A0A087XZZ6_POEFO Loading...

Store-operated calcium entry-associated regulatory factor

AlphaFold DB , UniProt , Accession A0A087XZZ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 319 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	59.5	Low	67.2	Low	221 Å²	221	115.2 Å²	115.2	100%	1.089	62%	0.622	S	S	*	*				0	-0.6	0	-75.1	-179.7	-86.7	0	0	113.1
2	E	58.4	Low	66.8	Low	160 Å²	160	116.9 Å²	116.9	75%	0.748	62%	0.62	S	S	*	*			trans	-85.1	-9.3	-176.4	-62.7	-71	138	0	0	115.5	P5	E2-P5 WeakPolarHBondContact O-CD 3.07Å; E2-P5 WeakPolarHBondContact O-CG 3.46Å
3	L	60.3	Low	66.5	Low	145 Å²	145	114.6 Å²	114.6	76%	0.759	61%	0.613	S	S	*	*	H	α-helix	trans	-81.2	-26	-176.5	-72.1	165.8	0	0	0	113.4	V6 T7	L3-V6 PolarHBondContact O-N 3.47Å; L3-T7 WeakPolarHBondContact O-CG2 3.37Å; L3-T7 PolarHBondContact O-N 3.34Å; L3-T7 PolarHBondContact O-OG1 2.93Å
4	L	65.8	Low	66.1	Low	123 Å²	123	113.4 Å²	113.4	64%	0.644	61%	0.605	S	S	*	*	H	α-helix	trans	-58.8	-51.1	178.9	-102.9	151.8	0	0	0	113.8	V6 T7 V8	L4-V6 VanDerWaalsContact C-N 3.33Å; L4-V6 PolarHBondContact O-N 2.91Å; L4-T7 WeakPolarHBondContact CA-OG1 3.26Å; L4-T7 PolarHBondContact O-N 3.44Å; L4-T7 PolarHBondContact O-OG1 3.07Å; L4-V8 VanDerWaalsContact O-CG2 3.31Å; L4-V8 WeakPolarHBondContact O-CG2 3.23Å; L4-V8 PolarHBondContact O-N 2.92Å
5	P	69.1	Low	65.6	Low	72 Å²	72	111.1 Å²	111.1	47%	0.468	60%	0.597	S	S	.	*	H	α-helix	trans	-65.3	-36.9	-179	24.5	-34.1	0	0	0	112.3	E2 V8 V9	E2-P5 WeakPolarHBondContact O-CD 3.07Å; E2-P5 WeakPolarHBondContact O-CG 3.46Å; P5-V8 PolarHBondContact O-N 3.4Å; P5-V9 VanDerWaalsContact O-CG2 3.3Å; P5-V9 WeakPolarHBondContact O-CG2 3.32Å; P5-V9 PolarHBondContact O-N 3.28Å
6	V	73.5	Confident	65	Low	94 Å²	94	113.8 Å²	113.8	57%	0.57	61%	0.605	S	S	*	*	H	α-helix	trans	-66.7	-42.4	178.7	-177.7	0	0	0	0	110.9	L3 L4 V9 L10	L3-V6 PolarHBondContact O-N 3.47Å; L4-V6 VanDerWaalsContact C-N 3.33Å; L4-V6 PolarHBondContact O-N 2.91Å; V6-V9 PolarHBondContact O-N 3.05Å; V6-L10 WeakPolarHBondContact O-CB 3.47Å; V6-L10 PolarHBondContact O-N 3.37Å
7	T	72.9	Confident	64.3	Low	72 Å²	72	112.4 Å²	112.4	44%	0.442	60%	0.602	S	S	.	*	H	α-helix	trans	-66.1	-36.6	176.4	48.3	0	0	0	0	113.1	L3 L4 L10 L11	L3-T7 WeakPolarHBondContact O-CG2 3.37Å; L3-T7 PolarHBondContact O-N 3.34Å; L3-T7 PolarHBondContact O-OG1 2.93Å; L4-T7 WeakPolarHBondContact CA-OG1 3.26Å; L4-T7 PolarHBondContact O-N 3.44Å; L4-T7 PolarHBondContact O-OG1 3.07Å; T7-L10 PolarHBondContact O-N 3Å; T7-L11 WeakPolarHBondContact O-CB 3.44Å; T7-L11 VanDerWaalsContact O-CG 3.27Å; T7-L11 WeakPolarHBondContact O-CG 3.37Å; T7-L11 PolarHBondContact O-N 3.37Å
8	V	74.3	Confident	63.7	Low	67 Å²	67	111.2 Å²	111.2	41%	0.406	60%	0.599	S	S	.	*	H	α-helix	trans	-68.7	-44.2	177.9	172.7	0	0	0	0	110.6	L4 P5 L10 L11 F12	L4-V8 VanDerWaalsContact O-CG2 3.31Å; L4-V8 WeakPolarHBondContact O-CG2 3.23Å; L4-V8 PolarHBondContact O-N 2.92Å; P5-V8 PolarHBondContact O-N 3.4Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.92Å; V8-L11 PolarHBondContact O-N 3.03Å; V8-F12 HydrophobicContact CG1-CD2 3.89Å; V8-F12 HydrophobicContact CG1-CE2 3.97Å; V8-F12 WeakPolarHBondContact O-CD2 3.27Å; V8-F12 PolarHBondContact O-N 2.83Å
9	V	72.1	Confident	63.1	Low	94 Å²	94	115.6 Å²	115.6	57%	0.57	61%	0.608	S	S	*	*	H	α-helix	trans	-62.6	-41.6	176.2	173.1	0	0	0	0	111.1	P5 V6 L11 F12 V13	P5-V9 VanDerWaalsContact O-CG2 3.3Å; P5-V9 WeakPolarHBondContact O-CG2 3.32Å; P5-V9 PolarHBondContact O-N 3.28Å; V6-V9 PolarHBondContact O-N 3.05Å; V9-L11 VanDerWaalsContact C-N 3.34Å; V9-L11 PolarHBondContact O-N 3.27Å; V9-F12 PolarHBondContact O-N 3.46Å; V9-V13 WeakPolarHBondContact O-CG2 3.33Å; V9-V13 PolarHBondContact O-N 3.38Å
10	L	67.8	Low	62.6	Low	109 Å²	109	114.2 Å²	114.2	57%	0.571	61%	0.608	S	S	*	*	H	α-helix	trans	-64.1	-38.8	177.2	-153.5	105.1	0	0	0	112	V6 T7 V8 V13 L14	V6-L10 WeakPolarHBondContact O-CB 3.47Å; V6-L10 PolarHBondContact O-N 3.37Å; T7-L10 PolarHBondContact O-N 3Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.92Å; L10-V13 PolarHBondContact O-N 3.49Å; L10-L14 HydrophobicContact CD2-CD1 3.99Å; L10-L14 HydrophobicContact CG-CD1 4.45Å; L10-L14 WeakPolarHBondContact O-CB 3.44Å; L10-L14 VanDerWaalsContact O-CG 3.22Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 3.38Å
11	L	65.5	Low	62.1	Low	110 Å²	110	118.8 Å²	118.8	58%	0.576	62%	0.617	S	S	*	*	H	α-helix	trans	-66.8	-39.8	175.3	-74.9	167	0	0	0	112.3	T7 V8 V9 L14 V15	T7-L11 WeakPolarHBondContact O-CB 3.44Å; T7-L11 VanDerWaalsContact O-CG 3.27Å; T7-L11 WeakPolarHBondContact O-CG 3.37Å; T7-L11 PolarHBondContact O-N 3.37Å; V8-L11 PolarHBondContact O-N 3.03Å; V9-L11 VanDerWaalsContact C-N 3.34Å; V9-L11 PolarHBondContact O-N 3.27Å; L11-L14 PolarHBondContact O-N 2.84Å; L11-V15 VanDerWaalsContact O-CG2 3.25Å; L11-V15 WeakPolarHBondContact O-CG2 3.39Å; L11-V15 PolarHBondContact O-N 3.36Å
12	F	62.7	Low	62.1	Low	136 Å²	136	112.9 Å²	112.9	60%	0.596	59%	0.59	S	S	*	*	H	α-helix	trans	-63.5	-42.1	174.6	-93.5	-86.9	0	0	0	112.2	V8 V9 L14 V15 E16	V8-F12 HydrophobicContact CG1-CD2 3.89Å; V8-F12 HydrophobicContact CG1-CE2 3.97Å; V8-F12 WeakPolarHBondContact O-CD2 3.27Å; V8-F12 PolarHBondContact O-N 2.83Å; V9-F12 PolarHBondContact O-N 3.46Å; F12-L14 VanDerWaalsContact C-N 3.34Å; F12-L14 PolarHBondContact O-N 2.95Å; F12-V15 PolarHBondContact O-N 3.24Å; F12-E16 PolarHBondContact O-N 2.86Å; F12-E16 VanDerWaalsContact O-N 3.07Å
13	V	63.1	Low	62.6	Low	87 Å²	87	112.9 Å²	112.9	53%	0.527	59%	0.59	S	S	.	*	H	α-helix	trans	-66.3	-35.7	176.2	175.2	0	0	0	0	111.9	V9 L10 T17	V9-V13 WeakPolarHBondContact O-CG2 3.33Å; V9-V13 PolarHBondContact O-N 3.38Å; L10-V13 PolarHBondContact O-N 3.49Å; V13-T17 WeakPolarHBondContact O-CG2 3.42Å; V13-T17 PolarHBondContact O-N 2.84Å; V13-T17 PolarHBondContact O-OG1 3.44Å; V13-T17 VanDerWaalsContact O-OG1 3.12Å
14	L	60.4	Low	63.8	Low	97 Å²	97	110.3 Å²	110.3	51%	0.508	58%	0.577	S	S	.	*	H	α-helix	trans	-72.7	-29.7	175.4	-71.1	169.4	0	0	0	112.8	L10 L11 F12 T17 T18	L10-L14 HydrophobicContact CD2-CD1 3.99Å; L10-L14 HydrophobicContact CG-CD1 4.45Å; L10-L14 WeakPolarHBondContact O-CB 3.44Å; L10-L14 VanDerWaalsContact O-CG 3.22Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 3.38Å; L11-L14 PolarHBondContact O-N 2.84Å; F12-L14 VanDerWaalsContact C-N 3.34Å; F12-L14 PolarHBondContact O-N 2.95Å; L14-T17 PolarHBondContact O-OG1 3.42Å; L14-T17 VanDerWaalsContact O-OG1 3.08Å; L14-T18 WeakPolarHBondContact O-CG2 3.32Å
15	V	59	Low	65	Low	80 Å²	80	105.9 Å²	105.9	49%	0.485	56%	0.556	S	S	.	*	H	α-helix	trans	-73.4	-41.4	175.1	171.8	0	0	0	0	111.1	L11 F12 T17 T18 Y19	L11-V15 VanDerWaalsContact O-CG2 3.25Å; L11-V15 WeakPolarHBondContact O-CG2 3.39Å; L11-V15 PolarHBondContact O-N 3.36Å; F12-V15 PolarHBondContact O-N 3.24Å; V15-T17 VanDerWaalsContact C-N 3.32Å; V15-T17 PolarHBondContact O-N 3.13Å; V15-T18 PolarHBondContact O-N 2.92Å; V15-T18 PolarHBondContact O-OG1 3.35Å; V15-Y19 HydrophobicContact CG1-CE2 4.23Å
16	E	55.3	Low	66.2	Low	153 Å²	153	104.9 Å²	104.9	72%	0.715	55%	0.549	S	S	*	.	H	α-helix	trans	-66.2	-30.2	178.8	-72.4	-167.8	175.8	0	0	113.8	F12 T18	F12-E16 PolarHBondContact O-N 2.86Å; F12-E16 VanDerWaalsContact O-N 3.07Å; E16-T18 PolarHBondContact O-N 2.91Å
17	T	53.4	Low	67.1	Low	91 Å²	91	102.3 Å²	102.3	56%	0.558	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-8.8	178.6	48.2	0	0	0	0	113.9	V13 L14 V15	V13-T17 WeakPolarHBondContact O-CG2 3.42Å; V13-T17 PolarHBondContact O-N 2.84Å; V13-T17 PolarHBondContact O-OG1 3.44Å; V13-T17 VanDerWaalsContact O-OG1 3.12Å; L14-T17 PolarHBondContact O-OG1 3.42Å; L14-T17 VanDerWaalsContact O-OG1 3.08Å; V15-T17 VanDerWaalsContact C-N 3.32Å; V15-T17 PolarHBondContact O-N 3.13Å
18	T	52.9	Low	67.9	Low	91 Å²	91	99.5 Å²	99.5	56%	0.558	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-7.1	-179.9	61.6	0	0	0	0	115.1	L14 V15 E16 S20	L14-T18 WeakPolarHBondContact O-CG2 3.32Å; V15-T18 PolarHBondContact O-N 2.92Å; V15-T18 PolarHBondContact O-OG1 3.35Å; E16-T18 PolarHBondContact O-N 2.91Å; T18-S20 PolarHBondContact O-N 2.85Å
19	Y	52.3	Low	68.7	Low	195 Å²	195	103.1 Å²	103.1	77%	0.765	52%	0.52	S	S	*	.	S	Bend	trans	-89.3	11.3	-178.4	-84	-80.8	0	0	0	115.4	V15	V15-Y19 HydrophobicContact CG1-CE2 4.23Å
20	S	54.4	Low	69.7	Low	87 Å²	87	104 Å²	104	61%	0.608	52%	0.521	S	S	*	.			trans	-111	44.3	-177.8	-172.2	0	0	0	0	113.6	T18	T18-S20 PolarHBondContact O-N 2.85Å
21	W	51.3	Low	71	Confident	210 Å²	210	99.9 Å²	99.9	80%	0.795	50%	0.5	S	S	*	.	S	Bend	trans	-125.9	104.6	177.9	-62.5	82	0	0	0	109.3
22	N	58.7	Low	72.4	Confident	97 Å²	97	102.4 Å²	102.4	52%	0.519	51%	0.509	S	S	.	.			trans	90.5	58.5	179.5	-57.1	-41.7	0	0	0	117.7	Y106	N22-Y106 WeakPolarHBondContact OD1-CE1 3.23Å; N22-Y106 PolarHBondContact OD1-OH 2.98Å
23	Q	68.9	Low	73.9	Confident	160 Å²	160	98.1 Å²	98.1	75%	0.748	50%	0.499	S	S	*	.	S	Bend	trans	-76	-10.3	162.1	-70.3	-161.2	-13.4	0	0	113.8
24	D	86.8	Confident	75.5	Confident	92 Å²	92	95.2 Å²	95.2	49%	0.492	48%	0.48	S	S	.	.	S	Bend	trans	-100.5	-3.2	-171.8	-58.5	-29.7	0	0	0	113.7	Y106 L115 K116	D24-Y106 HydrophobicContact CB-CE2 4.24Å; D24-L115 HydrophobicContact CB-CD1 4.05Å; D24-K116 WeakPolarHBondContact O-CB 3.28Å; D24-K116 PolarHBondContact O-N 3.06Å
25	S	91.3	Very high	77.3	Confident	30 Å²	30	93.2 Å²	93.2	21%	0.21	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	134.6	176.5	62.2	0	0	0	0	111.4	I114	S25-I114 WeakPolarHBondContact CA-O 3.1Å
26	V	93.1	Very high	79.1	Confident	50 Å²	50	89.6 Å²	89.6	30%	0.303	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.4	177	-178.5	0	0	0	0	109.3	L28 I31 Y113 I114 K116	V26-L28 PolarHBondContact O-N 3.17Å; V26-I31 HydrophobicContact CG1-CD1 4.29Å; V26-I31 HydrophobicContact CG1-CG1 3.86Å; V26-Y113 WeakPolarHBondContact O-CA 3.46Å; V26-I114 PolarHBondContact N-O 3.5Å; V26-I114 WeakPolarHBondContact O-CG1 3.35Å; V26-I114 PolarHBondContact O-N 2.79Å; V26-K116 HydrophobicContact CG2-CB 4.23Å
27	L	92.3	Very high	81	Confident	41 Å²	41	86.6 Å²	86.6	22%	0.215	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	123.8	173	-174.9	67.8	0	0	0	109.1	R29 D30 D112 Y113	L27-R29 HydrophobicContact CD2-CB 4.37Å; L27-R29 HydrophobicContact CG-CB 4.3Å; L27-R29 PolarHBondContact O-N 3.13Å; L27-R29 VanDerWaalsContact O-N 3.16Å; L27-D30 HydrophobicContact CB-CB 4.36Å; L27-D30 PolarHBondContact O-N 3.29Å; L27-D112 HydrophobicContact CD1-CB 3.65Å; L27-Y113 HydrophobicContact CB-CD1 4.23Å; L27-Y113 HydrophobicContact CB-CE1 3.96Å; L27-Y113 HydrophobicContact CD1-CD2 4.21Å; L27-Y113 HydrophobicContact CD1-CE1 4.33Å; L27-Y113 HydrophobicContact CD1-CE2 4Å; L27-Y113 HydrophobicContact CD1-CG 4.47Å
28	L	91.3	Very high	83	Confident	13 Å²	13	86.1 Å²	86.1	7%	0.068	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-55.3	-38.3	-175.3	179.9	59.8	0	0	0	112.5	V26 D30 I31 V82 W84 D112 I114 V317	V26-L28 PolarHBondContact O-N 3.17Å; L28-D30 VanDerWaalsContact C-N 3.33Å; L28-D30 PolarHBondContact O-N 3.4Å; L28-I31 HydrophobicContact CD1-CD1 4.09Å; L28-I31 WeakPolarHBondContact O-CB 3.38Å; L28-I31 WeakPolarHBondContact O-CG1 3.23Å; L28-I31 PolarHBondContact O-N 3.04Å; L28-V82 HydrophobicContact CG-CG2 4.11Å; L28-W84 HydrophobicContact CD1-CZ2 4.22Å; L28-D112 WeakPolarHBondContact CB-O 3.36Å; L28-D112 PolarHBondContact N-O 3.46Å; L28-I114 HydrophobicContact CB-CG2 4.24Å; L28-I114 HydrophobicContact CD1-CD1 4.16Å; L28-I114 HydrophobicContact CD1-CG2 4.46Å; L28-V317 HydrophobicContact CD2-CG1 4.39Å; L28-V317 HydrophobicContact CD2-CG2 4.05Å
29	R	91.1	Very high	85	Confident	143 Å²	143	88.6 Å²	88.6	54%	0.54	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-65	-30.7	179.2	-176.7	177.3	174.8	-172.8	-0.9	114.1	L27 I31 N74 V82	L27-R29 HydrophobicContact CD2-CB 4.37Å; L27-R29 HydrophobicContact CG-CB 4.3Å; L27-R29 PolarHBondContact O-N 3.13Å; L27-R29 VanDerWaalsContact O-N 3.16Å; R29-I31 PolarHBondContact O-N 2.7Å; R29-N74 PolarHBondContact O-ND2 3.43Å; R29-V82 HydrophobicContact CB-CG2 4.45Å
30	D	93	Very high	87	Confident	111 Å²	111	86.2 Å²	86.2	59%	0.594	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-82.1	-6.4	-176.4	-71	-9.7	0	0	0	112.5	L27 L28 Q32	L27-D30 HydrophobicContact CB-CB 4.36Å; L27-D30 PolarHBondContact O-N 3.29Å; L28-D30 VanDerWaalsContact C-N 3.33Å; L28-D30 PolarHBondContact O-N 3.4Å; D30-Q32 PolarHBondContact O-N 3.5Å
