9	Very high	4 Å²	4	10.4 Å²	10.4	2%	0.019	5%	0.052	C	C	.	.			trans	-69	132.9	171.6	-158.5	-72.5	145.5	0	0	109.3	Y100 F102 V104 R108 N148 A149 L150	Y100-E146 HydrophobicContact CD1-CB 3.69Å; Y100-E146 HydrophobicContact CD1-CG 4.21Å; Y100-E146 HydrophobicContact CD2-CG 4.29Å; Y100-E146 HydrophobicContact CE1-CB 3.89Å; Y100-E146 HydrophobicContact CE1-CG 4.22Å; Y100-E146 HydrophobicContact CE2-CG 4.24Å; Y100-E146 HydrophobicContact CG-CB 4.06Å; Y100-E146 HydrophobicContact CG-CG 4.22Å; F102-E146 HydrophobicContact CE1-CB 4.15Å; F102-E146 HydrophobicContact CZ-CB 3.6Å; F102-E146 HydrophobicContact CZ-CG 4.07Å; V104-E146 HydrophobicContact CB-CG 4.42Å; V104-E146 HydrophobicContact CG1-CG 3.7Å; V104-E146 HydrophobicContact CG2-CG 3.89Å; R108-E146 IonicContact NE-OE1 3.36Å; R108-E146 IonicContact NH2-OE1 3.25Å; E146-N148 PolarHBondContact O-N 3.13Å; E146-N148 VanDerWaalsContact OE2-CA 3.3Å; E146-N148 WeakPolarHBondContact OE2-CA 3.48Å; E146-N148 VanDerWaalsContact OE2-CB 3.26Å; E146-N148 WeakPolarHBondContact OE2-CB 3.46Å; E146-N148 PolarHBondContact OE2-N 2.72Å; E146-A149 HydrophobicContact CB-CB 4.34Å; E146-A149 PolarHBondContact O-N 2.9Å; E146-A149 PolarHBondContact OE2-N 3.29Å; E146-L150 PolarHBondContact O-N 3.3Å; E146-L150 VanDerWaalsContact O-N 3.09Å
147	C	91.9	Very high	95.7	Very high	10 Å²	10	10.4 Å²	10.4	7%	0.068	5%	0.052	C	C	.	.	H	α-helix	trans	-63.6	-41.8	-167	-161.6	0	0	0	0	112.7	E145 L150 F151 D180	E145-C147 PolarHBondContact O-N 3.5Å; C147-L150 PolarHBondContact O-N 3.47Å; C147-F151 WeakPolarHBondContact O-CD2 3.48Å; C147-F151 WeakPolarHBondContact O-CG 3.48Å; C147-F151 PolarHBondContact O-N 3.14Å; C147-F151 WeakPolarHBondContact SG-CE2 3.38Å; C147-D180 HydrophobicContact CB-CB 4.41Å
148	N	92.4	Very high	95.5	Very high	31 Å²	31	11.9 Å²	11.9	17%	0.166	6%	0.061	C	C	.	.	H	α-helix	trans	-68.6	-39.6	177.5	-83.5	32.6	0	0	0	112	S107 R108 E146 L150 F151 Q152	S107-N148 PolarHBondContact O-ND2 2.9Å; R108-N148 WeakPolarHBondContact CA-ND2 3.28Å; E146-N148 PolarHBondContact O-N 3.13Å; E146-N148 VanDerWaalsContact OE2-CA 3.3Å; E146-N148 WeakPolarHBondContact OE2-CA 3.48Å; E146-N148 VanDerWaalsContact OE2-CB 3.26Å; E146-N148 WeakPolarHBondContact OE2-CB 3.46Å; E146-N148 PolarHBondContact OE2-N 2.72Å; N148-L150 VanDerWaalsContact C-N 3.32Å; N148-L150 PolarHBondContact O-N 3.39Å; N148-F151 PolarHBondContact O-N 3.39Å; N148-Q152 WeakPolarHBondContact O-CB 3.45Å; N148-Q152 VanDerWaalsContact O-CG 3.28Å; N148-Q152 WeakPolarHBondContact O-CG 3.41Å; N148-Q152 PolarHBondContact O-N 3.24Å
149	A	95.1	Very high	95.3	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-61.6	-40	175.4	0	0	0	0	0	112.3	F102 E146 Q152 T153 S228 H229 I361	F102-A149 HydrophobicContact CE2-CB 4.39Å; F102-A149 HydrophobicContact CZ-CB 3.75Å; E146-A149 HydrophobicContact CB-CB 4.34Å; E146-A149 PolarHBondContact O-N 2.9Å; E146-A149 PolarHBondContact OE2-N 3.29Å; A149-Q152 PolarHBondContact O-N 3.32Å; A149-T153 PolarHBondContact O-N 3.16Å; A149-T153 PolarHBondContact O-OG1 3.26Å; A149-S228 CarbonylContact C-O 3.41Å; A149-H229 HydrophobicContact CB-CB 4.31Å; A149-I361 HydrophobicContact CB-CD1 4.27Å
150	L	95.7	Very high	95.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.2	-45.9	173.3	179.1	61.5	0	0	0	111.2	I140 F142 E145 E146 C147 N148 T153 M154 L181 L185 S228	I140-L150 HydrophobicContact CG2-CD1 4.18Å; F142-L150 HydrophobicContact CD1-CD2 4.4Å; F142-L150 HydrophobicContact CD2-CD2 4.3Å; F142-L150 HydrophobicContact CE1-CD2 4.42Å; F142-L150 HydrophobicContact CE2-CD2 4.3Å; F142-L150 HydrophobicContact CG-CD2 4.33Å; F142-L150 HydrophobicContact CZ-CD2 4.34Å; E145-L150 HydrophobicContact CG-CB 4.16Å; E146-L150 PolarHBondContact O-N 3.3Å; E146-L150 VanDerWaalsContact O-N 3.09Å; C147-L150 PolarHBondContact O-N 3.47Å; N148-L150 VanDerWaalsContact C-N 3.32Å; N148-L150 PolarHBondContact O-N 3.39Å; L150-T153 WeakPolarHBondContact O-CB 3.44Å; L150-T153 PolarHBondContact O-N 3.04Å; L150-M154 WeakPolarHBondContact O-CG 3.32Å; L150-M154 PolarHBondContact O-N 2.87Å; L150-L181 HydrophobicContact CD2-CD2 4.04Å; L150-L185 HydrophobicContact CD2-CD1 4.11Å; L150-L185 HydrophobicContact CD2-CD2 4.13Å; L150-S228 WeakPolarHBondContact CA-O 3.43Å
151	F	93.5	Very high	95	Very high	5 Å²	5	19 Å²	19	2%	0.022	10%	0.099	C	C	.	.	H	α-helix	trans	-66.7	-36.3	177.8	-71.1	-48.4	0	0	0	113.6	I112 C147 N148 T153 M154 S155 L185 H188 F192	I112-F151 HydrophobicContact CB-CB 3.98Å; I112-F151 HydrophobicContact CG2-CB 3.67Å; I112-F151 HydrophobicContact CG2-CD2 4.06Å; I112-F151 HydrophobicContact CG2-CG 4.18Å; C147-F151 WeakPolarHBondContact O-CD2 3.48Å; C147-F151 WeakPolarHBondContact O-CG 3.48Å; C147-F151 PolarHBondContact O-N 3.14Å; C147-F151 WeakPolarHBondContact SG-CE2 3.38Å; N148-F151 PolarHBondContact O-N 3.39Å; F151-T153 VanDerWaalsContact C-N 3.3Å; F151-T153 PolarHBondContact O-N 2.84Å; F151-M154 PolarHBondContact O-N 3.44Å; F151-S155 VanDerWaalsContact O-CB 3.29Å; F151-S155 WeakPolarHBondContact O-CB 3.43Å; F151-S155 PolarHBondContact O-N 3.38Å; F151-S155 PolarHBondContact O-OG 2.88Å; F151-L185 HydrophobicContact CE1-CD1 3.52Å; F151-L185 HydrophobicContact CZ-CD1 3.7Å; F151-H188 HydrophobicContact CE1-CB 3.49Å; F151-H188 VanDerWaalsContact CE1-CB 3.49Å; F151-H188 HydrophobicContact CE2-CB 4.29Å; F151-H188 HydrophobicContact CZ-CB 3.33Å; F151-H188 AromaticContact CZ-CG 3.56Å; F151-F192 HydrophobicContact CD1-CE2 4.22Å; F151-F192 HydrophobicContact CD1-CZ 4.46Å
152	Q	94.8	Very high	94.8	Very high	4 Å²	4	19.9 Å²	19.9	2%	0.019	11%	0.105	C	C	.	.	H	α-helix	trans	-61.5	-41.7	172.6	-76.3	173.2	-12.4	0	0	110.9	S107 G111 I112 N148 A149 S155 S156 E231	S107-Q152 PolarHBondContact O-NE2 3.38Å; G111-Q152 WeakPolarHBondContact O-CG 3.17Å; G111-Q152 PolarHBondContact O-NE2 3.09Å; I112-Q152 WeakPolarHBondContact O-CA 3.05Å; N148-Q152 WeakPolarHBondContact O-CB 3.45Å; N148-Q152 VanDerWaalsContact O-CG 3.28Å; N148-Q152 WeakPolarHBondContact O-CG 3.41Å; N148-Q152 PolarHBondContact O-N 3.24Å; A149-Q152 PolarHBondContact O-N 3.32Å; Q152-S155 PolarHBondContact O-N 3.45Å; Q152-S156 WeakPolarHBondContact O-CB 3.39Å; Q152-S156 PolarHBondContact O-N 2.95Å; Q152-S156 PolarHBondContact O-OG 3.42Å; Q152-E231 HydrophobicContact CB-CG 4.45Å
153	T	96.9	Very high	94.6	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-51.5	173.9	-52.3	0	0	0	0	111.2	I140 A149 L150 F151 S155 S156 V157 S228 H229 C230	I140-T153 HydrophobicContact CD1-CG2 4.1Å; A149-T153 PolarHBondContact O-N 3.16Å; A149-T153 PolarHBondContact O-OG1 3.26Å; L150-T153 WeakPolarHBondContact O-CB 3.44Å; L150-T153 PolarHBondContact O-N 3.04Å; F151-T153 VanDerWaalsContact C-N 3.3Å; F151-T153 PolarHBondContact O-N 2.84Å; T153-S155 PolarHBondContact O-N 3.24Å; T153-S156 PolarHBondContact O-N 2.79Å; T153-S156 PolarHBondContact O-OG 2.81Å; T153-V157 WeakPolarHBondContact O-CG2 3.33Å; T153-V157 PolarHBondContact O-N 2.95Å; T153-V157 VanDerWaalsContact O-N 3.1Å; T153-S228 VanDerWaalsContact OG1-C 3.29Å; T153-S228 PolarHBondContact OG1-O 3.18Å; T153-H229 WeakPolarHBondContact OG1-CA 3.34Å; T153-H229 PolarHBondContact OG1-N 3.04Å; T153-C230 WeakPolarHBondContact CA-O 3.42Å; T153-C230 WeakPolarHBondContact CB-O 2.71Å; T153-C230 HydrophobicContact CG2-CB 4.1Å; T153-C230 PolarHBondContact OG1-N 2.86Å; T153-C230 PolarHBondContact OG1-O 2.96Å
154	M	94.6	Very high	94.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-43.6	178.9	-73.4	-169.7	57.5	0	0	113.6	L150 F151 V157 T158 L171 L189 F192 V196	L150-M154 WeakPolarHBondContact O-CG 3.32Å; L150-M154 PolarHBondContact O-N 2.87Å; F151-M154 PolarHBondContact O-N 3.44Å; M154-V157 PolarHBondContact O-N 3.21Å; M154-T158 WeakPolarHBondContact O-CB 3.26Å; M154-T158 PolarHBondContact O-N 3Å; M154-T158 PolarHBondContact O-OG1 3Å; M154-L171 HydrophobicContact CE-CD1 4.21Å; M154-L171 HydrophobicContact CG-CD2 4.31Å; M154-L171 HydrophobicContact SD-CD1 3.58Å; M154-L171 VanDerWaalsContact SD-CD1 3.58Å; M154-L171 HydrophobicContact SD-CD2 4.19Å; M154-L171 HydrophobicContact SD-CG 4.45Å; M154-L189 HydrophobicContact CE-CD2 3.43Å; M154-L189 VanDerWaalsContact CE-CD2 3.43Å; M154-L189 HydrophobicContact SD-CD2 3.49Å; M154-L189 WeakPolarHBondContact SD-CD2 3.44Å; M154-F192 HydrophobicContact CB-CE1 3.99Å; M154-F192 HydrophobicContact CB-CZ 4.06Å; M154-F192 HydrophobicContact CE-CB 4.22Å; M154-F192 HydrophobicContact CE-CD1 3.92Å; M154-F192 HydrophobicContact CE-CD2 3.63Å; M154-F192 HydrophobicContact CE-CE1 4.15Å; M154-F192 HydrophobicContact CE-CE2 3.86Å; M154-F192 HydrophobicContact CE-CG 3.65Å; M154-F192 HydrophobicContact CE-CZ 4.11Å; M154-V196 HydrophobicContact CE-CG1 3.92Å; M154-V196 HydrophobicContact CE-CG2 3.86Å
155	S	93.9	Very high	94.6	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-69	-42	-177.6	-52.7	0	0	0	0	110.8	I112 F151 Q152 T153 V157 T158 N159	I112-S155 WeakPolarHBondContact O-CB 3.19Å; I112-S155 PolarHBondContact O-OG 3.37Å; F151-S155 VanDerWaalsContact O-CB 3.29Å; F151-S155 WeakPolarHBondContact O-CB 3.43Å; F151-S155 PolarHBondContact O-N 3.38Å; F151-S155 PolarHBondContact O-OG 2.88Å; Q152-S155 PolarHBondContact O-N 3.45Å; T153-S155 PolarHBondContact O-N 3.24Å; S155-V157 VanDerWaalsContact C-N 3.35Å; S155-V157 PolarHBondContact O-N 3.07Å; S155-T158 PolarHBondContact O-N 2.77Å; S155-N159 WeakPolarHBondContact O-CB 3.42Å; S155-N159 PolarHBondContact O-N 2.99Å; S155-N159 PolarHBondContact O-ND2 2.67Å
156	S	96.2	Very high	94.6	Very high	16 Å²	16	27.5 Å²	27.5	11%	0.112	14%	0.137	C	C	.	.	H	α-helix	trans	-60.3	-45.1	174.8	71.6	0	0	0	0	111.5	Q152 T153 L160 V232	Q152-S156 WeakPolarHBondContact O-CB 3.39Å; Q152-S156 PolarHBondContact O-N 2.95Å; Q152-S156 PolarHBondContact O-OG 3.42Å; T153-S156 PolarHBondContact O-N 2.79Å; T153-S156 PolarHBondContact O-OG 2.81Å; S156-L160 VanDerWaalsContact O-CB 3.25Å; S156-L160 WeakPolarHBondContact O-CB 3.48Å; S156-L160 WeakPolarHBondContact O-CG 3.2Å; S156-L160 PolarHBondContact O-N 2.76Å; S156-V232 VanDerWaalsContact C-CG2 3.5Å; S156-V232 WeakPolarHBondContact O-CG2 3.12Å; S156-V232 PolarHBondContact OG-N 2.89Å
157	V	96.4	Very high	94.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.9	-48.2	176.4	168.1	0	0	0	0	111.1	I138 T153 M154 S155 T161 I169 L226 V232 W236	I138-V157 HydrophobicContact CD1-CG1 3.26Å; T153-V157 WeakPolarHBondContact O-CG2 3.33Å; T153-V157 PolarHBondContact O-N 2.95Å; T153-V157 VanDerWaalsContact O-N 3.1Å; M154-V157 PolarHBondContact O-N 3.21Å; S155-V157 VanDerWaalsContact C-N 3.35Å; S155-V157 PolarHBondContact O-N 3.07Å; V157-T161 WeakPolarHBondContact O-CB 3.35Å; V157-T161 PolarHBondContact O-N 2.8Å; V157-T161 VanDerWaalsContact O-N 3.14Å; V157-T161 PolarHBondContact O-OG1 2.82Å; V157-I169 HydrophobicContact CG1-CD1 3.72Å; V157-I169 HydrophobicContact CG1-CG1 4.23Å; V157-L226 HydrophobicContact CG2-CD1 3.65Å; V157-V232 HydrophobicContact CG2-CG1 3.9Å; V157-V232 HydrophobicContact CG2-CG2 4.4Å; V157-W236 HydrophobicContact CG2-CZ2 4.36Å
158	T	93.9	Very high	95	Very high	31 Å²	31	30.9 Å²	30.9	19%	0.19	15%	0.151	C	C	.	.	H	α-helix	trans	-65.6	-41.6	-176.6	-57	0	0	0	0	111.7	M154 S155 F192	M154-T158 WeakPolarHBondContact O-CB 3.26Å; M154-T158 PolarHBondContact O-N 3Å; M154-T158 PolarHBondContact O-OG1 3Å; S155-T158 PolarHBondContact O-N 2.77Å; T158-F192 HydrophobicContact CG2-CD1 4.33Å
159	N	93.8	Very high	95.2	Very high	98 Å²	98	29.5 Å²	29.5	52%	0.524	14%	0.144	S	C	.	.	H	α-helix	trans	-81.1	-29.1	-174.3	-67.3	-17.3	0	0	0	112.9	E113 S155	E113-N159 PolarHBondContact OE1-ND2 2.9Å; E113-N159 VanDerWaalsContact OE1-ND2 3.1Å; S155-N159 WeakPolarHBondContact O-CB 3.42Å; S155-N159 PolarHBondContact O-N 2.99Å; S155-N159 PolarHBondContact O-ND2 2.67Å
160	L	95.6	Very high	95.4	Very high	47 Å²	47	29.4 Å²	29.4	25%	0.246	14%	0.143	C	C	.	.	H	α-helix	trans	-107.2	4	-174.4	-59.3	175.8	0	0	0	114.2	S156 V232 R234	S156-L160 VanDerWaalsContact O-CB 3.25Å; S156-L160 WeakPolarHBondContact O-CB 3.48Å; S156-L160 WeakPolarHBondContact O-CG 3.2Å; S156-L160 PolarHBondContact O-N 2.76Å; L160-V232 HydrophobicContact CB-CG2 4.1Å; L160-V232 HydrophobicContact CD1-CG2 4.18Å; L160-V232 WeakPolarHBondContact CD1-O 3.16Å; L160-R234 HydrophobicContact CD2-CG 4.18Å
161	T	95.8	Very high	95.5	Very high	6 Å²	6	29.4 Å²	29.4	4%	0.037	14%	0.143	C	C	.	.	S	Bend	trans	-110.9	121.6	176.8	-50.8	0	0	0	0	110.8	V157 H163 L166 W236 L237	V157-T161 WeakPolarHBondContact O-CB 3.35Å; V157-T161 PolarHBondContact O-N 2.8Å; V157-T161 VanDerWaalsContact O-N 3.14Å; V157-T161 PolarHBondContact O-OG1 2.82Å; T161-H163 PolarHBondContact O-N 2.8Å; T161-L166 HydrophobicContact CG2-CB 3.93Å; T161-W236 PolarHBondContact OG1-NE1 2.87Å; T161-W236 VanDerWaalsContact OG1-NE1 3.1Å; T161-L237 HydrophobicContact CG2-CD2 3.42Å; T161-L237 VanDerWaalsContact CG2-CD2 3.42Å
162	P	93.8	Very high	95.7	Very high	28 Å²	28	29.2 Å²	29.2	18%	0.182	14%	0.142	C	C	.	.			trans	-58.2	133.3	176.1	-24.1	33.2	0	0	0	112.7	Y164 F165 L166	P162-Y164 HydrophobicContact CB-CD1 4.01Å; P162-Y164 HydrophobicContact CB-CE1 3.45Å; P162-Y164 VanDerWaalsContact CB-CE1 3.45Å; P162-Y164 HydrophobicContact CB-CE2 4.11Å; P162-Y164 VanDerWaalsContact CB-CZ 3.49Å; P162-Y164 PolarHBondContact O-N 2.9Å; P162-F165 HydrophobicContact CB-CD2 3.88Å; P162-F165 HydrophobicContact CB-CE2 4.42Å; P162-F165 HydrophobicContact CG-CD2 3.83Å; P162-F165 HydrophobicContact CG-CE2 4.21Å; P162-F165 PolarHBondContact O-N 2.97Å; P162-L166 PolarHBondContact O-N 2.75Å
163	H	92.4	Very high	95.9	Very high	134 Å²	134	29.3 Å²	29.3	62%	0.62	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.1	-173.8	-71.2	-60.6	0	0	0	115.1	T161 K195	T161-H163 PolarHBondContact O-N 2.8Å; H163-K195 PolarHBondContact O-NZ 2.86Å
164	Y	93.4	Very high	95.9	Very high	150 Å²	150	29.7 Å²	29.7	59%	0.588	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.6	179.2	54.6	-93.2	0	0	0	113.4	P162	P162-Y164 HydrophobicContact CB-CD1 4.01Å; P162-Y164 HydrophobicContact CB-CE1 3.45Å; P162-Y164 VanDerWaalsContact CB-CE1 3.45Å; P162-Y164 HydrophobicContact CB-CE2 4.11Å; P162-Y164 VanDerWaalsContact CB-CZ 3.49Å; P162-Y164 PolarHBondContact O-N 2.9Å
165	F	96.2	Very high	95.9	Very high	5 Å²	5	33.5 Å²	33.5	2%	0.022	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-29.8	169.1	-63.9	-37.7	0	0	0	112.3	L133 T135 A136 P162 E167 L237 E238 L241	L133-F165 HydrophobicContact CB-CD1 4.08Å; L133-F165 HydrophobicContact CB-CE1 3.54Å; L133-F165 HydrophobicContact CB-CZ 4.1Å; L133-F165 HydrophobicContact CD1-CE1 4.15Å; L133-F165 HydrophobicContact CD1-CE2 4.47Å; L133-F165 HydrophobicContact CD1-CZ 3.82Å; L133-F165 HydrophobicContact CG-CE1 4.12Å; L133-F165 HydrophobicContact CG-CZ 4.2Å; T135-F165 CarbonylContact C-O 3.56Å; T135-F165 WeakPolarHBondContact CA-O 3.25Å; A136-F165 PolarHBondContact N-O 2.48Å; P162-F165 HydrophobicContact CB-CD2 3.88Å; P162-F165 HydrophobicContact CB-CE2 4.42Å; P162-F165 HydrophobicContact CG-CD2 3.83Å; P162-F165 HydrophobicContact CG-CE2 4.21Å; P162-F165 PolarHBondContact O-N 2.97Å; F165-E167 PolarHBondContact O-N 3.46Å; F165-L237 HydrophobicContact CB-CD2 4.12Å; F165-E238 HydrophobicContact CD2-CG 3.95Å; F165-E238 HydrophobicContact CE2-CG 3.46Å; F165-E238 VanDerWaalsContact CE2-CG 3.46Å; F165-E238 HydrophobicContact CZ-CG 4.38Å; F165-L241 HydrophobicContact CB-CD1 3.99Å; F165-L241 HydrophobicContact CD1-CD1 4.22Å; F165-L241 HydrophobicContact CG-CD1 4.03Å
166	L	96.6	Very high	96	Very high	6 Å²	6	33.9 Å²	33.9	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	106.7	179.8	-176.9	60.6	0	0	0	111.1	I138 T161 P162 I169 K195	I138-L166 HydrophobicContact CD1-CD1 3.55Å; I138-L166 HydrophobicContact CG1-CD1 3.97Å; T161-L166 HydrophobicContact CG2-CB 3.93Å; P162-L166 PolarHBondContact O-N 2.75Å; L166-I169 HydrophobicContact CD1-CG1 3.97Å; L166-I169 HydrophobicContact CD2-CD1 4.22Å; L166-I169 HydrophobicContact CD2-CG1 4.21Å; L166-K195 PolarHBondContact O-NZ 3Å
167	E	96.9	Very high	95.8	Very high	80 Å²	80	40 Å²	40	37%	0.374	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-56.4	171.6	-174.6	59.7	-147.8	0	0	109.6	A136 F165 S219	A136-E167 WeakPolarHBondContact O-CB 3.14Å; A136-E167 PolarHBondContact O-N 3.36Å; F165-E167 PolarHBondContact O-N 3.46Å; E167-S219 WeakPolarHBondContact CG-OG 3.4Å
168	E	96.9	Very high	95.4	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.019	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	159.7	-174.1	61.7	-166.8	144.7	0	0	111.6	S137 I138 I170 K195 K197 A218 S219	S137-E168 WeakPolarHBondContact CA-O 3.33Å; S137-E168 WeakPolarHBondContact OG-CG 3.19Å; S137-E168 PolarHBondContact OG-OE1 2.84Å; I138-E168 PolarHBondContact N-O 3.02Å; E168-I170 HydrophobicContact CG-CD1 4.17Å; E168-I170 HydrophobicContact CG-CG1 4.01Å; E168-K195 CarbonylContact C-O 3.55Å; E168-K195 VanDerWaalsContact CA-O 3.25Å; E168-K195 WeakPolarHBondContact CA-O 3.45Å; E168-K197 WeakPolarHBondContact OE2-CD 3.49Å; E168-K197 WeakPolarHBondContact OE2-CE 3.33Å; E168-K197 IonicContact OE2-NZ 2.64Å; E168-K197 PolarHBondContact OE2-NZ 3.37Å; E168-A218 WeakPolarHBondContact OE1-CA 3.3Å; E168-S219 WeakPolarHBondContact OE1-CB 3.35Å; E168-S219 PolarHBondContact OE1-N 2.79Å; E168-S219 PolarHBondContact OE1-OG 2.87Å
169	I	97.8	Very high	95	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.5	168.2	-55.6	174.9	0	0	0	107.2	I138 I140 V157 L166 L171 K195 V196 K197	I138-I169 HydrophobicContact CB-CG1 4.48Å; I138-I169 CarbonylContact O-C 3.55Å; I138-I169 WeakPolarHBondContact O-CA 3.36Å; I140-I169 HydrophobicContact CD1-CG2 3.99Å; V157-I169 HydrophobicContact CG1-CD1 3.72Å; V157-I169 HydrophobicContact CG1-CG1 4.23Å; L166-I169 HydrophobicContact CD1-CG1 3.97Å; L166-I169 HydrophobicContact CD2-CD1 4.22Å; L166-I169 HydrophobicContact CD2-CG1 4.21Å; I169-L171 HydrophobicContact CG2-CD2 4.03Å; I169-K195 PolarHBondContact N-O 3.13Å; I169-V196 HydrophobicContact CB-CG2 4.29Å; I169-V196 HydrophobicContact CD1-CG2 4.39Å; I169-V196 CarbonylContact O-C 3.12Å; I169-V196 VanDerWaalsContact O-CA 3.31Å; I169-V196 WeakPolarHBondContact O-CA 3.21Å; I169-K197 PolarHBondContact O-N 3.37Å
170	I	98.2	Very high	94.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	108.9	179.5	-58	174	0	0	0	108.2	I138 V139 I140 E168 V172 K197 I199 H217 A218	I138-I170 PolarHBondContact O-N 2.82Å; V139-I170 WeakPolarHBondContact CA-O 3.49Å; V139-I170 HydrophobicContact CG2-CB 4.45Å; I140-I170 PolarHBondContact N-O 2.84Å; E168-I170 HydrophobicContact CG-CD1 4.17Å; E168-I170 HydrophobicContact CG-CG1 4.01Å; I170-V172 HydrophobicContact CG2-CG2 4.05Å; I170-K197 CarbonylContact C-O 3.45Å; I170-K197 WeakPolarHBondContact CA-O 3.25Å; I170-I199 HydrophobicContact CG2-CD1 3.61Å; I170-I199 HydrophobicContact CG2-CG1 4.28Å; I170-H217 HydrophobicContact CD1-CB 4.37Å; I170-A218 HydrophobicContact CD1-CB 3.79Å
171	L	97.9	Very high	94.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.8	172.6	-57	-179	0	0	0	109	I140 F142 M154 I169 L189 V196 K197 I198 I199	I140-L171 HydrophobicContact CB-CD2 3.87Å; I140-L171 HydrophobicContact CD1-CD2 4.04Å; I140-L171 HydrophobicContact CG2-CD2 4.29Å; I140-L171 CarbonylContact O-C 3.52Å; I140-L171 WeakPolarHBondContact O-CA 3.44Å; F142-L171 HydrophobicContact CE1-CB 4.04Å; M154-L171 HydrophobicContact CE-CD1 4.21Å; M154-L171 HydrophobicContact CG-CD2 4.31Å; M154-L171 HydrophobicContact SD-CD1 3.58Å; M154-L171 VanDerWaalsContact SD-CD1 3.58Å; M154-L171 HydrophobicContact SD-CD2 4.19Å; M154-L171 HydrophobicContact SD-CG 4.45Å; I169-L171 HydrophobicContact CG2-CD2 4.03Å; L171-L189 HydrophobicContact CD1-CD1 3.87Å; L171-L189 HydrophobicContact CD1-CD2 3.52Å; L171-L189 HydrophobicContact CD1-CG 4.36Å; L171-V196 HydrophobicContact CD1-CG1 3.77Å; L171-V196 HydrophobicContact CG-CG1 3.98Å; L171-K197 PolarHBondContact N-O 3.15Å; L171-I198 HydrophobicContact CB-CB 4.46Å; L171-I198 HydrophobicContact CB-CG1 4.35Å; L171-I198 CarbonylContact O-C 3.58Å; L171-I198 WeakPolarHBondContact O-CA 3.05Å; L171-I199 PolarHBondContact O-N 2.92Å
172	V	98.3	Very high	93.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	105.2	176.6	-170.5	0	0	0	0	109.2	V139 I140 C141 F142 I170 D174 I199 A210 I213	V139-V172 HydrophobicContact CG1-CG2 4.35Å; I140-V172 PolarHBondContact O-N 3.41Å; C141-V172 WeakPolarHBondContact CA-O 3.31Å; C141-V172 HydrophobicContact CB-CB 4.44Å; F142-V172 WeakPolarHBondContact CD1-O 3.25Å; F142-V172 PolarHBondContact N-O 2.91Å; I170-V172 HydrophobicContact CG2-CG2 4.05Å; V172-D174 PolarHBondContact O-N 3.36Å; V172-I199 CarbonylContact C-O 3.56Å; V172-I199 WeakPolarHBondContact CA-O 3.47Å; V172-A210 HydrophobicContact CG1-CB 3.91Å; V172-I213 HydrophobicContact CG1-CG2 4.42Å
173	D	97.8	Very high	93.3	Very high	7 Å²	7	51.7 Å²	51.7	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	107.8	173.2	179.8	13.7	0	0	0	109.7	F142 M175 S176 I199 R200 N201	F142-D173 HydrophobicContact CE1-CB 3.89Å; F142-D173 HydrophobicContact CE2-CB 3.86Å; F142-D173 HydrophobicContact CZ-CB 3.43Å; F142-D173 VanDerWaalsContact CZ-CB 3.43Å; D173-M175 PolarHBondContact O-N 3.1Å; D173-M175 PolarHBondContact OD1-N 2.68Å; D173-S176 WeakPolarHBondContact OD1-CA 3.41Å; D173-S176 WeakPolarHBondContact OD1-CB 3.46Å; D173-S176 PolarHBondContact OD1-N 3.02Å; D173-S176 PolarHBondContact OD1-OG 3.21Å; D173-I199 PolarHBondContact N-O 3.26Å; D173-R200 HydrophobicContact CB-CG 4.12Å; D173-R200 IonicContact OD2-CZ 3.62Å; D173-R200 IonicContact OD2-NH1 3.7Å; D173-R200 PolarHBondContact OD2-NH1 3.44Å; D173-N201 WeakPolarHBondContact O-CB 3.43Å; D173-N201 PolarHBondContact O-N 3.18Å
174	D	97.1	Very high	92.9	Very high	7 Å²	7	50.1 Å²	50.1	4%	0.037	23%	0.234	C	C	.	.			trans	-83.2	53.7	179.2	-168.8	41	0	0	0	112.4	F142 Y143 V172 N201 E205 G206 A210	F142-D174 PolarHBondContact O-N 2.63Å; Y143-D174 VanDerWaalsContact CD2-O 3.23Å; Y143-D174 WeakPolarHBondContact CD2-O 3.33Å; V172-D174 PolarHBondContact O-N 3.36Å; D174-N201 PolarHBondContact OD1-ND2 2.83Å; D174-E205 WeakPolarHBondContact OD1-CB 3.33Å; D174-E205 PolarHBondContact OD1-N 3.03Å; D174-G206 PolarHBondContact OD1-N 3.15Å; D174-G206 VanDerWaalsContact OD2-CA 3.28Å; D174-G206 WeakPolarHBondContact OD2-CA 3.48Å; D174-G206 PolarHBondContact OD2-N 3.13Å; D174-A210 HydrophobicContact CB-CB 4.26Å
175	M	96.1	Very high	92.6	Very high	80 Å²	80	43 Å²	43	39%	0.394	21%	0.206	S	C	.	.	S	Bend	trans	65.5	51.2	179.2	-161.7	-164	-174.2	0	0	113.6	Y143 D173 R204	Y143-M175 WeakPolarHBondContact CE2-O 3.43Å; D173-M175 PolarHBondContact O-N 3.1Å; D173-M175 PolarHBondContact OD1-N 2.68Å; M175-R204 HydrophobicContact CB-CB 4.18Å; M175-R204 HydrophobicContact SD-CB 4.14Å; M175-R204 PolarHBondContact SD-N 3.17Å; M175-R204 VanDerWaalsContact SD-N 3.36Å
176	S	94.8	Very high	92.1	Very high	11 Å²	11	45.6 Å²	45.6	8%	0.077	22%	0.22	C	C	.	.			trans	-60.7	142	174.2	-62	0	0	0	0	112.2	Y143 N144 D173	Y143-S176 WeakPolarHBondContact CA-OG 3.39Å; N144-S176 PolarHBondContact N-OG 3.18Å; N144-S176 WeakPolarHBondContact OD1-CA 3.23Å; D173-S176 WeakPolarHBondContact OD1-CA 3.41Å; D173-S176 WeakPolarHBondContact OD1-CB 3.46Å; D173-S176 PolarHBondContact OD1-N 3.02Å; D173-S176 PolarHBondContact OD1-OG 3.21Å
177	K	91.9	Very high	91.5	Very high	144 Å²	144	53 Å²	53	63%	0.626	25%	0.249	S	C	*	.			trans	-100.9	-14.5	179.7	-62.8	-176.3	180	-175.9	0	113.2	N144	N144-K177 PolarHBondContact OD1-N 3.22Å
178	V	88.7	Confident	90.8	Very high	26 Å²	26	52 Å²	52	16%	0.158	24%	0.244	C	C	.	.			trans	-73.3	126.3	-179.3	-176.5	0	0	0	0	109.5	N144 D180 L181	N144-V178 HydrophobicContact CB-CG2 4.01Å; V178-D180 VanDerWaalsContact C-N 3.31Å; V178-D180 HydrophobicContact CG1-CB 4.14Å; V178-D180 PolarHBondContact O-N 2.96Å; V178-L181 HydrophobicContact CB-CD1 4.15Å; V178-L181 HydrophobicContact CB-CG 4.28Å; V178-L181 PolarHBondContact O-N 2.98Å; V178-L181 VanDerWaalsContact O-N 3.11Å
179	D	84.8	Confident	90.2	Very high	116 Å²	116	52.8 Å²	52.8	62%	0.62	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-65.5	-32.8	-175.7	-66.2	-34.8	0	0	0	113.1	L181 K182	D179-L181 PolarHBondContact O-N 2.89Å; D179-L181 VanDerWaalsContact O-N 3.1Å; D179-K182 WeakPolarHBondContact O-CB 3.38Å; D179-K182 PolarHBondContact O-N 2.86Å; D179-K182 IonicContact OD1-NZ 3.77Å; D179-K182 PolarHBondContact OD1-NZ 3.44Å
180	D	84.6	Confident	89.3	Confident	64 Å²	64	59.7 Å²	59.7	34%	0.342	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.5	-23.6	174.5	-73.5	-44.5	0	0	0	113.2	C147 V178 K182 K184 L185	C147-D180 HydrophobicContact CB-CB 4.41Å; V178-D180 VanDerWaalsContact C-N 3.31Å; V178-D180 HydrophobicContact CG1-CB 4.14Å; V178-D180 PolarHBondContact O-N 2.96Å; D180-K182 VanDerWaalsContact C-N 3.34Å; D180-K184 HydrophobicContact CB-CD 4.23Å; D180-K184 WeakPolarHBondContact OD1-CD 3.37Å; D180-K184 IonicContact OD1-NZ 3.79Å; D180-K184 PolarHBondContact OD1-NZ 3.28Å; D180-L185 PolarHBondContact O-N 3.37Å
181	L	87.8	Confident	88.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-90.1	4.5	178.9	-63.6	176.9	0	0	0	113.4	F142 E145 L150 V178 D179 L185 R200	F142-L181 HydrophobicContact CD2-CD1 4.08Å; F142-L181 HydrophobicContact CE2-CB 4.25Å; F142-L181 HydrophobicContact CE2-CD1 4.06Å; F142-L181 HydrophobicContact CE2-CD2 4.21Å; F142-L181 HydrophobicContact CE2-CG 4.42Å; E145-L181 WeakPolarHBondContact O-CD1 3.29Å; L150-L181 HydrophobicContact CD2-CD2 4.04Å; V178-L181 HydrophobicContact CB-CD1 4.15Å; V178-L181 HydrophobicContact CB-CG 4.28Å; V178-L181 PolarHBondContact O-N 2.98Å; V178-L181 VanDerWaalsContact O-N 3.11Å; D179-L181 PolarHBondContact O-N 2.89Å; D179-L181 VanDerWaalsContact O-N 3.1Å; L181-L185 HydrophobicContact CD2-CD2 4.42Å; L181-R200 PolarHBondContact O-NH1 3.13Å; L181-R200 PolarHBondContact O-NH2 2.94Å
182	K	87.4	Confident	87.1	Confident	83 Å²	83	65.8 Å²	65.8	36%	0.361	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-116.8	178.6	-58.7	177.9	-171.8	157.8	0	110	D179 D180 K184 L185 D186 R200	D179-K182 WeakPolarHBondContact O-CB 3.38Å; D179-K182 PolarHBondContact O-N 2.86Å; D179-K182 IonicContact OD1-NZ 3.77Å; D179-K182 PolarHBondContact OD1-NZ 3.44Å; D180-K182 VanDerWaalsContact C-N 3.34Å; K182-K184 VanDerWaalsContact C-N 3.27Å; K182-K184 PolarHBondContact O-N 3.41Å; K182-L185 WeakPolarHBondContact O-CB 3.21Å; K182-L185 PolarHBondContact O-N 2.81Å; K182-L185 VanDerWaalsContact O-N 3.09Å; K182-D186 PolarHBondContact O-N 3.28Å; K182-D186 VanDerWaalsContact O-N 3.08Å; K182-R200 PolarHBondContact O-NH2 3.42Å
183	E	84.1	Confident	85.5	Confident	167 Å²	167	76.8 Å²	76.8	78%	0.78	36%	0.357	S	S	*	.	H	α-helix	trans	-58.2	-37.4	-175.9	-63.3	175.3	-175.9	0	0	112.8	L185 D186 Y187	E183-L185 PolarHBondContact O-N 2.84Å; E183-D186 PolarHBondContact O-N 3.33Å; E183-Y187 PolarHBondContact O-N 3.15Å
184	K	84.1	Confident	84.5	Confident	100 Å²	100	80.2 Å²	80.2	44%	0.435	40%	0.395	S	S	.	.	H	α-helix	trans	-65.5	-38.3	178.2	-178.6	-179	174.7	-179.8	0	112.6	D180 K182 H188	D180-K184 HydrophobicContact CB-CD 4.23Å; D180-K184 WeakPolarHBondContact OD1-CD 3.37Å; D180-K184 IonicContact OD1-NZ 3.79Å; D180-K184 PolarHBondContact OD1-NZ 3.28Å; K182-K184 VanDerWaalsContact C-N 3.27Å; K182-K184 PolarHBondContact O-N 3.41Å; K184-H188 PolarHBondContact O-N 3.47Å; K184-H188 PolarHBondContact O-ND1 2.77Å
185	L	87.3	Confident	84	Confident	0 Å²	0	83.5 Å²	83.5	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-63.9	-51.6	172.7	176.7	61.1	0	0	0	109.1	F142 L150 F151 D180 L181 K182 E183 Y187 H188 L189 I198	F142-L185 HydrophobicContact CE2-CD2 4.16Å; F142-L185 HydrophobicContact CZ-CD2 3.68Å; L150-L185 HydrophobicContact CD2-CD1 4.11Å; L150-L185 HydrophobicContact CD2-CD2 4.13Å; F151-L185 HydrophobicContact CE1-CD1 3.52Å; F151-L185 HydrophobicContact CZ-CD1 3.7Å; D180-L185 PolarHBondContact O-N 3.37Å; L181-L185 HydrophobicContact CD2-CD2 4.42Å; K182-L185 WeakPolarHBondContact O-CB 3.21Å; K182-L185 PolarHBondContact O-N 2.81Å; K182-L185 VanDerWaalsContact O-N 3.09Å; E183-L185 PolarHBondContact O-N 2.84Å; L185-Y187 VanDerWaalsContact C-N 3.26Å; L185-Y187 PolarHBondContact O-N 2.93Å; L185-H188 PolarHBondContact O-N 2.8Å; L185-L189 HydrophobicContact CD1-CD1 4.41Å; L185-L189 HydrophobicContact CD1-CD2 3.91Å; L185-L189 HydrophobicContact CD1-CG 4.02Å; L185-L189 HydrophobicContact CG-CD1 4.07Å; L185-L189 HydrophobicContact CG-CD2 4.46Å; L185-L189 HydrophobicContact CG-CG 4.11Å; L185-L189 VanDerWaalsContact O-CG 3.29Å; L185-L189 WeakPolarHBondContact O-CG 3.45Å; L185-L189 PolarHBondContact O-N 2.77Å; L185-I198 HydrophobicContact CD2-CD1 3.78Å; L185-I198 HydrophobicContact CG-CD1 4.39Å
