A0A077Z3M7_TRITR Loading...

Protein FAM40A

AlphaFold DB , UniProt , Accession A0A077Z3M7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 306 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	41.8	Very low	51.3	Low	241 Å²	241	149.6 Å²	149.6	100%	1.187	77%	0.771	S	S	*	*				0	80.4	0	-84.6	172.2	165	0	0	107.2
2	N	41.4	Very low	51.7	Low	142 Å²	142	146.6 Å²	146.6	76%	0.759	75%	0.751	S	S	*	*			trans	-139.9	104.6	156.2	-97.4	4	0	0	0	103.2	D4	N2-D4 PolarHBondContact O-N 3.46Å
3	D	52	Low	52.3	Low	135 Å²	135	139.2 Å²	139.2	72%	0.722	72%	0.721	S	S	*	*			trans	-84.7	95	178.5	-179	10.4	0	0	0	106.6	W5	D3-W5 PolarHBondContact O-N 3.41Å
4	D	49.2	Very low	53.1	Low	121 Å²	121	139.5 Å²	139.5	65%	0.647	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-88.6	19.7	-174	-68.9	-23.7	0	0	0	112.5	N2 A6	N2-D4 PolarHBondContact O-N 3.46Å; D4-A6 VanDerWaalsContact C-N 3.32Å; D4-A6 PolarHBondContact O-N 3.42Å
5	W	57.4	Low	54	Low	238 Å²	238	137.9 Å²	137.9	90%	0.902	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-80.5	-7.6	-179.1	-79.3	49.8	0	0	0	114.3	D3	D3-W5 PolarHBondContact O-N 3.41Å
6	A	55.6	Low	55.1	Low	88 Å²	88	137 Å²	137	73%	0.727	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-89	-9.1	-175.2	0	0	0	0	0	115.4	D4	D4-A6 VanDerWaalsContact C-N 3.32Å; D4-A6 PolarHBondContact O-N 3.42Å
7	Y	51.1	Low	56.5	Low	216 Å²	216	136.6 Å²	136.6	85%	0.847	69%	0.694	S	S	*	*	S	Bend	trans	-103.3	3.3	-176.3	-78.3	-77	0	0	0	115
8	G	52.9	Low	57.9	Low	46 Å²	46	132.6 Å²	132.6	47%	0.474	68%	0.681	S	S	.	*	S	Bend	trans	-86.6	-11.1	-174.5	0	0	0	0	0	116.7
9	N	54.5	Low	59.1	Low	131 Å²	131	131.6 Å²	131.6	70%	0.701	67%	0.673	S	S	*	*	S	Bend	trans	-101.1	-12.6	-164.1	-96.2	10.4	0	0	0	116.6
10	E	52.9	Low	60.3	Low	171 Å²	171	132 Å²	132	80%	0.799	67%	0.672	S	S	*	*	H	α-helix	trans	-79.9	-27.8	-173.5	-69.5	-172.5	171.5	0	0	113.8	S13	E10-S13 PolarHBondContact O-OG 3.08Å; E10-S13 VanDerWaalsContact O-OG 3.08Å
11	T	55.5	Low	61.3	Low	117 Å²	117	129.5 Å²	129.5	72%	0.718	67%	0.666	S	S	*	*	H	α-helix	trans	-81.3	-33	-179.3	31.2	0	0	0	0	113.5
12	Q	56.2	Low	63.5	Low	113 Å²	113	121.5 Å²	121.5	53%	0.528	63%	0.634	S	S	.	*	H	α-helix	trans	-78.1	-25.7	177.9	-67.3	-170.9	9.6	0	0	113	Q14 D15 F16	Q12-Q14 VanDerWaalsContact C-N 3.28Å; Q12-Q14 PolarHBondContact O-N 3.09Å; Q12-D15 PolarHBondContact O-N 3.24Å; Q12-F16 HydrophobicContact CB-CD2 4.09Å; Q12-F16 HydrophobicContact CB-CE2 3.92Å; Q12-F16 WeakPolarHBondContact O-CD2 3.29Å; Q12-F16 PolarHBondContact O-N 3.27Å; Q12-F16 VanDerWaalsContact O-N 3.09Å
13	S	59.1	Low	65.7	Low	51 Å²	51	119.8 Å²	119.8	36%	0.357	62%	0.624	S	S	.	*	H	α-helix	trans	-63.5	-32.2	-175	60.2	0	0	0	0	113.4	E10 Q17	E10-S13 PolarHBondContact O-OG 3.08Å; E10-S13 VanDerWaalsContact O-OG 3.08Å; S13-Q17 WeakPolarHBondContact O-CB 3.25Å; S13-Q17 VanDerWaalsContact O-CG 3.25Å; S13-Q17 WeakPolarHBondContact O-CG 3.46Å; S13-Q17 PolarHBondContact O-N 2.68Å
14	Q	63.7	Low	67.4	Low	143 Å²	143	118.8 Å²	118.8	67%	0.668	62%	0.617	S	S	*	*	H	α-helix	trans	-70	-41.2	177.5	-71.5	-170.3	-4.9	0	0	112	Q12 Q17 S18	Q12-Q14 VanDerWaalsContact C-N 3.28Å; Q12-Q14 PolarHBondContact O-N 3.09Å; Q14-Q17 PolarHBondContact O-N 3.12Å; Q14-S18 PolarHBondContact O-N 2.88Å
15	D	67.3	Low	69.1	Low	116 Å²	116	116.3 Å²	116.3	62%	0.62	61%	0.609	S	S	*	*	H	α-helix	trans	-64.8	-44.3	177.7	-74	-17.7	0	0	0	110.7	Q12 Q17 S18 E19	Q12-D15 PolarHBondContact O-N 3.24Å; D15-Q17 PolarHBondContact O-N 3.01Å; D15-S18 WeakPolarHBondContact O-CB 3.16Å; D15-S18 PolarHBondContact O-N 3.42Å; D15-S18 VanDerWaalsContact O-N 3.12Å; D15-S18 PolarHBondContact O-OG 3.37Å; D15-E19 PolarHBondContact O-N 3.42Å
16	F	70.5	Confident	70.5	Confident	123 Å²	123	109.4 Å²	109.4	54%	0.539	59%	0.587	S	S	.	*	H	α-helix	trans	-60.7	-41.3	174.8	-77.7	-63.4	0	0	0	112.8	Q12 S18 E19 E20	Q12-F16 HydrophobicContact CB-CD2 4.09Å; Q12-F16 HydrophobicContact CB-CE2 3.92Å; Q12-F16 WeakPolarHBondContact O-CD2 3.29Å; Q12-F16 PolarHBondContact O-N 3.27Å; Q12-F16 VanDerWaalsContact O-N 3.09Å; F16-S18 VanDerWaalsContact C-N 3.28Å; F16-S18 PolarHBondContact O-N 3.33Å; F16-E19 PolarHBondContact O-N 3.06Å; F16-E20 VanDerWaalsContact O-CB 3.29Å; F16-E20 WeakPolarHBondContact O-CB 3.49Å; F16-E20 PolarHBondContact O-N 2.98Å
17	Q	79.7	Confident	71.8	Confident	130 Å²	130	108.8 Å²	108.8	61%	0.607	57%	0.574	S	S	*	*	H	α-helix	trans	-63	-36.6	175.4	-77.2	177.4	-1.3	0	0	112.1	S13 Q14 D15 S21	S13-Q17 WeakPolarHBondContact O-CB 3.25Å; S13-Q17 VanDerWaalsContact O-CG 3.25Å; S13-Q17 WeakPolarHBondContact O-CG 3.46Å; S13-Q17 PolarHBondContact O-N 2.68Å; Q14-Q17 PolarHBondContact O-N 3.12Å; D15-Q17 PolarHBondContact O-N 3.01Å; Q17-S21 VanDerWaalsContact O-CB 3.23Å; Q17-S21 WeakPolarHBondContact O-CB 3.46Å; Q17-S21 PolarHBondContact O-N 3.14Å
18	S	81.5	Confident	73.2	Confident	64 Å²	64	101.9 Å²	101.9	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-69.5	-39.8	178.4	80.6	0	0	0	0	112.4	Q14 D15 F16 S22	Q14-S18 PolarHBondContact O-N 2.88Å; D15-S18 WeakPolarHBondContact O-CB 3.16Å; D15-S18 PolarHBondContact O-N 3.42Å; D15-S18 VanDerWaalsContact O-N 3.12Å; D15-S18 PolarHBondContact O-OG 3.37Å; F16-S18 VanDerWaalsContact C-N 3.28Å; F16-S18 PolarHBondContact O-N 3.33Å; S18-S22 WeakPolarHBondContact O-CB 3.38Å; S18-S22 PolarHBondContact O-N 3.48Å; S18-S22 PolarHBondContact O-OG 3.44Å
19	E	80.5	Confident	74.4	Confident	115 Å²	115	107 Å²	107	54%	0.537	56%	0.556	S	S	.	*	H	α-helix	trans	-70.1	-45.4	177.7	-169.9	176.3	-172.8	0	0	110.7	D15 F16 S21 S22 L23	D15-E19 PolarHBondContact O-N 3.42Å; F16-E19 PolarHBondContact O-N 3.06Å; E19-S21 VanDerWaalsContact C-N 3.34Å; E19-S21 PolarHBondContact O-N 2.88Å; E19-S22 PolarHBondContact O-N 2.95Å; E19-S22 VanDerWaalsContact O-N 3.14Å; E19-L23 HydrophobicContact CG-CD1 4.22Å; E19-L23 WeakPolarHBondContact O-CB 3.35Å; E19-L23 WeakPolarHBondContact O-CG 3.23Å; E19-L23 PolarHBondContact O-N 2.89Å
20	E	82.5	Confident	75.6	Confident	139 Å²	139	105.6 Å²	105.6	65%	0.65	54%	0.544	S	S	*	.	H	α-helix	trans	-61.3	-42.8	175.9	-169.9	177.6	-167.2	0	0	111.1	F16 S22 L23 M24	F16-E20 VanDerWaalsContact O-CB 3.29Å; F16-E20 WeakPolarHBondContact O-CB 3.49Å; F16-E20 PolarHBondContact O-N 2.98Å; E20-S22 VanDerWaalsContact C-N 3.33Å; E20-S22 PolarHBondContact O-N 3.42Å; E20-L23 PolarHBondContact O-N 3.46Å; E20-M24 WeakPolarHBondContact O-CB 3.45Å; E20-M24 PolarHBondContact O-N 2.85Å
21	S	82.5	Confident	76.7	Confident	79 Å²	79	100.4 Å²	100.4	55%	0.552	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-37.5	174.7	-174.7	0	0	0	0	112.4	Q17 E19 S25	Q17-S21 VanDerWaalsContact O-CB 3.23Å; Q17-S21 WeakPolarHBondContact O-CB 3.46Å; Q17-S21 PolarHBondContact O-N 3.14Å; E19-S21 VanDerWaalsContact C-N 3.34Å; E19-S21 PolarHBondContact O-N 2.88Å; S21-S25 PolarHBondContact O-N 3.39Å; S21-S25 VanDerWaalsContact O-N 3.11Å
22	S	88.4	Confident	77.5	Confident	74 Å²	74	101.4 Å²	101.4	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-68.2	-45.1	177.5	-65.5	0	0	0	0	111	S18 E19 E20 M24 S25 E26	S18-S22 WeakPolarHBondContact O-CB 3.38Å; S18-S22 PolarHBondContact O-N 3.48Å; S18-S22 PolarHBondContact O-OG 3.44Å; E19-S22 PolarHBondContact O-N 2.95Å; E19-S22 VanDerWaalsContact O-N 3.14Å; E20-S22 VanDerWaalsContact C-N 3.33Å; E20-S22 PolarHBondContact O-N 3.42Å; S22-M24 PolarHBondContact O-N 3.34Å; S22-S25 PolarHBondContact O-N 3.26Å; S22-S25 PolarHBondContact O-OG 3.11Å; S22-E26 PolarHBondContact O-N 3.1Å; S22-E26 VanDerWaalsContact O-N 3.1Å
23	L	86.9	Confident	77.9	Confident	105 Å²	105	102.7 Å²	102.7	55%	0.55	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-44.6	175.7	-74.4	169.5	0	0	0	111.7	E19 E20 S25 E26 V27	E19-L23 HydrophobicContact CG-CD1 4.22Å; E19-L23 WeakPolarHBondContact O-CB 3.35Å; E19-L23 WeakPolarHBondContact O-CG 3.23Å; E19-L23 PolarHBondContact O-N 2.89Å; E20-L23 PolarHBondContact O-N 3.46Å; L23-S25 VanDerWaalsContact C-N 3.3Å; L23-S25 PolarHBondContact O-N 2.88Å; L23-E26 PolarHBondContact O-N 3.41Å; L23-V27 WeakPolarHBondContact O-CG2 3.36Å; L23-V27 PolarHBondContact O-N 3.49Å
24	M	88	Confident	78.2	Confident	114 Å²	114	108.4 Å²	108.4	56%	0.562	53%	0.534	S	S	*	.	H	α-helix	trans	-59.7	-42.4	177.2	-168.2	68.1	173.3	0	0	111.4	E20 S22 E26 V27 D28	E20-M24 WeakPolarHBondContact O-CB 3.45Å; E20-M24 PolarHBondContact O-N 2.85Å; S22-M24 PolarHBondContact O-N 3.34Å; M24-E26 VanDerWaalsContact C-N 3.32Å; M24-E26 PolarHBondContact O-N 2.94Å; M24-V27 PolarHBondContact O-N 3.18Å; M24-D28 WeakPolarHBondContact O-CB 3.4Å; M24-D28 PolarHBondContact O-N 2.95Å
25	S	85.6	Confident	78.5	Confident	69 Å²	69	109.6 Å²	109.6	48%	0.483	53%	0.533	S	S	.	.	H	α-helix	trans	-63.4	-37.1	177.4	80.1	0	0	0	0	112.8	S21 S22 L23 R29	S21-S25 PolarHBondContact O-N 3.39Å; S21-S25 VanDerWaalsContact O-N 3.11Å; S22-S25 PolarHBondContact O-N 3.26Å; S22-S25 PolarHBondContact O-OG 3.11Å; L23-S25 VanDerWaalsContact C-N 3.3Å; L23-S25 PolarHBondContact O-N 2.88Å; S25-R29 VanDerWaalsContact O-CB 3.3Å; S25-R29 WeakPolarHBondContact O-CB 3.49Å; S25-R29 PolarHBondContact O-N 3.47Å
26	E	86	Confident	78.3	Confident	94 Å²	94	106 Å²	106	44%	0.439	52%	0.523	S	S	.	.	H	α-helix	trans	-74	-36.7	179.5	-161.3	57.4	-141.6	0	0	111.3	S22 L23 M24 R29 F30 R33	S22-E26 PolarHBondContact O-N 3.1Å; S22-E26 VanDerWaalsContact O-N 3.1Å; L23-E26 PolarHBondContact O-N 3.41Å; M24-E26 VanDerWaalsContact C-N 3.32Å; M24-E26 PolarHBondContact O-N 2.94Å; E26-R29 PolarHBondContact O-N 2.81Å; E26-F30 PolarHBondContact O-N 3.47Å; E26-R33 IonicContact OE1-NH2 3.59Å; E26-R33 PolarHBondContact OE1-NH2 2.71Å
27	V	81.8	Confident	77.7	Confident	75 Å²	75	106.9 Å²	106.9	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-45.9	172.9	171.5	0	0	0	0	111.1	L23 M24 R29 F30 N31	L23-V27 WeakPolarHBondContact O-CG2 3.36Å; L23-V27 PolarHBondContact O-N 3.49Å; M24-V27 PolarHBondContact O-N 3.18Å; V27-R29 VanDerWaalsContact C-N 3.3Å; V27-R29 PolarHBondContact O-N 3.32Å; V27-F30 WeakPolarHBondContact O-CB 3.44Å; V27-F30 PolarHBondContact O-N 3.26Å; V27-N31 PolarHBondContact O-N 2.83Å; V27-N31 PolarHBondContact O-ND2 3.42Å
28	D	81.2	Confident	76.4	Confident	70 Å²	70	106 Å²	106	37%	0.374	54%	0.543	S	S	.	.	H	α-helix	trans	-62	-40.2	176.5	-81.3	-16.5	0	0	0	111.2	M24 F30 N31 M32	M24-D28 WeakPolarHBondContact O-CB 3.4Å; M24-D28 PolarHBondContact O-N 2.95Å; D28-F30 PolarHBondContact O-N 2.87Å; D28-N31 PolarHBondContact O-N 3.48Å; D28-M32 WeakPolarHBondContact O-CB 3.44Å; D28-M32 WeakPolarHBondContact O-CG 3.3Å; D28-M32 PolarHBondContact O-N 3.5Å
29	R	79.1	Confident	74.9	Confident	153 Å²	153	110.4 Å²	110.4	58%	0.577	56%	0.559	S	S	*	*	H	α-helix	trans	-63.1	-41.3	175.1	-159.6	180	-149.4	-173.1	6.2	112	S25 E26 V27 R33	S25-R29 VanDerWaalsContact O-CB 3.3Å; S25-R29 WeakPolarHBondContact O-CB 3.49Å; S25-R29 PolarHBondContact O-N 3.47Å; E26-R29 PolarHBondContact O-N 2.81Å; V27-R29 VanDerWaalsContact C-N 3.3Å; V27-R29 PolarHBondContact O-N 3.32Å; R29-R33 WeakPolarHBondContact O-CB 3.45Å; R29-R33 VanDerWaalsContact O-CG 3.28Å; R29-R33 WeakPolarHBondContact O-CG 3.37Å; R29-R33 PolarHBondContact O-N 3.15Å; R29-R33 PolarHBondContact O-NE 2.6Å
30	F	77.9	Confident	73.5	Confident	103 Å²	103	111.5 Å²	111.5	45%	0.452	57%	0.573	S	S	.	*	H	α-helix	trans	-62.2	-46.5	172.9	176.3	-94.1	0	0	0	111.9	E26 V27 D28 R33 R34	E26-F30 PolarHBondContact O-N 3.47Å; V27-F30 WeakPolarHBondContact O-CB 3.44Å; V27-F30 PolarHBondContact O-N 3.26Å; D28-F30 PolarHBondContact O-N 2.87Å; F30-R33 PolarHBondContact O-N 2.93Å; F30-R34 WeakPolarHBondContact O-CB 3.46Å; F30-R34 PolarHBondContact O-N 3.23Å
31	N	77	Confident	72.2	Confident	61 Å²	61	109 Å²	109	33%	0.326	57%	0.567	S	S	.	*	H	α-helix	trans	-65.3	-41.5	-179.8	-76	-27.3	0	0	0	112.3	V27 D28 R33 R34 Y35 G36	V27-N31 PolarHBondContact O-N 2.83Å; V27-N31 PolarHBondContact O-ND2 3.42Å; D28-N31 PolarHBondContact O-N 3.48Å; N31-R33 VanDerWaalsContact C-N 3.33Å; N31-R33 PolarHBondContact O-N 3.19Å; N31-R34 PolarHBondContact O-N 2.93Å; N31-Y35 HydrophobicContact CB-CD2 4.3Å; N31-Y35 WeakPolarHBondContact O-CA 3.35Å; N31-Y35 WeakPolarHBondContact O-CB 3.07Å; N31-Y35 PolarHBondContact O-N 3.42Å; N31-G36 PolarHBondContact O-N 2.98Å
32	M	71.2	Confident	71	Confident	138 Å²	138	108 Å²	108	68%	0.68	57%	0.569	S	S	*	*	H	α-helix	trans	-64.3	-36.3	174.2	-72.1	-174	-170.9	0	0	112.1	D28 G36	D28-M32 WeakPolarHBondContact O-CB 3.44Å; D28-M32 WeakPolarHBondContact O-CG 3.3Å; D28-M32 PolarHBondContact O-N 3.5Å; M32-G36 WeakPolarHBondContact O-CA 3.47Å; M32-G36 PolarHBondContact O-N 3.17Å
33	R	65.4	Low	69.6	Low	141 Å²	141	111.5 Å²	111.5	53%	0.532	58%	0.582	S	S	.	*	H	α-helix	trans	-67.6	-40.4	174.4	-75.9	-179.5	-65.8	-141.3	-2	112.4	E26 R29 F30 N31	E26-R33 IonicContact OE1-NH2 3.59Å; E26-R33 PolarHBondContact OE1-NH2 2.71Å; R29-R33 WeakPolarHBondContact O-CB 3.45Å; R29-R33 VanDerWaalsContact O-CG 3.28Å; R29-R33 WeakPolarHBondContact O-CG 3.37Å; R29-R33 PolarHBondContact O-N 3.15Å; R29-R33 PolarHBondContact O-NE 2.6Å; F30-R33 PolarHBondContact O-N 2.93Å; N31-R33 VanDerWaalsContact C-N 3.33Å; N31-R33 PolarHBondContact O-N 3.19Å
34	R	65.3	Low	68.2	Low	171 Å²	171	114.2 Å²	114.2	65%	0.645	59%	0.59	S	S	*	*	H	α-helix	trans	-88.5	-33	-171.7	-168.2	153.9	-177.8	89.3	-1.2	114	F30 N31	F30-R34 WeakPolarHBondContact O-CB 3.46Å; F30-R34 PolarHBondContact O-N 3.23Å; N31-R34 PolarHBondContact O-N 2.93Å
35	Y	70.2	Confident	67	Low	167 Å²	167	116 Å²	116	66%	0.655	60%	0.597	S	S	*	*	H	α-helix	trans	-121	-12	-176.1	-51.9	-66.2	0	0	0	113.3	N31 T37	N31-Y35 HydrophobicContact CB-CD2 4.3Å; N31-Y35 WeakPolarHBondContact O-CA 3.35Å; N31-Y35 WeakPolarHBondContact O-CB 3.07Å; N31-Y35 PolarHBondContact O-N 3.42Å; Y35-T37 PolarHBondContact O-N 3.09Å
36	G	62.1	Low	65.8	Low	40 Å²	40	118.7 Å²	118.7	41%	0.412	61%	0.612	S	S	.	*			trans	-73.8	126.9	178.8	0	0	0	0	0	111.3	N31 M32 T38	N31-G36 PolarHBondContact O-N 2.98Å; M32-G36 WeakPolarHBondContact O-CA 3.47Å; M32-G36 PolarHBondContact O-N 3.17Å; G36-T38 PolarHBondContact O-N 3.35Å
37	T	57.9	Low	64.9	Low	142 Å²	142	120.9 Å²	120.9	87%	0.871	63%	0.626	S	S	*	*	S	Bend	trans	-70.7	-14.9	-174.8	-51.3	0	0	0	0	113.8	Y35	Y35-T37 PolarHBondContact O-N 3.09Å
38	T	53	Low	64.4	Low	112 Å²	112	121.5 Å²	121.5	69%	0.687	63%	0.627	S	S	*	*	S	Bend	trans	-116.8	-4.5	-154.9	-29.8	0	0	0	0	116.7	G36	G36-T38 PolarHBondContact O-N 3.35Å
39	M	50.3	Low	64.1	Low	157 Å²	157	124.6 Å²	124.6	77%	0.773	64%	0.644	S	S	*	*			trans	-126.5	84.6	-175.9	-66.6	-81.2	94.6	0	0	112.3	V41	M39-V41 PolarHBondContact O-N 3.48Å; M39-V41 VanDerWaalsContact O-N 3.07Å
40	T	52	Low	64.1	Low	137 Å²	137	121.2 Å²	121.2	84%	0.84	64%	0.637	S	S	*	*			trans	-69.3	89.6	163.5	48.4	0	0	0	0	109.2
41	V	55.1	Low	64	Low	86 Å²	86	121.3 Å²	121.3	52%	0.521	65%	0.646	S	S	.	*			trans	-84.4	109.1	163.6	-176.7	0	0	0	0	105.9	M39 D43 F44	M39-V41 PolarHBondContact O-N 3.48Å; M39-V41 VanDerWaalsContact O-N 3.07Å; V41-D43 PolarHBondContact O-N 3.27Å; V41-F44 HydrophobicContact CB-CD2 4.29Å; V41-F44 HydrophobicContact CG1-CD2 3.97Å; V41-F44 HydrophobicContact CG1-CE2 4.39Å; V41-F44 PolarHBondContact O-N 2.94Å
42	G	56.6	Low	64	Low	58 Å²	58	124.2 Å²	124.2	60%	0.598	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-15.1	-163.7	0	0	0	0	0	117.1
43	D	58.5	Low	64.4	Low	149 Å²	149	119.9 Å²	119.9	80%	0.797	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-5.8	178.1	-58.6	-24.3	0	0	0	113.4	V41	V41-D43 PolarHBondContact O-N 3.27Å
44	F	57.4	Low	64.8	Low	162 Å²	162	117.5 Å²	117.5	71%	0.711	64%	0.644	S	S	*	*			trans	-122.5	36.8	-176.4	-59.9	-75.9	0	0	0	112.5	V41	V41-F44 HydrophobicContact CB-CD2 4.29Å; V41-F44 HydrophobicContact CG1-CD2 3.97Å; V41-F44 HydrophobicContact CG1-CE2 4.39Å; V41-F44 PolarHBondContact O-N 2.94Å
45	E	62.6	Low	65.2	Low	152 Å²	152	116.4 Å²	116.4	71%	0.71	65%	0.651	S	S	*	*			trans	-62	139.7	167.9	-66.7	-164.1	162.5	0	0	110.1	L47	E45-L47 PolarHBondContact O-N 3.07Å
46	P	60.9	Low	65.6	Low	124 Å²	124	111.2 Å²	111.2	81%	0.805	65%	0.648	S	S	*	*			trans	-59.7	114.1	176.3	22.3	-30.5	0	0	0	109.8	D48	P46-D48 PolarHBondContact O-N 3.26Å
47	L	67.1	Low	66.3	Low	140 Å²	140	113.3 Å²	113.3	73%	0.733	65%	0.653	S	S	*	*			trans	-63.2	122.4	177.1	-175	67	0	0	0	109.7	E45 N49	E45-L47 PolarHBondContact O-N 3.07Å; L47-N49 WeakPolarHBondContact CD2-OD1 3.29Å; L47-N49 WeakPolarHBondContact CG-OD1 3.28Å; L47-N49 PolarHBondContact O-N 3.41Å
48	D	71.9	Confident	67.1	Low	88 Å²	88	112.7 Å²	112.7	47%	0.471	65%	0.651	S	S	.	*			trans	-72.3	97.5	175.9	-174.6	4.9	0	0	0	110.5	P46 N50 S53	P46-D48 PolarHBondContact O-N 3.26Å; D48-N50 VanDerWaalsContact C-N 3.28Å; D48-N50 VanDerWaalsContact OD1-CB 3.29Å; D48-N50 WeakPolarHBondContact OD1-CB 3.4Å; D48-N50 PolarHBondContact OD1-N 3.03Å; D48-S53 WeakPolarHBondContact OD2-CB 3.46Å; D48-S53 PolarHBondContact OD2-OG 3.38Å
49	N	75.2	Confident	68.3	Low	135 Å²	135	114.4 Å²	114.4	72%	0.722	65%	0.65	S	S	*	*			trans	-88.9	8.6	177	-66.7	-21.9	0	0	0	112.7	L47 V51	L47-N49 WeakPolarHBondContact CD2-OD1 3.29Å; L47-N49 WeakPolarHBondContact CG-OD1 3.28Å; L47-N49 PolarHBondContact O-N 3.41Å; N49-V51 PolarHBondContact O-N 3.24Å
50	N	78.3	Confident	69.7	Low	83 Å²	83	113.4 Å²	113.4	44%	0.444	65%	0.652	S	S	.	*			trans	-86.6	107.5	-179.1	-171.7	-6.3	0	0	0	110.7	D48 I52 S53 V54	D48-N50 VanDerWaalsContact C-N 3.28Å; D48-N50 VanDerWaalsContact OD1-CB 3.29Å; D48-N50 WeakPolarHBondContact OD1-CB 3.4Å; D48-N50 PolarHBondContact OD1-N 3.03Å; N50-I52 PolarHBondContact O-N 3.31Å; N50-I52 VanDerWaalsContact O-N 3.1Å; N50-I52 WeakPolarHBondContact OD1-CB 3.47Å; N50-I52 PolarHBondContact OD1-N 3.13Å; N50-S53 WeakPolarHBondContact O-CA 3.49Å; N50-S53 VanDerWaalsContact O-CB 3.24Å; N50-S53 WeakPolarHBondContact O-CB 3.48Å; N50-S53 PolarHBondContact O-N 3Å; N50-V54 PolarHBondContact O-N 2.89Å
51	V	75	Confident	70.9	Confident	104 Å²	104	111.5 Å²	111.5	63%	0.63	63%	0.633	S	S	*	*	H	α-helix	trans	-54.2	-30.1	175.8	-67	0	0	0	0	113.5	N49 S53 V54 L55	N49-V51 PolarHBondContact O-N 3.24Å; V51-S53 VanDerWaalsContact C-N 3.31Å; V51-V54 PolarHBondContact O-N 3.15Å; V51-L55 WeakPolarHBondContact O-CB 3.31Å; V51-L55 VanDerWaalsContact O-CG 3.32Å; V51-L55 WeakPolarHBondContact O-CG 3.06Å; V51-L55 PolarHBondContact O-N 3.1Å
52	I	78.1	Confident	72.2	Confident	122 Å²	122	110.9 Å²	110.9	63%	0.626	63%	0.633	S	S	*	*	H	α-helix	trans	-68.4	-34.1	176.7	-62.6	173.1	0	0	0	110.9	N50 G56	N50-I52 PolarHBondContact O-N 3.31Å; N50-I52 VanDerWaalsContact O-N 3.1Å; N50-I52 WeakPolarHBondContact OD1-CB 3.47Å; N50-I52 PolarHBondContact OD1-N 3.13Å; I52-G56 PolarHBondContact O-N 3.33Å
53	S	78.5	Confident	73	Confident	48 Å²	48	113.9 Å²	113.9	34%	0.336	64%	0.635	S	S	.	*	H	α-helix	trans	-65.5	-47.7	176.9	-173.2	0	0	0	0	110.5	D48 N50 V51 L55 G56 T57	D48-S53 WeakPolarHBondContact OD2-CB 3.46Å; D48-S53 PolarHBondContact OD2-OG 3.38Å; N50-S53 WeakPolarHBondContact O-CA 3.49Å; N50-S53 VanDerWaalsContact O-CB 3.24Å; N50-S53 WeakPolarHBondContact O-CB 3.48Å; N50-S53 PolarHBondContact O-N 3Å; V51-S53 VanDerWaalsContact C-N 3.31Å; S53-L55 PolarHBondContact O-N 3.45Å; S53-G56 PolarHBondContact O-N 3.1Å; S53-G56 VanDerWaalsContact O-N 3.14Å; S53-T57 WeakPolarHBondContact O-CG2 3.28Å; S53-T57 PolarHBondContact O-N 3.04Å
54	V	75.6	Confident	73.5	Confident	90 Å²	90	115.7 Å²	115.7	55%	0.545	63%	0.631	S	S	.	*	H	α-helix	trans	-57.7	-49.6	174.9	178.2	0	0	0	0	111.3	N50 V51 G56 T57	N50-V54 PolarHBondContact O-N 2.89Å; V51-V54 PolarHBondContact O-N 3.15Å; V54-G56 PolarHBondContact O-N 2.97Å; V54-T57 PolarHBondContact O-N 2.85Å; V54-T57 PolarHBondContact O-OG1 3.32Å
55	L	73.5	Confident	74.3	Confident	149 Å²	149	112.8 Å²	112.8	78%	0.78	62%	0.618	S	S	*	*	H	α-helix	trans	-69.2	-22.1	179.5	-67.9	174.7	0	0	0	113.4	V51 S53	V51-L55 WeakPolarHBondContact O-CB 3.31Å; V51-L55 VanDerWaalsContact O-CG 3.32Å; V51-L55 WeakPolarHBondContact O-CG 3.06Å; V51-L55 PolarHBondContact O-N 3.1Å; S53-L55 PolarHBondContact O-N 3.45Å
56	G	78.4	Confident	74.9	Confident	58 Å²	58	111.4 Å²	111.4	60%	0.598	61%	0.606	S	S	*	*	H	α-helix	trans	-82.9	-16.2	175.2	0	0	0	0	0	113.8	I52 S53 V54 P58	I52-G56 PolarHBondContact O-N 3.33Å; S53-G56 PolarHBondContact O-N 3.1Å; S53-G56 VanDerWaalsContact O-N 3.14Å; V54-G56 PolarHBondContact O-N 2.97Å; G56-P58 WeakPolarHBondContact O-CD 3.37Å
57	T	76.3	Confident	75.5	Confident	83 Å²	83	111.3 Å²	111.3	51%	0.509	59%	0.593	S	S	.	*	S	Bend	trans	-62.8	126.5	176.1	59.1	0	0	0	0	110	S53 V54 F59	S53-T57 WeakPolarHBondContact O-CG2 3.28Å; S53-T57 PolarHBondContact O-N 3.04Å; V54-T57 PolarHBondContact O-N 2.85Å; V54-T57 PolarHBondContact O-OG1 3.32Å; T57-F59 PolarHBondContact O-N 3.47Å
58	P	74.3	Confident	75.5	Confident	129 Å²	129	108.6 Å²	108.6	84%	0.838	58%	0.579	S	S	*	*			trans	-66.3	105.8	177.6	23.7	-30	0	0	0	109.3	G56	G56-P58 WeakPolarHBondContact O-CD 3.37Å
59	F	77.9	Confident	75.5	Confident	149 Å²	149	109.7 Å²	109.7	65%	0.654	58%	0.578	S	S	*	*			trans	-93.3	116.9	175.8	-175.2	-92.5	0	0	0	109.8	T57 H61	T57-F59 PolarHBondContact O-N 3.47Å; F59-H61 AromaticContact CD1-CE1 3.53Å; F59-H61 AromaticContact CD1-CG 3.93Å; F59-H61 AromaticContact CD1-ND1 3.47Å; F59-H61 WeakPolarHBondContact CD1-ND1 3.29Å; F59-H61 AromaticContact CD1-NE2 4Å; F59-H61 AromaticContact CE1-ND1 3.58Å; F59-H61 PolarHBondContact O-N 3.14Å
60	V	80.1	Confident	75.3	Confident	135 Å²	135	107.3 Å²	107.3	82%	0.818	56%	0.562	S	S	*	*			trans	-79.5	102.8	175.9	-176.8	0	0	0	0	108.6