31	I	93.4	Very high	89	Confident	23 Å²	23	88.1 Å²	88.1	12%	0.118	42%	0.417	C	S	.	.			trans	-73.6	119	178	-55.6	178.2	0	0	0	108.9	V26 L28 R29 L34 N74 W84 I114	V26-I31 HydrophobicContact CG1-CD1 4.29Å; V26-I31 HydrophobicContact CG1-CG1 3.86Å; L28-I31 HydrophobicContact CD1-CD1 4.09Å; L28-I31 WeakPolarHBondContact O-CB 3.38Å; L28-I31 WeakPolarHBondContact O-CG1 3.23Å; L28-I31 PolarHBondContact O-N 3.04Å; R29-I31 PolarHBondContact O-N 2.7Å; I31-L34 HydrophobicContact CG2-CD2 3.74Å; I31-L34 HydrophobicContact CG2-CG 3.92Å; I31-N74 WeakPolarHBondContact O-CB 3.21Å; I31-N74 PolarHBondContact O-ND2 3.26Å; I31-W84 HydrophobicContact CB-CH2 3.95Å; I31-W84 HydrophobicContact CG2-CH2 3.71Å; I31-W84 HydrophobicContact CG2-CZ3 4.44Å; I31-I114 HydrophobicContact CD1-CD1 3.6Å; I31-I114 HydrophobicContact CD1-CG1 4.23Å
32	Q	94.9	Very high	91.2	Very high	164 Å²	164	78.5 Å²	78.5	77%	0.766	38%	0.382	S	S	*	.			trans	-81.1	-40.3	-179.4	-62.4	175	19.7	0	0	112	D30 N74	D30-Q32 PolarHBondContact O-N 3.5Å; Q32-N74 WeakPolarHBondContact O-CB 3.32Å; Q32-N74 PolarHBondContact O-N 3.35Å
33	A	96	Very high	92.8	Very high	46 Å²	46	77 Å²	77	38%	0.38	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	149.6	-179.4	0	0	0	0	0	111.6	C72	A33-C72 CarbonylContact C-O 3.6Å; A33-C72 VanDerWaalsContact CA-O 3.23Å; A33-C72 WeakPolarHBondContact CA-O 3.47Å
34	L	96.1	Very high	93.9	Very high	25 Å²	25	71 Å²	71	13%	0.131	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.4	172.6	-65.9	170.8	0	0	0	108.5	I31 F36 Q71 C72 W84 V101 C119	I31-L34 HydrophobicContact CG2-CD2 3.74Å; I31-L34 HydrophobicContact CG2-CG 3.92Å; L34-F36 HydrophobicContact CB-CE1 4.41Å; L34-F36 HydrophobicContact CB-CE2 3.67Å; L34-F36 HydrophobicContact CB-CZ 3.63Å; L34-F36 HydrophobicContact CD1-CE2 4.46Å; L34-F36 HydrophobicContact CD1-CZ 3.82Å; L34-F36 HydrophobicContact CG-CZ 4.3Å; L34-Q71 WeakPolarHBondContact O-CA 3.35Å; L34-C72 HydrophobicContact CB-CB 4.46Å; L34-C72 PolarHBondContact N-O 3.08Å; L34-C72 PolarHBondContact O-N 2.84Å; L34-W84 HydrophobicContact CB-CZ3 4.46Å; L34-W84 HydrophobicContact CD1-CD2 4.41Å; L34-W84 HydrophobicContact CD1-CE3 4.28Å; L34-W84 HydrophobicContact CD1-CH2 3.53Å; L34-W84 HydrophobicContact CD1-CZ2 3.65Å; L34-W84 HydrophobicContact CD1-CZ3 3.86Å; L34-W84 HydrophobicContact CG-CH2 3.75Å; L34-W84 HydrophobicContact CG-CZ2 4.38Å; L34-W84 HydrophobicContact CG-CZ3 3.88Å; L34-V101 HydrophobicContact CD1-CG1 3.78Å; L34-C119 HydrophobicContact CD1-CB 4.15Å; L34-C119 HydrophobicContact CD2-CB 4.29Å
35	T	97.1	Very high	93.9	Very high	55 Å²	55	74 Å²	74	34%	0.337	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.9	175.3	-53.8	0	0	0	0	108.6	Y37 V69 V70	T35-Y37 HydrophobicContact CG2-CD2 4.46Å; T35-Y37 HydrophobicContact CG2-CE1 4.4Å; T35-Y37 HydrophobicContact CG2-CE2 3.71Å; T35-V69 HydrophobicContact CG2-CG1 3.57Å; T35-V70 WeakPolarHBondContact CA-O 3.17Å
36	F	97.1	Very high	93.6	Very high	4 Å²	4	79.6 Å²	79.6	2%	0.018	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135	-177.3	-55.4	-79	0	0	0	109.3	L34 Q52 L53 V69 V70 C72 V101 C119 L121	L34-F36 HydrophobicContact CB-CE1 4.41Å; L34-F36 HydrophobicContact CB-CE2 3.67Å; L34-F36 HydrophobicContact CB-CZ 3.63Å; L34-F36 HydrophobicContact CD1-CE2 4.46Å; L34-F36 HydrophobicContact CD1-CZ 3.82Å; L34-F36 HydrophobicContact CG-CZ 4.3Å; F36-Q52 HydrophobicContact CB-CB 4.37Å; F36-Q52 HydrophobicContact CD1-CB 4.28Å; F36-Q52 WeakPolarHBondContact CD1-O 3.33Å; F36-L53 HydrophobicContact CB-CD1 4.43Å; F36-L53 HydrophobicContact CB-CD2 3.39Å; F36-L53 HydrophobicContact CB-CG 3.66Å; F36-L53 HydrophobicContact CG-CD2 4.24Å; F36-V69 WeakPolarHBondContact O-CA 3.13Å; F36-V70 PolarHBondContact N-O 3.38Å; F36-V70 PolarHBondContact O-N 2.75Å; F36-C72 HydrophobicContact CE2-CB 4.08Å; F36-C72 VanDerWaalsContact CE2-SG 3.53Å; F36-V101 HydrophobicContact CE2-CG2 4.39Å; F36-V101 HydrophobicContact CZ-CG1 4.05Å; F36-V101 HydrophobicContact CZ-CG2 4.31Å; F36-C119 HydrophobicContact CE1-CB 3.94Å; F36-C119 WeakPolarHBondContact CE1-O 3.07Å; F36-C119 HydrophobicContact CZ-CB 4.33Å; F36-L121 HydrophobicContact CD1-CB 4.15Å; F36-L121 HydrophobicContact CD2-CB 3.74Å; F36-L121 HydrophobicContact CD2-CD2 4.05Å; F36-L121 HydrophobicContact CD2-CG 4.47Å; F36-L121 HydrophobicContact CE1-CB 4.24Å; F36-L121 HydrophobicContact CE2-CB 3.84Å; F36-L121 HydrophobicContact CE2-CD2 4.47Å; F36-L121 HydrophobicContact CG-CB 3.89Å; F36-L121 HydrophobicContact CZ-CB 4.08Å
37	Y	96.8	Very high	93.2	Very high	90 Å²	90	80.2 Å²	80.2	35%	0.353	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.2	-179.1	-63.5	-93	0	0	0	110.6	T35 R40 D68 V69	T35-Y37 HydrophobicContact CG2-CD2 4.46Å; T35-Y37 HydrophobicContact CG2-CE1 4.4Å; T35-Y37 HydrophobicContact CG2-CE2 3.71Å; Y37-R40 PolarHBondContact O-N 3.45Å; Y37-D68 WeakPolarHBondContact CA-O 3.29Å; Y37-V69 HydrophobicContact CD1-CG1 4.46Å; Y37-V69 HydrophobicContact CD1-CG2 3.73Å; Y37-V69 HydrophobicContact CE1-CG1 4.23Å; Y37-V69 HydrophobicContact CE1-CG2 3.88Å
38	R	94.8	Very high	93.1	Very high	82 Å²	82	84.9 Å²	84.9	31%	0.309	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	145.2	170.9	-170.9	-164.2	-98.3	177.9	-24.9	109.2	R40 L53 I66 D68	R38-R40 PolarHBondContact O-N 3.05Å; R38-R40 VanDerWaalsContact O-N 3.12Å; R38-L53 HydrophobicContact CB-CD1 4.32Å; R38-I66 HydrophobicContact CG-CG2 4.42Å; R38-I66 PolarHBondContact NE-O 3.36Å; R38-I66 VanDerWaalsContact NH2-CB 3.25Å; R38-I66 PolarHBondContact NH2-O 3.49Å; R38-D68 WeakPolarHBondContact CD-OD1 3.36Å; R38-D68 IonicContact CZ-OD1 3.44Å; R38-D68 PolarHBondContact N-O 2.75Å; R38-D68 IonicContact NE-OD1 3.61Å; R38-D68 IonicContact NH1-OD1 2.7Å; R38-D68 PolarHBondContact NH1-OD1 2.92Å
39	N	93.6	Very high	93.2	Very high	143 Å²	143	87.7 Å²	87.7	77%	0.765	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	16.8	179.2	-52.1	-37.4	0	0	0	114.5
40	R	96.3	Very high	93.4	Very high	145 Å²	145	84.4 Å²	84.4	55%	0.547	42%	0.421	S	S	.	.			trans	-105.1	151.7	167	-64.6	-159.8	-172.7	-155.1	-1.5	110.4	Y37 R38 Q52	Y37-R40 PolarHBondContact O-N 3.45Å; R38-R40 PolarHBondContact O-N 3.05Å; R38-R40 VanDerWaalsContact O-N 3.12Å; R40-Q52 HydrophobicContact CB-CG 4.2Å; R40-Q52 PolarHBondContact O-N 3.37Å
41	F	96.2	Very high	93.5	Very high	127 Å²	127	81.9 Å²	81.9	56%	0.557	41%	0.41	S	S	*	.	B	Isolated β-bridge	trans	-107.9	152	177.3	-70.2	-96.8	0	0	0	110.4	P49 V50 P51 Q52	F41-P49 HydrophobicContact CB-CB 4.16Å; F41-P49 HydrophobicContact CD1-CB 4.46Å; F41-V50 CarbonylContact C-O 3.47Å; F41-V50 VanDerWaalsContact CA-O 3.23Å; F41-V50 WeakPolarHBondContact CA-O 3.01Å; F41-P51 HydrophobicContact CD1-CG 4.48Å; F41-P51 HydrophobicContact CE1-CG 4.04Å; F41-Q52 PolarHBondContact O-NE2 2.98Å
42	T	96.1	Very high	93.7	Very high	7 Å²	7	82.2 Å²	82.2	4%	0.043	41%	0.411	C	S	.	.			trans	-70.4	152.1	172.5	62	0	0	0	0	110	P49 V50 Q52 G117 S118 C119	T42-P49 WeakPolarHBondContact O-CB 3.43Å; T42-V50 HydrophobicContact CG2-CG2 3.85Å; T42-V50 PolarHBondContact N-O 2.74Å; T42-V50 WeakPolarHBondContact OG1-CG2 3.47Å; T42-V50 PolarHBondContact OG1-N 3.39Å; T42-V50 VanDerWaalsContact OG1-N 3.11Å; T42-V50 PolarHBondContact OG1-O 2.98Å; T42-Q52 HydrophobicContact CG2-CG 4.02Å; T42-G117 WeakPolarHBondContact CA-O 3.19Å; T42-S118 WeakPolarHBondContact CB-O 3.49Å; T42-S118 WeakPolarHBondContact CG2-O 3.23Å; T42-C119 VanDerWaalsContact CG2-O 3.29Å; T42-C119 WeakPolarHBondContact CG2-O 3.36Å
43	T	93.6	Very high	93.7	Very high	67 Å²	67	75.1 Å²	75.1	41%	0.411	38%	0.379	S	S	.	.			trans	-72.6	138.2	164.7	58.4	0	0	0	0	108.5	K116 G117 S118	T43-K116 PolarHBondContact OG1-O 3.13Å; T43-G117 PolarHBondContact N-O 3Å; T43-G117 WeakPolarHBondContact OG1-CA 3.36Å; T43-G117 PolarHBondContact OG1-O 3.43Å; T43-G117 VanDerWaalsContact OG1-O 3.13Å; T43-S118 VanDerWaalsContact O-CA 3.25Å; T43-S118 WeakPolarHBondContact O-CA 3.48Å; T43-S118 VanDerWaalsContact O-CB 3.23Å; T43-S118 WeakPolarHBondContact O-CB 3.42Å; T43-S118 PolarHBondContact OG1-N 3.02Å; T43-S118 VanDerWaalsContact OG1-N 3.13Å
44	A	90.8	Very high	93.7	Very high	32 Å²	32	77.5 Å²	77.5	26%	0.264	38%	0.381	S	S	.	.			trans	-133.6	144.2	176.2	0	0	0	0	0	109.8	S47 P49 E104	A44-S47 WeakPolarHBondContact CB-O 3.06Å; A44-S47 WeakPolarHBondContact CB-OG 3.35Å; A44-P49 HydrophobicContact CB-CG 4.02Å; A44-E104 WeakPolarHBondContact CA-OE2 3.42Å
45	R	86.7	Confident	93.7	Very high	155 Å²	155	77.4 Å²	77.4	59%	0.585	38%	0.382	S	S	*	.	S	Bend	trans	-110.4	-43.9	177	-178	178.5	175.4	-173.7	1	111.3	E104 L115	R45-E104 PolarHBondContact N-OE1 3.06Å; R45-E104 PolarHBondContact N-OE2 2.88Å; R45-L115 HydrophobicContact CB-CD2 3.79Å
46	R	84.6	Confident	93.6	Very high	149 Å²	149	78.4 Å²	78.4	56%	0.562	39%	0.387	S	S	*	.	S	Bend	trans	-113.6	-27.4	-178.5	-53.9	178.5	-163.3	-162.4	3.2	112.4	E104 Y106 S107	R46-E104 PolarHBondContact N-OE1 3.13Å; R46-Y106 PolarHBondContact NH2-O 2.98Å; R46-S107 PolarHBondContact NH1-O 3.28Å; R46-S107 VanDerWaalsContact NH2-C 3.33Å; R46-S107 PolarHBondContact NH2-O 2.9Å
47	S	85.3	Confident	93.5	Very high	63 Å²	63	79.2 Å²	79.2	44%	0.441	40%	0.397	S	S	.	.	S	Bend	trans	-91.7	176.4	176.2	76.4	0	0	0	0	111.1	A44 E104	A44-S47 WeakPolarHBondContact CB-O 3.06Å; A44-S47 WeakPolarHBondContact CB-OG 3.35Å; S47-E104 PolarHBondContact OG-OE2 2.91Å
48	N	90.9	Very high	93.4	Very high	138 Å²	138	76.5 Å²	76.5	74%	0.738	40%	0.397	S	S	*	.			trans	-86.6	140.3	169.5	-72.6	-50.8	0	0	0	109.4	V50	N48-V50 PolarHBondContact O-N 3.36Å
49	P	93.3	Very high	93.3	Very high	73 Å²	73	75.5 Å²	75.5	47%	0.474	40%	0.402	S	S	.	.			trans	-51.2	127.6	171.5	-29.3	37.2	0	0	0	112	F41 T42 A44	F41-P49 HydrophobicContact CB-CB 4.16Å; F41-P49 HydrophobicContact CD1-CB 4.46Å; T42-P49 WeakPolarHBondContact O-CB 3.43Å; A44-P49 HydrophobicContact CB-CG 4.02Å
50	V	94.4	Very high	93.2	Very high	74 Å²	74	69.2 Å²	69.2	45%	0.448	37%	0.37	S	S	.	.			trans	-111.1	158.8	177.4	-64.6	0	0	0	0	110.6	F41 T42 N48 Q52	F41-V50 CarbonylContact C-O 3.47Å; F41-V50 VanDerWaalsContact CA-O 3.23Å; F41-V50 WeakPolarHBondContact CA-O 3.01Å; T42-V50 HydrophobicContact CG2-CG2 3.85Å; T42-V50 PolarHBondContact N-O 2.74Å; T42-V50 WeakPolarHBondContact OG1-CG2 3.47Å; T42-V50 PolarHBondContact OG1-N 3.39Å; T42-V50 VanDerWaalsContact OG1-N 3.11Å; T42-V50 PolarHBondContact OG1-O 2.98Å; N48-V50 PolarHBondContact O-N 3.36Å; V50-Q52 PolarHBondContact O-N 3.22Å
51	P	96.2	Very high	92.9	Very high	57 Å²	57	63 Å²	63	37%	0.37	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-59	137.4	173.6	-24	34.7	0	0	0	111.8	F41 L53	F41-P51 HydrophobicContact CD1-CG 4.48Å; F41-P51 HydrophobicContact CE1-CG 4.04Å; P51-L53 VanDerWaalsContact C-N 3.29Å; P51-L53 PolarHBondContact O-N 3.09Å
52	Q	96.6	Very high	92.8	Very high	30 Å²	30	58.8 Å²	58.8	14%	0.14	34%	0.337	C	S	.	.	S	Bend	trans	-66.8	-30.7	176.2	-73.3	-173.5	-6.3	0	0	112.8	F36 R40 F41 T42 V50 L121	F36-Q52 HydrophobicContact CB-CB 4.37Å; F36-Q52 HydrophobicContact CD1-CB 4.28Å; F36-Q52 WeakPolarHBondContact CD1-O 3.33Å; R40-Q52 HydrophobicContact CB-CG 4.2Å; R40-Q52 PolarHBondContact O-N 3.37Å; F41-Q52 PolarHBondContact O-NE2 2.98Å; T42-Q52 HydrophobicContact CG2-CG 4.02Å; V50-Q52 PolarHBondContact O-N 3.22Å; Q52-L121 PolarHBondContact O-N 2.82Å
53	L	95.8	Very high	92.4	Very high	16 Å²	16	66.7 Å²	66.7	8%	0.084	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.2	175.2	-74.8	-177.2	0	0	0	109.4	F36 R38 P51 V70 L121	F36-L53 HydrophobicContact CB-CD1 4.43Å; F36-L53 HydrophobicContact CB-CD2 3.39Å; F36-L53 HydrophobicContact CB-CG 3.66Å; F36-L53 HydrophobicContact CG-CD2 4.24Å; R38-L53 HydrophobicContact CB-CD1 4.32Å; P51-L53 VanDerWaalsContact C-N 3.29Å; P51-L53 PolarHBondContact O-N 3.09Å; L53-V70 HydrophobicContact CD1-CG2 4.01Å; L53-V70 HydrophobicContact CD2-CB 4Å; L53-V70 HydrophobicContact CD2-CG2 3.71Å; L53-L121 HydrophobicContact CD2-CB 4.08Å; L53-L121 HydrophobicContact CD2-CD2 3.75Å; L53-L121 HydrophobicContact CD2-CG 4.33Å