186	D	84.8	Confident	83.9	Confident	60 Å²	60	81 Å²	81	32%	0.321	40%	0.397	S	S	.	.	H	α-helix	trans	-53.3	-44.3	-178.5	-63.6	-24.6	0	0	0	111.8	K182 E183 L189 E190 R200	K182-D186 PolarHBondContact O-N 3.28Å; K182-D186 VanDerWaalsContact O-N 3.08Å; E183-D186 PolarHBondContact O-N 3.33Å; D186-L189 PolarHBondContact O-N 3.22Å; D186-E190 PolarHBondContact O-N 2.94Å; D186-R200 VanDerWaalsContact CG-NH2 3.27Å; D186-R200 IonicContact OD1-CZ 2.62Å; D186-R200 IonicContact OD1-NE 3.96Å; D186-R200 IonicContact OD1-NH2 2.96Å; D186-R200 PolarHBondContact OD1-NH2 3.47Å; D186-R200 IonicContact OD2-CZ 2.74Å; D186-R200 IonicContact OD2-NE 3.18Å; D186-R200 IonicContact OD2-NH2 3.88Å; D186-R200 PolarHBondContact OD2-NH2 3.36Å
187	Y	84.3	Confident	83.9	Confident	162 Å²	162	85.4 Å²	85.4	64%	0.635	42%	0.415	S	S	*	.	H	α-helix	trans	-61	-44.8	174.4	179.4	-98.8	0	0	0	113.2	E183 L185 L189 E190	E183-Y187 PolarHBondContact O-N 3.15Å; L185-Y187 VanDerWaalsContact C-N 3.26Å; L185-Y187 PolarHBondContact O-N 2.93Å; Y187-L189 VanDerWaalsContact C-N 3.31Å; Y187-L189 PolarHBondContact O-N 3.15Å; Y187-E190 WeakPolarHBondContact O-CB 3.48Å; Y187-E190 PolarHBondContact O-N 2.75Å
188	H	81.8	Confident	84	Confident	60 Å²	60	81.1 Å²	81.1	28%	0.278	40%	0.398	S	S	.	.	H	α-helix	trans	-67.3	-33.1	177.8	-79.9	78	0	0	0	112.3	F151 K184 L185 E190 T191 F192	F151-H188 HydrophobicContact CE1-CB 3.49Å; F151-H188 VanDerWaalsContact CE1-CB 3.49Å; F151-H188 HydrophobicContact CE2-CB 4.29Å; F151-H188 HydrophobicContact CZ-CB 3.33Å; F151-H188 AromaticContact CZ-CG 3.56Å; K184-H188 PolarHBondContact O-N 3.47Å; K184-H188 PolarHBondContact O-ND1 2.77Å; L185-H188 PolarHBondContact O-N 2.8Å; H188-E190 PolarHBondContact O-N 3.37Å; H188-T191 WeakPolarHBondContact O-CB 3.44Å; H188-T191 PolarHBondContact O-N 2.88Å; H188-T191 PolarHBondContact O-OG1 3.4Å; H188-T191 VanDerWaalsContact O-OG1 3.13Å; H188-F192 WeakPolarHBondContact O-CD2 3.37Å
189	L	84.3	Confident	84.4	Confident	19 Å²	19	81.2 Å²	81.2	10%	0.099	40%	0.398	C	S	.	.	H	α-helix	trans	-61.4	-27.6	178.1	-64.8	-177.6	0	0	0	112.5	M154 L171 L185 D186 Y187 T191 F192 V196 I198	M154-L189 HydrophobicContact CE-CD2 3.43Å; M154-L189 VanDerWaalsContact CE-CD2 3.43Å; M154-L189 HydrophobicContact SD-CD2 3.49Å; M154-L189 WeakPolarHBondContact SD-CD2 3.44Å; L171-L189 HydrophobicContact CD1-CD1 3.87Å; L171-L189 HydrophobicContact CD1-CD2 3.52Å; L171-L189 HydrophobicContact CD1-CG 4.36Å; L185-L189 HydrophobicContact CD1-CD1 4.41Å; L185-L189 HydrophobicContact CD1-CD2 3.91Å; L185-L189 HydrophobicContact CD1-CG 4.02Å; L185-L189 HydrophobicContact CG-CD1 4.07Å; L185-L189 HydrophobicContact CG-CD2 4.46Å; L185-L189 HydrophobicContact CG-CG 4.11Å; L185-L189 VanDerWaalsContact O-CG 3.29Å; L185-L189 WeakPolarHBondContact O-CG 3.45Å; L185-L189 PolarHBondContact O-N 2.77Å; D186-L189 PolarHBondContact O-N 3.22Å; Y187-L189 VanDerWaalsContact C-N 3.31Å; Y187-L189 PolarHBondContact O-N 3.15Å; L189-T191 PolarHBondContact O-N 2.84Å; L189-F192 PolarHBondContact O-N 3.45Å; L189-V196 HydrophobicContact CD1-CG1 4.49Å; L189-V196 HydrophobicContact CD2-CG1 4.06Å; L189-I198 HydrophobicContact CD1-CB 3.93Å; L189-I198 HydrophobicContact CD1-CD1 3.96Å; L189-I198 HydrophobicContact CD1-CG2 4.15Å
190	E	80.3	Confident	85	Confident	147 Å²	147	79.7 Å²	79.7	69%	0.687	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-57.6	-28.9	173.6	-61.1	-175.6	167.2	0	0	112.2	D186 Y187 H188 F192	D186-E190 PolarHBondContact O-N 2.94Å; Y187-E190 WeakPolarHBondContact O-CB 3.48Å; Y187-E190 PolarHBondContact O-N 2.75Å; H188-E190 PolarHBondContact O-N 3.37Å; E190-F192 PolarHBondContact O-N 3.42Å
191	T	77.4	Confident	85.6	Confident	101 Å²	101	77.6 Å²	77.6	62%	0.62	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-67.1	-24.4	177.8	-48.4	0	0	0	0	112.4	H188 L189 R193	H188-T191 WeakPolarHBondContact O-CB 3.44Å; H188-T191 PolarHBondContact O-N 2.88Å; H188-T191 PolarHBondContact O-OG1 3.4Å; H188-T191 VanDerWaalsContact O-OG1 3.13Å; L189-T191 PolarHBondContact O-N 2.84Å; T191-R193 VanDerWaalsContact C-N 3.3Å; T191-R193 PolarHBondContact O-N 3.45Å
192	F	71.9	Confident	86	Confident	28 Å²	28	87.3 Å²	87.3	12%	0.123	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-89.2	18.5	-175.5	-65.2	-89.8	0	0	0	114.3	F151 M154 T158 H188 L189 E190 G194 V196	F151-F192 HydrophobicContact CD1-CE2 4.22Å; F151-F192 HydrophobicContact CD1-CZ 4.46Å; M154-F192 HydrophobicContact CB-CE1 3.99Å; M154-F192 HydrophobicContact CB-CZ 4.06Å; M154-F192 HydrophobicContact CE-CB 4.22Å; M154-F192 HydrophobicContact CE-CD1 3.92Å; M154-F192 HydrophobicContact CE-CD2 3.63Å; M154-F192 HydrophobicContact CE-CE1 4.15Å; M154-F192 HydrophobicContact CE-CE2 3.86Å; M154-F192 HydrophobicContact CE-CG 3.65Å; M154-F192 HydrophobicContact CE-CZ 4.11Å; T158-F192 HydrophobicContact CG2-CD1 4.33Å; H188-F192 WeakPolarHBondContact O-CD2 3.37Å; L189-F192 PolarHBondContact O-N 3.45Å; E190-F192 PolarHBondContact O-N 3.42Å; F192-G194 PolarHBondContact O-N 3.36Å; F192-V196 HydrophobicContact CB-CG2 3.51Å; F192-V196 HydrophobicContact CG-CG2 4.39Å
193	R	65.4	Low	86.3	Confident	230 Å²	230	89.3 Å²	89.3	87%	0.868	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	57	161.4	-60.9	-173	179.5	-178.6	0.4	116.5	T191 K195	T191-R193 VanDerWaalsContact C-N 3.3Å; T191-R193 PolarHBondContact O-N 3.45Å; R193-K195 VanDerWaalsContact C-N 3.28Å; R193-K195 PolarHBondContact O-N 3.48Å
194	G	76.1	Confident	86.8	Confident	80 Å²	80	85.4 Å²	85.4	83%	0.825	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	-6.2	156.8	0	0	0	0	0	117.7	F192	F192-G194 PolarHBondContact O-N 3.36Å
195	K	87.2	Confident	87.4	Confident	76 Å²	76	82.6 Å²	82.6	33%	0.33	39%	0.39	S	S	.	.			trans	-92.8	-2.5	171.3	-70.8	-162.6	172.7	-161.8	0	113.8	H163 L166 E168 I169 R193	H163-K195 PolarHBondContact O-NZ 2.86Å; L166-K195 PolarHBondContact O-NZ 3Å; E168-K195 CarbonylContact C-O 3.55Å; E168-K195 VanDerWaalsContact CA-O 3.25Å; E168-K195 WeakPolarHBondContact CA-O 3.45Å; I169-K195 PolarHBondContact N-O 3.13Å; R193-K195 VanDerWaalsContact C-N 3.28Å; R193-K195 PolarHBondContact O-N 3.48Å
196	V	93.7	Very high	87.7	Confident	26 Å²	26	82.7 Å²	82.7	16%	0.158	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.3	178.9	-172.7	0	0	0	0	109.8	M154 I169 L171 L189 F192	M154-V196 HydrophobicContact CE-CG1 3.92Å; M154-V196 HydrophobicContact CE-CG2 3.86Å; I169-V196 HydrophobicContact CB-CG2 4.29Å; I169-V196 HydrophobicContact CD1-CG2 4.39Å; I169-V196 CarbonylContact O-C 3.12Å; I169-V196 VanDerWaalsContact O-CA 3.31Å; I169-V196 WeakPolarHBondContact O-CA 3.21Å; L171-V196 HydrophobicContact CD1-CG1 3.77Å; L171-V196 HydrophobicContact CG-CG1 3.98Å; L189-V196 HydrophobicContact CD1-CG1 4.49Å; L189-V196 HydrophobicContact CD2-CG1 4.06Å; F192-V196 HydrophobicContact CB-CG2 3.51Å; F192-V196 HydrophobicContact CG-CG2 4.39Å
197	K	93.9	Very high	88.2	Confident	105 Å²	105	81.6 Å²	81.6	46%	0.457	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.9	171.1	-62.9	177.9	-175.8	167.7	0	108.8	E168 I169 I170 L171	E168-K197 WeakPolarHBondContact OE2-CD 3.49Å; E168-K197 WeakPolarHBondContact OE2-CE 3.33Å; E168-K197 IonicContact OE2-NZ 2.64Å; E168-K197 PolarHBondContact OE2-NZ 3.37Å; I169-K197 PolarHBondContact O-N 3.37Å; I170-K197 CarbonylContact C-O 3.45Å; I170-K197 WeakPolarHBondContact CA-O 3.25Å; L171-K197 PolarHBondContact N-O 3.15Å
198	I	95.3	Very high	88.8	Confident	53 Å²	53	73.9 Å²	73.9	27%	0.272	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.8	171.6	-172.5	165.3	0	0	0	110.4	F142 L171 L185 L189 R200	F142-I198 HydrophobicContact CZ-CD1 4.41Å; L171-I198 HydrophobicContact CB-CB 4.46Å; L171-I198 HydrophobicContact CB-CG1 4.35Å; L171-I198 CarbonylContact O-C 3.58Å; L171-I198 WeakPolarHBondContact O-CA 3.05Å; L185-I198 HydrophobicContact CD2-CD1 3.78Å; L185-I198 HydrophobicContact CG-CD1 4.39Å; L189-I198 HydrophobicContact CD1-CB 3.93Å; L189-I198 HydrophobicContact CD1-CD1 3.96Å; L189-I198 HydrophobicContact CD1-CG2 4.15Å; I198-R200 HydrophobicContact CD1-CG 4.47Å; I198-R200 HydrophobicContact CG1-CG 4.27Å
199	I	96.7	Very high	89.6	Confident	28 Å²	28	73.7 Å²	73.7	14%	0.144	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.8	175.7	-58	173.2	0	0	0	107.2	I170 L171 V172 D173 I213 H217	I170-I199 HydrophobicContact CG2-CD1 3.61Å; I170-I199 HydrophobicContact CG2-CG1 4.28Å; L171-I199 PolarHBondContact O-N 2.92Å; V172-I199 CarbonylContact C-O 3.56Å; V172-I199 WeakPolarHBondContact CA-O 3.47Å; D173-I199 PolarHBondContact N-O 3.26Å; I199-I213 HydrophobicContact CD1-CG2 4.48Å; I199-I213 HydrophobicContact CG2-CG2 3.82Å; I199-H217 HydrophobicContact CD1-CB 3.67Å; I199-H217 VanDerWaalsContact CD1-CG 3.46Å
200	R	96.9	Very high	90.2	Very high	84 Å²	84	72.8 Å²	72.8	32%	0.317	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.1	179.6	-61.8	-172.1	178.6	-87.1	4	110.8	D173 L181 K182 D186 I198	D173-R200 HydrophobicContact CB-CG 4.12Å; D173-R200 IonicContact OD2-CZ 3.62Å; D173-R200 IonicContact OD2-NH1 3.7Å; D173-R200 PolarHBondContact OD2-NH1 3.44Å; L181-R200 PolarHBondContact O-NH1 3.13Å; L181-R200 PolarHBondContact O-NH2 2.94Å; K182-R200 PolarHBondContact O-NH2 3.42Å; D186-R200 VanDerWaalsContact CG-NH2 3.27Å; D186-R200 IonicContact OD1-CZ 2.62Å; D186-R200 IonicContact OD1-NE 3.96Å; D186-R200 IonicContact OD1-NH2 2.96Å; D186-R200 PolarHBondContact OD1-NH2 3.47Å; D186-R200 IonicContact OD2-CZ 2.74Å; D186-R200 IonicContact OD2-NE 3.18Å; D186-R200 IonicContact OD2-NH2 3.88Å; D186-R200 PolarHBondContact OD2-NH2 3.36Å; I198-R200 HydrophobicContact CD1-CG 4.47Å; I198-R200 HydrophobicContact CG1-CG 4.27Å
201	N	97	Very high	91.1	Very high	20 Å²	20	66 Å²	66	11%	0.107	31%	0.314	C	S	.	.			trans	-71.2	136.1	176.8	-69.9	-11	0	0	0	110.5	D173 D174 K203 I213	D173-N201 WeakPolarHBondContact O-CB 3.43Å; D173-N201 PolarHBondContact O-N 3.18Å; D174-N201 PolarHBondContact OD1-ND2 2.83Å; N201-K203 VanDerWaalsContact C-N 3.28Å; N201-K203 VanDerWaalsContact CB-O 3.3Å; N201-K203 WeakPolarHBondContact CB-O 3.46Å; N201-K203 PolarHBondContact O-N 3.2Å; N201-I213 WeakPolarHBondContact OD1-CD1 3.28Å
202	K	95.4	Very high	92.1	Very high	205 Å²	205	62.1 Å²	62.1	89%	0.891	29%	0.29	S	S	*	.	S	Bend	trans	-74.7	-19.5	177.3	-63.8	-177.1	-179.9	179.7	0	113.2
203	K	95.2	Very high	93.3	Very high	125 Å²	125	62.7 Å²	62.7	54%	0.543	29%	0.294	S	S	.	.	S	Bend	trans	-138	156.3	176.2	66.2	-179.7	-174.4	173.9	0	109.1	N201 E205	N201-K203 VanDerWaalsContact C-N 3.28Å; N201-K203 VanDerWaalsContact CB-O 3.3Å; N201-K203 WeakPolarHBondContact CB-O 3.46Å; N201-K203 PolarHBondContact O-N 3.2Å; K203-E205 WeakPolarHBondContact CE-OE1 3.44Å; K203-E205 WeakPolarHBondContact CE-OE2 3.35Å; K203-E205 HydrophobicContact CG-CG 4.14Å; K203-E205 IonicContact NZ-OE1 2.74Å; K203-E205 IonicContact NZ-OE2 4Å; K203-E205 PolarHBondContact O-N 3.48Å; K203-E205 VanDerWaalsContact O-N 3.15Å
204	R	94.9	Very high	94.9	Very high	85 Å²	85	51.8 Å²	51.8	32%	0.321	25%	0.253	S	S	.	.			trans	-75	102	176	-169.1	179.3	-178.1	-104.8	-3	109.8	Y143 M175 F331	Y143-R204 HydrophobicContact CD2-CG 4.5Å; Y143-R204 HydrophobicContact CE2-CG 4.37Å; M175-R204 HydrophobicContact CB-CB 4.18Å; M175-R204 HydrophobicContact SD-CB 4.14Å; M175-R204 PolarHBondContact SD-N 3.17Å; M175-R204 VanDerWaalsContact SD-N 3.36Å; R204-F331 HydrophobicContact CG-CE1 4.06Å; R204-F331 VanDerWaalsContact NH1-CD1 3.25Å
205	E	95.2	Very high	96	Very high	40 Å²	40	48.1 Å²	48.1	19%	0.187	22%	0.215	C	C	.	.			trans	-88.2	-28.1	-173.1	-67.6	-77.2	-163.8	0	0	113	D174 K203 R209 I213	D174-E205 WeakPolarHBondContact OD1-CB 3.33Å; D174-E205 PolarHBondContact OD1-N 3.03Å; K203-E205 WeakPolarHBondContact CE-OE1 3.44Å; K203-E205 WeakPolarHBondContact CE-OE2 3.35Å; K203-E205 HydrophobicContact CG-CG 4.14Å; K203-E205 IonicContact NZ-OE1 2.74Å; K203-E205 IonicContact NZ-OE2 4Å; K203-E205 PolarHBondContact O-N 3.48Å; K203-E205 VanDerWaalsContact O-N 3.15Å; E205-R209 HydrophobicContact CB-CB 3.68Å; E205-R209 PolarHBondContact O-NH1 2.91Å; E205-R209 WeakPolarHBondContact OE2-CD 3.42Å; E205-I213 HydrophobicContact CG-CD1 4.26Å
206	G	95.1	Very high	96.5	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.021	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	100.9	161.7	-169.6	0	0	0	0	0	114.5	D174 I208 R209 A210 F331	D174-G206 PolarHBondContact OD1-N 3.15Å; D174-G206 VanDerWaalsContact OD2-CA 3.28Å; D174-G206 WeakPolarHBondContact OD2-CA 3.48Å; D174-G206 PolarHBondContact OD2-N 3.13Å; G206-I208 VanDerWaalsContact C-N 3.27Å; G206-I208 PolarHBondContact O-N 3.03Å; G206-R209 PolarHBondContact O-N 3.29Å; G206-A210 WeakPolarHBondContact O-CB 3.3Å; G206-A210 PolarHBondContact O-N 2.99Å; G206-F331 CarbonylContact C-O 3.55Å; G206-F331 WeakPolarHBondContact CA-O 3.45Å
207	L	95.3	Very high	96.7	Very high	37 Å²	37	52 Å²	52	19%	0.194	24%	0.242	C	C	.	.	H	α-helix	trans	-53.9	-44.5	176.5	-176.9	66	0	0	0	111.9	C141 A210 R211 F331	C141-L207 HydrophobicContact CB-CD1 3.84Å; L207-A210 PolarHBondContact O-N 2.66Å; L207-R211 HydrophobicContact CD1-CG 4.29Å; L207-R211 HydrophobicContact CG-CG 4.48Å; L207-R211 WeakPolarHBondContact O-CB 3.18Å; L207-R211 WeakPolarHBondContact O-CG 3.1Å; L207-R211 PolarHBondContact O-N 3.1Å; L207-F331 PolarHBondContact N-O 3.39Å
208	I	96.3	Very high	97	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-53.6	-174.5	-58	175.2	0	0	0	110.3	G206 R211 L212 Y325 M329 F331 E335	G206-I208 VanDerWaalsContact C-N 3.27Å; G206-I208 PolarHBondContact O-N 3.03Å; I208-R211 PolarHBondContact O-N 2.99Å; I208-L212 WeakPolarHBondContact O-CG 3.45Å; I208-L212 PolarHBondContact O-N 3.37Å; I208-L212 VanDerWaalsContact O-N 3.13Å; I208-Y325 HydrophobicContact CG2-CD2 4.44Å; I208-Y325 HydrophobicContact CG2-CG 4.04Å; I208-M329 HydrophobicContact CD1-CB 3.43Å; I208-M329 VanDerWaalsContact CD1-CB 3.43Å; I208-M329 HydrophobicContact CD1-CG 4.47Å; I208-M329 HydrophobicContact CD1-SD 4.33Å; I208-F331 PolarHBondContact N-O 3.19Å; I208-E335 HydrophobicContact CD1-CB 3.76Å; I208-E335 HydrophobicContact CD1-CG 4.36Å; I208-E335 HydrophobicContact CG1-CB 3.86Å; I208-E335 HydrophobicContact CG1-CG 3.98Å
209	R	97.4	Very high	97.1	Very high	56 Å²	56	47.6 Å²	47.6	21%	0.211	23%	0.229	C	C	.	.	H	α-helix	trans	-72.3	-35.4	-179.2	-71.2	179	-169.9	118.4	3	112	E205 G206 R211 L212 I213 K327 M329 D330	E205-R209 HydrophobicContact CB-CB 3.68Å; E205-R209 PolarHBondContact O-NH1 2.91Å; E205-R209 WeakPolarHBondContact OE2-CD 3.42Å; G206-R209 PolarHBondContact O-N 3.29Å; R209-R211 VanDerWaalsContact C-N 3.3Å; R209-R211 PolarHBondContact O-N 2.53Å; R209-L212 WeakPolarHBondContact O-CB 3.45Å; R209-L212 PolarHBondContact O-N 3.4Å; R209-L212 VanDerWaalsContact O-N 3.16Å; R209-I213 VanDerWaalsContact O-CG1 3.28Å; R209-I213 WeakPolarHBondContact O-CG1 3.41Å; R209-I213 PolarHBondContact O-N 3.33Å; R209-K327 PolarHBondContact NE-O 3.16Å; R209-K327 PolarHBondContact NH2-O 2.74Å; R209-M329 PolarHBondContact NH2-O 2.87Å; R209-D330 IonicContact CZ-OD1 3.6Å; R209-D330 IonicContact NH1-OD1 2.88Å; R209-D330 PolarHBondContact NH1-OD1 3.45Å; R209-D330 IonicContact NH2-OD1 3.64Å; R209-D330 PolarHBondContact NH2-OD1 3.12Å
210	A	98.2	Very high	97.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-41.4	172.1	0	0	0	0	0	111.7	C141 V172 D174 G206 L207 I213 G214	C141-A210 HydrophobicContact CB-CB 4.04Å; C141-A210 VanDerWaalsContact SG-C 3.54Å; V172-A210 HydrophobicContact CG1-CB 3.91Å; D174-A210 HydrophobicContact CB-CB 4.26Å; G206-A210 WeakPolarHBondContact O-CB 3.3Å; G206-A210 PolarHBondContact O-N 2.99Å; L207-A210 PolarHBondContact O-N 2.66Å; A210-I213 PolarHBondContact O-N 3.31Å; A210-G214 PolarHBondContact O-N 3Å
211	R	98.4	Very high	97.3	Very high	3 Å²	3	46.1 Å²	46.1	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-65.4	-39.1	174	-75.7	-179.1	176.8	-178.4	-3.6	112.8	C141 L207 I208 R209 I213 G214 A215 F225 D227 G309 G310 Y325	C141-R211 VanDerWaalsContact SG-CG 3.55Å; L207-R211 HydrophobicContact CD1-CG 4.29Å; L207-R211 HydrophobicContact CG-CG 4.48Å; L207-R211 WeakPolarHBondContact O-CB 3.18Å; L207-R211 WeakPolarHBondContact O-CG 3.1Å; L207-R211 PolarHBondContact O-N 3.1Å; I208-R211 PolarHBondContact O-N 2.99Å; R209-R211 VanDerWaalsContact C-N 3.3Å; R209-R211 PolarHBondContact O-N 2.53Å; R211-I213 VanDerWaalsContact C-N 3.34Å; R211-G214 PolarHBondContact O-N 3.17Å; R211-A215 VanDerWaalsContact O-CB 3.25Å; R211-A215 WeakPolarHBondContact O-CB 3.25Å; R211-A215 PolarHBondContact O-N 2.84Å; R211-F225 HydrophobicContact CB-CD1 4.11Å; R211-F225 HydrophobicContact CB-CE1 3.74Å; R211-F225 HydrophobicContact CG-CD1 3.79Å; R211-F225 HydrophobicContact CG-CE1 3.96Å; R211-D227 IonicContact NH2-OD1 2.92Å; R211-D227 PolarHBondContact NH2-OD1 2.97Å; R211-G309 VanDerWaalsContact CZ-O 3.24Å; R211-G309 PolarHBondContact NH1-O 2.81Å; R211-G309 PolarHBondContact NH2-O 2.84Å; R211-G310 PolarHBondContact NH2-O 3.25Å; R211-Y325 HydrophobicContact CB-CD2 4.46Å; R211-Y325 HydrophobicContact CB-CE2 4.2Å; R211-Y325 PolarHBondContact NH1-OH 3.1Å; R211-Y325 VanDerWaalsContact NH1-OH 3.1Å
212	L	98.4	Very high	97.3	Very high	21 Å²	21	45.2 Å²	45.2	11%	0.11	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-42.7	173.6	-68.3	177.4	0	0	0	111.8	I208 R209 A215 S216 F319 Q324 Y325 K327	I208-L212 WeakPolarHBondContact O-CG 3.45Å; I208-L212 PolarHBondContact O-N 3.37Å; I208-L212 VanDerWaalsContact O-N 3.13Å; R209-L212 WeakPolarHBondContact O-CB 3.45Å; R209-L212 PolarHBondContact O-N 3.4Å; R209-L212 VanDerWaalsContact O-N 3.16Å; L212-A215 PolarHBondContact O-N 3.46Å; L212-S216 PolarHBondContact O-N 3.33Å; L212-F319 HydrophobicContact CD2-CE1 4.37Å; L212-F319 HydrophobicContact CD2-CZ 4.22Å; L212-Q324 HydrophobicContact CD2-CB 3.54Å; L212-Q324 HydrophobicContact CD2-CG 4.41Å; L212-Y325 HydrophobicContact CD2-CD2 4.32Å; L212-K327 HydrophobicContact CD1-CB 3.91Å
213	I	98.5	Very high	97.5	Very high	40 Å²	40	35.5 Å²	35.5	21%	0.205	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-45.7	176.4	-68.1	164.3	0	0	0	110.6	V172 I199 N201 E205 R209 A210 R211 S216 H217	V172-I213 HydrophobicContact CG1-CG2 4.42Å; I199-I213 HydrophobicContact CD1-CG2 4.48Å; I199-I213 HydrophobicContact CG2-CG2 3.82Å; N201-I213 WeakPolarHBondContact OD1-CD1 3.28Å; E205-I213 HydrophobicContact CG-CD1 4.26Å; R209-I213 VanDerWaalsContact O-CG1 3.28Å; R209-I213 WeakPolarHBondContact O-CG1 3.41Å; R209-I213 PolarHBondContact O-N 3.33Å; A210-I213 PolarHBondContact O-N 3.31Å; R211-I213 VanDerWaalsContact C-N 3.34Å; I213-S216 PolarHBondContact O-N 3.29Å; I213-S216 PolarHBondContact O-OG 3.03Å; I213-H217 PolarHBondContact O-N 2.96Å; I213-H217 PolarHBondContact O-ND1 3.02Å
214	G	98.5	Very high	97.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.8	-44.5	176.1	0	0	0	0	0	112.3	A210 R211 S216 H217 A218	A210-G214 PolarHBondContact O-N 3Å; R211-G214 PolarHBondContact O-N 3.17Å; G214-S216 VanDerWaalsContact C-N 3.31Å; G214-S216 PolarHBondContact O-N 2.81Å; G214-H217 PolarHBondContact O-N 3.25Å; G214-A218 PolarHBondContact O-N 2.67Å
215	A	98.6	Very high	97.9	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.033	14%	0.139	C	C	.	.	H	α-helix	trans	-64.2	-32.5	178	0	0	0	0	0	113.3	R211 L212 H217 A218 L223 F225 F319	R211-A215 VanDerWaalsContact O-CB 3.25Å; R211-A215 WeakPolarHBondContact O-CB 3.25Å; R211-A215 PolarHBondContact O-N 2.84Å; L212-A215 PolarHBondContact O-N 3.46Å; A215-H217 VanDerWaalsContact C-N 3.28Å; A215-H217 PolarHBondContact O-N 3.48Å; A215-A218 WeakPolarHBondContact O-CB 3.12Å; A215-A218 PolarHBondContact O-N 3.26Å; A215-L223 HydrophobicContact CB-CD1 3.8Å; A215-L223 HydrophobicContact CB-CD2 4.43Å; A215-F225 HydrophobicContact CB-CZ 4.18Å; A215-F319 HydrophobicContact CB-CD1 4.31Å; A215-F319 HydrophobicContact CB-CE1 3.82Å
216	S	98.4	Very high	98	Very high	81 Å²	81	23.7 Å²	23.7	57%	0.566	13%	0.131	S	C	*	.	H	α-helix	trans	-73	-20.4	178.2	71.2	0	0	0	0	113.7	L212 I213 G214	L212-S216 PolarHBondContact O-N 3.33Å; I213-S216 PolarHBondContact O-N 3.29Å; I213-S216 PolarHBondContact O-OG 3.03Å; G214-S216 VanDerWaalsContact C-N 3.31Å; G214-S216 PolarHBondContact O-N 2.81Å
217	H	98.3	Very high	98.2	Very high	103 Å²	103	25 Å²	25	48%	0.477	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-3.4	176.2	-68	76.3	0	0	0	113.2	I170 I199 I213 G214 A215	I170-H217 HydrophobicContact CD1-CB 4.37Å; I199-H217 HydrophobicContact CD1-CB 3.67Å; I199-H217 VanDerWaalsContact CD1-CG 3.46Å; I213-H217 PolarHBondContact O-N 2.96Å; I213-H217 PolarHBondContact O-ND1 3.02Å; G214-H217 PolarHBondContact O-N 3.25Å; A215-H217 VanDerWaalsContact C-N 3.28Å; A215-H217 PolarHBondContact O-N 3.48Å
218	A	98.4	Very high	98.3	Very high	8 Å²	8	23.5 Å²	23.5	7%	0.066	13%	0.13	C	C	.	.			trans	-80	138.2	-179.5	0	0	0	0	0	112.9	E168 I170 G214 A215 L223 R316	E168-A218 WeakPolarHBondContact OE1-CA 3.3Å; I170-A218 HydrophobicContact CD1-CB 3.79Å; G214-A218 PolarHBondContact O-N 2.67Å; A215-A218 WeakPolarHBondContact O-CB 3.12Å; A215-A218 PolarHBondContact O-N 3.26Å; A218-L223 HydrophobicContact CB-CD2 3.32Å; A218-R316 WeakPolarHBondContact O-CD 3.21Å
219	S	98.1	Very high	98.3	Very high	56 Å²	56	24.6 Å²	24.6	39%	0.392	14%	0.135	S	C	.	.			trans	-111.1	-25.8	-177.8	59.6	0	0	0	0	113.8	S137 E167 E168 R316	S137-S219 PolarHBondContact OG-N 2.88Å; E167-S219 WeakPolarHBondContact CG-OG 3.4Å; E168-S219 WeakPolarHBondContact OE1-CB 3.35Å; E168-S219 PolarHBondContact OE1-N 2.79Å; E168-S219 PolarHBondContact OE1-OG 2.87Å; S219-R316 PolarHBondContact O-NH2 3.34Å; S219-R316 VanDerWaalsContact O-NH2 3.17Å
220	G	98.2	Very high	98.4	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-61.7	160	-179.9	0	0	0	0	0	113.7	T135 S137 V222 R316	T135-G220 WeakPolarHBondContact OG1-CA 3.28Å; S137-G220 WeakPolarHBondContact OG-CA 3.33Å; S137-G220 PolarHBondContact OG-N 3.4Å; G220-V222 VanDerWaalsContact C-N 3.29Å; G220-V222 PolarHBondContact O-N 2.95Å; G220-R316 WeakPolarHBondContact O-CD 3.06Å; G220-R316 PolarHBondContact O-NE 2.84Å
221	D	98.6	Very high	98.4	Very high	82 Å²	82	22.2 Å²	22.2	44%	0.439	13%	0.127	S	C	.	.	S	Bend	trans	-65.5	-34.5	-178.8	-64.6	-48.4	0	0	0	112.7	P134 T135 R316	P134-D221 WeakPolarHBondContact CA-OD2 3.45Å; P134-D221 HydrophobicContact CB-CB 3.55Å; T135-D221 PolarHBondContact N-OD2 2.75Å; T135-D221 WeakPolarHBondContact O-CB 3.44Å; T135-D221 PolarHBondContact O-N 2.77Å; T135-D221 PolarHBondContact OG1-N 3.2Å; D221-R316 WeakPolarHBondContact O-CB 3.34Å; D221-R316 PolarHBondContact O-N 3.4Å
222	V	98.9	Very high	98.4	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	134.6	-177.7	176.6	0	0	0	0	109.9	P134 T135 A136 S137 G220 V224 L241 I244 A313	P134-V222 HydrophobicContact CB-CG2 3.98Å; T135-V222 PolarHBondContact O-N 3.29Å; A136-V222 CarbonylContact C-O 3.44Å; A136-V222 VanDerWaalsContact CA-O 3.3Å; A136-V222 WeakPolarHBondContact CA-O 3.39Å; S137-V222 PolarHBondContact N-O 3.06Å; G220-V222 VanDerWaalsContact C-N 3.29Å; G220-V222 PolarHBondContact O-N 2.95Å; V222-V224 HydrophobicContact CG1-CG2 4.05Å; V222-L241 HydrophobicContact CB-CD2 3.87Å; V222-L241 HydrophobicContact CG1-CD2 3.99Å; V222-L241 HydrophobicContact CG2-CD2 3.84Å; V222-I244 HydrophobicContact CG1-CD1 3.61Å; V222-I244 HydrophobicContact CG2-CD1 4.18Å; V222-I244 HydrophobicContact CG2-CG2 3.99Å; V222-A313 HydrophobicContact CG1-CB 3.99Å
223	L	98.9	Very high	98.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.4	166.6	-60.7	174.5	0	0	0	108.4	A215 A218 F225 A313 I314 R316 F319	A215-L223 HydrophobicContact CB-CD1 3.8Å; A215-L223 HydrophobicContact CB-CD2 4.43Å; A218-L223 HydrophobicContact CB-CD2 3.32Å; L223-F225 HydrophobicContact CB-CE2 3.95Å; L223-F225 HydrophobicContact CB-CZ 4.32Å; L223-F225 HydrophobicContact CD1-CE2 4.28Å; L223-F225 HydrophobicContact CD1-CZ 4.13Å; L223-A313 CarbonylContact O-C 3.59Å; L223-A313 VanDerWaalsContact O-CA 3.23Å; L223-A313 WeakPolarHBondContact O-CA 3.44Å; L223-I314 HydrophobicContact CB-CG2 4.09Å; L223-I314 PolarHBondContact N-O 2.98Å; L223-I314 PolarHBondContact O-N 2.99Å; L223-R316 HydrophobicContact CD1-CB 4.38Å; L223-R316 HydrophobicContact CD1-CG 4.15Å; L223-R316 HydrophobicContact CD2-CB 4.35Å; L223-R316 HydrophobicContact CD2-CG 4.06Å; L223-R316 HydrophobicContact CG-CB 3.92Å; L223-R316 HydrophobicContact CG-CG 3.98Å; L223-F319 HydrophobicContact CD1-CB 4.06Å; L223-F319 HydrophobicContact CD1-CD1 3.48Å; L223-F319 VanDerWaalsContact CD1-CD1 3.48Å; L223-F319 HydrophobicContact CD1-CE1 4.14Å; L223-F319 HydrophobicContact CD1-CG 3.95Å
224	V	98.9	Very high	98.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	110.4	171.6	-174.2	0	0	0	0	108.2	A136 S137 I138 V139 V222 W236 L237 F312 A313	A136-V224 HydrophobicContact CB-CG2 3.89Å; S137-V224 PolarHBondContact O-N 2.88Å; I138-V224 CarbonylContact C-O 3.5Å; I138-V224 WeakPolarHBondContact CA-O 3.37Å; I138-V224 HydrophobicContact CG1-CB 4.2Å; V139-V224 PolarHBondContact N-O 2.81Å; V222-V224 HydrophobicContact CG1-CG2 4.05Å; V224-W236 HydrophobicContact CG1-CH2 3.73Å; V224-W236 HydrophobicContact CG1-CZ3 3.85Å; V224-L237 HydrophobicContact CG2-CD1 3.84Å; V224-F312 CarbonylContact C-O 3.41Å; V224-F312 WeakPolarHBondContact CA-O 3.28Å; V224-A313 HydrophobicContact CG2-CB 3.91Å
225	F	98.8	Very high	97.9	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.9	175.8	-62.9	-82.4	0	0	0	109.4	V139 R211 A215 L223 I311 F312 I314 F319	V139-F225 HydrophobicContact CB-CD1 3.84Å; V139-F225 HydrophobicContact CB-CE1 4.01Å; V139-F225 HydrophobicContact CG1-CD1 4.03Å; V139-F225 HydrophobicContact CG1-CE1 4.04Å; V139-F225 HydrophobicContact CG2-CE1 4.35Å; V139-F225 WeakPolarHBondContact O-CA 3.35Å; R211-F225 HydrophobicContact CB-CD1 4.11Å; R211-F225 HydrophobicContact CB-CE1 3.74Å; R211-F225 HydrophobicContact CG-CD1 3.79Å; R211-F225 HydrophobicContact CG-CE1 3.96Å; A215-F225 HydrophobicContact CB-CZ 4.18Å; L223-F225 HydrophobicContact CB-CE2 3.95Å; L223-F225 HydrophobicContact CB-CZ 4.32Å; L223-F225 HydrophobicContact CD1-CE2 4.28Å; L223-F225 HydrophobicContact CD1-CZ 4.13Å; F225-I311 VanDerWaalsContact O-CA 3.3Å; F225-I311 WeakPolarHBondContact O-CA 3.47Å; F225-F312 HydrophobicContact CB-CD1 4.06Å; F225-F312 HydrophobicContact CB-CE1 3.84Å; F225-F312 HydrophobicContact CB-CZ 4.43Å; F225-F312 HydrophobicContact CD2-CD1 4.11Å; F225-F312 HydrophobicContact CD2-CD2 4.18Å; F225-F312 AromaticContact CD2-CE1 3.45Å; F225-F312 HydrophobicContact CD2-CE1 3.45Å; F225-F312 VanDerWaalsContact CD2-CE1 3.45Å; F225-F312 AromaticContact CD2-CE2 3.55Å; F225-F312 HydrophobicContact CD2-CE2 3.55Å; F225-F312 HydrophobicContact CD2-CG 4.44Å; F225-F312 AromaticContact CD2-CZ 3.14Å; F225-F312 HydrophobicContact CD2-CZ 3.14Å; F225-F312 HydrophobicContact CE2-CE1 4.23Å; F225-F312 AromaticContact CE2-CE2 3.82Å; F225-F312 HydrophobicContact CE2-CE2 3.82Å; F225-F312 AromaticContact CE2-CZ 3.5Å; F225-F312 HydrophobicContact CE2-CZ 3.5Å; F225-F312 HydrophobicContact CG-CD1 4.46Å; F225-F312 AromaticContact CG-CE1 3.83Å; F225-F312 HydrophobicContact CG-CE1 3.83Å; F225-F312 AromaticContact CG-CZ 3.97Å; F225-F312 HydrophobicContact CG-CZ 3.97Å; F225-F312 PolarHBondContact N-O 3.07Å; F225-F312 PolarHBondContact O-N 3.43Å; F225-I314 HydrophobicContact CE2-CG2 4.23Å; F225-F319 HydrophobicContact CZ-CE1 4.33Å; F225-F319 HydrophobicContact CZ-CZ 4.22Å