61	H	78.3	Confident	74.9	Confident	97 Å²	97	108.8 Å²	108.8	45%	0.449	57%	0.565	S	S	.	*			trans	-66.3	144.1	173.5	-61.4	-78.7	0	0	0	111.1	F59 F65	F59-H61 AromaticContact CD1-CE1 3.53Å; F59-H61 AromaticContact CD1-CG 3.93Å; F59-H61 AromaticContact CD1-ND1 3.47Å; F59-H61 WeakPolarHBondContact CD1-ND1 3.29Å; F59-H61 AromaticContact CD1-NE2 4Å; F59-H61 AromaticContact CE1-ND1 3.58Å; F59-H61 PolarHBondContact O-N 3.14Å; H61-F65 HydrophobicContact CB-CB 4.33Å; H61-F65 HydrophobicContact CB-CD1 3.63Å; H61-F65 HydrophobicContact CB-CE1 4.37Å; H61-F65 HydrophobicContact CB-CG 4.29Å; H61-F65 AromaticContact CE1-CE1 3.78Å; H61-F65 AromaticContact CG-CD1 3.6Å; H61-F65 AromaticContact CG-CE1 3.84Å; H61-F65 AromaticContact ND1-CD1 3.42Å; H61-F65 WeakPolarHBondContact ND1-CD1 3.44Å; H61-F65 AromaticContact ND1-CE1 3.39Å; H61-F65 WeakPolarHBondContact ND1-CE1 2.99Å
62	S	80.9	Confident	75.1	Confident	73 Å²	73	109.9 Å²	109.9	51%	0.51	56%	0.558	S	S	.	*			trans	-63.8	151.8	172.7	66.2	0	0	0	0	111.3	R64 F65 R66	S62-R64 PolarHBondContact O-N 3.49Å; S62-R64 VanDerWaalsContact O-N 3.14Å; S62-F65 WeakPolarHBondContact O-CB 3.38Å; S62-F65 PolarHBondContact O-N 3.12Å; S62-F65 PolarHBondContact OG-N 3.06Å; S62-R66 PolarHBondContact O-N 3.43Å
63	D	73.9	Confident	74.6	Confident	121 Å²	121	107.2 Å²	107.2	65%	0.647	54%	0.544	S	S	*	.	H	α-helix	trans	-55.9	-33.5	176.3	-78.8	-47.2	0	0	0	112.7	R66 K67	D63-R66 IonicContact OD1-NH2 2.99Å; D63-K67 WeakPolarHBondContact O-CB 3.25Å; D63-K67 PolarHBondContact O-N 3.35Å
64	R	69.2	Low	74.2	Confident	188 Å²	188	110.8 Å²	110.8	71%	0.709	56%	0.556	S	S	*	*	H	α-helix	trans	-63	-46.3	174.9	-169.3	-179.3	99.4	-178.8	7	111.4	S62 N68	S62-R64 PolarHBondContact O-N 3.49Å; S62-R64 VanDerWaalsContact O-N 3.14Å; R64-N68 WeakPolarHBondContact O-CB 3.42Å; R64-N68 PolarHBondContact O-N 3.17Å; R64-N68 VanDerWaalsContact O-N 3.09Å
65	F	75	Confident	73.6	Confident	101 Å²	101	113.3 Å²	113.3	44%	0.443	56%	0.557	S	S	.	*	H	α-helix	trans	-62.9	-49.7	177.9	-179.9	-89	0	0	0	110.6	H61 S62 K67 N68 Y69	H61-F65 HydrophobicContact CB-CB 4.33Å; H61-F65 HydrophobicContact CB-CD1 3.63Å; H61-F65 HydrophobicContact CB-CE1 4.37Å; H61-F65 HydrophobicContact CB-CG 4.29Å; H61-F65 AromaticContact CE1-CE1 3.78Å; H61-F65 AromaticContact CG-CD1 3.6Å; H61-F65 AromaticContact CG-CE1 3.84Å; H61-F65 AromaticContact ND1-CD1 3.42Å; H61-F65 WeakPolarHBondContact ND1-CD1 3.44Å; H61-F65 AromaticContact ND1-CE1 3.39Å; H61-F65 WeakPolarHBondContact ND1-CE1 2.99Å; S62-F65 WeakPolarHBondContact O-CB 3.38Å; S62-F65 PolarHBondContact O-N 3.12Å; S62-F65 PolarHBondContact OG-N 3.06Å; F65-K67 VanDerWaalsContact C-N 3.33Å; F65-K67 PolarHBondContact O-N 3.09Å; F65-N68 PolarHBondContact O-N 3.1Å; F65-N68 VanDerWaalsContact O-N 3.15Å; F65-Y69 HydrophobicContact CE1-CG 4.33Å; F65-Y69 HydrophobicContact CZ-CD2 4.45Å; F65-Y69 VanDerWaalsContact O-CB 3.3Å; F65-Y69 WeakPolarHBondContact O-CB 3.31Å; F65-Y69 PolarHBondContact O-N 3.44Å
66	R	75.2	Confident	73	Confident	122 Å²	122	109.8 Å²	109.8	46%	0.46	54%	0.536	S	S	.	.	H	α-helix	trans	-56.4	-47	-179.8	-172.9	-178.2	59.5	73.8	0	111.8	S62 D63 N68 Y69 E70	S62-R66 PolarHBondContact O-N 3.43Å; D63-R66 IonicContact OD1-NH2 2.99Å; R66-N68 PolarHBondContact O-N 3.11Å; R66-Y69 PolarHBondContact O-N 3.33Å; R66-E70 IonicContact CZ-OE1 3.47Å; R66-E70 IonicContact NH1-OE1 3.38Å; R66-E70 PolarHBondContact NH1-OE1 3.44Å; R66-E70 IonicContact NH1-OE2 3.39Å; R66-E70 PolarHBondContact NH1-OE2 3.45Å; R66-E70 WeakPolarHBondContact O-CG 3.46Å; R66-E70 PolarHBondContact O-N 3.47Å
67	K	72.6	Confident	72.1	Confident	122 Å²	122	114.1 Å²	114.1	53%	0.53	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-37.9	178.8	-174.7	175.1	-177.2	176.5	0	113.2	D63 F65 K71	D63-K67 WeakPolarHBondContact O-CB 3.25Å; D63-K67 PolarHBondContact O-N 3.35Å; F65-K67 VanDerWaalsContact C-N 3.33Å; F65-K67 PolarHBondContact O-N 3.09Å; K67-K71 WeakPolarHBondContact O-CG 3.48Å; K67-K71 PolarHBondContact O-N 3.25Å
68	N	68.3	Low	71.1	Confident	84 Å²	84	114 Å²	114	45%	0.449	54%	0.537	S	S	.	.	H	α-helix	trans	-75.5	-34.9	177.9	-73	-12.3	0	0	0	111.8	R64 F65 R66 K71 W72	R64-N68 WeakPolarHBondContact O-CB 3.42Å; R64-N68 PolarHBondContact O-N 3.17Å; R64-N68 VanDerWaalsContact O-N 3.09Å; F65-N68 PolarHBondContact O-N 3.1Å; F65-N68 VanDerWaalsContact O-N 3.15Å; R66-N68 PolarHBondContact O-N 3.11Å; N68-K71 PolarHBondContact O-N 3.01Å; N68-W72 WeakPolarHBondContact O-CB 3.31Å; N68-W72 PolarHBondContact O-N 3.03Å
69	Y	70.3	Confident	70	Confident	110 Å²	110	111.3 Å²	111.3	43%	0.431	52%	0.516	S	S	.	.	H	α-helix	trans	-66.7	-42.4	176	-175.3	-107.2	0	0	0	111.8	F65 R66 K71 W72 L73	F65-Y69 HydrophobicContact CE1-CG 4.33Å; F65-Y69 HydrophobicContact CZ-CD2 4.45Å; F65-Y69 VanDerWaalsContact O-CB 3.3Å; F65-Y69 WeakPolarHBondContact O-CB 3.31Å; F65-Y69 PolarHBondContact O-N 3.44Å; R66-Y69 PolarHBondContact O-N 3.33Å; Y69-K71 PolarHBondContact O-N 3Å; Y69-W72 AromaticContact CD2-CE3 3.97Å; Y69-W72 HydrophobicContact CD2-CE3 3.97Å; Y69-W72 HydrophobicContact CD2-CZ3 4.45Å; Y69-W72 AromaticContact CE2-CE3 3.69Å; Y69-W72 HydrophobicContact CE2-CE3 3.69Å; Y69-W72 AromaticContact CE2-CZ3 3.72Å; Y69-W72 HydrophobicContact CE2-CZ3 3.72Å; Y69-W72 PolarHBondContact O-N 3.01Å; Y69-W72 VanDerWaalsContact O-N 3.15Å; Y69-L73 HydrophobicContact CD1-CD1 3.88Å; Y69-L73 HydrophobicContact CD1-CG 4.37Å; Y69-L73 HydrophobicContact CE1-CD1 3.47Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.47Å; Y69-L73 HydrophobicContact CE1-CD2 4.49Å; Y69-L73 HydrophobicContact CE1-CG 4Å; Y69-L73 PolarHBondContact O-N 2.92Å
70	E	72.6	Confident	68.5	Low	86 Å²	86	114.3 Å²	114.3	40%	0.402	52%	0.524	S	S	.	.	H	α-helix	trans	-57	-47.5	172.1	-76.7	166.7	-169.7	0	0	111.4	R66 W72 L73 E74	R66-E70 IonicContact CZ-OE1 3.47Å; R66-E70 IonicContact NH1-OE1 3.38Å; R66-E70 PolarHBondContact NH1-OE1 3.44Å; R66-E70 IonicContact NH1-OE2 3.39Å; R66-E70 PolarHBondContact NH1-OE2 3.45Å; R66-E70 WeakPolarHBondContact O-CG 3.46Å; R66-E70 PolarHBondContact O-N 3.47Å; E70-W72 VanDerWaalsContact C-N 3.31Å; E70-W72 PolarHBondContact O-N 3.07Å; E70-L73 PolarHBondContact O-N 3.09Å; E70-E74 WeakPolarHBondContact O-CG 3.34Å; E70-E74 PolarHBondContact O-N 2.9Å
71	K	69.2	Low	66.9	Low	114 Å²	114	112.2 Å²	112.2	50%	0.496	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-36.6	175.2	-72.2	177.3	177.7	-172.7	0	113.3	K67 N68 Y69 Y75	K67-K71 WeakPolarHBondContact O-CG 3.48Å; K67-K71 PolarHBondContact O-N 3.25Å; N68-K71 PolarHBondContact O-N 3.01Å; Y69-K71 PolarHBondContact O-N 3Å; K71-Y75 VanDerWaalsContact O-CB 3.3Å; K71-Y75 WeakPolarHBondContact O-CB 3.28Å; K71-Y75 PolarHBondContact O-N 3.12Å
72	W	78.6	Confident	64.8	Low	126 Å²	126	113.8 Å²	113.8	48%	0.477	52%	0.521	S	S	.	.	H	α-helix	trans	-67.8	-41.1	176.9	174.8	78.7	0	0	0	111.1	N68 Y69 E70 Y75 E76	N68-W72 WeakPolarHBondContact O-CB 3.31Å; N68-W72 PolarHBondContact O-N 3.03Å; Y69-W72 AromaticContact CD2-CE3 3.97Å; Y69-W72 HydrophobicContact CD2-CE3 3.97Å; Y69-W72 HydrophobicContact CD2-CZ3 4.45Å; Y69-W72 AromaticContact CE2-CE3 3.69Å; Y69-W72 HydrophobicContact CE2-CE3 3.69Å; Y69-W72 AromaticContact CE2-CZ3 3.72Å; Y69-W72 HydrophobicContact CE2-CZ3 3.72Å; Y69-W72 PolarHBondContact O-N 3.01Å; Y69-W72 VanDerWaalsContact O-N 3.15Å; E70-W72 VanDerWaalsContact C-N 3.31Å; E70-W72 PolarHBondContact O-N 3.07Å; W72-Y75 PolarHBondContact O-N 2.66Å; W72-E76 HydrophobicContact CD2-CG 4.1Å; W72-E76 VanDerWaalsContact CE2-CG 3.5Å; W72-E76 HydrophobicContact CH2-CG 4.13Å; W72-E76 HydrophobicContact CZ2-CG 3.54Å; W72-E76 PolarHBondContact O-N 3.15Å
73	L	68.5	Low	62.5	Low	67 Å²	67	115.7 Å²	115.7	35%	0.351	53%	0.53	S	S	.	.	H	α-helix	trans	-60.8	-46.1	173	-75.7	172.7	0	0	0	111.5	Y69 E70 Y75 E76 E77	Y69-L73 HydrophobicContact CD1-CD1 3.88Å; Y69-L73 HydrophobicContact CD1-CG 4.37Å; Y69-L73 HydrophobicContact CE1-CD1 3.47Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.47Å; Y69-L73 HydrophobicContact CE1-CD2 4.49Å; Y69-L73 HydrophobicContact CE1-CG 4Å; Y69-L73 PolarHBondContact O-N 2.92Å; E70-L73 PolarHBondContact O-N 3.09Å; L73-Y75 VanDerWaalsContact C-N 3.27Å; L73-Y75 PolarHBondContact O-N 2.65Å; L73-E76 PolarHBondContact O-N 2.96Å; L73-E77 WeakPolarHBondContact O-CB 3.44Å; L73-E77 WeakPolarHBondContact O-CG 3.31Å; L73-E77 PolarHBondContact O-N 3.02Å
74	E	69.6	Low	60.4	Low	122 Å²	122	118.3 Å²	118.3	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-58	-41.7	174.5	-71.7	171.9	178.9	0	0	111.3	E70 D78	E70-E74 WeakPolarHBondContact O-CG 3.34Å; E70-E74 PolarHBondContact O-N 2.9Å; E74-D78 VanDerWaalsContact O-CB 3.26Å; E74-D78 WeakPolarHBondContact O-CB 3.38Å; E74-D78 PolarHBondContact O-N 3.29Å
75	Y	63.3	Low	58.4	Low	144 Å²	144	115.9 Å²	115.9	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-71	-38.9	180	-173.2	-105.4	0	0	0	113.1	K71 W72 L73 N79	K71-Y75 VanDerWaalsContact O-CB 3.3Å; K71-Y75 WeakPolarHBondContact O-CB 3.28Å; K71-Y75 PolarHBondContact O-N 3.12Å; W72-Y75 PolarHBondContact O-N 2.66Å; L73-Y75 VanDerWaalsContact C-N 3.27Å; L73-Y75 PolarHBondContact O-N 2.65Å; Y75-N79 WeakPolarHBondContact CD1-ND2 3.2Å; Y75-N79 WeakPolarHBondContact CE1-ND2 3.45Å; Y75-N79 WeakPolarHBondContact O-CB 3.46Å; Y75-N79 VanDerWaalsContact O-CG 3.32Å; Y75-N79 PolarHBondContact O-N 3.17Å; Y75-N79 PolarHBondContact OH-ND2 3.49Å
76	E	61.1	Low	56.1	Low	74 Å²	74	120.7 Å²	120.7	35%	0.346	56%	0.562	S	S	.	*	H	α-helix	trans	-68.6	-44.6	174.4	-82.2	-68	158.6	0	0	111.8	W72 L73 D78 N79 Y80	W72-E76 HydrophobicContact CD2-CG 4.1Å; W72-E76 VanDerWaalsContact CE2-CG 3.5Å; W72-E76 HydrophobicContact CH2-CG 4.13Å; W72-E76 HydrophobicContact CZ2-CG 3.54Å; W72-E76 PolarHBondContact O-N 3.15Å; L73-E76 PolarHBondContact O-N 2.96Å; E76-D78 VanDerWaalsContact C-N 3.33Å; E76-D78 PolarHBondContact O-N 2.68Å; E76-N79 PolarHBondContact O-N 2.84Å; E76-Y80 PolarHBondContact O-N 2.84Å
77	E	59.1	Low	53.8	Low	150 Å²	150	122.9 Å²	122.9	70%	0.701	58%	0.575	S	S	*	*	H	α-helix	trans	-61.7	-41.9	174.9	-76.7	-169.8	163.4	0	0	111.3	L73 S81	L73-E77 WeakPolarHBondContact O-CB 3.44Å; L73-E77 WeakPolarHBondContact O-CG 3.31Å; L73-E77 PolarHBondContact O-N 3.02Å; E77-S81 PolarHBondContact O-N 2.85Å
78	D	56.2	Low	51.5	Low	79 Å²	79	126.9 Å²	126.9	42%	0.422	59%	0.592	S	S	.	*	H	α-helix	trans	-70.2	-37.2	176.4	-95.4	-21.1	0	0	0	112.9	E74 E76 S81 K82	E74-D78 VanDerWaalsContact O-CB 3.26Å; E74-D78 WeakPolarHBondContact O-CB 3.38Å; E74-D78 PolarHBondContact O-N 3.29Å; E76-D78 VanDerWaalsContact C-N 3.33Å; E76-D78 PolarHBondContact O-N 2.68Å; D78-S81 CarbonylContact O-C 3.58Å; D78-S81 PolarHBondContact O-N 3.02Å; D78-S81 VanDerWaalsContact O-N 3.13Å; D78-K82 WeakPolarHBondContact O-CB 3.29Å; D78-K82 PolarHBondContact O-N 3.21Å; D78-K82 IonicContact OD1-NZ 2.73Å; D78-K82 PolarHBondContact OD1-NZ 3.06Å; D78-K82 IonicContact OD2-NZ 3.76Å
79	N	49.4	Very low	49.5	Very low	74 Å²	74	130.5 Å²	130.5	40%	0.396	60%	0.604	S	S	.	*	H	α-helix	trans	-72.3	-35	-178.9	-89.3	-19.2	0	0	0	113.1	Y75 E76 S81	Y75-N79 WeakPolarHBondContact CD1-ND2 3.2Å; Y75-N79 WeakPolarHBondContact CE1-ND2 3.45Å; Y75-N79 WeakPolarHBondContact O-CB 3.46Å; Y75-N79 VanDerWaalsContact O-CG 3.32Å; Y75-N79 PolarHBondContact O-N 3.17Å; Y75-N79 PolarHBondContact OH-ND2 3.49Å; E76-N79 PolarHBondContact O-N 2.84Å; N79-S81 PolarHBondContact O-N 3.38Å
80	Y	48.2	Very low	47.4	Very low	212 Å²	212	134.4 Å²	134.4	83%	0.831	63%	0.626	S	S	*	*	H	α-helix	trans	-63.8	-27.3	169.8	-108	-85.9	0	0	0	111.7	E76	E76-Y80 PolarHBondContact O-N 2.84Å
81	S	45.1	Very low	45.4	Very low	90 Å²	90	134.6 Å²	134.6	63%	0.629	63%	0.63	S	S	*	*	H	α-helix	trans	-91.8	-20.3	-178.5	-178.4	0	0	0	0	115	E77 D78 N79	E77-S81 PolarHBondContact O-N 2.85Å; D78-S81 CarbonylContact O-C 3.58Å; D78-S81 PolarHBondContact O-N 3.02Å; D78-S81 VanDerWaalsContact O-N 3.13Å; N79-S81 PolarHBondContact O-N 3.38Å
82	K	34.4	Very low	43.7	Very low	130 Å²	130	133.2 Å²	133.2	57%	0.565	63%	0.631	S	S	*	*			trans	-130.4	69.9	-165.6	-66	174	-173.6	146.5	0	113.3	D78	D78-K82 WeakPolarHBondContact O-CB 3.29Å; D78-K82 PolarHBondContact O-N 3.21Å; D78-K82 IonicContact OD1-NZ 2.73Å; D78-K82 PolarHBondContact OD1-NZ 3.06Å; D78-K82 IonicContact OD2-NZ 3.76Å
83	T	32.7	Very low	41.4	Very low	114 Å²	114	134.7 Å²	134.7	70%	0.699	64%	0.643	S	S	*	*			trans	-64.7	138.7	152.7	-32.8	0	0	0	0	109.1
84	F	29.4	Very low	40.1	Very low	175 Å²	175	132.4 Å²	132.4	77%	0.768	63%	0.63	S	S	*	*			trans	82.5	89.2	172.3	-63.9	-90.5	0	0	0	118.9
85	V	28.4	Very low	38.7	Very low	137 Å²	137	130.7 Å²	130.7	83%	0.83	63%	0.629	S	S	*	*			trans	-141.7	100.1	134.7	-175.3	0	0	0	0	109.6	K87	V85-K87 PolarHBondContact O-N 2.9Å
86	K	26.8	Very low	37.7	Very low	203 Å²	203	127 Å²	127	88%	0.883	62%	0.619	S	S	*	*			trans	-70.2	91.8	168.3	-82	-178.3	173.9	178.2	0	109.2	K88	K86-K88 PolarHBondContact O-N 2.75Å
87	K	27	Very low	36.6	Very low	167 Å²	167	126.5 Å²	126.5	73%	0.726	62%	0.618	S	S	*	*			trans	-87.9	102.6	163.8	-131.9	177.3	-174.1	179.5	0	108	V85 F89	V85-K87 PolarHBondContact O-N 2.9Å; K87-F89 VanDerWaalsContact C-N 3.29Å; K87-F89 HydrophobicContact CB-CE2 4.33Å; K87-F89 HydrophobicContact CD-CE2 4.43Å; K87-F89 PolarHBondContact O-N 3.13Å
88	K	24.3	Very low	35.6	Very low	206 Å²	206	123.9 Å²	123.9	90%	0.896	61%	0.609	S	S	*	*			trans	-70.5	83.6	178.4	-162.7	179.5	-171.9	-177.9	0	108.4	K86	K86-K88 PolarHBondContact O-N 2.75Å
89	F	26.2	Very low	34.9	Very low	161 Å²	161	126 Å²	126	71%	0.706	62%	0.616	S	S	*	*			trans	-64.1	133.3	160.1	-77.2	-88.1	0	0	0	107	K87 L91	K87-F89 VanDerWaalsContact C-N 3.29Å; K87-F89 HydrophobicContact CB-CE2 4.33Å; K87-F89 HydrophobicContact CD-CE2 4.43Å; K87-F89 PolarHBondContact O-N 3.13Å; F89-L91 PolarHBondContact O-N 3.09Å
90	Q	25.8	Very low	34.7	Very low	192 Å²	192	123.3 Å²	123.3	90%	0.897	60%	0.602	S	S	*	*			trans	-63.7	94.8	166.8	-88.9	166.5	-38.5	0	0	106.1	T92	Q90-T92 PolarHBondContact O-N 2.89Å
91	L	30.9	Very low	34.4	Very low	90 Å²	90	118.9 Å²	118.9	47%	0.471	60%	0.597	S	S	.	*			trans	-50.4	121.9	169.2	-69.8	156.9	0	0	0	106.4	F89 Q93 E191	F89-L91 PolarHBondContact O-N 3.09Å; L91-Q93 PolarHBondContact O-N 2.84Å; L91-E191 WeakPolarHBondContact CD2-OE1 3.4Å; L91-E191 WeakPolarHBondContact CD2-OE2 3.25Å
92	T	32.7	Very low	34.7	Very low	84 Å²	84	117 Å²	117	52%	0.515	58%	0.584	S	S	.	*			trans	-56.1	113.9	163.4	-43.1	0	0	0	0	104.8	Q90 Y94	Q90-T92 PolarHBondContact O-N 2.89Å; T92-Y94 VanDerWaalsContact C-N 3.27Å; T92-Y94 VanDerWaalsContact O-CD2 3.26Å; T92-Y94 WeakPolarHBondContact O-CD2 3.45Å; T92-Y94 PolarHBondContact O-N 3.1Å
93	Q	31	Very low	35.9	Very low	158 Å²	158	111.5 Å²	111.5	74%	0.738	56%	0.561	S	S	*	*			trans	-65	90.1	-175.7	-72.5	179	-16	0	0	108.7	L91	L91-Q93 PolarHBondContact O-N 2.84Å
94	Y	41.1	Very low	37.4	Very low	19 Å²	19	111 Å²	111	8%	0.075	55%	0.553	C	S	.	*			trans	-66.6	128.3	164.7	-66.2	-80.4	0	0	0	106.7	T92 N96 M97 I158 A161 S163	T92-Y94 VanDerWaalsContact C-N 3.27Å; T92-Y94 VanDerWaalsContact O-CD2 3.26Å; T92-Y94 WeakPolarHBondContact O-CD2 3.45Å; T92-Y94 PolarHBondContact O-N 3.1Å; Y94-N96 PolarHBondContact O-N 3.4Å; Y94-M97 PolarHBondContact O-N 2.52Å; Y94-M97 VanDerWaalsContact O-N 3.12Å; Y94-I158 HydrophobicContact CD1-CB 4.33Å; Y94-I158 HydrophobicContact CD1-CD1 4.02Å; Y94-I158 HydrophobicContact CD1-CG2 4.33Å; Y94-I158 HydrophobicContact CE1-CB 4.11Å; Y94-I158 HydrophobicContact CE1-CD1 4.13Å; Y94-A161 HydrophobicContact CE1-CB 4.49Å; Y94-S163 PolarHBondContact OH-O 3Å; Y94-S163 PolarHBondContact OH-OG 3.46Å
95	P	40.5	Very low	39.5	Very low	85 Å²	85	106.6 Å²	106.6	55%	0.552	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	120.4	-180	17.7	-28.1	0	0	0	109.2	M97	P95-M97 PolarHBondContact O-N 3.35Å
96	N	41.7	Very low	41.8	Very low	66 Å²	66	101.9 Å²	101.9	35%	0.353	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	3.3	179.1	-66.2	-24.3	0	0	0	119.7	Y94 D98 Q99 V100 T137	Y94-N96 PolarHBondContact O-N 3.4Å; N96-D98 PolarHBondContact O-N 3.31Å; N96-Q99 PolarHBondContact O-N 2.94Å; N96-Q99 VanDerWaalsContact O-N 3.13Å; N96-V100 WeakPolarHBondContact O-CG2 3.39Å; N96-T137 WeakPolarHBondContact ND2-CG2 3.34Å
97	M	38.5	Very low	44.4	Very low	65 Å²	65	97.3 Å²	97.3	32%	0.32	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-65.5	-26.6	169.4	-101.1	-87.5	164.9	0	0	112.8	Y94 P95 Q99 V100 W189	Y94-M97 PolarHBondContact O-N 2.52Å; Y94-M97 VanDerWaalsContact O-N 3.12Å; P95-M97 PolarHBondContact O-N 3.35Å; M97-Q99 PolarHBondContact O-N 2.91Å; M97-Q99 VanDerWaalsContact O-N 3.13Å; M97-V100 HydrophobicContact CE-CB 4.37Å; M97-V100 HydrophobicContact CE-CG1 3.97Å; M97-V100 HydrophobicContact CE-CG2 4.35Å; M97-V100 HydrophobicContact CG-CG2 4.34Å; M97-V100 WeakPolarHBondContact O-CA 3.35Å; M97-V100 VanDerWaalsContact O-CB 3.25Å; M97-V100 WeakPolarHBondContact O-CB 3.42Å; M97-V100 PolarHBondContact O-N 3.39Å; M97-V100 HydrophobicContact SD-CB 3.84Å; M97-V100 HydrophobicContact SD-CG1 3.99Å; M97-V100 HydrophobicContact SD-CG2 4.1Å; M97-W189 HydrophobicContact SD-CH2 4.36Å
98	D	37.5	Very low	47.3	Very low	95 Å²	95	92.9 Å²	92.9	51%	0.508	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-64	-15.7	173.7	-73.4	-24.3	0	0	0	113.2	N96 T101	N96-D98 PolarHBondContact O-N 3.31Å; D98-T101 WeakPolarHBondContact O-CG2 3.47Å
99	Q	40.9	Very low	50.5	Low	124 Å²	124	83.7 Å²	83.7	58%	0.579	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-95.5	-2.9	168.9	-64.9	-168.7	1.3	0	0	113.2	N96 M97 T101	N96-Q99 PolarHBondContact O-N 2.94Å; N96-Q99 VanDerWaalsContact O-N 3.13Å; M97-Q99 PolarHBondContact O-N 2.91Å; M97-Q99 VanDerWaalsContact O-N 3.13Å; Q99-T101 PolarHBondContact O-N 3.06Å; Q99-T101 VanDerWaalsContact O-N 3.15Å
100	V	45.8	Very low	53.7	Low	17 Å²	17	77.7 Å²	77.7	10%	0.103	42%	0.423	C	S	.	.			trans	-85.2	31.1	175.8	-171.7	0	0	0	0	110.4	N96 M97 S102 T103	N96-V100 WeakPolarHBondContact O-CG2 3.39Å; M97-V100 HydrophobicContact CE-CB 4.37Å; M97-V100 HydrophobicContact CE-CG1 3.97Å; M97-V100 HydrophobicContact CE-CG2 4.35Å; M97-V100 HydrophobicContact CG-CG2 4.34Å; M97-V100 WeakPolarHBondContact O-CA 3.35Å; M97-V100 VanDerWaalsContact O-CB 3.25Å; M97-V100 WeakPolarHBondContact O-CB 3.42Å; M97-V100 PolarHBondContact O-N 3.39Å; M97-V100 HydrophobicContact SD-CB 3.84Å; M97-V100 HydrophobicContact SD-CG1 3.99Å; M97-V100 HydrophobicContact SD-CG2 4.1Å; V100-S102 PolarHBondContact O-N 3.25Å; V100-T103 PolarHBondContact O-N 2.94Å
101	T	42.3	Very low	57	Low	118 Å²	118	68.9 Å²	68.9	72%	0.724	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	3.3	-167	36.2	0	0	0	0	116.4	D98 Q99	D98-T101 WeakPolarHBondContact O-CG2 3.47Å; Q99-T101 PolarHBondContact O-N 3.06Å; Q99-T101 VanDerWaalsContact O-N 3.15Å
102	S	51.6	Low	60.1	Low	50 Å²	50	64.6 Å²	64.6	35%	0.35	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-24.3	174.9	69.3	0	0	0	0	113.6	V100	V100-S102 PolarHBondContact O-N 3.25Å
103	T	59.3	Low	63.1	Low	15 Å²	15	61.4 Å²	61.4	9%	0.092	34%	0.339	C	S	.	.	S	Bend	trans	-103.4	116.3	-175.6	61.4	0	0	0	0	111.4	V100 S109 Y187 W189	V100-T103 PolarHBondContact O-N 2.94Å; T103-S109 WeakPolarHBondContact CB-OG 3.49Å; T103-S109 WeakPolarHBondContact CG2-OG 3.48Å; T103-Y187 WeakPolarHBondContact CG2-OH 3.24Å; T103-W189 PolarHBondContact OG1-NE1 3.5Å
104	I	64.3	Low	66.1	Low	104 Å²	104	54 Å²	54	53%	0.533	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-86.8	130.8	-179.6	-55.8	162	0	0	0	108.4	G106 H107	I104-G106 PolarHBondContact O-N 3.27Å; I104-H107 HydrophobicContact CB-CB 4.05Å; I104-H107 WeakPolarHBondContact CG2-CD2 3.32Å; I104-H107 WeakPolarHBondContact O-CB 3.37Å; I104-H107 PolarHBondContact O-N 2.89Å
105	N	73.3	Confident	68.8	Low	83 Å²	83	53.3 Å²	53.3	44%	0.444	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	127.8	174.9	-178.8	-21.4	0	0	0	110.8	H107 W189 A190	N105-H107 PolarHBondContact O-N 3.4Å; N105-W189 PolarHBondContact OD1-O 2.79Å; N105-A190 WeakPolarHBondContact OD1-CA 2.93Å; N105-A190 WeakPolarHBondContact OD1-CB 3.42Å
106	G	76.1	Confident	71.5	Confident	38 Å²	38	49.3 Å²	49.3	39%	0.392	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-14.5	-177.6	0	0	0	0	0	115.8	I104 R188 W189	I104-G106 PolarHBondContact O-N 3.27Å; G106-R188 PolarHBondContact O-NH1 3.31Å; G106-W189 PolarHBondContact N-O 3.27Å
107	H	81.4	Confident	74.1	Confident	106 Å²	106	47.4 Å²	47.4	49%	0.491	27%	0.269	S	S	.	.	S	Bend	trans	-83.6	149.2	176.7	-70.3	-106.8	0	0	0	111.5	I104 N105 S109	I104-H107 HydrophobicContact CB-CB 4.05Å; I104-H107 WeakPolarHBondContact CG2-CD2 3.32Å; I104-H107 WeakPolarHBondContact O-CB 3.37Å; I104-H107 PolarHBondContact O-N 2.89Å; N105-H107 PolarHBondContact O-N 3.4Å; H107-S109 PolarHBondContact O-N 3.02Å
108	V	88	Confident	76.9	Confident	74 Å²	74	45.2 Å²	45.2	45%	0.448	26%	0.26	S	S	.	.			trans	-66	134.1	171.1	64	0	0	0	0	109.2	Y187 R188	V108-Y187 WeakPolarHBondContact CA-O 3.42Å; V108-R188 HydrophobicContact CB-CG 4.48Å
109	S	91.8	Very high	79.7	Confident	14 Å²	14	48.9 Å²	48.9	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.1	172	-59.7	0	0	0	0	108.1	T103 H107 E186 Y187	T103-S109 WeakPolarHBondContact CB-OG 3.49Å; T103-S109 WeakPolarHBondContact CG2-OG 3.48Å; H107-S109 PolarHBondContact O-N 3.02Å; S109-E186 WeakPolarHBondContact O-CA 3.42Å; S109-Y187 VanDerWaalsContact CB-CE1 3.42Å; S109-Y187 PolarHBondContact N-O 2.94Å; S109-Y187 VanDerWaalsContact O-CD1 3.3Å; S109-Y187 WeakPolarHBondContact O-CD1 3.41Å; S109-Y187 PolarHBondContact O-N 2.81Å
110	V	93	Very high	82.3	Confident	34 Å²	34	47.4 Å²	47.4	21%	0.206	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.8	-178.1	-172.6	0	0	0	0	108.9	V184 T185 E186 L244 I250	V110-V184 HydrophobicContact CG1-CG1 3.85Å; V110-T185 WeakPolarHBondContact CA-O 3.3Å; V110-E186 HydrophobicContact CG1-CG 4.3Å; V110-E186 HydrophobicContact CG2-CG 4.09Å; V110-L244 WeakPolarHBondContact O-CB 3.3Å; V110-L244 PolarHBondContact O-N 3.03Å; V110-I250 HydrophobicContact CG1-CG1 4.45Å