54	K	95.6	Very high	92.2	Very high	96 Å²	96	66.7 Å²	66.7	42%	0.417	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	117.6	179	-175.9	174.2	162.7	-151.1	0	111.3	V56 L121 E122 F123	K54-V56 HydrophobicContact CD-CG1 4.5Å; K54-V56 HydrophobicContact CG-CG1 4.16Å; K54-L121 PolarHBondContact N-O 2.88Å; K54-E122 HydrophobicContact CB-CG 4.35Å; K54-E122 HydrophobicContact CD-CG 4.49Å; K54-E122 WeakPolarHBondContact CD-OE1 3.39Å; K54-E122 WeakPolarHBondContact CE-OE1 3.31Å; K54-E122 IonicContact NZ-OE1 2.73Å; K54-E122 PolarHBondContact NZ-OE1 2.93Å; K54-E122 CarbonylContact O-C 3.59Å; K54-E122 VanDerWaalsContact O-CA 3.31Å; K54-E122 WeakPolarHBondContact O-CA 3.43Å; K54-F123 PolarHBondContact O-N 2.99Å
55	C	95.8	Very high	92.1	Very high	22 Å²	22	68.3 Å²	68.3	15%	0.149	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124	170.4	-178.5	0	0	0	0	109.5	C62 I66 F123	C55-C62 HydrophobicContact CB-CB 3.59Å; C55-C62 WeakPolarHBondContact CB-SG 3.45Å; C55-C62 PolarHBondContact O-SG 2.77Å; C55-C62 VanDerWaalsContact O-SG 3.39Å; C55-C62 WeakPolarHBondContact SG-CA 3.36Å; C55-C62 WeakPolarHBondContact SG-CB 3.15Å; C55-C62 CovalentContact SG-SG 2.03Å; C55-C62 PolarHBondContact SG-SG 3.09Å; C55-I66 HydrophobicContact CB-CD1 4.26Å; C55-I66 HydrophobicContact CB-CG1 4.18Å; C55-F123 CarbonylContact C-O 3.57Å; C55-F123 WeakPolarHBondContact CA-O 3.27Å; C55-F123 HydrophobicContact CB-CE1 4.21Å; C55-F123 HydrophobicContact CB-CE2 3.92Å; C55-F123 HydrophobicContact CB-CZ 3.69Å
56	V	95.6	Very high	92.4	Very high	76 Å²	76	63 Å²	63	46%	0.461	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-5.5	-176.4	-60.6	0	0	0	0	113.7	K54 E122 F123 T124	K54-V56 HydrophobicContact CD-CG1 4.5Å; K54-V56 HydrophobicContact CG-CG1 4.16Å; V56-E122 HydrophobicContact CG1-CB 4.03Å; V56-E122 HydrophobicContact CG1-CG 4.3Å; V56-F123 PolarHBondContact N-O 2.97Å; V56-T124 HydrophobicContact CG2-CG2 3.67Å
57	G	94.9	Very high	92.8	Very high	21 Å²	21	56 Å²	56	22%	0.216	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.1	-145.7	174.5	0	0	0	0	0	113.5	C62 T124 L125	G57-C62 PolarHBondContact N-SG 3.05Å; G57-C62 VanDerWaalsContact N-SG 3.36Å; G57-T124 CarbonylContact O-C 3.52Å; G57-T124 VanDerWaalsContact O-CA 3.31Å; G57-T124 WeakPolarHBondContact O-CA 3.01Å; G57-T124 WeakPolarHBondContact O-CB 3.25Å; G57-L125 PolarHBondContact O-N 2.78Å
58	G	94.1	Very high	93.3	Very high	34 Å²	34	57.8 Å²	57.8	35%	0.351	34%	0.336	S	S	.	.			trans	108.6	167.7	179.8	0	0	0	0	0	113.5	A60 G61 L125 E126	G58-A60 PolarHBondContact O-N 2.76Å; G58-G61 PolarHBondContact O-N 2.61Å; G58-G61 VanDerWaalsContact O-N 3.1Å; G58-L125 CarbonylContact C-O 3.59Å; G58-L125 VanDerWaalsContact CA-O 3.28Å; G58-L125 WeakPolarHBondContact CA-O 3.42Å; G58-E126 WeakPolarHBondContact CA-OE1 3.43Å
59	S	92.4	Very high	93.5	Very high	61 Å²	61	54.1 Å²	54.1	43%	0.427	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.9	-174.1	63.2	0	0	0	0	114.9	L125 E126 L127	S59-L125 PolarHBondContact N-O 2.66Å; S59-E126 WeakPolarHBondContact CB-OE2 3.48Å; S59-E126 PolarHBondContact N-OE1 2.94Å; S59-E126 PolarHBondContact N-OE2 2.82Å; S59-E126 PolarHBondContact OG-OE2 3.33Å; S59-L127 WeakPolarHBondContact O-CD1 3.36Å; S59-L127 PolarHBondContact OG-N 2.91Å
60	A	91.3	Very high	93.7	Very high	10 Å²	10	50.7 Å²	50.7	8%	0.083	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-28.6	175.1	0	0	0	0	0	112.6	G58 V64 Y94 L125 L127	G58-A60 PolarHBondContact O-N 2.76Å; A60-V64 WeakPolarHBondContact O-CG2 3.2Å; A60-Y94 HydrophobicContact CB-CD1 3.86Å; A60-Y94 HydrophobicContact CB-CE1 4.05Å; A60-L125 HydrophobicContact CB-CB 4.2Å; A60-L125 HydrophobicContact CB-CD2 3.84Å; A60-L125 HydrophobicContact CB-CG 3.84Å; A60-L125 WeakPolarHBondContact CB-O 3.48Å; A60-L125 PolarHBondContact N-O 3.44Å; A60-L127 HydrophobicContact CB-CD1 4.47Å; A60-L127 HydrophobicContact CB-CG 3.84Å
61	G	91.6	Very high	93.9	Very high	16 Å²	16	52 Å²	52	17%	0.165	30%	0.297	C	S	.	.			trans	75.6	148.3	-170.6	0	0	0	0	0	113.6	G58 H63	G58-G61 PolarHBondContact O-N 2.61Å; G58-G61 VanDerWaalsContact O-N 3.1Å; G61-H63 VanDerWaalsContact C-N 3.29Å; G61-H63 PolarHBondContact O-N 2.75Å
62	C	92.6	Very high	93.9	Very high	38 Å²	38	49.3 Å²	49.3	26%	0.257	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-10.8	-174.3	-61.2	0	0	0	0	115.1	C55 G57 I66	C55-C62 HydrophobicContact CB-CB 3.59Å; C55-C62 WeakPolarHBondContact CB-SG 3.45Å; C55-C62 PolarHBondContact O-SG 2.77Å; C55-C62 VanDerWaalsContact O-SG 3.39Å; C55-C62 WeakPolarHBondContact SG-CA 3.36Å; C55-C62 WeakPolarHBondContact SG-CB 3.15Å; C55-C62 CovalentContact SG-SG 2.03Å; C55-C62 PolarHBondContact SG-SG 3.09Å; G57-C62 PolarHBondContact N-SG 3.05Å; G57-C62 VanDerWaalsContact N-SG 3.36Å; C62-I66 WeakPolarHBondContact O-CD1 3.08Å; C62-I66 WeakPolarHBondContact O-CG1 3.33Å
63	H	89.5	Confident	93.9	Very high	172 Å²	172	50.5 Å²	50.5	80%	0.796	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-14.9	-178.5	62.2	-86.1	0	0	0	113	G61	G61-H63 VanDerWaalsContact C-N 3.29Å; G61-H63 PolarHBondContact O-N 2.75Å
64	V	89.1	Confident	93.8	Very high	67 Å²	67	51.6 Å²	51.6	41%	0.406	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-47.4	-173.2	-177.5	0	0	0	0	111.1	A60 Y94	A60-V64 WeakPolarHBondContact O-CG2 3.2Å; V64-Y94 HydrophobicContact CG1-CE1 4Å; V64-Y94 WeakPolarHBondContact CG1-OH 3.38Å
65	F	88.8	Confident	93.7	Very high	67 Å²	67	51 Å²	51	29%	0.294	30%	0.299	S	S	.	.			trans	-158	140.2	-178.4	177.7	-101.8	0	0	0	110.1	P67 M90 L125	F65-P67 HydrophobicContact CE1-CB 4.3Å; F65-P67 HydrophobicContact CZ-CB 4.47Å; F65-M90 HydrophobicContact CD1-CB 4.43Å; F65-M90 HydrophobicContact CE1-CB 3.69Å; F65-M90 HydrophobicContact CZ-CB 4.25Å; F65-L125 HydrophobicContact CB-CD2 4.28Å; F65-L125 WeakPolarHBondContact O-CD2 3.48Å
66	I	92	Very high	93.6	Very high	43 Å²	43	51.4 Å²	51.4	22%	0.221	31%	0.307	C	S	.	.			trans	-135	134.8	168.4	-66.2	167.9	0	0	0	105.1	R38 C55 C62 F123	R38-I66 HydrophobicContact CG-CG2 4.42Å; R38-I66 PolarHBondContact NE-O 3.36Å; R38-I66 VanDerWaalsContact NH2-CB 3.25Å; R38-I66 PolarHBondContact NH2-O 3.49Å; C55-I66 HydrophobicContact CB-CD1 4.26Å; C55-I66 HydrophobicContact CB-CG1 4.18Å; C62-I66 WeakPolarHBondContact O-CD1 3.08Å; C62-I66 WeakPolarHBondContact O-CG1 3.33Å; I66-F123 HydrophobicContact CG2-CZ 4.12Å
67	P	93.6	Very high	93.2	Very high	2 Å²	2	53 Å²	53	1%	0.013	31%	0.305	C	S	.	.			trans	-68.4	148.1	177.1	27.2	-33.8	0	0	0	111.6	F65 V70 T88 F123	F65-P67 HydrophobicContact CE1-CB 4.3Å; F65-P67 HydrophobicContact CZ-CB 4.47Å; P67-V70 HydrophobicContact CB-CG2 3.97Å; P67-V70 HydrophobicContact CG-CG2 3.46Å; P67-V70 VanDerWaalsContact CG-CG2 3.46Å; P67-T88 HydrophobicContact CB-CG2 3.9Å; P67-T88 VanDerWaalsContact CB-OG1 3.3Å; P67-T88 WeakPolarHBondContact CB-OG1 3.45Å; P67-T88 HydrophobicContact CG-CG2 4.18Å; P67-F123 HydrophobicContact CG-CZ 4.29Å
68	D	95	Very high	92.8	Very high	101 Å²	101	56.5 Å²	56.5	54%	0.54	32%	0.318	S	S	.	.	S	Bend	trans	-76.7	-33.4	174.8	-71.9	-38.9	0	0	0	112.3	Y37 R38	Y37-D68 WeakPolarHBondContact CA-O 3.29Å; R38-D68 WeakPolarHBondContact CD-OD1 3.36Å; R38-D68 IonicContact CZ-OD1 3.44Å; R38-D68 PolarHBondContact N-O 2.75Å; R38-D68 IonicContact NE-OD1 3.61Å; R38-D68 IonicContact NH1-OD1 2.7Å; R38-D68 PolarHBondContact NH1-OD1 2.92Å
69	V	96.3	Very high	92.3	Very high	61 Å²	61	57 Å²	57	37%	0.37	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	134	180	-174.7	0	0	0	0	109.6	T35 F36 Y37 T88	T35-V69 HydrophobicContact CG2-CG1 3.57Å; F36-V69 WeakPolarHBondContact O-CA 3.13Å; Y37-V69 HydrophobicContact CD1-CG1 4.46Å; Y37-V69 HydrophobicContact CD1-CG2 3.73Å; Y37-V69 HydrophobicContact CE1-CG1 4.23Å; Y37-V69 HydrophobicContact CE1-CG2 3.88Å; V69-T88 WeakPolarHBondContact O-CB 3.38Å; V69-T88 PolarHBondContact O-OG1 3.02Å
70	V	97.3	Very high	91.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.3	169.8	-175.2	0	0	0	0	108.5	T35 F36 L53 P67 C86 T88 F96 L121	T35-V70 WeakPolarHBondContact CA-O 3.17Å; F36-V70 PolarHBondContact N-O 3.38Å; F36-V70 PolarHBondContact O-N 2.75Å; L53-V70 HydrophobicContact CD1-CG2 4.01Å; L53-V70 HydrophobicContact CD2-CB 4Å; L53-V70 HydrophobicContact CD2-CG2 3.71Å; P67-V70 HydrophobicContact CB-CG2 3.97Å; P67-V70 HydrophobicContact CG-CG2 3.46Å; P67-V70 VanDerWaalsContact CG-CG2 3.46Å; V70-C86 HydrophobicContact CG1-CB 4.03Å; V70-T88 HydrophobicContact CG2-CG2 4.48Å; V70-F96 HydrophobicContact CG1-CE2 4.5Å; V70-F96 HydrophobicContact CG1-CZ 4.05Å; V70-F96 HydrophobicContact CG2-CZ 4.08Å; V70-L121 HydrophobicContact CB-CD2 3.92Å; V70-L121 HydrophobicContact CG1-CD2 3.59Å; V70-L121 HydrophobicContact CG2-CD2 4.26Å
71	Q	97.1	Very high	91.6	Very high	102 Å²	102	60.8 Å²	60.8	48%	0.477	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.3	176.9	-173.1	175.1	16.3	0	0	109.4	L34 V73 C86 K87	L34-Q71 WeakPolarHBondContact O-CA 3.35Å; Q71-V73 HydrophobicContact CG-CG2 4.48Å; Q71-C86 CarbonylContact O-C 3.44Å; Q71-C86 WeakPolarHBondContact O-CA 3.41Å; Q71-K87 PolarHBondContact N-O 2.73Å; Q71-K87 PolarHBondContact O-N 3.46Å
72	C	96.8	Very high	91.6	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.8	174	-55.9	0	0	0	0	109.7	A33 L34 F36 W84 E85 C86	A33-C72 CarbonylContact C-O 3.6Å; A33-C72 VanDerWaalsContact CA-O 3.23Å; A33-C72 WeakPolarHBondContact CA-O 3.47Å; L34-C72 HydrophobicContact CB-CB 4.46Å; L34-C72 PolarHBondContact N-O 3.08Å; L34-C72 PolarHBondContact O-N 2.84Å; F36-C72 HydrophobicContact CE2-CB 4.08Å; F36-C72 VanDerWaalsContact CE2-SG 3.53Å; C72-W84 HydrophobicContact CB-CE3 4.07Å; C72-E85 CarbonylContact C-O 3.59Å; C72-E85 VanDerWaalsContact CA-O 3.29Å; C72-E85 WeakPolarHBondContact CA-O 3.46Å; C72-C86 HydrophobicContact CB-CB 4.11Å; C72-C86 WeakPolarHBondContact CB-SG 3.48Å; C72-C86 WeakPolarHBondContact SG-CB 3.02Å; C72-C86 CovalentContact SG-SG 2.03Å; C72-C86 PolarHBondContact SG-SG 3.22Å
73	V	96.6	Very high	91.6	Very high	56 Å²	56	60.9 Å²	60.9	34%	0.339	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	138.5	179.1	-177.9	0	0	0	0	108.4	Q71 T75 E85	Q71-V73 HydrophobicContact CG-CG2 4.48Å; V73-T75 PolarHBondContact O-N 3.1Å; V73-E85 PolarHBondContact N-O 3.02Å; V73-E85 PolarHBondContact O-N 3.05Å
74	N	94.3	Very high	91.8	Very high	38 Å²	38	52.7 Å²	52.7	20%	0.203	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	115.8	172.8	-178.9	-11.7	0	0	0	108.9	R29 I31 Q32 G76 V82 W84	R29-N74 PolarHBondContact O-ND2 3.43Å; I31-N74 WeakPolarHBondContact O-CB 3.21Å; I31-N74 PolarHBondContact O-ND2 3.26Å; Q32-N74 WeakPolarHBondContact O-CB 3.32Å; Q32-N74 PolarHBondContact O-N 3.35Å; N74-G76 PolarHBondContact OD1-N 2.81Å; N74-G76 PolarHBondContact OD1-O 3.42Å; N74-G76 VanDerWaalsContact OD1-O 3.11Å; N74-V82 HydrophobicContact CB-CG1 4.16Å; N74-V82 WeakPolarHBondContact ND2-CG1 3.44Å; N74-V82 WeakPolarHBondContact OD1-CG1 3.49Å; N74-W84 HydrophobicContact CB-CE3 4.27Å; N74-W84 HydrophobicContact CB-CH2 4.2Å; N74-W84 HydrophobicContact CB-CZ3 3.84Å
75	T	94.3	Very high	92.1	Very high	85 Å²	85	51.7 Å²	51.7	52%	0.521	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-8.6	-178.8	59.6	0	0	0	0	113.3	V73 Q83 E85	V73-T75 PolarHBondContact O-N 3.1Å; T75-Q83 PolarHBondContact N-O 3.4Å; T75-Q83 PolarHBondContact OG1-O 3.39Å; T75-E85 HydrophobicContact CG2-CB 3.45Å; T75-E85 VanDerWaalsContact CG2-CB 3.45Å
76	G	92.3	Very high	92.5	Very high	30 Å²	30	48.5 Å²	48.5	31%	0.309	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153.7	-170.9	-178.5	0	0	0	0	0	113	N74 Q83	N74-G76 PolarHBondContact OD1-N 2.81Å; N74-G76 PolarHBondContact OD1-O 3.42Å; N74-G76 VanDerWaalsContact OD1-O 3.11Å; G76-Q83 PolarHBondContact O-N 2.8Å
77	W	87.5	Confident	92.6	Very high	109 Å²	109	50.1 Å²	50.1	41%	0.413	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	137.8	-178.9	151.6	-75.1	0	0	0	107.5	G79 V80 D81 V82	W77-G79 VanDerWaalsContact CE2-C 3.47Å; W77-G79 VanDerWaalsContact CE2-CA 3.45Å; W77-G79 WeakPolarHBondContact CZ2-O 3.42Å; W77-V80 WeakPolarHBondContact CH2-O 3.33Å; W77-V80 VanDerWaalsContact CZ3-O 3.26Å; W77-V80 WeakPolarHBondContact CZ3-O 3.39Å; W77-D81 WeakPolarHBondContact CA-O 3.43Å; W77-V82 HydrophobicContact CE3-CG2 4.48Å