226	L	98.5	Very high	97.8	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.4	174.4	-83.8	171.9	0	0	0	109.4	I138 V139 I140 V157 C230 V232 W236 I311 V358	I138-L226 HydrophobicContact CG2-CD1 3.76Å; I138-L226 HydrophobicContact CG2-CG 4.45Å; V139-L226 PolarHBondContact O-N 3.23Å; I140-L226 WeakPolarHBondContact CA-O 3.19Å; I140-L226 HydrophobicContact CG1-CB 3.91Å; V157-L226 HydrophobicContact CG2-CD1 3.65Å; L226-C230 HydrophobicContact CD2-CB 4.26Å; L226-V232 HydrophobicContact CD1-CG1 4.17Å; L226-V232 HydrophobicContact CD2-CG1 4.49Å; L226-W236 HydrophobicContact CD1-CH2 3.55Å; L226-W236 HydrophobicContact CD1-CZ2 4.25Å; L226-W236 HydrophobicContact CD1-CZ3 4.1Å; L226-W236 HydrophobicContact CD2-CZ3 4.27Å; L226-W236 HydrophobicContact CG-CH2 4.23Å; L226-W236 HydrophobicContact CG-CZ3 4.39Å; L226-I311 HydrophobicContact CD2-CB 4.38Å; L226-I311 HydrophobicContact CD2-CD1 4.37Å; L226-I311 HydrophobicContact CD2-CG1 4.12Å; L226-I311 HydrophobicContact CD2-CG2 3.45Å; L226-I311 VanDerWaalsContact CD2-CG2 3.45Å; L226-I311 HydrophobicContact CG-CG2 4.34Å; L226-V358 HydrophobicContact CD2-CG1 3.91Å
227	D	98	Very high	97.8	Very high	30 Å²	30	23 Å²	23	16%	0.16	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	155.5	167.8	-73.1	-7.4	0	0	0	109.9	R211 H229 C230 H360	R211-D227 IonicContact NH2-OD1 2.92Å; R211-D227 PolarHBondContact NH2-OD1 2.97Å; D227-H229 PolarHBondContact O-N 2.93Å; D227-H229 VanDerWaalsContact O-N 3.08Å; D227-C230 PolarHBondContact O-SG 3.36Å; D227-H360 IonicContact OD2-CD2 3.59Å; D227-H360 IonicContact OD2-CE1 2.79Å; D227-H360 IonicContact OD2-NE2 2.81Å; D227-H360 PolarHBondContact OD2-NE2 2.65Å
228	S	97.3	Very high	97.8	Very high	6 Å²	6	19.1 Å²	19.1	4%	0.042	10%	0.099	C	C	.	.	S	Bend	trans	-75.9	9.2	-173.6	49.5	0	0	0	0	116	E145 A149 L150 T153	E145-S228 PolarHBondContact OE2-OG 3.38Å; A149-S228 CarbonylContact C-O 3.41Å; L150-S228 WeakPolarHBondContact CA-O 3.43Å; T153-S228 VanDerWaalsContact OG1-C 3.29Å; T153-S228 PolarHBondContact OG1-O 3.18Å
229	H	97.4	Very high	97.7	Very high	23 Å²	23	19 Å²	19	11%	0.106	10%	0.098	C	C	.	.	S	Bend	trans	-140.8	56.1	-178.6	42.5	-87.8	0	0	0	109.7	E145 A149 T153 D227 H360 I361 K363	E145-H229 IonicContact OE1-ND1 2.98Å; E145-H229 IonicContact OE2-CE1 3.6Å; E145-H229 IonicContact OE2-CG 3.95Å; E145-H229 IonicContact OE2-ND1 3.61Å; E145-H229 PolarHBondContact OE2-ND1 2.99Å; A149-H229 HydrophobicContact CB-CB 4.31Å; T153-H229 WeakPolarHBondContact OG1-CA 3.34Å; T153-H229 PolarHBondContact OG1-N 3.04Å; D227-H229 PolarHBondContact O-N 2.93Å; D227-H229 VanDerWaalsContact O-N 3.08Å; H229-H360 AromaticContact CD2-CD2 3.99Å; H229-H360 AromaticContact CD2-CE1 3.74Å; H229-H360 AromaticContact CD2-NE2 3.47Å; H229-H360 PolarHBondContact CD2-NE2 3.25Å; H229-H360 AromaticContact NE2-CE1 3.55Å; H229-H360 AromaticContact NE2-NE2 3.24Å; H229-H360 PolarHBondContact NE2-NE2 2.82Å; H229-I361 HydrophobicContact CB-CB 4.21Å; H229-I361 HydrophobicContact CB-CD1 4.01Å; H229-I361 HydrophobicContact CB-CG1 4.2Å; H229-I361 PolarHBondContact O-N 3.03Å; H229-I361 VanDerWaalsContact O-N 3.07Å; H229-K363 PolarHBondContact CE1-NZ 3.37Å; H229-K363 VanDerWaalsContact CG-CE 3.44Å; H229-K363 WeakPolarHBondContact ND1-CE 3.31Å; H229-K363 PolarHBondContact ND1-NZ 2.9Å; H229-K363 VanDerWaalsContact ND1-NZ 3.11Å
230	C	98.3	Very high	97.7	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.007	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	155.9	178.6	-60.9	0	0	0	0	111.3	T153 L226 D227 V358 G359	T153-C230 WeakPolarHBondContact CA-O 3.42Å; T153-C230 WeakPolarHBondContact CB-O 2.71Å; T153-C230 HydrophobicContact CG2-CB 4.1Å; T153-C230 PolarHBondContact OG1-N 2.86Å; T153-C230 PolarHBondContact OG1-O 2.96Å; L226-C230 HydrophobicContact CD2-CB 4.26Å; D227-C230 PolarHBondContact O-SG 3.36Å; C230-V358 HydrophobicContact CB-CG1 3.79Å; C230-G359 CarbonylContact C-O 3.53Å; C230-G359 WeakPolarHBondContact CA-O 3.25Å; C230-G359 WeakPolarHBondContact CB-O 3.39Å
231	E	98.3	Very high	97.7	Very high	6 Å²	6	16.3 Å²	16.3	3%	0.028	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	116.8	164.3	-69.7	172.5	-99.4	0	0	108.5	R114 V116 Q152 I259 Y266 G359	R114-E231 WeakPolarHBondContact CG-OE2 3.46Å; R114-E231 IonicContact CZ-OE1 3.94Å; R114-E231 IonicContact CZ-OE2 2.65Å; R114-E231 IonicContact NE-OE1 3.57Å; R114-E231 PolarHBondContact NE-OE1 2.82Å; R114-E231 IonicContact NE-OE2 3.5Å; R114-E231 PolarHBondContact NE-OE2 3.21Å; R114-E231 IonicContact NH2-OE1 3.59Å; R114-E231 PolarHBondContact NH2-OE1 3.35Å; R114-E231 IonicContact NH2-OE2 3.25Å; V116-E231 HydrophobicContact CG1-CB 4.26Å; V116-E231 VanDerWaalsContact CG1-OE2 3.25Å; V116-E231 WeakPolarHBondContact CG1-OE2 3.12Å; Q152-E231 HydrophobicContact CB-CG 4.45Å; E231-I259 HydrophobicContact CB-CD1 4Å; E231-I259 HydrophobicContact CG-CD1 4.11Å; E231-I259 WeakPolarHBondContact OE1-CD1 3.4Å; E231-Y266 HydrophobicContact CB-CE2 4.44Å; E231-G359 PolarHBondContact N-O 2.86Å; E231-G359 PolarHBondContact O-N 3.46Å
232	V	98.4	Very high	97.7	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	149.1	-177.9	-56.2	0	0	0	0	110.8	S156 V157 L160 L226 W236 V358	S156-V232 VanDerWaalsContact C-CG2 3.5Å; S156-V232 WeakPolarHBondContact O-CG2 3.12Å; S156-V232 PolarHBondContact OG-N 2.89Å; V157-V232 HydrophobicContact CG2-CG1 3.9Å; V157-V232 HydrophobicContact CG2-CG2 4.4Å; L160-V232 HydrophobicContact CB-CG2 4.1Å; L160-V232 HydrophobicContact CD1-CG2 4.18Å; L160-V232 WeakPolarHBondContact CD1-O 3.16Å; L226-V232 HydrophobicContact CD1-CG1 4.17Å; L226-V232 HydrophobicContact CD2-CG1 4.49Å; V232-W236 HydrophobicContact CB-CB 4.33Å; V232-W236 HydrophobicContact CB-CD2 3.69Å; V232-W236 HydrophobicContact CB-CE3 4.32Å; V232-W236 HydrophobicContact CB-CG 3.64Å; V232-W236 HydrophobicContact CG1-CD2 3.68Å; V232-W236 HydrophobicContact CG1-CE3 3.93Å; V232-W236 HydrophobicContact CG1-CG 4.2Å; V232-W236 HydrophobicContact CG1-CH2 4.14Å; V232-W236 HydrophobicContact CG1-CZ2 3.91Å; V232-W236 HydrophobicContact CG1-CZ3 4.14Å; V232-W236 HydrophobicContact CG2-CD2 4.31Å; V232-W236 HydrophobicContact CG2-CG 4.13Å; V232-V358 HydrophobicContact CB-CG2 4.44Å; V232-V358 HydrophobicContact CG1-CG1 4.11Å; V232-V358 HydrophobicContact CG1-CG2 4.09Å
233	N	96.7	Very high	97.6	Very high	1 Å²	1	15 Å²	15	1%	0.005	7%	0.072	C	C	.	.			trans	-91.5	174.3	175.6	-145.1	-64.6	0	0	0	111.6	P117 T119 W236 Y266 R357	P117-N233 PolarHBondContact O-ND2 3.22Å; T119-N233 PolarHBondContact OG1-ND2 3.31Å; N233-W236 VanDerWaalsContact O-CB 3.3Å; N233-W236 WeakPolarHBondContact O-CB 3.1Å; N233-W236 PolarHBondContact O-N 2.81Å; N233-Y266 PolarHBondContact ND2-OH 2.78Å; N233-R357 HydrophobicContact CB-CB 4.08Å; N233-R357 VanDerWaalsContact CB-O 3.3Å; N233-R357 WeakPolarHBondContact CB-O 3.46Å; N233-R357 PolarHBondContact N-O 3.28Å
234	R	94.4	Very high	97.6	Very high	117 Å²	117	15.1 Å²	15.1	44%	0.442	7%	0.073	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	138.9	176.8	-63.4	178.3	-177.2	-91.7	0.1	110.6	E115 R120 L160 W236	E115-R234 IonicContact OE1-NH2 2.75Å; R120-R234 VanDerWaalsContact CD-O 3.22Å; R120-R234 WeakPolarHBondContact CD-O 3.5Å; R120-R234 VanDerWaalsContact CZ-O 3.27Å; R120-R234 PolarHBondContact NE-O 2.78Å; R120-R234 PolarHBondContact NH1-O 2.9Å; L160-R234 HydrophobicContact CD2-CG 4.18Å; R234-W236 PolarHBondContact O-N 2.62Å
235	V	94.6	Very high	97.5	Very high	46 Å²	46	17.6 Å²	17.6	28%	0.279	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	38.4	178.8	-161.3	0	0	0	0	111.7	R120 Y129 E238 P239	R120-V235 VanDerWaalsContact NH1-CB 3.27Å; R120-V235 VanDerWaalsContact NH1-CG2 3.25Å; Y129-V235 HydrophobicContact CD2-CG1 4.04Å; Y129-V235 HydrophobicContact CE2-CG1 3.97Å; V235-E238 WeakPolarHBondContact CA-OE2 3.08Å; V235-E238 HydrophobicContact CG1-CB 3.97Å; V235-E238 VanDerWaalsContact CG1-CD 3.45Å; V235-E238 HydrophobicContact CG1-CG 4.1Å; V235-E238 WeakPolarHBondContact CG1-OE2 3.28Å; V235-P239 WeakPolarHBondContact O-CD 3.33Å; V235-P239 VanDerWaalsContact O-CG 3.28Å; V235-P239 WeakPolarHBondContact O-CG 3.46Å
236	W	97.3	Very high	97.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.			trans	-75.9	-30.7	-178.2	74.8	-72.6	0	0	0	112.1	I138 V157 T161 V224 L226 V232 N233 R234 L240 S356 V358	I138-W236 HydrophobicContact CD1-CH2 4.13Å; I138-W236 HydrophobicContact CD1-CZ2 3.83Å; V157-W236 HydrophobicContact CG2-CZ2 4.36Å; T161-W236 PolarHBondContact OG1-NE1 2.87Å; T161-W236 VanDerWaalsContact OG1-NE1 3.1Å; V224-W236 HydrophobicContact CG1-CH2 3.73Å; V224-W236 HydrophobicContact CG1-CZ3 3.85Å; L226-W236 HydrophobicContact CD1-CH2 3.55Å; L226-W236 HydrophobicContact CD1-CZ2 4.25Å; L226-W236 HydrophobicContact CD1-CZ3 4.1Å; L226-W236 HydrophobicContact CD2-CZ3 4.27Å; L226-W236 HydrophobicContact CG-CH2 4.23Å; L226-W236 HydrophobicContact CG-CZ3 4.39Å; V232-W236 HydrophobicContact CB-CB 4.33Å; V232-W236 HydrophobicContact CB-CD2 3.69Å; V232-W236 HydrophobicContact CB-CE3 4.32Å; V232-W236 HydrophobicContact CB-CG 3.64Å; V232-W236 HydrophobicContact CG1-CD2 3.68Å; V232-W236 HydrophobicContact CG1-CE3 3.93Å; V232-W236 HydrophobicContact CG1-CG 4.2Å; V232-W236 HydrophobicContact CG1-CH2 4.14Å; V232-W236 HydrophobicContact CG1-CZ2 3.91Å; V232-W236 HydrophobicContact CG1-CZ3 4.14Å; V232-W236 HydrophobicContact CG2-CD2 4.31Å; V232-W236 HydrophobicContact CG2-CG 4.13Å; N233-W236 VanDerWaalsContact O-CB 3.3Å; N233-W236 WeakPolarHBondContact O-CB 3.1Å; N233-W236 PolarHBondContact O-N 2.81Å; R234-W236 PolarHBondContact O-N 2.62Å; W236-L240 HydrophobicContact CE3-CD1 4.33Å; W236-L240 HydrophobicContact CZ3-CD1 4.43Å; W236-S356 WeakPolarHBondContact O-CB 3.13Å; W236-S356 PolarHBondContact O-OG 3.09Å; W236-V358 HydrophobicContact CD2-CG2 4.35Å; W236-V358 HydrophobicContact CE3-CG2 3.58Å; W236-V358 HydrophobicContact CZ3-CG2 4.15Å
237	L	98.1	Very high	97.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-89.4	-40.9	-169.4	-177.8	60	0	0	0	112.1	A136 T161 F165 V224 P239 L240 L241	A136-L237 HydrophobicContact CB-CD1 4.3Å; A136-L237 HydrophobicContact CB-CD2 4.05Å; T161-L237 HydrophobicContact CG2-CD2 3.42Å; T161-L237 VanDerWaalsContact CG2-CD2 3.42Å; F165-L237 HydrophobicContact CB-CD2 4.12Å; V224-L237 HydrophobicContact CG2-CD1 3.84Å; L237-P239 VanDerWaalsContact C-CD 3.43Å; L237-L240 WeakPolarHBondContact O-CA 3.42Å; L237-L240 WeakPolarHBondContact O-CB 3.06Å; L237-L240 PolarHBondContact O-N 3.48Å; L237-L241 HydrophobicContact CD1-CD1 4.23Å; L237-L241 HydrophobicContact CD1-CD2 4.23Å; L237-L241 HydrophobicContact CD1-CG 3.93Å; L237-L241 HydrophobicContact CD2-CD1 3.93Å; L237-L241 HydrophobicContact CG-CD1 3.64Å; L237-L241 HydrophobicContact CG-CG 3.84Å; L237-L241 WeakPolarHBondContact O-CG 3.3Å; L237-L241 PolarHBondContact O-N 3.41Å
238	E	97.1	Very high	97.4	Very high	22 Å²	22	27.6 Å²	27.6	10%	0.103	14%	0.142	C	C	.	.	H	α-helix	trans	-54.8	-43.7	-176.3	-55.1	90.6	136.9	0	0	113.2	Y129 L133 F165 V235 L240 L241 H242	Y129-E238 HydrophobicContact CD2-CB 3.93Å; Y129-E238 HydrophobicContact CG-CB 3.97Å; L133-E238 HydrophobicContact CD1-CB 4.32Å; F165-E238 HydrophobicContact CD2-CG 3.95Å; F165-E238 HydrophobicContact CE2-CG 3.46Å; F165-E238 VanDerWaalsContact CE2-CG 3.46Å; F165-E238 HydrophobicContact CZ-CG 4.38Å; V235-E238 WeakPolarHBondContact CA-OE2 3.08Å; V235-E238 HydrophobicContact CG1-CB 3.97Å; V235-E238 VanDerWaalsContact CG1-CD 3.45Å; V235-E238 HydrophobicContact CG1-CG 4.1Å; V235-E238 WeakPolarHBondContact CG1-OE2 3.28Å; E238-L240 VanDerWaalsContact C-N 3.29Å; E238-L240 PolarHBondContact O-N 2.75Å; E238-L241 PolarHBondContact O-N 3.34Å; E238-H242 WeakPolarHBondContact O-CB 3.13Å; E238-H242 PolarHBondContact O-N 3.19Å
239	P	96.9	Very high	97.4	Very high	5 Å²	5	31.2 Å²	31.2	3%	0.032	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-33.7	176.3	-16.7	29.7	0	0	0	113	Y129 V235 L237 A243 I353 C355	Y129-P239 HydrophobicContact CE1-CB 4Å; Y129-P239 HydrophobicContact CE1-CG 4.23Å; Y129-P239 HydrophobicContact CE2-CG 3.92Å; Y129-P239 WeakPolarHBondContact OH-CB 3.4Å; Y129-P239 WeakPolarHBondContact OH-CG 3.47Å; V235-P239 WeakPolarHBondContact O-CD 3.33Å; V235-P239 VanDerWaalsContact O-CG 3.28Å; V235-P239 WeakPolarHBondContact O-CG 3.46Å; L237-P239 VanDerWaalsContact C-CD 3.43Å; P239-A243 PolarHBondContact O-N 3Å; P239-I353 HydrophobicContact CB-CG2 3.67Å; P239-C355 HydrophobicContact CB-CB 3.74Å; P239-C355 HydrophobicContact CG-CB 3.89Å
240	L	98.4	Very high	97.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-71.3	-49.1	178.3	-56.3	178.7	0	0	0	110.2	W236 L237 E238 H242 A243 I244 V252 A313 I353	W236-L240 HydrophobicContact CE3-CD1 4.33Å; W236-L240 HydrophobicContact CZ3-CD1 4.43Å; L237-L240 WeakPolarHBondContact O-CA 3.42Å; L237-L240 WeakPolarHBondContact O-CB 3.06Å; L237-L240 PolarHBondContact O-N 3.48Å; E238-L240 VanDerWaalsContact C-N 3.29Å; E238-L240 PolarHBondContact O-N 2.75Å; L240-H242 VanDerWaalsContact C-N 3.33Å; L240-H242 PolarHBondContact O-N 3.2Å; L240-A243 PolarHBondContact O-N 2.62Å; L240-I244 WeakPolarHBondContact O-CG1 3.27Å; L240-I244 PolarHBondContact O-N 2.95Å; L240-I244 VanDerWaalsContact O-N 3.11Å; L240-V252 HydrophobicContact CB-CG2 3.88Å; L240-V252 HydrophobicContact CD2-CB 4.2Å; L240-V252 HydrophobicContact CD2-CG2 3.88Å; L240-V252 HydrophobicContact CG-CG2 4.45Å; L240-A313 HydrophobicContact CB-CB 4.23Å; L240-A313 HydrophobicContact CD1-CB 4.33Å; L240-I353 HydrophobicContact CD2-CB 3.89Å; L240-I353 HydrophobicContact CD2-CG1 3.88Å
241	L	98.6	Very high	97.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.2	-40.5	178	-65.7	179.9	0	0	0	112	L133 P134 A136 F165 V222 L237 E238 A243 I244 A245	L133-L241 HydrophobicContact CB-CB 4.03Å; L133-L241 HydrophobicContact CB-CD1 4.32Å; L133-L241 HydrophobicContact CD1-CB 4.01Å; L133-L241 HydrophobicContact CG-CB 4.44Å; P134-L241 WeakPolarHBondContact O-CD1 3.25Å; A136-L241 HydrophobicContact CB-CD2 4.26Å; F165-L241 HydrophobicContact CB-CD1 3.99Å; F165-L241 HydrophobicContact CD1-CD1 4.22Å; F165-L241 HydrophobicContact CG-CD1 4.03Å; V222-L241 HydrophobicContact CB-CD2 3.87Å; V222-L241 HydrophobicContact CG1-CD2 3.99Å; V222-L241 HydrophobicContact CG2-CD2 3.84Å; L237-L241 HydrophobicContact CD1-CD1 4.23Å; L237-L241 HydrophobicContact CD1-CD2 4.23Å; L237-L241 HydrophobicContact CD1-CG 3.93Å; L237-L241 HydrophobicContact CD2-CD1 3.93Å; L237-L241 HydrophobicContact CG-CD1 3.64Å; L237-L241 HydrophobicContact CG-CG 3.84Å; L237-L241 WeakPolarHBondContact O-CG 3.3Å; L237-L241 PolarHBondContact O-N 3.41Å; E238-L241 PolarHBondContact O-N 3.34Å; L241-A243 VanDerWaalsContact C-N 3.33Å; L241-A243 PolarHBondContact O-N 2.74Å; L241-I244 PolarHBondContact O-N 3.11Å; L241-A245 VanDerWaalsContact O-CB 3.27Å; L241-A245 WeakPolarHBondContact O-CB 3.32Å; L241-A245 PolarHBondContact O-N 2.93Å
242	H	97.4	Very high	97.5	Very high	44 Å²	44	31 Å²	31	20%	0.204	16%	0.156	C	C	.	.	H	α-helix	trans	-63.1	-38.9	176.8	-175.5	61.4	0	0	0	112.6	Y129 P130 L133 E238 L240 K246	Y129-H242 HydrophobicContact CD1-CB 3.74Å; Y129-H242 AromaticContact CD1-CD2 3.81Å; Y129-H242 AromaticContact CD1-CG 3.85Å; Y129-H242 HydrophobicContact CE1-CB 4.22Å; P130-H242 WeakPolarHBondContact CD-ND1 3.31Å; L133-H242 HydrophobicContact CD1-CB 4.37Å; L133-H242 HydrophobicContact CD2-CB 4.05Å; E238-H242 WeakPolarHBondContact O-CB 3.13Å; E238-H242 PolarHBondContact O-N 3.19Å; L240-H242 VanDerWaalsContact C-N 3.33Å; L240-H242 PolarHBondContact O-N 3.2Å; H242-K246 VanDerWaalsContact NE2-CE 3.33Å; H242-K246 WeakPolarHBondContact NE2-CE 3.37Å; H242-K246 WeakPolarHBondContact O-CG 3.39Å; H242-K246 PolarHBondContact O-N 3.31Å
243	A	97.3	Very high	97.5	Very high	10 Å²	10	31.3 Å²	31.3	8%	0.083	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-50.3	174.5	0	0	0	0	0	110.9	P239 L240 L241 A245 K246 D247 M250 V252 I353	P239-A243 PolarHBondContact O-N 3Å; L240-A243 PolarHBondContact O-N 2.62Å; L241-A243 VanDerWaalsContact C-N 3.33Å; L241-A243 PolarHBondContact O-N 2.74Å; A243-A245 VanDerWaalsContact C-N 3.29Å; A243-A245 PolarHBondContact O-N 3.1Å; A243-K246 WeakPolarHBondContact O-CB 3.47Å; A243-K246 PolarHBondContact O-N 3.26Å; A243-K246 VanDerWaalsContact O-N 3.08Å; A243-D247 PolarHBondContact O-N 3.23Å; A243-M250 WeakPolarHBondContact O-CE 3.49Å; A243-V252 HydrophobicContact CB-CG1 3.82Å; A243-I353 HydrophobicContact CB-CD1 4.11Å
244	I	98.5	Very high	97.6	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-33.9	179.5	-63.6	169.7	0	0	0	112	V222 L240 L241 K246 D247 V252 A313 R315	V222-I244 HydrophobicContact CG1-CD1 3.61Å; V222-I244 HydrophobicContact CG2-CD1 4.18Å; V222-I244 HydrophobicContact CG2-CG2 3.99Å; L240-I244 WeakPolarHBondContact O-CG1 3.27Å; L240-I244 PolarHBondContact O-N 2.95Å; L240-I244 VanDerWaalsContact O-N 3.11Å; L241-I244 PolarHBondContact O-N 3.11Å; I244-K246 VanDerWaalsContact C-N 3.26Å; I244-K246 PolarHBondContact O-N 2.72Å; I244-D247 CarbonylContact O-C 3.18Å; I244-D247 PolarHBondContact O-N 3.32Å; I244-V252 HydrophobicContact CD1-CG2 3.84Å; I244-V252 HydrophobicContact CG1-CG2 3.86Å; I244-A313 HydrophobicContact CD1-CB 3.75Å; I244-R315 HydrophobicContact CG2-CB 3.89Å
245	A	97.8	Very high	97.7	Very high	51 Å²	51	25.9 Å²	25.9	42%	0.421	14%	0.138	S	C	.	.	H	α-helix	trans	-64.7	-30.4	176	0	0	0	0	0	112.5	L133 P134 L241 A243	L133-A245 HydrophobicContact CD2-CB 4.05Å; P134-A245 HydrophobicContact CG-CB 4.18Å; L241-A245 VanDerWaalsContact O-CB 3.27Å; L241-A245 WeakPolarHBondContact O-CB 3.32Å; L241-A245 PolarHBondContact O-N 2.93Å; A243-A245 VanDerWaalsContact C-N 3.29Å; A243-A245 PolarHBondContact O-N 3.1Å
246	K	96.6	Very high	97.9	Very high	151 Å²	151	25 Å²	25	66%	0.657	13%	0.132	S	C	*	.	H	α-helix	trans	-77	-42	176.6	-73.9	-178.7	175.5	-173.5	0	112.9	H242 A243 I244 M250	H242-K246 VanDerWaalsContact NE2-CE 3.33Å; H242-K246 WeakPolarHBondContact NE2-CE 3.37Å; H242-K246 WeakPolarHBondContact O-CG 3.39Å; H242-K246 PolarHBondContact O-N 3.31Å; A243-K246 WeakPolarHBondContact O-CB 3.47Å; A243-K246 PolarHBondContact O-N 3.26Å; A243-K246 VanDerWaalsContact O-N 3.08Å; I244-K246 VanDerWaalsContact C-N 3.26Å; I244-K246 PolarHBondContact O-N 2.72Å; K246-M250 HydrophobicContact CB-CE 4.15Å
247	D	97.7	Very high	97.9	Very high	43 Å²	43	25.1 Å²	25.1	23%	0.23	13%	0.132	C	C	.	.			trans	-136.8	108.5	173.2	-178.5	-3.7	0	0	0	109.4	A243 I244 K249 M250 Q349	A243-D247 PolarHBondContact O-N 3.23Å; I244-D247 CarbonylContact O-C 3.18Å; I244-D247 PolarHBondContact O-N 3.32Å; D247-K249 PolarHBondContact O-N 2.57Å; D247-K249 WeakPolarHBondContact OD1-CB 3.25Å; D247-K249 PolarHBondContact OD1-N 3Å; D247-M250 HydrophobicContact CB-CB 4.44Å; D247-M250 HydrophobicContact CB-CE 3.36Å; D247-M250 HydrophobicContact CB-CG 3.93Å; D247-M250 HydrophobicContact CB-SD 4.44Å; D247-M250 WeakPolarHBondContact O-CB 3.18Å; D247-M250 PolarHBondContact O-N 3.07Å; D247-Q349 PolarHBondContact OD2-NE2 3.46Å
248	P	97.5	Very high	97.9	Very high	49 Å²	49	27.7 Å²	27.7	32%	0.318	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-16.9	177.2	-31.2	38.9	0	0	0	116.3	R315	P248-R315 VanDerWaalsContact CB-NH1 3.35Å
249	K	98.3	Very high	97.9	Very high	82 Å²	82	26.6 Å²	26.6	36%	0.357	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	0.7	177.5	-61.5	-166.8	172.3	-169.4	0	113.4	D247 Y318 G348 Q349	D247-K249 PolarHBondContact O-N 2.57Å; D247-K249 WeakPolarHBondContact OD1-CB 3.25Å; D247-K249 PolarHBondContact OD1-N 3Å; K249-Y318 HydrophobicContact CB-CD2 4.47Å; K249-Y318 HydrophobicContact CB-CE1 4.19Å; K249-Y318 HydrophobicContact CB-CE2 4.05Å; K249-Y318 HydrophobicContact CD-CE2 4Å; K249-Y318 HydrophobicContact CG-CD2 3.97Å; K249-Y318 HydrophobicContact CG-CE2 3.72Å; K249-Y318 WeakPolarHBondContact O-CE1 3.47Å; K249-G348 WeakPolarHBondContact O-CA 3.38Å; K249-Q349 PolarHBondContact O-N 2.84Å
250	M	98.3	Very high	97.9	Very high	26 Å²	26	28 Å²	28	13%	0.128	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	130.3	168.5	-83.6	-168.1	-86.4	0	0	110.6	A243 K246 D247 V252 Q349 F351	A243-M250 WeakPolarHBondContact O-CE 3.49Å; K246-M250 HydrophobicContact CB-CE 4.15Å; D247-M250 HydrophobicContact CB-CB 4.44Å; D247-M250 HydrophobicContact CB-CE 3.36Å; D247-M250 HydrophobicContact CB-CG 3.93Å; D247-M250 HydrophobicContact CB-SD 4.44Å; D247-M250 WeakPolarHBondContact O-CB 3.18Å; D247-M250 PolarHBondContact O-N 3.07Å; M250-V252 HydrophobicContact CB-CG1 4.26Å; M250-Q349 HydrophobicContact CG-CB 4.18Å; M250-F351 HydrophobicContact CG-CD2 4.08Å; M250-F351 HydrophobicContact CG-CE2 4.13Å; M250-F351 HydrophobicContact SD-CD2 3.85Å; M250-F351 HydrophobicContact SD-CE2 3.95Å
251	V	98.8	Very high	97.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.9	164.4	-175.7	0	0	0	0	106.9	F312 I314 Y318 I343 Q349 L350 F351	V251-F312 HydrophobicContact CG1-CD2 3.83Å; V251-F312 HydrophobicContact CG1-CE2 4.49Å; V251-I314 HydrophobicContact CG1-CB 4.31Å; V251-I314 HydrophobicContact CG2-CB 4.36Å; V251-I314 HydrophobicContact CG2-CD1 3.54Å; V251-I314 HydrophobicContact CG2-CG1 3.85Å; V251-Y318 HydrophobicContact CG2-CD1 4.39Å; V251-Y318 HydrophobicContact CG2-CE1 4.1Å; V251-I343 HydrophobicContact CB-CD1 3.84Å; V251-I343 HydrophobicContact CB-CG2 4.43Å; V251-I343 HydrophobicContact CG1-CD1 3.87Å; V251-I343 HydrophobicContact CG2-CD1 3.58Å; V251-I343 HydrophobicContact CG2-CG1 3.85Å; V251-I343 HydrophobicContact CG2-CG2 4.01Å; V251-Q349 PolarHBondContact N-O 2.87Å; V251-L350 HydrophobicContact CB-CD1 3.94Å; V251-L350 HydrophobicContact CG1-CD1 3.85Å; V251-L350 WeakPolarHBondContact O-CA 3.29Å; V251-F351 PolarHBondContact O-N 3.46Å
252	V	98.8	Very high	97.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.1	-170.2	-64.9	0	0	0	0	112	L240 A243 I244 M250 F312 A313 F351 I353	L240-V252 HydrophobicContact CB-CG2 3.88Å; L240-V252 HydrophobicContact CD2-CB 4.2Å; L240-V252 HydrophobicContact CD2-CG2 3.88Å; L240-V252 HydrophobicContact CG-CG2 4.45Å; A243-V252 HydrophobicContact CB-CG1 3.82Å; I244-V252 HydrophobicContact CD1-CG2 3.84Å; I244-V252 HydrophobicContact CG1-CG2 3.86Å; M250-V252 HydrophobicContact CB-CG1 4.26Å; V252-F312 CarbonylContact O-C 3.56Å; V252-F312 WeakPolarHBondContact O-CA 3.3Å; V252-A313 HydrophobicContact CG2-CB 3.99Å; V252-A313 PolarHBondContact N-O 3.18Å; V252-A313 PolarHBondContact O-N 3.08Å; V252-F351 CarbonylContact C-O 3.4Å; V252-F351 VanDerWaalsContact CA-O 3.29Å; V252-F351 WeakPolarHBondContact CA-O 3.46Å; V252-F351 HydrophobicContact CG1-CB 4.4Å; V252-I353 HydrophobicContact CB-CD1 4.38Å; V252-I353 HydrophobicContact CB-CG1 3.79Å; V252-I353 HydrophobicContact CG1-CD1 4Å; V252-I353 HydrophobicContact CG1-CG1 3.97Å
253	C	98.7	Very high	97.3	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.034	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.3	173.9	-66.3	0	0	0	0	109.7	F351 I352 I353	C253-F351 PolarHBondContact N-O 3Å; C253-I352 HydrophobicContact CB-CG1 4.11Å; C253-I352 CarbonylContact O-C 3.57Å; C253-I352 WeakPolarHBondContact O-CA 3.43Å; C253-I353 PolarHBondContact O-N 3.07Å
254	P	98.3	Very high	97.2	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.013	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	162.9	160.7	32.7	-35.4	0	0	0	109.8	I311 S356 V358	P254-I311 HydrophobicContact CG-CB 4.08Å; P254-I311 HydrophobicContact CG-CG2 3.41Å; P254-I311 VanDerWaalsContact CG-CG2 3.41Å; P254-S356 VanDerWaalsContact CB-OG 3.3Å; P254-S356 WeakPolarHBondContact CB-OG 3.13Å; P254-V358 HydrophobicContact CB-CB 4.4Å; P254-V358 HydrophobicContact CB-CG2 3.85Å; P254-V358 HydrophobicContact CG-CB 4.2Å; P254-V358 HydrophobicContact CG-CG2 3.81Å
255	L	97.2	Very high	97.1	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.7	162.5	-165.3	157.5	0	0	0	108.7	L271 I352 S356 R357 V358	L255-L271 HydrophobicContact CD1-CD2 3.46Å; L255-L271 VanDerWaalsContact CD1-CD2 3.46Å; L255-I352 HydrophobicContact CB-CG2 4.09Å; L255-S356 PolarHBondContact N-O 3.42Å; L255-R357 VanDerWaalsContact CD2-CZ 3.43Å; L255-R357 WeakPolarHBondContact O-CA 3.47Å; L255-V358 PolarHBondContact O-N 2.81Å
256	I	98	Very high	97.1	Very high	29 Å²	29	37.2 Å²	37.2	15%	0.149	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	114.3	-172.5	-56.7	176.6	0	0	0	109.4	S269 W284 S308 I311 V358 H360	I256-S269 WeakPolarHBondContact O-CB 3.18Å; I256-S269 PolarHBondContact O-OG 3.44Å; I256-W284 HydrophobicContact CD1-CH2 4.29Å; I256-W284 HydrophobicContact CD1-CZ2 4.26Å; I256-S308 WeakPolarHBondContact CD1-OG 3.48Å; I256-I311 HydrophobicContact CD1-CB 4.5Å; I256-I311 HydrophobicContact CD1-CD1 4.2Å; I256-I311 HydrophobicContact CG1-CD1 4.21Å; I256-I311 HydrophobicContact CG2-CD1 4.44Å; I256-V358 CarbonylContact C-O 3.53Å; I256-V358 WeakPolarHBondContact CA-O 3.23Å; I256-H360 HydrophobicContact CG2-CB 3.59Å
257	D	97.9	Very high	97.1	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	158.8	172.4	-75.5	-25.8	0	0	0	111.1	T119 Y266 K267 P268 S269 R357 V358 G359 H360	T119-D257 WeakPolarHBondContact CB-OD2 3.38Å; T119-D257 PolarHBondContact OG1-OD2 2.73Å; D257-Y266 HydrophobicContact CB-CD1 4.39Å; D257-Y266 HydrophobicContact CB-CE1 3.52Å; D257-Y266 HydrophobicContact CB-CE2 4.49Å; D257-Y266 WeakPolarHBondContact CB-OH 3.18Å; D257-Y266 WeakPolarHBondContact OD2-CE1 3.14Å; D257-Y266 PolarHBondContact OD2-OH 3.19Å; D257-K267 WeakPolarHBondContact CB-O 3.37Å; D257-P268 WeakPolarHBondContact OD1-CA 3.32Å; D257-S269 WeakPolarHBondContact CA-OG 3.26Å; D257-S269 PolarHBondContact OD1-N 3.41Å; D257-R357 VanDerWaalsContact CG-NE 3.33Å; D257-R357 IonicContact OD1-CZ 2.77Å; D257-R357 IonicContact OD1-NE 3.2Å; D257-R357 PolarHBondContact OD1-NE 3.41Å; D257-R357 IonicContact OD1-NH2 3.93Å; D257-R357 PolarHBondContact OD1-NH2 3.47Å; D257-R357 IonicContact OD2-CZ 3.59Å; D257-R357 IonicContact OD2-NE 3.67Å; D257-R357 PolarHBondContact OD2-NE 2.8Å; D257-R357 IonicContact OD2-NH2 3.84Å; D257-V358 PolarHBondContact N-O 3.19Å; D257-G359 WeakPolarHBondContact O-CA 3.4Å; D257-H360 PolarHBondContact O-N 3.41Å
258	V	97.5	Very high	97	Very high	54 Å²	54	35.6 Å²	35.6	33%	0.327	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.8	-179.5	173.6	0	0	0	0	109.3	K267	V258-K267 PolarHBondContact N-O 3.39Å; V258-K267 PolarHBondContact O-N 3Å
259	I	98	Very high	96.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	115.3	159.4	-58	161.2	0	0	0	106.4	E231 D261 L264 E265 Y266 H360 I361 S362	E231-I259 HydrophobicContact CB-CD1 4Å; E231-I259 HydrophobicContact CG-CD1 4.11Å; E231-I259 WeakPolarHBondContact OE1-CD1 3.4Å; I259-D261 PolarHBondContact O-N 2.97Å; I259-L264 HydrophobicContact CG2-CB 4.23Å; I259-E265 WeakPolarHBondContact CA-O 3.46Å; I259-Y266 HydrophobicContact CD1-CD2 4.24Å; I259-Y266 HydrophobicContact CG1-CD2 3.86Å; I259-Y266 HydrophobicContact CG1-CG 4.39Å; I259-H360 PolarHBondContact N-O 3.04Å; I259-I361 HydrophobicContact CB-CG1 3.97Å; I259-I361 HydrophobicContact CD1-CG1 4.17Å; I259-I361 HydrophobicContact CG2-CG1 3.88Å; I259-I361 WeakPolarHBondContact O-CA 3.38Å; I259-S362 PolarHBondContact O-N 2.9Å; I259-S362 VanDerWaalsContact O-N 3.07Å
260	D	96.4	Very high	96.6	Very high	35 Å²	35	34.7 Å²	34.7	19%	0.187	18%	0.183	C	C	.	.			trans	-59.1	132.3	-175.2	-172.1	-78.4	0	0	0	110.9	R262 T263 L264 E265 K267	D260-R262 PolarHBondContact O-N 3.23Å; D260-R262 WeakPolarHBondContact OD1-CA 3.47Å; D260-R262 WeakPolarHBondContact OD1-CB 3.39Å; D260-R262 PolarHBondContact OD1-N 2.95Å; D260-T263 WeakPolarHBondContact CB-OG1 3.39Å; D260-T263 PolarHBondContact OD1-N 3.01Å; D260-T263 PolarHBondContact OD1-OG1 3.03Å; D260-L264 WeakPolarHBondContact O-CA 3.29Å; D260-L264 WeakPolarHBondContact O-CD2 3.36Å; D260-L264 PolarHBondContact O-N 3.01Å; D260-E265 PolarHBondContact N-O 3.18Å; D260-K267 IonicContact OD2-NZ 2.78Å
261	D	94.1	Very high	96.4	Very high	28 Å²	28	35.5 Å²	35.5	15%	0.15	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.7	-176.1	67	-48.8	0	0	0	113.4	F102 N103 I259 S362	F102-D261 CarbonylContact C-O 3.59Å; F102-D261 WeakPolarHBondContact CA-O 3.45Å; F102-D261 HydrophobicContact CB-CB 3.99Å; F102-D261 VanDerWaalsContact CB-O 3.3Å; F102-D261 WeakPolarHBondContact CB-O 3.43Å; N103-D261 PolarHBondContact N-O 3.23Å; I259-D261 PolarHBondContact O-N 2.97Å; D261-S362 WeakPolarHBondContact CB-O 3.31Å
262	R	92.6	Very high	96.2	Very high	115 Å²	115	36.3 Å²	36.3	43%	0.434	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-42.6	-176.9	-58.5	-175.1	-176.9	-170.7	3.6	112.8	N103 I106 D260	N103-R262 WeakPolarHBondContact CB-O 3.29Å; N103-R262 PolarHBondContact ND2-O 3.46Å; I106-R262 WeakPolarHBondContact CD1-O 3.42Å; D260-R262 PolarHBondContact O-N 3.23Å; D260-R262 WeakPolarHBondContact OD1-CA 3.47Å; D260-R262 WeakPolarHBondContact OD1-CB 3.39Å; D260-R262 PolarHBondContact OD1-N 2.95Å