111	N	94.7	Very high	84.7	Confident	8 Å²	8	48.6 Å²	48.6	4%	0.043	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	150.4	177.2	-66.7	-19.6	0	0	0	110.8	E113 V184 T185 Y187 I241 Y242	N111-E113 HydrophobicContact CB-CG 3.76Å; N111-E113 PolarHBondContact ND2-OE1 3.34Å; N111-V184 WeakPolarHBondContact O-CA 3.28Å; N111-T185 PolarHBondContact N-O 3.47Å; N111-T185 PolarHBondContact O-N 3.13Å; N111-Y187 WeakPolarHBondContact ND2-CE1 3.25Å; N111-I241 HydrophobicContact CB-CG2 3.79Å; N111-I241 WeakPolarHBondContact ND2-CG2 3.45Å; N111-Y242 WeakPolarHBondContact CA-O 3.41Å
112	V	95.9	Very high	87.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.7	158.7	172.3	0	0	0	0	107.5	P182 M183 V184 Y242 L244 I250 L254 M257	V112-P182 HydrophobicContact CG1-CB 3.74Å; V112-M183 CarbonylContact C-O 3.55Å; V112-M183 WeakPolarHBondContact CA-O 3.38Å; V112-V184 HydrophobicContact CG2-CG2 4.45Å; V112-Y242 PolarHBondContact N-O 2.9Å; V112-Y242 PolarHBondContact O-N 3.17Å; V112-L244 HydrophobicContact CB-CD1 4.41Å; V112-L244 HydrophobicContact CG2-CD1 3.89Å; V112-I250 HydrophobicContact CG2-CG2 4.37Å; V112-L254 HydrophobicContact CG1-CD2 3.77Å; V112-L254 HydrophobicContact CG2-CD2 4.25Å; V112-L254 HydrophobicContact CG2-CG 4.39Å; V112-M257 HydrophobicContact CG1-CB 4.15Å; V112-M257 HydrophobicContact CG1-CE 4.17Å; V112-M257 HydrophobicContact CG1-CG 4.44Å; V112-M257 WeakPolarHBondContact O-CE 3.46Å
113	E	95.8	Very high	89.3	Confident	17 Å²	17	48.6 Å²	48.6	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.1	-168.4	-54.5	-175.6	172.9	0	0	111	N111 R171 P182 M183 T185 I240 I241	N111-E113 HydrophobicContact CB-CG 3.76Å; N111-E113 PolarHBondContact ND2-OE1 3.34Å; E113-R171 IonicContact OE2-CZ 3.19Å; E113-R171 IonicContact OE2-NH1 2.6Å; E113-R171 PolarHBondContact OE2-NH1 2.95Å; E113-R171 IonicContact OE2-NH2 3.17Å; E113-P182 CarbonylContact O-C 3.38Å; E113-P182 VanDerWaalsContact O-CA 3.29Å; E113-P182 WeakPolarHBondContact O-CA 3.39Å; E113-M183 PolarHBondContact N-O 2.86Å; E113-M183 PolarHBondContact O-N 3.13Å; E113-T185 VanDerWaalsContact OE1-CB 3.28Å; E113-T185 WeakPolarHBondContact OE1-CB 3.18Å; E113-T185 PolarHBondContact OE1-OG1 3.09Å; E113-T185 PolarHBondContact OE2-OG1 2.95Å; E113-I240 WeakPolarHBondContact CA-O 3.3Å; E113-I241 HydrophobicContact CB-CG1 4.41Å; E113-I241 HydrophobicContact CG-CB 4.46Å; E113-I241 HydrophobicContact CG-CG1 4.02Å; E113-I241 HydrophobicContact CG-CG2 4.17Å
114	L	95.4	Very high	91	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.2	173.4	179.9	70.3	0	0	0	108.9	I116 P182 E239 I240 M257 M261 L266 I271	L114-I116 HydrophobicContact CD2-CD1 3.9Å; L114-I116 HydrophobicContact CD2-CG1 4.19Å; L114-I116 HydrophobicContact CG-CD1 4.22Å; L114-I116 HydrophobicContact CG-CG1 3.98Å; L114-P182 HydrophobicContact CD1-CG 4.4Å; L114-E239 CarbonylContact O-C 3.49Å; L114-E239 VanDerWaalsContact O-CA 3.28Å; L114-E239 WeakPolarHBondContact O-CA 3.35Å; L114-I240 PolarHBondContact N-O 3.48Å; L114-I240 PolarHBondContact O-N 3.42Å; L114-M257 HydrophobicContact CB-CE 4.07Å; L114-M257 HydrophobicContact CB-CG 4.01Å; L114-M257 HydrophobicContact CB-SD 3.58Å; L114-M257 VanDerWaalsContact CB-SD 3.58Å; L114-M257 HydrophobicContact CD2-CG 4.31Å; L114-M257 HydrophobicContact CD2-SD 3.91Å; L114-M257 HydrophobicContact CG-SD 4.38Å; L114-M261 HydrophobicContact CD1-CG 4.39Å; L114-M261 HydrophobicContact CD1-SD 3.88Å; L114-M261 HydrophobicContact CD2-CG 3.51Å; L114-M261 HydrophobicContact CD2-SD 4.06Å; L114-L266 HydrophobicContact CD2-CD2 3.91Å; L114-I271 HydrophobicContact CD1-CB 4.48Å; L114-I271 HydrophobicContact CD1-CD1 3.97Å; L114-I271 HydrophobicContact CD1-CG1 4.03Å; L114-I271 HydrophobicContact CD1-CG2 3.67Å
115	K	96.2	Very high	92.5	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.026	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.6	176	179.9	-175.8	-51	87.6	0	110.2	Y237 A238 E239 I271 S272 M274 Y276 L279	K115-Y237 HydrophobicContact CD-CD1 3.98Å; K115-Y237 HydrophobicContact CD-CE1 4.45Å; K115-Y237 HydrophobicContact CG-CD1 3.78Å; K115-A238 CarbonylContact C-O 3.56Å; K115-A238 WeakPolarHBondContact CA-O 3.41Å; K115-E239 HydrophobicContact CB-CG 4.27Å; K115-E239 WeakPolarHBondContact CE-OE1 3.18Å; K115-E239 HydrophobicContact CG-CG 4.13Å; K115-E239 IonicContact NZ-OE1 3.43Å; K115-I271 WeakPolarHBondContact O-CA 3.26Å; K115-S272 PolarHBondContact O-N 3.01Å; K115-M274 WeakPolarHBondContact CE-O 3.39Å; K115-M274 PolarHBondContact NZ-O 3.47Å; K115-Y276 HydrophobicContact CD-CE1 4.03Å; K115-L279 HydrophobicContact CD-CD1 4.23Å
116	I	97.4	Very high	93.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.9	-169.8	-51.6	171.1	0	0	0	108.5	L114 V118 M124 Y237 A238 I240 M264 L266 L270	L114-I116 HydrophobicContact CD2-CD1 3.9Å; L114-I116 HydrophobicContact CD2-CG1 4.19Å; L114-I116 HydrophobicContact CG-CD1 4.22Å; L114-I116 HydrophobicContact CG-CG1 3.98Å; I116-V118 PolarHBondContact O-N 2.95Å; I116-M124 HydrophobicContact CG2-CE 4.04Å; I116-Y237 CarbonylContact O-C 3.57Å; I116-Y237 WeakPolarHBondContact O-CA 3.39Å; I116-Y237 WeakPolarHBondContact O-CD1 3.47Å; I116-A238 HydrophobicContact CB-CB 4.38Å; I116-A238 PolarHBondContact N-O 3.34Å; I116-A238 PolarHBondContact O-N 2.82Å; I116-I240 HydrophobicContact CD1-CD1 4.37Å; I116-M264 HydrophobicContact CD1-CE 4.17Å; I116-L266 HydrophobicContact CD1-CD1 4.03Å; I116-L266 HydrophobicContact CD1-CD2 3.66Å; I116-L266 HydrophobicContact CG1-CD1 4.34Å; I116-L266 HydrophobicContact CG1-CD2 3.86Å; I116-L266 HydrophobicContact CG2-CD1 3.59Å; I116-L270 CarbonylContact C-O 3.57Å; I116-L270 WeakPolarHBondContact CA-O 3.36Å; I116-L270 HydrophobicContact CG2-CB 4.14Å
117	A	97.1	Very high	94.3	Very high	26 Å²	26	50 Å²	50	22%	0.215	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	127.9	169	0	0	0	0	0	110	Y237 L270	A117-Y237 HydrophobicContact CB-CD1 4.22Å; A117-Y237 HydrophobicContact CB-CE1 3.72Å; A117-L270 HydrophobicContact CB-CD2 4.47Å; A117-L270 PolarHBondContact N-O 3.03Å
118	V	97.7	Very high	95	Very high	19 Å²	19	45.1 Å²	45.1	12%	0.115	24%	0.238	C	C	.	.			trans	-100.9	118.2	-175.8	176	0	0	0	0	109.7	I116 D120 M124 L228 A236 A238	I116-V118 PolarHBondContact O-N 2.95Å; V118-D120 WeakPolarHBondContact CG1-O 3.48Å; V118-M124 HydrophobicContact CG1-CB 3.76Å; V118-M124 HydrophobicContact CG1-CG 4.24Å; V118-M124 HydrophobicContact CG2-CB 4.29Å; V118-M124 HydrophobicContact CG2-CE 4.16Å; V118-M124 HydrophobicContact CG2-CG 3.85Å; V118-L228 HydrophobicContact CG2-CD1 3.94Å; V118-A236 HydrophobicContact CB-CB 3.9Å; V118-A236 HydrophobicContact CG1-CB 4.26Å; V118-A236 PolarHBondContact N-O 3.49Å; V118-A238 HydrophobicContact CG2-CB 3.96Å
119	Q	95.1	Very high	95.2	Very high	173 Å²	173	45.8 Å²	45.8	81%	0.808	24%	0.235	S	C	*	.	S	Bend	trans	-87.7	-38.1	177.7	-64.6	-179.8	-23.9	0	0	112.3	L270	Q119-L270 HydrophobicContact CG-CD2 4.28Å
120	D	96.4	Very high	95.2	Very high	92 Å²	92	50 Å²	50	49%	0.492	26%	0.256	S	S	.	.			trans	-127.3	109.6	176.3	-177.8	-27.2	0	0	0	108.5	V118 D122 A123 M124	V118-D120 WeakPolarHBondContact CG1-O 3.48Å; D120-D122 PolarHBondContact OD1-N 3.48Å; D120-D122 VanDerWaalsContact OD1-N 3.08Å; D120-A123 HydrophobicContact CB-CB 3.87Å; D120-A123 VanDerWaalsContact CG-CB 3.48Å; D120-A123 PolarHBondContact OD1-N 2.66Å; D120-M124 WeakPolarHBondContact O-CB 3.4Å; D120-M124 PolarHBondContact O-N 3.5Å
121	Y	95.4	Very high	95.2	Very high	43 Å²	43	51.4 Å²	51.4	17%	0.169	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-43.5	-175.2	-172.5	-80.8	0	0	0	111.8	M124 Q125 S217 L228 E230 A236	Y121-M124 PolarHBondContact O-N 2.99Å; Y121-Q125 HydrophobicContact CE1-CB 4.49Å; Y121-Q125 VanDerWaalsContact O-CB 3.28Å; Y121-Q125 WeakPolarHBondContact O-CB 3.43Å; Y121-Q125 PolarHBondContact O-N 2.89Å; Y121-S217 PolarHBondContact OH-OG 2.99Å; Y121-S217 VanDerWaalsContact OH-OG 3.13Å; Y121-L228 HydrophobicContact CD1-CD2 4.24Å; Y121-L228 HydrophobicContact CD2-CD1 4.33Å; Y121-L228 HydrophobicContact CD2-CD2 4.25Å; Y121-L228 HydrophobicContact CD2-CG 4.19Å; Y121-L228 HydrophobicContact CE1-CD2 3.71Å; Y121-L228 HydrophobicContact CE1-CG 4.41Å; Y121-L228 HydrophobicContact CE2-CD1 4.1Å; Y121-L228 HydrophobicContact CE2-CD2 3.74Å; Y121-L228 HydrophobicContact CE2-CG 3.53Å; Y121-L228 HydrophobicContact CG-CD2 4.48Å; Y121-L228 VanDerWaalsContact CZ-CD2 3.42Å; Y121-E230 HydrophobicContact CD2-CG 4.14Å; Y121-E230 HydrophobicContact CE2-CG 3.72Å; Y121-A236 HydrophobicContact CD2-CB 4.2Å
122	D	94.9	Very high	95.1	Very high	117 Å²	117	52 Å²	52	63%	0.626	26%	0.264	S	S	*	.	H	α-helix	trans	-70.2	-40.6	-176.6	-70.9	-37.2	0	0	0	111	D120 Q125 K126	D120-D122 PolarHBondContact OD1-N 3.48Å; D120-D122 VanDerWaalsContact OD1-N 3.08Å; D122-Q125 PolarHBondContact O-N 2.78Å; D122-K126 WeakPolarHBondContact O-CB 3.32Å; D122-K126 PolarHBondContact O-N 2.84Å
123	A	95.7	Very high	94.5	Very high	51 Å²	51	54.8 Å²	54.8	42%	0.421	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-45.5	174.9	0	0	0	0	0	111.8	D120 K126 Q127	D120-A123 HydrophobicContact CB-CB 3.87Å; D120-A123 VanDerWaalsContact CG-CB 3.48Å; D120-A123 PolarHBondContact OD1-N 2.66Å; A123-K126 PolarHBondContact O-N 3.26Å; A123-Q127 PolarHBondContact O-N 2.99Å
124	M	95.9	Very high	93.7	Very high	19 Å²	19	56.4 Å²	56.4	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-45.6	176.3	-179	61.4	72.3	0	0	111.3	I116 V118 D120 Y121 K126 Q127 L128 L228 A238 M264	I116-M124 HydrophobicContact CG2-CE 4.04Å; V118-M124 HydrophobicContact CG1-CB 3.76Å; V118-M124 HydrophobicContact CG1-CG 4.24Å; V118-M124 HydrophobicContact CG2-CB 4.29Å; V118-M124 HydrophobicContact CG2-CE 4.16Å; V118-M124 HydrophobicContact CG2-CG 3.85Å; D120-M124 WeakPolarHBondContact O-CB 3.4Å; D120-M124 PolarHBondContact O-N 3.5Å; Y121-M124 PolarHBondContact O-N 2.99Å; M124-K126 VanDerWaalsContact C-N 3.28Å; M124-K126 PolarHBondContact O-N 2.86Å; M124-Q127 PolarHBondContact O-N 3.12Å; M124-Q127 VanDerWaalsContact O-N 3.12Å; M124-L128 HydrophobicContact CG-CD1 4.02Å; M124-L128 HydrophobicContact CG-CG 4.25Å; M124-L128 WeakPolarHBondContact O-CG 3.38Å; M124-L128 PolarHBondContact O-N 2.88Å; M124-L128 HydrophobicContact SD-CD1 4.28Å; M124-L128 HydrophobicContact SD-CD2 4.28Å; M124-L128 HydrophobicContact SD-CG 4.03Å; M124-L228 HydrophobicContact CG-CD1 3.9Å; M124-A238 HydrophobicContact CG-CB 4.14Å; M124-A238 HydrophobicContact SD-CB 4.22Å; M124-M264 HydrophobicContact SD-CE 4.05Å
125	Q	94.4	Very high	92.5	Very high	59 Å²	59	60.7 Å²	60.7	28%	0.276	33%	0.327	S	S	.	.	H	α-helix	trans	-57.4	-43.5	177.7	-172.2	177	-93.7	0	0	111.4	Y121 D122 F129 M135 L228	Y121-Q125 HydrophobicContact CE1-CB 4.49Å; Y121-Q125 VanDerWaalsContact O-CB 3.28Å; Y121-Q125 WeakPolarHBondContact O-CB 3.43Å; Y121-Q125 PolarHBondContact O-N 2.89Å; D122-Q125 PolarHBondContact O-N 2.78Å; Q125-F129 WeakPolarHBondContact O-CB 3.48Å; Q125-F129 PolarHBondContact O-N 2.8Å; Q125-M135 HydrophobicContact CG-CE 4.04Å; Q125-M135 HydrophobicContact CG-SD 4.09Å; Q125-L228 HydrophobicContact CB-CD2 3.64Å; Q125-L228 HydrophobicContact CG-CD2 4.06Å
126	K	93.9	Very high	91.9	Very high	127 Å²	127	61.9 Å²	61.9	55%	0.552	34%	0.341	S	S	*	.	H	α-helix	trans	-62.4	-45.5	175.2	-174.2	-173	177.7	-60.9	0	111.7	D122 A123 M124 L128 F129 D130	D122-K126 WeakPolarHBondContact O-CB 3.32Å; D122-K126 PolarHBondContact O-N 2.84Å; A123-K126 PolarHBondContact O-N 3.26Å; M124-K126 VanDerWaalsContact C-N 3.28Å; M124-K126 PolarHBondContact O-N 2.86Å; K126-L128 PolarHBondContact O-N 2.84Å; K126-F129 WeakPolarHBondContact O-CB 3.45Å; K126-F129 PolarHBondContact O-N 2.89Å; K126-D130 IonicContact NZ-OD1 2.66Å; K126-D130 IonicContact NZ-OD2 2.72Å; K126-D130 PolarHBondContact NZ-OD2 2.84Å; K126-D130 VanDerWaalsContact O-CG 3.29Å; K126-D130 PolarHBondContact O-N 3.25Å
127	Q	94.9	Very high	91.6	Very high	64 Å²	64	63.5 Å²	63.5	30%	0.299	35%	0.352	S	S	.	.	H	α-helix	trans	-63	-43.3	179.7	-177	173.1	-12	0	0	112.1	A123 M124 F129 D130 L131 M264	A123-Q127 PolarHBondContact O-N 2.99Å; M124-Q127 PolarHBondContact O-N 3.12Å; M124-Q127 VanDerWaalsContact O-N 3.12Å; Q127-F129 VanDerWaalsContact C-N 3.32Å; Q127-F129 PolarHBondContact O-N 3.38Å; Q127-D130 PolarHBondContact O-N 2.95Å; Q127-L131 HydrophobicContact CG-CD1 4.05Å; Q127-L131 WeakPolarHBondContact O-CD1 3.19Å; Q127-L131 VanDerWaalsContact O-CG 3.31Å; Q127-L131 WeakPolarHBondContact O-CG 3.39Å; Q127-L131 PolarHBondContact O-N 2.84Å; Q127-L131 VanDerWaalsContact O-N 3.09Å; Q127-M264 HydrophobicContact CG-CE 4.46Å; Q127-M264 VanDerWaalsContact NE2-CA 3.28Å; Q127-M264 VanDerWaalsContact NE2-CB 3.32Å; Q127-M264 PolarHBondContact NE2-O 2.77Å
128	L	94.7	Very high	91.4	Very high	4 Å²	4	65.9 Å²	65.9	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-38.1	175.6	-65	177.2	0	0	0	111.5	M124 K126 L131 F132 V226 L228 A238 I240 M264	M124-L128 HydrophobicContact CG-CD1 4.02Å; M124-L128 HydrophobicContact CG-CG 4.25Å; M124-L128 WeakPolarHBondContact O-CG 3.38Å; M124-L128 PolarHBondContact O-N 2.88Å; M124-L128 HydrophobicContact SD-CD1 4.28Å; M124-L128 HydrophobicContact SD-CD2 4.28Å; M124-L128 HydrophobicContact SD-CG 4.03Å; K126-L128 PolarHBondContact O-N 2.84Å; L128-L131 PolarHBondContact O-N 3.21Å; L128-F132 HydrophobicContact CB-CD2 4.45Å; L128-F132 HydrophobicContact CD2-CD2 4.3Å; L128-F132 HydrophobicContact CD2-CE2 3.95Å; L128-F132 WeakPolarHBondContact O-CB 3.46Å; L128-F132 VanDerWaalsContact O-CD2 3.28Å; L128-F132 WeakPolarHBondContact O-CD2 3.3Å; L128-F132 PolarHBondContact O-N 3.06Å; L128-V226 HydrophobicContact CD1-CG1 3.94Å; L128-V226 HydrophobicContact CD2-CG1 4Å; L128-V226 HydrophobicContact CG-CG1 4.43Å; L128-L228 HydrophobicContact CD1-CB 4.22Å; L128-L228 HydrophobicContact CD1-CD1 4.44Å; L128-A238 HydrophobicContact CD1-CB 4.19Å; L128-I240 HydrophobicContact CD2-CD1 4.02Å; L128-I240 HydrophobicContact CD2-CG1 4.45Å; L128-M264 HydrophobicContact CD2-CE 4.16Å
129	F	92.1	Very high	91.3	Very high	87 Å²	87	66.3 Å²	66.3	38%	0.382	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-48.1	173.2	-179.3	-103	0	0	0	112.8	Q125 K126 Q127 L131 F132 G133 M135	Q125-F129 WeakPolarHBondContact O-CB 3.48Å; Q125-F129 PolarHBondContact O-N 2.8Å; K126-F129 WeakPolarHBondContact O-CB 3.45Å; K126-F129 PolarHBondContact O-N 2.89Å; Q127-F129 VanDerWaalsContact C-N 3.32Å; Q127-F129 PolarHBondContact O-N 3.38Å; F129-L131 PolarHBondContact O-N 2.81Å; F129-F132 PolarHBondContact O-N 3.34Å; F129-G133 VanDerWaalsContact O-CA 3.32Å; F129-G133 WeakPolarHBondContact O-CA 3.47Å; F129-G133 PolarHBondContact O-N 3.14Å; F129-M135 HydrophobicContact CB-CE 3.31Å; F129-M135 HydrophobicContact CD2-CE 3.27Å; F129-M135 HydrophobicContact CD2-CG 4.34Å; F129-M135 HydrophobicContact CE2-CE 4.23Å; F129-M135 HydrophobicContact CG-CE 3.45Å; F129-M135 VanDerWaalsContact CG-CE 3.45Å
130	D	93.2	Very high	91.5	Very high	102 Å²	102	65.9 Å²	65.9	55%	0.545	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-30.7	179.9	-68.1	-22.4	0	0	0	111.4	K126 Q127	K126-D130 IonicContact NZ-OD1 2.66Å; K126-D130 IonicContact NZ-OD2 2.72Å; K126-D130 PolarHBondContact NZ-OD2 2.84Å; K126-D130 VanDerWaalsContact O-CG 3.29Å; K126-D130 PolarHBondContact O-N 3.25Å; Q127-D130 PolarHBondContact O-N 2.95Å
131	L	92.8	Very high	91.5	Very high	65 Å²	65	61.7 Å²	61.7	34%	0.34	33%	0.331	S	S	.	.	H	α-helix	trans	-82.8	-38.7	179	-72.1	166.3	0	0	0	114.1	Q127 L128 F129 L260 M264	Q127-L131 HydrophobicContact CG-CD1 4.05Å; Q127-L131 WeakPolarHBondContact O-CD1 3.19Å; Q127-L131 VanDerWaalsContact O-CG 3.31Å; Q127-L131 WeakPolarHBondContact O-CG 3.39Å; Q127-L131 PolarHBondContact O-N 2.84Å; Q127-L131 VanDerWaalsContact O-N 3.09Å; L128-L131 PolarHBondContact O-N 3.21Å; F129-L131 PolarHBondContact O-N 2.81Å; L131-L260 HydrophobicContact CD1-CD1 4.36Å; L131-L260 HydrophobicContact CD2-CD1 4.45Å; L131-M264 HydrophobicContact CD1-CE 4.38Å; L131-M264 HydrophobicContact CD1-CG 3.51Å; L131-M264 HydrophobicContact CD1-SD 4.01Å
132	F	92.3	Very high	91.7	Very high	20 Å²	20	61.4 Å²	61.4	9%	0.088	33%	0.334	C	S	.	.	H	α-helix	trans	-117.6	-12	-167.8	-60.6	-71.2	0	0	0	114.8	L128 F129 L219 S221 F224 V226 I240 L260	L128-F132 HydrophobicContact CB-CD2 4.45Å; L128-F132 HydrophobicContact CD2-CD2 4.3Å; L128-F132 HydrophobicContact CD2-CE2 3.95Å; L128-F132 WeakPolarHBondContact O-CB 3.46Å; L128-F132 VanDerWaalsContact O-CD2 3.28Å; L128-F132 WeakPolarHBondContact O-CD2 3.3Å; L128-F132 PolarHBondContact O-N 3.06Å; F129-F132 PolarHBondContact O-N 3.34Å; F132-L219 HydrophobicContact CB-CD1 3.43Å; F132-L219 VanDerWaalsContact CB-CD1 3.43Å; F132-L219 HydrophobicContact CB-CD2 4.48Å; F132-L219 HydrophobicContact CD2-CD1 4.35Å; F132-L219 HydrophobicContact CG-CD1 3.93Å; F132-S221 PolarHBondContact O-OG 2.97Å; F132-F224 HydrophobicContact CD1-CB 4.31Å; F132-F224 HydrophobicContact CD1-CG 4.48Å; F132-F224 HydrophobicContact CE1-CB 3.9Å; F132-F224 HydrophobicContact CE1-CD1 4.15Å; F132-F224 AromaticContact CE1-CD2 3.86Å; F132-F224 HydrophobicContact CE1-CD2 3.86Å; F132-F224 HydrophobicContact CE1-CE2 4.37Å; F132-F224 AromaticContact CE1-CG 3.71Å; F132-F224 HydrophobicContact CE1-CG 3.71Å; F132-F224 HydrophobicContact CZ-CG 4.48Å; F132-V226 HydrophobicContact CD1-CG2 4.27Å; F132-V226 HydrophobicContact CD2-CG1 4.45Å; F132-V226 HydrophobicContact CD2-CG2 3.89Å; F132-V226 HydrophobicContact CE1-CG2 4.09Å; F132-V226 HydrophobicContact CE2-CG1 4.39Å; F132-V226 HydrophobicContact CE2-CG2 3.72Å; F132-V226 HydrophobicContact CG-CG2 4.17Å; F132-V226 HydrophobicContact CZ-CG2 3.81Å; F132-I240 HydrophobicContact CE2-CD1 4.24Å; F132-I240 HydrophobicContact CZ-CD1 4.37Å; F132-I240 HydrophobicContact CZ-CG2 4.07Å; F132-L260 HydrophobicContact CZ-CD1 4.18Å; F132-L260 HydrophobicContact CZ-CD2 3.98Å
133	G	83.9	Confident	91.8	Very high	59 Å²	59	56.1 Å²	56.1	61%	0.608	31%	0.306	S	S	*	.	S	Bend	trans	82.2	13.9	166.6	0	0	0	0	0	116.7	F129	F129-G133 VanDerWaalsContact O-CA 3.32Å; F129-G133 WeakPolarHBondContact O-CA 3.47Å; F129-G133 PolarHBondContact O-N 3.14Å
134	S	77.5	Confident	92	Very high	51 Å²	51	54.5 Å²	54.5	36%	0.357	29%	0.29	S	S	.	.			trans	-152	148.2	179.2	-179.1	0	0	0	0	112.1	G136 L219	S134-G136 VanDerWaalsContact C-N 3.28Å; S134-G136 PolarHBondContact OG-N 3.45Å; S134-L219 VanDerWaalsContact O-CD2 3.3Å; S134-L219 WeakPolarHBondContact O-CD2 3.38Å
135	M	71.2	Confident	92	Very high	90 Å²	90	53.9 Å²	53.9	44%	0.443	29%	0.287	S	S	.	.			trans	-77.1	-17.2	169.4	-73	-74.4	104.7	0	0	112.5	Q125 F129	Q125-M135 HydrophobicContact CG-CE 4.04Å; Q125-M135 HydrophobicContact CG-SD 4.09Å; F129-M135 HydrophobicContact CB-CE 3.31Å; F129-M135 HydrophobicContact CD2-CE 3.27Å; F129-M135 HydrophobicContact CD2-CG 4.34Å; F129-M135 HydrophobicContact CE2-CE 4.23Å; F129-M135 HydrophobicContact CG-CE 3.45Å; F129-M135 VanDerWaalsContact CG-CE 3.45Å
136	G	83.1	Confident	92.1	Very high	31 Å²	31	51.1 Å²	51.1	32%	0.32	27%	0.273	S	S	.	.			trans	73.5	-163	-178.9	0	0	0	0	0	114.5	S134 L218	S134-G136 VanDerWaalsContact C-N 3.28Å; S134-G136 PolarHBondContact OG-N 3.45Å; G136-L218 CarbonylContact C-O 3.55Å; G136-L218 WeakPolarHBondContact CA-O 3.45Å
137	T	91.1	Very high	91.9	Very high	35 Å²	35	46.2 Å²	46.2	22%	0.215	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.5	177	47.3	0	0	0	0	110.1	N96 L218	N96-T137 WeakPolarHBondContact ND2-CG2 3.34Å; T137-L218 PolarHBondContact N-O 3.02Å; T137-L218 PolarHBondContact O-N 3.25Å
138	V	93.7	Very high	91.6	Very high	76 Å²	76	45.1 Å²	45.1	46%	0.461	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.5	178.6	-179	0	0	0	0	110.2	R215 R216	V138-R215 HydrophobicContact CG1-CG 4.04Å; V138-R216 VanDerWaalsContact CA-O 3.26Å; V138-R216 WeakPolarHBondContact CA-O 3.14Å
139	Y	95.9	Very high	91.1	Very high	27 Å²	27	51.5 Å²	51.5	11%	0.106	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	174.5	176.6	59.1	-89.9	0	0	0	110.8	E141 I158 D159 R216 L218	Y139-E141 HydrophobicContact CD2-CG 3.85Å; Y139-E141 HydrophobicContact CE2-CG 3.4Å; Y139-E141 VanDerWaalsContact CE2-CG 3.4Å; Y139-E141 WeakPolarHBondContact CE2-OE1 3.48Å; Y139-E141 PolarHBondContact OH-OE1 2.69Å; Y139-E141 VanDerWaalsContact OH-OE1 3.14Å; Y139-I158 HydrophobicContact CD2-CG2 3.65Å; Y139-I158 HydrophobicContact CE2-CD1 4.46Å; Y139-I158 HydrophobicContact CE2-CG1 4.36Å; Y139-I158 HydrophobicContact CE2-CG2 4.08Å; Y139-I158 HydrophobicContact CG-CG2 4.3Å; Y139-D159 WeakPolarHBondContact CB-OD2 3.28Å; Y139-R216 HydrophobicContact CE1-CG 4.35Å; Y139-R216 PolarHBondContact N-O 3.18Å; Y139-R216 PolarHBondContact O-N 2.89Å; Y139-R216 WeakPolarHBondContact OH-CD 3.35Å; Y139-L218 HydrophobicContact CE1-CB 3.63Å; Y139-L218 HydrophobicContact CE1-CD2 3.83Å; Y139-L218 HydrophobicContact CE1-CG 4.35Å
140	R	97.9	Very high	90.7	Very high	165 Å²	165	52 Å²	52	62%	0.623	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109	140.2	178.6	-63.8	176.4	-178.5	168	0.1	110.8	I158 D159 K214	R140-I158 WeakPolarHBondContact O-CA 3.35Å; R140-D159 PolarHBondContact N-OD1 2.88Å; R140-D159 PolarHBondContact O-N 2.76Å; R140-K214 WeakPolarHBondContact CA-O 3.36Å