78	D	86.6	Confident	92.7	Very high	94 Å²	94	50.7 Å²	50.7	50%	0.503	28%	0.282	S	S	.	.			trans	-100.8	-0.7	-174.4	63.9	6.8	0	0	0	114.6	V80 D81 Q83	D78-V80 PolarHBondContact OD1-N 3.4Å; D78-D81 PolarHBondContact N-O 3.32Å; D78-D81 PolarHBondContact OD1-N 2.8Å; D78-Q83 HydrophobicContact CB-CG 4.46Å; D78-Q83 PolarHBondContact OD2-NE2 3.38Å
79	G	84.4	Confident	92.6	Very high	46 Å²	46	51.1 Å²	51.1	47%	0.474	28%	0.284	S	S	.	.	S	Bend	trans	112.9	-18.6	-172.3	0	0	0	0	0	113.4	W77	W77-G79 VanDerWaalsContact CE2-C 3.47Å; W77-G79 VanDerWaalsContact CE2-CA 3.45Å; W77-G79 WeakPolarHBondContact CZ2-O 3.42Å
80	V	83.6	Confident	92.3	Very high	105 Å²	105	48.2 Å²	48.2	64%	0.636	27%	0.267	S	S	*	.	S	Bend	trans	-130.7	-53.4	-175.7	-175.8	0	0	0	0	110.3	W77 D78	W77-V80 WeakPolarHBondContact CH2-O 3.33Å; W77-V80 VanDerWaalsContact CZ3-O 3.26Å; W77-V80 WeakPolarHBondContact CZ3-O 3.39Å; D78-V80 PolarHBondContact OD1-N 3.4Å
81	D	85.6	Confident	92	Very high	45 Å²	45	50.6 Å²	50.6	24%	0.241	28%	0.279	C	S	.	.	S	Bend	trans	-127.6	160.2	-172.2	-74.2	-52.9	0	0	0	112.5	W77 D78	W77-D81 WeakPolarHBondContact CA-O 3.43Å; D78-D81 PolarHBondContact N-O 3.32Å; D78-D81 PolarHBondContact OD1-N 2.8Å
82	V	90.9	Very high	91.7	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.1	174.1	-179.6	0	0	0	0	109.8	L28 R29 N74 W77 W84	L28-V82 HydrophobicContact CG-CG2 4.11Å; R29-V82 HydrophobicContact CB-CG2 4.45Å; N74-V82 HydrophobicContact CB-CG1 4.16Å; N74-V82 WeakPolarHBondContact ND2-CG1 3.44Å; N74-V82 WeakPolarHBondContact OD1-CG1 3.49Å; W77-V82 HydrophobicContact CE3-CG2 4.48Å; V82-W84 HydrophobicContact CB-CZ2 4.33Å; V82-W84 HydrophobicContact CG1-CD2 4.22Å; V82-W84 HydrophobicContact CG1-CH2 4.37Å; V82-W84 HydrophobicContact CG1-CZ2 3.76Å
83	Q	92.7	Very high	91.5	Very high	53 Å²	53	47.3 Å²	47.3	25%	0.248	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	107.5	-179.7	-65.6	-62.3	-30.8	0	0	110.4	T75 G76 D78	T75-Q83 PolarHBondContact N-O 3.4Å; T75-Q83 PolarHBondContact OG1-O 3.39Å; G76-Q83 PolarHBondContact O-N 2.8Å; D78-Q83 HydrophobicContact CB-CG 4.46Å; D78-Q83 PolarHBondContact OD2-NE2 3.38Å
84	W	94	Very high	91.3	Very high	1 Å²	1	46.8 Å²	46.8	0%	0.004	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.7	-179.6	-60.5	97.5	0	0	0	112.3	L28 I31 L34 C72 N74 V82 V101 A315	L28-W84 HydrophobicContact CD1-CZ2 4.22Å; I31-W84 HydrophobicContact CB-CH2 3.95Å; I31-W84 HydrophobicContact CG2-CH2 3.71Å; I31-W84 HydrophobicContact CG2-CZ3 4.44Å; L34-W84 HydrophobicContact CB-CZ3 4.46Å; L34-W84 HydrophobicContact CD1-CD2 4.41Å; L34-W84 HydrophobicContact CD1-CE3 4.28Å; L34-W84 HydrophobicContact CD1-CH2 3.53Å; L34-W84 HydrophobicContact CD1-CZ2 3.65Å; L34-W84 HydrophobicContact CD1-CZ3 3.86Å; L34-W84 HydrophobicContact CG-CH2 3.75Å; L34-W84 HydrophobicContact CG-CZ2 4.38Å; L34-W84 HydrophobicContact CG-CZ3 3.88Å; C72-W84 HydrophobicContact CB-CE3 4.07Å; N74-W84 HydrophobicContact CB-CE3 4.27Å; N74-W84 HydrophobicContact CB-CH2 4.2Å; N74-W84 HydrophobicContact CB-CZ3 3.84Å; V82-W84 HydrophobicContact CB-CZ2 4.33Å; V82-W84 HydrophobicContact CG1-CD2 4.22Å; V82-W84 HydrophobicContact CG1-CH2 4.37Å; V82-W84 HydrophobicContact CG1-CZ2 3.76Å; W84-V101 HydrophobicContact CB-CG2 4.49Å; W84-V101 HydrophobicContact CG-CG2 4.24Å; W84-A315 HydrophobicContact CB-CB 3.93Å; W84-A315 HydrophobicContact CG-CB 4.32Å
85	E	94.8	Very high	91.3	Very high	45 Å²	45	51.2 Å²	51.2	21%	0.21	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	113.7	164.6	-174.3	-171.4	-174.5	0	0	109.4	C72 V73 T75 K87 S311 T313	C72-E85 CarbonylContact C-O 3.59Å; C72-E85 VanDerWaalsContact CA-O 3.29Å; C72-E85 WeakPolarHBondContact CA-O 3.46Å; V73-E85 PolarHBondContact N-O 3.02Å; V73-E85 PolarHBondContact O-N 3.05Å; T75-E85 HydrophobicContact CG2-CB 3.45Å; T75-E85 VanDerWaalsContact CG2-CB 3.45Å; E85-K87 WeakPolarHBondContact OE1-CE 3.49Å; E85-K87 IonicContact OE1-NZ 3.24Å; E85-K87 PolarHBondContact OE1-NZ 3.34Å; E85-K87 WeakPolarHBondContact OE2-CE 3Å; E85-K87 IonicContact OE2-NZ 3.95Å; E85-K87 PolarHBondContact OE2-NZ 3.4Å; E85-S311 WeakPolarHBondContact OE1-CB 3.41Å; E85-S311 PolarHBondContact OE1-OG 3.06Å; E85-T313 HydrophobicContact CG-CG2 4.34Å
86	C	96.2	Very high	91.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.1	-177.5	-64.1	0	0	0	0	111.8	V70 Q71 C72 I99 S311 G312	V70-C86 HydrophobicContact CG1-CB 4.03Å; Q71-C86 CarbonylContact O-C 3.44Å; Q71-C86 WeakPolarHBondContact O-CA 3.41Å; C72-C86 HydrophobicContact CB-CB 4.11Å; C72-C86 WeakPolarHBondContact CB-SG 3.48Å; C72-C86 WeakPolarHBondContact SG-CB 3.02Å; C72-C86 CovalentContact SG-SG 2.03Å; C72-C86 PolarHBondContact SG-SG 3.22Å; C86-I99 HydrophobicContact CB-CD1 3.89Å; C86-S311 CarbonylContact O-C 3.6Å; C86-S311 VanDerWaalsContact O-CA 3.29Å; C86-S311 WeakPolarHBondContact O-CA 3.34Å; C86-G312 PolarHBondContact N-O 3.23Å; C86-G312 PolarHBondContact O-N 3.28Å
87	K	95.2	Very high	91.4	Very high	77 Å²	77	47.8 Å²	47.8	34%	0.335	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	141	-177.1	-70.6	175.6	-179	153.2	0	111.5	Q71 E85 T309 A310 S311	Q71-K87 PolarHBondContact N-O 2.73Å; Q71-K87 PolarHBondContact O-N 3.46Å; E85-K87 WeakPolarHBondContact OE1-CE 3.49Å; E85-K87 IonicContact OE1-NZ 3.24Å; E85-K87 PolarHBondContact OE1-NZ 3.34Å; E85-K87 WeakPolarHBondContact OE2-CE 3Å; E85-K87 IonicContact OE2-NZ 3.95Å; E85-K87 PolarHBondContact OE2-NZ 3.4Å; K87-T309 HydrophobicContact CB-CG2 3.79Å; K87-T309 HydrophobicContact CD-CG2 4.06Å; K87-T309 HydrophobicContact CG-CG2 3.92Å; K87-A310 WeakPolarHBondContact CA-O 3.43Å; K87-S311 WeakPolarHBondContact CE-OG 3.36Å; K87-S311 WeakPolarHBondContact CG-OG 3.47Å
88	T	95.6	Very high	91.6	Very high	14 Å²	14	45.9 Å²	45.9	9%	0.086	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	164.2	169	-166.3	0	0	0	0	110.2	P67 V69 V70 M90 F96 T309 A310	P67-T88 HydrophobicContact CB-CG2 3.9Å; P67-T88 VanDerWaalsContact CB-OG1 3.3Å; P67-T88 WeakPolarHBondContact CB-OG1 3.45Å; P67-T88 HydrophobicContact CG-CG2 4.18Å; V69-T88 WeakPolarHBondContact O-CB 3.38Å; V69-T88 PolarHBondContact O-OG1 3.02Å; V70-T88 HydrophobicContact CG2-CG2 4.48Å; T88-M90 HydrophobicContact CG2-CE 3.23Å; T88-F96 HydrophobicContact CG2-CE1 4.32Å; T88-F96 HydrophobicContact CG2-CE2 3.5Å; T88-F96 HydrophobicContact CG2-CZ 3.28Å; T88-T309 WeakPolarHBondContact O-CA 3.31Å; T88-A310 PolarHBondContact N-O 3.47Å; T88-A310 PolarHBondContact O-N 2.88Å
89	D	92.5	Very high	92	Very high	110 Å²	110	41.9 Å²	41.9	59%	0.588	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89	120.3	175	-64.4	-33.2	0	0	0	110.3
90	M	90.8	Very high	92.4	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	157.5	177.8	60	175.7	74.3	0	0	111.6	F65 T88 R95 F96 L125 T307 R308 A310	F65-M90 HydrophobicContact CD1-CB 4.43Å; F65-M90 HydrophobicContact CE1-CB 3.69Å; F65-M90 HydrophobicContact CZ-CB 4.25Å; T88-M90 HydrophobicContact CG2-CE 3.23Å; M90-R95 VanDerWaalsContact SD-CA 3.58Å; M90-F96 HydrophobicContact CE-CD1 4Å; M90-F96 HydrophobicContact CE-CD2 3.86Å; M90-F96 HydrophobicContact CE-CE1 3.77Å; M90-F96 HydrophobicContact CE-CE2 3.64Å; M90-F96 HydrophobicContact CE-CG 4.05Å; M90-F96 HydrophobicContact CE-CZ 3.6Å; M90-L125 HydrophobicContact SD-CD1 4.48Å; M90-T307 CarbonylContact O-C 3.51Å; M90-T307 WeakPolarHBondContact O-CA 3.39Å; M90-R308 PolarHBondContact N-O 2.83Å; M90-R308 VanDerWaalsContact N-O 3.17Å; M90-R308 PolarHBondContact O-N 3.48Å; M90-A310 HydrophobicContact CE-CB 3.74Å; M90-A310 HydrophobicContact CG-CB 3.6Å; M90-A310 HydrophobicContact SD-CB 3.45Å; M90-A310 WeakPolarHBondContact SD-CB 3.22Å
91	D	91.2	Very high	92.9	Very high	49 Å²	49	37.1 Å²	37.1	26%	0.262	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	145	175.5	-171.6	-73.7	0	0	0	110.4	A93 Y94 K134	D91-A93 PolarHBondContact O-N 2.65Å; D91-A93 WeakPolarHBondContact OD1-CB 3.07Å; D91-A93 PolarHBondContact OD1-N 2.97Å; D91-Y94 HydrophobicContact CB-CD2 4.01Å; D91-Y94 HydrophobicContact CB-CE2 4.19Å; D91-Y94 PolarHBondContact O-N 2.97Å; D91-K134 IonicContact OD1-NZ 3.02Å; D91-K134 PolarHBondContact OD1-NZ 2.79Å; D91-K134 IonicContact OD2-NZ 2.84Å
92	N	90.7	Very high	93.3	Very high	30 Å²	30	37.1 Å²	37.1	16%	0.16	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-20.6	175.6	-67.3	-16.7	0	0	0	114.1	Y94 T128 E130 G306 R308	N92-Y94 PolarHBondContact O-N 3.24Å; N92-T128 WeakPolarHBondContact O-CB 3.47Å; N92-T128 WeakPolarHBondContact O-CG2 3.46Å; N92-T128 PolarHBondContact O-OG1 3.29Å; N92-E130 VanDerWaalsContact CB-OE2 3.32Å; N92-E130 WeakPolarHBondContact CB-OE2 3.36Å; N92-G306 PolarHBondContact N-O 3.08Å; N92-G306 PolarHBondContact ND2-O 2.96Å; N92-G306 PolarHBondContact OD1-O 3.3Å; N92-R308 VanDerWaalsContact OD1-CB 3.29Å; N92-R308 WeakPolarHBondContact OD1-CB 3.25Å; N92-R308 WeakPolarHBondContact OD1-CD 3.29Å; N92-R308 WeakPolarHBondContact OD1-CG 3.3Å
93	A	91.4	Very high	93.4	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.033	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.2	172.5	0	0	0	0	0	113.9	D91 T128	D91-A93 PolarHBondContact O-N 2.65Å; D91-A93 WeakPolarHBondContact OD1-CB 3.07Å; D91-A93 PolarHBondContact OD1-N 2.97Å; A93-T128 VanDerWaalsContact C-OG1 3.28Å; A93-T128 WeakPolarHBondContact CA-OG1 2.84Å; A93-T128 PolarHBondContact O-N 3.45Å; A93-T128 PolarHBondContact O-OG1 3.24Å
94	Y	93.4	Very high	93.3	Very high	45 Å²	45	36.1 Å²	36.1	18%	0.176	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	159.8	-175.2	-49.6	-67.2	0	0	0	112.7	A60 V64 D91 N92 L125 E126 L127 T128 R308	A60-Y94 HydrophobicContact CB-CD1 3.86Å; A60-Y94 HydrophobicContact CB-CE1 4.05Å; V64-Y94 HydrophobicContact CG1-CE1 4Å; V64-Y94 WeakPolarHBondContact CG1-OH 3.38Å; D91-Y94 HydrophobicContact CB-CD2 4.01Å; D91-Y94 HydrophobicContact CB-CE2 4.19Å; D91-Y94 PolarHBondContact O-N 2.97Å; N92-Y94 PolarHBondContact O-N 3.24Å; Y94-L125 HydrophobicContact CD1-CD2 4.22Å; Y94-L125 HydrophobicContact CD1-CG 4.46Å; Y94-L125 HydrophobicContact CG-CD2 4.48Å; Y94-E126 WeakPolarHBondContact CA-O 3.41Å; Y94-L127 HydrophobicContact CD1-CD2 4.19Å; Y94-L127 HydrophobicContact CE1-CD2 3.83Å; Y94-T128 WeakPolarHBondContact O-CG2 3.45Å; Y94-R308 PolarHBondContact O-NH2 3.36Å
95	R	93.9	Very high	93.2	Very high	131 Å²	131	36.3 Å²	36.3	49%	0.494	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	158.7	168.7	64.9	178.7	-176.7	-166	4.4	109.9	M90 E126 T128	M90-R95 VanDerWaalsContact SD-CA 3.58Å; R95-E126 HydrophobicContact CG-CB 3.93Å; R95-E126 PolarHBondContact N-O 3.45Å; R95-E126 PolarHBondContact O-N 2.91Å; R95-T128 HydrophobicContact CB-CG2 4.06Å; R95-T128 HydrophobicContact CG-CG2 4.04Å
96	F	95.3	Very high	93.1	Very high	12 Å²	12	35.4 Å²	35.4	5%	0.053	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	138.5	164.5	-68.9	-58.2	0	0	0	110.6	V70 T88 M90 I99 F123 A310	V70-F96 HydrophobicContact CG1-CE2 4.5Å; V70-F96 HydrophobicContact CG1-CZ 4.05Å; V70-F96 HydrophobicContact CG2-CZ 4.08Å; T88-F96 HydrophobicContact CG2-CE1 4.32Å; T88-F96 HydrophobicContact CG2-CE2 3.5Å; T88-F96 HydrophobicContact CG2-CZ 3.28Å; M90-F96 HydrophobicContact CE-CD1 4Å; M90-F96 HydrophobicContact CE-CD2 3.86Å; M90-F96 HydrophobicContact CE-CE1 3.77Å; M90-F96 HydrophobicContact CE-CE2 3.64Å; M90-F96 HydrophobicContact CE-CG 4.05Å; M90-F96 HydrophobicContact CE-CZ 3.6Å; F96-I99 HydrophobicContact CB-CG2 3.97Å; F96-I99 HydrophobicContact CD1-CG2 4.25Å; F96-I99 HydrophobicContact CG-CG2 4.16Å; F96-F123 HydrophobicContact CD1-CB 4.15Å; F96-F123 AromaticContact CD1-CD2 3.9Å; F96-F123 HydrophobicContact CD1-CD2 3.9Å; F96-F123 HydrophobicContact CD1-CG 4.19Å; F96-F123 HydrophobicContact CE1-CB 4.33Å; F96-F123 AromaticContact CE1-CD2 3.85Å; F96-F123 HydrophobicContact CE1-CD2 3.85Å; F96-F123 HydrophobicContact CE1-CE2 4.35Å; F96-F123 HydrophobicContact CE1-CG 4.02Å; F96-A310 HydrophobicContact CD2-CB 4.27Å
97	G	93.3	Very high	92.7	Very high	31 Å²	31	37.9 Å²	37.9	32%	0.32	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-117.2	165.4	0	0	0	0	0	109.8	T124	G97-T124 WeakPolarHBondContact CA-OG1 2.98Å; G97-T124 PolarHBondContact N-O 3.27Å