263	T	94.2	Very high	96.1	Very high	43 Å²	43	36.9 Å²	36.9	26%	0.264	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-15.6	-177.2	69.2	0	0	0	0	113.1	D260 E265	D260-T263 WeakPolarHBondContact CB-OG1 3.39Å; D260-T263 PolarHBondContact OD1-N 3.01Å; D260-T263 PolarHBondContact OD1-OG1 3.03Å; T263-E265 PolarHBondContact O-N 3.26Å; T263-E265 VanDerWaalsContact OG1-CB 3.26Å; T263-E265 WeakPolarHBondContact OG1-CB 3.03Å; T263-E265 PolarHBondContact OG1-N 3.2Å
264	L	95.6	Very high	96	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.			trans	53.6	23.6	-168.3	-55.7	-151.2	0	0	0	113.8	F102 I106 L110 R114 I259 D260	F102-L264 HydrophobicContact CB-CD2 4.45Å; F102-L264 HydrophobicContact CD2-CD1 4.42Å; F102-L264 HydrophobicContact CD2-CD2 4.03Å; I106-L264 HydrophobicContact CB-CG 4.46Å; I106-L264 HydrophobicContact CG2-CB 4.1Å; I106-L264 HydrophobicContact CG2-CD1 4.5Å; I106-L264 HydrophobicContact CG2-CG 4.06Å; L110-L264 HydrophobicContact CD1-CB 3.9Å; L110-L264 HydrophobicContact CD1-CD1 4.09Å; L110-L264 HydrophobicContact CD1-CG 4.48Å; R114-L264 VanDerWaalsContact CZ-O 3.3Å; R114-L264 PolarHBondContact NH1-O 3.13Å; R114-L264 PolarHBondContact NH2-O 3.16Å; I259-L264 HydrophobicContact CG2-CB 4.23Å; D260-L264 WeakPolarHBondContact O-CA 3.29Å; D260-L264 WeakPolarHBondContact O-CD2 3.36Å; D260-L264 PolarHBondContact O-N 3.01Å
265	E	96.7	Very high	96	Very high	105 Å²	105	37 Å²	37	49%	0.491	20%	0.196	S	C	.	.			trans	-71.6	130.7	173.3	-172.7	-175.3	-178.3	0	0	110	I259 D260 T263 K267	I259-E265 WeakPolarHBondContact CA-O 3.46Å; D260-E265 PolarHBondContact N-O 3.18Å; T263-E265 PolarHBondContact O-N 3.26Å; T263-E265 VanDerWaalsContact OG1-CB 3.26Å; T263-E265 WeakPolarHBondContact OG1-CB 3.03Å; T263-E265 PolarHBondContact OG1-N 3.2Å; E265-K267 HydrophobicContact CG-CG 4.23Å; E265-K267 WeakPolarHBondContact OE2-CE 3.47Å; E265-K267 IonicContact OE2-NZ 3.12Å; E265-K267 PolarHBondContact OE2-NZ 3.35Å
266	Y	97.4	Very high	96	Very high	12 Å²	12	37.3 Å²	37.3	5%	0.047	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	117.8	176.2	-171.8	-64.4	0	0	0	109.7	V116 P117 T119 E231 N233 D257 I259 G359	V116-Y266 HydrophobicContact CB-CD2 3.84Å; V116-Y266 HydrophobicContact CB-CE2 4.27Å; V116-Y266 HydrophobicContact CB-CG 4.14Å; V116-Y266 HydrophobicContact CG1-CD2 3.76Å; V116-Y266 HydrophobicContact CG1-CE2 4.4Å; V116-Y266 HydrophobicContact CG1-CG 4.32Å; V116-Y266 HydrophobicContact CG2-CD2 4.36Å; V116-Y266 HydrophobicContact CG2-CE2 4.29Å; P117-Y266 HydrophobicContact CG-CD1 4.04Å; P117-Y266 HydrophobicContact CG-CG 4.41Å; T119-Y266 HydrophobicContact CG2-CD1 3.73Å; T119-Y266 HydrophobicContact CG2-CE1 3.46Å; T119-Y266 VanDerWaalsContact CG2-CE1 3.46Å; E231-Y266 HydrophobicContact CB-CE2 4.44Å; N233-Y266 PolarHBondContact ND2-OH 2.78Å; D257-Y266 HydrophobicContact CB-CD1 4.39Å; D257-Y266 HydrophobicContact CB-CE1 3.52Å; D257-Y266 HydrophobicContact CB-CE2 4.49Å; D257-Y266 WeakPolarHBondContact CB-OH 3.18Å; D257-Y266 WeakPolarHBondContact OD2-CE1 3.14Å; D257-Y266 PolarHBondContact OD2-OH 3.19Å; I259-Y266 HydrophobicContact CD1-CD2 4.24Å; I259-Y266 HydrophobicContact CG1-CD2 3.86Å; I259-Y266 HydrophobicContact CG1-CG 4.39Å; Y266-G359 VanDerWaalsContact CE2-CA 3.4Å; Y266-G359 PolarHBondContact OH-N 3.06Å
267	K	96.7	Very high	95.8	Very high	75 Å²	75	37.1 Å²	37.1	33%	0.326	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.7	-175	-66.7	175.3	-177.4	166.3	0	111.9	D257 V258 D260 E265 S269	D257-K267 WeakPolarHBondContact CB-O 3.37Å; V258-K267 PolarHBondContact N-O 3.39Å; V258-K267 PolarHBondContact O-N 3Å; D260-K267 IonicContact OD2-NZ 2.78Å; E265-K267 HydrophobicContact CG-CG 4.23Å; E265-K267 WeakPolarHBondContact OE2-CE 3.47Å; E265-K267 IonicContact OE2-NZ 3.12Å; E265-K267 PolarHBondContact OE2-NZ 3.35Å; K267-S269 PolarHBondContact O-N 2.92Å
268	P	95.9	Very high	95.6	Very high	85 Å²	85	37.3 Å²	37.3	55%	0.552	20%	0.197	S	C	*	.	P	Polyproline II helix	trans	-66.2	133.4	176.4	27.3	-33.4	0	0	0	111.5	T119 D257	T119-P268 HydrophobicContact CG2-CB 3.83Å; T119-P268 HydrophobicContact CG2-CG 4.28Å; D257-P268 WeakPolarHBondContact OD1-CA 3.32Å
269	S	94.6	Very high	95.3	Very high	22 Å²	22	37.2 Å²	37.2	15%	0.154	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-83.7	150.5	168.1	-68.8	0	0	0	0	112.9	I256 D257 K267 R357	I256-S269 WeakPolarHBondContact O-CB 3.18Å; I256-S269 PolarHBondContact O-OG 3.44Å; D257-S269 WeakPolarHBondContact CA-OG 3.26Å; D257-S269 PolarHBondContact OD1-N 3.41Å; K267-S269 PolarHBondContact O-N 2.92Å; S269-R357 VanDerWaalsContact N-NH2 3.14Å; S269-R357 PolarHBondContact O-NH2 2.64Å
270	P	93.6	Very high	95.2	Very high	89 Å²	89	37.3 Å²	37.3	58%	0.578	20%	0.195	S	C	*	.	P	Polyproline II helix	trans	-64.1	165.6	171.3	27.7	-33.5	0	0	0	111.8	V272	P270-V272 HydrophobicContact CG-CG1 4.04Å; P270-V272 PolarHBondContact O-N 3.13Å
271	L	93.1	Very high	95	Very high	44 Å²	44	40.1 Å²	40.1	23%	0.23	21%	0.207	C	C	.	.	S	Bend	trans	-69.4	116.1	170.6	-63.5	-178.6	0	0	0	109.1	L255 V287 M292 I302 P354	L255-L271 HydrophobicContact CD1-CD2 3.46Å; L255-L271 VanDerWaalsContact CD1-CD2 3.46Å; L271-V287 HydrophobicContact CB-CG2 4.15Å; L271-M292 HydrophobicContact CD1-SD 3.45Å; L271-M292 WeakPolarHBondContact CD1-SD 3.26Å; L271-I302 HydrophobicContact CB-CD1 4.43Å; L271-I302 HydrophobicContact CD2-CD1 4.37Å; L271-P354 HydrophobicContact CD2-CB 3.9Å; L271-P354 HydrophobicContact CD2-CG 4.21Å
272	V	95.1	Very high	95.1	Very high	17 Å²	17	41 Å²	41	10%	0.103	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	157.2	-177	-67.6	0	0	0	0	110.4	P270 W284 D285 I352	P270-V272 HydrophobicContact CG-CG1 4.04Å; P270-V272 PolarHBondContact O-N 3.13Å; V272-W284 HydrophobicContact CB-CB 4.36Å; V272-W284 HydrophobicContact CB-CE3 4.04Å; V272-W284 HydrophobicContact CG1-CB 4.45Å; V272-W284 HydrophobicContact CG2-CD2 4.01Å; V272-W284 HydrophobicContact CG2-CE3 3.44Å; V272-W284 VanDerWaalsContact CG2-CE3 3.44Å; V272-W284 HydrophobicContact CG2-CZ3 3.9Å; V272-D285 CarbonylContact C-O 3.59Å; V272-D285 WeakPolarHBondContact CA-O 3.11Å; V272-D285 WeakPolarHBondContact CB-O 3.32Å; V272-I352 VanDerWaalsContact O-CD1 3.25Å; V272-I352 WeakPolarHBondContact O-CD1 3.28Å
273	R	96.2	Very high	95.2	Very high	11 Å²	11	40 Å²	40	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	151.5	165.7	65.5	-179	-174.4	151.6	6.7	110	T275 D285 F288 I302 E435	R273-T275 HydrophobicContact CG-CG2 4.23Å; R273-D285 HydrophobicContact CG-CB 4.18Å; R273-D285 IonicContact CZ-OD2 2.73Å; R273-D285 PolarHBondContact N-O 3.29Å; R273-D285 IonicContact NE-OD2 3.37Å; R273-D285 PolarHBondContact NE-OD2 2.86Å; R273-D285 IonicContact NH2-OD2 2.79Å; R273-D285 PolarHBondContact NH2-OD2 3.14Å; R273-D285 PolarHBondContact O-N 3.33Å; R273-F288 VanDerWaalsContact NH2-CE2 3.28Å; R273-F288 VanDerWaalsContact NH2-CZ 3.27Å; R273-I302 HydrophobicContact CB-CG2 3.9Å; R273-E435 IonicContact CZ-OE1 2.7Å; R273-E435 VanDerWaalsContact CZ-OE1 3.3Å; R273-E435 IonicContact NH1-OE1 3.71Å; R273-E435 PolarHBondContact NH1-OE1 3.07Å; R273-E435 IonicContact NH2-OE1 3.28Å; R273-E435 PolarHBondContact NH2-OE1 3.35Å
274	G	97.8	Very high	95.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.4	176.4	0	0	0	0	0	111.5	S304 P305 A306	G274-S304 WeakPolarHBondContact CA-OG 3.25Å; G274-S304 PolarHBondContact N-OG 3.22Å; G274-S304 PolarHBondContact O-OG 3.24Å; G274-P305 VanDerWaalsContact O-CD 3.26Å; G274-P305 WeakPolarHBondContact O-CD 3.3Å; G274-A306 CarbonylContact C-O 3.52Å; G274-A306 VanDerWaalsContact CA-O 3.23Å; G274-A306 WeakPolarHBondContact CA-O 3.3Å; G274-A306 PolarHBondContact O-N 2.89Å
275	T	97.3	Very high	95.3	Very high	11 Å²	11	46.4 Å²	46.4	7%	0.067	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	-177.8	-179.2	64.6	0	0	0	0	110.3	R273 F282 K283 D285 P305 F433	R273-T275 HydrophobicContact CG-CG2 4.23Å; T275-F282 CarbonylContact O-C 3.6Å; T275-F282 WeakPolarHBondContact O-CA 3.37Å; T275-F282 WeakPolarHBondContact O-CD2 3.18Å; T275-K283 PolarHBondContact N-O 2.74Å; T275-K283 PolarHBondContact O-N 3.29Å; T275-K283 PolarHBondContact OG1-O 3.38Å; T275-D285 HydrophobicContact CG2-CB 3.59Å; T275-P305 HydrophobicContact CG2-CG 4.34Å; T275-F433 HydrophobicContact CG2-CE2 4.03Å; T275-F433 HydrophobicContact CG2-CZ 3.95Å
276	F	96.8	Very high	95.1	Very high	7 Å²	7	46.7 Å²	46.7	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	166	170.1	62	-83.7	0	0	0	111.1	L280 Q281 A306 L337 L341 F425 Y428 F433 L436	F276-L280 HydrophobicContact CD2-CD2 3.86Å; F276-L280 HydrophobicContact CE2-CD2 3.77Å; F276-Q281 WeakPolarHBondContact CA-O 3.49Å; F276-Q281 VanDerWaalsContact CB-O 3.26Å; F276-Q281 WeakPolarHBondContact CB-O 3.39Å; F276-A306 HydrophobicContact CD1-CB 3.96Å; F276-L337 HydrophobicContact CB-CD1 4.04Å; F276-L337 HydrophobicContact CB-CD2 3.97Å; F276-L337 HydrophobicContact CD1-CD2 3.92Å; F276-L337 HydrophobicContact CG-CD1 4.22Å; F276-L337 HydrophobicContact CG-CD2 4.09Å; F276-L341 HydrophobicContact CE1-CD2 4.28Å; F276-L341 HydrophobicContact CZ-CD2 4.05Å; F276-F425 HydrophobicContact CZ-CZ 4.46Å; F276-Y428 HydrophobicContact CE1-CE1 4.27Å; F276-Y428 HydrophobicContact CZ-CE1 4.17Å; F276-F433 HydrophobicContact CD1-CD1 4.34Å; F276-F433 HydrophobicContact CD1-CE1 4.1Å; F276-F433 AromaticContact CE1-CD1 3.99Å; F276-F433 HydrophobicContact CE1-CD1 3.99Å; F276-F433 HydrophobicContact CE1-CE1 4.19Å; F276-F433 HydrophobicContact CG-CE1 4.46Å; F276-F433 HydrophobicContact CZ-CD1 4.36Å; F276-F433 VanDerWaalsContact O-CE1 3.29Å; F276-F433 WeakPolarHBondContact O-CE1 3.32Å; F276-L436 HydrophobicContact CD2-CD2 4.15Å; F276-L436 HydrophobicContact CE2-CD2 3.42Å; F276-L436 VanDerWaalsContact CE2-CD2 3.42Å; F276-L436 HydrophobicContact CZ-CD2 3.65Å
277	D	94.6	Very high	94.9	Very high	26 Å²	26	46.9 Å²	46.9	14%	0.139	24%	0.24	C	C	.	.			trans	-106.9	178.7	174.1	65.6	12.4	0	0	0	112.5	N279 L280 Q281 K283	D277-N279 PolarHBondContact O-N 3.25Å; D277-N279 VanDerWaalsContact O-N 3.11Å; D277-N279 WeakPolarHBondContact OD1-CA 3.23Å; D277-N279 VanDerWaalsContact OD1-CB 3.25Å; D277-N279 WeakPolarHBondContact OD1-CB 3.44Å; D277-N279 PolarHBondContact OD1-N 2.97Å; D277-L280 WeakPolarHBondContact O-CA 3.24Å; D277-L280 PolarHBondContact O-N 2.64Å; D277-L280 PolarHBondContact OD1-N 2.99Å; D277-Q281 PolarHBondContact N-O 2.98Å; D277-Q281 PolarHBondContact OD1-N 3.31Å; D277-K283 WeakPolarHBondContact OD2-CE 3.15Å; D277-K283 IonicContact OD2-NZ 2.72Å; D277-K283 PolarHBondContact OD2-NZ 3.44Å
278	W	93.4	Very high	94.4	Very high	5 Å²	5	46.3 Å²	46.3	2%	0.019	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-9	176.5	-70.3	108.3	0	0	0	114.8	L280 Y391 Q394 R398 F425 L429 L436 S439 V440	W278-L280 PolarHBondContact O-N 3.37Å; W278-Y391 AromaticContact CH2-CD1 3.68Å; W278-Y391 HydrophobicContact CH2-CD1 3.68Å; W278-Y391 HydrophobicContact CH2-CG 4.28Å; W278-Y391 HydrophobicContact CZ3-CD1 4.37Å; W278-Q394 HydrophobicContact CD2-CB 3.96Å; W278-Q394 HydrophobicContact CE3-CB 3.48Å; W278-Q394 VanDerWaalsContact CE3-CB 3.48Å; W278-Q394 HydrophobicContact CE3-CG 4.26Å; W278-Q394 HydrophobicContact CH2-CB 4.35Å; W278-Q394 HydrophobicContact CH2-CG 4.29Å; W278-Q394 HydrophobicContact CZ3-CB 3.71Å; W278-Q394 HydrophobicContact CZ3-CG 4.12Å; W278-R398 VanDerWaalsContact CB-NE 3.34Å; W278-F425 AromaticContact CH2-CE1 3.96Å; W278-F425 HydrophobicContact CH2-CE1 3.96Å; W278-F425 HydrophobicContact CZ3-CE1 4.15Å; W278-L429 HydrophobicContact CH2-CD1 4.45Å; W278-L436 HydrophobicContact CD2-CD1 4.13Å; W278-L436 HydrophobicContact CD2-CG 4.41Å; W278-L436 HydrophobicContact CG-CD1 4.18Å; W278-L436 HydrophobicContact CH2-CD2 4.49Å; W278-L436 HydrophobicContact CH2-CG 4.44Å; W278-L436 HydrophobicContact CZ2-CD1 4.35Å; W278-L436 HydrophobicContact CZ2-CD2 4.33Å; W278-L436 HydrophobicContact CZ2-CG 3.81Å; W278-L436 PolarHBondContact NE1-O 3.41Å; W278-S439 PolarHBondContact NE1-OG 2.93Å; W278-V440 HydrophobicContact CD2-CG2 4.31Å; W278-V440 HydrophobicContact CH2-CG2 4.48Å; W278-V440 HydrophobicContact CZ2-CG2 3.41Å; W278-V440 VanDerWaalsContact CZ2-CG2 3.41Å
279	N	92.2	Very high	93.9	Very high	51 Å²	51	46.5 Å²	46.5	27%	0.273	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	1.6	165.3	-65.1	-51.9	0	0	0	111.9	D277 Q281 Y380 K399	D277-N279 PolarHBondContact O-N 3.25Å; D277-N279 VanDerWaalsContact O-N 3.11Å; D277-N279 WeakPolarHBondContact OD1-CA 3.23Å; D277-N279 VanDerWaalsContact OD1-CB 3.25Å; D277-N279 WeakPolarHBondContact OD1-CB 3.44Å; D277-N279 PolarHBondContact OD1-N 2.97Å; N279-Q281 HydrophobicContact CB-CG 4.03Å; N279-Q281 PolarHBondContact O-N 2.88Å; N279-Y380 WeakPolarHBondContact O-CE1 3.11Å; N279-Y380 VanDerWaalsContact O-CZ 3.27Å; N279-Y380 PolarHBondContact O-OH 3.22Å; N279-K399 PolarHBondContact O-NZ 3.42Å
280	L	94.1	Very high	93.4	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	26%	0.259	C	S	.	.			trans	47.7	41.1	-167.6	-35.5	166.2	0	0	0	111.7	F276 D277 W278 R334 L337 Y380 L383 V384 L388 F395	F276-L280 HydrophobicContact CD2-CD2 3.86Å; F276-L280 HydrophobicContact CE2-CD2 3.77Å; D277-L280 WeakPolarHBondContact O-CA 3.24Å; D277-L280 PolarHBondContact O-N 2.64Å; D277-L280 PolarHBondContact OD1-N 2.99Å; W278-L280 PolarHBondContact O-N 3.37Å; L280-R334 PolarHBondContact O-NE 2.87Å; L280-R334 PolarHBondContact O-NH1 3.19Å; L280-L337 HydrophobicContact CB-CD1 3.77Å; L280-L337 WeakPolarHBondContact O-CD1 3.34Å; L280-Y380 HydrophobicContact CB-CD1 4.32Å; L280-Y380 HydrophobicContact CB-CE1 3.63Å; L280-Y380 HydrophobicContact CD1-CD1 3.83Å; L280-Y380 HydrophobicContact CD1-CE1 3.93Å; L280-Y380 HydrophobicContact CG-CD1 4.49Å; L280-Y380 HydrophobicContact CG-CE1 4.1Å; L280-L383 HydrophobicContact CD1-CD2 3.97Å; L280-V384 HydrophobicContact CD1-CG2 3.55Å; L280-L388 HydrophobicContact CD1-CD1 4.07Å; L280-L388 HydrophobicContact CD2-CD1 4.06Å; L280-F395 HydrophobicContact CD1-CD2 3.8Å; L280-F395 HydrophobicContact CD1-CE2 3.98Å; L280-F395 HydrophobicContact CG-CD2 3.94Å; L280-F395 HydrophobicContact CG-CE2 4.29Å
281	Q	93.1	Very high	92.8	Very high	94 Å²	94	49.9 Å²	49.9	44%	0.439	24%	0.241	S	C	.	.			trans	-90.7	126.5	169.2	-66.2	-173.4	-16.2	0	0	108.8	F276 D277 N279	F276-Q281 WeakPolarHBondContact CA-O 3.49Å; F276-Q281 VanDerWaalsContact CB-O 3.26Å; F276-Q281 WeakPolarHBondContact CB-O 3.39Å; D277-Q281 PolarHBondContact N-O 2.98Å; D277-Q281 PolarHBondContact OD1-N 3.31Å; N279-Q281 HydrophobicContact CB-CG 4.03Å; N279-Q281 PolarHBondContact O-N 2.88Å
282	F	95.5	Very high	92.2	Very high	47 Å²	47	51.1 Å²	51.1	21%	0.206	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	141.3	174.6	175.2	-92.8	0	0	0	110.2	T275 W284 A306 M307 L337	T275-F282 CarbonylContact O-C 3.6Å; T275-F282 WeakPolarHBondContact O-CA 3.37Å; T275-F282 WeakPolarHBondContact O-CD2 3.18Å; F282-W284 AromaticContact CE1-CD2 3.8Å; F282-W284 HydrophobicContact CE1-CD2 3.8Å; F282-W284 AromaticContact CE1-CE2 3.54Å; F282-W284 HydrophobicContact CE1-CE3 4.3Å; F282-W284 HydrophobicContact CE1-CG 4.22Å; F282-W284 HydrophobicContact CE1-CH2 4.35Å; F282-W284 AromaticContact CE1-CZ2 3.84Å; F282-W284 HydrophobicContact CE1-CZ2 3.84Å; F282-W284 AromaticContact CE1-NE1 3.77Å; F282-W284 AromaticContact CZ-CD2 3.86Å; F282-W284 HydrophobicContact CZ-CD2 3.86Å; F282-W284 AromaticContact CZ-CE2 3.83Å; F282-W284 AromaticContact CZ-CE3 3.87Å; F282-W284 HydrophobicContact CZ-CE3 3.87Å; F282-W284 AromaticContact CZ-CH2 3.88Å; F282-W284 HydrophobicContact CZ-CH2 3.88Å; F282-W284 AromaticContact CZ-CZ2 3.85Å; F282-W284 HydrophobicContact CZ-CZ2 3.85Å; F282-W284 AromaticContact CZ-CZ3 3.88Å; F282-W284 HydrophobicContact CZ-CZ3 3.88Å; F282-A306 HydrophobicContact CD2-CB 4.22Å; F282-A306 HydrophobicContact CE2-CB 4.33Å; F282-M307 WeakPolarHBondContact CD2-O 3.33Å; F282-M307 WeakPolarHBondContact CE2-O 3.41Å; F282-L337 HydrophobicContact CD2-CD2 4.37Å
283	K	95.5	Very high	91.6	Very high	94 Å²	94	55.7 Å²	55.7	41%	0.409	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.3	177.1	-64.8	-177	-175.4	172.8	0	110	T275 D277	T275-K283 PolarHBondContact N-O 2.74Å; T275-K283 PolarHBondContact O-N 3.29Å; T275-K283 PolarHBondContact OG1-O 3.38Å; D277-K283 WeakPolarHBondContact OD2-CE 3.15Å; D277-K283 IonicContact OD2-NZ 2.72Å; D277-K283 PolarHBondContact OD2-NZ 3.44Å
284	W	96	Very high	91	Very high	118 Å²	118	57.7 Å²	57.7	45%	0.447	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.9	164.3	-64.6	112.7	0	0	0	108.4	I256 V272 F282 I352	I256-W284 HydrophobicContact CD1-CH2 4.29Å; I256-W284 HydrophobicContact CD1-CZ2 4.26Å; V272-W284 HydrophobicContact CB-CB 4.36Å; V272-W284 HydrophobicContact CB-CE3 4.04Å; V272-W284 HydrophobicContact CG1-CB 4.45Å; V272-W284 HydrophobicContact CG2-CD2 4.01Å; V272-W284 HydrophobicContact CG2-CE3 3.44Å; V272-W284 VanDerWaalsContact CG2-CE3 3.44Å; V272-W284 HydrophobicContact CG2-CZ3 3.9Å; F282-W284 AromaticContact CE1-CD2 3.8Å; F282-W284 HydrophobicContact CE1-CD2 3.8Å; F282-W284 AromaticContact CE1-CE2 3.54Å; F282-W284 HydrophobicContact CE1-CE3 4.3Å; F282-W284 HydrophobicContact CE1-CG 4.22Å; F282-W284 HydrophobicContact CE1-CH2 4.35Å; F282-W284 AromaticContact CE1-CZ2 3.84Å; F282-W284 HydrophobicContact CE1-CZ2 3.84Å; F282-W284 AromaticContact CE1-NE1 3.77Å; F282-W284 AromaticContact CZ-CD2 3.86Å; F282-W284 HydrophobicContact CZ-CD2 3.86Å; F282-W284 AromaticContact CZ-CE2 3.83Å; F282-W284 AromaticContact CZ-CE3 3.87Å; F282-W284 HydrophobicContact CZ-CE3 3.87Å; F282-W284 AromaticContact CZ-CH2 3.88Å; F282-W284 HydrophobicContact CZ-CH2 3.88Å; F282-W284 AromaticContact CZ-CZ2 3.85Å; F282-W284 HydrophobicContact CZ-CZ2 3.85Å; F282-W284 AromaticContact CZ-CZ3 3.88Å; F282-W284 HydrophobicContact CZ-CZ3 3.88Å; W284-I352 HydrophobicContact CZ3-CD1 3.96Å
285	D	95	Very high	90.3	Very high	59 Å²	59	64 Å²	64	32%	0.316	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	154.5	174.9	-172.4	24.4	0	0	0	109.5	V272 R273 T275	V272-D285 CarbonylContact C-O 3.59Å; V272-D285 WeakPolarHBondContact CA-O 3.11Å; V272-D285 WeakPolarHBondContact CB-O 3.32Å; R273-D285 HydrophobicContact CG-CB 4.18Å; R273-D285 IonicContact CZ-OD2 2.73Å; R273-D285 PolarHBondContact N-O 3.29Å; R273-D285 IonicContact NE-OD2 3.37Å; R273-D285 PolarHBondContact NE-OD2 2.86Å; R273-D285 IonicContact NH2-OD2 2.79Å; R273-D285 PolarHBondContact NH2-OD2 3.14Å; R273-D285 PolarHBondContact O-N 3.33Å; T275-D285 HydrophobicContact CG2-CB 3.59Å
286	N	93.6	Very high	89.5	Confident	111 Å²	111	67.8 Å²	67.8	59%	0.594	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	148.3	176.4	-68.9	-35	0	0	0	110.2
287	V	91.9	Very high	89	Confident	16 Å²	16	68 Å²	68	10%	0.097	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-73.8	136.7	169.5	-175.9	0	0	0	0	108.5	L271 E291 M292 I302	L271-V287 HydrophobicContact CB-CG2 4.15Å; V287-E291 HydrophobicContact CG1-CB 3.89Å; V287-M292 HydrophobicContact CG1-CG 3.96Å; V287-I302 HydrophobicContact CG1-CG1 4.46Å; V287-I302 HydrophobicContact CG1-CG2 4.25Å; V287-I302 HydrophobicContact CG2-CD1 3.71Å; V287-I302 HydrophobicContact CG2-CG1 4.1Å; V287-I302 HydrophobicContact CG2-CG2 3.71Å
288	F	87.6	Confident	88.6	Confident	64 Å²	64	68.5 Å²	68.5	28%	0.281	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-66.5	142.9	176.3	-60.9	-67.8	0	0	0	111	R273 Y290 E291 E435	R273-F288 VanDerWaalsContact NH2-CE2 3.28Å; R273-F288 VanDerWaalsContact NH2-CZ 3.27Å; F288-Y290 VanDerWaalsContact C-N 3.26Å; F288-Y290 HydrophobicContact CB-CD1 3.64Å; F288-Y290 HydrophobicContact CB-CE1 3.26Å; F288-Y290 HydrophobicContact CB-CE2 4.38Å; F288-Y290 HydrophobicContact CB-CG 4.35Å; F288-Y290 HydrophobicContact CD1-CE1 4.23Å; F288-Y290 AromaticContact CD2-CE1 3.94Å; F288-Y290 HydrophobicContact CD2-CE1 3.94Å; F288-Y290 AromaticContact CD2-CZ 3.72Å; F288-Y290 WeakPolarHBondContact CD2-OH 3.21Å; F288-Y290 HydrophobicContact CG-CD1 4.41Å; F288-Y290 AromaticContact CG-CE1 3.58Å; F288-Y290 HydrophobicContact CG-CE1 3.58Å; F288-Y290 AromaticContact CG-CZ 3.86Å; F288-Y290 PolarHBondContact O-N 3Å; F288-E291 HydrophobicContact CB-CG 4.33Å; F288-E291 WeakPolarHBondContact O-CB 3.22Å; F288-E291 PolarHBondContact O-N 3.03Å; F288-E435 WeakPolarHBondContact CE2-OE1 3.43Å; F288-E435 HydrophobicContact CZ-CG 4.25Å; F288-E435 WeakPolarHBondContact CZ-OE1 3.37Å
289	S	85.3	Confident	88.3	Confident	88 Å²	88	68.5 Å²	68.5	62%	0.615	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-54.8	-42.4	-178.5	50.7	0	0	0	0	112.4	E291 M292 D293	S289-E291 PolarHBondContact O-N 2.89Å; S289-M292 WeakPolarHBondContact O-CA 3.23Å; S289-M292 WeakPolarHBondContact O-CB 3.24Å; S289-M292 PolarHBondContact O-N 2.96Å; S289-D293 PolarHBondContact O-N 2.92Å
290	Y	83	Confident	88.3	Confident	141 Å²	141	70 Å²	70	55%	0.553	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-65.4	-24.5	-179.6	67.8	-100	0	0	0	113.8	F288 M292 D293	F288-Y290 VanDerWaalsContact C-N 3.26Å; F288-Y290 HydrophobicContact CB-CD1 3.64Å; F288-Y290 HydrophobicContact CB-CE1 3.26Å; F288-Y290 HydrophobicContact CB-CE2 4.38Å; F288-Y290 HydrophobicContact CB-CG 4.35Å; F288-Y290 HydrophobicContact CD1-CE1 4.23Å; F288-Y290 AromaticContact CD2-CE1 3.94Å; F288-Y290 HydrophobicContact CD2-CE1 3.94Å; F288-Y290 AromaticContact CD2-CZ 3.72Å; F288-Y290 WeakPolarHBondContact CD2-OH 3.21Å; F288-Y290 HydrophobicContact CG-CD1 4.41Å; F288-Y290 AromaticContact CG-CE1 3.58Å; F288-Y290 HydrophobicContact CG-CE1 3.58Å; F288-Y290 AromaticContact CG-CZ 3.86Å; F288-Y290 PolarHBondContact O-N 3Å; Y290-M292 PolarHBondContact O-N 3.44Å; Y290-D293 WeakPolarHBondContact CA-OD2 3.44Å; Y290-D293 PolarHBondContact O-N 2.98Å
291	E	81.8	Confident	88.3	Confident	41 Å²	41	72.3 Å²	72.3	19%	0.192	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-70.7	-23	174.9	-68.7	-166	106.3	0	0	111.5	V287 F288 S289 K300	V287-E291 HydrophobicContact CG1-CB 3.89Å; F288-E291 HydrophobicContact CB-CG 4.33Å; F288-E291 WeakPolarHBondContact O-CB 3.22Å; F288-E291 PolarHBondContact O-N 3.03Å; S289-E291 PolarHBondContact O-N 2.89Å; E291-K300 WeakPolarHBondContact O-CD 3.34Å; E291-K300 PolarHBondContact O-NZ 2.97Å
292	M	81.8	Confident	88.5	Confident	71 Å²	71	68.4 Å²	68.4	35%	0.35	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-93.3	-1.3	178.1	-54.7	-159.7	-65.2	0	0	113.6	L271 V287 S289 Y290 G297	L271-M292 HydrophobicContact CD1-SD 3.45Å; L271-M292 WeakPolarHBondContact CD1-SD 3.26Å; V287-M292 HydrophobicContact CG1-CG 3.96Å; S289-M292 WeakPolarHBondContact O-CA 3.23Å; S289-M292 WeakPolarHBondContact O-CB 3.24Å; S289-M292 PolarHBondContact O-N 2.96Å; Y290-M292 PolarHBondContact O-N 3.44Å; M292-G297 WeakPolarHBondContact O-CA 3.3Å
293	D	82.4	Confident	88.5	Confident	112 Å²	112	70.1 Å²	70.1	60%	0.599	37%	0.369	S	S	*	.			trans	-71.5	151.4	175.5	-68.9	-22.5	0	0	0	111.3	S289 Y290	S289-D293 PolarHBondContact O-N 2.92Å; Y290-D293 WeakPolarHBondContact CA-OD2 3.44Å; Y290-D293 PolarHBondContact O-N 2.98Å
294	G	83.4	Confident	88.6	Confident	54 Å²	54	65.7 Å²	65.7	56%	0.557	35%	0.35	S	S	*	.	S	Bend	trans	100.4	-178.4	176.5	0	0	0	0	0	115	E296 G297	G294-E296 VanDerWaalsContact C-N 3.32Å; G294-E296 PolarHBondContact O-N 3.02Å; G294-G297 PolarHBondContact O-N 3.26Å; G294-G297 VanDerWaalsContact O-N 3.13Å
295	P	81.4	Confident	88.7	Confident	132 Å²	132	60.2 Å²	60.2	86%	0.857	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-27.6	-167.2	25.2	-34.3	0	0	0	114
296	E	82.1	Confident	88.9	Confident	91 Å²	91	57.4 Å²	57.4	43%	0.425	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.7	176.6	-69.4	-160.2	-130.3	0	0	113.3	K127 G294 S298 T299 K300	K127-E296 IonicContact NZ-OE2 3.65Å; K127-E296 PolarHBondContact NZ-OE2 3.13Å; G294-E296 VanDerWaalsContact C-N 3.32Å; G294-E296 PolarHBondContact O-N 3.02Å; E296-S298 PolarHBondContact O-N 3.23Å; E296-T299 WeakPolarHBondContact O-CB 3.48Å; E296-T299 PolarHBondContact O-N 2.77Å; E296-T299 PolarHBondContact O-OG1 3.43Å; E296-K300 HydrophobicContact CB-CB 3.88Å; E296-K300 HydrophobicContact CB-CG 4.42Å
297	G	86.3	Confident	89.1	Confident	12 Å²	12	52.3 Å²	52.3	12%	0.124	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	46.8	-132.6	177.2	0	0	0	0	0	114.1	M292 G294 T299 K300	M292-G297 WeakPolarHBondContact O-CA 3.3Å; G294-G297 PolarHBondContact O-N 3.26Å; G294-G297 VanDerWaalsContact O-N 3.13Å; G297-T299 PolarHBondContact O-N 2.8Å; G297-K300 WeakPolarHBondContact O-CB 3.41Å; G297-K300 PolarHBondContact O-N 3.32Å
298	S	84.8	Confident	89.2	Confident	35 Å²	35	53 Å²	53	25%	0.245	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-61.2	-5.1	176.4	62.6	0	0	0	0	116.1	S121 E296 P354	S121-S298 PolarHBondContact OG-OG 3.01Å; E296-S298 PolarHBondContact O-N 3.23Å; S298-P354 VanDerWaalsContact O-CB 3.3Å; S298-P354 WeakPolarHBondContact O-CB 3.34Å
299	T	88.8	Confident	89.5	Confident	6 Å²	6	50 Å²	50	4%	0.037	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-104	-4.5	-177.4	75.4	0	0	0	0	113.4	M123 R124 K127 E296 G297 C355	M123-T299 HydrophobicContact CB-CG2 3.86Å; R124-T299 HydrophobicContact CG-CG2 3.81Å; K127-T299 WeakPolarHBondContact CE-OG1 3.33Å; K127-T299 PolarHBondContact NZ-O 3.45Å; K127-T299 PolarHBondContact NZ-OG1 2.95Å; K127-T299 VanDerWaalsContact NZ-OG1 3.12Å; E296-T299 WeakPolarHBondContact O-CB 3.48Å; E296-T299 PolarHBondContact O-N 2.77Å; E296-T299 PolarHBondContact O-OG1 3.43Å; G297-T299 PolarHBondContact O-N 2.8Å; T299-C355 PolarHBondContact O-SG 3.46Å
300	K	91.1	Very high	89.9	Confident	82 Å²	82	46.4 Å²	46.4	36%	0.357	26%	0.257	S	S	.	.	S	Bend	trans	-66.6	140.4	177.6	-172.1	-178.4	169.9	-170.9	0	110.5	E291 E296 G297 I302 P354	E291-K300 WeakPolarHBondContact O-CD 3.34Å; E291-K300 PolarHBondContact O-NZ 2.97Å; E296-K300 HydrophobicContact CB-CB 3.88Å; E296-K300 HydrophobicContact CB-CG 4.42Å; G297-K300 WeakPolarHBondContact O-CB 3.41Å; G297-K300 PolarHBondContact O-N 3.32Å; K300-I302 PolarHBondContact O-N 3.1Å; K300-P354 VanDerWaalsContact O-CD 3.27Å; K300-P354 WeakPolarHBondContact O-CD 3.33Å; K300-P354 VanDerWaalsContact O-CG 3.32Å; K300-P354 WeakPolarHBondContact O-CG 3.21Å
301	P	94.4	Very high	90.6	Very high	51 Å²	51	39.8 Å²	39.8	33%	0.331	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-54	130.4	168.5	-26.9	36.7	0	0	0	111.5	F351 I353	P301-F351 HydrophobicContact CB-CB 4.31Å; P301-F351 HydrophobicContact CB-CD1 3.91Å; P301-F351 HydrophobicContact CB-CG 4.27Å; P301-I353 HydrophobicContact CB-CD1 3.78Å; P301-I353 HydrophobicContact CG-CD1 3.96Å
302	I	96.1	Very high	91.4	Very high	11 Å²	11	37.8 Å²	37.8	6%	0.056	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.6	-179.2	-62.2	160	0	0	0	108.3	L271 R273 V287 K300 S304 F351 I352 P354	L271-I302 HydrophobicContact CB-CD1 4.43Å; L271-I302 HydrophobicContact CD2-CD1 4.37Å; R273-I302 HydrophobicContact CB-CG2 3.9Å; V287-I302 HydrophobicContact CG1-CG1 4.46Å; V287-I302 HydrophobicContact CG1-CG2 4.25Å; V287-I302 HydrophobicContact CG2-CD1 3.71Å; V287-I302 HydrophobicContact CG2-CG1 4.1Å; V287-I302 HydrophobicContact CG2-CG2 3.71Å; K300-I302 PolarHBondContact O-N 3.1Å; I302-S304 PolarHBondContact O-N 3.23Å; I302-F351 CarbonylContact O-C 3.48Å; I302-F351 WeakPolarHBondContact O-CA 3.21Å; I302-F351 WeakPolarHBondContact O-CD1 3.09Å; I302-I352 HydrophobicContact CB-CB 4.29Å; I302-I352 PolarHBondContact N-O 3.04Å; I302-I352 PolarHBondContact O-N 3.44Å; I302-P354 HydrophobicContact CD1-CG 3.62Å; I302-P354 HydrophobicContact CG1-CG 3.98Å
303	R	96.1	Very high	92.3	Very high	84 Å²	84	34.4 Å²	34.4	32%	0.317	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	129.4	176	-167	177.6	-179.3	-152.8	-0.3	109.6	W344 F351 N431	R303-W344 HydrophobicContact CG-CH2 3.61Å; R303-W344 HydrophobicContact CG-CZ2 3.58Å; R303-F351 HydrophobicContact CB-CD1 4.21Å; R303-F351 HydrophobicContact CB-CE1 3.88Å; R303-F351 HydrophobicContact CG-CE1 4.15Å; R303-N431 PolarHBondContact NH1-O 2.91Å; R303-N431 PolarHBondContact NH2-O 3.2Å