141	E	97.9	Very high	90.5	Very high	3 Å²	3	48.5 Å²	48.5	1%	0.014	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.9	174.4	-66.4	-175.3	157.5	0	0	110.7	Y139 R156 M157 I158 K214 R216	Y139-E141 HydrophobicContact CD2-CG 3.85Å; Y139-E141 HydrophobicContact CE2-CG 3.4Å; Y139-E141 VanDerWaalsContact CE2-CG 3.4Å; Y139-E141 WeakPolarHBondContact CE2-OE1 3.48Å; Y139-E141 PolarHBondContact OH-OE1 2.69Å; Y139-E141 VanDerWaalsContact OH-OE1 3.14Å; E141-R156 VanDerWaalsContact CD-CD 3.49Å; E141-R156 VanDerWaalsContact CD-CZ 3.47Å; E141-R156 HydrophobicContact CG-CG 4.48Å; E141-R156 WeakPolarHBondContact OE1-CD 3.28Å; E141-R156 IonicContact OE1-CZ 2.83Å; E141-R156 IonicContact OE1-NE 3.36Å; E141-R156 IonicContact OE1-NH1 2.86Å; E141-R156 PolarHBondContact OE1-NH1 2.86Å; E141-R156 IonicContact OE2-CZ 3.87Å; E141-R156 IonicContact OE2-NE 3Å; E141-R156 PolarHBondContact OE2-NE 2.8Å; E141-R156 IonicContact OE2-NH1 3.87Å; E141-R156 PolarHBondContact OE2-NH1 3.45Å; E141-R156 VanDerWaalsContact OE2-NH1 3.11Å; E141-R156 IonicContact OE2-NH2 3.53Å; E141-R156 PolarHBondContact OE2-NH2 3Å; E141-M157 VanDerWaalsContact CA-O 3.29Å; E141-M157 WeakPolarHBondContact CA-O 3.24Å; E141-I158 HydrophobicContact CG-CG1 4.24Å; E141-K214 HydrophobicContact CB-CG 4.03Å; E141-K214 PolarHBondContact N-O 3.47Å; E141-K214 PolarHBondContact O-N 2.62Å; E141-K214 WeakPolarHBondContact OE2-CE 3.3Å; E141-K214 IonicContact OE2-NZ 3.7Å; E141-K214 PolarHBondContact OE2-NZ 3.16Å; E141-R216 IonicContact OE1-NH1 3.12Å; E141-R216 PolarHBondContact OE1-NH1 3.18Å; E141-R216 IonicContact OE2-CZ 3.87Å; E141-R216 IonicContact OE2-NE 3.63Å; E141-R216 IonicContact OE2-NH1 2.65Å; E141-R216 PolarHBondContact OE2-NH1 2.94Å; E141-R216 IonicContact OE2-NH2 2.76Å
142	V	98.3	Very high	90.5	Very high	37 Å²	37	49.1 Å²	49.1	22%	0.224	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	114.2	167	-175.2	0	0	0	0	108	R156 M157 V211 I212 K213	V142-R156 WeakPolarHBondContact O-CA 3.28Å; V142-M157 HydrophobicContact CB-CB 4.37Å; V142-M157 PolarHBondContact N-O 2.9Å; V142-M157 PolarHBondContact O-N 2.97Å; V142-V211 HydrophobicContact CG1-CG1 3.68Å; V142-I212 WeakPolarHBondContact CA-O 3.42Å; V142-K213 HydrophobicContact CG1-CG 4.24Å; V142-K213 HydrophobicContact CG2-CG 4.28Å
143	D	98.2	Very high	90.7	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.032	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.7	-179.1	-65.4	-15.1	0	0	0	109.6	I145 M154 R156 V211 I212 K214	D143-I145 HydrophobicContact CB-CD1 4.1Å; D143-M154 HydrophobicContact CB-CG 3.92Å; D143-M154 HydrophobicContact CB-SD 3.71Å; D143-M154 VanDerWaalsContact OD2-SD 3.35Å; D143-R156 VanDerWaalsContact OD1-CB 3.3Å; D143-R156 WeakPolarHBondContact OD1-CB 3.42Å; D143-R156 WeakPolarHBondContact OD1-CG 3.31Å; D143-R156 IonicContact OD1-CZ 3.79Å; D143-R156 IonicContact OD1-NE 2.7Å; D143-R156 PolarHBondContact OD1-NE 2.87Å; D143-R156 IonicContact OD1-NH2 3.03Å; D143-R156 IonicContact OD2-CZ 3.3Å; D143-R156 IonicContact OD2-NE 3.34Å; D143-R156 IonicContact OD2-NH2 2.7Å; D143-R156 PolarHBondContact OD2-NH2 3.34Å; D143-V211 CarbonylContact O-C 3.58Å; D143-V211 VanDerWaalsContact O-CA 3.3Å; D143-V211 WeakPolarHBondContact O-CA 3.42Å; D143-I212 HydrophobicContact CB-CB 4.28Å; D143-I212 PolarHBondContact N-O 2.96Å; D143-I212 PolarHBondContact O-N 3.31Å; D143-K214 VanDerWaalsContact CG-NZ 3.34Å; D143-K214 IonicContact OD1-NZ 3.07Å; D143-K214 IonicContact OD2-NZ 3.9Å; D143-K214 PolarHBondContact OD2-NZ 3.14Å
144	H	98.3	Very high	91.3	Very high	18 Å²	18	47 Å²	47	8%	0.083	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.9	166.5	-69.7	-100.8	0	0	0	108.6	Y146 M154 L155 F195 K199 E208 V211	H144-Y146 HydrophobicContact CB-CE2 3.68Å; H144-M154 CarbonylContact O-C 3.47Å; H144-M154 VanDerWaalsContact O-CA 3.31Å; H144-M154 WeakPolarHBondContact O-CA 3.2Å; H144-L155 PolarHBondContact N-O 3.25Å; H144-L155 PolarHBondContact O-N 3.35Å; H144-F195 AromaticContact CD2-CZ 3.55Å; H144-F195 AromaticContact NE2-CZ 3.82Å; H144-K199 WeakPolarHBondContact CE1-CE 3.42Å; H144-K199 WeakPolarHBondContact ND1-CE 3.47Å; H144-E208 IonicContact CE1-OE1 2.96Å; H144-E208 VanDerWaalsContact ND1-CD 3.32Å; H144-E208 IonicContact ND1-OE1 3.61Å; H144-E208 PolarHBondContact ND1-OE1 3Å; H144-E208 IonicContact ND1-OE2 2.9Å; H144-E208 PolarHBondContact ND1-OE2 3.27Å; H144-V211 WeakPolarHBondContact ND1-CG2 3.45Å
145	I	97.4	Very high	92.3	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.7	-178.7	-49.8	-58	0	0	0	108.6	D143 Y152 M154 E208 L209 G210 I212 H277	D143-I145 HydrophobicContact CB-CD1 4.1Å; I145-Y152 HydrophobicContact CG2-CD1 4.37Å; I145-M154 HydrophobicContact CD1-CB 3.83Å; I145-M154 HydrophobicContact CD1-CG 3.63Å; I145-M154 HydrophobicContact CD1-SD 3.89Å; I145-E208 CarbonylContact O-C 3.59Å; I145-L209 HydrophobicContact CG2-CB 4.48Å; I145-L209 HydrophobicContact CG2-CD1 4.36Å; I145-L209 PolarHBondContact O-N 2.87Å; I145-G210 PolarHBondContact N-O 2.91Å; I145-G210 PolarHBondContact O-N 3.49Å; I145-I212 HydrophobicContact CG1-CG1 4.48Å; I145-H277 HydrophobicContact CG1-CB 4.45Å
146	Y	96.5	Very high	93.6	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	146.5	179.3	-57.8	-84.5	0	0	0	110.7	H144 L153 L155 L202 S203 L206 E207 E208	H144-Y146 HydrophobicContact CB-CE2 3.68Å; Y146-L153 PolarHBondContact N-O 2.87Å; Y146-L153 PolarHBondContact O-N 2.98Å; Y146-L155 HydrophobicContact CE2-CB 3.97Å; Y146-L202 HydrophobicContact CD1-CB 4.42Å; Y146-L202 HydrophobicContact CD2-CB 4.44Å; Y146-L202 HydrophobicContact CD2-CD1 4.25Å; Y146-L202 HydrophobicContact CE1-CB 4.04Å; Y146-L202 HydrophobicContact CE2-CB 4.05Å; Y146-L202 HydrophobicContact CE2-CD1 3.9Å; Y146-S203 PolarHBondContact OH-OG 2.95Å; Y146-L206 HydrophobicContact CD1-CB 4.23Å; Y146-E207 VanDerWaalsContact CA-O 3.27Å; Y146-E207 WeakPolarHBondContact CA-O 3.23Å; Y146-E208 HydrophobicContact CD1-CB 3.95Å; Y146-E208 HydrophobicContact CD1-CG 4.23Å; Y146-E208 HydrophobicContact CE1-CB 3.77Å; Y146-E208 HydrophobicContact CE1-CG 3.83Å; Y146-E208 WeakPolarHBondContact CE1-OE2 3.47Å; Y146-E208 PolarHBondContact OH-OE2 2.88Å; Y146-E208 VanDerWaalsContact OH-OE2 3.08Å
147	G	90	Very high	94.3	Very high	24 Å²	24	41.8 Å²	41.8	25%	0.247	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	133.8	167.9	0	0	0	0	0	110.2	E207	G147-E207 PolarHBondContact N-O 2.92Å
148	A	87.3	Confident	94.5	Very high	42 Å²	42	40.9 Å²	40.9	35%	0.347	23%	0.23	S	C	.	.			trans	-123.9	158.4	174.7	0	0	0	0	0	109.9	V150 L153	A148-V150 WeakPolarHBondContact CB-O 3.49Å; A148-V150 PolarHBondContact O-N 2.8Å; A148-L153 HydrophobicContact CB-CB 4.24Å
149	C	84.8	Confident	94.6	Very high	138 Å²	138	41.6 Å²	41.6	93%	0.932	23%	0.231	S	C	*	.	S	Bend	trans	-63.8	-27.2	175	-63.2	0	0	0	0	112.5
150	V	83.1	Confident	94.5	Very high	96 Å²	96	48 Å²	48	58%	0.582	26%	0.262	S	S	*	.	S	Bend	trans	-134.6	126	178	-179.8	0	0	0	0	107.2	A148 E170	A148-V150 WeakPolarHBondContact CB-O 3.49Å; A148-V150 PolarHBondContact O-N 2.8Å; V150-E170 HydrophobicContact CG1-CG 4.12Å; V150-E170 WeakPolarHBondContact CG1-OE1 3.3Å
151	G	88.4	Confident	94.3	Very high	29 Å²	29	41.2 Å²	41.2	30%	0.299	24%	0.24	S	C	.	.	S	Bend	trans	57.4	-136.5	-178.1	0	0	0	0	0	113.6	Y169	G151-Y169 WeakPolarHBondContact CA-O 3.42Å
152	Y	92.9	Very high	94.1	Very high	78 Å²	78	46.2 Å²	46.2	31%	0.306	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	153.7	-179.3	-59.3	-90.1	0	0	0	110.8	I145 A168 Y169 L209	I145-Y152 HydrophobicContact CG2-CD1 4.37Å; Y152-A168 WeakPolarHBondContact O-CA 3.42Å; Y152-Y169 HydrophobicContact CD2-CD2 4.37Å; Y152-Y169 AromaticContact CD2-CE2 3.77Å; Y152-Y169 HydrophobicContact CD2-CE2 3.77Å; Y152-Y169 HydrophobicContact CG-CE2 4.06Å; Y152-Y169 PolarHBondContact N-O 3.25Å; Y152-Y169 PolarHBondContact O-N 2.96Å; Y152-L209 HydrophobicContact CD1-CD1 4.36Å; Y152-L209 HydrophobicContact CE1-CD1 4.47Å
153	L	96.6	Very high	93.9	Very high	27 Å²	27	44.9 Å²	44.9	14%	0.141	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.1	169.8	-172.7	73.8	0	0	0	109.2	Y146 A148 L166 M167 A168 L202 L206	Y146-L153 PolarHBondContact N-O 2.87Å; Y146-L153 PolarHBondContact O-N 2.98Å; A148-L153 HydrophobicContact CB-CB 4.24Å; L153-L166 HydrophobicContact CD1-CD1 3.75Å; L153-L166 HydrophobicContact CD1-CD2 4.48Å; L153-L166 HydrophobicContact CD1-CG 4.03Å; L153-L166 HydrophobicContact CD2-CD1 4.12Å; L153-L166 HydrophobicContact CG-CD1 3.83Å; L153-M167 CarbonylContact C-O 3.51Å; L153-M167 WeakPolarHBondContact CA-O 3.41Å; L153-A168 HydrophobicContact CD1-CB 4.02Å; L153-L202 HydrophobicContact CD2-CD1 4.34Å; L153-L202 HydrophobicContact CD2-CD2 3.83Å; L153-L206 HydrophobicContact CD2-CD1 3.53Å
154	M	97.4	Very high	93.8	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.039	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.2	-179.4	172.8	-178.6	75.9	0	0	110.6	D143 H144 I145 R156 L166 M167 Y169	D143-M154 HydrophobicContact CB-CG 3.92Å; D143-M154 HydrophobicContact CB-SD 3.71Å; D143-M154 VanDerWaalsContact OD2-SD 3.35Å; H144-M154 CarbonylContact O-C 3.47Å; H144-M154 VanDerWaalsContact O-CA 3.31Å; H144-M154 WeakPolarHBondContact O-CA 3.2Å; I145-M154 HydrophobicContact CD1-CB 3.83Å; I145-M154 HydrophobicContact CD1-CG 3.63Å; I145-M154 HydrophobicContact CD1-SD 3.89Å; M154-R156 HydrophobicContact CE-CB 4.48Å; M154-L166 CarbonylContact O-C 3.58Å; M154-L166 WeakPolarHBondContact O-CA 3.22Å; M154-M167 HydrophobicContact CE-CB 4.05Å; M154-M167 HydrophobicContact CE-CE 4.46Å; M154-M167 HydrophobicContact CE-SD 3.86Å; M154-M167 PolarHBondContact N-O 3.3Å; M154-M167 PolarHBondContact O-N 3.08Å; M154-Y169 HydrophobicContact CB-CE1 3.9Å
155	L	98.5	Very high	93.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.2	167.3	179.7	65.6	0	0	0	109.3	H144 Y146 I165 L166 V192 F195 M198 K199 L202	H144-L155 PolarHBondContact N-O 3.25Å; H144-L155 PolarHBondContact O-N 3.35Å; Y146-L155 HydrophobicContact CE2-CB 3.97Å; L155-I165 WeakPolarHBondContact CA-O 3.05Å; L155-L166 HydrophobicContact CB-CD1 4.3Å; L155-L166 HydrophobicContact CD1-CB 4.47Å; L155-L166 HydrophobicContact CD1-CD1 4.43Å; L155-V192 HydrophobicContact CD1-CG2 3.66Å; L155-F195 HydrophobicContact CD1-CD2 4.12Å; L155-F195 HydrophobicContact CD1-CE2 4.45Å; L155-F195 HydrophobicContact CD2-CD2 3.84Å; L155-F195 HydrophobicContact CD2-CE2 3.76Å; L155-F195 HydrophobicContact CD2-CG 4.41Å; L155-F195 HydrophobicContact CD2-CZ 4.28Å; L155-F195 HydrophobicContact CG-CD2 3.72Å; L155-F195 HydrophobicContact CG-CE2 3.59Å; L155-F195 HydrophobicContact CG-CZ 4.49Å; L155-M198 HydrophobicContact CD1-CB 4.36Å; L155-M198 HydrophobicContact CD1-CG 3.99Å; L155-M198 HydrophobicContact CD2-CB 4.19Å; L155-M198 HydrophobicContact CD2-CG 4.16Å; L155-K199 HydrophobicContact CD2-CB 3.67Å; L155-L202 HydrophobicContact CB-CD1 4.15Å; L155-L202 HydrophobicContact CD2-CD1 4.29Å
156	R	98.3	Very high	93.7	Very high	35 Å²	35	45.7 Å²	45.7	13%	0.132	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.1	-178	172.6	170.6	-67.4	173.3	9	111.8	E141 V142 D143 M154 I158 G164 I165	E141-R156 VanDerWaalsContact CD-CD 3.49Å; E141-R156 VanDerWaalsContact CD-CZ 3.47Å; E141-R156 HydrophobicContact CG-CG 4.48Å; E141-R156 WeakPolarHBondContact OE1-CD 3.28Å; E141-R156 IonicContact OE1-CZ 2.83Å; E141-R156 IonicContact OE1-NE 3.36Å; E141-R156 IonicContact OE1-NH1 2.86Å; E141-R156 PolarHBondContact OE1-NH1 2.86Å; E141-R156 IonicContact OE2-CZ 3.87Å; E141-R156 IonicContact OE2-NE 3Å; E141-R156 PolarHBondContact OE2-NE 2.8Å; E141-R156 IonicContact OE2-NH1 3.87Å; E141-R156 PolarHBondContact OE2-NH1 3.45Å; E141-R156 VanDerWaalsContact OE2-NH1 3.11Å; E141-R156 IonicContact OE2-NH2 3.53Å; E141-R156 PolarHBondContact OE2-NH2 3Å; V142-R156 WeakPolarHBondContact O-CA 3.28Å; D143-R156 VanDerWaalsContact OD1-CB 3.3Å; D143-R156 WeakPolarHBondContact OD1-CB 3.42Å; D143-R156 WeakPolarHBondContact OD1-CG 3.31Å; D143-R156 IonicContact OD1-CZ 3.79Å; D143-R156 IonicContact OD1-NE 2.7Å; D143-R156 PolarHBondContact OD1-NE 2.87Å; D143-R156 IonicContact OD1-NH2 3.03Å; D143-R156 IonicContact OD2-CZ 3.3Å; D143-R156 IonicContact OD2-NE 3.34Å; D143-R156 IonicContact OD2-NH2 2.7Å; D143-R156 PolarHBondContact OD2-NH2 3.34Å; M154-R156 HydrophobicContact CE-CB 4.48Å; R156-I158 HydrophobicContact CG-CG1 4.14Å; R156-G164 CarbonylContact O-C 3.58Å; R156-G164 WeakPolarHBondContact O-CA 3.12Å; R156-I165 HydrophobicContact CB-CB 4.36Å; R156-I165 PolarHBondContact N-O 2.98Å; R156-I165 PolarHBondContact O-N 3.05Å
157	M	97.3	Very high	93.7	Very high	27 Å²	27	47.4 Å²	47.4	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141.2	163.3	-179.4	-175.9	-81.9	0	0	109.6	E141 V142 E160 F195	E141-M157 VanDerWaalsContact CA-O 3.29Å; E141-M157 WeakPolarHBondContact CA-O 3.24Å; V142-M157 HydrophobicContact CB-CB 4.37Å; V142-M157 PolarHBondContact N-O 2.9Å; V142-M157 PolarHBondContact O-N 2.97Å; M157-E160 HydrophobicContact SD-CB 4.49Å; M157-F195 HydrophobicContact CB-CD2 3.75Å; M157-F195 HydrophobicContact CB-CE2 3.57Å; M157-F195 HydrophobicContact CB-CG 4.34Å; M157-F195 HydrophobicContact CB-CZ 4.02Å; M157-F195 HydrophobicContact CE-CB 4.09Å; M157-F195 HydrophobicContact CE-CD1 3.16Å; M157-F195 HydrophobicContact CE-CD2 4.12Å; M157-F195 HydrophobicContact CE-CE1 3.41Å; M157-F195 VanDerWaalsContact CE-CE1 3.41Å; M157-F195 HydrophobicContact CE-CE2 4.32Å; M157-F195 HydrophobicContact CE-CG 3.53Å; M157-F195 HydrophobicContact CE-CZ 3.98Å
158	I	96.5	Very high	93.9	Very high	17 Å²	17	48.4 Å²	48.4	9%	0.087	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.4	175.6	-63.3	173.7	0	0	0	108.1	Y94 Y139 R140 E141 R156 E160 A161 I165	Y94-I158 HydrophobicContact CD1-CB 4.33Å; Y94-I158 HydrophobicContact CD1-CD1 4.02Å; Y94-I158 HydrophobicContact CD1-CG2 4.33Å; Y94-I158 HydrophobicContact CE1-CB 4.11Å; Y94-I158 HydrophobicContact CE1-CD1 4.13Å; Y139-I158 HydrophobicContact CD2-CG2 3.65Å; Y139-I158 HydrophobicContact CE2-CD1 4.46Å; Y139-I158 HydrophobicContact CE2-CG1 4.36Å; Y139-I158 HydrophobicContact CE2-CG2 4.08Å; Y139-I158 HydrophobicContact CG-CG2 4.3Å; R140-I158 WeakPolarHBondContact O-CA 3.35Å; E141-I158 HydrophobicContact CG-CG1 4.24Å; R156-I158 HydrophobicContact CG-CG1 4.14Å; I158-E160 PolarHBondContact O-N 2.9Å; I158-E160 VanDerWaalsContact O-N 3.09Å; I158-A161 WeakPolarHBondContact O-CB 3.44Å; I158-A161 PolarHBondContact O-N 2.81Å; I158-I165 HydrophobicContact CD1-CD1 3.92Å
159	D	95.4	Very high	94.2	Very high	90 Å²	90	47.7 Å²	47.7	48%	0.481	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.2	42	176.3	-71.3	-24.5	0	0	0	114.6	Y139 R140 A161	Y139-D159 WeakPolarHBondContact CB-OD2 3.28Å; R140-D159 PolarHBondContact N-OD1 2.88Å; R140-D159 PolarHBondContact O-N 2.76Å; D159-A161 PolarHBondContact O-N 3.47Å; D159-A161 VanDerWaalsContact O-N 3.09Å
160	E	93.6	Very high	94.5	Very high	163 Å²	163	45.6 Å²	45.6	76%	0.762	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	22.4	179.7	-58.3	177.1	-156.4	0	0	114.1	M157 I158	M157-E160 HydrophobicContact SD-CB 4.49Å; I158-E160 PolarHBondContact O-N 2.9Å; I158-E160 VanDerWaalsContact O-N 3.09Å
161	A	92.7	Very high	94.9	Very high	21 Å²	21	43.7 Å²	43.7	17%	0.174	23%	0.232	C	C	.	.			trans	-61.2	144.9	175.7	0	0	0	0	0	111.2	Y94 I158 D159 S163	Y94-A161 HydrophobicContact CE1-CB 4.49Å; I158-A161 WeakPolarHBondContact O-CB 3.44Å; I158-A161 PolarHBondContact O-N 2.81Å; D159-A161 PolarHBondContact O-N 3.47Å; D159-A161 VanDerWaalsContact O-N 3.09Å; A161-S163 PolarHBondContact O-N 3.44Å
162	P	94.2	Very high	94.8	Very high	108 Å²	108	46.4 Å²	46.4	70%	0.701	24%	0.244	S	C	*	.	S	Bend	trans	-68	-25.4	178.4	27.3	-34.8	0	0	0	112.6	S194 F195	P162-S194 CarbonylContact O-C 3.56Å; P162-S194 WeakPolarHBondContact O-CA 3.29Å; P162-F195 PolarHBondContact O-N 2.83Å
163	S	95.6	Very high	94.2	Very high	10 Å²	10	45.7 Å²	45.7	7%	0.07	25%	0.248	C	C	.	.			trans	-89.3	156.1	172.5	53	0	0	0	0	111.3	Y94 A161 V192	Y94-S163 PolarHBondContact OH-O 3Å; Y94-S163 PolarHBondContact OH-OG 3.46Å; A161-S163 PolarHBondContact O-N 3.44Å; S163-V192 CarbonylContact C-O 3.55Å; S163-V192 VanDerWaalsContact CA-O 3.3Å; S163-V192 WeakPolarHBondContact CA-O 3.44Å; S163-V192 WeakPolarHBondContact CB-O 3.47Å
164	G	95.2	Very high	92.9	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	-179.1	177	0	0	0	0	0	112.7	R156 V192	R156-G164 CarbonylContact O-C 3.58Å; R156-G164 WeakPolarHBondContact O-CA 3.12Å; G164-V192 PolarHBondContact N-O 2.81Å; G164-V192 WeakPolarHBondContact O-CG2 3.44Å; G164-V192 PolarHBondContact O-N 3.34Å
165	I	96.6	Very high	91.5	Very high	10 Å²	10	47.5 Å²	47.5	5%	0.051	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.4	173.1	-65.2	165.1	0	0	0	107.7	L155 R156 I158 W189	L155-I165 WeakPolarHBondContact CA-O 3.05Å; R156-I165 HydrophobicContact CB-CB 4.36Å; R156-I165 PolarHBondContact N-O 2.98Å; R156-I165 PolarHBondContact O-N 3.05Å; I158-I165 HydrophobicContact CD1-CD1 3.92Å; I165-W189 HydrophobicContact CG2-CB 4.23Å; I165-W189 HydrophobicContact CG2-CE3 3.97Å
166	L	97.2	Very high	89.9	Confident	35 Å²	35	52.7 Å²	52.7	18%	0.183	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.8	169.6	-174.1	63.4	0	0	0	108.6	L153 M154 L155 W189 A190 V192 M198 L202	L153-L166 HydrophobicContact CD1-CD1 3.75Å; L153-L166 HydrophobicContact CD1-CD2 4.48Å; L153-L166 HydrophobicContact CD1-CG 4.03Å; L153-L166 HydrophobicContact CD2-CD1 4.12Å; L153-L166 HydrophobicContact CG-CD1 3.83Å; M154-L166 CarbonylContact O-C 3.58Å; M154-L166 WeakPolarHBondContact O-CA 3.22Å; L155-L166 HydrophobicContact CB-CD1 4.3Å; L155-L166 HydrophobicContact CD1-CB 4.47Å; L155-L166 HydrophobicContact CD1-CD1 4.43Å; L166-W189 CarbonylContact O-C 3.56Å; L166-W189 WeakPolarHBondContact O-CA 3.47Å; L166-A190 PolarHBondContact N-O 3.29Å; L166-A190 PolarHBondContact O-N 2.93Å; L166-V192 HydrophobicContact CB-CG1 3.79Å; L166-M198 HydrophobicContact CD2-SD 4.48Å; L166-L202 HydrophobicContact CD1-CD1 3.62Å
167	M	95.6	Very high	88.3	Confident	36 Å²	36	56 Å²	56	18%	0.177	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.6	-178.3	-174.6	178.5	-70.4	0	0	110.4	L153 M154 Y169 Y187 R188 W189	L153-M167 CarbonylContact C-O 3.51Å; L153-M167 WeakPolarHBondContact CA-O 3.41Å; M154-M167 HydrophobicContact CE-CB 4.05Å; M154-M167 HydrophobicContact CE-CE 4.46Å; M154-M167 HydrophobicContact CE-SD 3.86Å; M154-M167 PolarHBondContact N-O 3.3Å; M154-M167 PolarHBondContact O-N 3.08Å; M167-Y169 HydrophobicContact CG-CD1 4.14Å; M167-Y169 HydrophobicContact SD-CD1 4.33Å; M167-Y187 HydrophobicContact CE-CD2 3.93Å; M167-Y187 HydrophobicContact CE-CE2 4.15Å; M167-Y187 HydrophobicContact CG-CD2 4.26Å; M167-Y187 HydrophobicContact SD-CD2 4.02Å; M167-Y187 HydrophobicContact SD-CG 4.47Å; M167-R188 CarbonylContact C-O 3.54Å; M167-R188 VanDerWaalsContact CA-O 3.29Å; M167-R188 WeakPolarHBondContact CA-O 3.39Å; M167-R188 WeakPolarHBondContact CG-O 2.98Å; M167-W189 HydrophobicContact CB-CB 4.27Å; M167-W189 HydrophobicContact CE-CB 4.06Å; M167-W189 HydrophobicContact CG-CB 4.26Å
168	A	94.7	Very high	86.8	Confident	46 Å²	46	60.2 Å²	60.2	38%	0.38	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.4	167	0	0	0	0	0	108.1	Y152 L153 Y187 R188	Y152-A168 WeakPolarHBondContact O-CA 3.42Å; L153-A168 HydrophobicContact CD1-CB 4.02Å; A168-Y187 CarbonylContact O-C 3.58Å; A168-Y187 VanDerWaalsContact O-CA 3.23Å; A168-Y187 WeakPolarHBondContact O-CA 3.4Å; A168-Y187 WeakPolarHBondContact O-CB 3.5Å; A168-R188 PolarHBondContact N-O 2.87Å; A168-R188 PolarHBondContact O-N 3.38Å
169	Y	94	Very high	85.4	Confident	26 Å²	26	67.2 Å²	67.2	10%	0.102	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	152.8	-177.4	65.6	-91.3	0	0	0	113.2	G151 Y152 M154 M167 R171 E186	G151-Y169 WeakPolarHBondContact CA-O 3.42Å; Y152-Y169 HydrophobicContact CD2-CD2 4.37Å; Y152-Y169 AromaticContact CD2-CE2 3.77Å; Y152-Y169 HydrophobicContact CD2-CE2 3.77Å; Y152-Y169 HydrophobicContact CG-CE2 4.06Å; Y152-Y169 PolarHBondContact N-O 3.25Å; Y152-Y169 PolarHBondContact O-N 2.96Å; M154-Y169 HydrophobicContact CB-CE1 3.9Å; M167-Y169 HydrophobicContact CG-CD1 4.14Å; M167-Y169 HydrophobicContact SD-CD1 4.33Å; Y169-R171 HydrophobicContact CD2-CG 3.92Å; Y169-R171 HydrophobicContact CE2-CG 4.14Å; Y169-E186 CarbonylContact C-O 3.56Å; Y169-E186 WeakPolarHBondContact CA-O 3.25Å; Y169-E186 WeakPolarHBondContact CB-O 3.38Å
170	E	90.4	Very high	84.8	Confident	95 Å²	95	66.7 Å²	66.7	44%	0.444	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	139.2	171.7	-70.8	-178.4	-108.5	0	0	108.8	V150 T185 E186	V150-E170 HydrophobicContact CG1-CG 4.12Å; V150-E170 WeakPolarHBondContact CG1-OE1 3.3Å; E170-T185 VanDerWaalsContact O-CA 3.3Å; E170-T185 WeakPolarHBondContact O-CA 3.38Å; E170-E186 PolarHBondContact N-O 3.33Å; E170-E186 PolarHBondContact O-N 3.02Å
171	R	90.7	Very high	84.4	Confident	55 Å²	55	59.4 Å²	59.4	21%	0.208	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126	179.4	-64	171.9	69.4	86.5	8.1	108.3	E113 Y169 M183 V184 T185	E113-R171 IonicContact OE2-CZ 3.19Å; E113-R171 IonicContact OE2-NH1 2.6Å; E113-R171 PolarHBondContact OE2-NH1 2.95Å; E113-R171 IonicContact OE2-NH2 3.17Å; Y169-R171 HydrophobicContact CD2-CG 3.92Å; Y169-R171 HydrophobicContact CE2-CG 4.14Å; R171-M183 HydrophobicContact CB-CE 4Å; R171-V184 WeakPolarHBondContact CA-O 3.31Å; R171-T185 HydrophobicContact CG-CG2 4.13Å
172	T	87.4	Confident	84.4	Confident	87 Å²	87	58.6 Å²	58.6	53%	0.534	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.4	176.9	-49.5	0	0	0	0	108.9	S174 V184	T172-S174 PolarHBondContact O-N 2.95Å; T172-V184 PolarHBondContact N-O 2.76Å; T172-V184 PolarHBondContact O-N 2.9Å
173	P	80.1	Confident	84.4	Confident	62 Å²	62	54.2 Å²	54.2	40%	0.403	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	139.5	173.3	27	-33.3	0	0	0	109.7	S175 V181 M183	P173-S175 PolarHBondContact O-N 2.73Å; P173-V181 HydrophobicContact CB-CG2 4.3Å; P173-M183 VanDerWaalsContact CA-SD 3.58Å; P173-M183 HydrophobicContact CB-CE 4.26Å; P173-M183 HydrophobicContact CB-SD 3.95Å
174	S	68.6	Low	84.3	Confident	43 Å²	43	54.4 Å²	54.4	30%	0.301	31%	0.313	S	S	.	.	S	Bend	trans	-67.3	-18.5	179.9	55.2	0	0	0	0	113.5	T172 V181 P182	T172-S174 PolarHBondContact O-N 2.95Å; S174-V181 WeakPolarHBondContact OG-CB 3.36Å; S174-P182 WeakPolarHBondContact CB-O 2.89Å; S174-P182 PolarHBondContact N-O 2.93Å; S174-P182 PolarHBondContact OG-O 3.15Å