98	A	92.5	Very high	92.3	Very high	69 Å²	69	39.9 Å²	39.9	57%	0.57	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.5	171.3	0	0	0	0	0	109.7	F123 T124	A98-F123 CarbonylContact O-C 3.5Å; A98-F123 VanDerWaalsContact O-CA 3.27Å; A98-F123 WeakPolarHBondContact O-CA 3.34Å; A98-T124 PolarHBondContact N-OG1 3.43Å; A98-T124 PolarHBondContact O-N 2.5Å
99	I	93.9	Very high	91.8	Very high	10 Å²	10	43 Å²	43	5%	0.051	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.9	173.6	63.3	171.6	0	0	0	108.6	C86 F96 L121 E122 F123 G312 E314 A315	C86-I99 HydrophobicContact CB-CD1 3.89Å; F96-I99 HydrophobicContact CB-CG2 3.97Å; F96-I99 HydrophobicContact CD1-CG2 4.25Å; F96-I99 HydrophobicContact CG-CG2 4.16Å; I99-L121 HydrophobicContact CB-CD1 4.28Å; I99-E122 CarbonylContact C-O 3.55Å; I99-E122 WeakPolarHBondContact CA-O 3.32Å; I99-F123 HydrophobicContact CG2-CB 4.04Å; I99-G312 VanDerWaalsContact CD1-C 3.41Å; I99-G312 VanDerWaalsContact CD1-O 3.26Å; I99-G312 WeakPolarHBondContact CD1-O 3.41Å; I99-E314 WeakPolarHBondContact CG1-O 3.42Å; I99-A315 HydrophobicContact CD1-CB 4.43Å; I99-A315 HydrophobicContact CG1-CB 4.24Å; I99-A315 WeakPolarHBondContact O-CA 3.47Å
100	E	93.6	Very high	91.3	Very high	50 Å²	50	41.6 Å²	41.6	23%	0.234	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	124.5	-179.1	-163	175.4	175	0	0	109.1	L121 E122 C316 R318	E100-L121 WeakPolarHBondContact O-CA 3.39Å; E100-E122 HydrophobicContact CB-CB 4.47Å; E100-E122 PolarHBondContact N-O 2.88Å; E100-E122 PolarHBondContact O-N 3.17Å; E100-C316 WeakPolarHBondContact CG-O 3.45Å; E100-R318 VanDerWaalsContact OE1-CB 3.3Å; E100-R318 WeakPolarHBondContact OE1-CB 3.09Å; E100-R318 WeakPolarHBondContact OE1-CD 3.13Å; E100-R318 WeakPolarHBondContact OE1-CG 3.5Å
101	V	94.6	Very high	91.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.3	-179.3	173	0	0	0	0	106.9	L34 F36 W84 G120 L121 A315 C316 V317	L34-V101 HydrophobicContact CD1-CG1 3.78Å; F36-V101 HydrophobicContact CE2-CG2 4.39Å; F36-V101 HydrophobicContact CZ-CG1 4.05Å; F36-V101 HydrophobicContact CZ-CG2 4.31Å; W84-V101 HydrophobicContact CB-CG2 4.49Å; W84-V101 HydrophobicContact CG-CG2 4.24Å; V101-G120 WeakPolarHBondContact CA-O 3.08Å; V101-L121 HydrophobicContact CG2-CD1 3.63Å; V101-A315 HydrophobicContact CB-CB 3.99Å; V101-A315 HydrophobicContact CG2-CB 3.73Å; V101-C316 PolarHBondContact N-O 2.94Å; V101-C316 VanDerWaalsContact O-O 3.11Å; V101-V317 WeakPolarHBondContact O-CA 3.46Å
102	S	92.3	Very high	91	Very high	45 Å²	45	46.4 Å²	46.4	32%	0.315	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133	-178.6	171.6	0	0	0	0	109.8	C119 G120 R318	S102-C119 CarbonylContact O-C 3.5Å; S102-C119 VanDerWaalsContact O-CA 3.26Å; S102-C119 WeakPolarHBondContact O-CA 3.49Å; S102-G120 PolarHBondContact N-O 3.02Å; S102-G120 PolarHBondContact O-N 2.84Å; S102-R318 WeakPolarHBondContact CB-O 3.3Å; S102-R318 PolarHBondContact OG-O 3.08Å
103	C	92.7	Very high	91.1	Very high	4 Å²	4	50.9 Å²	50.9	3%	0.027	28%	0.284	C	S	.	.			trans	-126.7	146.4	-180	-50.3	0	0	0	0	110	G105 I114 C119	C103-G105 PolarHBondContact O-N 3.23Å; C103-I114 HydrophobicContact CB-CB 4.1Å; C103-I114 HydrophobicContact CB-CD1 3.68Å; C103-I114 HydrophobicContact CB-CG2 3.84Å; C103-C119 HydrophobicContact CB-CB 4.06Å; C103-C119 WeakPolarHBondContact CB-SG 3.4Å; C103-C119 WeakPolarHBondContact SG-CB 3.47Å; C103-C119 CovalentContact SG-SG 2.04Å; C103-C119 PolarHBondContact SG-SG 3.19Å
104	E	92.4	Very high	91.2	Very high	31 Å²	31	50.8 Å²	50.8	15%	0.145	28%	0.283	C	S	.	.			trans	-73	119.6	174	-175	176.2	149.8	0	0	109.9	A44 R45 R46 S47 I114 L115 S118	A44-E104 WeakPolarHBondContact CA-OE2 3.42Å; R45-E104 PolarHBondContact N-OE1 3.06Å; R45-E104 PolarHBondContact N-OE2 2.88Å; R46-E104 PolarHBondContact N-OE1 3.13Å; S47-E104 PolarHBondContact OG-OE2 2.91Å; E104-I114 CarbonylContact O-C 3.58Å; E104-I114 WeakPolarHBondContact O-CA 3.18Å; E104-I114 WeakPolarHBondContact O-CB 3.26Å; E104-L115 PolarHBondContact O-N 3.07Å; E104-S118 PolarHBondContact N-OG 2.89Å; E104-S118 PolarHBondContact O-OG 2.98Å
105	G	92.1	Very high	91.2	Very high	5 Å²	5	49.3 Å²	49.3	5%	0.052	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-62.1	142.1	171	0	0	0	0	0	112	C103 H108	C103-G105 PolarHBondContact O-N 3.23Å; G105-H108 CarbonylContact C-O 3.51Å; G105-H108 WeakPolarHBondContact CA-O 3.47Å
106	Y	91.1	Very high	91.2	Very high	25 Å²	25	49.6 Å²	49.6	10%	0.098	28%	0.283	C	S	.	.	S	Bend	trans	-71.6	-49.7	-168.3	-169	-108	0	0	0	112.8	N22 D24 R46 Y113 L115	N22-Y106 WeakPolarHBondContact OD1-CE1 3.23Å; N22-Y106 PolarHBondContact OD1-OH 2.98Å; D24-Y106 HydrophobicContact CB-CE2 4.24Å; R46-Y106 PolarHBondContact NH2-O 2.98Å; Y106-Y113 WeakPolarHBondContact CB-O 3.33Å; Y106-Y113 PolarHBondContact N-O 3.33Å; Y106-L115 HydrophobicContact CD2-CB 4.42Å; Y106-L115 HydrophobicContact CD2-CD1 4.16Å; Y106-L115 HydrophobicContact CE2-CD1 4.06Å
107	S	89.1	Confident	91.1	Very high	53 Å²	53	50.9 Å²	50.9	37%	0.371	30%	0.3	S	S	.	.	S	Bend	trans	-103	-36.7	-179.1	-42.9	0	0	0	0	112.7	R46 D111	R46-S107 PolarHBondContact NH1-O 3.28Å; R46-S107 VanDerWaalsContact NH2-C 3.33Å; R46-S107 PolarHBondContact NH2-O 2.9Å; S107-D111 VanDerWaalsContact C-OD2 3.29Å; S107-D111 WeakPolarHBondContact CA-OD2 3.05Å; S107-D111 WeakPolarHBondContact CB-OD2 3.29Å; S107-D111 PolarHBondContact N-OD2 3.05Å
108	H	86.3	Confident	91.2	Very high	119 Å²	119	49.7 Å²	49.7	55%	0.551	29%	0.287	S	S	*	.	S	Bend	trans	-143.4	163.2	175.7	-62.9	89.8	0	0	0	109.8	G105 A110 D111	G105-H108 CarbonylContact C-O 3.51Å; G105-H108 WeakPolarHBondContact CA-O 3.47Å; H108-A110 VanDerWaalsContact C-N 3.34Å; H108-A110 PolarHBondContact O-N 2.92Å; H108-D111 PolarHBondContact N-OD2 3.35Å; H108-D111 IonicContact ND1-OD1 3.83Å; H108-D111 PolarHBondContact O-N 2.87Å
109	P	84.4	Confident	91.3	Very high	79 Å²	79	46.8 Å²	46.8	51%	0.513	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-50.2	174.8	-25.7	34.8	0	0	0	111.3	D111 F319	P109-D111 VanDerWaalsContact C-N 3.25Å; P109-D111 PolarHBondContact O-N 3Å; P109-F319 HydrophobicContact CB-CB 3.86Å; P109-F319 WeakPolarHBondContact O-CD1 3.45Å; P109-F319 WeakPolarHBondContact O-CE1 3.4Å; P109-F319 WeakPolarHBondContact O-CG 3.27Å
110	A	82.6	Confident	91.4	Very high	81 Å²	81	46.7 Å²	46.7	67%	0.669	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	25.9	-174.9	0	0	0	0	0	116	H108	H108-A110 VanDerWaalsContact C-N 3.34Å; H108-A110 PolarHBondContact O-N 2.92Å
111	D	86.1	Confident	91.5	Very high	40 Å²	40	44.3 Å²	44.3	21%	0.214	25%	0.252	C	S	.	.			trans	-86.4	143.7	179.6	-73.4	-9.7	0	0	0	112.2	S107 H108 P109 Y113	S107-D111 VanDerWaalsContact C-OD2 3.29Å; S107-D111 WeakPolarHBondContact CA-OD2 3.05Å; S107-D111 WeakPolarHBondContact CB-OD2 3.29Å; S107-D111 PolarHBondContact N-OD2 3.05Å; H108-D111 PolarHBondContact N-OD2 3.35Å; H108-D111 IonicContact ND1-OD1 3.83Å; H108-D111 PolarHBondContact O-N 2.87Å; P109-D111 VanDerWaalsContact C-N 3.25Å; P109-D111 PolarHBondContact O-N 3Å; D111-Y113 PolarHBondContact O-N 3.45Å
112	D	89.3	Confident	91.6	Very high	110 Å²	110	47.3 Å²	47.3	59%	0.588	27%	0.266	S	S	*	.	S	Bend	trans	-65.9	-24.3	171.3	-59.4	-29.9	0	0	0	112.7	L27 L28	L27-D112 HydrophobicContact CD1-CB 3.65Å; L28-D112 WeakPolarHBondContact CB-O 3.36Å; L28-D112 PolarHBondContact N-O 3.46Å
113	Y	92.1	Very high	91.8	Very high	124 Å²	124	45.2 Å²	45.2	49%	0.486	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.4	176	-72.6	-91.5	0	0	0	110.3	V26 L27 Y106 D111	V26-Y113 WeakPolarHBondContact O-CA 3.46Å; L27-Y113 HydrophobicContact CB-CD1 4.23Å; L27-Y113 HydrophobicContact CB-CE1 3.96Å; L27-Y113 HydrophobicContact CD1-CD2 4.21Å; L27-Y113 HydrophobicContact CD1-CE1 4.33Å; L27-Y113 HydrophobicContact CD1-CE2 4Å; L27-Y113 HydrophobicContact CD1-CG 4.47Å; Y106-Y113 WeakPolarHBondContact CB-O 3.33Å; Y106-Y113 PolarHBondContact N-O 3.33Å; D111-Y113 PolarHBondContact O-N 3.45Å
114	I	93.7	Very high	91.9	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	160.2	179.5	63.6	150.7	0	0	0	111.5	S25 V26 L28 I31 C103 E104 C119	S25-I114 WeakPolarHBondContact CA-O 3.1Å; V26-I114 PolarHBondContact N-O 3.5Å; V26-I114 WeakPolarHBondContact O-CG1 3.35Å; V26-I114 PolarHBondContact O-N 2.79Å; L28-I114 HydrophobicContact CB-CG2 4.24Å; L28-I114 HydrophobicContact CD1-CD1 4.16Å; L28-I114 HydrophobicContact CD1-CG2 4.46Å; I31-I114 HydrophobicContact CD1-CD1 3.6Å; I31-I114 HydrophobicContact CD1-CG1 4.23Å; C103-I114 HydrophobicContact CB-CB 4.1Å; C103-I114 HydrophobicContact CB-CD1 3.68Å; C103-I114 HydrophobicContact CB-CG2 3.84Å; E104-I114 CarbonylContact O-C 3.58Å; E104-I114 WeakPolarHBondContact O-CA 3.18Å; E104-I114 WeakPolarHBondContact O-CB 3.26Å; I114-C119 WeakPolarHBondContact CD1-SG 3.21Å
115	L	93.4	Very high	92	Very high	15 Å²	15	44.7 Å²	44.7	8%	0.079	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	129.3	170.4	-179.1	70.3	0	0	0	110.7	D24 R45 E104 Y106 G117 S118	D24-L115 HydrophobicContact CB-CD1 4.05Å; R45-L115 HydrophobicContact CB-CD2 3.79Å; E104-L115 PolarHBondContact O-N 3.07Å; Y106-L115 HydrophobicContact CD2-CB 4.42Å; Y106-L115 HydrophobicContact CD2-CD1 4.16Å; Y106-L115 HydrophobicContact CE2-CD1 4.06Å; L115-G117 PolarHBondContact O-N 3.22Å; L115-S118 VanDerWaalsContact O-CB 3.29Å; L115-S118 WeakPolarHBondContact O-CB 3.35Å; L115-S118 PolarHBondContact O-N 2.87Å; L115-S118 VanDerWaalsContact O-N 3.11Å; L115-S118 PolarHBondContact O-OG 3.17Å
116	K	93.5	Very high	92.1	Very high	136 Å²	136	46.9 Å²	46.9	59%	0.591	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	122.4	178.5	-178.2	-178.3	178.1	-178.9	0	111	D24 V26 T43	D24-K116 WeakPolarHBondContact O-CB 3.28Å; D24-K116 PolarHBondContact O-N 3.06Å; V26-K116 HydrophobicContact CG2-CB 4.23Å; T43-K116 PolarHBondContact OG1-O 3.13Å
117	G	93.5	Very high	92.2	Very high	40 Å²	40	46.9 Å²	46.9	41%	0.412	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	6.2	179	0	0	0	0	0	114.6	T42 T43 L115	T42-G117 WeakPolarHBondContact CA-O 3.19Å; T43-G117 PolarHBondContact N-O 3Å; T43-G117 WeakPolarHBondContact OG1-CA 3.36Å; T43-G117 PolarHBondContact OG1-O 3.43Å; T43-G117 VanDerWaalsContact OG1-O 3.13Å; L115-G117 PolarHBondContact O-N 3.22Å
118	S	95.3	Very high	92.5	Very high	6 Å²	6	44.9 Å²	44.9	4%	0.042	25%	0.247	C	C	.	.			trans	-85.3	-11.2	-179	73.4	0	0	0	0	114.6	T42 T43 E104 L115	T42-S118 WeakPolarHBondContact CB-O 3.49Å; T42-S118 WeakPolarHBondContact CG2-O 3.23Å; T43-S118 VanDerWaalsContact O-CA 3.25Å; T43-S118 WeakPolarHBondContact O-CA 3.48Å; T43-S118 VanDerWaalsContact O-CB 3.23Å; T43-S118 WeakPolarHBondContact O-CB 3.42Å; T43-S118 PolarHBondContact OG1-N 3.02Å; T43-S118 VanDerWaalsContact OG1-N 3.13Å; E104-S118 PolarHBondContact N-OG 2.89Å; E104-S118 PolarHBondContact O-OG 2.98Å; L115-S118 VanDerWaalsContact O-CB 3.29Å; L115-S118 WeakPolarHBondContact O-CB 3.35Å; L115-S118 PolarHBondContact O-N 2.87Å; L115-S118 VanDerWaalsContact O-N 3.11Å; L115-S118 PolarHBondContact O-OG 3.17Å
119	C	94.9	Very high	92.7	Very high	7 Å²	7	44.8 Å²	44.8	5%	0.047	25%	0.246	C	C	.	.			trans	-69.1	135.8	-178.5	-58.9	0	0	0	0	112.4	L34 F36 T42 S102 C103 I114	L34-C119 HydrophobicContact CD1-CB 4.15Å; L34-C119 HydrophobicContact CD2-CB 4.29Å; F36-C119 HydrophobicContact CE1-CB 3.94Å; F36-C119 WeakPolarHBondContact CE1-O 3.07Å; F36-C119 HydrophobicContact CZ-CB 4.33Å; T42-C119 VanDerWaalsContact CG2-O 3.29Å; T42-C119 WeakPolarHBondContact CG2-O 3.36Å; S102-C119 CarbonylContact O-C 3.5Å; S102-C119 VanDerWaalsContact O-CA 3.26Å; S102-C119 WeakPolarHBondContact O-CA 3.49Å; C103-C119 HydrophobicContact CB-CB 4.06Å; C103-C119 WeakPolarHBondContact CB-SG 3.4Å; C103-C119 WeakPolarHBondContact SG-CB 3.47Å; C103-C119 CovalentContact SG-SG 2.04Å; C103-C119 PolarHBondContact SG-SG 3.19Å; I114-C119 WeakPolarHBondContact CD1-SG 3.21Å
120	G	95.9	Very high	92.9	Very high	8 Å²	8	45.9 Å²	45.9	8%	0.082	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	158.8	167.8	0	0	0	0	0	111.6	V101 S102	V101-G120 WeakPolarHBondContact CA-O 3.08Å; S102-G120 PolarHBondContact N-O 3.02Å; S102-G120 PolarHBondContact O-N 2.84Å