304	S	97.8	Very high	93.1	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.007	18%	0.177	C	C	.	.			trans	-123.1	117.8	-173.9	-158.7	0	0	0	0	111.1	G274 I302 A306 W344 L350	G274-S304 WeakPolarHBondContact CA-OG 3.25Å; G274-S304 PolarHBondContact N-OG 3.22Å; G274-S304 PolarHBondContact O-OG 3.24Å; I302-S304 PolarHBondContact O-N 3.23Å; S304-A306 VanDerWaalsContact C-N 3.27Å; S304-A306 PolarHBondContact O-N 3.49Å; S304-A306 PolarHBondContact OG-O 2.96Å; S304-W344 PolarHBondContact O-NE1 2.9Å; S304-L350 PolarHBondContact N-O 3.22Å
305	P	98.1	Very high	93.8	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.013	17%	0.169	C	C	.	.	S	Bend	trans	-54	-43	173.2	-31.2	37.3	0	0	0	113.3	G274 T275 Y428 F433	G274-P305 VanDerWaalsContact O-CD 3.26Å; G274-P305 WeakPolarHBondContact O-CD 3.3Å; T275-P305 HydrophobicContact CG2-CG 4.34Å; P305-Y428 WeakPolarHBondContact CB-OH 3.49Å; P305-Y428 PolarHBondContact O-OH 3.44Å; P305-F433 HydrophobicContact CB-CB 3.94Å; P305-F433 HydrophobicContact CB-CD1 3.85Å; P305-F433 HydrophobicContact CB-CD2 4.24Å; P305-F433 HydrophobicContact CB-CE1 4.46Å; P305-F433 HydrophobicContact CB-CG 3.75Å; P305-F433 HydrophobicContact CG-CB 4.12Å; P305-F433 HydrophobicContact CG-CD1 4.42Å; P305-F433 HydrophobicContact CG-CD2 3.91Å; P305-F433 HydrophobicContact CG-CG 3.9Å
306	A	98.3	Very high	94.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-135.4	161.4	177.4	0	0	0	0	0	112.1	G274 F276 F282 S304 L337 S340	G274-A306 CarbonylContact C-O 3.52Å; G274-A306 VanDerWaalsContact CA-O 3.23Å; G274-A306 WeakPolarHBondContact CA-O 3.3Å; G274-A306 PolarHBondContact O-N 2.89Å; F276-A306 HydrophobicContact CD1-CB 3.96Å; F282-A306 HydrophobicContact CD2-CB 4.22Å; F282-A306 HydrophobicContact CE2-CB 4.33Å; S304-A306 VanDerWaalsContact C-N 3.27Å; S304-A306 PolarHBondContact O-N 3.49Å; S304-A306 PolarHBondContact OG-O 2.96Å; A306-L337 HydrophobicContact CB-CD2 3.61Å; A306-S340 WeakPolarHBondContact CA-OG 3.43Å
307	M	97.8	Very high	95.4	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.02	15%	0.149	C	C	.	.			trans	-110.2	155.7	168.4	58.6	173.3	178.5	0	0	111.4	F282 G309 F312 N336 L339 S340 L350	F282-M307 WeakPolarHBondContact CD2-O 3.33Å; F282-M307 WeakPolarHBondContact CE2-O 3.41Å; M307-G309 PolarHBondContact O-N 3.22Å; M307-F312 HydrophobicContact CE-CD1 4.42Å; M307-F312 HydrophobicContact CE-CE1 4.37Å; M307-F312 HydrophobicContact CE-CE2 4.5Å; M307-F312 HydrophobicContact CE-CZ 4.39Å; M307-F312 HydrophobicContact SD-CB 4.1Å; M307-F312 HydrophobicContact SD-CD1 4.08Å; M307-F312 HydrophobicContact SD-CD2 4.32Å; M307-F312 HydrophobicContact SD-CG 3.92Å; M307-N336 PolarHBondContact O-ND2 2.7Å; M307-L339 HydrophobicContact CE-CB 3.97Å; M307-L339 HydrophobicContact CE-CD2 3.46Å; M307-L339 VanDerWaalsContact CE-CD2 3.46Å; M307-L339 HydrophobicContact CE-CG 3.67Å; M307-S340 WeakPolarHBondContact CG-OG 3.21Å; M307-S340 PolarHBondContact N-OG 3.2Å; M307-L350 HydrophobicContact CB-CD1 4.29Å; M307-L350 HydrophobicContact CB-CD2 4.04Å; M307-L350 HydrophobicContact CG-CD1 4.47Å; M307-L350 HydrophobicContact CG-CD2 4.18Å; M307-L350 HydrophobicContact SD-CD1 4.28Å
308	S	95.7	Very high	96	Very high	32 Å²	32	30.1 Å²	30.1	22%	0.224	14%	0.144	C	C	.	.			trans	-62.8	-31.7	170.7	64	0	0	0	0	111.4	I256 G310 N336	I256-S308 WeakPolarHBondContact CD1-OG 3.48Å; S308-G310 VanDerWaalsContact C-N 3.33Å; S308-N336 VanDerWaalsContact O-CB 3.31Å; S308-N336 WeakPolarHBondContact O-CB 3.14Å; S308-N336 PolarHBondContact O-ND2 3.28Å
309	G	92.8	Very high	96.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	88.4	-14.4	176.1	0	0	0	0	0	114.5	R211 M307	R211-G309 VanDerWaalsContact CZ-O 3.24Å; R211-G309 PolarHBondContact NH1-O 2.81Å; R211-G309 PolarHBondContact NH2-O 2.84Å; M307-G309 PolarHBondContact O-N 3.22Å
310	G	94.2	Very high	97.1	Very high	13 Å²	13	31.4 Å²	31.4	13%	0.134	15%	0.148	C	C	.	.	S	Bend	trans	-63.6	-46.6	177	0	0	0	0	0	112.5	R211 S308	R211-G310 PolarHBondContact NH2-O 3.25Å; S308-G310 VanDerWaalsContact C-N 3.33Å
311	I	98.4	Very high	97.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	15%	0.148	C	C	.	.	S	Bend	trans	-133.2	117.4	-170.1	-48.5	165.9	0	0	0	110.2	F225 L226 P254 I256 V358 H360	F225-I311 VanDerWaalsContact O-CA 3.3Å; F225-I311 WeakPolarHBondContact O-CA 3.47Å; L226-I311 HydrophobicContact CD2-CB 4.38Å; L226-I311 HydrophobicContact CD2-CD1 4.37Å; L226-I311 HydrophobicContact CD2-CG1 4.12Å; L226-I311 HydrophobicContact CD2-CG2 3.45Å; L226-I311 VanDerWaalsContact CD2-CG2 3.45Å; L226-I311 HydrophobicContact CG-CG2 4.34Å; P254-I311 HydrophobicContact CG-CB 4.08Å; P254-I311 HydrophobicContact CG-CG2 3.41Å; P254-I311 VanDerWaalsContact CG-CG2 3.41Å; I256-I311 HydrophobicContact CD1-CB 4.5Å; I256-I311 HydrophobicContact CD1-CD1 4.2Å; I256-I311 HydrophobicContact CG1-CD1 4.21Å; I256-I311 HydrophobicContact CG2-CD1 4.44Å; I311-V358 HydrophobicContact CD1-CB 4.21Å; I311-V358 HydrophobicContact CD1-CG1 3.79Å; I311-H360 HydrophobicContact CD1-CB 4.44Å
312	F	98.9	Very high	97.6	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	160.5	177	69.7	-78.7	0	0	0	111.9	V224 F225 V251 V252 M307 I314 Y325 L339	V224-F312 CarbonylContact C-O 3.41Å; V224-F312 WeakPolarHBondContact CA-O 3.28Å; F225-F312 HydrophobicContact CB-CD1 4.06Å; F225-F312 HydrophobicContact CB-CE1 3.84Å; F225-F312 HydrophobicContact CB-CZ 4.43Å; F225-F312 HydrophobicContact CD2-CD1 4.11Å; F225-F312 HydrophobicContact CD2-CD2 4.18Å; F225-F312 AromaticContact CD2-CE1 3.45Å; F225-F312 HydrophobicContact CD2-CE1 3.45Å; F225-F312 VanDerWaalsContact CD2-CE1 3.45Å; F225-F312 AromaticContact CD2-CE2 3.55Å; F225-F312 HydrophobicContact CD2-CE2 3.55Å; F225-F312 HydrophobicContact CD2-CG 4.44Å; F225-F312 AromaticContact CD2-CZ 3.14Å; F225-F312 HydrophobicContact CD2-CZ 3.14Å; F225-F312 HydrophobicContact CE2-CE1 4.23Å; F225-F312 AromaticContact CE2-CE2 3.82Å; F225-F312 HydrophobicContact CE2-CE2 3.82Å; F225-F312 AromaticContact CE2-CZ 3.5Å; F225-F312 HydrophobicContact CE2-CZ 3.5Å; F225-F312 HydrophobicContact CG-CD1 4.46Å; F225-F312 AromaticContact CG-CE1 3.83Å; F225-F312 HydrophobicContact CG-CE1 3.83Å; F225-F312 AromaticContact CG-CZ 3.97Å; F225-F312 HydrophobicContact CG-CZ 3.97Å; F225-F312 PolarHBondContact N-O 3.07Å; F225-F312 PolarHBondContact O-N 3.43Å; V251-F312 HydrophobicContact CG1-CD2 3.83Å; V251-F312 HydrophobicContact CG1-CE2 4.49Å; V252-F312 CarbonylContact O-C 3.56Å; V252-F312 WeakPolarHBondContact O-CA 3.3Å; M307-F312 HydrophobicContact CE-CD1 4.42Å; M307-F312 HydrophobicContact CE-CE1 4.37Å; M307-F312 HydrophobicContact CE-CE2 4.5Å; M307-F312 HydrophobicContact CE-CZ 4.39Å; M307-F312 HydrophobicContact SD-CB 4.1Å; M307-F312 HydrophobicContact SD-CD1 4.08Å; M307-F312 HydrophobicContact SD-CD2 4.32Å; M307-F312 HydrophobicContact SD-CG 3.92Å; F312-I314 HydrophobicContact CD2-CB 4.36Å; F312-I314 HydrophobicContact CD2-CG2 4.23Å; F312-I314 HydrophobicContact CE2-CB 4.27Å; F312-I314 HydrophobicContact CE2-CG2 3.77Å; F312-Y325 WeakPolarHBondContact CE1-OH 3.47Å; F312-Y325 WeakPolarHBondContact CZ-OH 3.35Å; F312-L339 HydrophobicContact CE2-CD2 4.28Å; F312-L339 HydrophobicContact CZ-CD2 4.08Å
313	A	98.9	Very high	97.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140	173.2	0	0	0	0	0	111	V222 L223 V224 L240 I244 V252	V222-A313 HydrophobicContact CG1-CB 3.99Å; L223-A313 CarbonylContact O-C 3.59Å; L223-A313 VanDerWaalsContact O-CA 3.23Å; L223-A313 WeakPolarHBondContact O-CA 3.44Å; V224-A313 HydrophobicContact CG2-CB 3.91Å; L240-A313 HydrophobicContact CB-CB 4.23Å; L240-A313 HydrophobicContact CD1-CB 4.33Å; I244-A313 HydrophobicContact CD1-CB 3.75Å; V252-A313 HydrophobicContact CG2-CB 3.99Å; V252-A313 PolarHBondContact N-O 3.18Å; V252-A313 PolarHBondContact O-N 3.08Å
314	I	98.9	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	141	179.3	-175.5	166.6	0	0	0	109.9	L223 F225 V251 F312 R316 Y318 F319 I322	L223-I314 HydrophobicContact CB-CG2 4.09Å; L223-I314 PolarHBondContact N-O 2.98Å; L223-I314 PolarHBondContact O-N 2.99Å; F225-I314 HydrophobicContact CE2-CG2 4.23Å; V251-I314 HydrophobicContact CG1-CB 4.31Å; V251-I314 HydrophobicContact CG2-CB 4.36Å; V251-I314 HydrophobicContact CG2-CD1 3.54Å; V251-I314 HydrophobicContact CG2-CG1 3.85Å; F312-I314 HydrophobicContact CD2-CB 4.36Å; F312-I314 HydrophobicContact CD2-CG2 4.23Å; F312-I314 HydrophobicContact CE2-CB 4.27Å; F312-I314 HydrophobicContact CE2-CG2 3.77Å; I314-R316 PolarHBondContact O-N 3.16Å; I314-Y318 HydrophobicContact CD1-CD1 3.91Å; I314-Y318 HydrophobicContact CD1-CE1 4.45Å; I314-Y318 HydrophobicContact CG1-CD1 4.03Å; I314-F319 HydrophobicContact CD1-CB 3.9Å; I314-F319 HydrophobicContact CD1-CD2 4.06Å; I314-F319 HydrophobicContact CD1-CG 4.48Å; I314-F319 HydrophobicContact CG1-CB 4.16Å; I314-F319 HydrophobicContact CG2-CB 3.98Å; I314-F319 HydrophobicContact CG2-CD2 4.19Å; I314-F319 HydrophobicContact CG2-CG 4.26Å; I314-I322 HydrophobicContact CD1-CD1 4.02Å
315	R	98.8	Very high	97.8	Very high	107 Å²	107	28.2 Å²	28.2	40%	0.404	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	128.6	172.7	-170.5	177.1	-174.4	-160.7	3.9	109.9	I244 P248 H317 Y318 F319	I244-R315 HydrophobicContact CG2-CB 3.89Å; P248-R315 VanDerWaalsContact CB-NH1 3.35Å; R315-H317 VanDerWaalsContact C-N 3.33Å; R315-H317 PolarHBondContact O-N 2.94Å; R315-Y318 WeakPolarHBondContact O-CA 3.46Å; R315-Y318 WeakPolarHBondContact O-CB 3.38Å; R315-Y318 PolarHBondContact O-N 2.97Å; R315-F319 PolarHBondContact O-N 2.86Å
316	R	98.8	Very high	97.8	Very high	80 Å²	80	28.3 Å²	28.3	30%	0.302	14%	0.138	S	C	.	.	H	α-helix	trans	-57.1	-44.4	-174.6	-175.5	170.4	59.8	90.2	-0.4	112.5	A218 S219 G220 D221 L223 I314 Y318 F319 N320	A218-R316 WeakPolarHBondContact O-CD 3.21Å; S219-R316 PolarHBondContact O-NH2 3.34Å; S219-R316 VanDerWaalsContact O-NH2 3.17Å; G220-R316 WeakPolarHBondContact O-CD 3.06Å; G220-R316 PolarHBondContact O-NE 2.84Å; D221-R316 WeakPolarHBondContact O-CB 3.34Å; D221-R316 PolarHBondContact O-N 3.4Å; L223-R316 HydrophobicContact CD1-CB 4.38Å; L223-R316 HydrophobicContact CD1-CG 4.15Å; L223-R316 HydrophobicContact CD2-CB 4.35Å; L223-R316 HydrophobicContact CD2-CG 4.06Å; L223-R316 HydrophobicContact CG-CB 3.92Å; L223-R316 HydrophobicContact CG-CG 3.98Å; I314-R316 PolarHBondContact O-N 3.16Å; R316-Y318 VanDerWaalsContact C-N 3.34Å; R316-Y318 PolarHBondContact O-N 3.28Å; R316-F319 PolarHBondContact O-N 2.94Å; R316-N320 PolarHBondContact O-N 2.9Å; R316-N320 VanDerWaalsContact O-N 3.14Å; R316-N320 PolarHBondContact O-ND2 2.61Å
317	H	98.6	Very high	97.7	Very high	119 Å²	119	32.9 Å²	32.9	55%	0.551	16%	0.157	S	C	*	.	H	α-helix	trans	-60.3	-44	175.1	-175.6	-83	0	0	0	111.9	R315 N320 E321	R315-H317 VanDerWaalsContact C-N 3.33Å; R315-H317 PolarHBondContact O-N 2.94Å; H317-N320 WeakPolarHBondContact O-CB 3.09Å; H317-N320 PolarHBondContact O-N 3.09Å; H317-E321 IonicContact CE1-OE2 3.18Å; H317-E321 IonicContact ND1-OE2 2.75Å; H317-E321 WeakPolarHBondContact O-CB 3.42Å; H317-E321 PolarHBondContact O-N 2.73Å
318	Y	98.8	Very high	97.7	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-66.3	-40.3	180	-174.5	-123.2	0	0	0	111.7	K249 V251 I314 R315 R316 N320 E321 I322 G348	K249-Y318 HydrophobicContact CB-CD2 4.47Å; K249-Y318 HydrophobicContact CB-CE1 4.19Å; K249-Y318 HydrophobicContact CB-CE2 4.05Å; K249-Y318 HydrophobicContact CD-CE2 4Å; K249-Y318 HydrophobicContact CG-CD2 3.97Å; K249-Y318 HydrophobicContact CG-CE2 3.72Å; K249-Y318 WeakPolarHBondContact O-CE1 3.47Å; V251-Y318 HydrophobicContact CG2-CD1 4.39Å; V251-Y318 HydrophobicContact CG2-CE1 4.1Å; I314-Y318 HydrophobicContact CD1-CD1 3.91Å; I314-Y318 HydrophobicContact CD1-CE1 4.45Å; I314-Y318 HydrophobicContact CG1-CD1 4.03Å; R315-Y318 WeakPolarHBondContact O-CA 3.46Å; R315-Y318 WeakPolarHBondContact O-CB 3.38Å; R315-Y318 PolarHBondContact O-N 2.97Å; R316-Y318 VanDerWaalsContact C-N 3.34Å; R316-Y318 PolarHBondContact O-N 3.28Å; Y318-N320 VanDerWaalsContact C-N 3.27Å; Y318-N320 PolarHBondContact O-N 3.27Å; Y318-E321 PolarHBondContact O-N 2.92Å; Y318-I322 HydrophobicContact CD2-CG2 3.85Å; Y318-I322 HydrophobicContact CE1-CD1 4.22Å; Y318-I322 HydrophobicContact CE1-CG2 4.12Å; Y318-I322 HydrophobicContact CE2-CG2 3.29Å; Y318-I322 HydrophobicContact CG-CG2 4.46Å; Y318-I322 VanDerWaalsContact CZ-CG2 3.43Å; Y318-I322 WeakPolarHBondContact O-CG1 3.4Å; Y318-I322 PolarHBondContact O-N 3.47Å; Y318-G348 WeakPolarHBondContact OH-CA 3.48Å; Y318-G348 PolarHBondContact OH-N 3.08Å
319	F	98.8	Very high	97.8	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-56.5	-41.3	172.9	-176.3	-115.3	0	0	0	112.2	L212 A215 L223 F225 I314 R315 R316 Q324 Y325 L339	L212-F319 HydrophobicContact CD2-CE1 4.37Å; L212-F319 HydrophobicContact CD2-CZ 4.22Å; A215-F319 HydrophobicContact CB-CD1 4.31Å; A215-F319 HydrophobicContact CB-CE1 3.82Å; L223-F319 HydrophobicContact CD1-CB 4.06Å; L223-F319 HydrophobicContact CD1-CD1 3.48Å; L223-F319 VanDerWaalsContact CD1-CD1 3.48Å; L223-F319 HydrophobicContact CD1-CE1 4.14Å; L223-F319 HydrophobicContact CD1-CG 3.95Å; F225-F319 HydrophobicContact CZ-CE1 4.33Å; F225-F319 HydrophobicContact CZ-CZ 4.22Å; I314-F319 HydrophobicContact CD1-CB 3.9Å; I314-F319 HydrophobicContact CD1-CD2 4.06Å; I314-F319 HydrophobicContact CD1-CG 4.48Å; I314-F319 HydrophobicContact CG1-CB 4.16Å; I314-F319 HydrophobicContact CG2-CB 3.98Å; I314-F319 HydrophobicContact CG2-CD2 4.19Å; I314-F319 HydrophobicContact CG2-CG 4.26Å; R315-F319 PolarHBondContact O-N 2.86Å; R316-F319 PolarHBondContact O-N 2.94Å; F319-Q324 HydrophobicContact CD1-CB 4.15Å; F319-Q324 HydrophobicContact CD1-CG 3.82Å; F319-Q324 HydrophobicContact CE1-CB 3.63Å; F319-Q324 HydrophobicContact CE1-CG 3.69Å; F319-Q324 HydrophobicContact CE2-CB 4.25Å; F319-Q324 HydrophobicContact CG-CG 4.49Å; F319-Q324 HydrophobicContact CZ-CB 3.7Å; F319-Q324 HydrophobicContact CZ-CG 4.27Å; F319-Q324 VanDerWaalsContact O-CA 3.28Å; F319-Q324 WeakPolarHBondContact O-CA 3.36Å; F319-Q324 PolarHBondContact O-N 3.48Å; F319-Y325 HydrophobicContact CE2-CD2 4.32Å; F319-Y325 HydrophobicContact CE2-CE2 4.4Å; F319-Y325 AromaticContact CZ-CD2 3.96Å; F319-Y325 HydrophobicContact CZ-CD2 3.96Å; F319-Y325 HydrophobicContact CZ-CE2 4.27Å; F319-L339 HydrophobicContact CE2-CD2 4.43Å
320	N	98.4	Very high	97.8	Very high	68 Å²	68	36.2 Å²	36.2	36%	0.364	17%	0.173	S	C	.	.	H	α-helix	trans	-68.5	-46.4	175.3	-66.4	-23	0	0	0	112.2	R316 H317 Y318 I322 G323 Q324	R316-N320 PolarHBondContact O-N 2.9Å; R316-N320 VanDerWaalsContact O-N 3.14Å; R316-N320 PolarHBondContact O-ND2 2.61Å; H317-N320 WeakPolarHBondContact O-CB 3.09Å; H317-N320 PolarHBondContact O-N 3.09Å; Y318-N320 VanDerWaalsContact C-N 3.27Å; Y318-N320 PolarHBondContact O-N 3.27Å; N320-I322 PolarHBondContact O-N 3.47Å; N320-G323 PolarHBondContact O-N 3.25Å; N320-Q324 PolarHBondContact OD1-NE2 2.94Å
321	E	98.3	Very high	97.6	Very high	80 Å²	80	38.1 Å²	38.1	37%	0.374	18%	0.178	S	C	.	.	H	α-helix	trans	-56.8	-46.6	-179.6	-178.3	-173.7	149.2	0	0	112	H317 Y318 G323	H317-E321 IonicContact CE1-OE2 3.18Å; H317-E321 IonicContact ND1-OE2 2.75Å; H317-E321 WeakPolarHBondContact O-CB 3.42Å; H317-E321 PolarHBondContact O-N 2.73Å; Y318-E321 PolarHBondContact O-N 2.92Å; E321-G323 PolarHBondContact O-N 3.24Å
322	I	98.1	Very high	97.2	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-1.1	179.5	69.1	178.7	0	0	0	112.8	I314 Y318 N320 L339 R342 I343 L416	I314-I322 HydrophobicContact CD1-CD1 4.02Å; Y318-I322 HydrophobicContact CD2-CG2 3.85Å; Y318-I322 HydrophobicContact CE1-CD1 4.22Å; Y318-I322 HydrophobicContact CE1-CG2 4.12Å; Y318-I322 HydrophobicContact CE2-CG2 3.29Å; Y318-I322 HydrophobicContact CG-CG2 4.46Å; Y318-I322 VanDerWaalsContact CZ-CG2 3.43Å; Y318-I322 WeakPolarHBondContact O-CG1 3.4Å; Y318-I322 PolarHBondContact O-N 3.47Å; N320-I322 PolarHBondContact O-N 3.47Å; I322-L339 HydrophobicContact CD1-CD1 3.83Å; I322-R342 WeakPolarHBondContact O-CD 3.37Å; I322-R342 PolarHBondContact O-NH1 2.96Å; I322-I343 HydrophobicContact CD1-CG1 4.07Å; I322-L416 WeakPolarHBondContact O-CD2 3.36Å
323	G	98	Very high	96.8	Very high	17 Å²	17	42.6 Å²	42.6	18%	0.175	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	34.9	177	0	0	0	0	0	114.8	N320 E321 R342 R413	N320-G323 PolarHBondContact O-N 3.25Å; E321-G323 PolarHBondContact O-N 3.24Å; G323-R342 PolarHBondContact O-NH1 3.11Å; G323-R413 PolarHBondContact O-NH1 3.38Å
324	Q	98.1	Very high	96.5	Very high	58 Å²	58	43.8 Å²	43.8	27%	0.271	20%	0.199	S	C	.	.			trans	49.6	-131.3	168.3	-56.1	-179.7	-24.6	0	0	113.7	L212 F319 N320 R342	L212-Q324 HydrophobicContact CD2-CB 3.54Å; L212-Q324 HydrophobicContact CD2-CG 4.41Å; F319-Q324 HydrophobicContact CD1-CB 4.15Å; F319-Q324 HydrophobicContact CD1-CG 3.82Å; F319-Q324 HydrophobicContact CE1-CB 3.63Å; F319-Q324 HydrophobicContact CE1-CG 3.69Å; F319-Q324 HydrophobicContact CE2-CB 4.25Å; F319-Q324 HydrophobicContact CG-CG 4.49Å; F319-Q324 HydrophobicContact CZ-CB 3.7Å; F319-Q324 HydrophobicContact CZ-CG 4.27Å; F319-Q324 VanDerWaalsContact O-CA 3.28Å; F319-Q324 WeakPolarHBondContact O-CA 3.36Å; F319-Q324 PolarHBondContact O-N 3.48Å; N320-Q324 PolarHBondContact OD1-NE2 2.94Å; Q324-R342 PolarHBondContact O-NH1 2.92Å; Q324-R342 PolarHBondContact O-NH2 2.98Å
325	Y	98.3	Very high	96.4	Very high	5 Å²	5	43.9 Å²	43.9	2%	0.02	20%	0.2	C	C	.	.	S	Bend	trans	-98	159	162.5	-76.5	-66.6	0	0	0	110.4	I208 R211 L212 F312 F319 K327 E335 L339	I208-Y325 HydrophobicContact CG2-CD2 4.44Å; I208-Y325 HydrophobicContact CG2-CG 4.04Å; R211-Y325 HydrophobicContact CB-CD2 4.46Å; R211-Y325 HydrophobicContact CB-CE2 4.2Å; R211-Y325 PolarHBondContact NH1-OH 3.1Å; R211-Y325 VanDerWaalsContact NH1-OH 3.1Å; L212-Y325 HydrophobicContact CD2-CD2 4.32Å; F312-Y325 WeakPolarHBondContact CE1-OH 3.47Å; F312-Y325 WeakPolarHBondContact CZ-OH 3.35Å; F319-Y325 HydrophobicContact CE2-CD2 4.32Å; F319-Y325 HydrophobicContact CE2-CE2 4.4Å; F319-Y325 AromaticContact CZ-CD2 3.96Å; F319-Y325 HydrophobicContact CZ-CD2 3.96Å; F319-Y325 HydrophobicContact CZ-CE2 4.27Å; Y325-K327 PolarHBondContact O-N 3.02Å; Y325-K327 VanDerWaalsContact O-N 3.08Å; Y325-E335 HydrophobicContact CD1-CB 3.89Å; Y325-E335 HydrophobicContact CD1-CG 4.28Å; Y325-E335 HydrophobicContact CE1-CB 3.79Å; Y325-E335 HydrophobicContact CE1-CG 3.73Å; Y325-L339 HydrophobicContact CD1-CB 4.41Å; Y325-L339 HydrophobicContact CD1-CD2 4.2Å; Y325-L339 HydrophobicContact CE1-CB 4Å; Y325-L339 HydrophobicContact CE1-CD2 3.51Å; Y325-L339 HydrophobicContact CE1-CG 4.38Å
326	D	98.2	Very high	96.4	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.021	18%	0.183	C	C	.	.			trans	-66.8	103.2	166.6	-177.6	3.9	0	0	0	110.1	D328 M329 R382 R413	D326-D328 PolarHBondContact O-N 2.97Å; D326-D328 VanDerWaalsContact O-N 3.13Å; D326-D328 PolarHBondContact OD1-N 3.11Å; D326-M329 HydrophobicContact CB-CE 4.34Å; D326-M329 HydrophobicContact CB-CG 3.9Å; D326-M329 HydrophobicContact CB-SD 4.18Å; D326-M329 WeakPolarHBondContact O-CB 3.42Å; D326-M329 PolarHBondContact O-N 2.78Å; D326-R382 IonicContact OD1-CZ 2.92Å; D326-R382 IonicContact OD1-NE 2.73Å; D326-R382 IonicContact OD1-NH2 3.97Å; D326-R382 PolarHBondContact OD1-NH2 3.38Å; D326-R382 IonicContact OD2-CZ 3.02Å; D326-R382 VanDerWaalsContact OD2-CZ 3.28Å; D326-R382 IonicContact OD2-NE 3.28Å; D326-R382 PolarHBondContact OD2-NE 3.19Å; D326-R382 IonicContact OD2-NH2 2.82Å; D326-R382 PolarHBondContact OD2-NH2 3Å; D326-R413 HydrophobicContact CB-CG 4.43Å
327	K	96.1	Very high	96.3	Very high	96 Å²	96	35.6 Å²	35.6	42%	0.417	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.7	-175.6	70.5	-171.6	177.5	-151.4	0	114.3	R209 L212 Y325 M329 E412	R209-K327 PolarHBondContact NE-O 3.16Å; R209-K327 PolarHBondContact NH2-O 2.74Å; L212-K327 HydrophobicContact CD1-CB 3.91Å; Y325-K327 PolarHBondContact O-N 3.02Å; Y325-K327 VanDerWaalsContact O-N 3.08Å; K327-M329 VanDerWaalsContact C-N 3.34Å; K327-E412 VanDerWaalsContact CE-OE2 3.27Å; K327-E412 WeakPolarHBondContact CE-OE2 3.3Å; K327-E412 VanDerWaalsContact NZ-CD 3.34Å; K327-E412 IonicContact NZ-OE1 3.76Å; K327-E412 PolarHBondContact NZ-OE1 3.24Å; K327-E412 IonicContact NZ-OE2 3.42Å; K327-E412 PolarHBondContact NZ-OE2 3.32Å
328	D	96.9	Very high	96.3	Very high	60 Å²	60	30 Å²	30	32%	0.321	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	0.9	178.1	-61.2	-32.7	0	0	0	112.1	D326 H378 R382	D326-D328 PolarHBondContact O-N 2.97Å; D326-D328 VanDerWaalsContact O-N 3.13Å; D326-D328 PolarHBondContact OD1-N 3.11Å; D328-H378 PolarHBondContact O-CD2 3.15Å; D328-H378 PolarHBondContact O-NE2 3.43Å; D328-R382 VanDerWaalsContact CB-CZ 3.42Å; D328-R382 VanDerWaalsContact CB-NH2 3.34Å; D328-R382 IonicContact OD2-NH2 3.58Å; D328-R382 PolarHBondContact OD2-NH2 2.76Å
329	M	96.8	Very high	96.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-72.8	141	162.1	-72.2	-173.6	171.9	0	0	110.2	I208 R209 D326 K327 E335 E338 N379 R382 L383	I208-M329 HydrophobicContact CD1-CB 3.43Å; I208-M329 VanDerWaalsContact CD1-CB 3.43Å; I208-M329 HydrophobicContact CD1-CG 4.47Å; I208-M329 HydrophobicContact CD1-SD 4.33Å; R209-M329 PolarHBondContact NH2-O 2.87Å; D326-M329 HydrophobicContact CB-CE 4.34Å; D326-M329 HydrophobicContact CB-CG 3.9Å; D326-M329 HydrophobicContact CB-SD 4.18Å; D326-M329 WeakPolarHBondContact O-CB 3.42Å; D326-M329 PolarHBondContact O-N 2.78Å; K327-M329 VanDerWaalsContact C-N 3.34Å; M329-E335 HydrophobicContact SD-CB 4.29Å; M329-E338 HydrophobicContact CE-CB 3.8Å; M329-E338 HydrophobicContact CE-CG 3.68Å; M329-N379 WeakPolarHBondContact CA-OD1 3.34Å; M329-N379 HydrophobicContact CB-CB 4.41Å; M329-N379 WeakPolarHBondContact CB-OD1 3.42Å; M329-N379 HydrophobicContact CE-CB 4.43Å; M329-N379 HydrophobicContact CG-CB 4.09Å; M329-N379 HydrophobicContact SD-CB 4.18Å; M329-R382 HydrophobicContact CE-CB 4.23Å; M329-L383 HydrophobicContact CE-CB 4.27Å
330	D	92.7	Very high	96.3	Very high	47 Å²	47	29.8 Å²	29.8	25%	0.251	14%	0.143	S	C	.	.			trans	-101.9	143.1	-173.9	-72	-38.4	0	0	0	112.3	R209 W332 A375 H378 N379	R209-D330 IonicContact CZ-OD1 3.6Å; R209-D330 IonicContact NH1-OD1 2.88Å; R209-D330 PolarHBondContact NH1-OD1 3.45Å; R209-D330 IonicContact NH2-OD1 3.64Å; R209-D330 PolarHBondContact NH2-OD1 3.12Å; D330-W332 PolarHBondContact O-N 3.14Å; D330-A375 HydrophobicContact CB-CB 3.71Å; D330-H378 IonicContact OD2-CD2 2.64Å; D330-H378 PolarHBondContact OD2-CD2 3Å; D330-H378 IonicContact OD2-NE2 3.03Å; D330-N379 PolarHBondContact N-OD1 2.83Å; D330-N379 PolarHBondContact O-ND2 3.39Å
331	F	90.3	Very high	96.3	Very high	52 Å²	52	26.6 Å²	26.6	23%	0.228	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	49.6	-87.3	173.8	-68.5	-71.6	0	0	0	115.2	R204 G206 L207 I208 I372 A375	R204-F331 HydrophobicContact CG-CE1 4.06Å; R204-F331 VanDerWaalsContact NH1-CD1 3.25Å; G206-F331 CarbonylContact C-O 3.55Å; G206-F331 WeakPolarHBondContact CA-O 3.45Å; L207-F331 PolarHBondContact N-O 3.39Å; I208-F331 PolarHBondContact N-O 3.19Å; F331-I372 HydrophobicContact CB-CD1 3.86Å; F331-I372 HydrophobicContact CD1-CD1 4.42Å; F331-I372 HydrophobicContact CG-CD1 4.04Å; F331-A375 HydrophobicContact CB-CB 4.08Å; F331-A375 HydrophobicContact CD2-CB 3.93Å
332	W	91.4	Very high	96.4	Very high	94 Å²	94	22.8 Å²	22.8	36%	0.356	11%	0.108	S	C	.	.	S	Bend	trans	-157.7	148.6	-172.1	177.4	78.7	0	0	0	111.1	D330 M376	D330-W332 PolarHBondContact O-N 3.14Å; W332-M376 HydrophobicContact CE3-CG 4.41Å; W332-M376 HydrophobicContact CE3-SD 4.18Å; W332-M376 HydrophobicContact CZ3-CE 4.07Å; W332-M376 HydrophobicContact CZ3-SD 3.85Å; W332-M376 WeakPolarHBondContact O-CG 3.45Å
333	G	89.6	Confident	96.4	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.01	11%	0.107	C	C	.	.	S	Bend	trans	111.6	135.7	167.3	0	0	0	0	0	112.1	E335 N379	G333-E335 WeakPolarHBondContact CA-OE2 3.48Å; G333-E335 PolarHBondContact N-OE2 3.01Å; G333-E335 PolarHBondContact O-N 3.05Å; G333-N379 VanDerWaalsContact O-CB 3.25Å; G333-N379 WeakPolarHBondContact O-CB 3.46Å; G333-N379 PolarHBondContact O-ND2 3.45Å
334	R	93.8	Very high	96.4	Very high	25 Å²	25	22.3 Å²	22.3	9%	0.094	10%	0.101	C	C	.	.	S	Bend	trans	71	-6	178.6	-47	-61.1	162.5	-148.5	8.2	115.4	L280 N336 L337 E338 N379 Y380 L383	L280-R334 PolarHBondContact O-NE 2.87Å; L280-R334 PolarHBondContact O-NH1 3.19Å; R334-N336 PolarHBondContact O-N 3.21Å; R334-L337 PolarHBondContact O-N 2.74Å; R334-E338 WeakPolarHBondContact O-CB 3.44Å; R334-E338 PolarHBondContact O-N 3.21Å; R334-N379 HydrophobicContact CB-CB 4.28Å; R334-Y380 HydrophobicContact CG-CD1 4.19Å; R334-Y380 HydrophobicContact CG-CD2 3.96Å; R334-Y380 HydrophobicContact CG-CE1 4.41Å; R334-Y380 HydrophobicContact CG-CE2 4.17Å; R334-Y380 HydrophobicContact CG-CG 3.96Å; R334-Y380 VanDerWaalsContact CZ-CZ 3.46Å; R334-Y380 PolarHBondContact NE-OH 3.27Å; R334-Y380 PolarHBondContact NH2-OH 3.47Å; R334-L383 HydrophobicContact CB-CD1 4.33Å
335	E	96.4	Very high	96.5	Very high	3 Å²	3	19.6 Å²	19.6	1%	0.014	9%	0.088	C	C	.	.	H	α-helix	trans	-60.7	-33.8	170.7	80.2	-67.9	167.8	0	0	111.6	I208 Y325 M329 G333 L339	I208-E335 HydrophobicContact CD1-CB 3.76Å; I208-E335 HydrophobicContact CD1-CG 4.36Å; I208-E335 HydrophobicContact CG1-CB 3.86Å; I208-E335 HydrophobicContact CG1-CG 3.98Å; Y325-E335 HydrophobicContact CD1-CB 3.89Å; Y325-E335 HydrophobicContact CD1-CG 4.28Å; Y325-E335 HydrophobicContact CE1-CB 3.79Å; Y325-E335 HydrophobicContact CE1-CG 3.73Å; M329-E335 HydrophobicContact SD-CB 4.29Å; G333-E335 WeakPolarHBondContact CA-OE2 3.48Å; G333-E335 PolarHBondContact N-OE2 3.01Å; G333-E335 PolarHBondContact O-N 3.05Å; E335-L339 VanDerWaalsContact O-CB 3.28Å; E335-L339 WeakPolarHBondContact O-CB 3.48Å; E335-L339 PolarHBondContact O-N 2.71Å
336	N	97.4	Very high	96.5	Very high	10 Å²	10	20.2 Å²	20.2	5%	0.053	9%	0.093	C	C	.	.	H	α-helix	trans	-65.3	-44.1	178.4	69.9	-53.8	0	0	0	111.6	M307 S308 R334 S340	M307-N336 PolarHBondContact O-ND2 2.7Å; S308-N336 VanDerWaalsContact O-CB 3.31Å; S308-N336 WeakPolarHBondContact O-CB 3.14Å; S308-N336 PolarHBondContact O-ND2 3.28Å; R334-N336 PolarHBondContact O-N 3.21Å; N336-S340 WeakPolarHBondContact O-CB 3.25Å; N336-S340 PolarHBondContact O-N 3.46Å; N336-S340 PolarHBondContact O-OG 3.46Å
337	L	98.1	Very high	96.5	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-72.6	-41.9	177.2	-63.7	-173.7	0	0	0	111.6	F276 L280 F282 A306 R334 L339 S340 L341 L383	F276-L337 HydrophobicContact CB-CD1 4.04Å; F276-L337 HydrophobicContact CB-CD2 3.97Å; F276-L337 HydrophobicContact CD1-CD2 3.92Å; F276-L337 HydrophobicContact CG-CD1 4.22Å; F276-L337 HydrophobicContact CG-CD2 4.09Å; L280-L337 HydrophobicContact CB-CD1 3.77Å; L280-L337 WeakPolarHBondContact O-CD1 3.34Å; F282-L337 HydrophobicContact CD2-CD2 4.37Å; A306-L337 HydrophobicContact CB-CD2 3.61Å; R334-L337 PolarHBondContact O-N 2.74Å; L337-L339 VanDerWaalsContact C-N 3.33Å; L337-L339 PolarHBondContact O-N 3.42Å; L337-S340 PolarHBondContact O-N 3.22Å; L337-L341 WeakPolarHBondContact O-CG 3.02Å; L337-L341 PolarHBondContact O-N 2.61Å; L337-L383 HydrophobicContact CB-CD1 3.67Å
338	E	98.6	Very high	96.6	Very high	1 Å²	1	18 Å²	18	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-57.2	-48.7	177.1	-171.7	-81.6	163.1	0	0	111.1	M329 R334 L341 R342 L383 W387 R413	M329-E338 HydrophobicContact CE-CB 3.8Å; M329-E338 HydrophobicContact CE-CG 3.68Å; R334-E338 WeakPolarHBondContact O-CB 3.44Å; R334-E338 PolarHBondContact O-N 3.21Å; E338-L341 PolarHBondContact O-N 3.43Å; E338-R342 WeakPolarHBondContact O-CB 3.14Å; E338-R342 PolarHBondContact O-N 2.71Å; E338-R342 IonicContact OE1-CZ 3.62Å; E338-R342 IonicContact OE1-NE 2.69Å; E338-R342 PolarHBondContact OE1-NE 3.45Å; E338-R342 IonicContact OE1-NH2 3.35Å; E338-R342 IonicContact OE2-CZ 3.77Å; E338-R342 IonicContact OE2-NE 3.18Å; E338-R342 IonicContact OE2-NH2 3.83Å; E338-R342 PolarHBondContact OE2-NH2 2.91Å; E338-L383 HydrophobicContact CB-CB 4.39Å; E338-L383 HydrophobicContact CB-CD1 3.93Å; E338-L383 HydrophobicContact CB-CG 4.13Å; E338-L383 VanDerWaalsContact N-CD1 3.34Å; E338-W387 PolarHBondContact OE1-NE1 3.33Å; E338-R413 IonicContact OE1-CZ 3.6Å; E338-R413 IonicContact OE1-NE 3.27Å; E338-R413 IonicContact OE1-NH2 3.6Å; E338-R413 PolarHBondContact OE1-NH2 3.13Å; E338-R413 IonicContact OE2-NH2 3.85Å