175	S	69.8	Low	84.2	Confident	30 Å²	30	54.6 Å²	54.6	21%	0.21	31%	0.313	C	S	.	.			trans	-140.3	130.7	172.5	177.7	0	0	0	0	109.8	P173 S177	P173-S175 PolarHBondContact O-N 2.73Å; S175-S177 VanDerWaalsContact C-N 3.26Å; S175-S177 PolarHBondContact O-N 3.45Å; S175-S177 PolarHBondContact OG-N 3.33Å; S175-S177 PolarHBondContact OG-OG 3.13Å; S175-S177 VanDerWaalsContact OG-OG 3.09Å
176	A	63.2	Low	84.1	Confident	110 Å²	110	58.7 Å²	58.7	91%	0.909	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-21.3	177.3	0	0	0	0	0	113
177	S	65.5	Low	83.9	Confident	105 Å²	105	58.1 Å²	58.1	73%	0.734	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.6	-177.3	56.7	0	0	0	0	113.9	S175	S175-S177 VanDerWaalsContact C-N 3.26Å; S175-S177 PolarHBondContact O-N 3.45Å; S175-S177 PolarHBondContact OG-N 3.33Å; S175-S177 PolarHBondContact OG-OG 3.13Å; S175-S177 VanDerWaalsContact OG-OG 3.09Å
178	E	66.1	Low	83.8	Confident	114 Å²	114	62.6 Å²	62.6	53%	0.533	34%	0.343	S	S	.	.			trans	-121.8	127.5	-172.7	-63.6	177.2	-154	0	0	110.7	V181	E178-V181 HydrophobicContact CB-CG1 3.34Å; E178-V181 HydrophobicContact CG-CG1 4.23Å; E178-V181 WeakPolarHBondContact O-CG2 3.19Å; E178-V181 WeakPolarHBondContact OE2-CG1 3.49Å
179	Q	67.3	Low	83.8	Confident	164 Å²	164	61.6 Å²	61.6	77%	0.766	33%	0.329	S	S	*	.	S	Bend	trans	-83.8	-18.7	-178.5	-65.9	-178.3	-10.5	0	0	113
180	H	82.9	Confident	83.8	Confident	80 Å²	80	62 Å²	62	37%	0.37	34%	0.337	S	S	.	.	S	Bend	trans	-116.2	54.5	-170.3	-62	-59.7	0	0	0	111.4	P268 I271	H180-P268 WeakPolarHBondContact CB-O 3.14Å; H180-P268 VanDerWaalsContact CG-O 3.31Å; H180-P268 PolarHBondContact ND1-O 2.95Å; H180-I271 HydrophobicContact CB-CB 4.13Å; H180-I271 PolarHBondContact ND1-O 3.24Å
181	V	84.5	Confident	83.9	Confident	9 Å²	9	59.9 Å²	59.9	6%	0.055	33%	0.328	C	S	.	.	S	Bend	trans	-122.2	159	-175.5	-68.6	0	0	0	0	112.6	P173 S174 E178	P173-V181 HydrophobicContact CB-CG2 4.3Å; S174-V181 WeakPolarHBondContact OG-CB 3.36Å; E178-V181 HydrophobicContact CB-CG1 3.34Å; E178-V181 HydrophobicContact CG-CG1 4.23Å; E178-V181 WeakPolarHBondContact O-CG2 3.19Å; E178-V181 WeakPolarHBondContact OE2-CG1 3.49Å
182	P	92.6	Very high	84.1	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.026	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-55.7	143.8	166.3	-22.7	33.6	0	0	0	111.5	V112 E113 L114 S174 L254 M257 M261	V112-P182 HydrophobicContact CG1-CB 3.74Å; E113-P182 CarbonylContact O-C 3.38Å; E113-P182 VanDerWaalsContact O-CA 3.29Å; E113-P182 WeakPolarHBondContact O-CA 3.39Å; L114-P182 HydrophobicContact CD1-CG 4.4Å; S174-P182 WeakPolarHBondContact CB-O 2.89Å; S174-P182 PolarHBondContact N-O 2.93Å; S174-P182 PolarHBondContact OG-O 3.15Å; P182-L254 HydrophobicContact CB-CD2 4.08Å; P182-L254 HydrophobicContact CG-CD2 4.45Å; P182-M257 HydrophobicContact CB-CG 4.12Å; P182-M257 HydrophobicContact CG-CB 4.15Å; P182-M257 HydrophobicContact CG-CG 3.65Å; P182-M261 HydrophobicContact CG-SD 4.18Å
183	M	93.5	Very high	84.4	Confident	17 Å²	17	59.2 Å²	59.2	8%	0.084	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	142.4	173.9	-60.1	-63.1	-69.8	0	0	109.5	V112 E113 R171 P173	V112-M183 CarbonylContact C-O 3.55Å; V112-M183 WeakPolarHBondContact CA-O 3.38Å; E113-M183 PolarHBondContact N-O 2.86Å; E113-M183 PolarHBondContact O-N 3.13Å; R171-M183 HydrophobicContact CB-CE 4Å; P173-M183 VanDerWaalsContact CA-SD 3.58Å; P173-M183 HydrophobicContact CB-CE 4.26Å; P173-M183 HydrophobicContact CB-SD 3.95Å
184	V	94.2	Very high	85.1	Confident	14 Å²	14	58.2 Å²	58.2	9%	0.085	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.6	164.8	-176.8	0	0	0	0	107.3	V110 N111 V112 R171 T172 I250	V110-V184 HydrophobicContact CG1-CG1 3.85Å; N111-V184 WeakPolarHBondContact O-CA 3.28Å; V112-V184 HydrophobicContact CG2-CG2 4.45Å; R171-V184 WeakPolarHBondContact CA-O 3.31Å; T172-V184 PolarHBondContact N-O 2.76Å; T172-V184 PolarHBondContact O-N 2.9Å; V184-I250 HydrophobicContact CG1-CD1 4.04Å; V184-I250 HydrophobicContact CG1-CG1 4.39Å; V184-I250 HydrophobicContact CG1-CG2 4.47Å; V184-I250 HydrophobicContact CG2-CG2 3.63Å
185	T	94	Very high	86.5	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.025	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.9	178.7	-57.3	0	0	0	0	109.1	V110 N111 E113 E170 R171	V110-T185 WeakPolarHBondContact CA-O 3.3Å; N111-T185 PolarHBondContact N-O 3.47Å; N111-T185 PolarHBondContact O-N 3.13Å; E113-T185 VanDerWaalsContact OE1-CB 3.28Å; E113-T185 WeakPolarHBondContact OE1-CB 3.18Å; E113-T185 PolarHBondContact OE1-OG1 3.09Å; E113-T185 PolarHBondContact OE2-OG1 2.95Å; E170-T185 VanDerWaalsContact O-CA 3.3Å; E170-T185 WeakPolarHBondContact O-CA 3.38Å; R171-T185 HydrophobicContact CG-CG2 4.13Å
186	E	92.8	Very high	87.8	Confident	97 Å²	97	60.4 Å²	60.4	45%	0.453	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.3	168	-60.6	-167.3	-169.6	0	0	108.6	S109 V110 Y169 E170	S109-E186 WeakPolarHBondContact O-CA 3.42Å; V110-E186 HydrophobicContact CG1-CG 4.3Å; V110-E186 HydrophobicContact CG2-CG 4.09Å; Y169-E186 CarbonylContact C-O 3.56Å; Y169-E186 WeakPolarHBondContact CA-O 3.25Å; Y169-E186 WeakPolarHBondContact CB-O 3.38Å; E170-E186 PolarHBondContact N-O 3.33Å; E170-E186 PolarHBondContact O-N 3.02Å
187	Y	93.9	Very high	89.5	Confident	23 Å²	23	58.8 Å²	58.8	9%	0.09	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	158.2	-176.4	71.2	-76.4	0	0	0	113.4	T103 V108 S109 N111 M167 A168 W189	T103-Y187 WeakPolarHBondContact CG2-OH 3.24Å; V108-Y187 WeakPolarHBondContact CA-O 3.42Å; S109-Y187 VanDerWaalsContact CB-CE1 3.42Å; S109-Y187 PolarHBondContact N-O 2.94Å; S109-Y187 VanDerWaalsContact O-CD1 3.3Å; S109-Y187 WeakPolarHBondContact O-CD1 3.41Å; S109-Y187 PolarHBondContact O-N 2.81Å; N111-Y187 WeakPolarHBondContact ND2-CE1 3.25Å; M167-Y187 HydrophobicContact CE-CD2 3.93Å; M167-Y187 HydrophobicContact CE-CE2 4.15Å; M167-Y187 HydrophobicContact CG-CD2 4.26Å; M167-Y187 HydrophobicContact SD-CD2 4.02Å; M167-Y187 HydrophobicContact SD-CG 4.47Å; A168-Y187 CarbonylContact O-C 3.58Å; A168-Y187 VanDerWaalsContact O-CA 3.23Å; A168-Y187 WeakPolarHBondContact O-CA 3.4Å; A168-Y187 WeakPolarHBondContact O-CB 3.5Å; Y187-W189 AromaticContact CE2-CD1 3.79Å
188	R	93.7	Very high	91	Very high	129 Å²	129	56.3 Å²	56.3	49%	0.487	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.4	168.2	-64.8	176.1	-174.9	-92.3	2.3	107.8	G106 V108 M167 A168	G106-R188 PolarHBondContact O-NH1 3.31Å; V108-R188 HydrophobicContact CB-CG 4.48Å; M167-R188 CarbonylContact C-O 3.54Å; M167-R188 VanDerWaalsContact CA-O 3.29Å; M167-R188 WeakPolarHBondContact CA-O 3.39Å; M167-R188 WeakPolarHBondContact CG-O 2.98Å; A168-R188 PolarHBondContact N-O 2.87Å; A168-R188 PolarHBondContact O-N 3.38Å
189	W	94.4	Very high	92.6	Very high	26 Å²	26	53.5 Å²	53.5	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156	177.9	71.6	-84.2	0	0	0	111.4	M97 T103 N105 G106 I165 L166 M167 Y187 E191	M97-W189 HydrophobicContact SD-CH2 4.36Å; T103-W189 PolarHBondContact OG1-NE1 3.5Å; N105-W189 PolarHBondContact OD1-O 2.79Å; G106-W189 PolarHBondContact N-O 3.27Å; I165-W189 HydrophobicContact CG2-CB 4.23Å; I165-W189 HydrophobicContact CG2-CE3 3.97Å; L166-W189 CarbonylContact O-C 3.56Å; L166-W189 WeakPolarHBondContact O-CA 3.47Å; M167-W189 HydrophobicContact CB-CB 4.27Å; M167-W189 HydrophobicContact CE-CB 4.06Å; M167-W189 HydrophobicContact CG-CB 4.26Å; Y187-W189 AromaticContact CE2-CD1 3.79Å; W189-E191 HydrophobicContact CE3-CG 4.5Å; W189-E191 HydrophobicContact CH2-CG 4.43Å; W189-E191 HydrophobicContact CZ3-CG 3.63Å
190	A	93.6	Very high	94	Very high	33 Å²	33	48.7 Å²	48.7	27%	0.273	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	142.5	173.4	0	0	0	0	0	110.3	N105 L166	N105-A190 WeakPolarHBondContact OD1-CA 2.93Å; N105-A190 WeakPolarHBondContact OD1-CB 3.42Å; L166-A190 PolarHBondContact N-O 3.29Å; L166-A190 PolarHBondContact O-N 2.93Å
191	E	92.7	Very high	94.7	Very high	51 Å²	51	49 Å²	49	24%	0.238	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	140.3	166.5	-61	-172	172.5	0	0	110.4	L91 W189	L91-E191 WeakPolarHBondContact CD2-OE1 3.4Å; L91-E191 WeakPolarHBondContact CD2-OE2 3.25Å; W189-E191 HydrophobicContact CE3-CG 4.5Å; W189-E191 HydrophobicContact CH2-CG 4.43Å; W189-E191 HydrophobicContact CZ3-CG 3.63Å
192	V	94.6	Very high	95.3	Very high	7 Å²	7	49.4 Å²	49.4	4%	0.042	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.1	172.5	-58.1	0	0	0	0	109.1	L155 S163 G164 L166 S194 M198	L155-V192 HydrophobicContact CD1-CG2 3.66Å; S163-V192 CarbonylContact C-O 3.55Å; S163-V192 VanDerWaalsContact CA-O 3.3Å; S163-V192 WeakPolarHBondContact CA-O 3.44Å; S163-V192 WeakPolarHBondContact CB-O 3.47Å; G164-V192 PolarHBondContact N-O 2.81Å; G164-V192 WeakPolarHBondContact O-CG2 3.44Å; G164-V192 PolarHBondContact O-N 3.34Å; L166-V192 HydrophobicContact CB-CG1 3.79Å; V192-S194 VanDerWaalsContact C-N 3.26Å; V192-S194 PolarHBondContact O-N 3.06Å; V192-M198 HydrophobicContact CB-CB 4.29Å; V192-M198 HydrophobicContact CB-CE 4.17Å; V192-M198 HydrophobicContact CB-CG 4.34Å; V192-M198 HydrophobicContact CG1-CE 3.66Å; V192-M198 HydrophobicContact CG1-CG 4.1Å; V192-M198 HydrophobicContact CG2-CB 4.04Å; V192-M198 HydrophobicContact CG2-CG 4.23Å
193	P	94.2	Very high	95.4	Very high	121 Å²	121	51.5 Å²	51.5	79%	0.786	29%	0.286	S	S	*	.	S	Bend	trans	-70.8	-22	-171.7	26.6	-35	0	0	0	113.6
194	S	95.9	Very high	95.4	Very high	41 Å²	41	57.6 Å²	57.6	29%	0.287	32%	0.319	S	S	.	.			trans	-133.8	109	176.5	173.7	0	0	0	0	109	P162 V192 S197 M198	P162-S194 CarbonylContact O-C 3.56Å; P162-S194 WeakPolarHBondContact O-CA 3.29Å; V192-S194 VanDerWaalsContact C-N 3.26Å; V192-S194 PolarHBondContact O-N 3.06Å; S194-S197 WeakPolarHBondContact OG-CB 3.14Å; S194-S197 PolarHBondContact OG-N 3.35Å; S194-S197 VanDerWaalsContact OG-N 3.14Å; S194-S197 PolarHBondContact OG-OG 2.84Å; S194-M198 WeakPolarHBondContact O-CB 3.16Å; S194-M198 PolarHBondContact O-N 2.88Å
195	F	97.3	Very high	95.4	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-60.7	-51.5	175	174.4	-86.4	0	0	0	110.6	H144 L155 M157 P162 S197 M198 K199	H144-F195 AromaticContact CD2-CZ 3.55Å; H144-F195 AromaticContact NE2-CZ 3.82Å; L155-F195 HydrophobicContact CD1-CD2 4.12Å; L155-F195 HydrophobicContact CD1-CE2 4.45Å; L155-F195 HydrophobicContact CD2-CD2 3.84Å; L155-F195 HydrophobicContact CD2-CE2 3.76Å; L155-F195 HydrophobicContact CD2-CG 4.41Å; L155-F195 HydrophobicContact CD2-CZ 4.28Å; L155-F195 HydrophobicContact CG-CD2 3.72Å; L155-F195 HydrophobicContact CG-CE2 3.59Å; L155-F195 HydrophobicContact CG-CZ 4.49Å; M157-F195 HydrophobicContact CB-CD2 3.75Å; M157-F195 HydrophobicContact CB-CE2 3.57Å; M157-F195 HydrophobicContact CB-CG 4.34Å; M157-F195 HydrophobicContact CB-CZ 4.02Å; M157-F195 HydrophobicContact CE-CB 4.09Å; M157-F195 HydrophobicContact CE-CD1 3.16Å; M157-F195 HydrophobicContact CE-CD2 4.12Å; M157-F195 HydrophobicContact CE-CE1 3.41Å; M157-F195 VanDerWaalsContact CE-CE1 3.41Å; M157-F195 HydrophobicContact CE-CE2 4.32Å; M157-F195 HydrophobicContact CE-CG 3.53Å; M157-F195 HydrophobicContact CE-CZ 3.98Å; P162-F195 PolarHBondContact O-N 2.83Å; F195-S197 VanDerWaalsContact C-N 3.35Å; F195-S197 PolarHBondContact O-N 3.37Å; F195-M198 PolarHBondContact O-N 2.91Å; F195-M198 VanDerWaalsContact O-N 3.16Å; F195-K199 HydrophobicContact CD1-CD 4.48Å; F195-K199 HydrophobicContact CE1-CB 4.34Å; F195-K199 HydrophobicContact CE1-CD 3.62Å; F195-K199 HydrophobicContact CZ-CD 4.01Å; F195-K199 VanDerWaalsContact O-CB 3.28Å; F195-K199 WeakPolarHBondContact O-CB 3.32Å; F195-K199 PolarHBondContact O-N 2.81Å
196	E	97.5	Very high	95.4	Very high	116 Å²	116	63.3 Å²	63.3	54%	0.542	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-41.2	-176.6	-71.1	-57.1	139.2	0	0	112.3	A200	E196-A200 WeakPolarHBondContact O-CB 3.39Å; E196-A200 PolarHBondContact O-N 2.83Å
197	S	97.9	Very high	95.4	Very high	75 Å²	75	65.7 Å²	65.7	52%	0.524	37%	0.366	S	S	.	.	H	α-helix	trans	-66.7	-41.3	176.2	-54.6	0	0	0	0	111.7	S194 F195 A200 V201	S194-S197 WeakPolarHBondContact OG-CB 3.14Å; S194-S197 PolarHBondContact OG-N 3.35Å; S194-S197 VanDerWaalsContact OG-N 3.14Å; S194-S197 PolarHBondContact OG-OG 2.84Å; F195-S197 VanDerWaalsContact C-N 3.35Å; F195-S197 PolarHBondContact O-N 3.37Å; S197-A200 PolarHBondContact O-N 3.21Å; S197-V201 WeakPolarHBondContact O-CG2 3.35Å; S197-V201 PolarHBondContact O-N 2.87Å
198	M	98.1	Very high	95.5	Very high	54 Å²	54	67.9 Å²	67.9	27%	0.266	38%	0.377	S	S	.	.	H	α-helix	trans	-65.9	-45.5	177.5	-174.3	56.9	70.4	0	0	111.1	L155 L166 V192 S194 F195 A200 V201 L202	L155-M198 HydrophobicContact CD1-CB 4.36Å; L155-M198 HydrophobicContact CD1-CG 3.99Å; L155-M198 HydrophobicContact CD2-CB 4.19Å; L155-M198 HydrophobicContact CD2-CG 4.16Å; L166-M198 HydrophobicContact CD2-SD 4.48Å; V192-M198 HydrophobicContact CB-CB 4.29Å; V192-M198 HydrophobicContact CB-CE 4.17Å; V192-M198 HydrophobicContact CB-CG 4.34Å; V192-M198 HydrophobicContact CG1-CE 3.66Å; V192-M198 HydrophobicContact CG1-CG 4.1Å; V192-M198 HydrophobicContact CG2-CB 4.04Å; V192-M198 HydrophobicContact CG2-CG 4.23Å; S194-M198 WeakPolarHBondContact O-CB 3.16Å; S194-M198 PolarHBondContact O-N 2.88Å; F195-M198 PolarHBondContact O-N 2.91Å; F195-M198 VanDerWaalsContact O-N 3.16Å; M198-A200 VanDerWaalsContact C-N 3.34Å; M198-A200 PolarHBondContact O-N 3.27Å; M198-V201 PolarHBondContact O-N 2.88Å; M198-V201 VanDerWaalsContact O-N 3.15Å; M198-L202 HydrophobicContact CG-CD1 3.86Å; M198-L202 HydrophobicContact CG-CG 4.22Å; M198-L202 WeakPolarHBondContact O-CG 3.26Å; M198-L202 PolarHBondContact O-N 3.49Å; M198-L202 HydrophobicContact SD-CD1 4.24Å; M198-L202 HydrophobicContact SD-CD2 4.45Å; M198-L202 HydrophobicContact SD-CG 4.1Å
199	K	98.2	Very high	95.5	Very high	54 Å²	54	64.5 Å²	64.5	24%	0.235	37%	0.368	C	S	.	.	H	α-helix	trans	-55.2	-47.8	175.5	-179.1	169.7	177	-73.2	0	111.3	H144 L155 F195 V201 L202 S203	H144-K199 WeakPolarHBondContact CE1-CE 3.42Å; H144-K199 WeakPolarHBondContact ND1-CE 3.47Å; L155-K199 HydrophobicContact CD2-CB 3.67Å; F195-K199 HydrophobicContact CD1-CD 4.48Å; F195-K199 HydrophobicContact CE1-CB 4.34Å; F195-K199 HydrophobicContact CE1-CD 3.62Å; F195-K199 HydrophobicContact CZ-CD 4.01Å; F195-K199 VanDerWaalsContact O-CB 3.28Å; F195-K199 WeakPolarHBondContact O-CB 3.32Å; F195-K199 PolarHBondContact O-N 2.81Å; K199-V201 VanDerWaalsContact C-N 3.31Å; K199-V201 PolarHBondContact O-N 2.87Å; K199-L202 PolarHBondContact O-N 2.83Å; K199-S203 WeakPolarHBondContact O-CB 3.38Å; K199-S203 PolarHBondContact O-N 3.25Å; K199-S203 PolarHBondContact O-OG 3Å; K199-S203 VanDerWaalsContact O-OG 3.11Å
200	A	96.8	Very high	95.4	Very high	64 Å²	64	63.9 Å²	63.9	53%	0.529	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-40.9	177.8	0	0	0	0	0	112.8	E196 S197 M198 N204	E196-A200 WeakPolarHBondContact O-CB 3.39Å; E196-A200 PolarHBondContact O-N 2.83Å; S197-A200 PolarHBondContact O-N 3.21Å; M198-A200 VanDerWaalsContact C-N 3.34Å; M198-A200 PolarHBondContact O-N 3.27Å; A200-N204 WeakPolarHBondContact O-CB 3.39Å; A200-N204 PolarHBondContact O-N 2.7Å
201	V	97.6	Very high	95.6	Very high	86 Å²	86	64.6 Å²	64.6	52%	0.521	37%	0.371	S	S	.	.	H	α-helix	trans	-66.9	-46.1	176.5	172.4	0	0	0	0	111.1	S197 M198 K199 N204 S205	S197-V201 WeakPolarHBondContact O-CG2 3.35Å; S197-V201 PolarHBondContact O-N 2.87Å; M198-V201 PolarHBondContact O-N 2.88Å; M198-V201 VanDerWaalsContact O-N 3.15Å; K199-V201 VanDerWaalsContact C-N 3.31Å; K199-V201 PolarHBondContact O-N 2.87Å; V201-N204 PolarHBondContact O-N 3.21Å; V201-S205 WeakPolarHBondContact O-CB 3.42Å; V201-S205 PolarHBondContact O-N 2.85Å; V201-S205 PolarHBondContact O-OG 2.91Å
202	L	97.1	Very high	95.9	Very high	17 Å²	17	62.4 Å²	62.4	9%	0.089	36%	0.361	C	S	.	.	H	α-helix	trans	-67.7	-50	-178	-66.1	177.6	0	0	0	111.9	Y146 L153 L155 L166 M198 K199 N204 S205 L206	Y146-L202 HydrophobicContact CD1-CB 4.42Å; Y146-L202 HydrophobicContact CD2-CB 4.44Å; Y146-L202 HydrophobicContact CD2-CD1 4.25Å; Y146-L202 HydrophobicContact CE1-CB 4.04Å; Y146-L202 HydrophobicContact CE2-CB 4.05Å; Y146-L202 HydrophobicContact CE2-CD1 3.9Å; L153-L202 HydrophobicContact CD2-CD1 4.34Å; L153-L202 HydrophobicContact CD2-CD2 3.83Å; L155-L202 HydrophobicContact CB-CD1 4.15Å; L155-L202 HydrophobicContact CD2-CD1 4.29Å; L166-L202 HydrophobicContact CD1-CD1 3.62Å; M198-L202 HydrophobicContact CG-CD1 3.86Å; M198-L202 HydrophobicContact CG-CG 4.22Å; M198-L202 WeakPolarHBondContact O-CG 3.26Å; M198-L202 PolarHBondContact O-N 3.49Å; M198-L202 HydrophobicContact SD-CD1 4.24Å; M198-L202 HydrophobicContact SD-CD2 4.45Å; M198-L202 HydrophobicContact SD-CG 4.1Å; K199-L202 PolarHBondContact O-N 2.83Å; L202-N204 PolarHBondContact O-N 3.3Å; L202-N204 VanDerWaalsContact O-N 3.16Å; L202-S205 CarbonylContact O-C 3.55Å; L202-S205 PolarHBondContact O-N 2.86Å; L202-L206 HydrophobicContact CD2-CD1 4.18Å; L202-L206 PolarHBondContact O-N 3.13Å
203	S	94.7	Very high	96.1	Very high	49 Å²	49	67 Å²	67	34%	0.343	38%	0.381	S	S	.	.	H	α-helix	trans	-63.8	-20.5	179.3	-55.8	0	0	0	0	113.3	Y146 K199 E208	Y146-S203 PolarHBondContact OH-OG 2.95Å; K199-S203 WeakPolarHBondContact O-CB 3.38Å; K199-S203 PolarHBondContact O-N 3.25Å; K199-S203 PolarHBondContact O-OG 3Å; K199-S203 VanDerWaalsContact O-OG 3.11Å; S203-E208 PolarHBondContact OG-OE2 2.91Å
204	N	95.1	Very high	96.3	Very high	145 Å²	145	61.7 Å²	61.7	78%	0.775	35%	0.345	S	S	*	.	H	α-helix	trans	-86.6	-18.8	171.9	-172.8	46.7	0	0	0	113.1	A200 V201 L202	A200-N204 WeakPolarHBondContact O-CB 3.39Å; A200-N204 PolarHBondContact O-N 2.7Å; V201-N204 PolarHBondContact O-N 3.21Å; L202-N204 PolarHBondContact O-N 3.3Å; L202-N204 VanDerWaalsContact O-N 3.16Å
205	S	93.1	Very high	96.4	Very high	76 Å²	76	64.1 Å²	64.1	53%	0.531	35%	0.348	S	S	.	.	H	α-helix	trans	-106.4	-23.3	-173.6	-54.9	0	0	0	0	113.3	V201 L202	V201-S205 WeakPolarHBondContact O-CB 3.42Å; V201-S205 PolarHBondContact O-N 2.85Å; V201-S205 PolarHBondContact O-OG 2.91Å; L202-S205 CarbonylContact O-C 3.55Å; L202-S205 PolarHBondContact O-N 2.86Å
206	L	94.6	Very high	96.3	Very high	62 Å²	62	64.1 Å²	64.1	33%	0.325	35%	0.348	S	S	.	.	S	Bend	trans	-137.9	153.9	-172.3	-58.5	175.5	0	0	0	110.1	Y146 L153 L202	Y146-L206 HydrophobicContact CD1-CB 4.23Å; L153-L206 HydrophobicContact CD2-CD1 3.53Å; L202-L206 HydrophobicContact CD2-CD1 4.18Å; L202-L206 PolarHBondContact O-N 3.13Å
207	E	92.9	Very high	96.2	Very high	146 Å²	146	59 Å²	59	68%	0.682	33%	0.325	S	S	*	.			trans	-72.3	127.6	170.1	-176.1	177.7	-170.3	0	0	110.1	Y146 G147 L209	Y146-E207 VanDerWaalsContact CA-O 3.27Å; Y146-E207 WeakPolarHBondContact CA-O 3.23Å; G147-E207 PolarHBondContact N-O 2.92Å; E207-L209 HydrophobicContact CG-CD2 4.22Å
208	E	95	Very high	96	Very high	69 Å²	69	56.3 Å²	56.3	32%	0.322	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	110.3	171.2	-168.5	168	126.7	0	0	108.8	H144 I145 Y146 S203 V211	H144-E208 IonicContact CE1-OE1 2.96Å; H144-E208 VanDerWaalsContact ND1-CD 3.32Å; H144-E208 IonicContact ND1-OE1 3.61Å; H144-E208 PolarHBondContact ND1-OE1 3Å; H144-E208 IonicContact ND1-OE2 2.9Å; H144-E208 PolarHBondContact ND1-OE2 3.27Å; I145-E208 CarbonylContact O-C 3.59Å; Y146-E208 HydrophobicContact CD1-CB 3.95Å; Y146-E208 HydrophobicContact CD1-CG 4.23Å; Y146-E208 HydrophobicContact CE1-CB 3.77Å; Y146-E208 HydrophobicContact CE1-CG 3.83Å; Y146-E208 WeakPolarHBondContact CE1-OE2 3.47Å; Y146-E208 PolarHBondContact OH-OE2 2.88Å; Y146-E208 VanDerWaalsContact OH-OE2 3.08Å; S203-E208 PolarHBondContact OG-OE2 2.91Å; E208-V211 WeakPolarHBondContact OE1-CG2 3.44Å
209	L	93.5	Very high	95.6	Very high	58 Å²	58	54.4 Å²	54.4	30%	0.304	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-29.4	-176.4	-58	179	0	0	0	111.9	I145 Y152 E207 H277	I145-L209 HydrophobicContact CG2-CB 4.48Å; I145-L209 HydrophobicContact CG2-CD1 4.36Å; I145-L209 PolarHBondContact O-N 2.87Å; Y152-L209 HydrophobicContact CD1-CD1 4.36Å; Y152-L209 HydrophobicContact CE1-CD1 4.47Å; E207-L209 HydrophobicContact CG-CD2 4.22Å; L209-H277 VanDerWaalsContact C-NE2 3.26Å; L209-H277 PolarHBondContact O-NE2 3.45Å
210	G	94	Very high	95	Very high	14 Å²	14	53.6 Å²	53.6	14%	0.144	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.7	174	178.1	0	0	0	0	0	113.9	I145	I145-G210 PolarHBondContact N-O 2.91Å; I145-G210 PolarHBondContact O-N 3.49Å
211	V	97.6	Very high	94.6	Very high	48 Å²	48	52.5 Å²	52.5	29%	0.291	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.6	-179.2	-174.8	0	0	0	0	109.4	V142 D143 H144 E208 K213	V142-V211 HydrophobicContact CG1-CG1 3.68Å; D143-V211 CarbonylContact O-C 3.58Å; D143-V211 VanDerWaalsContact O-CA 3.3Å; D143-V211 WeakPolarHBondContact O-CA 3.42Å; H144-V211 WeakPolarHBondContact ND1-CG2 3.45Å; E208-V211 WeakPolarHBondContact OE1-CG2 3.44Å; V211-K213 HydrophobicContact CG1-CG 4.4Å
212	I	98.2	Very high	94.2	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.026	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.1	177	-55.8	-58.6	0	0	0	109.4	V142 D143 I145 K214 V231 Y276 H277 L280	V142-I212 WeakPolarHBondContact CA-O 3.42Å; D143-I212 HydrophobicContact CB-CB 4.28Å; D143-I212 PolarHBondContact N-O 2.96Å; D143-I212 PolarHBondContact O-N 3.31Å; I145-I212 HydrophobicContact CG1-CG1 4.48Å; I212-K214 HydrophobicContact CG2-CD 4.48Å; I212-V231 HydrophobicContact CG2-CG1 3.73Å; I212-Y276 HydrophobicContact CG2-CD2 4.5Å; I212-H277 HydrophobicContact CD1-CB 4.4Å; I212-H277 HydrophobicContact CG1-CB 4.5Å; I212-L280 HydrophobicContact CD1-CB 4.14Å; I212-L280 HydrophobicContact CD1-CD2 3.65Å