121	L	96.6	Very high	93.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.3	177.7	175	73	0	0	0	109.9	F36 Q52 L53 K54 V70 I99 E100 V101	F36-L121 HydrophobicContact CD1-CB 4.15Å; F36-L121 HydrophobicContact CD2-CB 3.74Å; F36-L121 HydrophobicContact CD2-CD2 4.05Å; F36-L121 HydrophobicContact CD2-CG 4.47Å; F36-L121 HydrophobicContact CE1-CB 4.24Å; F36-L121 HydrophobicContact CE2-CB 3.84Å; F36-L121 HydrophobicContact CE2-CD2 4.47Å; F36-L121 HydrophobicContact CG-CB 3.89Å; F36-L121 HydrophobicContact CZ-CB 4.08Å; Q52-L121 PolarHBondContact O-N 2.82Å; L53-L121 HydrophobicContact CD2-CB 4.08Å; L53-L121 HydrophobicContact CD2-CD2 3.75Å; L53-L121 HydrophobicContact CD2-CG 4.33Å; K54-L121 PolarHBondContact N-O 2.88Å; V70-L121 HydrophobicContact CB-CD2 3.92Å; V70-L121 HydrophobicContact CG1-CD2 3.59Å; V70-L121 HydrophobicContact CG2-CD2 4.26Å; I99-L121 HydrophobicContact CB-CD1 4.28Å; E100-L121 WeakPolarHBondContact O-CA 3.39Å; V101-L121 HydrophobicContact CG2-CD1 3.63Å
122	E	96.3	Very high	93.3	Very high	62 Å²	62	45 Å²	45	29%	0.29	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.7	166.1	-58.7	-157.4	149.5	0	0	109.7	K54 V56 I99 E100	K54-E122 HydrophobicContact CB-CG 4.35Å; K54-E122 HydrophobicContact CD-CG 4.49Å; K54-E122 WeakPolarHBondContact CD-OE1 3.39Å; K54-E122 WeakPolarHBondContact CE-OE1 3.31Å; K54-E122 IonicContact NZ-OE1 2.73Å; K54-E122 PolarHBondContact NZ-OE1 2.93Å; K54-E122 CarbonylContact O-C 3.59Å; K54-E122 VanDerWaalsContact O-CA 3.31Å; K54-E122 WeakPolarHBondContact O-CA 3.43Å; V56-E122 HydrophobicContact CG1-CB 4.03Å; V56-E122 HydrophobicContact CG1-CG 4.3Å; I99-E122 CarbonylContact C-O 3.55Å; I99-E122 WeakPolarHBondContact CA-O 3.32Å; E100-E122 HydrophobicContact CB-CB 4.47Å; E100-E122 PolarHBondContact N-O 2.88Å; E100-E122 PolarHBondContact O-N 3.17Å
123	F	95.5	Very high	93.1	Very high	1 Å²	1	47.7 Å²	47.7	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	153.6	178.9	69.3	-86	0	0	0	112.8	K54 C55 V56 I66 P67 F96 A98 I99	K54-F123 PolarHBondContact O-N 2.99Å; C55-F123 CarbonylContact C-O 3.57Å; C55-F123 WeakPolarHBondContact CA-O 3.27Å; C55-F123 HydrophobicContact CB-CE1 4.21Å; C55-F123 HydrophobicContact CB-CE2 3.92Å; C55-F123 HydrophobicContact CB-CZ 3.69Å; V56-F123 PolarHBondContact N-O 2.97Å; I66-F123 HydrophobicContact CG2-CZ 4.12Å; P67-F123 HydrophobicContact CG-CZ 4.29Å; F96-F123 HydrophobicContact CD1-CB 4.15Å; F96-F123 AromaticContact CD1-CD2 3.9Å; F96-F123 HydrophobicContact CD1-CD2 3.9Å; F96-F123 HydrophobicContact CD1-CG 4.19Å; F96-F123 HydrophobicContact CE1-CB 4.33Å; F96-F123 AromaticContact CE1-CD2 3.85Å; F96-F123 HydrophobicContact CE1-CD2 3.85Å; F96-F123 HydrophobicContact CE1-CE2 4.35Å; F96-F123 HydrophobicContact CE1-CG 4.02Å; A98-F123 CarbonylContact O-C 3.5Å; A98-F123 VanDerWaalsContact O-CA 3.27Å; A98-F123 WeakPolarHBondContact O-CA 3.34Å; I99-F123 HydrophobicContact CG2-CB 4.04Å
124	T	95.4	Very high	92.6	Very high	25 Å²	25	46.3 Å²	46.3	15%	0.153	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	146.8	165.2	64.8	0	0	0	0	111.2	V56 G57 G97 A98	V56-T124 HydrophobicContact CG2-CG2 3.67Å; G57-T124 CarbonylContact O-C 3.52Å; G57-T124 VanDerWaalsContact O-CA 3.31Å; G57-T124 WeakPolarHBondContact O-CA 3.01Å; G57-T124 WeakPolarHBondContact O-CB 3.25Å; G97-T124 WeakPolarHBondContact CA-OG1 2.98Å; G97-T124 PolarHBondContact N-O 3.27Å; A98-T124 PolarHBondContact N-OG1 3.43Å; A98-T124 PolarHBondContact O-N 2.5Å
125	L	95.1	Very high	91.7	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.5	178.9	-166.5	72.3	0	0	0	110.6	G57 G58 S59 A60 F65 M90 Y94	G57-L125 PolarHBondContact O-N 2.78Å; G58-L125 CarbonylContact C-O 3.59Å; G58-L125 VanDerWaalsContact CA-O 3.28Å; G58-L125 WeakPolarHBondContact CA-O 3.42Å; S59-L125 PolarHBondContact N-O 2.66Å; A60-L125 HydrophobicContact CB-CB 4.2Å; A60-L125 HydrophobicContact CB-CD2 3.84Å; A60-L125 HydrophobicContact CB-CG 3.84Å; A60-L125 WeakPolarHBondContact CB-O 3.48Å; A60-L125 PolarHBondContact N-O 3.44Å; F65-L125 HydrophobicContact CB-CD2 4.28Å; F65-L125 WeakPolarHBondContact O-CD2 3.48Å; M90-L125 HydrophobicContact SD-CD1 4.48Å; Y94-L125 HydrophobicContact CD1-CD2 4.22Å; Y94-L125 HydrophobicContact CD1-CG 4.46Å; Y94-L125 HydrophobicContact CG-CD2 4.48Å
126	E	94.8	Very high	90.6	Very high	50 Å²	50	54.7 Å²	54.7	23%	0.234	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	138.9	-176.7	-68	-61.7	147.4	0	0	111.8	G58 S59 Y94 R95	G58-E126 WeakPolarHBondContact CA-OE1 3.43Å; S59-E126 WeakPolarHBondContact CB-OE2 3.48Å; S59-E126 PolarHBondContact N-OE1 2.94Å; S59-E126 PolarHBondContact N-OE2 2.82Å; S59-E126 PolarHBondContact OG-OE2 3.33Å; Y94-E126 WeakPolarHBondContact CA-O 3.41Å; R95-E126 HydrophobicContact CG-CB 3.93Å; R95-E126 PolarHBondContact N-O 3.45Å; R95-E126 PolarHBondContact O-N 2.91Å
127	L	93.3	Very high	89.1	Confident	25 Å²	25	51.7 Å²	51.7	13%	0.131	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	127.7	170	-81.7	157.1	0	0	0	110	S59 A60 Y94 K132 T135	S59-L127 WeakPolarHBondContact O-CD1 3.36Å; S59-L127 PolarHBondContact OG-N 2.91Å; A60-L127 HydrophobicContact CB-CD1 4.47Å; A60-L127 HydrophobicContact CB-CG 3.84Å; Y94-L127 HydrophobicContact CD1-CD2 4.19Å; Y94-L127 HydrophobicContact CE1-CD2 3.83Å; L127-K132 HydrophobicContact CB-CG 3.95Å; L127-K132 WeakPolarHBondContact O-CE 3.46Å; L127-T135 HydrophobicContact CD2-CG2 4.44Å
128	T	93.5	Very high	87.5	Confident	12 Å²	12	53.9 Å²	53.9	7%	0.074	28%	0.275	C	S	.	.			trans	-73.2	170.3	169.6	69.5	0	0	0	0	110.6	N92 A93 Y94 R95 E130 G131 K132	N92-T128 WeakPolarHBondContact O-CB 3.47Å; N92-T128 WeakPolarHBondContact O-CG2 3.46Å; N92-T128 PolarHBondContact O-OG1 3.29Å; A93-T128 VanDerWaalsContact C-OG1 3.28Å; A93-T128 WeakPolarHBondContact CA-OG1 2.84Å; A93-T128 PolarHBondContact O-N 3.45Å; A93-T128 PolarHBondContact O-OG1 3.24Å; Y94-T128 WeakPolarHBondContact O-CG2 3.45Å; R95-T128 HydrophobicContact CB-CG2 4.06Å; R95-T128 HydrophobicContact CG-CG2 4.04Å; T128-E130 PolarHBondContact O-N 2.97Å; T128-E130 PolarHBondContact OG1-N 3.07Å; T128-G131 PolarHBondContact O-N 2.86Å; T128-G131 VanDerWaalsContact O-N 3.13Å; T128-G131 PolarHBondContact OG1-N 2.85Å; T128-K132 WeakPolarHBondContact O-CG 3.44Å; T128-K132 PolarHBondContact O-N 2.86Å
129	Q	91.3	Very high	85.8	Confident	117 Å²	117	55.1 Å²	55.1	55%	0.547	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-32.6	175.7	-167.6	65.5	-1.3	0	0	112.1	R133	Q129-R133 WeakPolarHBondContact O-CG 3.31Å; Q129-R133 PolarHBondContact O-N 2.84Å; Q129-R133 VanDerWaalsContact O-N 3.1Å
130	E	88.7	Confident	84.1	Confident	102 Å²	102	60.2 Å²	60.2	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-68.2	-45.2	174.3	-63	-177.7	-171.7	0	0	111.3	N92 T128 K132 R133 K134	N92-E130 VanDerWaalsContact CB-OE2 3.32Å; N92-E130 WeakPolarHBondContact CB-OE2 3.36Å; T128-E130 PolarHBondContact O-N 2.97Å; T128-E130 PolarHBondContact OG1-N 3.07Å; E130-K132 PolarHBondContact O-N 3.02Å; E130-R133 PolarHBondContact O-N 2.76Å; E130-K134 WeakPolarHBondContact O-CG 3.26Å; E130-K134 PolarHBondContact O-N 3.14Å
131	G	87.8	Confident	82.3	Confident	2 Å²	2	61.2 Å²	61.2	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-58.6	-45.6	175	0	0	0	0	0	112.2	T128 R133 K134 T135	T128-G131 PolarHBondContact O-N 2.86Å; T128-G131 VanDerWaalsContact O-N 3.13Å; T128-G131 PolarHBondContact OG1-N 2.85Å; G131-R133 VanDerWaalsContact C-N 3.33Å; G131-R133 PolarHBondContact O-N 2.9Å; G131-K134 PolarHBondContact O-N 3.47Å; G131-T135 WeakPolarHBondContact O-CG2 3.42Å; G131-T135 PolarHBondContact O-N 3.03Å; G131-T135 PolarHBondContact O-OG1 3.23Å
132	K	88.9	Confident	80.4	Confident	100 Å²	100	63 Å²	63	44%	0.435	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-38.4	177	-68.3	177.4	-174.2	-179.2	0	112.8	L127 T128 E130 T135 L136	L127-K132 HydrophobicContact CB-CG 3.95Å; L127-K132 WeakPolarHBondContact O-CE 3.46Å; T128-K132 WeakPolarHBondContact O-CG 3.44Å; T128-K132 PolarHBondContact O-N 2.86Å; E130-K132 PolarHBondContact O-N 3.02Å; K132-T135 WeakPolarHBondContact CA-OG1 3.35Å; K132-T135 PolarHBondContact O-OG1 3.23Å; K132-T135 VanDerWaalsContact O-OG1 3.05Å; K132-L136 VanDerWaalsContact O-CB 3.25Å; K132-L136 WeakPolarHBondContact O-CB 3.12Å; K132-L136 PolarHBondContact O-N 3.1Å
133	R	86.4	Confident	78.6	Confident	167 Å²	167	65.5 Å²	65.5	63%	0.63	36%	0.359	S	S	*	.	H	α-helix	trans	-67	-42.8	175.4	-75.7	176	179	165.4	-0.1	111.5	Q129 E130 G131 L136 S137	Q129-R133 WeakPolarHBondContact O-CG 3.31Å; Q129-R133 PolarHBondContact O-N 2.84Å; Q129-R133 VanDerWaalsContact O-N 3.1Å; E130-R133 PolarHBondContact O-N 2.76Å; G131-R133 VanDerWaalsContact C-N 3.33Å; G131-R133 PolarHBondContact O-N 2.9Å; R133-L136 PolarHBondContact O-N 3.21Å; R133-S137 WeakPolarHBondContact O-CB 3.38Å; R133-S137 PolarHBondContact O-N 2.95Å; R133-S137 PolarHBondContact O-OG 2.8Å; R133-S137 VanDerWaalsContact O-OG 3.09Å
134	K	80.9	Confident	76.9	Confident	94 Å²	94	67.4 Å²	67.4	41%	0.409	38%	0.375	S	S	.	.	H	α-helix	trans	-61.5	-45.8	176	-70.7	177.2	-176.7	177.5	0	111.4	D91 E130 G131 S137 S138	D91-K134 IonicContact OD1-NZ 3.02Å; D91-K134 PolarHBondContact OD1-NZ 2.79Å; D91-K134 IonicContact OD2-NZ 2.84Å; E130-K134 WeakPolarHBondContact O-CG 3.26Å; E130-K134 PolarHBondContact O-N 3.14Å; G131-K134 PolarHBondContact O-N 3.47Å; K134-S137 WeakPolarHBondContact CA-OG 3.06Å; K134-S137 PolarHBondContact O-N 2.92Å; K134-S137 PolarHBondContact O-OG 2.81Å; K134-S138 WeakPolarHBondContact O-CB 3.42Å; K134-S138 PolarHBondContact O-N 3.41Å; K134-S138 PolarHBondContact O-OG 2.96Å
135	T	74.6	Confident	75.1	Confident	79 Å²	79	69.9 Å²	69.9	49%	0.485	39%	0.393	S	S	.	.	H	α-helix	trans	-67.6	-38.7	179	56.7	0	0	0	0	112	L127 G131 K132 G139	L127-T135 HydrophobicContact CD2-CG2 4.44Å; G131-T135 WeakPolarHBondContact O-CG2 3.42Å; G131-T135 PolarHBondContact O-N 3.03Å; G131-T135 PolarHBondContact O-OG1 3.23Å; K132-T135 WeakPolarHBondContact CA-OG1 3.35Å; K132-T135 PolarHBondContact O-OG1 3.23Å; K132-T135 VanDerWaalsContact O-OG1 3.05Å; T135-G139 PolarHBondContact O-N 3.23Å
136	L	70.6	Confident	73.3	Confident	115 Å²	115	71.5 Å²	71.5	60%	0.602	41%	0.41	S	S	*	.	H	α-helix	trans	-67.5	-43.2	175.1	-166.6	81.6	0	0	0	111.8	K132 R133 G139 L140	K132-L136 VanDerWaalsContact O-CB 3.25Å; K132-L136 WeakPolarHBondContact O-CB 3.12Å; K132-L136 PolarHBondContact O-N 3.1Å; R133-L136 PolarHBondContact O-N 3.21Å; L136-G139 PolarHBondContact O-N 2.84Å; L136-L140 WeakPolarHBondContact O-CB 3.49Å; L136-L140 PolarHBondContact O-N 2.7Å
137	S	61.6	Low	71.6	Confident	72 Å²	72	74 Å²	74	50%	0.503	42%	0.424	S	S	.	.	H	α-helix	trans	-67.8	-35.1	177.9	64.5	0	0	0	0	112.2	R133 K134 G141	R133-S137 WeakPolarHBondContact O-CB 3.38Å; R133-S137 PolarHBondContact O-N 2.95Å; R133-S137 PolarHBondContact O-OG 2.8Å; R133-S137 VanDerWaalsContact O-OG 3.09Å; K134-S137 WeakPolarHBondContact CA-OG 3.06Å; K134-S137 PolarHBondContact O-N 2.92Å; K134-S137 PolarHBondContact O-OG 2.81Å; S137-G141 WeakPolarHBondContact O-CA 3.47Å; S137-G141 PolarHBondContact O-N 3.31Å
138	S	60.6	Low	70	Confident	87 Å²	87	78.6 Å²	78.6	61%	0.608	44%	0.443	S	S	*	.	H	α-helix	trans	-72.6	-35.6	173.8	-62.5	0	0	0	0	111.8	K134 G142	K134-S138 WeakPolarHBondContact O-CB 3.42Å; K134-S138 PolarHBondContact O-N 3.41Å; K134-S138 PolarHBondContact O-OG 2.96Å; S138-G142 WeakPolarHBondContact O-CA 3.46Å; S138-G142 PolarHBondContact O-N 2.87Å
139	G	58.7	Low	68.3	Low	32 Å²	32	81.5 Å²	81.5	33%	0.33	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-71.4	171.4	0	0	0	0	0	110.2	T135 L136 G141 G142 L143	T135-G139 PolarHBondContact O-N 3.23Å; L136-G139 PolarHBondContact O-N 2.84Å; G139-G141 PolarHBondContact O-N 2.98Å; G139-G142 PolarHBondContact O-N 3.24Å; G139-G142 VanDerWaalsContact O-N 3.08Å; G139-L143 WeakPolarHBondContact O-CD2 3.5Å; G139-L143 WeakPolarHBondContact O-CG 3.3Å; G139-L143 PolarHBondContact O-N 2.61Å
140	L	59.7	Low	66.5	Low	113 Å²	113	80.7 Å²	80.7	59%	0.592	47%	0.472	S	S	*	.	H	α-helix	trans	-62.1	-38.2	-177.1	-121.7	140.4	0	0	0	113.4	L136 L143 A144	L136-L140 WeakPolarHBondContact O-CB 3.49Å; L136-L140 PolarHBondContact O-N 2.7Å; L140-L143 PolarHBondContact O-N 3.49Å; L140-A144 WeakPolarHBondContact O-CB 3.23Å; L140-A144 PolarHBondContact O-N 2.03Å