339	L	98.6	Very high	96.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-67.9	-37.8	179.1	-180	54.9	0	0	0	111.2	M307 F312 F319 I322 Y325 E335 L337 R342 I343	M307-L339 HydrophobicContact CE-CB 3.97Å; M307-L339 HydrophobicContact CE-CD2 3.46Å; M307-L339 VanDerWaalsContact CE-CD2 3.46Å; M307-L339 HydrophobicContact CE-CG 3.67Å; F312-L339 HydrophobicContact CE2-CD2 4.28Å; F312-L339 HydrophobicContact CZ-CD2 4.08Å; F319-L339 HydrophobicContact CE2-CD2 4.43Å; I322-L339 HydrophobicContact CD1-CD1 3.83Å; Y325-L339 HydrophobicContact CD1-CB 4.41Å; Y325-L339 HydrophobicContact CD1-CD2 4.2Å; Y325-L339 HydrophobicContact CE1-CB 4Å; Y325-L339 HydrophobicContact CE1-CD2 3.51Å; Y325-L339 HydrophobicContact CE1-CG 4.38Å; E335-L339 VanDerWaalsContact O-CB 3.28Å; E335-L339 WeakPolarHBondContact O-CB 3.48Å; E335-L339 PolarHBondContact O-N 2.71Å; L337-L339 VanDerWaalsContact C-N 3.33Å; L337-L339 PolarHBondContact O-N 3.42Å; L339-R342 PolarHBondContact O-N 3.1Å; L339-I343 HydrophobicContact CD1-CD1 3.9Å; L339-I343 HydrophobicContact CD1-CG1 3.93Å; L339-I343 HydrophobicContact CG-CD1 3.74Å; L339-I343 HydrophobicContact CG-CG1 4.3Å; L339-I343 WeakPolarHBondContact O-CB 3.34Å; L339-I343 WeakPolarHBondContact O-CD1 3.29Å; L339-I343 WeakPolarHBondContact O-CG1 3.45Å; L339-I343 PolarHBondContact O-N 2.88Å
340	S	98.8	Very high	96.7	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.6	-49.5	175.8	-60	0	0	0	0	112.3	A306 M307 N336 L337 R342 I343 W344	A306-S340 WeakPolarHBondContact CA-OG 3.43Å; M307-S340 WeakPolarHBondContact CG-OG 3.21Å; M307-S340 PolarHBondContact N-OG 3.2Å; N336-S340 WeakPolarHBondContact O-CB 3.25Å; N336-S340 PolarHBondContact O-N 3.46Å; N336-S340 PolarHBondContact O-OG 3.46Å; L337-S340 PolarHBondContact O-N 3.22Å; S340-R342 VanDerWaalsContact C-N 3.34Å; S340-R342 PolarHBondContact O-N 2.62Å; S340-I343 PolarHBondContact O-N 2.73Å; S340-W344 PolarHBondContact O-N 3.49Å
341	L	98.8	Very high	97	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-60	-47.1	177.5	-68.8	179.3	0	0	0	110.7	F276 L337 E338 I343 W344 M345 L383 W387 L388 F425 Y428	F276-L341 HydrophobicContact CE1-CD2 4.28Å; F276-L341 HydrophobicContact CZ-CD2 4.05Å; L337-L341 WeakPolarHBondContact O-CG 3.02Å; L337-L341 PolarHBondContact O-N 2.61Å; E338-L341 PolarHBondContact O-N 3.43Å; L341-I343 PolarHBondContact O-N 3.33Å; L341-W344 PolarHBondContact O-N 2.8Å; L341-M345 HydrophobicContact CB-SD 4.08Å; L341-M345 VanDerWaalsContact O-CB 3.24Å; L341-M345 WeakPolarHBondContact O-CB 3.38Å; L341-M345 WeakPolarHBondContact O-CG 2.97Å; L341-M345 PolarHBondContact O-N 2.84Å; L341-L383 HydrophobicContact CD1-CD2 3.87Å; L341-L383 HydrophobicContact CD1-CG 4.37Å; L341-W387 HydrophobicContact CB-CB 4.39Å; L341-W387 HydrophobicContact CB-CG 4.45Å; L341-W387 HydrophobicContact CD1-CB 3.82Å; L341-L388 HydrophobicContact CD1-CD2 3.96Å; L341-F425 HydrophobicContact CD1-CE2 4.26Å; L341-F425 HydrophobicContact CD2-CD2 4.33Å; L341-F425 HydrophobicContact CD2-CE2 3.7Å; L341-Y428 HydrophobicContact CD2-CD1 4.07Å; L341-Y428 HydrophobicContact CD2-CD2 4.09Å; L341-Y428 HydrophobicContact CD2-CE1 3.78Å; L341-Y428 HydrophobicContact CD2-CE2 3.78Å; L341-Y428 HydrophobicContact CD2-CG 4.24Å
342	R	98.6	Very high	97.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.4	-44.9	178.6	176.3	159.1	39.9	105.8	8.3	113	I322 G323 Q324 E338 L339 S340 W344 C346 W387 R413	I322-R342 WeakPolarHBondContact O-CD 3.37Å; I322-R342 PolarHBondContact O-NH1 2.96Å; G323-R342 PolarHBondContact O-NH1 3.11Å; Q324-R342 PolarHBondContact O-NH1 2.92Å; Q324-R342 PolarHBondContact O-NH2 2.98Å; E338-R342 WeakPolarHBondContact O-CB 3.14Å; E338-R342 PolarHBondContact O-N 2.71Å; E338-R342 IonicContact OE1-CZ 3.62Å; E338-R342 IonicContact OE1-NE 2.69Å; E338-R342 PolarHBondContact OE1-NE 3.45Å; E338-R342 IonicContact OE1-NH2 3.35Å; E338-R342 IonicContact OE2-CZ 3.77Å; E338-R342 IonicContact OE2-NE 3.18Å; E338-R342 IonicContact OE2-NH2 3.83Å; E338-R342 PolarHBondContact OE2-NH2 2.91Å; L339-R342 PolarHBondContact O-N 3.1Å; S340-R342 VanDerWaalsContact C-N 3.34Å; S340-R342 PolarHBondContact O-N 2.62Å; R342-W344 VanDerWaalsContact C-N 3.33Å; R342-W344 PolarHBondContact O-N 3.18Å; R342-C346 WeakPolarHBondContact O-CB 3.42Å; R342-C346 PolarHBondContact O-N 2.67Å; R342-C346 PolarHBondContact O-SG 2.87Å; R342-W387 HydrophobicContact CB-CH2 3.55Å; R342-W387 HydrophobicContact CB-CZ2 3.57Å; R342-W387 HydrophobicContact CB-CZ3 4.05Å; R342-W387 VanDerWaalsContact CD-CZ2 3.49Å; R342-W387 HydrophobicContact CG-CH2 3.51Å; R342-W387 HydrophobicContact CG-CZ2 3.75Å; R342-W387 HydrophobicContact CG-CZ3 4.32Å; R342-R413 VanDerWaalsContact NH2-NH2 3.14Å
343	I	98.8	Very high	97.6	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-54.8	-52.7	178.1	-73	158.5	0	0	0	109.6	V251 I322 L339 S340 L341 G348 L350	V251-I343 HydrophobicContact CB-CD1 3.84Å; V251-I343 HydrophobicContact CB-CG2 4.43Å; V251-I343 HydrophobicContact CG1-CD1 3.87Å; V251-I343 HydrophobicContact CG2-CD1 3.58Å; V251-I343 HydrophobicContact CG2-CG1 3.85Å; V251-I343 HydrophobicContact CG2-CG2 4.01Å; I322-I343 HydrophobicContact CD1-CG1 4.07Å; L339-I343 HydrophobicContact CD1-CD1 3.9Å; L339-I343 HydrophobicContact CD1-CG1 3.93Å; L339-I343 HydrophobicContact CG-CD1 3.74Å; L339-I343 HydrophobicContact CG-CG1 4.3Å; L339-I343 WeakPolarHBondContact O-CB 3.34Å; L339-I343 WeakPolarHBondContact O-CD1 3.29Å; L339-I343 WeakPolarHBondContact O-CG1 3.45Å; L339-I343 PolarHBondContact O-N 2.88Å; S340-I343 PolarHBondContact O-N 2.73Å; L341-I343 PolarHBondContact O-N 3.33Å; I343-G348 CarbonylContact O-C 3.6Å; I343-G348 WeakPolarHBondContact O-CA 3.12Å; I343-G348 PolarHBondContact O-N 3.49Å; I343-L350 HydrophobicContact CG2-CB 4.28Å
344	W	98.8	Very high	97.9	Very high	10 Å²	10	11.3 Å²	11.3	4%	0.038	7%	0.068	C	C	.	.	H	α-helix	trans	-66.5	-51.2	-178.6	-81.9	117.1	0	0	0	112.9	R303 S304 S340 L341 R342 C346 G347 Q349 L350 W427 Y428 V432	R303-W344 HydrophobicContact CG-CH2 3.61Å; R303-W344 HydrophobicContact CG-CZ2 3.58Å; S304-W344 PolarHBondContact O-NE1 2.9Å; S340-W344 PolarHBondContact O-N 3.49Å; L341-W344 PolarHBondContact O-N 2.8Å; R342-W344 VanDerWaalsContact C-N 3.33Å; R342-W344 PolarHBondContact O-N 3.18Å; W344-C346 PolarHBondContact O-N 2.87Å; W344-G347 PolarHBondContact O-N 2.78Å; W344-Q349 HydrophobicContact CH2-CB 4.07Å; W344-Q349 HydrophobicContact CZ3-CB 4.14Å; W344-Q349 HydrophobicContact CZ3-CG 4.37Å; W344-L350 HydrophobicContact CZ2-CB 4.06Å; W344-L350 WeakPolarHBondContact CZ2-O 3.34Å; W344-W427 WeakPolarHBondContact O-CZ3 3.45Å; W344-Y428 HydrophobicContact CB-CD2 3.78Å; W344-Y428 HydrophobicContact CB-CE2 3.87Å; W344-Y428 AromaticContact CD1-CE2 3.78Å; W344-Y428 HydrophobicContact CG-CD2 4.32Å; W344-Y428 AromaticContact CG-CE2 3.98Å; W344-Y428 HydrophobicContact CG-CE2 3.98Å; W344-V432 HydrophobicContact CB-CG2 4.11Å; W344-V432 HydrophobicContact CD2-CB 4.45Å; W344-V432 HydrophobicContact CD2-CG1 3.65Å; W344-V432 HydrophobicContact CD2-CG2 3.86Å; W344-V432 HydrophobicContact CE3-CG1 4.32Å; W344-V432 HydrophobicContact CE3-CG2 3.89Å; W344-V432 HydrophobicContact CG-CB 4.49Å; W344-V432 HydrophobicContact CG-CG1 3.74Å; W344-V432 HydrophobicContact CG-CG2 3.99Å; W344-V432 HydrophobicContact CZ2-CG1 4.27Å
345	M	98.8	Very high	98	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-69	-23.7	-173.7	-65.9	168.2	67.6	0	0	112	L341 W387 R417 C422 K423 F425 Y428	L341-M345 HydrophobicContact CB-SD 4.08Å; L341-M345 VanDerWaalsContact O-CB 3.24Å; L341-M345 WeakPolarHBondContact O-CB 3.38Å; L341-M345 WeakPolarHBondContact O-CG 2.97Å; L341-M345 PolarHBondContact O-N 2.84Å; M345-W387 HydrophobicContact CB-CZ3 4.35Å; M345-W387 HydrophobicContact CE-CE3 3.97Å; M345-W387 HydrophobicContact SD-CE3 3.85Å; M345-R417 VanDerWaalsContact CE-NH2 3.25Å; M345-C422 HydrophobicContact CB-CB 4.41Å; M345-C422 CarbonylContact O-C 3.13Å; M345-C422 WeakPolarHBondContact O-CA 3.34Å; M345-C422 WeakPolarHBondContact O-CB 3.45Å; M345-K423 WeakPolarHBondContact CE-O 2.84Å; M345-K423 PolarHBondContact O-N 2.77Å; M345-F425 HydrophobicContact CE-CB 4.33Å; M345-F425 HydrophobicContact SD-CD2 4.26Å; M345-Y428 HydrophobicContact CG-CD2 4.21Å; M345-Y428 HydrophobicContact CG-CG 4.42Å
346	C	98.7	Very high	98	Very high	17 Å²	17	10.1 Å²	10.1	12%	0.115	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	22	-178.8	-51.2	0	0	0	0	113.4	R342 W344 L420 C422	R342-C346 WeakPolarHBondContact O-CB 3.42Å; R342-C346 PolarHBondContact O-N 2.67Å; R342-C346 PolarHBondContact O-SG 2.87Å; W344-C346 PolarHBondContact O-N 2.87Å; C346-L420 HydrophobicContact CB-CB 4.35Å; C346-L420 HydrophobicContact CB-CD1 4.21Å; C346-C422 HydrophobicContact CB-CB 4.05Å; C346-C422 WeakPolarHBondContact CB-SG 3.16Å; C346-C422 WeakPolarHBondContact SG-CB 3.47Å; C346-C422 CovalentContact SG-SG 2.03Å; C346-C422 PolarHBondContact SG-SG 3.15Å
347	G	97.8	Very high	98	Very high	52 Å²	52	10.2 Å²	10.2	54%	0.536	6%	0.064	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	14.6	168.8	0	0	0	0	0	115.7	W344	W344-G347 PolarHBondContact O-N 2.78Å
348	G	98.4	Very high	98.1	Very high	3 Å²	3	10.1 Å²	10.1	3%	0.031	6%	0.063	C	C	.	.			trans	-92.8	-175	166.2	0	0	0	0	0	112.7	K249 Y318 I343	K249-G348 WeakPolarHBondContact O-CA 3.38Å; Y318-G348 WeakPolarHBondContact OH-CA 3.48Å; Y318-G348 PolarHBondContact OH-N 3.08Å; I343-G348 CarbonylContact O-C 3.6Å; I343-G348 WeakPolarHBondContact O-CA 3.12Å; I343-G348 PolarHBondContact O-N 3.49Å
349	Q	98.2	Very high	98	Very high	68 Å²	68	10.1 Å²	10.1	32%	0.318	6%	0.063	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.5	-180	-46.5	-176.8	51.7	0	0	110.4	D247 K249 M250 V251 W344 F351	D247-Q349 PolarHBondContact OD2-NE2 3.46Å; K249-Q349 PolarHBondContact O-N 2.84Å; M250-Q349 HydrophobicContact CG-CB 4.18Å; V251-Q349 PolarHBondContact N-O 2.87Å; W344-Q349 HydrophobicContact CH2-CB 4.07Å; W344-Q349 HydrophobicContact CZ3-CB 4.14Å; W344-Q349 HydrophobicContact CZ3-CG 4.37Å; Q349-F351 HydrophobicContact CB-CD2 4.05Å; Q349-F351 HydrophobicContact CB-CE2 3.46Å; Q349-F351 VanDerWaalsContact CB-CE2 3.46Å; Q349-F351 HydrophobicContact CB-CZ 4.36Å; Q349-F351 HydrophobicContact CG-CE2 4.33Å; Q349-F351 VanDerWaalsContact OE1-CE2 3.3Å
350	L	98.8	Very high	98	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.1	-179.9	-177.1	61.9	0	0	0	110.6	V251 S304 M307 I343 W344	V251-L350 HydrophobicContact CB-CD1 3.94Å; V251-L350 HydrophobicContact CG1-CD1 3.85Å; V251-L350 WeakPolarHBondContact O-CA 3.29Å; S304-L350 PolarHBondContact N-O 3.22Å; M307-L350 HydrophobicContact CB-CD1 4.29Å; M307-L350 HydrophobicContact CB-CD2 4.04Å; M307-L350 HydrophobicContact CG-CD1 4.47Å; M307-L350 HydrophobicContact CG-CD2 4.18Å; M307-L350 HydrophobicContact SD-CD1 4.28Å; I343-L350 HydrophobicContact CG2-CB 4.28Å; W344-L350 HydrophobicContact CZ2-CB 4.06Å; W344-L350 WeakPolarHBondContact CZ2-O 3.34Å
351	F	98.4	Very high	98	Very high	30 Å²	30	12 Å²	12	13%	0.132	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148	-178.5	-67.4	-86.2	0	0	0	112.7	M250 V251 V252 C253 P301 I302 R303 Q349 I353	M250-F351 HydrophobicContact CG-CD2 4.08Å; M250-F351 HydrophobicContact CG-CE2 4.13Å; M250-F351 HydrophobicContact SD-CD2 3.85Å; M250-F351 HydrophobicContact SD-CE2 3.95Å; V251-F351 PolarHBondContact O-N 3.46Å; V252-F351 CarbonylContact C-O 3.4Å; V252-F351 VanDerWaalsContact CA-O 3.29Å; V252-F351 WeakPolarHBondContact CA-O 3.46Å; V252-F351 HydrophobicContact CG1-CB 4.4Å; C253-F351 PolarHBondContact N-O 3Å; P301-F351 HydrophobicContact CB-CB 4.31Å; P301-F351 HydrophobicContact CB-CD1 3.91Å; P301-F351 HydrophobicContact CB-CG 4.27Å; I302-F351 CarbonylContact O-C 3.48Å; I302-F351 WeakPolarHBondContact O-CA 3.21Å; I302-F351 WeakPolarHBondContact O-CD1 3.09Å; R303-F351 HydrophobicContact CB-CD1 4.21Å; R303-F351 HydrophobicContact CB-CE1 3.88Å; R303-F351 HydrophobicContact CG-CE1 4.15Å; Q349-F351 HydrophobicContact CB-CD2 4.05Å; Q349-F351 HydrophobicContact CB-CE2 3.46Å; Q349-F351 VanDerWaalsContact CB-CE2 3.46Å; Q349-F351 HydrophobicContact CB-CZ 4.36Å; Q349-F351 HydrophobicContact CG-CE2 4.33Å; Q349-F351 VanDerWaalsContact OE1-CE2 3.3Å; F351-I353 HydrophobicContact CB-CD1 4.21Å
352	I	98.3	Very high	97.6	Very high	5 Å²	5	14.6 Å²	14.6	3%	0.026	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.7	160.2	-65	164.8	0	0	0	107.2	C253 L255 V272 W284 I302 P354	C253-I352 HydrophobicContact CB-CG1 4.11Å; C253-I352 CarbonylContact O-C 3.57Å; C253-I352 WeakPolarHBondContact O-CA 3.43Å; L255-I352 HydrophobicContact CB-CG2 4.09Å; V272-I352 VanDerWaalsContact O-CD1 3.25Å; V272-I352 WeakPolarHBondContact O-CD1 3.28Å; W284-I352 HydrophobicContact CZ3-CD1 3.96Å; I302-I352 HydrophobicContact CB-CB 4.29Å; I302-I352 PolarHBondContact N-O 3.04Å; I302-I352 PolarHBondContact O-N 3.44Å; I352-P354 VanDerWaalsContact O-CD 3.31Å; I352-P354 WeakPolarHBondContact O-CD 3.41Å
353	I	97.1	Very high	97.2	Very high	8 Å²	8	17.2 Å²	17.2	4%	0.041	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	100	179	-54.5	-59	0	0	0	107.5	P239 L240 A243 V252 C253 P301 F351 C355 S356	P239-I353 HydrophobicContact CB-CG2 3.67Å; L240-I353 HydrophobicContact CD2-CB 3.89Å; L240-I353 HydrophobicContact CD2-CG1 3.88Å; A243-I353 HydrophobicContact CB-CD1 4.11Å; V252-I353 HydrophobicContact CB-CD1 4.38Å; V252-I353 HydrophobicContact CB-CG1 3.79Å; V252-I353 HydrophobicContact CG1-CD1 4Å; V252-I353 HydrophobicContact CG1-CG1 3.97Å; C253-I353 PolarHBondContact O-N 3.07Å; P301-I353 HydrophobicContact CB-CD1 3.78Å; P301-I353 HydrophobicContact CG-CD1 3.96Å; F351-I353 HydrophobicContact CB-CD1 4.21Å; I353-C355 HydrophobicContact CG2-CB 4.01Å; I353-C355 PolarHBondContact O-N 2.89Å; I353-S356 PolarHBondContact O-N 2.79Å; I353-S356 VanDerWaalsContact O-O 3.06Å
354	P	95.1	Very high	96.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	-23.1	-177.6	-25.7	35.4	0	0	0	113	R124 L271 S298 K300 I302 I352 S356	R124-P354 PolarHBondContact NH1-O 2.95Å; R124-P354 PolarHBondContact NH2-O 3.21Å; L271-P354 HydrophobicContact CD2-CB 3.9Å; L271-P354 HydrophobicContact CD2-CG 4.21Å; S298-P354 VanDerWaalsContact O-CB 3.3Å; S298-P354 WeakPolarHBondContact O-CB 3.34Å; K300-P354 VanDerWaalsContact O-CD 3.27Å; K300-P354 WeakPolarHBondContact O-CD 3.33Å; K300-P354 VanDerWaalsContact O-CG 3.32Å; K300-P354 WeakPolarHBondContact O-CG 3.21Å; I302-P354 HydrophobicContact CD1-CG 3.62Å; I302-P354 HydrophobicContact CG1-CG 3.98Å; I352-P354 VanDerWaalsContact O-CD 3.31Å; I352-P354 WeakPolarHBondContact O-CD 3.41Å; P354-S356 VanDerWaalsContact C-N 3.31Å
355	C	95.1	Very high	95	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.02	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	-27.8	179.7	-60.7	0	0	0	0	114.7	R124 Y129 P239 T299 I353	R124-C355 VanDerWaalsContact CD-CB 3.44Å; R124-C355 WeakPolarHBondContact CD-SG 3.3Å; R124-C355 VanDerWaalsContact CZ-O 3.29Å; R124-C355 PolarHBondContact NE-O 3.17Å; R124-C355 PolarHBondContact NH2-O 2.9Å; Y129-C355 WeakPolarHBondContact OH-CB 3.16Å; P239-C355 HydrophobicContact CB-CB 3.74Å; P239-C355 HydrophobicContact CG-CB 3.89Å; T299-C355 PolarHBondContact O-SG 3.46Å; I353-C355 HydrophobicContact CG2-CB 4.01Å; I353-C355 PolarHBondContact O-N 2.89Å
356	S	97.4	Very high	93.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.5	173.6	179	0	0	0	0	109	W236 P254 L255 I353 P354	W236-S356 WeakPolarHBondContact O-CB 3.13Å; W236-S356 PolarHBondContact O-OG 3.09Å; P254-S356 VanDerWaalsContact CB-OG 3.3Å; P254-S356 WeakPolarHBondContact CB-OG 3.13Å; L255-S356 PolarHBondContact N-O 3.42Å; I353-S356 PolarHBondContact O-N 2.79Å; I353-S356 VanDerWaalsContact O-O 3.06Å; P354-S356 VanDerWaalsContact C-N 3.31Å
357	R	97.8	Very high	91.5	Very high	13 Å²	13	35.5 Å²	35.5	5%	0.049	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.7	177.3	-62.7	-171.8	88.8	102.8	-11.3	110.7	T119 R120 N233 L255 D257 S269	T119-R357 WeakPolarHBondContact O-CD 3.45Å; T119-R357 PolarHBondContact O-NE 2.92Å; T119-R357 WeakPolarHBondContact OG1-CD 3.43Å; T119-R357 PolarHBondContact OG1-NE 2.85Å; R120-R357 HydrophobicContact CG-CG 4.46Å; N233-R357 HydrophobicContact CB-CB 4.08Å; N233-R357 VanDerWaalsContact CB-O 3.3Å; N233-R357 WeakPolarHBondContact CB-O 3.46Å; N233-R357 PolarHBondContact N-O 3.28Å; L255-R357 VanDerWaalsContact CD2-CZ 3.43Å; L255-R357 WeakPolarHBondContact O-CA 3.47Å; D257-R357 VanDerWaalsContact CG-NE 3.33Å; D257-R357 IonicContact OD1-CZ 2.77Å; D257-R357 IonicContact OD1-NE 3.2Å; D257-R357 PolarHBondContact OD1-NE 3.41Å; D257-R357 IonicContact OD1-NH2 3.93Å; D257-R357 PolarHBondContact OD1-NH2 3.47Å; D257-R357 IonicContact OD2-CZ 3.59Å; D257-R357 IonicContact OD2-NE 3.67Å; D257-R357 PolarHBondContact OD2-NE 2.8Å; D257-R357 IonicContact OD2-NH2 3.84Å; S269-R357 VanDerWaalsContact N-NH2 3.14Å; S269-R357 PolarHBondContact O-NH2 2.64Å
358	V	98.6	Very high	90.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	123.5	177.2	-179.4	0	0	0	0	107.6	L226 C230 V232 W236 P254 L255 I256 D257 I311	L226-V358 HydrophobicContact CD2-CG1 3.91Å; C230-V358 HydrophobicContact CB-CG1 3.79Å; V232-V358 HydrophobicContact CB-CG2 4.44Å; V232-V358 HydrophobicContact CG1-CG1 4.11Å; V232-V358 HydrophobicContact CG1-CG2 4.09Å; W236-V358 HydrophobicContact CD2-CG2 4.35Å; W236-V358 HydrophobicContact CE3-CG2 3.58Å; W236-V358 HydrophobicContact CZ3-CG2 4.15Å; P254-V358 HydrophobicContact CB-CB 4.4Å; P254-V358 HydrophobicContact CB-CG2 3.85Å; P254-V358 HydrophobicContact CG-CB 4.2Å; P254-V358 HydrophobicContact CG-CG2 3.81Å; L255-V358 PolarHBondContact O-N 2.81Å; I256-V358 CarbonylContact C-O 3.53Å; I256-V358 WeakPolarHBondContact CA-O 3.23Å; D257-V358 PolarHBondContact N-O 3.19Å; I311-V358 HydrophobicContact CD1-CB 4.21Å; I311-V358 HydrophobicContact CD1-CG1 3.79Å
359	G	98.4	Very high	89.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.8	171.3	0	0	0	0	0	110.4	C230 E231 D257 Y266	C230-G359 CarbonylContact C-O 3.53Å; C230-G359 WeakPolarHBondContact CA-O 3.25Å; C230-G359 WeakPolarHBondContact CB-O 3.39Å; E231-G359 PolarHBondContact N-O 2.86Å; E231-G359 PolarHBondContact O-N 3.46Å; D257-G359 WeakPolarHBondContact O-CA 3.4Å; Y266-G359 VanDerWaalsContact CE2-CA 3.4Å; Y266-G359 PolarHBondContact OH-N 3.06Å
360	H	98.3	Very high	88.8	Confident	38 Å²	38	41.4 Å²	41.4	18%	0.176	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.9	177.6	-178.6	-90.1	0	0	0	109.7	D227 H229 I256 D257 I259 I311 S362	D227-H360 IonicContact OD2-CD2 3.59Å; D227-H360 IonicContact OD2-CE1 2.79Å; D227-H360 IonicContact OD2-NE2 2.81Å; D227-H360 PolarHBondContact OD2-NE2 2.65Å; H229-H360 AromaticContact CD2-CD2 3.99Å; H229-H360 AromaticContact CD2-CE1 3.74Å; H229-H360 AromaticContact CD2-NE2 3.47Å; H229-H360 PolarHBondContact CD2-NE2 3.25Å; H229-H360 AromaticContact NE2-CE1 3.55Å; H229-H360 AromaticContact NE2-NE2 3.24Å; H229-H360 PolarHBondContact NE2-NE2 2.82Å; I256-H360 HydrophobicContact CG2-CB 3.59Å; D257-H360 PolarHBondContact O-N 3.41Å; I259-H360 PolarHBondContact N-O 3.04Å; I311-H360 HydrophobicContact CD1-CB 4.44Å; H360-S362 PolarHBondContact O-N 2.79Å
361	I	97.5	Very high	88.1	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	116.3	176	-57.7	-177.6	0	0	0	108.8	F102 A149 H229 I259 K363	F102-I361 HydrophobicContact CB-CG2 3.79Å; F102-I361 HydrophobicContact CD1-CG2 4.13Å; F102-I361 HydrophobicContact CD2-CD1 4.43Å; F102-I361 HydrophobicContact CD2-CG2 4.47Å; F102-I361 HydrophobicContact CE2-CD1 4.28Å; F102-I361 HydrophobicContact CG-CG2 3.9Å; F102-I361 HydrophobicContact CZ-CD1 4.41Å; A149-I361 HydrophobicContact CB-CD1 4.27Å; H229-I361 HydrophobicContact CB-CB 4.21Å; H229-I361 HydrophobicContact CB-CD1 4.01Å; H229-I361 HydrophobicContact CB-CG1 4.2Å; H229-I361 PolarHBondContact O-N 3.03Å; H229-I361 VanDerWaalsContact O-N 3.07Å; I259-I361 HydrophobicContact CB-CG1 3.97Å; I259-I361 HydrophobicContact CD1-CG1 4.17Å; I259-I361 HydrophobicContact CG2-CG1 3.88Å; I259-I361 WeakPolarHBondContact O-CA 3.38Å; I361-K363 HydrophobicContact CG2-CG 4.09Å; I361-K363 PolarHBondContact O-N 3.49Å
362	S	91.9	Very high	87.5	Confident	55 Å²	55	44.7 Å²	44.7	39%	0.385	26%	0.26	S	S	.	.			trans	-78.4	65.9	-177.8	-70.7	0	0	0	0	111.6	I259 D261 H360 K364	I259-S362 PolarHBondContact O-N 2.9Å; I259-S362 VanDerWaalsContact O-N 3.07Å; D261-S362 WeakPolarHBondContact CB-O 3.31Å; H360-S362 PolarHBondContact O-N 2.79Å; S362-K364 PolarHBondContact O-N 2.77Å
363	K	90	Very high	87.1	Confident	56 Å²	56	48.7 Å²	48.7	24%	0.243	28%	0.28	C	S	.	.			trans	-52.2	129.5	-174.7	-68.1	-176.9	172.6	-176.6	0	112	Y100 G101 F102 E145 H229 I361 Q365	Y100-K363 WeakPolarHBondContact O-CD 3.41Å; G101-K363 CarbonylContact O-C 3.5Å; G101-K363 WeakPolarHBondContact O-CA 3.41Å; F102-K363 HydrophobicContact CD1-CD 4.38Å; F102-K363 HydrophobicContact CD1-CG 4.07Å; E145-K363 IonicContact OE1-NZ 3.33Å; E145-K363 PolarHBondContact OE1-NZ 2.98Å; E145-K363 IonicContact OE2-NZ 2.64Å; E145-K363 PolarHBondContact OE2-NZ 2.88Å; H229-K363 PolarHBondContact CE1-NZ 3.37Å; H229-K363 VanDerWaalsContact CG-CE 3.44Å; H229-K363 WeakPolarHBondContact ND1-CE 3.31Å; H229-K363 PolarHBondContact ND1-NZ 2.9Å; H229-K363 VanDerWaalsContact ND1-NZ 3.11Å; I361-K363 HydrophobicContact CG2-CG 4.09Å; I361-K363 PolarHBondContact O-N 3.49Å; K363-Q365 PolarHBondContact O-N 3.5Å
364	K	82.1	Confident	86.7	Confident	132 Å²	132	52.2 Å²	52.2	57%	0.574	31%	0.305	S	S	*	.			trans	-71.1	112.9	169.9	-163	174.2	-174.6	-176.8	0	109	G101 S362 T366	G101-K364 WeakPolarHBondContact CA-O 3.5Å; G101-K364 PolarHBondContact O-N 3.32Å; S362-K364 PolarHBondContact O-N 2.77Å; K364-T366 PolarHBondContact O-N 2.77Å
365	Q	68.6	Low	86.6	Confident	132 Å²	132	52.3 Å²	52.3	62%	0.617	31%	0.307	S	S	*	.			trans	-69.2	117.3	175.4	-68.6	-177.4	29.4	0	0	109.4	K363	K363-Q365 PolarHBondContact O-N 3.5Å
366	T	61.1	Low	86.4	Confident	70 Å²	70	53.1 Å²	53.1	43%	0.429	31%	0.31	S	S	.	.			trans	-75.9	151.7	157.6	52.1	0	0	0	0	108.3	L98 K364 K368	L98-T366 HydrophobicContact CB-CG2 4.32Å; L98-T366 HydrophobicContact CD2-CG2 3.54Å; L98-T366 WeakPolarHBondContact O-CG2 3.24Å; L98-T366 PolarHBondContact O-OG1 2.92Å; K364-T366 PolarHBondContact O-N 2.77Å; T366-K368 PolarHBondContact O-N 3.5Å
367	G	62.8	Low	86.2	Confident	77 Å²	77	54.8 Å²	54.8	79%	0.794	32%	0.321	S	S	*	.			trans	-42.9	137.6	-167.2	0	0	0	0	0	114.4
368	K	74.6	Confident	86.2	Confident	74 Å²	74	55.9 Å²	55.9	32%	0.322	33%	0.326	S	S	.	.			trans	-71.1	129.7	-176.6	-68.3	-179.7	-179.9	176.3	0	110.5	T366 I372 I373 M376	T366-K368 PolarHBondContact O-N 3.5Å; K368-I372 HydrophobicContact CB-CG2 4.5Å; K368-I372 HydrophobicContact CD-CG2 4.33Å; K368-I373 HydrophobicContact CB-CD1 4.42Å; K368-I373 HydrophobicContact CB-CG1 4.02Å; K368-M376 HydrophobicContact CD-SD 4Å
369	P	80.6	Confident	86.1	Confident	79 Å²	79	55.9 Å²	55.9	51%	0.513	33%	0.326	S	S	.	.			trans	-55	148.2	171	-24.5	33.5	0	0	0	111.4	T371 I372 I373	P369-T371 PolarHBondContact O-N 3.03Å; P369-T371 VanDerWaalsContact O-N 3.14Å; P369-I372 HydrophobicContact CB-CG1 4.38Å; P369-I372 HydrophobicContact CG-CG1 4.36Å; P369-I372 WeakPolarHBondContact O-CB 3.26Å; P369-I372 PolarHBondContact O-N 3.07Å; P369-I373 PolarHBondContact O-N 3.33Å
370	S	82.4	Confident	85.9	Confident	94 Å²	94	56.5 Å²	56.5	66%	0.657	33%	0.329	S	S	*	.	H	α-helix	trans	-54.6	-34.2	179.3	55.7	0	0	0	0	113	I372 I373 S374	S370-I372 VanDerWaalsContact C-N 3.35Å; S370-I372 PolarHBondContact O-N 3.47Å; S370-I373 PolarHBondContact O-N 2.89Å; S370-S374 PolarHBondContact O-N 3.42Å
371	T	85	Confident	85.8	Confident	79 Å²	79	54.7 Å²	54.7	49%	0.485	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-40.3	175.4	53	0	0	0	0	112.5	P369 A375	P369-T371 PolarHBondContact O-N 3.03Å; P369-T371 VanDerWaalsContact O-N 3.14Å; T371-A375 WeakPolarHBondContact O-CB 3.5Å; T371-A375 PolarHBondContact O-N 2.89Å
372	I	85.9	Confident	85.8	Confident	20 Å²	20	54.8 Å²	54.8	10%	0.103	32%	0.32	C	S	.	.	H	α-helix	trans	-70.1	-38.4	176.2	-59.3	-59.5	0	0	0	110.5	F331 K368 P369 S370 A375 M376	F331-I372 HydrophobicContact CB-CD1 3.86Å; F331-I372 HydrophobicContact CD1-CD1 4.42Å; F331-I372 HydrophobicContact CG-CD1 4.04Å; K368-I372 HydrophobicContact CB-CG2 4.5Å; K368-I372 HydrophobicContact CD-CG2 4.33Å; P369-I372 HydrophobicContact CB-CG1 4.38Å; P369-I372 HydrophobicContact CG-CG1 4.36Å; P369-I372 WeakPolarHBondContact O-CB 3.26Å; P369-I372 PolarHBondContact O-N 3.07Å; S370-I372 VanDerWaalsContact C-N 3.35Å; S370-I372 PolarHBondContact O-N 3.47Å; I372-A375 PolarHBondContact O-N 3.02Å; I372-M376 HydrophobicContact CG2-CG 4.39Å; I372-M376 HydrophobicContact CG2-SD 4.28Å; I372-M376 WeakPolarHBondContact O-CB 3.45Å; I372-M376 VanDerWaalsContact O-CG 3.24Å; I372-M376 WeakPolarHBondContact O-CG 3.46Å; I372-M376 PolarHBondContact O-N 2.91Å
373	I	88	Confident	86.1	Confident	90 Å²	90	52.2 Å²	52.2	46%	0.462	30%	0.302	S	S	.	.	H	α-helix	trans	-64.2	-43	176.8	-61.9	172.7	0	0	0	111.1	K368 P369 S370 M376 T377	K368-I373 HydrophobicContact CB-CD1 4.42Å; K368-I373 HydrophobicContact CB-CG1 4.02Å; P369-I373 PolarHBondContact O-N 3.33Å; S370-I373 PolarHBondContact O-N 2.89Å; I373-M376 PolarHBondContact O-N 3Å; I373-T377 PolarHBondContact O-N 2.99Å; I373-T377 PolarHBondContact O-OG1 3.42Å
374	S	90.4	Very high	86.5	Confident	81 Å²	81	49.5 Å²	49.5	57%	0.566	29%	0.291	S	S	*	.	H	α-helix	trans	-63.7	-46.2	175.6	176.7	0	0	0	0	111.4	S370 M376 T377 H378	S370-S374 PolarHBondContact O-N 3.42Å; S374-M376 PolarHBondContact O-N 3.15Å; S374-T377 WeakPolarHBondContact O-CB 3.45Å; S374-T377 PolarHBondContact O-N 3.21Å; S374-T377 VanDerWaalsContact O-N 3.13Å; S374-H378 PolarHBondContact O-N 2.85Å
375	A	91.7	Very high	87.3	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.033	27%	0.273	C	S	.	.	H	α-helix	trans	-58.9	-45.6	175.7	0	0	0	0	0	112.2	D330 F331 T371 I372 T377 H378 N379	D330-A375 HydrophobicContact CB-CB 3.71Å; F331-A375 HydrophobicContact CB-CB 4.08Å; F331-A375 HydrophobicContact CD2-CB 3.93Å; T371-A375 WeakPolarHBondContact O-CB 3.5Å; T371-A375 PolarHBondContact O-N 2.89Å; I372-A375 PolarHBondContact O-N 3.02Å; A375-T377 VanDerWaalsContact C-N 3.31Å; A375-T377 PolarHBondContact O-N 3.28Å; A375-H378 PolarHBondContact O-N 3.13Å; A375-N379 PolarHBondContact O-N 3.17Å; A375-N379 PolarHBondContact O-ND2 3.06Å; A375-N379 PolarHBondContact O-OD1 3.19Å
376	M	91.6	Very high	88.7	Confident	20 Å²	20	39.4 Å²	39.4	10%	0.099	25%	0.245	C	C	.	.	H	α-helix	trans	-58.8	-42.8	175.3	-74.2	-179.6	70.4	0	0	111.5	W332 K368 I372 I373 S374 N379 Y380	W332-M376 HydrophobicContact CE3-CG 4.41Å; W332-M376 HydrophobicContact CE3-SD 4.18Å; W332-M376 HydrophobicContact CZ3-CE 4.07Å; W332-M376 HydrophobicContact CZ3-SD 3.85Å; W332-M376 WeakPolarHBondContact O-CG 3.45Å; K368-M376 HydrophobicContact CD-SD 4Å; I372-M376 HydrophobicContact CG2-CG 4.39Å; I372-M376 HydrophobicContact CG2-SD 4.28Å; I372-M376 WeakPolarHBondContact O-CB 3.45Å; I372-M376 VanDerWaalsContact O-CG 3.24Å; I372-M376 WeakPolarHBondContact O-CG 3.46Å; I372-M376 PolarHBondContact O-N 2.91Å; I373-M376 PolarHBondContact O-N 3Å; S374-M376 PolarHBondContact O-N 3.15Å; M376-N379 PolarHBondContact O-N 3.12Å; M376-Y380 WeakPolarHBondContact O-CB 3.31Å; M376-Y380 WeakPolarHBondContact O-CD2 3.38Å; M376-Y380 PolarHBondContact O-N 3.18Å
377	T	94.1	Very high	90.5	Very high	35 Å²	35	36.1 Å²	36.1	22%	0.215	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-43.8	177.6	-60.4	0	0	0	0	112.1	I373 S374 A375 Y380 L381 L402 V405	I373-T377 PolarHBondContact O-N 2.99Å; I373-T377 PolarHBondContact O-OG1 3.42Å; S374-T377 WeakPolarHBondContact O-CB 3.45Å; S374-T377 PolarHBondContact O-N 3.21Å; S374-T377 VanDerWaalsContact O-N 3.13Å; A375-T377 VanDerWaalsContact C-N 3.31Å; A375-T377 PolarHBondContact O-N 3.28Å; T377-Y380 VanDerWaalsContact O-CB 3.28Å; T377-Y380 WeakPolarHBondContact O-CB 3.3Å; T377-Y380 PolarHBondContact O-N 3.02Å; T377-L381 HydrophobicContact CG2-CD1 4.36Å; T377-L381 WeakPolarHBondContact O-CG 3.28Å; T377-L381 PolarHBondContact O-N 3.42Å; T377-L402 HydrophobicContact CG2-CD1 4.3Å; T377-L402 HydrophobicContact CG2-CD2 3.57Å; T377-V405 HydrophobicContact CG2-CG1 4.4Å