213	K	98.6	Very high	94	Very high	104 Å²	104	53.6 Å²	53.6	45%	0.452	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.2	175.5	-63.1	177.6	179.2	177.5	0	109	V142 V211 Q232	V142-K213 HydrophobicContact CG1-CG 4.24Å; V142-K213 HydrophobicContact CG2-CG 4.28Å; V211-K213 HydrophobicContact CG1-CG 4.4Å; K213-Q232 HydrophobicContact CB-CB 4.18Å; K213-Q232 WeakPolarHBondContact O-CB 3.49Å; K213-Q232 PolarHBondContact O-N 3.23Å
214	K	97.9	Very high	94	Very high	9 Å²	9	53 Å²	53	4%	0.039	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	151.7	-178.3	62.5	-167.4	-175.8	-62	0	113.1	R140 E141 D143 I212 E230 V231 Y276	R140-K214 WeakPolarHBondContact CA-O 3.36Å; E141-K214 HydrophobicContact CB-CG 4.03Å; E141-K214 PolarHBondContact N-O 3.47Å; E141-K214 PolarHBondContact O-N 2.62Å; E141-K214 WeakPolarHBondContact OE2-CE 3.3Å; E141-K214 IonicContact OE2-NZ 3.7Å; E141-K214 PolarHBondContact OE2-NZ 3.16Å; D143-K214 VanDerWaalsContact CG-NZ 3.34Å; D143-K214 IonicContact OD1-NZ 3.07Å; D143-K214 IonicContact OD2-NZ 3.9Å; D143-K214 PolarHBondContact OD2-NZ 3.14Å; I212-K214 HydrophobicContact CG2-CD 4.48Å; K214-E230 VanDerWaalsContact CA-O 3.26Å; K214-E230 WeakPolarHBondContact CA-O 3.31Å; K214-E230 WeakPolarHBondContact CB-O 3.28Å; K214-V231 HydrophobicContact CB-CB 4.4Å; K214-V231 HydrophobicContact CB-CG2 4Å; K214-V231 HydrophobicContact CD-CG2 4.39Å; K214-Y276 HydrophobicContact CD-CD2 4.36Å; K214-Y276 HydrophobicContact CD-CE2 4.21Å
215	R	97.8	Very high	93.9	Very high	92 Å²	92	47.3 Å²	47.3	35%	0.347	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.5	164.8	177.1	178.4	169.9	-82	-6	107.3	V138 D229 E230	V138-R215 HydrophobicContact CG1-CG 4.04Å; R215-D229 WeakPolarHBondContact O-CA 3.26Å; R215-E230 HydrophobicContact CB-CB 4.46Å; R215-E230 WeakPolarHBondContact CD-OE2 3.3Å; R215-E230 IonicContact CZ-OE2 3.88Å; R215-E230 PolarHBondContact N-O 3.2Å; R215-E230 IonicContact NE-OE2 3.21Å; R215-E230 IonicContact NH1-OE2 3.68Å; R215-E230 PolarHBondContact NH1-OE2 3.37Å; R215-E230 PolarHBondContact O-N 3.36Å
216	R	97	Very high	94.1	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.6	-175.3	170.1	163.1	-72	168	-3.6	110.6	V138 Y139 E141 L218 H227 D229 E239	V138-R216 VanDerWaalsContact CA-O 3.26Å; V138-R216 WeakPolarHBondContact CA-O 3.14Å; Y139-R216 HydrophobicContact CE1-CG 4.35Å; Y139-R216 PolarHBondContact N-O 3.18Å; Y139-R216 PolarHBondContact O-N 2.89Å; Y139-R216 WeakPolarHBondContact OH-CD 3.35Å; E141-R216 IonicContact OE1-NH1 3.12Å; E141-R216 PolarHBondContact OE1-NH1 3.18Å; E141-R216 IonicContact OE2-CZ 3.87Å; E141-R216 IonicContact OE2-NE 3.63Å; E141-R216 IonicContact OE2-NH1 2.65Å; E141-R216 PolarHBondContact OE2-NH1 2.94Å; E141-R216 IonicContact OE2-NH2 2.76Å; R216-L218 HydrophobicContact CG-CB 4.2Å; R216-H227 VanDerWaalsContact CZ-ND1 3.28Å; R216-H227 PolarHBondContact NH1-CE1 3.13Å; R216-H227 PolarHBondContact NH2-ND1 3.24Å; R216-D229 WeakPolarHBondContact CA-OD1 3.26Å; R216-D229 WeakPolarHBondContact CB-OD1 3.4Å; R216-D229 WeakPolarHBondContact CG-OD1 3.4Å; R216-D229 IonicContact CZ-OD1 3.86Å; R216-D229 IonicContact CZ-OD2 2.66Å; R216-D229 IonicContact NE-OD1 2.63Å; R216-D229 PolarHBondContact NE-OD1 3.46Å; R216-D229 IonicContact NE-OD2 3.72Å; R216-D229 PolarHBondContact NE-OD2 3.45Å; R216-D229 IonicContact NH2-OD1 2.74Å; R216-D229 IonicContact NH2-OD2 3.59Å; R216-D229 PolarHBondContact NH2-OD2 3.4Å; R216-E239 IonicContact NH2-OE2 3.91Å
217	S	94.4	Very high	94.1	Very high	9 Å²	9	41.3 Å²	41.3	6%	0.063	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	112.4	160.3	-48.8	0	0	0	0	108.2	Y121 H227 L228	Y121-S217 PolarHBondContact OH-OG 2.99Å; Y121-S217 VanDerWaalsContact OH-OG 3.13Å; S217-H227 CarbonylContact O-C 3.57Å; S217-H227 WeakPolarHBondContact O-CA 3.24Å; S217-L228 PolarHBondContact N-O 3.27Å; S217-L228 PolarHBondContact O-N 2.96Å
218	L	93.3	Very high	94.3	Very high	17 Å²	17	34.7 Å²	34.7	9%	0.089	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123.7	-175.3	176.3	69.1	0	0	0	110.9	G136 T137 Y139 R216 L225 H227	G136-L218 CarbonylContact C-O 3.55Å; G136-L218 WeakPolarHBondContact CA-O 3.45Å; T137-L218 PolarHBondContact N-O 3.02Å; T137-L218 PolarHBondContact O-N 3.25Å; Y139-L218 HydrophobicContact CE1-CB 3.63Å; Y139-L218 HydrophobicContact CE1-CD2 3.83Å; Y139-L218 HydrophobicContact CE1-CG 4.35Å; R216-L218 HydrophobicContact CG-CB 4.2Å; L218-L225 HydrophobicContact CD1-CD1 3.48Å; L218-L225 VanDerWaalsContact CD1-CD1 3.48Å; L218-L225 HydrophobicContact CD1-CD2 4.38Å; L218-L225 HydrophobicContact CD1-CG 3.79Å; L218-L225 HydrophobicContact CG-CD1 4.34Å; L218-H227 WeakPolarHBondContact CD1-CD2 3.36Å; L218-H227 WeakPolarHBondContact CD1-NE2 3.4Å
219	L	90.6	Very high	94.4	Very high	14 Å²	14	31.4 Å²	31.4	7%	0.073	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.8	168	69.3	89.9	0	0	0	111.3	F132 S134 V226	F132-L219 HydrophobicContact CB-CD1 3.43Å; F132-L219 VanDerWaalsContact CB-CD1 3.43Å; F132-L219 HydrophobicContact CB-CD2 4.48Å; F132-L219 HydrophobicContact CD2-CD1 4.35Å; F132-L219 HydrophobicContact CG-CD1 3.93Å; S134-L219 VanDerWaalsContact O-CD2 3.3Å; S134-L219 WeakPolarHBondContact O-CD2 3.38Å; L219-V226 HydrophobicContact CD1-CB 3.69Å; L219-V226 HydrophobicContact CD1-CG1 4.49Å; L219-V226 HydrophobicContact CD1-CG2 3.93Å; L219-V226 HydrophobicContact CD2-CB 4.27Å; L219-V226 HydrophobicContact CD2-CG1 4.3Å; L219-V226 HydrophobicContact CG-CB 3.76Å; L219-V226 HydrophobicContact CG-CG1 4.32Å; L219-V226 PolarHBondContact N-O 2.95Å; L219-V226 PolarHBondContact O-N 3.36Å
220	T	86.4	Confident	94.7	Very high	37 Å²	37	32.7 Å²	32.7	23%	0.227	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.4	175.7	46	0	0	0	0	109.5	L225	T220-L225 HydrophobicContact CG2-CD1 3.41Å; T220-L225 VanDerWaalsContact CG2-CD1 3.41Å
221	S	88.1	Confident	94.9	Very high	42 Å²	42	32.4 Å²	32.4	29%	0.294	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	99	177.4	-168	0	0	0	0	110.4	F132 K223 F224	F132-S221 PolarHBondContact O-OG 2.97Å; S221-K223 PolarHBondContact O-N 3.39Å; S221-F224 PolarHBondContact N-O 3.07Å; S221-F224 WeakPolarHBondContact O-CB 3.29Å; S221-F224 PolarHBondContact O-N 3.44Å
222	G	89.6	Confident	94.9	Very high	69 Å²	69	34.8 Å²	34.8	71%	0.711	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	-122.8	-171.9	0	0	0	0	0	112.1	F224 R243	G222-F224 VanDerWaalsContact C-N 3.27Å; G222-F224 PolarHBondContact O-N 3.29Å; G222-R243 PolarHBondContact O-NH2 2.73Å; G222-R243 VanDerWaalsContact O-NH2 3.16Å
223	K	92.8	Very high	94.8	Very high	57 Å²	57	39.7 Å²	39.7	25%	0.248	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-14	176.1	-72.5	-172.6	170.9	-169.5	0	113.8	S221 Y242 R243 D245 E248	S221-K223 PolarHBondContact O-N 3.39Å; K223-Y242 HydrophobicContact CB-CD2 4.01Å; K223-Y242 HydrophobicContact CB-CE2 3.65Å; K223-Y242 HydrophobicContact CD-CE1 4.3Å; K223-Y242 HydrophobicContact CD-CE2 3.88Å; K223-Y242 VanDerWaalsContact CD-OH 3.31Å; K223-Y242 WeakPolarHBondContact CD-OH 3.44Å; K223-Y242 HydrophobicContact CG-CE2 4.4Å; K223-R243 PolarHBondContact O-N 3.14Å; K223-R243 PolarHBondContact O-NE 3.24Å; K223-D245 WeakPolarHBondContact CE-OD2 3.35Å; K223-D245 VanDerWaalsContact NZ-CG 3.34Å; K223-D245 IonicContact NZ-OD1 3.5Å; K223-D245 IonicContact NZ-OD2 3.23Å; K223-D245 PolarHBondContact NZ-OD2 3.35Å; K223-E248 IonicContact NZ-OE1 3.52Å; K223-E248 PolarHBondContact NZ-OE1 3Å; K223-E248 VanDerWaalsContact NZ-OE1 3.12Å; K223-E248 IonicContact NZ-OE2 3.54Å; K223-E248 PolarHBondContact NZ-OE2 2.96Å
224	F	94	Very high	94.7	Very high	37 Å²	37	35.2 Å²	35.2	16%	0.162	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	135	179.9	-65.4	-81.1	0	0	0	112.1	F132 S221 G222 V226 I240 I241 Y242 V256 L260	F132-F224 HydrophobicContact CD1-CB 4.31Å; F132-F224 HydrophobicContact CD1-CG 4.48Å; F132-F224 HydrophobicContact CE1-CB 3.9Å; F132-F224 HydrophobicContact CE1-CD1 4.15Å; F132-F224 AromaticContact CE1-CD2 3.86Å; F132-F224 HydrophobicContact CE1-CD2 3.86Å; F132-F224 HydrophobicContact CE1-CE2 4.37Å; F132-F224 AromaticContact CE1-CG 3.71Å; F132-F224 HydrophobicContact CE1-CG 3.71Å; F132-F224 HydrophobicContact CZ-CG 4.48Å; S221-F224 PolarHBondContact N-O 3.07Å; S221-F224 WeakPolarHBondContact O-CB 3.29Å; S221-F224 PolarHBondContact O-N 3.44Å; G222-F224 VanDerWaalsContact C-N 3.27Å; G222-F224 PolarHBondContact O-N 3.29Å; F224-V226 HydrophobicContact CB-CG2 4.23Å; F224-I240 HydrophobicContact CD1-CG2 3.79Å; F224-I240 HydrophobicContact CE1-CG2 4.15Å; F224-I241 CarbonylContact C-O 3.52Å; F224-I241 VanDerWaalsContact CA-O 3.3Å; F224-I241 WeakPolarHBondContact CA-O 3.37Å; F224-Y242 HydrophobicContact CD1-CD2 4.11Å; F224-Y242 AromaticContact CE1-CD2 3.74Å; F224-Y242 HydrophobicContact CE1-CD2 3.74Å; F224-Y242 HydrophobicContact CE1-CG 4.43Å; F224-Y242 HydrophobicContact CE2-CD2 4.23Å; F224-Y242 AromaticContact CZ-CD2 3.82Å; F224-Y242 HydrophobicContact CZ-CD2 3.82Å; F224-Y242 HydrophobicContact CZ-CE2 4.38Å; F224-V256 HydrophobicContact CE1-CG1 4.07Å; F224-V256 HydrophobicContact CE2-CG1 4.24Å; F224-V256 HydrophobicContact CZ-CG1 3.38Å; F224-L260 HydrophobicContact CE1-CD2 4.06Å; F224-L260 HydrophobicContact CZ-CD2 4.5Å
225	L	93.9	Very high	94.6	Very high	25 Å²	25	36.5 Å²	36.5	13%	0.131	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127	160.8	-170.1	73	0	0	0	106.4	L218 T220 H227 I241	L218-L225 HydrophobicContact CD1-CD1 3.48Å; L218-L225 VanDerWaalsContact CD1-CD1 3.48Å; L218-L225 HydrophobicContact CD1-CD2 4.38Å; L218-L225 HydrophobicContact CD1-CG 3.79Å; L218-L225 HydrophobicContact CG-CD1 4.34Å; T220-L225 HydrophobicContact CG2-CD1 3.41Å; T220-L225 VanDerWaalsContact CG2-CD1 3.41Å; L225-H227 WeakPolarHBondContact CD2-NE2 3.33Å; L225-I241 HydrophobicContact CB-CB 4.1Å; L225-I241 HydrophobicContact CB-CG2 4.44Å; L225-I241 HydrophobicContact CD2-CD1 4.24Å; L225-I241 PolarHBondContact N-O 2.8Å; L225-I241 WeakPolarHBondContact O-CA 3.23Å; L225-I241 WeakPolarHBondContact O-CB 3.35Å; L225-I241 PolarHBondContact O-N 3.07Å
226	V	95.3	Very high	94.6	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	128.1	-175.7	179.9	0	0	0	0	109.2	L128 F132 L219 F224 E239 I240	L128-V226 HydrophobicContact CD1-CG1 3.94Å; L128-V226 HydrophobicContact CD2-CG1 4Å; L128-V226 HydrophobicContact CG-CG1 4.43Å; F132-V226 HydrophobicContact CD1-CG2 4.27Å; F132-V226 HydrophobicContact CD2-CG1 4.45Å; F132-V226 HydrophobicContact CD2-CG2 3.89Å; F132-V226 HydrophobicContact CE1-CG2 4.09Å; F132-V226 HydrophobicContact CE2-CG1 4.39Å; F132-V226 HydrophobicContact CE2-CG2 3.72Å; F132-V226 HydrophobicContact CG-CG2 4.17Å; F132-V226 HydrophobicContact CZ-CG2 3.81Å; L219-V226 HydrophobicContact CD1-CB 3.69Å; L219-V226 HydrophobicContact CD1-CG1 4.49Å; L219-V226 HydrophobicContact CD1-CG2 3.93Å; L219-V226 HydrophobicContact CD2-CB 4.27Å; L219-V226 HydrophobicContact CD2-CG1 4.3Å; L219-V226 HydrophobicContact CG-CB 3.76Å; L219-V226 HydrophobicContact CG-CG1 4.32Å; L219-V226 PolarHBondContact N-O 2.95Å; L219-V226 PolarHBondContact O-N 3.36Å; F224-V226 HydrophobicContact CB-CG2 4.23Å; V226-E239 CarbonylContact C-O 3.58Å; V226-E239 WeakPolarHBondContact CA-O 3.46Å; V226-I240 HydrophobicContact CG1-CG1 4.24Å; V226-I240 HydrophobicContact CG2-CG1 4.5Å; V226-I240 HydrophobicContact CG2-CG2 4.1Å
227	H	96	Very high	94.7	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.046	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.5	177.2	-51.3	154.6	0	0	0	109.1	R216 S217 L218 L225 A238 E239 I241	R216-H227 VanDerWaalsContact CZ-ND1 3.28Å; R216-H227 PolarHBondContact NH1-CE1 3.13Å; R216-H227 PolarHBondContact NH2-ND1 3.24Å; S217-H227 CarbonylContact O-C 3.57Å; S217-H227 WeakPolarHBondContact O-CA 3.24Å; L218-H227 WeakPolarHBondContact CD1-CD2 3.36Å; L218-H227 WeakPolarHBondContact CD1-NE2 3.4Å; L225-H227 WeakPolarHBondContact CD2-NE2 3.33Å; H227-A238 CarbonylContact O-C 3.59Å; H227-A238 VanDerWaalsContact O-CA 3.24Å; H227-A238 WeakPolarHBondContact O-CA 3.33Å; H227-E239 HydrophobicContact CB-CB 4.03Å; H227-E239 IonicContact CE1-OE2 2.66Å; H227-E239 PolarHBondContact N-O 2.86Å; H227-E239 IonicContact ND1-OE2 3.97Å; H227-E239 PolarHBondContact ND1-OE2 3.23Å; H227-E239 PolarHBondContact O-N 3.24Å; H227-I241 WeakPolarHBondContact CE1-CD1 3.26Å
228	L	96.8	Very high	94.8	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.037	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	106.9	160.8	-178.1	63.8	0	0	0	107.4	V118 Y121 M124 Q125 L128 S217 A238	V118-L228 HydrophobicContact CG2-CD1 3.94Å; Y121-L228 HydrophobicContact CD1-CD2 4.24Å; Y121-L228 HydrophobicContact CD2-CD1 4.33Å; Y121-L228 HydrophobicContact CD2-CD2 4.25Å; Y121-L228 HydrophobicContact CD2-CG 4.19Å; Y121-L228 HydrophobicContact CE1-CD2 3.71Å; Y121-L228 HydrophobicContact CE1-CG 4.41Å; Y121-L228 HydrophobicContact CE2-CD1 4.1Å; Y121-L228 HydrophobicContact CE2-CD2 3.74Å; Y121-L228 HydrophobicContact CE2-CG 3.53Å; Y121-L228 HydrophobicContact CG-CD2 4.48Å; Y121-L228 VanDerWaalsContact CZ-CD2 3.42Å; M124-L228 HydrophobicContact CG-CD1 3.9Å; Q125-L228 HydrophobicContact CB-CD2 3.64Å; Q125-L228 HydrophobicContact CG-CD2 4.06Å; L128-L228 HydrophobicContact CD1-CB 4.22Å; L128-L228 HydrophobicContact CD1-CD1 4.44Å; S217-L228 PolarHBondContact N-O 3.27Å; S217-L228 PolarHBondContact O-N 2.96Å; L228-A238 HydrophobicContact CD1-CB 4.1Å
229	D	97.8	Very high	95	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.4	-166.3	-70.6	-10.2	0	0	0	111.1	R215 R216 V231 A236 Y237 Y276	R215-D229 WeakPolarHBondContact O-CA 3.26Å; R216-D229 WeakPolarHBondContact CA-OD1 3.26Å; R216-D229 WeakPolarHBondContact CB-OD1 3.4Å; R216-D229 WeakPolarHBondContact CG-OD1 3.4Å; R216-D229 IonicContact CZ-OD1 3.86Å; R216-D229 IonicContact CZ-OD2 2.66Å; R216-D229 IonicContact NE-OD1 2.63Å; R216-D229 PolarHBondContact NE-OD1 3.46Å; R216-D229 IonicContact NE-OD2 3.72Å; R216-D229 PolarHBondContact NE-OD2 3.45Å; R216-D229 IonicContact NH2-OD1 2.74Å; R216-D229 IonicContact NH2-OD2 3.59Å; R216-D229 PolarHBondContact NH2-OD2 3.4Å; D229-V231 HydrophobicContact CB-CG2 3.98Å; D229-A236 CarbonylContact O-C 3.56Å; D229-A236 VanDerWaalsContact O-CA 3.26Å; D229-A236 WeakPolarHBondContact O-CA 3.4Å; D229-Y237 PolarHBondContact N-O 3.31Å; D229-Y237 PolarHBondContact O-N 2.99Å; D229-Y276 PolarHBondContact OD2-OH 3.27Å
230	E	98.1	Very high	95.2	Very high	86 Å²	86	32.6 Å²	32.6	40%	0.402	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	108.8	160.4	-64.4	175.2	102.7	0	0	108	Y121 K214 R215	Y121-E230 HydrophobicContact CD2-CG 4.14Å; Y121-E230 HydrophobicContact CE2-CG 3.72Å; K214-E230 VanDerWaalsContact CA-O 3.26Å; K214-E230 WeakPolarHBondContact CA-O 3.31Å; K214-E230 WeakPolarHBondContact CB-O 3.28Å; R215-E230 HydrophobicContact CB-CB 4.46Å; R215-E230 WeakPolarHBondContact CD-OE2 3.3Å; R215-E230 IonicContact CZ-OE2 3.88Å; R215-E230 PolarHBondContact N-O 3.2Å; R215-E230 IonicContact NE-OE2 3.21Å; R215-E230 IonicContact NH1-OE2 3.68Å; R215-E230 PolarHBondContact NH1-OE2 3.37Å; R215-E230 PolarHBondContact O-N 3.36Å
231	V	98.2	Very high	95.7	Very high	7 Å²	7	31.2 Å²	31.2	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.8	-174.6	-173.3	0	0	0	0	109.6	I212 K214 D229 E233 V234 G235 Y276	I212-V231 HydrophobicContact CG2-CG1 3.73Å; K214-V231 HydrophobicContact CB-CB 4.4Å; K214-V231 HydrophobicContact CB-CG2 4Å; K214-V231 HydrophobicContact CD-CG2 4.39Å; D229-V231 HydrophobicContact CB-CG2 3.98Å; V231-E233 PolarHBondContact O-N 2.88Å; V231-V234 HydrophobicContact CB-CB 3.93Å; V231-V234 HydrophobicContact CB-CG1 4.5Å; V231-V234 HydrophobicContact CG1-CB 3.76Å; V231-V234 HydrophobicContact CG1-CG1 4.47Å; V231-V234 HydrophobicContact CG1-CG2 3.85Å; V231-V234 PolarHBondContact O-N 2.7Å; V231-V234 VanDerWaalsContact O-N 3.13Å; V231-G235 PolarHBondContact N-O 3.23Å; V231-G235 PolarHBondContact O-N 3.03Å; V231-Y276 HydrophobicContact CG1-CD1 4.44Å; V231-Y276 HydrophobicContact CG1-CG 4.37Å; V231-Y276 HydrophobicContact CG2-CD1 3.9Å; V231-Y276 HydrophobicContact CG2-CD2 4.24Å; V231-Y276 HydrophobicContact CG2-CE1 3.71Å; V231-Y276 HydrophobicContact CG2-CE2 4.05Å; V231-Y276 HydrophobicContact CG2-CG 4.18Å
232	Q	97.9	Very high	96.1	Very high	98 Å²	98	30 Å²	30	46%	0.458	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	134	-179.6	-178.7	179.7	-27.1	0	0	110.3	K213 V234	K213-Q232 HydrophobicContact CB-CB 4.18Å; K213-Q232 WeakPolarHBondContact O-CB 3.49Å; K213-Q232 PolarHBondContact O-N 3.23Å; Q232-V234 PolarHBondContact O-N 3.46Å
233	E	95.7	Very high	96.3	Very high	109 Å²	109	27.6 Å²	27.6	51%	0.509	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	-0.9	-178.6	-65.3	156	-114.9	0	0	115.7	V231 L280 R284	V231-E233 PolarHBondContact O-N 2.88Å; E233-L280 HydrophobicContact CB-CD1 3.5Å; E233-L280 VanDerWaalsContact CB-CD1 3.5Å; E233-R284 IonicContact OE2-CZ 3.55Å; E233-R284 IonicContact OE2-NE 2.73Å; E233-R284 IonicContact OE2-NH2 3.49Å; E233-R284 PolarHBondContact OE2-NH2 2.9Å
234	V	96.3	Very high	96.3	Very high	10 Å²	10	25.7 Å²	25.7	6%	0.061	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-43.9	-177	179.3	0	0	0	0	112.3	V231 Q232 Y237 L279 L280	V231-V234 HydrophobicContact CB-CB 3.93Å; V231-V234 HydrophobicContact CB-CG1 4.5Å; V231-V234 HydrophobicContact CG1-CB 3.76Å; V231-V234 HydrophobicContact CG1-CG1 4.47Å; V231-V234 HydrophobicContact CG1-CG2 3.85Å; V231-V234 PolarHBondContact O-N 2.7Å; V231-V234 VanDerWaalsContact O-N 3.13Å; Q232-V234 PolarHBondContact O-N 3.46Å; V234-Y237 HydrophobicContact CG1-CD2 4.34Å; V234-Y237 HydrophobicContact CG1-CE2 3.68Å; V234-L279 HydrophobicContact CG1-CB 3.72Å; V234-L279 HydrophobicContact CG1-CD1 4.29Å; V234-L280 HydrophobicContact CG2-CB 3.68Å; V234-L280 HydrophobicContact CG2-CD1 3.89Å; V234-L280 HydrophobicContact CG2-CG 4.37Å
235	G	96.6	Very high	96.2	Very high	36 Å²	36	27.6 Å²	27.6	37%	0.371	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	117.8	-164.7	-178.5	0	0	0	0	0	113.6	V231	V231-G235 PolarHBondContact N-O 3.23Å; V231-G235 PolarHBondContact O-N 3.03Å
236	A	98	Very high	95.9	Very high	25 Å²	25	32.8 Å²	32.8	21%	0.207	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135.8	-177.3	0	0	0	0	0	112.1	V118 Y121 D229	V118-A236 HydrophobicContact CB-CB 3.9Å; V118-A236 HydrophobicContact CG1-CB 4.26Å; V118-A236 PolarHBondContact N-O 3.49Å; Y121-A236 HydrophobicContact CD2-CB 4.2Å; D229-A236 CarbonylContact O-C 3.56Å; D229-A236 VanDerWaalsContact O-CA 3.26Å; D229-A236 WeakPolarHBondContact O-CA 3.4Å
237	Y	98.3	Very high	95.4	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.043	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144.3	179.6	-75.3	-97.5	0	0	0	111.5	K115 I116 A117 D229 V234 Y276 L279	K115-Y237 HydrophobicContact CD-CD1 3.98Å; K115-Y237 HydrophobicContact CD-CE1 4.45Å; K115-Y237 HydrophobicContact CG-CD1 3.78Å; I116-Y237 CarbonylContact O-C 3.57Å; I116-Y237 WeakPolarHBondContact O-CA 3.39Å; I116-Y237 WeakPolarHBondContact O-CD1 3.47Å; A117-Y237 HydrophobicContact CB-CD1 4.22Å; A117-Y237 HydrophobicContact CB-CE1 3.72Å; D229-Y237 PolarHBondContact N-O 3.31Å; D229-Y237 PolarHBondContact O-N 2.99Å; V234-Y237 HydrophobicContact CG1-CD2 4.34Å; V234-Y237 HydrophobicContact CG1-CE2 3.68Å; Y237-Y276 WeakPolarHBondContact CB-OH 3.42Å; Y237-Y276 HydrophobicContact CD1-CE1 4.4Å; Y237-Y276 AromaticContact CD2-CE1 3.87Å; Y237-Y276 HydrophobicContact CD2-CE1 3.87Å; Y237-Y276 AromaticContact CG-CE1 3.73Å; Y237-Y276 HydrophobicContact CG-CE1 3.73Å; Y237-L279 HydrophobicContact CE1-CD1 3.85Å; Y237-L279 HydrophobicContact CE2-CD1 4.26Å
238	A	97.1	Very high	95.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.7	166.4	0	0	0	0	0	109.4	K115 I116 V118 M124 L128 H227 L228	K115-A238 CarbonylContact C-O 3.56Å; K115-A238 WeakPolarHBondContact CA-O 3.41Å; I116-A238 HydrophobicContact CB-CB 4.38Å; I116-A238 PolarHBondContact N-O 3.34Å; I116-A238 PolarHBondContact O-N 2.82Å; V118-A238 HydrophobicContact CG2-CB 3.96Å; M124-A238 HydrophobicContact CG-CB 4.14Å; M124-A238 HydrophobicContact SD-CB 4.22Å; L128-A238 HydrophobicContact CD1-CB 4.19Å; H227-A238 CarbonylContact O-C 3.59Å; H227-A238 VanDerWaalsContact O-CA 3.24Å; H227-A238 WeakPolarHBondContact O-CA 3.33Å; L228-A238 HydrophobicContact CD1-CB 4.1Å
239	E	97	Very high	94.9	Very high	18 Å²	18	40.8 Å²	40.8	8%	0.084	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.5	168.7	-59.1	-176.7	151.3	0	0	109.4	L114 K115 R216 V226 H227	L114-E239 CarbonylContact O-C 3.49Å; L114-E239 VanDerWaalsContact O-CA 3.28Å; L114-E239 WeakPolarHBondContact O-CA 3.35Å; K115-E239 HydrophobicContact CB-CG 4.27Å; K115-E239 WeakPolarHBondContact CE-OE1 3.18Å; K115-E239 HydrophobicContact CG-CG 4.13Å; K115-E239 IonicContact NZ-OE1 3.43Å; R216-E239 IonicContact NH2-OE2 3.91Å; V226-E239 CarbonylContact C-O 3.58Å; V226-E239 WeakPolarHBondContact CA-O 3.46Å; H227-E239 HydrophobicContact CB-CB 4.03Å; H227-E239 IonicContact CE1-OE2 2.66Å; H227-E239 PolarHBondContact N-O 2.86Å; H227-E239 IonicContact ND1-OE2 3.97Å; H227-E239 PolarHBondContact ND1-OE2 3.23Å; H227-E239 PolarHBondContact O-N 3.24Å