141	G	57.4	Low	64.8	Low	29 Å²	29	81.4 Å²	81.4	30%	0.299	47%	0.474	S	S	.	.	H	α-helix	trans	-70.3	-30.2	174.4	0	0	0	0	0	112.6	S137 G139 S145	S137-G141 WeakPolarHBondContact O-CA 3.47Å; S137-G141 PolarHBondContact O-N 3.31Å; G139-G141 PolarHBondContact O-N 2.98Å; G141-S145 WeakPolarHBondContact O-CA 3.46Å; G141-S145 WeakPolarHBondContact O-CB 3.39Å; G141-S145 PolarHBondContact O-N 3.34Å; G141-S145 PolarHBondContact O-OG 2.83Å
142	G	56.7	Low	63.2	Low	40 Å²	40	87.4 Å²	87.4	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-70.3	-39.4	170.2	0	0	0	0	0	112.5	S138 G139 G146	S138-G142 WeakPolarHBondContact O-CA 3.46Å; S138-G142 PolarHBondContact O-N 2.87Å; G139-G142 PolarHBondContact O-N 3.24Å; G139-G142 VanDerWaalsContact O-N 3.08Å; G142-G146 PolarHBondContact O-N 3.11Å
143	L	59.5	Low	61.2	Low	113 Å²	113	85.7 Å²	85.7	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-70.4	-45.2	176.4	-22.8	-178.6	0	0	0	109.8	G139 L140 G146 L147	G139-L143 WeakPolarHBondContact O-CD2 3.5Å; G139-L143 WeakPolarHBondContact O-CG 3.3Å; G139-L143 PolarHBondContact O-N 2.61Å; L140-L143 PolarHBondContact O-N 3.49Å; L143-G146 PolarHBondContact O-N 2.83Å; L143-L147 WeakPolarHBondContact O-CB 3.1Å; L143-L147 WeakPolarHBondContact O-CD1 3.26Å; L143-L147 WeakPolarHBondContact O-CG 3.04Å; L143-L147 PolarHBondContact O-N 2.97Å
144	A	58.8	Low	59.2	Low	42 Å²	42	85.1 Å²	85.1	35%	0.347	52%	0.519	S	S	.	.	H	α-helix	trans	-64.4	-41.8	176.6	0	0	0	0	0	111.2	L140 F148	L140-A144 WeakPolarHBondContact O-CB 3.23Å; L140-A144 PolarHBondContact O-N 2.03Å; A144-F148 VanDerWaalsContact O-CB 3.23Å; A144-F148 WeakPolarHBondContact O-CB 3.41Å; A144-F148 WeakPolarHBondContact O-CD2 3.44Å; A144-F148 PolarHBondContact O-N 2.03Å
145	S	57.6	Low	57.5	Low	76 Å²	76	88.1 Å²	88.1	53%	0.531	53%	0.532	S	S	.	.	H	α-helix	trans	-71.7	-35.3	177.8	-59.9	0	0	0	0	112.5	G141 F148 S149	G141-S145 WeakPolarHBondContact O-CA 3.46Å; G141-S145 WeakPolarHBondContact O-CB 3.39Å; G141-S145 PolarHBondContact O-N 3.34Å; G141-S145 PolarHBondContact O-OG 2.83Å; S145-F148 PolarHBondContact O-N 3.39Å; S145-S149 VanDerWaalsContact O-CB 3.23Å; S145-S149 WeakPolarHBondContact O-CB 3.44Å; S145-S149 PolarHBondContact O-N 2.81Å; S145-S149 PolarHBondContact O-OG 3.36Å; S145-S149 VanDerWaalsContact O-OG 3.05Å
146	G	57.5	Low	56	Low	34 Å²	34	95.5 Å²	95.5	35%	0.351	55%	0.551	S	S	.	*	H	α-helix	trans	-69.8	-35.5	174.4	0	0	0	0	0	112.7	G142 L143 S149 S150	G142-G146 PolarHBondContact O-N 3.11Å; L143-G146 PolarHBondContact O-N 2.83Å; G146-S149 PolarHBondContact O-OG 3.13Å; G146-S149 VanDerWaalsContact O-OG 3.09Å; G146-S150 WeakPolarHBondContact O-CB 3.35Å; G146-S150 PolarHBondContact O-N 2.86Å; G146-S150 PolarHBondContact O-OG 2.91Å
147	L	60.3	Low	54.4	Low	102 Å²	102	97.8 Å²	97.8	53%	0.534	56%	0.558	S	S	.	*	H	α-helix	trans	-68	-52.3	169	-71	166.5	0	0	0	110.1	L143 S149 S150 F151	L143-L147 WeakPolarHBondContact O-CB 3.1Å; L143-L147 WeakPolarHBondContact O-CD1 3.26Å; L143-L147 WeakPolarHBondContact O-CG 3.04Å; L143-L147 PolarHBondContact O-N 2.97Å; L147-S149 PolarHBondContact O-N 2.86Å; L147-S150 WeakPolarHBondContact O-CB 3.45Å; L147-S150 PolarHBondContact O-N 3.12Å; L147-F151 HydrophobicContact CB-CD2 4.49Å; L147-F151 HydrophobicContact CD2-CE2 4.23Å; L147-F151 WeakPolarHBondContact O-CD2 3.29Å; L147-F151 PolarHBondContact O-N 3.43Å
148	F	59.3	Low	53.3	Low	122 Å²	122	103.3 Å²	103.3	54%	0.535	58%	0.576	S	S	.	*	H	α-helix	trans	-62.1	-36.5	-179.8	-99.2	-95.5	0	0	0	113.1	A144 S145 S150 F151 F152	A144-F148 VanDerWaalsContact O-CB 3.23Å; A144-F148 WeakPolarHBondContact O-CB 3.41Å; A144-F148 WeakPolarHBondContact O-CD2 3.44Å; A144-F148 PolarHBondContact O-N 2.03Å; S145-F148 PolarHBondContact O-N 3.39Å; F148-S150 PolarHBondContact O-N 3.36Å; F148-F151 PolarHBondContact O-N 3.27Å; F148-F152 HydrophobicContact CB-CD2 4.43Å; F148-F152 HydrophobicContact CD1-CB 4.42Å; F148-F152 AromaticContact CD1-CD2 3.13Å; F148-F152 HydrophobicContact CD1-CD2 3.13Å; F148-F152 AromaticContact CD1-CE2 3.5Å; F148-F152 HydrophobicContact CD1-CE2 3.5Å; F148-F152 VanDerWaalsContact CD1-CE2 3.5Å; F148-F152 AromaticContact CD1-CG 3.99Å; F148-F152 HydrophobicContact CD1-CG 3.99Å; F148-F152 AromaticContact CE1-CD2 3.45Å; F148-F152 HydrophobicContact CE1-CD2 3.45Å; F148-F152 VanDerWaalsContact CE1-CD2 3.45Å; F148-F152 AromaticContact CE1-CE2 3.28Å; F148-F152 HydrophobicContact CE1-CE2 3.28Å; F148-F152 HydrophobicContact CE1-CG 4.31Å; F148-F152 HydrophobicContact CE1-CZ 4.07Å; F148-F152 AromaticContact CG-CD2 3.96Å; F148-F152 HydrophobicContact CG-CD2 3.96Å; F148-F152 HydrophobicContact CG-CE2 4.31Å; F148-F152 HydrophobicContact CZ-CD2 4.46Å; F148-F152 AromaticContact CZ-CE2 3.98Å; F148-F152 HydrophobicContact CZ-CE2 3.98Å; F148-F152 CarbonylContact O-C 3.21Å; F148-F152 WeakPolarHBondContact O-CA 3.46Å; F148-F152 WeakPolarHBondContact O-CB 3.38Å; F148-F152 PolarHBondContact O-N 3.41Å
149	S	57.3	Low	52.2	Low	74 Å²	74	107.8 Å²	107.8	52%	0.517	59%	0.587	S	S	.	*	H	α-helix	trans	-66.6	-30.4	175.2	62.8	0	0	0	0	112.2	S145 G146 L147	S145-S149 VanDerWaalsContact O-CB 3.23Å; S145-S149 WeakPolarHBondContact O-CB 3.44Å; S145-S149 PolarHBondContact O-N 2.81Å; S145-S149 PolarHBondContact O-OG 3.36Å; S145-S149 VanDerWaalsContact O-OG 3.05Å; G146-S149 PolarHBondContact O-OG 3.13Å; G146-S149 VanDerWaalsContact O-OG 3.09Å; L147-S149 PolarHBondContact O-N 2.86Å
150	S	54	Low	50.9	Low	100 Å²	100	117.2 Å²	117.2	70%	0.699	62%	0.615	S	S	*	*	H	α-helix	trans	-77.7	-27.9	177	-55.8	0	0	0	0	112.3	G146 L147 F148	G146-S150 WeakPolarHBondContact O-CB 3.35Å; G146-S150 PolarHBondContact O-N 2.86Å; G146-S150 PolarHBondContact O-OG 2.91Å; L147-S150 WeakPolarHBondContact O-CB 3.45Å; L147-S150 PolarHBondContact O-N 3.12Å; F148-S150 PolarHBondContact O-N 3.36Å
151	F	53.2	Low	50.1	Low	117 Å²	117	116.3 Å²	116.3	51%	0.513	62%	0.623	S	S	.	*	H	α-helix	trans	-97.6	-35.3	179.6	-72.7	-69.7	0	0	0	114.4	L147 F148 L176	L147-F151 HydrophobicContact CB-CD2 4.49Å; L147-F151 HydrophobicContact CD2-CE2 4.23Å; L147-F151 WeakPolarHBondContact O-CD2 3.29Å; L147-F151 PolarHBondContact O-N 3.43Å; F148-F151 PolarHBondContact O-N 3.27Å; F151-L176 HydrophobicContact CD1-CD1 4.14Å; F151-L176 HydrophobicContact CE1-CD1 4.44Å
152	F	53.5	Low	49.1	Very low	128 Å²	128	124 Å²	124	56%	0.561	65%	0.652	S	S	*	*	S	Bend	trans	-125	69.7	-177.9	-54.4	-89.5	0	0	0	107.7	F148 N154	F148-F152 HydrophobicContact CB-CD2 4.43Å; F148-F152 HydrophobicContact CD1-CB 4.42Å; F148-F152 AromaticContact CD1-CD2 3.13Å; F148-F152 HydrophobicContact CD1-CD2 3.13Å; F148-F152 AromaticContact CD1-CE2 3.5Å; F148-F152 HydrophobicContact CD1-CE2 3.5Å; F148-F152 VanDerWaalsContact CD1-CE2 3.5Å; F148-F152 AromaticContact CD1-CG 3.99Å; F148-F152 HydrophobicContact CD1-CG 3.99Å; F148-F152 AromaticContact CE1-CD2 3.45Å; F148-F152 HydrophobicContact CE1-CD2 3.45Å; F148-F152 VanDerWaalsContact CE1-CD2 3.45Å; F148-F152 AromaticContact CE1-CE2 3.28Å; F148-F152 HydrophobicContact CE1-CE2 3.28Å; F148-F152 HydrophobicContact CE1-CG 4.31Å; F148-F152 HydrophobicContact CE1-CZ 4.07Å; F148-F152 AromaticContact CG-CD2 3.96Å; F148-F152 HydrophobicContact CG-CD2 3.96Å; F148-F152 HydrophobicContact CG-CE2 4.31Å; F148-F152 HydrophobicContact CZ-CD2 4.46Å; F148-F152 AromaticContact CZ-CE2 3.98Å; F148-F152 HydrophobicContact CZ-CE2 3.98Å; F148-F152 CarbonylContact O-C 3.21Å; F148-F152 WeakPolarHBondContact O-CA 3.46Å; F148-F152 WeakPolarHBondContact O-CB 3.38Å; F148-F152 PolarHBondContact O-N 3.41Å; F152-N154 VanDerWaalsContact C-N 3.32Å; F152-N154 PolarHBondContact O-N 3.03Å
153	G	47	Very low	48.5	Very low	63 Å²	63	130.2 Å²	130.2	65%	0.649	68%	0.675	S	S	*	*			trans	-58.2	96.5	171.9	0	0	0	0	0	109.7	K155	G153-K155 PolarHBondContact O-N 3.42Å
154	N	45.4	Very low	47.7	Very low	156 Å²	156	128 Å²	128	83%	0.834	68%	0.679	S	S	*	*			trans	-72.8	97.3	172.6	-133.9	23	0	0	0	106.4	F152 R156	F152-N154 VanDerWaalsContact C-N 3.32Å; F152-N154 PolarHBondContact O-N 3.03Å; N154-R156 VanDerWaalsContact C-N 3.26Å; N154-R156 PolarHBondContact O-N 3.36Å
155	K	44.9	Very low	47.4	Very low	156 Å²	156	135.4 Å²	135.4	68%	0.678	71%	0.707	S	S	*	*			trans	-60.5	95.2	164	-75.2	-175.5	-178.1	-179.7	0	106.7	G153 H157	G153-K155 PolarHBondContact O-N 3.42Å; K155-H157 PolarHBondContact O-CD2 2.93Å; K155-H157 PolarHBondContact O-N 3.16Å
156	R	42.5	Very low	47	Very low	235 Å²	235	136.3 Å²	136.3	89%	0.887	71%	0.713	S	S	*	*			trans	-63.4	98.1	154	-91.8	-174.1	174.4	171.2	-0.8	105.4	N154 Q158	N154-R156 VanDerWaalsContact C-N 3.26Å; N154-R156 PolarHBondContact O-N 3.36Å; R156-Q158 VanDerWaalsContact C-N 3.31Å; R156-Q158 PolarHBondContact O-N 2.82Å
157	H	36.8	Very low	47	Very low	162 Å²	162	139.6 Å²	139.6	75%	0.75	73%	0.731	S	S	*	*			trans	-55.9	95.9	167.3	-73.5	-94.7	0	0	0	108.1	K155	K155-H157 PolarHBondContact O-CD2 2.93Å; K155-H157 PolarHBondContact O-N 3.16Å
158	Q	38	Very low	46.8	Very low	189 Å²	189	137.1 Å²	137.1	88%	0.883	73%	0.73	S	S	*	*			trans	-85.7	120.7	141.6	-82.2	-147.7	-29.6	0	0	106.3	R156 Y160	R156-Q158 VanDerWaalsContact C-N 3.31Å; R156-Q158 PolarHBondContact O-N 2.82Å; Q158-Y160 PolarHBondContact O-N 3.45Å
159	H	37.2	Very low	46.7	Very low	180 Å²	180	133.8 Å²	133.8	83%	0.833	73%	0.73	S	S	*	*			trans	-49.3	110.6	175.9	-74.5	-99	0	0	0	110.5
160	Y	33.1	Very low	46.8	Very low	231 Å²	231	137.2 Å²	137.2	91%	0.906	74%	0.742	S	S	*	*			trans	-153.8	124.9	143.5	-115.8	-84.4	0	0	0	107.8	Q158	Q158-Y160 PolarHBondContact O-N 3.45Å
161	A	42.3	Very low	47.5	Very low	94 Å²	94	138.2 Å²	138.2	78%	0.777	74%	0.739	S	S	*	*			trans	-68.9	126.1	-177.9	0	0	0	0	0	110.6
162	Q	36.5	Very low	48.3	Very low	191 Å²	191	134 Å²	134	89%	0.893	73%	0.728	S	S	*	*			trans	-170.2	138	131.3	-119.7	-179.2	-40.9	0	0	110.8
163	D	44.2	Very low	49.4	Very low	169 Å²	169	132.1 Å²	132.1	90%	0.904	73%	0.727	S	S	*	*			trans	-57.3	142.6	-180	-58.9	-62.6	0	0	0	113.1
164	G	41.9	Very low	50.9	Low	66 Å²	66	131.4 Å²	131.4	68%	0.68	72%	0.715	S	S	*	*			trans	177.6	95.3	175.2	0	0	0	0	0	110	S166	G164-S166 PolarHBondContact O-N 3.34Å
165	E	52.9	Low	52.7	Low	198 Å²	198	127.3 Å²	127.3	93%	0.925	70%	0.695	S	S	*	*			trans	-52.9	109.5	176.5	-68.5	178.1	111.9	0	0	110.6	S167	E165-S167 PolarHBondContact O-N 2.95Å
166	S	48.7	Very low	54.5	Low	96 Å²	96	124 Å²	124	67%	0.671	69%	0.685	S	S	*	*			trans	-93.7	94.8	-179.6	-167.9	0	0	0	0	109.6	G164 G168	G164-S166 PolarHBondContact O-N 3.34Å; S166-G168 PolarHBondContact O-N 2.85Å; S166-G168 VanDerWaalsContact O-N 3.13Å
167	S	57.3	Low	56.5	Low	102 Å²	102	118.3 Å²	118.3	71%	0.713	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	5.7	178.4	52.2	0	0	0	0	115	E165	E165-S167 PolarHBondContact O-N 2.95Å
168	G	56.9	Low	58.8	Low	50 Å²	50	116.3 Å²	116.3	52%	0.515	67%	0.665	S	S	.	*	H	α-helix	trans	-77.6	-26.5	-177.5	0	0	0	0	0	115.2	S166	S166-G168 PolarHBondContact O-N 2.85Å; S166-G168 VanDerWaalsContact O-N 3.13Å
169	G	57.8	Low	61.1	Low	52 Å²	52	111.9 Å²	111.9	54%	0.536	65%	0.647	S	S	.	*	H	α-helix	trans	-73.7	-32.5	-178.5	0	0	0	0	0	113.8	V173	G169-V173 WeakPolarHBondContact O-CG2 2.68Å; G169-V173 PolarHBondContact O-N 3.34Å
170	L	59.6	Low	63.3	Low	146 Å²	146	105.9 Å²	105.9	76%	0.764	63%	0.629	S	S	*	*	H	α-helix	trans	-69.6	-35.5	-178.2	-152.9	91	0	0	0	111.9	V173 A174	L170-V173 PolarHBondContact O-N 3.22Å; L170-A174 WeakPolarHBondContact O-CB 3.02Å; L170-A174 PolarHBondContact O-N 3.13Å
171	L	66.9	Low	65.9	Low	121 Å²	121	101.6 Å²	101.6	63%	0.634	61%	0.612	S	S	*	*	H	α-helix	trans	-68	-40.7	180	-123	162.6	0	0	0	111.6	A174 V175	L171-A174 PolarHBondContact O-N 2.85Å; L171-V175 HydrophobicContact CD2-CG2 4.47Å; L171-V175 WeakPolarHBondContact O-CG2 3.02Å; L171-V175 PolarHBondContact O-N 3.39Å
172	G	70.6	Confident	67.8	Low	29 Å²	29	99 Å²	99	30%	0.299	59%	0.594	S	S	.	*	H	α-helix	trans	-64.2	-41.9	176.2	0	0	0	0	0	112.9	V175 L176	G172-V175 PolarHBondContact O-N 2.92Å; G172-L176 PolarHBondContact O-N 2.04Å; G172-L176 VanDerWaalsContact O-N 3.08Å