378	H	96.2	Very high	92.1	Very high	36 Å²	36	32.4 Å²	32.4	17%	0.167	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-49.5	174.3	175.5	73.3	0	0	0	111.3	D328 D330 S374 A375 Y380 L381 R382 Y407	D328-H378 PolarHBondContact O-CD2 3.15Å; D328-H378 PolarHBondContact O-NE2 3.43Å; D330-H378 IonicContact OD2-CD2 2.64Å; D330-H378 PolarHBondContact OD2-CD2 3Å; D330-H378 IonicContact OD2-NE2 3.03Å; S374-H378 PolarHBondContact O-N 2.85Å; A375-H378 PolarHBondContact O-N 3.13Å; H378-Y380 VanDerWaalsContact C-N 3.32Å; H378-Y380 PolarHBondContact O-N 3.22Å; H378-L381 PolarHBondContact O-N 3.47Å; H378-R382 WeakPolarHBondContact NE2-CD 3.36Å; H378-R382 WeakPolarHBondContact O-CG 3.42Å; H378-R382 PolarHBondContact O-N 3.01Å; H378-R382 VanDerWaalsContact O-N 3.09Å; H378-Y407 PolarHBondContact CE1-O 3.15Å; H378-Y407 VanDerWaalsContact CE1-O 3.32Å
379	N	96.9	Very high	93.3	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-39.5	179.5	-60.2	-7.2	0	0	0	112.4	M329 D330 G333 R334 A375 M376 L381 R382 L383	M329-N379 WeakPolarHBondContact CA-OD1 3.34Å; M329-N379 HydrophobicContact CB-CB 4.41Å; M329-N379 WeakPolarHBondContact CB-OD1 3.42Å; M329-N379 HydrophobicContact CE-CB 4.43Å; M329-N379 HydrophobicContact CG-CB 4.09Å; M329-N379 HydrophobicContact SD-CB 4.18Å; D330-N379 PolarHBondContact N-OD1 2.83Å; D330-N379 PolarHBondContact O-ND2 3.39Å; G333-N379 VanDerWaalsContact O-CB 3.25Å; G333-N379 WeakPolarHBondContact O-CB 3.46Å; G333-N379 PolarHBondContact O-ND2 3.45Å; R334-N379 HydrophobicContact CB-CB 4.28Å; A375-N379 PolarHBondContact O-N 3.17Å; A375-N379 PolarHBondContact O-ND2 3.06Å; A375-N379 PolarHBondContact O-OD1 3.19Å; M376-N379 PolarHBondContact O-N 3.12Å; N379-L381 VanDerWaalsContact C-N 3.34Å; N379-L381 PolarHBondContact O-N 3.13Å; N379-R382 PolarHBondContact O-N 3Å; N379-L383 PolarHBondContact O-N 3.22Å
380	Y	93.4	Very high	94	Very high	13 Å²	13	32.9 Å²	32.9	5%	0.051	19%	0.185	C	C	.	.	H	α-helix	trans	-51.1	-54.6	172.8	-104	-69	0	0	0	111.2	N279 L280 R334 M376 T377 H378 R382 L383 V384 F395 K399	N279-Y380 WeakPolarHBondContact O-CE1 3.11Å; N279-Y380 VanDerWaalsContact O-CZ 3.27Å; N279-Y380 PolarHBondContact O-OH 3.22Å; L280-Y380 HydrophobicContact CB-CD1 4.32Å; L280-Y380 HydrophobicContact CB-CE1 3.63Å; L280-Y380 HydrophobicContact CD1-CD1 3.83Å; L280-Y380 HydrophobicContact CD1-CE1 3.93Å; L280-Y380 HydrophobicContact CG-CD1 4.49Å; L280-Y380 HydrophobicContact CG-CE1 4.1Å; R334-Y380 HydrophobicContact CG-CD1 4.19Å; R334-Y380 HydrophobicContact CG-CD2 3.96Å; R334-Y380 HydrophobicContact CG-CE1 4.41Å; R334-Y380 HydrophobicContact CG-CE2 4.17Å; R334-Y380 HydrophobicContact CG-CG 3.96Å; R334-Y380 VanDerWaalsContact CZ-CZ 3.46Å; R334-Y380 PolarHBondContact NE-OH 3.27Å; R334-Y380 PolarHBondContact NH2-OH 3.47Å; M376-Y380 WeakPolarHBondContact O-CB 3.31Å; M376-Y380 WeakPolarHBondContact O-CD2 3.38Å; M376-Y380 PolarHBondContact O-N 3.18Å; T377-Y380 VanDerWaalsContact O-CB 3.28Å; T377-Y380 WeakPolarHBondContact O-CB 3.3Å; T377-Y380 PolarHBondContact O-N 3.02Å; H378-Y380 VanDerWaalsContact C-N 3.32Å; H378-Y380 PolarHBondContact O-N 3.22Å; Y380-R382 VanDerWaalsContact C-N 3.35Å; Y380-R382 PolarHBondContact O-N 3.14Å; Y380-L383 PolarHBondContact O-N 3.17Å; Y380-V384 WeakPolarHBondContact O-CB 3.38Å; Y380-V384 WeakPolarHBondContact O-CG2 3.26Å; Y380-V384 PolarHBondContact O-N 3.41Å; Y380-F395 AromaticContact CD1-CE2 3.44Å; Y380-F395 HydrophobicContact CD1-CE2 3.44Å; Y380-F395 VanDerWaalsContact CD1-CE2 3.44Å; Y380-F395 AromaticContact CD1-CZ 3.61Å; Y380-F395 HydrophobicContact CD1-CZ 3.61Å; Y380-F395 HydrophobicContact CE1-CD2 4.5Å; Y380-F395 AromaticContact CE1-CE2 3.49Å; Y380-F395 HydrophobicContact CE1-CE2 3.49Å; Y380-F395 VanDerWaalsContact CE1-CE2 3.49Å; Y380-F395 HydrophobicContact CE1-CZ 4.08Å; Y380-F395 HydrophobicContact CG-CE2 4.36Å; Y380-F395 HydrophobicContact CG-CZ 4.13Å; Y380-K399 VanDerWaalsContact CZ-NZ 3.29Å; Y380-K399 PolarHBondContact OH-NZ 3.41Å
381	L	97.3	Very high	94.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.8	-38.2	-174.1	-68.8	168.5	0	0	0	111.5	T377 H378 N379 L383 V384 H385 F395 F396 L402 V405 Y407	T377-L381 HydrophobicContact CG2-CD1 4.36Å; T377-L381 WeakPolarHBondContact O-CG 3.28Å; T377-L381 PolarHBondContact O-N 3.42Å; H378-L381 PolarHBondContact O-N 3.47Å; N379-L381 VanDerWaalsContact C-N 3.34Å; N379-L381 PolarHBondContact O-N 3.13Å; L381-L383 PolarHBondContact O-N 2.92Å; L381-V384 PolarHBondContact O-N 3.23Å; L381-H385 WeakPolarHBondContact O-CB 3.46Å; L381-H385 PolarHBondContact O-CD2 3.47Å; L381-H385 PolarHBondContact O-N 3.44Å; L381-F395 HydrophobicContact CD2-CE1 4.39Å; L381-F396 HydrophobicContact CD2-CE1 3.79Å; L381-F396 HydrophobicContact CD2-CZ 4.13Å; L381-L402 HydrophobicContact CD2-CB 4.18Å; L381-L402 WeakPolarHBondContact CD2-O 3.42Å; L381-V405 HydrophobicContact CD1-CB 3.67Å; L381-V405 HydrophobicContact CD1-CG1 3.61Å; L381-Y407 VanDerWaalsContact CB-CB 3.44Å; L381-Y407 HydrophobicContact CB-CD1 4.17Å; L381-Y407 HydrophobicContact CB-CG 4.1Å
382	R	98.3	Very high	95.2	Very high	3 Å²	3	29.6 Å²	29.6	1%	0.011	15%	0.152	C	C	.	.	H	α-helix	trans	-58.4	-47.9	173.5	-66.8	-176	67.4	80.1	-0.9	112.1	D326 D328 M329 H378 N379 Y380 V386 Y407 N409 I410	D326-R382 IonicContact OD1-CZ 2.92Å; D326-R382 IonicContact OD1-NE 2.73Å; D326-R382 IonicContact OD1-NH2 3.97Å; D326-R382 PolarHBondContact OD1-NH2 3.38Å; D326-R382 IonicContact OD2-CZ 3.02Å; D326-R382 VanDerWaalsContact OD2-CZ 3.28Å; D326-R382 IonicContact OD2-NE 3.28Å; D326-R382 PolarHBondContact OD2-NE 3.19Å; D326-R382 IonicContact OD2-NH2 2.82Å; D326-R382 PolarHBondContact OD2-NH2 3Å; D328-R382 VanDerWaalsContact CB-CZ 3.42Å; D328-R382 VanDerWaalsContact CB-NH2 3.34Å; D328-R382 IonicContact OD2-NH2 3.58Å; D328-R382 PolarHBondContact OD2-NH2 2.76Å; M329-R382 HydrophobicContact CE-CB 4.23Å; H378-R382 WeakPolarHBondContact NE2-CD 3.36Å; H378-R382 WeakPolarHBondContact O-CG 3.42Å; H378-R382 PolarHBondContact O-N 3.01Å; H378-R382 VanDerWaalsContact O-N 3.09Å; N379-R382 PolarHBondContact O-N 3Å; Y380-R382 VanDerWaalsContact C-N 3.35Å; Y380-R382 PolarHBondContact O-N 3.14Å; R382-V386 WeakPolarHBondContact O-CB 3.48Å; R382-V386 WeakPolarHBondContact O-CG2 3.25Å; R382-V386 PolarHBondContact O-N 3.3Å; R382-Y407 VanDerWaalsContact CG-O 3.26Å; R382-Y407 WeakPolarHBondContact CG-O 3.37Å; R382-Y407 PolarHBondContact NH1-O 3.07Å; R382-Y407 VanDerWaalsContact NH1-O 3.08Å; R382-N409 PolarHBondContact NH1-O 2.96Å; R382-N409 PolarHBondContact NH2-O 3.25Å; R382-I410 HydrophobicContact CB-CG2 4.39Å; R382-I410 HydrophobicContact CG-CG2 4.17Å
383	L	97.9	Very high	95.6	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-52	174.8	-179.8	168.6	0	0	0	110.8	L280 M329 R334 L337 E338 L341 N379 Y380 L381 H385 V386 W387 L388	L280-L383 HydrophobicContact CD1-CD2 3.97Å; M329-L383 HydrophobicContact CE-CB 4.27Å; R334-L383 HydrophobicContact CB-CD1 4.33Å; L337-L383 HydrophobicContact CB-CD1 3.67Å; E338-L383 HydrophobicContact CB-CB 4.39Å; E338-L383 HydrophobicContact CB-CD1 3.93Å; E338-L383 HydrophobicContact CB-CG 4.13Å; E338-L383 VanDerWaalsContact N-CD1 3.34Å; L341-L383 HydrophobicContact CD1-CD2 3.87Å; L341-L383 HydrophobicContact CD1-CG 4.37Å; N379-L383 PolarHBondContact O-N 3.22Å; Y380-L383 PolarHBondContact O-N 3.17Å; L381-L383 PolarHBondContact O-N 2.92Å; L383-H385 PolarHBondContact O-N 2.9Å; L383-V386 PolarHBondContact O-N 3.39Å; L383-W387 WeakPolarHBondContact O-CB 3.47Å; L383-W387 PolarHBondContact O-N 3.32Å; L383-L388 HydrophobicContact CD2-CD1 4.45Å; L383-L388 HydrophobicContact CD2-CD2 4.27Å; L383-L388 HydrophobicContact CD2-CG 4.16Å
384	V	97.9	Very high	95.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.9	-48.4	-175.4	167.2	0	0	0	0	111.3	L280 Y380 L381 V386 L388 K392 F395 F396	L280-V384 HydrophobicContact CD1-CG2 3.55Å; Y380-V384 WeakPolarHBondContact O-CB 3.38Å; Y380-V384 WeakPolarHBondContact O-CG2 3.26Å; Y380-V384 PolarHBondContact O-N 3.41Å; L381-V384 PolarHBondContact O-N 3.23Å; V384-V386 VanDerWaalsContact C-N 3.33Å; V384-V386 PolarHBondContact O-N 3.21Å; V384-L388 HydrophobicContact CB-CD1 4.28Å; V384-L388 HydrophobicContact CG1-CD1 4.29Å; V384-L388 HydrophobicContact CG2-CD1 3.88Å; V384-L388 PolarHBondContact O-N 3.1Å; V384-K392 HydrophobicContact CG1-CB 3.46Å; V384-K392 VanDerWaalsContact CG1-CB 3.46Å; V384-F395 HydrophobicContact CB-CD1 4.48Å; V384-F395 HydrophobicContact CG1-CD1 4.04Å; V384-F395 HydrophobicContact CG2-CB 4.45Å; V384-F395 HydrophobicContact CG2-CD1 3.7Å; V384-F395 HydrophobicContact CG2-CD2 4.15Å; V384-F395 HydrophobicContact CG2-CE1 3.88Å; V384-F395 HydrophobicContact CG2-CE2 4.29Å; V384-F395 HydrophobicContact CG2-CG 3.83Å; V384-F395 HydrophobicContact CG2-CZ 4.16Å; V384-F396 HydrophobicContact CG1-CE2 4.09Å; V384-F396 HydrophobicContact CG1-CZ 3.95Å
385	H	98.1	Very high	96	Very high	46 Å²	46	26.3 Å²	26.3	21%	0.213	13%	0.125	C	C	.	.	H	α-helix	trans	-72.7	-23.8	-177.3	-78.8	-77.2	0	0	0	113.9	L381 L383 F396 Y407 I410	L381-H385 WeakPolarHBondContact O-CB 3.46Å; L381-H385 PolarHBondContact O-CD2 3.47Å; L381-H385 PolarHBondContact O-N 3.44Å; L383-H385 PolarHBondContact O-N 2.9Å; H385-F396 AromaticContact NE2-CZ 3.7Å; H385-Y407 HydrophobicContact CB-CE2 4.3Å; H385-Y407 AromaticContact CD2-CD1 3.48Å; H385-Y407 VanDerWaalsContact CD2-CD1 3.48Å; H385-Y407 WeakPolarHBondContact CD2-CD1 3.31Å; H385-Y407 AromaticContact CD2-CE1 3.35Å; H385-Y407 WeakPolarHBondContact CD2-CE1 3.11Å; H385-Y407 AromaticContact CD2-CG 3.91Å; H385-Y407 AromaticContact CD2-CZ 3.65Å; H385-Y407 AromaticContact CE1-CE1 3.64Å; H385-Y407 AromaticContact CE1-CZ 3.86Å; H385-Y407 AromaticContact CG-CE1 3.94Å; H385-Y407 AromaticContact CG-CZ 3.76Å; H385-Y407 AromaticContact ND1-CZ 3.87Å; H385-Y407 AromaticContact NE2-CD1 3.58Å; H385-Y407 AromaticContact NE2-CE1 3.16Å; H385-Y407 WeakPolarHBondContact NE2-CE1 3.5Å; H385-Y407 AromaticContact NE2-CZ 3.75Å; H385-I410 HydrophobicContact CB-CD1 3.65Å
386	V	98.5	Very high	96.1	Very high	5 Å²	5	26.5 Å²	26.5	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-91.8	-36.6	-179.6	177.2	0	0	0	0	112.3	R382 L383 V384 I410 R413 V414 R417	R382-V386 WeakPolarHBondContact O-CB 3.48Å; R382-V386 WeakPolarHBondContact O-CG2 3.25Å; R382-V386 PolarHBondContact O-N 3.3Å; L383-V386 PolarHBondContact O-N 3.39Å; V384-V386 VanDerWaalsContact C-N 3.33Å; V384-V386 PolarHBondContact O-N 3.21Å; V386-I410 HydrophobicContact CG2-CB 3.86Å; V386-I410 HydrophobicContact CG2-CD1 3.95Å; V386-I410 HydrophobicContact CG2-CG1 4.44Å; V386-I410 HydrophobicContact CG2-CG2 4.16Å; V386-R413 HydrophobicContact CG1-CB 3.97Å; V386-R413 HydrophobicContact CG2-CB 3.83Å; V386-V414 HydrophobicContact CG2-CG2 4.31Å; V386-R417 WeakPolarHBondContact O-CD 3.33Å; V386-R417 PolarHBondContact O-NH1 3.41Å
387	W	98.4	Very high	96.2	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-118.4	-18.2	-162.9	-64.4	105.9	0	0	0	115.8	E338 L341 R342 M345 L383 R417 C422 F425	E338-W387 PolarHBondContact OE1-NE1 3.33Å; L341-W387 HydrophobicContact CB-CB 4.39Å; L341-W387 HydrophobicContact CB-CG 4.45Å; L341-W387 HydrophobicContact CD1-CB 3.82Å; R342-W387 HydrophobicContact CB-CH2 3.55Å; R342-W387 HydrophobicContact CB-CZ2 3.57Å; R342-W387 HydrophobicContact CB-CZ3 4.05Å; R342-W387 VanDerWaalsContact CD-CZ2 3.49Å; R342-W387 HydrophobicContact CG-CH2 3.51Å; R342-W387 HydrophobicContact CG-CZ2 3.75Å; R342-W387 HydrophobicContact CG-CZ3 4.32Å; M345-W387 HydrophobicContact CB-CZ3 4.35Å; M345-W387 HydrophobicContact CE-CE3 3.97Å; M345-W387 HydrophobicContact SD-CE3 3.85Å; L383-W387 WeakPolarHBondContact O-CB 3.47Å; L383-W387 PolarHBondContact O-N 3.32Å; W387-R417 HydrophobicContact CE3-CG 4.49Å; W387-R417 HydrophobicContact CH2-CB 4.16Å; W387-R417 HydrophobicContact CH2-CG 4.02Å; W387-R417 HydrophobicContact CZ3-CB 4.46Å; W387-R417 HydrophobicContact CZ3-CG 3.82Å; W387-C422 HydrophobicContact CZ3-CB 4.44Å; W387-F425 WeakPolarHBondContact O-CB 3.14Å; W387-F425 WeakPolarHBondContact O-CD2 3.39Å
388	L	98.1	Very high	96.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.154	C	C	.	.			trans	-95.5	0.7	-174.8	-58.6	-171.5	0	0	0	114.6	L280 L341 L383 V384 E390 Y391 K392 F425	L280-L388 HydrophobicContact CD1-CD1 4.07Å; L280-L388 HydrophobicContact CD2-CD1 4.06Å; L341-L388 HydrophobicContact CD1-CD2 3.96Å; L383-L388 HydrophobicContact CD2-CD1 4.45Å; L383-L388 HydrophobicContact CD2-CD2 4.27Å; L383-L388 HydrophobicContact CD2-CG 4.16Å; V384-L388 HydrophobicContact CB-CD1 4.28Å; V384-L388 HydrophobicContact CG1-CD1 4.29Å; V384-L388 HydrophobicContact CG2-CD1 3.88Å; V384-L388 PolarHBondContact O-N 3.1Å; L388-E390 PolarHBondContact O-N 3.09Å; L388-Y391 WeakPolarHBondContact O-CA 3.32Å; L388-Y391 WeakPolarHBondContact O-CB 3.45Å; L388-Y391 PolarHBondContact O-N 2.91Å; L388-K392 HydrophobicContact CB-CB 4.2Å; L388-K392 PolarHBondContact O-N 2.84Å; L388-F425 HydrophobicContact CD2-CD1 4.34Å; L388-F425 HydrophobicContact CD2-CD2 3.71Å; L388-F425 HydrophobicContact CD2-CE1 4.01Å; L388-F425 HydrophobicContact CD2-CE2 3.34Å; L388-F425 HydrophobicContact CD2-CG 4.21Å; L388-F425 HydrophobicContact CD2-CZ 3.5Å
389	D	98.2	Very high	96	Very high	45 Å²	45	33.7 Å²	33.7	24%	0.241	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	48.4	-128.7	179.2	-59.2	-32.9	0	0	0	112.5	Y391 K392 R417 S424 F425	D389-Y391 VanDerWaalsContact C-N 3.31Å; D389-K392 VanDerWaalsContact O-CD 3.29Å; D389-K392 WeakPolarHBondContact O-CD 3.09Å; D389-K392 VanDerWaalsContact O-CG 3.25Å; D389-K392 WeakPolarHBondContact O-CG 3.35Å; D389-R417 VanDerWaalsContact CG-NH2 3.33Å; D389-R417 IonicContact OD1-CZ 3.68Å; D389-R417 VanDerWaalsContact OD1-CZ 3.26Å; D389-R417 IonicContact OD1-NH1 3.26Å; D389-R417 PolarHBondContact OD1-NH1 3.04Å; D389-R417 IonicContact OD1-NH2 2.77Å; D389-R417 PolarHBondContact OD1-NH2 3.29Å; D389-R417 IonicContact OD2-CZ 3.73Å; D389-R417 IonicContact OD2-NH1 3.79Å; D389-R417 IonicContact OD2-NH2 3.74Å; D389-R417 PolarHBondContact OD2-NH2 3.17Å; D389-S424 WeakPolarHBondContact OD2-CA 3.24Å; D389-F425 HydrophobicContact CB-CB 4.32Å; D389-F425 PolarHBondContact OD2-N 2.74Å
390	E	96.3	Very high	95.8	Very high	118 Å²	118	37.6 Å²	37.6	55%	0.551	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-69.2	-24.5	173.3	61.8	-84.2	-167	0	0	113.6	L388 K392 E393	L388-E390 PolarHBondContact O-N 3.09Å; E390-K392 PolarHBondContact O-N 2.94Å; E390-K392 VanDerWaalsContact O-N 3.14Å; E390-E393 PolarHBondContact O-N 2.76Å
391	Y	96.4	Very high	95.8	Very high	37 Å²	37	39.9 Å²	39.9	15%	0.145	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-69.8	-9.1	-179.4	-68.4	-89.2	0	0	0	113.9	W278 L388 D389 E393 Q394 F425 Q426 L429	W278-Y391 AromaticContact CH2-CD1 3.68Å; W278-Y391 HydrophobicContact CH2-CD1 3.68Å; W278-Y391 HydrophobicContact CH2-CG 4.28Å; W278-Y391 HydrophobicContact CZ3-CD1 4.37Å; L388-Y391 WeakPolarHBondContact O-CA 3.32Å; L388-Y391 WeakPolarHBondContact O-CB 3.45Å; L388-Y391 PolarHBondContact O-N 2.91Å; D389-Y391 VanDerWaalsContact C-N 3.31Å; Y391-E393 PolarHBondContact O-N 2.91Å; Y391-E393 VanDerWaalsContact O-N 3.15Å; Y391-Q394 WeakPolarHBondContact O-CB 3.21Å; Y391-Q394 PolarHBondContact O-N 3.46Å; Y391-F425 HydrophobicContact CD2-CB 4.44Å; Y391-F425 AromaticContact CD2-CD1 3.66Å; Y391-F425 HydrophobicContact CD2-CD1 3.66Å; Y391-F425 AromaticContact CG-CD1 3.66Å; Y391-F425 HydrophobicContact CG-CD1 3.66Å; Y391-F425 HydrophobicContact CG-CE1 4.09Å; Y391-Q426 HydrophobicContact CE2-CB 4.34Å; Y391-Q426 PolarHBondContact OH-OE1 3.1Å; Y391-L429 HydrophobicContact CD1-CD1 3.93Å; Y391-L429 HydrophobicContact CD2-CD1 4.41Å; Y391-L429 HydrophobicContact CE1-CD1 3.64Å; Y391-L429 HydrophobicContact CE2-CD1 4.15Å; Y391-L429 HydrophobicContact CG-CD1 4.3Å
392	K	95.6	Very high	95.7	Very high	66 Å²	66	41.5 Å²	41.5	29%	0.287	22%	0.217	S	C	.	.	H	α-helix	trans	-54.9	-27.6	168.3	68.9	-171.9	176.1	-172.1	0	112.9	V384 L388 D389 E390 Q394 F395 F396	V384-K392 HydrophobicContact CG1-CB 3.46Å; V384-K392 VanDerWaalsContact CG1-CB 3.46Å; L388-K392 HydrophobicContact CB-CB 4.2Å; L388-K392 PolarHBondContact O-N 2.84Å; D389-K392 VanDerWaalsContact O-CD 3.29Å; D389-K392 WeakPolarHBondContact O-CD 3.09Å; D389-K392 VanDerWaalsContact O-CG 3.25Å; D389-K392 WeakPolarHBondContact O-CG 3.35Å; E390-K392 PolarHBondContact O-N 2.94Å; E390-K392 VanDerWaalsContact O-N 3.14Å; K392-Q394 VanDerWaalsContact C-N 3.26Å; K392-Q394 PolarHBondContact O-N 3.37Å; K392-F395 WeakPolarHBondContact O-CB 3.4Å; K392-F395 PolarHBondContact O-N 2.95Å; K392-F395 VanDerWaalsContact O-N 3.13Å; K392-F396 HydrophobicContact CB-CD2 4.39Å; K392-F396 HydrophobicContact CB-CE2 4.05Å; K392-F396 HydrophobicContact CD-CE2 4.3Å; K392-F396 HydrophobicContact CG-CD2 4.37Å; K392-F396 HydrophobicContact CG-CE2 4.09Å; K392-F396 WeakPolarHBondContact O-CD2 3.36Å; K392-F396 PolarHBondContact O-N 2.96Å
393	E	94.3	Very high	95.4	Very high	76 Å²	76	45.6 Å²	45.6	36%	0.355	24%	0.235	S	C	.	.	H	α-helix	trans	-64.4	-31.6	176.4	-62.8	-55.9	135.7	0	0	111.6	E390 Y391 F395 F396 L397 K403	E390-E393 PolarHBondContact O-N 2.76Å; Y391-E393 PolarHBondContact O-N 2.91Å; Y391-E393 VanDerWaalsContact O-N 3.15Å; E393-F395 VanDerWaalsContact C-N 3.27Å; E393-F395 PolarHBondContact O-N 3.2Å; E393-F396 PolarHBondContact O-N 3Å; E393-F396 VanDerWaalsContact O-N 3.17Å; E393-L397 VanDerWaalsContact O-CG 3.31Å; E393-L397 WeakPolarHBondContact O-CG 3.35Å; E393-L397 PolarHBondContact O-N 3.12Å; E393-K403 IonicContact OE1-NZ 3.41Å; E393-K403 IonicContact OE2-NZ 2.76Å; E393-K403 PolarHBondContact OE2-NZ 3.43Å
394	Q	92.9	Very high	95.2	Very high	47 Å²	47	55.1 Å²	55.1	22%	0.22	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-35.4	173.7	-65.6	-60.6	-26.3	0	0	112.5	W278 Y391 K392 R398	W278-Q394 HydrophobicContact CD2-CB 3.96Å; W278-Q394 HydrophobicContact CE3-CB 3.48Å; W278-Q394 VanDerWaalsContact CE3-CB 3.48Å; W278-Q394 HydrophobicContact CE3-CG 4.26Å; W278-Q394 HydrophobicContact CH2-CB 4.35Å; W278-Q394 HydrophobicContact CH2-CG 4.29Å; W278-Q394 HydrophobicContact CZ3-CB 3.71Å; W278-Q394 HydrophobicContact CZ3-CG 4.12Å; Y391-Q394 WeakPolarHBondContact O-CB 3.21Å; Y391-Q394 PolarHBondContact O-N 3.46Å; K392-Q394 VanDerWaalsContact C-N 3.26Å; K392-Q394 PolarHBondContact O-N 3.37Å; Q394-R398 PolarHBondContact O-NH1 3.44Å
395	F	93.3	Very high	95.1	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68.7	-45.5	172.9	173	-96.4	0	0	0	111.2	L280 Y380 L381 V384 K392 E393 L397 R398 K399 L402	L280-F395 HydrophobicContact CD1-CD2 3.8Å; L280-F395 HydrophobicContact CD1-CE2 3.98Å; L280-F395 HydrophobicContact CG-CD2 3.94Å; L280-F395 HydrophobicContact CG-CE2 4.29Å; Y380-F395 AromaticContact CD1-CE2 3.44Å; Y380-F395 HydrophobicContact CD1-CE2 3.44Å; Y380-F395 VanDerWaalsContact CD1-CE2 3.44Å; Y380-F395 AromaticContact CD1-CZ 3.61Å; Y380-F395 HydrophobicContact CD1-CZ 3.61Å; Y380-F395 HydrophobicContact CE1-CD2 4.5Å; Y380-F395 AromaticContact CE1-CE2 3.49Å; Y380-F395 HydrophobicContact CE1-CE2 3.49Å; Y380-F395 VanDerWaalsContact CE1-CE2 3.49Å; Y380-F395 HydrophobicContact CE1-CZ 4.08Å; Y380-F395 HydrophobicContact CG-CE2 4.36Å; Y380-F395 HydrophobicContact CG-CZ 4.13Å; L381-F395 HydrophobicContact CD2-CE1 4.39Å; V384-F395 HydrophobicContact CB-CD1 4.48Å; V384-F395 HydrophobicContact CG1-CD1 4.04Å; V384-F395 HydrophobicContact CG2-CB 4.45Å; V384-F395 HydrophobicContact CG2-CD1 3.7Å; V384-F395 HydrophobicContact CG2-CD2 4.15Å; V384-F395 HydrophobicContact CG2-CE1 3.88Å; V384-F395 HydrophobicContact CG2-CE2 4.29Å; V384-F395 HydrophobicContact CG2-CG 3.83Å; V384-F395 HydrophobicContact CG2-CZ 4.16Å; K392-F395 WeakPolarHBondContact O-CB 3.4Å; K392-F395 PolarHBondContact O-N 2.95Å; K392-F395 VanDerWaalsContact O-N 3.13Å; E393-F395 VanDerWaalsContact C-N 3.27Å; E393-F395 PolarHBondContact O-N 3.2Å; F395-L397 PolarHBondContact O-N 3.21Å; F395-R398 PolarHBondContact O-N 3.33Å; F395-K399 HydrophobicContact CE2-CD 3.78Å; F395-K399 HydrophobicContact CZ-CD 3.79Å; F395-K399 PolarHBondContact O-N 3.14Å; F395-L402 HydrophobicContact CE1-CB 4.47Å; F395-L402 HydrophobicContact CE1-CD1 4.11Å; F395-L402 HydrophobicContact CZ-CD1 3.85Å
396	F	95.1	Very high	94.9	Very high	8 Å²	8	61.6 Å²	61.6	4%	0.035	32%	0.315	C	S	.	.	H	α-helix	trans	-70	-28.6	-179.6	-66.6	-53.9	0	0	0	113.8	L381 V384 H385 K392 E393 R398 K399 P400 L402 K403	L381-F396 HydrophobicContact CD2-CE1 3.79Å; L381-F396 HydrophobicContact CD2-CZ 4.13Å; V384-F396 HydrophobicContact CG1-CE2 4.09Å; V384-F396 HydrophobicContact CG1-CZ 3.95Å; H385-F396 AromaticContact NE2-CZ 3.7Å; K392-F396 HydrophobicContact CB-CD2 4.39Å; K392-F396 HydrophobicContact CB-CE2 4.05Å; K392-F396 HydrophobicContact CD-CE2 4.3Å; K392-F396 HydrophobicContact CG-CD2 4.37Å; K392-F396 HydrophobicContact CG-CE2 4.09Å; K392-F396 WeakPolarHBondContact O-CD2 3.36Å; K392-F396 PolarHBondContact O-N 2.96Å; E393-F396 PolarHBondContact O-N 3Å; E393-F396 VanDerWaalsContact O-N 3.17Å; F396-R398 PolarHBondContact O-N 2.94Å; F396-K399 CarbonylContact O-C 3.54Å; F396-K399 PolarHBondContact O-N 3.42Å; F396-P400 WeakPolarHBondContact O-CA 3.41Å; F396-P400 WeakPolarHBondContact O-CD 3.43Å; F396-P400 WeakPolarHBondContact O-CG 3.18Å; F396-L402 HydrophobicContact CE1-CB 4.45Å; F396-K403 HydrophobicContact CB-CD 4.44Å; F396-K403 HydrophobicContact CD1-CB 3.85Å; F396-K403 HydrophobicContact CD1-CG 4.4Å; F396-K403 HydrophobicContact CE1-CB 4.25Å; F396-K403 HydrophobicContact CG-CB 4.17Å; F396-K403 HydrophobicContact CG-CD 4.47Å; F396-K403 HydrophobicContact CG-CG 4.32Å
397	L	93.3	Very high	94.7	Very high	122 Å²	122	64.8 Å²	64.8	64%	0.639	33%	0.327	S	S	*	.	H	α-helix	trans	-59.2	-37.4	171.1	-76.3	172.3	0	0	0	111.8	E393 F395	E393-L397 VanDerWaalsContact O-CG 3.31Å; E393-L397 WeakPolarHBondContact O-CG 3.35Å; E393-L397 PolarHBondContact O-N 3.12Å; F395-L397 PolarHBondContact O-N 3.21Å
398	R	92.8	Very high	94.6	Very high	73 Å²	73	67 Å²	67	28%	0.275	35%	0.35	S	S	.	.	H	α-helix	trans	-84.2	-24.9	179.2	-67.3	168.6	177.5	78.5	-1.5	112.7	W278 Q394 F395 F396 L443	W278-R398 VanDerWaalsContact CB-NE 3.34Å; Q394-R398 PolarHBondContact O-NH1 3.44Å; F395-R398 PolarHBondContact O-N 3.33Å; F396-R398 PolarHBondContact O-N 2.94Å; R398-L443 VanDerWaalsContact NH2-CD1 3.26Å
399	K	92.3	Very high	94.5	Very high	46 Å²	46	72.3 Å²	72.3	20%	0.2	38%	0.379	C	S	.	.			trans	-133.1	67	178.7	-62.3	179.2	-174.7	161.8	0	111.7	N279 Y380 F395 F396 G401 L402	N279-K399 PolarHBondContact O-NZ 3.42Å; Y380-K399 VanDerWaalsContact CZ-NZ 3.29Å; Y380-K399 PolarHBondContact OH-NZ 3.41Å; F395-K399 HydrophobicContact CE2-CD 3.78Å; F395-K399 HydrophobicContact CZ-CD 3.79Å; F395-K399 PolarHBondContact O-N 3.14Å; F396-K399 CarbonylContact O-C 3.54Å; F396-K399 PolarHBondContact O-N 3.42Å; K399-G401 VanDerWaalsContact C-N 3.26Å; K399-G401 PolarHBondContact O-N 2.92Å; K399-L402 HydrophobicContact CB-CB 4.41Å; K399-L402 HydrophobicContact CB-CD1 3.91Å; K399-L402 HydrophobicContact CB-CG 4.04Å; K399-L402 HydrophobicContact CD-CD1 3.75Å; K399-L402 HydrophobicContact CG-CD1 4.42Å; K399-L402 PolarHBondContact O-N 3.48Å
400	P	93.6	Very high	94.5	Very high	83 Å²	83	71.3 Å²	71.3	54%	0.539	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-59.5	-36.3	-172	-25.8	35.1	0	0	0	113.5	F396 L402 K403	F396-P400 WeakPolarHBondContact O-CA 3.41Å; F396-P400 WeakPolarHBondContact O-CD 3.43Å; F396-P400 WeakPolarHBondContact O-CG 3.18Å; P400-L402 PolarHBondContact O-N 2.94Å; P400-L402 VanDerWaalsContact O-N 3.13Å; P400-K403 WeakPolarHBondContact O-CB 3.34Å; P400-K403 PolarHBondContact O-N 3.49Å; P400-K403 VanDerWaalsContact O-N 3.15Å
401	G	93.8	Very high	94.6	Very high	61 Å²	61	73.4 Å²	73.4	63%	0.629	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-62.4	-19.3	179.4	0	0	0	0	0	114.4	K399	K399-G401 VanDerWaalsContact C-N 3.26Å; K399-G401 PolarHBondContact O-N 2.92Å
402	L	94.4	Very high	94.7	Very high	34 Å²	34	76.4 Å²	76.4	18%	0.178	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-84.1	-11.9	179.6	-61.1	-171.2	0	0	0	113.5	T377 L381 F395 F396 K399 P400 Y404 V405	T377-L402 HydrophobicContact CG2-CD1 4.3Å; T377-L402 HydrophobicContact CG2-CD2 3.57Å; L381-L402 HydrophobicContact CD2-CB 4.18Å; L381-L402 WeakPolarHBondContact CD2-O 3.42Å; F395-L402 HydrophobicContact CE1-CB 4.47Å; F395-L402 HydrophobicContact CE1-CD1 4.11Å; F395-L402 HydrophobicContact CZ-CD1 3.85Å; F396-L402 HydrophobicContact CE1-CB 4.45Å; K399-L402 HydrophobicContact CB-CB 4.41Å; K399-L402 HydrophobicContact CB-CD1 3.91Å; K399-L402 HydrophobicContact CB-CG 4.04Å; K399-L402 HydrophobicContact CD-CD1 3.75Å; K399-L402 HydrophobicContact CG-CD1 4.42Å; K399-L402 PolarHBondContact O-N 3.48Å; P400-L402 PolarHBondContact O-N 2.94Å; P400-L402 VanDerWaalsContact O-N 3.13Å; L402-Y404 PolarHBondContact O-N 2.91Å; L402-V405 HydrophobicContact CD2-CG2 4.15Å; L402-V405 PolarHBondContact O-N 3.34Å
403	K	93.3	Very high	94.9	Very high	89 Å²	89	73.6 Å²	73.6	39%	0.387	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-61.7	-26.4	-178.2	-171.4	163.7	-176.8	157.6	0	113.5	E393 F396 P400	E393-K403 IonicContact OE1-NZ 3.41Å; E393-K403 IonicContact OE2-NZ 2.76Å; E393-K403 PolarHBondContact OE2-NZ 3.43Å; F396-K403 HydrophobicContact CB-CD 4.44Å; F396-K403 HydrophobicContact CD1-CB 3.85Å; F396-K403 HydrophobicContact CD1-CG 4.4Å; F396-K403 HydrophobicContact CE1-CB 4.25Å; F396-K403 HydrophobicContact CG-CB 4.17Å; F396-K403 HydrophobicContact CG-CD 4.47Å; F396-K403 HydrophobicContact CG-CG 4.32Å; P400-K403 WeakPolarHBondContact O-CB 3.34Å; P400-K403 PolarHBondContact O-N 3.49Å; P400-K403 VanDerWaalsContact O-N 3.15Å
404	Y	92.7	Very high	95.1	Very high	201 Å²	201	72.2 Å²	72.2	79%	0.788	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-109	6.6	-176.2	-50.9	-70.1	0	0	0	113.5	L402	L402-Y404 PolarHBondContact O-N 2.91Å
405	V	95.3	Very high	95.3	Very high	59 Å²	59	74 Å²	74	36%	0.358	38%	0.384	S	S	.	.	S	Bend	trans	-85.3	140.2	179.3	176.1	0	0	0	0	109.5	T377 L381 L402	T377-V405 HydrophobicContact CG2-CG1 4.4Å; L381-V405 HydrophobicContact CD1-CB 3.67Å; L381-V405 HydrophobicContact CD1-CG1 3.61Å; L402-V405 HydrophobicContact CD2-CG2 4.15Å; L402-V405 PolarHBondContact O-N 3.34Å
406	T	93.8	Very high	95.6	Very high	123 Å²	123	74.2 Å²	74.2	76%	0.755	39%	0.385	S	S	*	.			trans	-73.6	148.5	178.4	56.9	0	0	0	0	111.4
407	Y	95	Very high	95.8	Very high	71 Å²	71	75.5 Å²	75.5	28%	0.278	39%	0.39	S	S	.	.			trans	-132.8	15.2	-176.2	48.8	-97.3	0	0	0	113.2	H378 L381 R382 H385 I410	H378-Y407 PolarHBondContact CE1-O 3.15Å; H378-Y407 VanDerWaalsContact CE1-O 3.32Å; L381-Y407 VanDerWaalsContact CB-CB 3.44Å; L381-Y407 HydrophobicContact CB-CD1 4.17Å; L381-Y407 HydrophobicContact CB-CG 4.1Å; R382-Y407 VanDerWaalsContact CG-O 3.26Å; R382-Y407 WeakPolarHBondContact CG-O 3.37Å; R382-Y407 PolarHBondContact NH1-O 3.07Å; R382-Y407 VanDerWaalsContact NH1-O 3.08Å; H385-Y407 HydrophobicContact CB-CE2 4.3Å; H385-Y407 AromaticContact CD2-CD1 3.48Å; H385-Y407 VanDerWaalsContact CD2-CD1 3.48Å; H385-Y407 WeakPolarHBondContact CD2-CD1 3.31Å; H385-Y407 AromaticContact CD2-CE1 3.35Å; H385-Y407 WeakPolarHBondContact CD2-CE1 3.11Å; H385-Y407 AromaticContact CD2-CG 3.91Å; H385-Y407 AromaticContact CD2-CZ 3.65Å; H385-Y407 AromaticContact CE1-CE1 3.64Å; H385-Y407 AromaticContact CE1-CZ 3.86Å; H385-Y407 AromaticContact CG-CE1 3.94Å; H385-Y407 AromaticContact CG-CZ 3.76Å; H385-Y407 AromaticContact ND1-CZ 3.87Å; H385-Y407 AromaticContact NE2-CD1 3.58Å; H385-Y407 AromaticContact NE2-CE1 3.16Å; H385-Y407 WeakPolarHBondContact NE2-CE1 3.5Å; H385-Y407 AromaticContact NE2-CZ 3.75Å; Y407-I410 HydrophobicContact CD2-CD1 4.49Å; Y407-I410 HydrophobicContact CD2-CG2 3.96Å; Y407-I410 HydrophobicContact CE2-CD1 3.94Å; Y407-I410 HydrophobicContact CE2-CG1 4.22Å; Y407-I410 HydrophobicContact CE2-CG2 4.4Å
408	G	95.9	Very high	96	Very high	48 Å²	48	77.3 Å²	77.3	50%	0.495	39%	0.392	S	S	.	.			trans	65.4	-167.7	-176.7	0	0	0	0	0	113.5