240	I	96.5	Very high	94.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.9	173.1	-53.7	-178.4	0	0	0	107.5	E113 L114 I116 L128 F132 F224 V226 M257 L260 M264	E113-I240 WeakPolarHBondContact CA-O 3.3Å; L114-I240 PolarHBondContact N-O 3.48Å; L114-I240 PolarHBondContact O-N 3.42Å; I116-I240 HydrophobicContact CD1-CD1 4.37Å; L128-I240 HydrophobicContact CD2-CD1 4.02Å; L128-I240 HydrophobicContact CD2-CG1 4.45Å; F132-I240 HydrophobicContact CE2-CD1 4.24Å; F132-I240 HydrophobicContact CZ-CD1 4.37Å; F132-I240 HydrophobicContact CZ-CG2 4.07Å; F224-I240 HydrophobicContact CD1-CG2 3.79Å; F224-I240 HydrophobicContact CE1-CG2 4.15Å; V226-I240 HydrophobicContact CG1-CG1 4.24Å; V226-I240 HydrophobicContact CG2-CG1 4.5Å; V226-I240 HydrophobicContact CG2-CG2 4.1Å; I240-M257 HydrophobicContact CB-SD 4.49Å; I240-M257 HydrophobicContact CG2-CE 4.28Å; I240-M257 HydrophobicContact CG2-SD 4.29Å; I240-M257 VanDerWaalsContact O-CE 3.28Å; I240-M257 WeakPolarHBondContact O-CE 3.27Å; I240-L260 HydrophobicContact CB-CD2 4.43Å; I240-L260 HydrophobicContact CD1-CD2 3.78Å; I240-L260 HydrophobicContact CG2-CD2 3.57Å; I240-M264 HydrophobicContact CD1-CE 4.17Å; I240-M264 HydrophobicContact CD1-SD 3.54Å; I240-M264 VanDerWaalsContact CD1-SD 3.54Å
241	I	96.6	Very high	94.4	Very high	7 Å²	7	41.3 Å²	41.3	4%	0.036	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.5	-172.5	-59	171.2	0	0	0	107.5	N111 E113 F224 L225 H227 R243	N111-I241 HydrophobicContact CB-CG2 3.79Å; N111-I241 WeakPolarHBondContact ND2-CG2 3.45Å; E113-I241 HydrophobicContact CB-CG1 4.41Å; E113-I241 HydrophobicContact CG-CB 4.46Å; E113-I241 HydrophobicContact CG-CG1 4.02Å; E113-I241 HydrophobicContact CG-CG2 4.17Å; F224-I241 CarbonylContact C-O 3.52Å; F224-I241 VanDerWaalsContact CA-O 3.3Å; F224-I241 WeakPolarHBondContact CA-O 3.37Å; L225-I241 HydrophobicContact CB-CB 4.1Å; L225-I241 HydrophobicContact CB-CG2 4.44Å; L225-I241 HydrophobicContact CD2-CD1 4.24Å; L225-I241 PolarHBondContact N-O 2.8Å; L225-I241 WeakPolarHBondContact O-CA 3.23Å; L225-I241 WeakPolarHBondContact O-CB 3.35Å; L225-I241 PolarHBondContact O-N 3.07Å; H227-I241 WeakPolarHBondContact CE1-CD1 3.26Å; I241-R243 HydrophobicContact CG2-CG 4.26Å
242	Y	96.1	Very high	94.2	Very high	16 Å²	16	44.7 Å²	44.7	6%	0.063	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	114	168.3	-174.2	-98.6	0	0	0	109	N111 V112 K223 F224 L244 E248 V256	N111-Y242 WeakPolarHBondContact CA-O 3.41Å; V112-Y242 PolarHBondContact N-O 2.9Å; V112-Y242 PolarHBondContact O-N 3.17Å; K223-Y242 HydrophobicContact CB-CD2 4.01Å; K223-Y242 HydrophobicContact CB-CE2 3.65Å; K223-Y242 HydrophobicContact CD-CE1 4.3Å; K223-Y242 HydrophobicContact CD-CE2 3.88Å; K223-Y242 VanDerWaalsContact CD-OH 3.31Å; K223-Y242 WeakPolarHBondContact CD-OH 3.44Å; K223-Y242 HydrophobicContact CG-CE2 4.4Å; F224-Y242 HydrophobicContact CD1-CD2 4.11Å; F224-Y242 AromaticContact CE1-CD2 3.74Å; F224-Y242 HydrophobicContact CE1-CD2 3.74Å; F224-Y242 HydrophobicContact CE1-CG 4.43Å; F224-Y242 HydrophobicContact CE2-CD2 4.23Å; F224-Y242 AromaticContact CZ-CD2 3.82Å; F224-Y242 HydrophobicContact CZ-CD2 3.82Å; F224-Y242 HydrophobicContact CZ-CE2 4.38Å; Y242-L244 HydrophobicContact CD1-CD1 3.93Å; Y242-L244 HydrophobicContact CD1-CG 4.39Å; Y242-L244 HydrophobicContact CE1-CD1 4.46Å; Y242-L244 HydrophobicContact CE1-CG 4.44Å; Y242-E248 PolarHBondContact OH-OE1 2.96Å; Y242-V256 HydrophobicContact CD2-CB 4.44Å; Y242-V256 HydrophobicContact CD2-CG1 3.73Å; Y242-V256 HydrophobicContact CE2-CB 4.29Å; Y242-V256 HydrophobicContact CE2-CG1 3.72Å; Y242-V256 HydrophobicContact CE2-CG2 4.31Å; Y242-V256 HydrophobicContact CG-CG1 4.39Å
243	R	93.8	Very high	94	Very high	19 Å²	19	40 Å²	40	7%	0.072	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124.9	178.9	-62.5	178.8	-67.6	174.7	-0.7	109.9	G222 K223 I241	G222-R243 PolarHBondContact O-NH2 2.73Å; G222-R243 VanDerWaalsContact O-NH2 3.16Å; K223-R243 PolarHBondContact O-N 3.14Å; K223-R243 PolarHBondContact O-NE 3.24Å; I241-R243 HydrophobicContact CG2-CG 4.26Å
244	L	92.9	Very high	93.9	Very high	17 Å²	17	36.5 Å²	36.5	9%	0.089	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-83.6	139.7	177.8	-77.8	79.5	0	0	0	110.3	V110 V112 Y242 E248 I250	V110-L244 WeakPolarHBondContact O-CB 3.3Å; V110-L244 PolarHBondContact O-N 3.03Å; V112-L244 HydrophobicContact CB-CD1 4.41Å; V112-L244 HydrophobicContact CG2-CD1 3.89Å; Y242-L244 HydrophobicContact CD1-CD1 3.93Å; Y242-L244 HydrophobicContact CD1-CG 4.39Å; Y242-L244 HydrophobicContact CE1-CD1 4.46Å; Y242-L244 HydrophobicContact CE1-CG 4.44Å; L244-E248 WeakPolarHBondContact CA-OE2 3.2Å; L244-E248 HydrophobicContact CB-CB 4.21Å; L244-E248 HydrophobicContact CD2-CB 4.4Å; L244-E248 HydrophobicContact CD2-CG 4.39Å; L244-E248 WeakPolarHBondContact CD2-O 2.9Å; L244-E248 HydrophobicContact CG-CB 4.46Å; L244-E248 HydrophobicContact CG-CG 4.4Å; L244-I250 HydrophobicContact CD2-CG1 4.27Å
245	D	91.1	Very high	93.9	Very high	78 Å²	78	43.1 Å²	43.1	42%	0.417	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-69.8	154.7	166.8	-68.7	-36.1	0	0	0	109.9	K223 G247 E248	K223-D245 WeakPolarHBondContact CE-OD2 3.35Å; K223-D245 VanDerWaalsContact NZ-CG 3.34Å; K223-D245 IonicContact NZ-OD1 3.5Å; K223-D245 IonicContact NZ-OD2 3.23Å; K223-D245 PolarHBondContact NZ-OD2 3.35Å; D245-G247 PolarHBondContact O-N 3.12Å; D245-G247 VanDerWaalsContact O-N 3.09Å; D245-E248 HydrophobicContact CB-CB 4.26Å; D245-E248 PolarHBondContact N-OE2 3.15Å; D245-E248 VanDerWaalsContact O-CB 3.25Å; D245-E248 WeakPolarHBondContact O-CB 3.22Å; D245-E248 PolarHBondContact O-N 3.42Å
246	P	87.2	Confident	93.8	Very high	133 Å²	133	43.3 Å²	43.3	86%	0.864	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	119.8	172.9	-26.8	35.4	0	0	0	112	E248	P246-E248 VanDerWaalsContact C-N 3.33Å
247	G	85.6	Confident	93.7	Very high	82 Å²	82	42.1 Å²	42.1	85%	0.845	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.5	-1.4	-178.7	0	0	0	0	0	115.3	D245	D245-G247 PolarHBondContact O-N 3.12Å; D245-G247 VanDerWaalsContact O-N 3.09Å
248	E	90.6	Very high	93.4	Very high	25 Å²	25	45 Å²	45	12%	0.117	26%	0.262	C	S	.	.			trans	-65.4	132.7	170.6	-175.1	168.6	-157.7	0	0	110.1	K223 Y242 L244 D245 P246 Q252	K223-E248 IonicContact NZ-OE1 3.52Å; K223-E248 PolarHBondContact NZ-OE1 3Å; K223-E248 VanDerWaalsContact NZ-OE1 3.12Å; K223-E248 IonicContact NZ-OE2 3.54Å; K223-E248 PolarHBondContact NZ-OE2 2.96Å; Y242-E248 PolarHBondContact OH-OE1 2.96Å; L244-E248 WeakPolarHBondContact CA-OE2 3.2Å; L244-E248 HydrophobicContact CB-CB 4.21Å; L244-E248 HydrophobicContact CD2-CB 4.4Å; L244-E248 HydrophobicContact CD2-CG 4.39Å; L244-E248 WeakPolarHBondContact CD2-O 2.9Å; L244-E248 HydrophobicContact CG-CB 4.46Å; L244-E248 HydrophobicContact CG-CG 4.4Å; D245-E248 HydrophobicContact CB-CB 4.26Å; D245-E248 PolarHBondContact N-OE2 3.15Å; D245-E248 VanDerWaalsContact O-CB 3.25Å; D245-E248 WeakPolarHBondContact O-CB 3.22Å; D245-E248 PolarHBondContact O-N 3.42Å; P246-E248 VanDerWaalsContact C-N 3.33Å; E248-Q252 HydrophobicContact CG-CB 4.38Å; E248-Q252 HydrophobicContact CG-CG 4.49Å; E248-Q252 PolarHBondContact OE1-NE2 3.33Å
249	P	91.4	Very high	93.3	Very high	79 Å²	79	48.3 Å²	48.3	51%	0.513	28%	0.28	S	S	.	.			trans	-68.6	136.7	179.3	-21.4	33.3	0	0	0	112.6	G251 Q252	P249-G251 PolarHBondContact O-N 2.84Å; P249-G251 VanDerWaalsContact O-N 3.15Å; P249-Q252 VanDerWaalsContact O-CB 3.29Å; P249-Q252 WeakPolarHBondContact O-CB 3.3Å; P249-Q252 PolarHBondContact O-N 3.15Å
250	I	92.7	Very high	93.2	Very high	66 Å²	66	48 Å²	48	34%	0.338	28%	0.279	S	S	.	.	H	α-helix	trans	-50.8	-41.9	174.1	-66	166.6	0	0	0	111.8	V110 V112 V184 L244 Q252 G253 L254	V110-I250 HydrophobicContact CG1-CG1 4.45Å; V112-I250 HydrophobicContact CG2-CG2 4.37Å; V184-I250 HydrophobicContact CG1-CD1 4.04Å; V184-I250 HydrophobicContact CG1-CG1 4.39Å; V184-I250 HydrophobicContact CG1-CG2 4.47Å; V184-I250 HydrophobicContact CG2-CG2 3.63Å; L244-I250 HydrophobicContact CD2-CG1 4.27Å; I250-Q252 PolarHBondContact O-N 2.91Å; I250-Q252 VanDerWaalsContact O-N 3.13Å; I250-G253 PolarHBondContact O-N 2.94Å; I250-L254 HydrophobicContact CG2-CD1 3.95Å; I250-L254 HydrophobicContact CG2-CG 4.15Å; I250-L254 PolarHBondContact O-N 3.14Å
251	G	93.4	Very high	93.1	Very high	32 Å²	32	49.6 Å²	49.6	33%	0.33	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-22.4	178.5	0	0	0	0	0	114.5	P249 R255	P249-G251 PolarHBondContact O-N 2.84Å; P249-G251 VanDerWaalsContact O-N 3.15Å; G251-R255 WeakPolarHBondContact O-CG 3.31Å; G251-R255 VanDerWaalsContact O-CZ 3.27Å; G251-R255 PolarHBondContact O-N 3.4Å; G251-R255 PolarHBondContact O-NH1 2.66Å; G251-R255 VanDerWaalsContact O-NH1 3.15Å
252	Q	93.2	Very high	92.9	Very high	78 Å²	78	57 Å²	57	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-72.5	-46.6	171.5	-179.8	168.7	-0.3	0	0	111.3	E248 P249 I250 L254 R255 V256	E248-Q252 HydrophobicContact CG-CB 4.38Å; E248-Q252 HydrophobicContact CG-CG 4.49Å; E248-Q252 PolarHBondContact OE1-NE2 3.33Å; P249-Q252 VanDerWaalsContact O-CB 3.29Å; P249-Q252 WeakPolarHBondContact O-CB 3.3Å; P249-Q252 PolarHBondContact O-N 3.15Å; I250-Q252 PolarHBondContact O-N 2.91Å; I250-Q252 VanDerWaalsContact O-N 3.13Å; Q252-L254 VanDerWaalsContact C-N 3.31Å; Q252-L254 PolarHBondContact O-N 3.46Å; Q252-R255 PolarHBondContact O-N 3.41Å; Q252-V256 WeakPolarHBondContact O-CG2 3.26Å; Q252-V256 PolarHBondContact O-N 3.43Å; Q252-V256 VanDerWaalsContact O-N 3.1Å
253	G	93.9	Very high	92.9	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-39.7	175.2	0	0	0	0	0	112.7	I250 V256 M257	I250-G253 PolarHBondContact O-N 2.94Å; G253-V256 PolarHBondContact O-N 3.04Å; G253-M257 PolarHBondContact O-N 2.8Å
254	L	94.1	Very high	92.9	Very high	35 Å²	35	63 Å²	63	18%	0.183	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-46.8	175.4	-67.6	173.4	0	0	0	112.2	V112 P182 I250 Q252 V256 M257 D258	V112-L254 HydrophobicContact CG1-CD2 3.77Å; V112-L254 HydrophobicContact CG2-CD2 4.25Å; V112-L254 HydrophobicContact CG2-CG 4.39Å; P182-L254 HydrophobicContact CB-CD2 4.08Å; P182-L254 HydrophobicContact CG-CD2 4.45Å; I250-L254 HydrophobicContact CG2-CD1 3.95Å; I250-L254 HydrophobicContact CG2-CG 4.15Å; I250-L254 PolarHBondContact O-N 3.14Å; Q252-L254 VanDerWaalsContact C-N 3.31Å; Q252-L254 PolarHBondContact O-N 3.46Å; L254-V256 VanDerWaalsContact C-N 3.28Å; L254-V256 PolarHBondContact O-N 2.88Å; L254-M257 CarbonylContact O-C 3.59Å; L254-M257 WeakPolarHBondContact O-CA 3.45Å; L254-M257 WeakPolarHBondContact O-CB 3.47Å; L254-M257 PolarHBondContact O-N 3.11Å; L254-D258 VanDerWaalsContact O-CG 3.32Å; L254-D258 PolarHBondContact O-N 2.99Å
255	R	95.4	Very high	93	Very high	148 Å²	148	70.5 Å²	70.5	56%	0.558	38%	0.376	S	S	*	.	H	α-helix	trans	-59.2	-40.6	176	-75.9	-173.5	-62	-90.4	4.4	112.6	G251 Q252 M257 D258 D259	G251-R255 WeakPolarHBondContact O-CG 3.31Å; G251-R255 VanDerWaalsContact O-CZ 3.27Å; G251-R255 PolarHBondContact O-N 3.4Å; G251-R255 PolarHBondContact O-NH1 2.66Å; G251-R255 VanDerWaalsContact O-NH1 3.15Å; Q252-R255 PolarHBondContact O-N 3.41Å; R255-M257 VanDerWaalsContact C-N 3.3Å; R255-D258 PolarHBondContact O-N 3.23Å; R255-D259 PolarHBondContact O-N 2.72Å
256	V	95.6	Very high	93	Very high	40 Å²	40	68 Å²	68	24%	0.242	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-40.7	175.7	170.4	0	0	0	0	110.8	F224 Y242 Q252 G253 L254 L260	F224-V256 HydrophobicContact CE1-CG1 4.07Å; F224-V256 HydrophobicContact CE2-CG1 4.24Å; F224-V256 HydrophobicContact CZ-CG1 3.38Å; Y242-V256 HydrophobicContact CD2-CB 4.44Å; Y242-V256 HydrophobicContact CD2-CG1 3.73Å; Y242-V256 HydrophobicContact CE2-CB 4.29Å; Y242-V256 HydrophobicContact CE2-CG1 3.72Å; Y242-V256 HydrophobicContact CE2-CG2 4.31Å; Y242-V256 HydrophobicContact CG-CG1 4.39Å; Q252-V256 WeakPolarHBondContact O-CG2 3.26Å; Q252-V256 PolarHBondContact O-N 3.43Å; Q252-V256 VanDerWaalsContact O-N 3.1Å; G253-V256 PolarHBondContact O-N 3.04Å; L254-V256 VanDerWaalsContact C-N 3.28Å; L254-V256 PolarHBondContact O-N 2.88Å; V256-L260 WeakPolarHBondContact O-CB 3.47Å; V256-L260 PolarHBondContact O-N 2.72Å; V256-L260 VanDerWaalsContact O-N 3.1Å
257	M	94.7	Very high	93.2	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-67.9	-40.5	176.9	-160.3	60.6	75.1	0	0	112.1	V112 L114 P182 I240 G253 L254 R255 D259 L260 M261	V112-M257 HydrophobicContact CG1-CB 4.15Å; V112-M257 HydrophobicContact CG1-CE 4.17Å; V112-M257 HydrophobicContact CG1-CG 4.44Å; V112-M257 WeakPolarHBondContact O-CE 3.46Å; L114-M257 HydrophobicContact CB-CE 4.07Å; L114-M257 HydrophobicContact CB-CG 4.01Å; L114-M257 HydrophobicContact CB-SD 3.58Å; L114-M257 VanDerWaalsContact CB-SD 3.58Å; L114-M257 HydrophobicContact CD2-CG 4.31Å; L114-M257 HydrophobicContact CD2-SD 3.91Å; L114-M257 HydrophobicContact CG-SD 4.38Å; P182-M257 HydrophobicContact CB-CG 4.12Å; P182-M257 HydrophobicContact CG-CB 4.15Å; P182-M257 HydrophobicContact CG-CG 3.65Å; I240-M257 HydrophobicContact CB-SD 4.49Å; I240-M257 HydrophobicContact CG2-CE 4.28Å; I240-M257 HydrophobicContact CG2-SD 4.29Å; I240-M257 VanDerWaalsContact O-CE 3.28Å; I240-M257 WeakPolarHBondContact O-CE 3.27Å; G253-M257 PolarHBondContact O-N 2.8Å; L254-M257 CarbonylContact O-C 3.59Å; L254-M257 WeakPolarHBondContact O-CA 3.45Å; L254-M257 WeakPolarHBondContact O-CB 3.47Å; L254-M257 PolarHBondContact O-N 3.11Å; R255-M257 VanDerWaalsContact C-N 3.3Å; M257-D259 PolarHBondContact O-N 3.44Å; M257-L260 WeakPolarHBondContact O-CB 3.43Å; M257-L260 PolarHBondContact O-N 3.09Å; M257-L260 VanDerWaalsContact O-N 3.14Å; M257-L260 HydrophobicContact SD-CD2 4.09Å; M257-M261 HydrophobicContact CG-SD 4.31Å; M257-M261 VanDerWaalsContact O-CG 3.31Å; M257-M261 WeakPolarHBondContact O-CG 3.49Å; M257-M261 PolarHBondContact O-N 2.74Å
258	D	92.9	Very high	93.4	Very high	72 Å²	72	64.8 Å²	64.8	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-63.4	-42.1	176.5	-66.9	-25.3	0	0	0	112.4	L254 R255 L260 R262	L254-D258 VanDerWaalsContact O-CG 3.32Å; L254-D258 PolarHBondContact O-N 2.99Å; R255-D258 PolarHBondContact O-N 3.23Å; D258-L260 VanDerWaalsContact C-N 3.27Å; D258-L260 PolarHBondContact O-N 3.34Å; D258-R262 PolarHBondContact O-N 3.32Å; D258-R262 VanDerWaalsContact O-N 3.12Å; D258-R262 PolarHBondContact O-NE 3Å
259	D	95.1	Very high	93.4	Very high	69 Å²	69	68.2 Å²	68.2	37%	0.369	35%	0.345	S	S	.	.	H	α-helix	trans	-60.9	-39.9	173.6	-82.2	-31.4	0	0	0	111.1	R255 M257 R262 K263	R255-D259 PolarHBondContact O-N 2.72Å; M257-D259 PolarHBondContact O-N 3.44Å; D259-R262 IonicContact OD1-CZ 3.56Å; D259-R262 IonicContact OD1-NH1 2.99Å; D259-R262 PolarHBondContact OD1-NH1 2.8Å; D259-R262 IonicContact OD1-NH2 3.11Å; D259-R262 PolarHBondContact OD1-NH2 3.15Å; D259-K263 VanDerWaalsContact O-CG 3.31Å; D259-K263 WeakPolarHBondContact O-CG 3.31Å; D259-K263 PolarHBondContact O-N 2.97Å
260	L	94.4	Very high	93.5	Very high	13 Å²	13	66.1 Å²	66.1	7%	0.068	33%	0.329	C	S	.	.	H	α-helix	trans	-69.4	-46.5	179.2	-178.5	65.9	0	0	0	111.9	L131 F132 F224 I240 V256 M257 D258 R262 K263 M264	L131-L260 HydrophobicContact CD1-CD1 4.36Å; L131-L260 HydrophobicContact CD2-CD1 4.45Å; F132-L260 HydrophobicContact CZ-CD1 4.18Å; F132-L260 HydrophobicContact CZ-CD2 3.98Å; F224-L260 HydrophobicContact CE1-CD2 4.06Å; F224-L260 HydrophobicContact CZ-CD2 4.5Å; I240-L260 HydrophobicContact CB-CD2 4.43Å; I240-L260 HydrophobicContact CD1-CD2 3.78Å; I240-L260 HydrophobicContact CG2-CD2 3.57Å; V256-L260 WeakPolarHBondContact O-CB 3.47Å; V256-L260 PolarHBondContact O-N 2.72Å; V256-L260 VanDerWaalsContact O-N 3.1Å; M257-L260 WeakPolarHBondContact O-CB 3.43Å; M257-L260 PolarHBondContact O-N 3.09Å; M257-L260 VanDerWaalsContact O-N 3.14Å; M257-L260 HydrophobicContact SD-CD2 4.09Å; D258-L260 VanDerWaalsContact C-N 3.27Å; D258-L260 PolarHBondContact O-N 3.34Å; L260-R262 VanDerWaalsContact C-N 3.26Å; L260-R262 PolarHBondContact O-N 2.84Å; L260-K263 WeakPolarHBondContact O-CB 3.46Å; L260-K263 PolarHBondContact O-N 3.3Å; L260-K263 VanDerWaalsContact O-N 3.09Å; L260-M264 HydrophobicContact CD1-CG 4.3Å; L260-M264 HydrophobicContact CD1-SD 4.37Å; L260-M264 HydrophobicContact CG-CG 4.41Å; L260-M264 HydrophobicContact CG-SD 4.13Å; L260-M264 WeakPolarHBondContact O-CB 3.49Å; L260-M264 WeakPolarHBondContact O-CG 3.32Å; L260-M264 PolarHBondContact O-N 3.14Å
261	M	93.8	Very high	93.6	Very high	33 Å²	33	63.1 Å²	63.1	16%	0.163	31%	0.314	C	S	.	.	H	α-helix	trans	-55.9	-42.7	176.2	-72.6	170.1	54.1	0	0	111.3	L114 P182 M257 M264 Q265 L266 I271	L114-M261 HydrophobicContact CD1-CG 4.39Å; L114-M261 HydrophobicContact CD1-SD 3.88Å; L114-M261 HydrophobicContact CD2-CG 3.51Å; L114-M261 HydrophobicContact CD2-SD 4.06Å; P182-M261 HydrophobicContact CG-SD 4.18Å; M257-M261 HydrophobicContact CG-SD 4.31Å; M257-M261 VanDerWaalsContact O-CG 3.31Å; M257-M261 WeakPolarHBondContact O-CG 3.49Å; M257-M261 PolarHBondContact O-N 2.74Å; M261-M264 PolarHBondContact O-N 2.79Å; M261-Q265 PolarHBondContact O-N 2.9Å; M261-Q265 VanDerWaalsContact O-N 3.1Å; M261-L266 HydrophobicContact CG-CD2 4.25Å; M261-L266 PolarHBondContact O-N 2.63Å; M261-I271 HydrophobicContact CE-CD1 3.37Å; M261-I271 HydrophobicContact SD-CD1 4.36Å
262	R	93.8	Very high	93.5	Very high	163 Å²	163	62.6 Å²	62.6	62%	0.615	31%	0.305	S	S	*	.	H	α-helix	trans	-63.2	-44.8	174	-80.1	-177.1	-80.8	130.7	-6.6	112.8	D258 D259 L260 M264 Q265	D258-R262 PolarHBondContact O-N 3.32Å; D258-R262 VanDerWaalsContact O-N 3.12Å; D258-R262 PolarHBondContact O-NE 3Å; D259-R262 IonicContact OD1-CZ 3.56Å; D259-R262 IonicContact OD1-NH1 2.99Å; D259-R262 PolarHBondContact OD1-NH1 2.8Å; D259-R262 IonicContact OD1-NH2 3.11Å; D259-R262 PolarHBondContact OD1-NH2 3.15Å; L260-R262 VanDerWaalsContact C-N 3.26Å; L260-R262 PolarHBondContact O-N 2.84Å; R262-M264 VanDerWaalsContact C-N 3.28Å; R262-M264 PolarHBondContact O-N 3Å; R262-Q265 PolarHBondContact O-N 2.96Å; R262-Q265 VanDerWaalsContact O-N 3.11Å
263	K	94.4	Very high	93.3	Very high	149 Å²	149	60 Å²	60	65%	0.648	30%	0.299	S	S	*	.	H	α-helix	trans	-62.7	-36.7	176.4	-75.3	169.9	-176.6	173.8	0	112.2	D259 L260 Q265	D259-K263 VanDerWaalsContact O-CG 3.31Å; D259-K263 WeakPolarHBondContact O-CG 3.31Å; D259-K263 PolarHBondContact O-N 2.97Å; L260-K263 WeakPolarHBondContact O-CB 3.46Å; L260-K263 PolarHBondContact O-N 3.3Å; L260-K263 VanDerWaalsContact O-N 3.09Å; K263-Q265 PolarHBondContact O-N 2.77Å
264	M	94.7	Very high	93.1	Very high	10 Å²	10	63.4 Å²	63.4	5%	0.049	32%	0.316	C	S	.	.	H	α-helix	trans	-73.8	-13.7	176.5	-72.8	-173.2	74	0	0	113.5	I116 M124 Q127 L128 L131 I240 L260 M261 R262 L266	I116-M264 HydrophobicContact CD1-CE 4.17Å; M124-M264 HydrophobicContact SD-CE 4.05Å; Q127-M264 HydrophobicContact CG-CE 4.46Å; Q127-M264 VanDerWaalsContact NE2-CA 3.28Å; Q127-M264 VanDerWaalsContact NE2-CB 3.32Å; Q127-M264 PolarHBondContact NE2-O 2.77Å; L128-M264 HydrophobicContact CD2-CE 4.16Å; L131-M264 HydrophobicContact CD1-CE 4.38Å; L131-M264 HydrophobicContact CD1-CG 3.51Å; L131-M264 HydrophobicContact CD1-SD 4.01Å; I240-M264 HydrophobicContact CD1-CE 4.17Å; I240-M264 HydrophobicContact CD1-SD 3.54Å; I240-M264 VanDerWaalsContact CD1-SD 3.54Å; L260-M264 HydrophobicContact CD1-CG 4.3Å; L260-M264 HydrophobicContact CD1-SD 4.37Å; L260-M264 HydrophobicContact CG-CG 4.41Å; L260-M264 HydrophobicContact CG-SD 4.13Å; L260-M264 WeakPolarHBondContact O-CB 3.49Å; L260-M264 WeakPolarHBondContact O-CG 3.32Å; L260-M264 PolarHBondContact O-N 3.14Å; M261-M264 PolarHBondContact O-N 2.79Å; R262-M264 VanDerWaalsContact C-N 3.28Å; R262-M264 PolarHBondContact O-N 3Å; M264-L266 HydrophobicContact CB-CB 4.25Å; M264-L266 PolarHBondContact O-N 2.99Å
265	Q	94.1	Very high	93	Very high	176 Å²	176	62.3 Å²	62.3	82%	0.822	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	41.4	-170.2	-58.6	174	43.8	0	0	110.9	M261 R262 K263 D267	M261-Q265 PolarHBondContact O-N 2.9Å; M261-Q265 VanDerWaalsContact O-N 3.1Å; R262-Q265 PolarHBondContact O-N 2.96Å; R262-Q265 VanDerWaalsContact O-N 3.11Å; K263-Q265 PolarHBondContact O-N 2.77Å; Q265-D267 PolarHBondContact O-N 3.45Å
266	L	91.1	Very high	93	Very high	26 Å²	26	56.1 Å²	56.1	14%	0.136	29%	0.288	C	S	.	.			trans	-68.8	130.8	-171.5	-177.7	63.2	0	0	0	110.7	L114 I116 M261 M264 P268 I271	L114-L266 HydrophobicContact CD2-CD2 3.91Å; I116-L266 HydrophobicContact CD1-CD1 4.03Å; I116-L266 HydrophobicContact CD1-CD2 3.66Å; I116-L266 HydrophobicContact CG1-CD1 4.34Å; I116-L266 HydrophobicContact CG1-CD2 3.86Å; I116-L266 HydrophobicContact CG2-CD1 3.59Å; M261-L266 HydrophobicContact CG-CD2 4.25Å; M261-L266 PolarHBondContact O-N 2.63Å; M264-L266 HydrophobicContact CB-CB 4.25Å; M264-L266 PolarHBondContact O-N 2.99Å; L266-P268 VanDerWaalsContact O-CD 3.28Å; L266-P268 WeakPolarHBondContact O-CD 3.47Å; L266-I271 HydrophobicContact CD2-CD1 3.83Å; L266-I271 HydrophobicContact CD2-CG1 3.69Å; L266-I271 HydrophobicContact CG-CG1 4.34Å
267	D	91.8	Very high	93	Very high	76 Å²	76	55 Å²	55	41%	0.406	28%	0.28	S	S	.	.			trans	-68.3	116.4	168	-177.3	-15.9	0	0	0	109.2	Q265 T269 L270	Q265-D267 PolarHBondContact O-N 3.45Å; D267-T269 PolarHBondContact O-N 3.4Å; D267-T269 VanDerWaalsContact O-N 3.13Å; D267-T269 WeakPolarHBondContact OD1-CB 3.35Å; D267-T269 WeakPolarHBondContact OD1-CG2 3.38Å; D267-T269 PolarHBondContact OD1-N 2.98Å; D267-T269 PolarHBondContact OD1-OG1 2.89Å; D267-T269 PolarHBondContact OD2-OG1 2.85Å; D267-T269 VanDerWaalsContact OD2-OG1 3.09Å; D267-L270 HydrophobicContact CB-CD1 4.08Å; D267-L270 HydrophobicContact CB-CG 4.11Å; D267-L270 WeakPolarHBondContact O-CB 3.31Å; D267-L270 PolarHBondContact O-N 2.81Å
268	P	89.4	Confident	92.8	Very high	71 Å²	71	57.2 Å²	57.2	46%	0.461	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-58.4	-27	-179	-24.3	35.1	0	0	0	113.6	H180 L266 L270 I271	H180-P268 WeakPolarHBondContact CB-O 3.14Å; H180-P268 VanDerWaalsContact CG-O 3.31Å; H180-P268 PolarHBondContact ND1-O 2.95Å; L266-P268 VanDerWaalsContact O-CD 3.28Å; L266-P268 WeakPolarHBondContact O-CD 3.47Å; P268-L270 PolarHBondContact O-N 3.13Å; P268-I271 HydrophobicContact CB-CD1 4.42Å; P268-I271 WeakPolarHBondContact O-CB 3.48Å; P268-I271 PolarHBondContact O-N 3.03Å