409	N	97.4	Very high	96.3	Very high	112 Å²	112	82.6 Å²	82.6	60%	0.599	41%	0.412	S	S	*	.			trans	-80.7	126.1	179.5	-175.8	-1.8	0	0	0	110.5	R382 R411	R382-N409 PolarHBondContact NH1-O 2.96Å; R382-N409 PolarHBondContact NH2-O 3.25Å; N409-R411 WeakPolarHBondContact OD1-CB 3.41Å; N409-R411 PolarHBondContact OD1-N 3.48Å
410	I	98.2	Very high	96.6	Very high	24 Å²	24	82.6 Å²	82.6	12%	0.123	41%	0.414	C	S	.	.			trans	-111.9	7.9	177.7	58.9	169.8	0	0	0	113.2	R382 H385 V386 Y407 E412 R413 V414	R382-I410 HydrophobicContact CB-CG2 4.39Å; R382-I410 HydrophobicContact CG-CG2 4.17Å; H385-I410 HydrophobicContact CB-CD1 3.65Å; V386-I410 HydrophobicContact CG2-CB 3.86Å; V386-I410 HydrophobicContact CG2-CD1 3.95Å; V386-I410 HydrophobicContact CG2-CG1 4.44Å; V386-I410 HydrophobicContact CG2-CG2 4.16Å; Y407-I410 HydrophobicContact CD2-CD1 4.49Å; Y407-I410 HydrophobicContact CD2-CG2 3.96Å; Y407-I410 HydrophobicContact CE2-CD1 3.94Å; Y407-I410 HydrophobicContact CE2-CG1 4.22Å; Y407-I410 HydrophobicContact CE2-CG2 4.4Å; I410-E412 VanDerWaalsContact C-N 3.33Å; I410-E412 PolarHBondContact O-N 2.97Å; I410-R413 PolarHBondContact O-N 3.01Å; I410-V414 HydrophobicContact CD1-CG2 4.11Å; I410-V414 HydrophobicContact CG1-CG2 4.19Å; I410-V414 WeakPolarHBondContact O-CG2 3.49Å; I410-V414 PolarHBondContact O-N 3.42Å
411	R	98.3	Very high	96.8	Very high	162 Å²	162	81.3 Å²	81.3	61%	0.611	42%	0.416	S	S	*	.	H	α-helix	trans	-53.9	-46.5	-174.2	-179.6	176.8	173.8	175.7	-1.3	112.6	N409 R413 V414 E415	N409-R411 WeakPolarHBondContact OD1-CB 3.41Å; N409-R411 PolarHBondContact OD1-N 3.48Å; R411-R413 VanDerWaalsContact C-N 3.27Å; R411-R413 PolarHBondContact O-N 3.01Å; R411-V414 PolarHBondContact O-N 3.47Å; R411-E415 HydrophobicContact CG-CG 4.27Å; R411-E415 WeakPolarHBondContact CG-OE1 3.44Å; R411-E415 IonicContact CZ-OE1 2.94Å; R411-E415 IonicContact NE-OE1 2.94Å; R411-E415 PolarHBondContact NE-OE1 3.08Å; R411-E415 IonicContact NH2-OE1 3.34Å; R411-E415 PolarHBondContact NH2-OE1 2.82Å; R411-E415 WeakPolarHBondContact O-CB 3.44Å; R411-E415 WeakPolarHBondContact O-CG 3.39Å; R411-E415 PolarHBondContact O-N 3.07Å
412	E	98.1	Very high	97	Very high	100 Å²	100	79.4 Å²	79.4	47%	0.467	39%	0.393	S	S	.	.	H	α-helix	trans	-58.8	-39.7	179.1	-175.9	178.9	162.5	0	0	111.8	K327 I410 L416	K327-E412 VanDerWaalsContact CE-OE2 3.27Å; K327-E412 WeakPolarHBondContact CE-OE2 3.3Å; K327-E412 VanDerWaalsContact NZ-CD 3.34Å; K327-E412 IonicContact NZ-OE1 3.76Å; K327-E412 PolarHBondContact NZ-OE1 3.24Å; K327-E412 IonicContact NZ-OE2 3.42Å; K327-E412 PolarHBondContact NZ-OE2 3.32Å; I410-E412 VanDerWaalsContact C-N 3.33Å; I410-E412 PolarHBondContact O-N 2.97Å; E412-L416 VanDerWaalsContact O-CB 3.22Å; E412-L416 WeakPolarHBondContact O-CB 3.28Å; E412-L416 PolarHBondContact O-N 3.1Å
413	R	98.6	Very high	97.2	Very high	6 Å²	6	83.1 Å²	83.1	2%	0.023	41%	0.408	C	S	.	.	H	α-helix	trans	-72.4	-39.3	179.3	-54.9	-52.8	-62.7	177.3	-6.8	112	G323 D326 E338 R342 V386 I410 R411 R417	G323-R413 PolarHBondContact O-NH1 3.38Å; D326-R413 HydrophobicContact CB-CG 4.43Å; E338-R413 IonicContact OE1-CZ 3.6Å; E338-R413 IonicContact OE1-NE 3.27Å; E338-R413 IonicContact OE1-NH2 3.6Å; E338-R413 PolarHBondContact OE1-NH2 3.13Å; E338-R413 IonicContact OE2-NH2 3.85Å; R342-R413 VanDerWaalsContact NH2-NH2 3.14Å; V386-R413 HydrophobicContact CG1-CB 3.97Å; V386-R413 HydrophobicContact CG2-CB 3.83Å; I410-R413 PolarHBondContact O-N 3.01Å; R411-R413 VanDerWaalsContact C-N 3.27Å; R411-R413 PolarHBondContact O-N 3.01Å; R413-R417 PolarHBondContact O-N 3.39Å
414	V	98.6	Very high	97.5	Very high	48 Å²	48	81.3 Å²	81.3	29%	0.291	41%	0.406	S	S	.	.	H	α-helix	trans	-66.1	-43.5	175	174.3	0	0	0	0	111.2	V386 I410 R411 R417 K418	V386-V414 HydrophobicContact CG2-CG2 4.31Å; I410-V414 HydrophobicContact CD1-CG2 4.11Å; I410-V414 HydrophobicContact CG1-CG2 4.19Å; I410-V414 WeakPolarHBondContact O-CG2 3.49Å; I410-V414 PolarHBondContact O-N 3.42Å; R411-V414 PolarHBondContact O-N 3.47Å; V414-R417 PolarHBondContact O-N 3.36Å; V414-K418 WeakPolarHBondContact O-CG 3.37Å; V414-K418 PolarHBondContact O-N 3.47Å; V414-K418 VanDerWaalsContact O-N 3.07Å
415	E	98.6	Very high	97.8	Very high	85 Å²	85	71.8 Å²	71.8	40%	0.397	37%	0.369	S	S	.	.	H	α-helix	trans	-65.8	-40.3	176.7	-74.4	175.7	173	0	0	111.7	R411 K418 R419	R411-E415 HydrophobicContact CG-CG 4.27Å; R411-E415 WeakPolarHBondContact CG-OE1 3.44Å; R411-E415 IonicContact CZ-OE1 2.94Å; R411-E415 IonicContact NE-OE1 2.94Å; R411-E415 PolarHBondContact NE-OE1 3.08Å; R411-E415 IonicContact NH2-OE1 3.34Å; R411-E415 PolarHBondContact NH2-OE1 2.82Å; R411-E415 WeakPolarHBondContact O-CB 3.44Å; R411-E415 WeakPolarHBondContact O-CG 3.39Å; R411-E415 PolarHBondContact O-N 3.07Å; E415-K418 PolarHBondContact O-N 3.39Å; E415-R419 WeakPolarHBondContact O-CB 3.29Å; E415-R419 PolarHBondContact O-N 3.32Å
416	L	98.6	Very high	97.9	Very high	4 Å²	4	71.2 Å²	71.2	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-57.9	-49.4	171.8	173.8	69.7	0	0	0	111.5	I322 E412 K418 R419 L420	I322-L416 WeakPolarHBondContact O-CD2 3.36Å; E412-L416 VanDerWaalsContact O-CB 3.22Å; E412-L416 WeakPolarHBondContact O-CB 3.28Å; E412-L416 PolarHBondContact O-N 3.1Å; L416-K418 VanDerWaalsContact C-N 3.28Å; L416-K418 PolarHBondContact O-N 3.25Å; L416-R419 PolarHBondContact O-N 3.31Å; L416-L420 HydrophobicContact CD1-CD1 3.72Å; L416-L420 HydrophobicContact CD1-CG 4.05Å; L416-L420 HydrophobicContact CG-CD1 4.01Å; L416-L420 WeakPolarHBondContact O-CG 3.29Å; L416-L420 PolarHBondContact O-N 3.35Å
417	R	98.7	Very high	98.1	Very high	35 Å²	35	68.9 Å²	68.9	13%	0.132	34%	0.34	C	S	.	.	H	α-helix	trans	-57.6	-41.1	178.5	-173.4	178.1	175.2	-161.1	-6.3	111.8	M345 V386 W387 D389 R413 V414 G421 C422 K423	M345-R417 VanDerWaalsContact CE-NH2 3.25Å; V386-R417 WeakPolarHBondContact O-CD 3.33Å; V386-R417 PolarHBondContact O-NH1 3.41Å; W387-R417 HydrophobicContact CE3-CG 4.49Å; W387-R417 HydrophobicContact CH2-CB 4.16Å; W387-R417 HydrophobicContact CH2-CG 4.02Å; W387-R417 HydrophobicContact CZ3-CB 4.46Å; W387-R417 HydrophobicContact CZ3-CG 3.82Å; D389-R417 VanDerWaalsContact CG-NH2 3.33Å; D389-R417 IonicContact OD1-CZ 3.68Å; D389-R417 VanDerWaalsContact OD1-CZ 3.26Å; D389-R417 IonicContact OD1-NH1 3.26Å; D389-R417 PolarHBondContact OD1-NH1 3.04Å; D389-R417 IonicContact OD1-NH2 2.77Å; D389-R417 PolarHBondContact OD1-NH2 3.29Å; D389-R417 IonicContact OD2-CZ 3.73Å; D389-R417 IonicContact OD2-NH1 3.79Å; D389-R417 IonicContact OD2-NH2 3.74Å; D389-R417 PolarHBondContact OD2-NH2 3.17Å; R413-R417 PolarHBondContact O-N 3.39Å; V414-R417 PolarHBondContact O-N 3.36Å; R417-G421 PolarHBondContact O-N 3.47Å; R417-C422 HydrophobicContact CG-CB 3.75Å; R417-C422 PolarHBondContact O-N 3.34Å; R417-C422 PolarHBondContact O-SG 3.26Å; R417-K423 PolarHBondContact NH2-O 3.5Å; R417-K423 VanDerWaalsContact NH2-O 3.09Å
418	K	98.6	Very high	98.3	Very high	160 Å²	160	65.5 Å²	65.5	70%	0.696	33%	0.326	S	S	*	.	H	α-helix	trans	-66.2	-48.8	175	-70.7	176.6	-178.7	-177.3	0	112.1	V414 E415 L416 L420 G421	V414-K418 WeakPolarHBondContact O-CG 3.37Å; V414-K418 PolarHBondContact O-N 3.47Å; V414-K418 VanDerWaalsContact O-N 3.07Å; E415-K418 PolarHBondContact O-N 3.39Å; L416-K418 VanDerWaalsContact C-N 3.28Å; L416-K418 PolarHBondContact O-N 3.25Å; K418-L420 VanDerWaalsContact C-N 3.29Å; K418-L420 PolarHBondContact O-N 3.2Å; K418-G421 PolarHBondContact O-N 3.38Å
419	R	98.4	Very high	98.4	Very high	183 Å²	183	63.2 Å²	63.2	69%	0.691	30%	0.303	S	S	*	.	H	α-helix	trans	-60.3	-37.8	-177.8	-180	175.7	62.9	-136.4	2.3	112.5	E415 L416 G421	E415-R419 WeakPolarHBondContact O-CB 3.29Å; E415-R419 PolarHBondContact O-N 3.32Å; L416-R419 PolarHBondContact O-N 3.31Å; R419-G421 PolarHBondContact O-N 3.12Å
420	L	98.4	Very high	98.4	Very high	47 Å²	47	62.1 Å²	62.1	25%	0.246	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-5	177.9	-66.8	177.5	0	0	0	113.4	C346 L416 K418 C422	C346-L420 HydrophobicContact CB-CB 4.35Å; C346-L420 HydrophobicContact CB-CD1 4.21Å; L416-L420 HydrophobicContact CD1-CD1 3.72Å; L416-L420 HydrophobicContact CD1-CG 4.05Å; L416-L420 HydrophobicContact CG-CD1 4.01Å; L416-L420 WeakPolarHBondContact O-CG 3.29Å; L416-L420 PolarHBondContact O-N 3.35Å; K418-L420 VanDerWaalsContact C-N 3.29Å; K418-L420 PolarHBondContact O-N 3.2Å; L420-C422 VanDerWaalsContact C-N 3.27Å; L420-C422 VanDerWaalsContact CB-SG 3.51Å; L420-C422 PolarHBondContact O-N 3.38Å
421	G	98.4	Very high	98.3	Very high	55 Å²	55	64.5 Å²	64.5	57%	0.567	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	35.1	-177.9	0	0	0	0	0	113	R417 K418 R419	R417-G421 PolarHBondContact O-N 3.47Å; K418-G421 PolarHBondContact O-N 3.38Å; R419-G421 PolarHBondContact O-N 3.12Å
422	C	98.8	Very high	98.2	Very high	22 Å²	22	57.1 Å²	57.1	15%	0.149	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-65.5	147.7	-174.5	-48.8	0	0	0	0	111.8	M345 C346 W387 R417 L420	M345-C422 HydrophobicContact CB-CB 4.41Å; M345-C422 CarbonylContact O-C 3.13Å; M345-C422 WeakPolarHBondContact O-CA 3.34Å; M345-C422 WeakPolarHBondContact O-CB 3.45Å; C346-C422 HydrophobicContact CB-CB 4.05Å; C346-C422 WeakPolarHBondContact CB-SG 3.16Å; C346-C422 WeakPolarHBondContact SG-CB 3.47Å; C346-C422 CovalentContact SG-SG 2.03Å; C346-C422 PolarHBondContact SG-SG 3.15Å; W387-C422 HydrophobicContact CZ3-CB 4.44Å; R417-C422 HydrophobicContact CG-CB 3.75Å; R417-C422 PolarHBondContact O-N 3.34Å; R417-C422 PolarHBondContact O-SG 3.26Å; L420-C422 VanDerWaalsContact C-N 3.27Å; L420-C422 VanDerWaalsContact CB-SG 3.51Å; L420-C422 PolarHBondContact O-N 3.38Å
423	K	98.8	Very high	98.2	Very high	112 Å²	112	52.9 Å²	52.9	49%	0.487	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-69.1	167.2	177.3	-54.3	-59.1	-176.2	-176.1	0	112.2	M345 R417 W427	M345-K423 WeakPolarHBondContact CE-O 2.84Å; M345-K423 PolarHBondContact O-N 2.77Å; R417-K423 PolarHBondContact NH2-O 3.5Å; R417-K423 VanDerWaalsContact NH2-O 3.09Å; K423-W427 HydrophobicContact CB-CB 3.88Å; K423-W427 HydrophobicContact CB-CD2 3.59Å; K423-W427 HydrophobicContact CB-CE3 3.56Å; K423-W427 HydrophobicContact CB-CG 3.72Å; K423-W427 HydrophobicContact CB-CZ3 4.36Å; K423-W427 HydrophobicContact CG-CD2 3.66Å; K423-W427 HydrophobicContact CG-CE3 3.83Å; K423-W427 HydrophobicContact CG-CG 4.01Å; K423-W427 HydrophobicContact CG-CZ2 4.48Å; K423-W427 HydrophobicContact CG-CZ3 4.31Å
424	S	98.6	Very high	98	Very high	51 Å²	51	55.6 Å²	55.6	36%	0.357	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-74	162.3	174.1	59.4	0	0	0	0	111.6	D389 Q426 W427 Y428	D389-S424 WeakPolarHBondContact OD2-CA 3.24Å; S424-Q426 VanDerWaalsContact C-N 3.27Å; S424-W427 WeakPolarHBondContact O-CB 3.38Å; S424-W427 PolarHBondContact O-N 3.11Å; S424-W427 PolarHBondContact OG-N 3.28Å; S424-Y428 PolarHBondContact O-N 3.24Å
425	F	98.6	Very high	97.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66	-32.1	172.3	-167.3	-107.4	0	0	0	111.6	F276 W278 L341 M345 W387 L388 D389 Y391 W427 Y428 L429 L436	F276-F425 HydrophobicContact CZ-CZ 4.46Å; W278-F425 AromaticContact CH2-CE1 3.96Å; W278-F425 HydrophobicContact CH2-CE1 3.96Å; W278-F425 HydrophobicContact CZ3-CE1 4.15Å; L341-F425 HydrophobicContact CD1-CE2 4.26Å; L341-F425 HydrophobicContact CD2-CD2 4.33Å; L341-F425 HydrophobicContact CD2-CE2 3.7Å; M345-F425 HydrophobicContact CE-CB 4.33Å; M345-F425 HydrophobicContact SD-CD2 4.26Å; W387-F425 WeakPolarHBondContact O-CB 3.14Å; W387-F425 WeakPolarHBondContact O-CD2 3.39Å; L388-F425 HydrophobicContact CD2-CD1 4.34Å; L388-F425 HydrophobicContact CD2-CD2 3.71Å; L388-F425 HydrophobicContact CD2-CE1 4.01Å; L388-F425 HydrophobicContact CD2-CE2 3.34Å; L388-F425 HydrophobicContact CD2-CG 4.21Å; L388-F425 HydrophobicContact CD2-CZ 3.5Å; D389-F425 HydrophobicContact CB-CB 4.32Å; D389-F425 PolarHBondContact OD2-N 2.74Å; Y391-F425 HydrophobicContact CD2-CB 4.44Å; Y391-F425 AromaticContact CD2-CD1 3.66Å; Y391-F425 HydrophobicContact CD2-CD1 3.66Å; Y391-F425 AromaticContact CG-CD1 3.66Å; Y391-F425 HydrophobicContact CG-CD1 3.66Å; Y391-F425 HydrophobicContact CG-CE1 4.09Å; F425-W427 VanDerWaalsContact C-N 3.34Å; F425-W427 PolarHBondContact O-N 3.47Å; F425-Y428 HydrophobicContact CD2-CD1 4.21Å; F425-Y428 AromaticContact CE2-CD1 3.75Å; F425-Y428 HydrophobicContact CE2-CD1 3.75Å; F425-Y428 HydrophobicContact CE2-CE1 4.23Å; F425-Y428 HydrophobicContact CE2-CG 4.43Å; F425-Y428 HydrophobicContact CZ-CD1 4.24Å; F425-Y428 WeakPolarHBondContact O-CA 3.45Å; F425-Y428 WeakPolarHBondContact O-CB 3.14Å; F425-Y428 PolarHBondContact O-N 3.02Å; F425-Y428 VanDerWaalsContact O-N 3.1Å; F425-L429 HydrophobicContact CD1-CD1 4Å; F425-L429 HydrophobicContact CD1-CG 4.13Å; F425-L429 HydrophobicContact CE1-CD1 3.87Å; F425-L429 HydrophobicContact CE1-CD2 3.88Å; F425-L429 HydrophobicContact CE1-CG 3.88Å; F425-L429 HydrophobicContact CZ-CD2 4.1Å; F425-L429 HydrophobicContact CZ-CG 4.43Å; F425-L429 PolarHBondContact O-N 3Å; F425-L436 HydrophobicContact CZ-CD2 4.31Å
426	Q	98	Very high	97.4	Very high	48 Å²	48	52.2 Å²	52.2	22%	0.224	26%	0.263	C	S	.	.	H	α-helix	trans	-54.4	-49.9	168.8	-177.1	69.3	59.9	0	0	111.4	Y391 S424 Y428 L429 D430 E437	Y391-Q426 HydrophobicContact CE2-CB 4.34Å; Y391-Q426 PolarHBondContact OH-OE1 3.1Å; S424-Q426 VanDerWaalsContact C-N 3.27Å; Q426-Y428 PolarHBondContact O-N 3.43Å; Q426-L429 WeakPolarHBondContact O-CB 3.43Å; Q426-L429 PolarHBondContact O-N 3.4Å; Q426-D430 PolarHBondContact NE2-OD1 2.92Å; Q426-D430 VanDerWaalsContact O-CG 3.23Å; Q426-D430 PolarHBondContact O-N 3.48Å; Q426-E437 PolarHBondContact NE2-OE1 3.3Å
427	W	98.4	Very high	96.6	Very high	74 Å²	74	54.7 Å²	54.7	28%	0.28	27%	0.274	S	S	.	.	H	α-helix	trans	-58.1	-37.5	178.3	176.1	89.9	0	0	0	111.5	W344 K423 S424 F425 D430 N431 V432	W344-W427 WeakPolarHBondContact O-CZ3 3.45Å; K423-W427 HydrophobicContact CB-CB 3.88Å; K423-W427 HydrophobicContact CB-CD2 3.59Å; K423-W427 HydrophobicContact CB-CE3 3.56Å; K423-W427 HydrophobicContact CB-CG 3.72Å; K423-W427 HydrophobicContact CB-CZ3 4.36Å; K423-W427 HydrophobicContact CG-CD2 3.66Å; K423-W427 HydrophobicContact CG-CE3 3.83Å; K423-W427 HydrophobicContact CG-CG 4.01Å; K423-W427 HydrophobicContact CG-CZ2 4.48Å; K423-W427 HydrophobicContact CG-CZ3 4.31Å; S424-W427 WeakPolarHBondContact O-CB 3.38Å; S424-W427 PolarHBondContact O-N 3.11Å; S424-W427 PolarHBondContact OG-N 3.28Å; F425-W427 VanDerWaalsContact C-N 3.34Å; F425-W427 PolarHBondContact O-N 3.47Å; W427-D430 PolarHBondContact O-N 2.97Å; W427-N431 HydrophobicContact CD2-CB 4.35Å; W427-N431 HydrophobicContact CZ2-CB 4.07Å; W427-N431 PolarHBondContact NE1-ND2 3.46Å; W427-N431 VanDerWaalsContact O-CB 3.25Å; W427-N431 WeakPolarHBondContact O-CB 3.48Å; W427-N431 PolarHBondContact O-N 3.42Å; W427-N431 PolarHBondContact O-ND2 2.85Å; W427-V432 HydrophobicContact CH2-CG2 4.32Å; W427-V432 HydrophobicContact CZ3-CG2 4.01Å
428	Y	98.6	Very high	95.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-44.2	175	174.1	-86.1	0	0	0	111.8	F276 P305 L341 W344 M345 S424 F425 Q426 V432 F433	F276-Y428 HydrophobicContact CE1-CE1 4.27Å; F276-Y428 HydrophobicContact CZ-CE1 4.17Å; P305-Y428 WeakPolarHBondContact CB-OH 3.49Å; P305-Y428 PolarHBondContact O-OH 3.44Å; L341-Y428 HydrophobicContact CD2-CD1 4.07Å; L341-Y428 HydrophobicContact CD2-CD2 4.09Å; L341-Y428 HydrophobicContact CD2-CE1 3.78Å; L341-Y428 HydrophobicContact CD2-CE2 3.78Å; L341-Y428 HydrophobicContact CD2-CG 4.24Å; W344-Y428 HydrophobicContact CB-CD2 3.78Å; W344-Y428 HydrophobicContact CB-CE2 3.87Å; W344-Y428 AromaticContact CD1-CE2 3.78Å; W344-Y428 HydrophobicContact CG-CD2 4.32Å; W344-Y428 AromaticContact CG-CE2 3.98Å; W344-Y428 HydrophobicContact CG-CE2 3.98Å; M345-Y428 HydrophobicContact CG-CD2 4.21Å; M345-Y428 HydrophobicContact CG-CG 4.42Å; S424-Y428 PolarHBondContact O-N 3.24Å; F425-Y428 HydrophobicContact CD2-CD1 4.21Å; F425-Y428 AromaticContact CE2-CD1 3.75Å; F425-Y428 HydrophobicContact CE2-CD1 3.75Å; F425-Y428 HydrophobicContact CE2-CE1 4.23Å; F425-Y428 HydrophobicContact CE2-CG 4.43Å; F425-Y428 HydrophobicContact CZ-CD1 4.24Å; F425-Y428 WeakPolarHBondContact O-CA 3.45Å; F425-Y428 WeakPolarHBondContact O-CB 3.14Å; F425-Y428 PolarHBondContact O-N 3.02Å; F425-Y428 VanDerWaalsContact O-N 3.1Å; Q426-Y428 PolarHBondContact O-N 3.43Å; Y428-V432 HydrophobicContact CD2-CB 3.77Å; Y428-V432 HydrophobicContact CD2-CG1 4.09Å; Y428-V432 HydrophobicContact CD2-CG2 3.8Å; Y428-V432 HydrophobicContact CE2-CB 3.76Å; Y428-V432 HydrophobicContact CE2-CG1 3.57Å; Y428-V432 HydrophobicContact CE2-CG2 4.16Å; Y428-V432 HydrophobicContact CG-CB 4.25Å; Y428-V432 HydrophobicContact CG-CG2 4.42Å; Y428-V432 WeakPolarHBondContact O-CA 3.29Å; Y428-V432 WeakPolarHBondContact O-CB 3.37Å; Y428-V432 PolarHBondContact O-N 2.87Å; Y428-F433 HydrophobicContact CD1-CB 4.49Å; Y428-F433 HydrophobicContact CE1-CB 3.7Å; Y428-F433 HydrophobicContact CE1-CD1 4.29Å; Y428-F433 PolarHBondContact O-N 3.45Å
429	L	97.6	Very high	94.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-50.9	174.3	-64.8	174.3	0	0	0	110.4	W278 Y391 F425 Q426 N431 F433 P434 L436 E437	W278-L429 HydrophobicContact CH2-CD1 4.45Å; Y391-L429 HydrophobicContact CD1-CD1 3.93Å; Y391-L429 HydrophobicContact CD2-CD1 4.41Å; Y391-L429 HydrophobicContact CE1-CD1 3.64Å; Y391-L429 HydrophobicContact CE2-CD1 4.15Å; Y391-L429 HydrophobicContact CG-CD1 4.3Å; F425-L429 HydrophobicContact CD1-CD1 4Å; F425-L429 HydrophobicContact CD1-CG 4.13Å; F425-L429 HydrophobicContact CE1-CD1 3.87Å; F425-L429 HydrophobicContact CE1-CD2 3.88Å; F425-L429 HydrophobicContact CE1-CG 3.88Å; F425-L429 HydrophobicContact CZ-CD2 4.1Å; F425-L429 HydrophobicContact CZ-CG 4.43Å; F425-L429 PolarHBondContact O-N 3Å; Q426-L429 WeakPolarHBondContact O-CB 3.43Å; Q426-L429 PolarHBondContact O-N 3.4Å; L429-N431 VanDerWaalsContact C-N 3.32Å; L429-N431 PolarHBondContact O-N 3.43Å; L429-F433 CarbonylContact O-C 3.5Å; L429-F433 PolarHBondContact O-N 2.98Å; L429-P434 WeakPolarHBondContact O-CA 3.48Å; L429-P434 WeakPolarHBondContact O-CB 3.42Å; L429-P434 VanDerWaalsContact O-CD 3.25Å; L429-P434 WeakPolarHBondContact O-CD 3.33Å; L429-L436 HydrophobicContact CD2-CB 3.99Å; L429-L436 HydrophobicContact CD2-CD2 3.92Å; L429-L436 HydrophobicContact CD2-CG 4.13Å; L429-E437 HydrophobicContact CB-CB 4.39Å; L429-E437 HydrophobicContact CD1-CB 4.25Å; L429-E437 HydrophobicContact CD1-CG 4.43Å; L429-E437 HydrophobicContact CD2-CB 4.41Å
430	D	97.1	Very high	92.9	Very high	88 Å²	88	42.9 Å²	42.9	47%	0.471	25%	0.247	S	C	.	.	H	α-helix	trans	-62.3	-37.1	-177	-59.7	-17.7	0	0	0	113.4	Q426 W427	Q426-D430 PolarHBondContact NE2-OD1 2.92Å; Q426-D430 VanDerWaalsContact O-CG 3.23Å; Q426-D430 PolarHBondContact O-N 3.48Å; W427-D430 PolarHBondContact O-N 2.97Å
431	N	96.9	Very high	90.9	Very high	74 Å²	74	46.9 Å²	46.9	40%	0.396	27%	0.269	S	S	.	.	H	α-helix	trans	-110.7	-20.9	-166.3	-65.7	-95.3	0	0	0	114.1	R303 W427 L429	R303-N431 PolarHBondContact NH1-O 2.91Å; R303-N431 PolarHBondContact NH2-O 3.2Å; W427-N431 HydrophobicContact CD2-CB 4.35Å; W427-N431 HydrophobicContact CZ2-CB 4.07Å; W427-N431 PolarHBondContact NE1-ND2 3.46Å; W427-N431 VanDerWaalsContact O-CB 3.25Å; W427-N431 WeakPolarHBondContact O-CB 3.48Å; W427-N431 PolarHBondContact O-N 3.42Å; W427-N431 PolarHBondContact O-ND2 2.85Å; L429-N431 VanDerWaalsContact C-N 3.32Å; L429-N431 PolarHBondContact O-N 3.43Å
432	V	96.9	Very high	88.7	Confident	8 Å²	8	48.8 Å²	48.8	5%	0.048	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-44.8	-172.6	-171.7	0	0	0	0	111.5	W344 W427 Y428	W344-V432 HydrophobicContact CB-CG2 4.11Å; W344-V432 HydrophobicContact CD2-CB 4.45Å; W344-V432 HydrophobicContact CD2-CG1 3.65Å; W344-V432 HydrophobicContact CD2-CG2 3.86Å; W344-V432 HydrophobicContact CE3-CG1 4.32Å; W344-V432 HydrophobicContact CE3-CG2 3.89Å; W344-V432 HydrophobicContact CG-CB 4.49Å; W344-V432 HydrophobicContact CG-CG1 3.74Å; W344-V432 HydrophobicContact CG-CG2 3.99Å; W344-V432 HydrophobicContact CZ2-CG1 4.27Å; W427-V432 HydrophobicContact CH2-CG2 4.32Å; W427-V432 HydrophobicContact CZ3-CG2 4.01Å; Y428-V432 HydrophobicContact CD2-CB 3.77Å; Y428-V432 HydrophobicContact CD2-CG1 4.09Å; Y428-V432 HydrophobicContact CD2-CG2 3.8Å; Y428-V432 HydrophobicContact CE2-CB 3.76Å; Y428-V432 HydrophobicContact CE2-CG1 3.57Å; Y428-V432 HydrophobicContact CE2-CG2 4.16Å; Y428-V432 HydrophobicContact CG-CB 4.25Å; Y428-V432 HydrophobicContact CG-CG2 4.42Å; Y428-V432 WeakPolarHBondContact O-CA 3.29Å; Y428-V432 WeakPolarHBondContact O-CB 3.37Å; Y428-V432 PolarHBondContact O-N 2.87Å
433	F	96.4	Very high	86	Confident	10 Å²	10	56.3 Å²	56.3	4%	0.044	31%	0.311	C	S	.	.			trans	-142.2	62.2	-173.7	-163.8	-163.2	0	0	0	113.6	T275 F276 P305 Y428 L429 E435 L436	T275-F433 HydrophobicContact CG2-CE2 4.03Å; T275-F433 HydrophobicContact CG2-CZ 3.95Å; F276-F433 HydrophobicContact CD1-CD1 4.34Å; F276-F433 HydrophobicContact CD1-CE1 4.1Å; F276-F433 AromaticContact CE1-CD1 3.99Å; F276-F433 HydrophobicContact CE1-CD1 3.99Å; F276-F433 HydrophobicContact CE1-CE1 4.19Å; F276-F433 HydrophobicContact CG-CE1 4.46Å; F276-F433 HydrophobicContact CZ-CD1 4.36Å; F276-F433 VanDerWaalsContact O-CE1 3.29Å; F276-F433 WeakPolarHBondContact O-CE1 3.32Å; P305-F433 HydrophobicContact CB-CB 3.94Å; P305-F433 HydrophobicContact CB-CD1 3.85Å; P305-F433 HydrophobicContact CB-CD2 4.24Å; P305-F433 HydrophobicContact CB-CE1 4.46Å; P305-F433 HydrophobicContact CB-CG 3.75Å; P305-F433 HydrophobicContact CG-CB 4.12Å; P305-F433 HydrophobicContact CG-CD1 4.42Å; P305-F433 HydrophobicContact CG-CD2 3.91Å; P305-F433 HydrophobicContact CG-CG 3.9Å; Y428-F433 HydrophobicContact CD1-CB 4.49Å; Y428-F433 HydrophobicContact CE1-CB 3.7Å; Y428-F433 HydrophobicContact CE1-CD1 4.29Å; Y428-F433 PolarHBondContact O-N 3.45Å; L429-F433 CarbonylContact O-C 3.5Å; L429-F433 PolarHBondContact O-N 2.98Å; F433-E435 HydrophobicContact CD2-CB 4.27Å; F433-E435 WeakPolarHBondContact CD2-OE2 3.22Å; F433-E435 HydrophobicContact CE2-CB 4.01Å; F433-E435 PolarHBondContact O-N 3.31Å; F433-L436 HydrophobicContact CD1-CB 3.61Å; F433-L436 HydrophobicContact CD1-CD2 3.91Å; F433-L436 HydrophobicContact CD1-CG 4.32Å; F433-L436 HydrophobicContact CD2-CB 4.26Å; F433-L436 HydrophobicContact CE1-CB 3.63Å; F433-L436 HydrophobicContact CE1-CD1 4.3Å; F433-L436 HydrophobicContact CE1-CD2 4.01Å; F433-L436 HydrophobicContact CE1-CG 4.19Å; F433-L436 HydrophobicContact CE2-CB 4.27Å; F433-L436 HydrophobicContact CG-CB 3.92Å; F433-L436 HydrophobicContact CZ-CB 3.93Å; F433-L436 WeakPolarHBondContact O-CB 3.3Å; F433-L436 PolarHBondContact O-N 2.94Å
434	P	94.2	Very high	85.4	Confident	63 Å²	63	53.6 Å²	53.6	41%	0.409	30%	0.303	S	S	.	.	H	α-helix	trans	-63.5	-24.4	-177.2	24	-34.8	0	0	0	113.3	L429 L436 E437 A438	L429-P434 WeakPolarHBondContact O-CA 3.48Å; L429-P434 WeakPolarHBondContact O-CB 3.42Å; L429-P434 VanDerWaalsContact O-CD 3.25Å; L429-P434 WeakPolarHBondContact O-CD 3.33Å; P434-L436 VanDerWaalsContact C-N 3.25Å; P434-L436 PolarHBondContact O-N 3.2Å; P434-E437 PolarHBondContact O-N 3.38Å; P434-A438 PolarHBondContact O-N 3.46Å
435	E	92.8	Very high	84.7	Confident	60 Å²	60	53.7 Å²	53.7	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-68.1	-25.5	179.5	-50.1	93.3	133.3	0	0	112.3	R273 F288 F433 S439	R273-E435 IonicContact CZ-OE1 2.7Å; R273-E435 VanDerWaalsContact CZ-OE1 3.3Å; R273-E435 IonicContact NH1-OE1 3.71Å; R273-E435 PolarHBondContact NH1-OE1 3.07Å; R273-E435 IonicContact NH2-OE1 3.28Å; R273-E435 PolarHBondContact NH2-OE1 3.35Å; F288-E435 WeakPolarHBondContact CE2-OE1 3.43Å; F288-E435 HydrophobicContact CZ-CG 4.25Å; F288-E435 WeakPolarHBondContact CZ-OE1 3.37Å; F433-E435 HydrophobicContact CD2-CB 4.27Å; F433-E435 WeakPolarHBondContact CD2-OE2 3.22Å; F433-E435 HydrophobicContact CE2-CB 4.01Å; F433-E435 PolarHBondContact O-N 3.31Å; E435-S439 PolarHBondContact O-N 3.43Å
436	L	91.9	Very high	83.9	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-66.9	-40.2	173.8	-178.9	59.7	0	0	0	111.2	F276 W278 F425 L429 F433 P434 S439	F276-L436 HydrophobicContact CD2-CD2 4.15Å; F276-L436 HydrophobicContact CE2-CD2 3.42Å; F276-L436 VanDerWaalsContact CE2-CD2 3.42Å; F276-L436 HydrophobicContact CZ-CD2 3.65Å; W278-L436 HydrophobicContact CD2-CD1 4.13Å; W278-L436 HydrophobicContact CD2-CG 4.41Å; W278-L436 HydrophobicContact CG-CD1 4.18Å; W278-L436 HydrophobicContact CH2-CD2 4.49Å; W278-L436 HydrophobicContact CH2-CG 4.44Å; W278-L436 HydrophobicContact CZ2-CD1 4.35Å; W278-L436 HydrophobicContact CZ2-CD2 4.33Å; W278-L436 HydrophobicContact CZ2-CG 3.81Å; W278-L436 PolarHBondContact NE1-O 3.41Å; F425-L436 HydrophobicContact CZ-CD2 4.31Å; L429-L436 HydrophobicContact CD2-CB 3.99Å; L429-L436 HydrophobicContact CD2-CD2 3.92Å; L429-L436 HydrophobicContact CD2-CG 4.13Å; F433-L436 HydrophobicContact CD1-CB 3.61Å; F433-L436 HydrophobicContact CD1-CD2 3.91Å; F433-L436 HydrophobicContact CD1-CG 4.32Å; F433-L436 HydrophobicContact CD2-CB 4.26Å; F433-L436 HydrophobicContact CE1-CB 3.63Å; F433-L436 HydrophobicContact CE1-CD1 4.3Å; F433-L436 HydrophobicContact CE1-CD2 4.01Å; F433-L436 HydrophobicContact CE1-CG 4.19Å; F433-L436 HydrophobicContact CE2-CB 4.27Å; F433-L436 HydrophobicContact CG-CB 3.92Å; F433-L436 HydrophobicContact CZ-CB 3.93Å; F433-L436 WeakPolarHBondContact O-CB 3.3Å; F433-L436 PolarHBondContact O-N 2.94Å; P434-L436 VanDerWaalsContact C-N 3.25Å; P434-L436 PolarHBondContact O-N 3.2Å; L436-S439 PolarHBondContact O-N 3.38Å; L436-S439 PolarHBondContact O-OG 2.76Å
437	E	82.2	Confident	83.1	Confident	55 Å²	55	57.2 Å²	57.2	26%	0.257	32%	0.322	S	S	.	.	H	α-helix	trans	-68	-43.2	178.2	-172	171.7	-161.8	0	0	111.2	Q426 L429 P434 S439 V440	Q426-E437 PolarHBondContact NE2-OE1 3.3Å; L429-E437 HydrophobicContact CB-CB 4.39Å; L429-E437 HydrophobicContact CD1-CB 4.25Å; L429-E437 HydrophobicContact CD1-CG 4.43Å; L429-E437 HydrophobicContact CD2-CB 4.41Å; P434-E437 PolarHBondContact O-N 3.38Å; E437-S439 PolarHBondContact O-N 2.88Å; E437-S439 VanDerWaalsContact O-N 3.1Å; E437-V440 WeakPolarHBondContact O-CB 3.41Å; E437-V440 PolarHBondContact O-N 3.26Å
438	A	73.2	Confident	82.2	Confident	60 Å²	60	56.1 Å²	56.1	50%	0.496	32%	0.324	S	S	.	.	H	α-helix	trans	-54.9	-31.7	174.5	0	0	0	0	0	112.9	P434 V440 N441	P434-A438 PolarHBondContact O-N 3.46Å; A438-V440 PolarHBondContact O-N 3.2Å; A438-N441 PolarHBondContact O-N 3.18Å
439	S	76.1	Confident	81.1	Confident	42 Å²	42	59.9 Å²	59.9	29%	0.294	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.7	177.7	76.7	0	0	0	0	115.1	W278 E435 L436 E437 S442	W278-S439 PolarHBondContact NE1-OG 2.93Å; E435-S439 PolarHBondContact O-N 3.43Å; L436-S439 PolarHBondContact O-N 3.38Å; L436-S439 PolarHBondContact O-OG 2.76Å; E437-S439 PolarHBondContact O-N 2.88Å; E437-S439 VanDerWaalsContact O-N 3.1Å; S439-S442 WeakPolarHBondContact CA-OG 3.41Å; S439-S442 PolarHBondContact O-OG 3.06Å
440	V	68.2	Low	79.9	Confident	28 Å²	28	64.1 Å²	64.1	17%	0.17	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-39.1	171.5	-176.9	0	0	0	0	110.3	W278 E437 A438 S442	W278-V440 HydrophobicContact CD2-CG2 4.31Å; W278-V440 HydrophobicContact CH2-CG2 4.48Å; W278-V440 HydrophobicContact CZ2-CG2 3.41Å; W278-V440 VanDerWaalsContact CZ2-CG2 3.41Å; E437-V440 WeakPolarHBondContact O-CB 3.41Å; E437-V440 PolarHBondContact O-N 3.26Å; A438-V440 PolarHBondContact O-N 3.2Å; V440-S442 VanDerWaalsContact C-N 3.29Å; V440-S442 PolarHBondContact O-N 3.2Å
441	N	57.3	Low	78.6	Confident	132 Å²	132	62.3 Å²	62.3	71%	0.706	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-4.1	-173.8	-63.3	-28.7	0	0	0	113.7	A438	A438-N441 PolarHBondContact O-N 3.18Å
442	S	51.6	Low	77	Confident	94 Å²	94	61.3 Å²	61.3	66%	0.657	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	1	177.4	59.3	0	0	0	0	114	S439 V440	S439-S442 WeakPolarHBondContact CA-OG 3.41Å; S439-S442 PolarHBondContact O-OG 3.06Å; V440-S442 VanDerWaalsContact C-N 3.29Å; V440-S442 PolarHBondContact O-N 3.2Å
443	L	43.6	Very low	75.2	Confident	181 Å²	181	66.2 Å²	66.2	95%	0.948	39%	0.389	S	S	*	.			trans	-102.1	0	171.1	-74.7	163.2	0	0	0	108.8	R398	R398-L443 VanDerWaalsContact NH2-CD1 3.26Å

Retrieved 443 of 443 residues in 139.6 ms (Link to these results)

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