269	T	90.7	Very high	92.9	Very high	97 Å²	97	54.4 Å²	54.4	60%	0.595	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-67	-18	179.7	67.8	0	0	0	0	113.1	D267 I271	D267-T269 PolarHBondContact O-N 3.4Å; D267-T269 VanDerWaalsContact O-N 3.13Å; D267-T269 WeakPolarHBondContact OD1-CB 3.35Å; D267-T269 WeakPolarHBondContact OD1-CG2 3.38Å; D267-T269 PolarHBondContact OD1-N 2.98Å; D267-T269 PolarHBondContact OD1-OG1 2.89Å; D267-T269 PolarHBondContact OD2-OG1 2.85Å; D267-T269 VanDerWaalsContact OD2-OG1 3.09Å; T269-I271 VanDerWaalsContact C-N 3.33Å
270	L	94.2	Very high	92.8	Very high	34 Å²	34	51.4 Å²	51.4	18%	0.178	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-83.8	-9	174.3	-60.1	178.8	0	0	0	113	I116 A117 Q119 D267 P268	I116-L270 CarbonylContact C-O 3.57Å; I116-L270 WeakPolarHBondContact CA-O 3.36Å; I116-L270 HydrophobicContact CG2-CB 4.14Å; A117-L270 HydrophobicContact CB-CD2 4.47Å; A117-L270 PolarHBondContact N-O 3.03Å; Q119-L270 HydrophobicContact CG-CD2 4.28Å; D267-L270 HydrophobicContact CB-CD1 4.08Å; D267-L270 HydrophobicContact CB-CG 4.11Å; D267-L270 WeakPolarHBondContact O-CB 3.31Å; D267-L270 PolarHBondContact O-N 2.81Å; P268-L270 PolarHBondContact O-N 3.13Å
271	I	93.9	Very high	92.7	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.021	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-81.4	131.1	-179.3	-57.7	170.6	0	0	0	109.5	L114 K115 H180 M261 L266 P268 T269	L114-I271 HydrophobicContact CD1-CB 4.48Å; L114-I271 HydrophobicContact CD1-CD1 3.97Å; L114-I271 HydrophobicContact CD1-CG1 4.03Å; L114-I271 HydrophobicContact CD1-CG2 3.67Å; K115-I271 WeakPolarHBondContact O-CA 3.26Å; H180-I271 HydrophobicContact CB-CB 4.13Å; H180-I271 PolarHBondContact ND1-O 3.24Å; M261-I271 HydrophobicContact CE-CD1 3.37Å; M261-I271 HydrophobicContact SD-CD1 4.36Å; L266-I271 HydrophobicContact CD2-CD1 3.83Å; L266-I271 HydrophobicContact CD2-CG1 3.69Å; L266-I271 HydrophobicContact CG-CG1 4.34Å; P268-I271 HydrophobicContact CB-CD1 4.42Å; P268-I271 WeakPolarHBondContact O-CB 3.48Å; P268-I271 PolarHBondContact O-N 3.03Å; T269-I271 VanDerWaalsContact C-N 3.33Å
272	S	91.6	Very high	92.5	Very high	20 Å²	20	55.9 Å²	55.9	14%	0.14	29%	0.287	C	S	.	.			trans	-124.1	124.7	178.6	-176.8	0	0	0	0	112.4	K115 M274	K115-S272 PolarHBondContact O-N 3.01Å; S272-M274 VanDerWaalsContact C-N 3.28Å; S272-M274 WeakPolarHBondContact OG-CB 3.21Å; S272-M274 PolarHBondContact OG-N 3.17Å
273	G	89.7	Confident	92.4	Very high	23 Å²	23	53.1 Å²	53.1	24%	0.237	28%	0.277	C	S	.	.			trans	-74.7	-16.8	169.4	0	0	0	0	0	113.9
274	M	90.4	Very high	92.1	Very high	72 Å²	72	51.3 Å²	51.3	36%	0.355	27%	0.266	S	S	.	.	S	Bend	trans	-69.2	148.2	-174.2	-61.6	-176.7	77.7	0	0	112	K115 S272 D278 L279 V282	K115-M274 WeakPolarHBondContact CE-O 3.39Å; K115-M274 PolarHBondContact NZ-O 3.47Å; S272-M274 VanDerWaalsContact C-N 3.28Å; S272-M274 WeakPolarHBondContact OG-CB 3.21Å; S272-M274 PolarHBondContact OG-N 3.17Å; M274-D278 HydrophobicContact CB-CB 4.1Å; M274-D278 HydrophobicContact CE-CB 3.48Å; M274-D278 VanDerWaalsContact CE-CB 3.48Å; M274-L279 HydrophobicContact CB-CD2 4Å; M274-L279 HydrophobicContact CB-CG 3.84Å; M274-L279 HydrophobicContact SD-CD2 3.96Å; M274-V282 HydrophobicContact CE-CG2 3.51Å; M274-V282 HydrophobicContact SD-CG2 4.5Å
275	S	91.9	Very high	91.7	Very high	13 Å²	13	54.4 Å²	54.4	9%	0.091	29%	0.285	C	S	.	.			trans	-74.8	165	167.9	74.2	0	0	0	0	110.7	H277 D278 L279	S275-H277 PolarHBondContact O-N 2.82Å; S275-H277 PolarHBondContact OG-N 2.95Å; S275-D278 VanDerWaalsContact CB-OD2 3.3Å; S275-D278 WeakPolarHBondContact CB-OD2 3.5Å; S275-D278 PolarHBondContact N-OD2 2.87Å; S275-D278 PolarHBondContact O-N 3.21Å; S275-D278 PolarHBondContact OG-N 3.28Å; S275-D278 VanDerWaalsContact OG-N 3.14Å; S275-D278 PolarHBondContact OG-OD2 3.48Å; S275-L279 VanDerWaalsContact O-CG 3.31Å; S275-L279 WeakPolarHBondContact O-CG 3.12Å; S275-L279 PolarHBondContact O-N 3.48Å
276	Y	95.7	Very high	91.4	Very high	17 Å²	17	49.2 Å²	49.2	7%	0.067	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-28.5	172.5	-69.2	-45.4	0	0	0	113	K115 I212 K214 D229 V231 Y237 L279 L280	K115-Y276 HydrophobicContact CD-CE1 4.03Å; I212-Y276 HydrophobicContact CG2-CD2 4.5Å; K214-Y276 HydrophobicContact CD-CD2 4.36Å; K214-Y276 HydrophobicContact CD-CE2 4.21Å; D229-Y276 PolarHBondContact OD2-OH 3.27Å; V231-Y276 HydrophobicContact CG1-CD1 4.44Å; V231-Y276 HydrophobicContact CG1-CG 4.37Å; V231-Y276 HydrophobicContact CG2-CD1 3.9Å; V231-Y276 HydrophobicContact CG2-CD2 4.24Å; V231-Y276 HydrophobicContact CG2-CE1 3.71Å; V231-Y276 HydrophobicContact CG2-CE2 4.05Å; V231-Y276 HydrophobicContact CG2-CG 4.18Å; Y237-Y276 WeakPolarHBondContact CB-OH 3.42Å; Y237-Y276 HydrophobicContact CD1-CE1 4.4Å; Y237-Y276 AromaticContact CD2-CE1 3.87Å; Y237-Y276 HydrophobicContact CD2-CE1 3.87Å; Y237-Y276 AromaticContact CG-CE1 3.73Å; Y237-Y276 HydrophobicContact CG-CE1 3.73Å; Y276-L279 HydrophobicContact CD1-CD1 4.07Å; Y276-L280 VanDerWaalsContact O-CB 3.31Å; Y276-L280 WeakPolarHBondContact O-CB 3.42Å; Y276-L280 PolarHBondContact O-N 2.99Å
277	H	93.7	Very high	91	Very high	18 Å²	18	50.3 Å²	50.3	8%	0.083	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-48.2	173.8	177.5	-96	0	0	0	111.6	I145 L209 I212 S275 L279 L280 L281	I145-H277 HydrophobicContact CG1-CB 4.45Å; L209-H277 VanDerWaalsContact C-NE2 3.26Å; L209-H277 PolarHBondContact O-NE2 3.45Å; I212-H277 HydrophobicContact CD1-CB 4.4Å; I212-H277 HydrophobicContact CG1-CB 4.5Å; S275-H277 PolarHBondContact O-N 2.82Å; S275-H277 PolarHBondContact OG-N 2.95Å; H277-L279 VanDerWaalsContact C-N 3.32Å; H277-L279 PolarHBondContact O-N 3.46Å; H277-L280 WeakPolarHBondContact O-CB 3.29Å; H277-L280 PolarHBondContact O-N 2.76Å; H277-L281 WeakPolarHBondContact O-CG 3.39Å; H277-L281 PolarHBondContact O-N 3Å
278	D	92.5	Very high	90.6	Very high	46 Å²	46	53.1 Å²	53.1	25%	0.246	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-41.7	177	-50.7	-53.9	0	0	0	111.2	M274 S275 L280 L281 V282	M274-D278 HydrophobicContact CB-CB 4.1Å; M274-D278 HydrophobicContact CE-CB 3.48Å; M274-D278 VanDerWaalsContact CE-CB 3.48Å; S275-D278 VanDerWaalsContact CB-OD2 3.3Å; S275-D278 WeakPolarHBondContact CB-OD2 3.5Å; S275-D278 PolarHBondContact N-OD2 2.87Å; S275-D278 PolarHBondContact O-N 3.21Å; S275-D278 PolarHBondContact OG-N 3.28Å; S275-D278 VanDerWaalsContact OG-N 3.14Å; S275-D278 PolarHBondContact OG-OD2 3.48Å; D278-L280 VanDerWaalsContact C-N 3.32Å; D278-L280 PolarHBondContact O-N 2.83Å; D278-L281 PolarHBondContact O-N 3.28Å; D278-V282 WeakPolarHBondContact O-CG2 3.33Å; D278-V282 PolarHBondContact O-N 3.13Å
279	L	93.9	Very high	90.2	Very high	13 Å²	13	55.6 Å²	55.6	7%	0.068	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-39.9	176.3	-71.1	168	0	0	0	111.9	K115 V234 Y237 M274 S275 Y276 H277 V282 R283	K115-L279 HydrophobicContact CD-CD1 4.23Å; V234-L279 HydrophobicContact CG1-CB 3.72Å; V234-L279 HydrophobicContact CG1-CD1 4.29Å; Y237-L279 HydrophobicContact CE1-CD1 3.85Å; Y237-L279 HydrophobicContact CE2-CD1 4.26Å; M274-L279 HydrophobicContact CB-CD2 4Å; M274-L279 HydrophobicContact CB-CG 3.84Å; M274-L279 HydrophobicContact SD-CD2 3.96Å; S275-L279 VanDerWaalsContact O-CG 3.31Å; S275-L279 WeakPolarHBondContact O-CG 3.12Å; S275-L279 PolarHBondContact O-N 3.48Å; Y276-L279 HydrophobicContact CD1-CD1 4.07Å; H277-L279 VanDerWaalsContact C-N 3.32Å; H277-L279 PolarHBondContact O-N 3.46Å; L279-V282 PolarHBondContact O-N 2.92Å; L279-R283 VanDerWaalsContact O-CG 3.28Å; L279-R283 WeakPolarHBondContact O-CG 3.35Å; L279-R283 PolarHBondContact O-N 2.85Å
280	L	93.6	Very high	89.5	Confident	6 Å²	6	58.1 Å²	58.1	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-42.8	175.3	179.3	62.7	0	0	0	111.7	I212 E233 V234 Y276 H277 D278 R283 R284	I212-L280 HydrophobicContact CD1-CB 4.14Å; I212-L280 HydrophobicContact CD1-CD2 3.65Å; E233-L280 HydrophobicContact CB-CD1 3.5Å; E233-L280 VanDerWaalsContact CB-CD1 3.5Å; V234-L280 HydrophobicContact CG2-CB 3.68Å; V234-L280 HydrophobicContact CG2-CD1 3.89Å; V234-L280 HydrophobicContact CG2-CG 4.37Å; Y276-L280 VanDerWaalsContact O-CB 3.31Å; Y276-L280 WeakPolarHBondContact O-CB 3.42Å; Y276-L280 PolarHBondContact O-N 2.99Å; H277-L280 WeakPolarHBondContact O-CB 3.29Å; H277-L280 PolarHBondContact O-N 2.76Å; D278-L280 VanDerWaalsContact C-N 3.32Å; D278-L280 PolarHBondContact O-N 2.83Å; L280-R283 PolarHBondContact O-N 2.99Å; L280-R284 WeakPolarHBondContact O-CG 3.46Å; L280-R284 PolarHBondContact O-N 2.79Å; L280-R284 VanDerWaalsContact O-N 3.07Å
281	L	92.1	Very high	88.5	Confident	83 Å²	83	61.8 Å²	61.8	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-61.1	-46.3	175.9	-67.7	-179.7	0	0	0	111.3	H277 D278 R283 R284 V285	H277-L281 WeakPolarHBondContact O-CG 3.39Å; H277-L281 PolarHBondContact O-N 3Å; D278-L281 PolarHBondContact O-N 3.28Å; L281-R283 PolarHBondContact O-N 2.83Å; L281-R284 PolarHBondContact O-N 2.74Å; L281-V285 PolarHBondContact O-N 3.48Å; L281-V285 VanDerWaalsContact O-N 3.14Å
282	V	90	Very high	87.3	Confident	57 Å²	57	65 Å²	65	35%	0.345	33%	0.328	S	S	.	.	H	α-helix	trans	-57.7	-47.8	175.8	170.9	0	0	0	0	111.2	M274 D278 L279 R284 V285 E286	M274-V282 HydrophobicContact CE-CG2 3.51Å; M274-V282 HydrophobicContact SD-CG2 4.5Å; D278-V282 WeakPolarHBondContact O-CG2 3.33Å; D278-V282 PolarHBondContact O-N 3.13Å; L279-V282 PolarHBondContact O-N 2.92Å; V282-R284 VanDerWaalsContact C-N 3.26Å; V282-R284 PolarHBondContact O-N 2.92Å; V282-V285 PolarHBondContact O-N 2.79Å; V282-E286 HydrophobicContact CG1-CG 4.26Å; V282-E286 WeakPolarHBondContact O-CG 3.32Å; V282-E286 PolarHBondContact O-N 2.86Å
283	R	90.1	Very high	86.1	Confident	105 Å²	105	68.4 Å²	68.4	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-33.1	-179.8	-70.7	-63.2	-176.2	-143.7	-2.8	113.3	L279 L280 L281 E286 A287	L279-R283 VanDerWaalsContact O-CG 3.28Å; L279-R283 WeakPolarHBondContact O-CG 3.35Å; L279-R283 PolarHBondContact O-N 2.85Å; L280-R283 PolarHBondContact O-N 2.99Å; L281-R283 PolarHBondContact O-N 2.83Å; R283-E286 WeakPolarHBondContact CD-OE2 3.45Å; R283-E286 IonicContact CZ-OE2 2.72Å; R283-E286 IonicContact NH1-OE1 3.67Å; R283-E286 IonicContact NH1-OE2 3.95Å; R283-E286 PolarHBondContact NH1-OE2 2.84Å; R283-A287 WeakPolarHBondContact O-CB 3.36Å; R283-A287 PolarHBondContact O-N 2.88Å
284	R	89.4	Confident	84.6	Confident	111 Å²	111	68.7 Å²	68.7	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-70.1	-44.1	176.7	-74.2	175.1	177.2	178.3	-0.6	111.9	E233 L280 L281 V282 A287 E288	E233-R284 IonicContact OE2-CZ 3.55Å; E233-R284 IonicContact OE2-NE 2.73Å; E233-R284 IonicContact OE2-NH2 3.49Å; E233-R284 PolarHBondContact OE2-NH2 2.9Å; L280-R284 WeakPolarHBondContact O-CG 3.46Å; L280-R284 PolarHBondContact O-N 2.79Å; L280-R284 VanDerWaalsContact O-N 3.07Å; L281-R284 PolarHBondContact O-N 2.74Å; V282-R284 VanDerWaalsContact C-N 3.26Å; V282-R284 PolarHBondContact O-N 2.92Å; R284-A287 PolarHBondContact O-N 2.79Å; R284-E288 WeakPolarHBondContact O-CG 3.33Å; R284-E288 PolarHBondContact O-N 3.08Å
285	V	85.7	Confident	83.3	Confident	74 Å²	74	67.7 Å²	67.7	45%	0.448	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-46.9	175.4	178.4	0	0	0	0	110.7	L281 V282 A287 E288 E289	L281-V285 PolarHBondContact O-N 3.48Å; L281-V285 VanDerWaalsContact O-N 3.14Å; V282-V285 PolarHBondContact O-N 2.79Å; V285-A287 PolarHBondContact O-N 2.9Å; V285-E288 PolarHBondContact O-N 3.38Å; V285-E288 VanDerWaalsContact O-N 3.13Å; V285-E289 HydrophobicContact CG1-CG 4.45Å; V285-E289 PolarHBondContact O-N 3.03Å
286	E	86.9	Confident	81.6	Confident	67 Å²	67	74.4 Å²	74.4	31%	0.313	37%	0.369	S	S	.	.	H	α-helix	trans	-59.5	-33.2	176.7	-72.2	178.7	167.1	0	0	112.8	V282 R283 K290	V282-E286 HydrophobicContact CG1-CG 4.26Å; V282-E286 WeakPolarHBondContact O-CG 3.32Å; V282-E286 PolarHBondContact O-N 2.86Å; R283-E286 WeakPolarHBondContact CD-OE2 3.45Å; R283-E286 IonicContact CZ-OE2 2.72Å; R283-E286 IonicContact NH1-OE1 3.67Å; R283-E286 IonicContact NH1-OE2 3.95Å; R283-E286 PolarHBondContact NH1-OE2 2.84Å; E286-K290 VanDerWaalsContact O-CG 3.29Å; E286-K290 WeakPolarHBondContact O-CG 3.33Å; E286-K290 PolarHBondContact O-N 2.87Å
287	A	84.6	Confident	79.3	Confident	49 Å²	49	78.7 Å²	78.7	41%	0.405	39%	0.392	S	S	.	.	H	α-helix	trans	-72.1	-39.9	176.6	0	0	0	0	0	111.8	R283 R284 V285 I291	R283-A287 WeakPolarHBondContact O-CB 3.36Å; R283-A287 PolarHBondContact O-N 2.88Å; R284-A287 PolarHBondContact O-N 2.79Å; V285-A287 PolarHBondContact O-N 2.9Å; A287-I291 VanDerWaalsContact O-CG1 3.31Å; A287-I291 WeakPolarHBondContact O-CG1 3.41Å; A287-I291 PolarHBondContact O-N 3.16Å
288	E	82.2	Confident	77.6	Confident	135 Å²	135	83.3 Å²	83.3	63%	0.631	41%	0.414	S	S	*	.	H	α-helix	trans	-66.2	-42.6	176.4	-71.8	175.4	-175.7	0	0	112	R284 V285 K290 I291 D292	R284-E288 WeakPolarHBondContact O-CG 3.33Å; R284-E288 PolarHBondContact O-N 3.08Å; V285-E288 PolarHBondContact O-N 3.38Å; V285-E288 VanDerWaalsContact O-N 3.13Å; E288-K290 PolarHBondContact O-N 3.42Å; E288-I291 WeakPolarHBondContact O-CB 3.3Å; E288-I291 PolarHBondContact O-N 2.95Å; E288-I291 VanDerWaalsContact O-N 3.17Å; E288-D292 PolarHBondContact O-N 3.39Å
289	E	80.4	Confident	75.9	Confident	123 Å²	123	90.9 Å²	90.9	58%	0.575	44%	0.439	S	S	*	.	H	α-helix	trans	-62.4	-41.3	176.8	-72.5	-176.8	164.3	0	0	112.1	V285 I291 D292 D293	V285-E289 HydrophobicContact CG1-CG 4.45Å; V285-E289 PolarHBondContact O-N 3.03Å; E289-I291 VanDerWaalsContact C-N 3.26Å; E289-I291 PolarHBondContact O-N 3.24Å; E289-D292 PolarHBondContact O-N 2.9Å; E289-D293 PolarHBondContact O-N 2.96Å
290	K	75.9	Confident	73.8	Confident	151 Å²	151	94.3 Å²	94.3	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-63.3	-32.8	175.5	-75.8	173.9	-174.6	173.9	0	112.8	E286 E288 G294	E286-K290 VanDerWaalsContact O-CG 3.29Å; E286-K290 WeakPolarHBondContact O-CG 3.33Å; E286-K290 PolarHBondContact O-N 2.87Å; E288-K290 PolarHBondContact O-N 3.42Å; K290-G294 PolarHBondContact O-N 3.21Å
291	I	73.7	Confident	72.5	Confident	111 Å²	111	100 Å²	100	57%	0.569	50%	0.499	S	S	*	.	H	α-helix	trans	-69.8	-45.3	174.7	-65.9	164.6	0	0	0	109.6	A287 E288 E289 D293 G294 V295	A287-I291 VanDerWaalsContact O-CG1 3.31Å; A287-I291 WeakPolarHBondContact O-CG1 3.41Å; A287-I291 PolarHBondContact O-N 3.16Å; E288-I291 WeakPolarHBondContact O-CB 3.3Å; E288-I291 PolarHBondContact O-N 2.95Å; E288-I291 VanDerWaalsContact O-N 3.17Å; E289-I291 VanDerWaalsContact C-N 3.26Å; E289-I291 PolarHBondContact O-N 3.24Å; I291-D293 PolarHBondContact O-N 2.92Å; I291-G294 PolarHBondContact O-N 3.24Å; I291-V295 HydrophobicContact CG2-CG2 4.36Å; I291-V295 VanDerWaalsContact O-CG2 3.32Å; I291-V295 WeakPolarHBondContact O-CG2 3.38Å; I291-V295 PolarHBondContact O-N 3.49Å
292	D	69.6	Low	70.6	Confident	72 Å²	72	98.9 Å²	98.9	39%	0.385	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-42.2	177.6	-169.4	31.8	0	0	0	111.5	E288 E289 G294 V295 R296	E288-D292 PolarHBondContact O-N 3.39Å; E289-D292 PolarHBondContact O-N 2.9Å; D292-G294 VanDerWaalsContact C-N 3.35Å; D292-G294 PolarHBondContact O-N 2.91Å; D292-V295 PolarHBondContact O-N 3.29Å; D292-R296 WeakPolarHBondContact O-CB 3.3Å; D292-R296 VanDerWaalsContact O-CG 3.23Å; D292-R296 WeakPolarHBondContact O-CG 3.15Å; D292-R296 PolarHBondContact O-N 2.9Å; D292-R296 IonicContact OD1-NE 3.7Å; D292-R296 PolarHBondContact OD1-NE 3.34Å; D292-R296 IonicContact OD2-CZ 3.58Å; D292-R296 IonicContact OD2-NE 3.56Å; D292-R296 PolarHBondContact OD2-NE 3.04Å; D292-R296 IonicContact OD2-NH2 2.84Å; D292-R296 PolarHBondContact OD2-NH2 2.78Å
293	D	67	Low	68.8	Low	90 Å²	90	100.6 Å²	100.6	48%	0.481	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-40.8	174.3	-81	-13.3	0	0	0	112.1	E289 I291 R296 L297	E289-D293 PolarHBondContact O-N 2.96Å; I291-D293 PolarHBondContact O-N 2.92Å; D293-R296 PolarHBondContact O-N 3.09Å; D293-L297 WeakPolarHBondContact O-CB 3.28Å; D293-L297 PolarHBondContact O-N 3.09Å
294	G	57.3	Low	66.6	Low	29 Å²	29	100.8 Å²	100.8	30%	0.299	54%	0.535	S	S	.	.	H	α-helix	trans	-61.1	-47.4	173.4	0	0	0	0	0	112.6	K290 I291 D292 R296 L297 E298	K290-G294 PolarHBondContact O-N 3.21Å; I291-G294 PolarHBondContact O-N 3.24Å; D292-G294 VanDerWaalsContact C-N 3.35Å; D292-G294 PolarHBondContact O-N 2.91Å; G294-R296 PolarHBondContact O-N 3.2Å; G294-L297 WeakPolarHBondContact O-CB 3.35Å; G294-L297 PolarHBondContact O-N 3.35Å; G294-E298 WeakPolarHBondContact O-CG 3.21Å; G294-E298 PolarHBondContact O-N 3.15Å
295	V	62.9	Low	64.7	Low	52 Å²	52	101.3 Å²	101.3	32%	0.315	55%	0.552	S	S	.	*	H	α-helix	trans	-64.6	-39.3	177.2	172.3	0	0	0	0	111.3	I291 D292 R299	I291-V295 HydrophobicContact CG2-CG2 4.36Å; I291-V295 VanDerWaalsContact O-CG2 3.32Å; I291-V295 WeakPolarHBondContact O-CG2 3.38Å; I291-V295 PolarHBondContact O-N 3.49Å; D292-V295 PolarHBondContact O-N 3.29Å; V295-R299 WeakPolarHBondContact O-CB 3.34Å; V295-R299 VanDerWaalsContact O-CG 3.31Å; V295-R299 WeakPolarHBondContact O-CG 3.4Å; V295-R299 PolarHBondContact O-N 3.4Å
296	R	56.9	Low	62.8	Low	153 Å²	153	110.6 Å²	110.6	58%	0.577	59%	0.591	S	S	*	*	H	α-helix	trans	-63.8	-41.5	173.6	-74.4	174.2	-172.8	-170.8	3.1	111.3	D292 D293 G294 A300	D292-R296 WeakPolarHBondContact O-CB 3.3Å; D292-R296 VanDerWaalsContact O-CG 3.23Å; D292-R296 WeakPolarHBondContact O-CG 3.15Å; D292-R296 PolarHBondContact O-N 2.9Å; D292-R296 IonicContact OD1-NE 3.7Å; D292-R296 PolarHBondContact OD1-NE 3.34Å; D292-R296 IonicContact OD2-CZ 3.58Å; D292-R296 IonicContact OD2-NE 3.56Å; D292-R296 PolarHBondContact OD2-NE 3.04Å; D292-R296 IonicContact OD2-NH2 2.84Å; D292-R296 PolarHBondContact OD2-NH2 2.78Å; D293-R296 PolarHBondContact O-N 3.09Å; G294-R296 PolarHBondContact O-N 3.2Å; R296-A300 VanDerWaalsContact O-CB 3.26Å; R296-A300 WeakPolarHBondContact O-CB 3.42Å; R296-A300 PolarHBondContact O-N 2.96Å
297	L	45.9	Very low	61.6	Low	107 Å²	107	112.8 Å²	112.8	56%	0.56	61%	0.605	S	S	*	*	H	α-helix	trans	-65	-46.2	174.8	-97.9	144	0	0	0	112.2	D293 G294 R299 A300 L301	D293-L297 WeakPolarHBondContact O-CB 3.28Å; D293-L297 PolarHBondContact O-N 3.09Å; G294-L297 WeakPolarHBondContact O-CB 3.35Å; G294-L297 PolarHBondContact O-N 3.35Å; L297-R299 PolarHBondContact O-N 2.78Å; L297-A300 CarbonylContact O-C 3.53Å; L297-A300 PolarHBondContact O-N 3.16Å; L297-L301 HydrophobicContact CD2-CD1 4.36Å; L297-L301 WeakPolarHBondContact O-CB 3.4Å; L297-L301 VanDerWaalsContact O-CG 3.24Å; L297-L301 WeakPolarHBondContact O-CG 3.07Å; L297-L301 PolarHBondContact O-N 3.37Å
298	E	59.9	Low	60.4	Low	115 Å²	115	116.1 Å²	116.1	54%	0.537	62%	0.615	S	S	.	*	H	α-helix	trans	-62	-42.9	176.7	-75	-177.1	170.9	0	0	111.9	G294 A300 L301 G302 V303	G294-E298 WeakPolarHBondContact O-CG 3.21Å; G294-E298 PolarHBondContact O-N 3.15Å; E298-A300 VanDerWaalsContact C-N 3.34Å; E298-A300 PolarHBondContact O-N 2.71Å; E298-L301 CarbonylContact O-C 3.52Å; E298-L301 PolarHBondContact O-N 3.19Å; E298-G302 PolarHBondContact O-N 3.48Å; E298-V303 PolarHBondContact O-N 3.33Å
299	R	56.5	Low	59.2	Low	205 Å²	205	115.1 Å²	115.1	77%	0.774	61%	0.614	S	S	*	*	H	α-helix	trans	-62.6	-39.3	173	-76.3	-179.8	179.2	178.9	2.9	112.2	V295 L297 G302	V295-R299 WeakPolarHBondContact O-CB 3.34Å; V295-R299 VanDerWaalsContact O-CG 3.31Å; V295-R299 WeakPolarHBondContact O-CG 3.4Å; V295-R299 PolarHBondContact O-N 3.4Å; L297-R299 PolarHBondContact O-N 2.78Å; R299-G302 PolarHBondContact O-N 2.83Å
300	A	49.7	Very low	57.9	Low	86 Å²	86	114.6 Å²	114.6	71%	0.711	62%	0.617	S	S	*	*	H	α-helix	trans	-70.1	-33.3	176.5	0	0	0	0	0	112.5	R296 L297 E298 G302	R296-A300 VanDerWaalsContact O-CB 3.26Å; R296-A300 WeakPolarHBondContact O-CB 3.42Å; R296-A300 PolarHBondContact O-N 2.96Å; L297-A300 CarbonylContact O-C 3.53Å; L297-A300 PolarHBondContact O-N 3.16Å; E298-A300 VanDerWaalsContact C-N 3.34Å; E298-A300 PolarHBondContact O-N 2.71Å; A300-G302 VanDerWaalsContact C-N 3.32Å
301	L	66.5	Low	56.8	Low	125 Å²	125	112.3 Å²	112.3	65%	0.654	61%	0.614	S	S	*	*	H	α-helix	trans	-83.1	-6	177.8	-69	171.3	0	0	0	113.2	L297 E298 V303	L297-L301 HydrophobicContact CD2-CD1 4.36Å; L297-L301 WeakPolarHBondContact O-CB 3.4Å; L297-L301 VanDerWaalsContact O-CG 3.24Å; L297-L301 WeakPolarHBondContact O-CG 3.07Å; L297-L301 PolarHBondContact O-N 3.37Å; E298-L301 CarbonylContact O-C 3.52Å; E298-L301 PolarHBondContact O-N 3.19Å; L301-V303 HydrophobicContact CB-CG2 4.07Å; L301-V303 PolarHBondContact O-N 2.78Å
302	G	50.8	Low	55.7	Low	60 Å²	60	112.4 Å²	112.4	62%	0.619	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.4	21.2	176.9	0	0	0	0	0	113.9	E298 R299 A300 C304	E298-G302 PolarHBondContact O-N 3.48Å; R299-G302 PolarHBondContact O-N 2.83Å; A300-G302 VanDerWaalsContact C-N 3.32Å; G302-C304 PolarHBondContact O-N 3.11Å; G302-C304 VanDerWaalsContact O-N 3.13Å
303	V	52.5	Low	54.7	Low	93 Å²	93	115.3 Å²	115.3	56%	0.564	63%	0.634	S	S	*	*			trans	-82.3	91.8	176.5	-171	0	0	0	0	107.2	E298 L301	E298-V303 PolarHBondContact O-N 3.33Å; L301-V303 HydrophobicContact CB-CG2 4.07Å; L301-V303 PolarHBondContact O-N 2.78Å
304	C	43.8	Very low	53.8	Low	109 Å²	109	117.2 Å²	117.2	74%	0.736	65%	0.645	S	S	*	*			trans	-65.7	134.9	168	-76.7	0	0	0	0	108.9	G302 E306	G302-C304 PolarHBondContact O-N 3.11Å; G302-C304 VanDerWaalsContact O-N 3.13Å; C304-E306 PolarHBondContact O-N 3.14Å
305	P	50.4	Low	53.5	Low	121 Å²	121	124.6 Å²	124.6	79%	0.786	67%	0.674	S	S	*	*			trans	-66.1	131.5	175.7	21.2	-21.6	0	0	0	109.6
306	E	46	Very low	52.6	Low	269 Å²	269	131.2 Å²	131.2	100%	1.257	71%	0.707	S	S	*	*			trans	-65.5	0	166.2	-72.5	-171.6	162.9	0	0	111.7	C304	C304-E306 PolarHBondContact O-N 3.14Å

Retrieved 306 of 306 residues in 184.4 ms (Link to these results)

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