173	V	77.1	Confident	70.1	Confident	89 Å²	89	94.1 Å²	94.1	54%	0.539	57%	0.574	S	S	.	*	H	α-helix	trans	-65	-41.4	175.9	176.1	0	0	0	0	111.2	G169 L170 L176 L177	G169-V173 WeakPolarHBondContact O-CG2 2.68Å; G169-V173 PolarHBondContact O-N 3.34Å; L170-V173 PolarHBondContact O-N 3.22Å; V173-L176 PolarHBondContact O-N 3.35Å; V173-L177 HydrophobicContact CG1-CD1 4.09Å; V173-L177 WeakPolarHBondContact O-CG 3.4Å; V173-L177 PolarHBondContact O-N 2.85Å
174	A	78.4	Confident	71.9	Confident	48 Å²	48	92.5 Å²	92.5	40%	0.397	56%	0.556	S	S	.	*	H	α-helix	trans	-62.6	-42.8	177.3	0	0	0	0	0	112.5	L170 L171 L177 L178	L170-A174 WeakPolarHBondContact O-CB 3.02Å; L170-A174 PolarHBondContact O-N 3.13Å; L171-A174 PolarHBondContact O-N 2.85Å; A174-L177 PolarHBondContact O-N 3.11Å; A174-L178 WeakPolarHBondContact O-CG 3.41Å; A174-L178 PolarHBondContact O-N 3.3Å
175	V	83.9	Confident	73.3	Confident	69 Å²	69	93.9 Å²	93.9	42%	0.418	54%	0.543	S	S	.	.	H	α-helix	trans	-65.6	-40.7	177.5	172.9	0	0	0	0	111.4	L171 G172 L178 I179	L171-V175 HydrophobicContact CD2-CG2 4.47Å; L171-V175 WeakPolarHBondContact O-CG2 3.02Å; L171-V175 PolarHBondContact O-N 3.39Å; G172-V175 PolarHBondContact O-N 2.92Å; V175-L178 PolarHBondContact O-N 2.78Å; V175-I179 HydrophobicContact CG1-CD1 4Å; V175-I179 WeakPolarHBondContact O-CG1 3.29Å; V175-I179 PolarHBondContact O-N 3.3Å
176	L	81.8	Confident	74.2	Confident	87 Å²	87	91.1 Å²	91.1	46%	0.455	53%	0.534	S	S	.	.	H	α-helix	trans	-62.8	-41.6	175.8	-103.6	163.9	0	0	0	112.5	F151 G172 V173 L178 I179 A180	F151-L176 HydrophobicContact CD1-CD1 4.14Å; F151-L176 HydrophobicContact CE1-CD1 4.44Å; G172-L176 PolarHBondContact O-N 2.04Å; G172-L176 VanDerWaalsContact O-N 3.08Å; V173-L176 PolarHBondContact O-N 3.35Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-I179 PolarHBondContact O-N 2.8Å; L176-A180 WeakPolarHBondContact O-CB 3.23Å; L176-A180 PolarHBondContact O-N 2.93Å
177	L	85.3	Confident	75.3	Confident	115 Å²	115	94.2 Å²	94.2	60%	0.602	54%	0.535	S	S	*	.	H	α-helix	trans	-65.3	-36.1	175.7	-72.7	172.2	0	0	0	112.2	V173 A174 A180 Y181	V173-L177 HydrophobicContact CG1-CD1 4.09Å; V173-L177 WeakPolarHBondContact O-CG 3.4Å; V173-L177 PolarHBondContact O-N 2.85Å; A174-L177 PolarHBondContact O-N 3.11Å; L177-A180 PolarHBondContact O-N 3.37Å; L177-Y181 VanDerWaalsContact O-CB 3.23Å; L177-Y181 WeakPolarHBondContact O-CB 3.41Å; L177-Y181 PolarHBondContact O-N 3.47Å
178	L	83.6	Confident	75.6	Confident	120 Å²	120	94.8 Å²	94.8	63%	0.628	53%	0.53	S	S	*	.	H	α-helix	trans	-67.4	-40.5	174.9	-73.3	173.5	0	0	0	112.5	A174 V175 L176 Y181 G182	A174-L178 WeakPolarHBondContact O-CG 3.41Å; A174-L178 PolarHBondContact O-N 3.3Å; V175-L178 PolarHBondContact O-N 2.78Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L178-Y181 PolarHBondContact O-N 2.66Å; L178-G182 PolarHBondContact O-N 2.88Å
179	I	86.5	Confident	75.6	Confident	97 Å²	97	95.8 Å²	95.8	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-65.6	-45.4	175.4	-66.2	167.4	0	0	0	110.1	V175 L176 Y181 G182 I183	V175-I179 HydrophobicContact CG1-CD1 4Å; V175-I179 WeakPolarHBondContact O-CG1 3.29Å; V175-I179 PolarHBondContact O-N 3.3Å; L176-I179 PolarHBondContact O-N 2.8Å; I179-Y181 VanDerWaalsContact C-N 3.33Å; I179-Y181 PolarHBondContact O-N 2.73Å; I179-G182 PolarHBondContact O-N 3.13Å; I179-I183 HydrophobicContact CG2-CD1 4.01Å; I179-I183 WeakPolarHBondContact O-CG1 3.33Å; I179-I183 PolarHBondContact O-N 2.94Å
180	A	84.9	Confident	75.7	Confident	54 Å²	54	96 Å²	96	45%	0.446	53%	0.532	S	S	.	.	H	α-helix	trans	-61.6	-40.2	176.1	0	0	0	0	0	112.1	L176 L177 I183 Y184	L176-A180 WeakPolarHBondContact O-CB 3.23Å; L176-A180 PolarHBondContact O-N 2.93Å; L177-A180 PolarHBondContact O-N 3.37Å; A180-I183 PolarHBondContact O-N 2.79Å; A180-Y184 VanDerWaalsContact O-CB 3.26Å; A180-Y184 WeakPolarHBondContact O-CB 3.4Å; A180-Y184 PolarHBondContact O-N 2.8Å
181	Y	85.8	Confident	75.4	Confident	140 Å²	140	96.5 Å²	96.5	55%	0.549	54%	0.535	S	S	.	.	H	α-helix	trans	-67.1	-38.6	174.9	-179.9	-105.9	0	0	0	112.5	L177 L178 I179 Y184 K185	L177-Y181 VanDerWaalsContact O-CB 3.23Å; L177-Y181 WeakPolarHBondContact O-CB 3.41Å; L177-Y181 PolarHBondContact O-N 3.47Å; L178-Y181 PolarHBondContact O-N 2.66Å; I179-Y181 VanDerWaalsContact C-N 3.33Å; I179-Y181 PolarHBondContact O-N 2.73Å; Y181-Y184 HydrophobicContact CD2-CD1 4.38Å; Y181-Y184 HydrophobicContact CE2-CD1 4.5Å; Y181-Y184 PolarHBondContact O-N 3.37Å; Y181-K185 HydrophobicContact CD1-CG 4.33Å; Y181-K185 HydrophobicContact CD2-CG 4.35Å; Y181-K185 HydrophobicContact CE1-CG 3.86Å; Y181-K185 HydrophobicContact CE2-CD 4.21Å; Y181-K185 HydrophobicContact CE2-CG 3.87Å; Y181-K185 WeakPolarHBondContact O-CB 3.25Å; Y181-K185 WeakPolarHBondContact O-CG 3.32Å; Y181-K185 PolarHBondContact O-N 3.17Å
182	G	82.3	Confident	74.3	Confident	40 Å²	40	97.5 Å²	97.5	41%	0.412	55%	0.546	S	S	.	.	H	α-helix	trans	-61.9	-45.1	174.2	0	0	0	0	0	112	L178 I179 K185 L186	L178-G182 PolarHBondContact O-N 2.88Å; I179-G182 PolarHBondContact O-N 3.13Å; G182-K185 PolarHBondContact O-N 2.87Å; G182-L186 VanDerWaalsContact O-CB 3.27Å; G182-L186 WeakPolarHBondContact O-CB 3.36Å; G182-L186 PolarHBondContact O-N 2.65Å
183	I	85.6	Confident	73.1	Confident	89 Å²	89	100.9 Å²	100.9	46%	0.456	57%	0.571	S	S	.	*	H	α-helix	trans	-63.3	-48.4	173.8	-67.2	171	0	0	0	109.9	I179 A180 K185 L186 F187	I179-I183 HydrophobicContact CG2-CD1 4.01Å; I179-I183 WeakPolarHBondContact O-CG1 3.33Å; I179-I183 PolarHBondContact O-N 2.94Å; A180-I183 PolarHBondContact O-N 2.79Å; I183-K185 VanDerWaalsContact C-N 3.34Å; I183-K185 PolarHBondContact O-N 3.11Å; I183-L186 PolarHBondContact O-N 2.75Å; I183-L186 VanDerWaalsContact O-N 3.13Å; I183-F187 HydrophobicContact CG2-CD2 3.55Å; I183-F187 HydrophobicContact CG2-CE2 3.77Å; I183-F187 VanDerWaalsContact O-CD2 3.24Å; I183-F187 WeakPolarHBondContact O-CD2 3.48Å; I183-F187 PolarHBondContact O-N 3.06Å
184	Y	81.7	Confident	71.2	Confident	135 Å²	135	104.5 Å²	104.5	53%	0.529	58%	0.582	S	S	.	*	H	α-helix	trans	-54	-48	176.3	173	-92.3	0	0	0	112	A180 Y181 F187 L188	A180-Y184 VanDerWaalsContact O-CB 3.26Å; A180-Y184 WeakPolarHBondContact O-CB 3.4Å; A180-Y184 PolarHBondContact O-N 2.8Å; Y181-Y184 HydrophobicContact CD2-CD1 4.38Å; Y181-Y184 HydrophobicContact CE2-CD1 4.5Å; Y181-Y184 PolarHBondContact O-N 3.37Å; Y184-F187 PolarHBondContact O-N 3.38Å; Y184-L188 HydrophobicContact CD2-CD1 3.28Å; Y184-L188 HydrophobicContact CE2-CD1 3.17Å; Y184-L188 HydrophobicContact CG-CD1 4.05Å; Y184-L188 VanDerWaalsContact O-CB 3.32Å; Y184-L188 WeakPolarHBondContact O-CB 3.2Å; Y184-L188 PolarHBondContact O-N 2.94Å
185	K	72.1	Confident	68.9	Low	94 Å²	94	114.6 Å²	114.6	41%	0.409	61%	0.61	S	S	.	*	H	α-helix	trans	-67.7	-37	178	-73	-71.4	-77.1	161.9	0	112.3	Y181 G182 I183 S189	Y181-K185 HydrophobicContact CD1-CG 4.33Å; Y181-K185 HydrophobicContact CD2-CG 4.35Å; Y181-K185 HydrophobicContact CE1-CG 3.86Å; Y181-K185 HydrophobicContact CE2-CD 4.21Å; Y181-K185 HydrophobicContact CE2-CG 3.87Å; Y181-K185 WeakPolarHBondContact O-CB 3.25Å; Y181-K185 WeakPolarHBondContact O-CG 3.32Å; Y181-K185 PolarHBondContact O-N 3.17Å; G182-K185 PolarHBondContact O-N 2.87Å; I183-K185 VanDerWaalsContact C-N 3.34Å; I183-K185 PolarHBondContact O-N 3.11Å; K185-S189 PolarHBondContact NZ-OG 2.8Å; K185-S189 WeakPolarHBondContact O-CA 3.41Å; K185-S189 WeakPolarHBondContact O-CB 3.33Å; K185-S189 PolarHBondContact O-N 2.57Å; K185-S189 PolarHBondContact O-OG 3.28Å; K185-S189 VanDerWaalsContact O-OG 3.05Å
186	L	72.4	Confident	66.5	Low	141 Å²	141	114.7 Å²	114.7	74%	0.738	63%	0.625	S	S	*	*	H	α-helix	trans	-68.5	-34.5	178.7	-162	77.5	0	0	0	112.6	G182 I183	G182-L186 VanDerWaalsContact O-CB 3.27Å; G182-L186 WeakPolarHBondContact O-CB 3.36Å; G182-L186 PolarHBondContact O-N 2.65Å; I183-L186 PolarHBondContact O-N 2.75Å; I183-L186 VanDerWaalsContact O-N 3.13Å
187	F	70.7	Confident	64.2	Low	160 Å²	160	119.8 Å²	119.8	70%	0.702	65%	0.647	S	S	*	*	H	α-helix	trans	-93	-21	-178.5	-76.4	-79.6	0	0	0	114.4	I183 Y184	I183-F187 HydrophobicContact CG2-CD2 3.55Å; I183-F187 HydrophobicContact CG2-CE2 3.77Å; I183-F187 VanDerWaalsContact O-CD2 3.24Å; I183-F187 WeakPolarHBondContact O-CD2 3.48Å; I183-F187 PolarHBondContact O-N 3.06Å; Y184-F187 PolarHBondContact O-N 3.38Å
188	L	62.8	Low	61.7	Low	115 Å²	115	121.2 Å²	121.2	60%	0.602	66%	0.66	S	S	*	*	H	α-helix	trans	-114.8	-8.5	-179.4	-73.2	147.9	0	0	0	114.8	Y184 G190	Y184-L188 HydrophobicContact CD2-CD1 3.28Å; Y184-L188 HydrophobicContact CE2-CD1 3.17Å; Y184-L188 HydrophobicContact CG-CD1 4.05Å; Y184-L188 VanDerWaalsContact O-CB 3.32Å; Y184-L188 WeakPolarHBondContact O-CB 3.2Å; Y184-L188 PolarHBondContact O-N 2.94Å; L188-G190 VanDerWaalsContact C-N 3.26Å; L188-G190 PolarHBondContact O-N 3.41Å
189	S	58.5	Low	59.1	Low	71 Å²	71	119.4 Å²	119.4	50%	0.497	67%	0.671	S	S	.	*			trans	-96.2	54	168.2	-47.5	0	0	0	0	110.1	K185	K185-S189 PolarHBondContact NZ-OG 2.8Å; K185-S189 WeakPolarHBondContact O-CA 3.41Å; K185-S189 WeakPolarHBondContact O-CB 3.33Å; K185-S189 PolarHBondContact O-N 2.57Å; K185-S189 PolarHBondContact O-OG 3.28Å; K185-S189 VanDerWaalsContact O-OG 3.05Å
190	G	59.7	Low	56.4	Low	57 Å²	57	118.8 Å²	118.8	59%	0.588	69%	0.689	S	S	*	*			trans	-93.8	131.3	155.8	0	0	0	0	0	108.3	L188	L188-G190 VanDerWaalsContact C-N 3.26Å; L188-G190 PolarHBondContact O-N 3.41Å
191	D	51.7	Low	53.8	Low	156 Å²	156	125.2 Å²	125.2	83%	0.834	71%	0.709	S	S	*	*			trans	82.3	89.1	174.2	-59.5	-33.2	0	0	0	119.2
192	T	44.5	Very low	51.7	Low	142 Å²	142	124.3 Å²	124.3	87%	0.871	72%	0.72	S	S	*	*			trans	-130.2	74.4	131.1	53	0	0	0	0	109.8	Q194	T192-Q194 VanDerWaalsContact C-N 3.28Å; T192-Q194 PolarHBondContact O-N 3.24Å
193	A	45.2	Very low	49.1	Very low	100 Å²	100	126.2 Å²	126.2	83%	0.826	74%	0.74	S	S	*	*			trans	-79.4	82.7	152.9	0	0	0	0	0	108
194	Q	38.3	Very low	46.2	Very low	165 Å²	165	132.9 Å²	132.9	77%	0.771	76%	0.761	S	S	*	*			trans	-90.8	124.8	155.9	-95.5	-171.9	-5.8	0	0	106.6	T192	T192-Q194 VanDerWaalsContact C-N 3.28Å; T192-Q194 PolarHBondContact O-N 3.24Å
195	W	29.6	Very low	44.4	Very low	259 Å²	259	131.1 Å²	131.1	98%	0.981	77%	0.766	S	S	*	*			trans	-179.7	97.2	133.5	-85.6	111.1	0	0	0	108
196	G	32.6	Very low	42.4	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	78%	0.778	S	S	*	*			trans	-157.9	92	168.2	0	0	0	0	0	109.7
197	Q	34.2	Very low	40.4	Very low	195 Å²	195	133.5 Å²	133.5	91%	0.911	78%	0.779	S	S	*	*			trans	-146.4	142.7	153.2	-77.3	-157.7	-2.9	0	0	110.9
198	T	33.1	Very low	38.4	Very low	144 Å²	144	131.1 Å²	131.1	88%	0.883	77%	0.774	S	S	*	*			trans	-79.6	151.3	-164	37.9	0	0	0	0	116.1
199	G	29.9	Very low	36.9	Very low	83 Å²	83	133.5 Å²	133.5	86%	0.856	78%	0.782	S	S	*	*			trans	131.8	118.1	141.1	0	0	0	0	0	118.5
200	G	28.5	Very low	36.2	Very low	84 Å²	84	134.4 Å²	134.4	87%	0.866	79%	0.786	S	S	*	*			trans	97.2	115	145.5	0	0	0	0	0	120
201	Q	29.9	Very low	34.9	Very low	188 Å²	188	138.7 Å²	138.7	88%	0.879	80%	0.796	S	S	*	*			trans	-82	177.4	156.7	-76.4	-115.5	-53.4	0	0	110.8
202	P	41.8	Very low	34	Very low	121 Å²	121	139.2 Å²	139.2	79%	0.786	80%	0.798	S	S	*	*			cis	-133.5	171.7	-8.7	33.4	-12.9	0	0	0	115.4
203	G	27.9	Very low	33.5	Very low	80 Å²	80	141 Å²	141	83%	0.825	80%	0.799	S	S	*	*			trans	162.2	112.3	160.2	0	0	0	0	0	117.4
204	Y	26	Very low	33.1	Very low	230 Å²	230	139.8 Å²	139.8	90%	0.902	80%	0.796	S	S	*	*			trans	-84.4	-179.8	168.3	-100.1	-90.4	0	0	0	111.5
205	P	43.6	Very low	33.3	Very low	97 Å²	97	135 Å²	135	63%	0.63	79%	0.791	S	S	*	*			cis	-136.4	180	-11.7	34.7	-14.1	0	0	0	116.1
206	Q	30.6	Very low	34.5	Very low	143 Å²	143	128.6 Å²	128.6	67%	0.668	78%	0.782	S	S	*	*			trans	72.4	135.8	152	-119.8	68.4	-8	0	0	117.5
207	D	28.4	Very low	35.7	Very low	142 Å²	142	130.2 Å²	130.2	76%	0.759	78%	0.78	S	S	*	*				-158.4	142.6	52.2	-83.1	-56.9	0	0	0	115.9
208	N	30	Very low	36.5	Very low	111 Å²	111	126 Å²	126	59%	0.594	77%	0.769	S	S	*	*			trans	-2.4	126.9	152.3	-68.3	-49.5	0	0	0	124
209	H	31.2	Very low	37.6	Very low	165 Å²	165	125.9 Å²	125.9	76%	0.764	77%	0.771	S	S	*	*				53.7	164.4	125.1	-68.9	91.3	0	0	0	121.5
210	P	43.3	Very low	38.7	Very low	90 Å²	90	125.8 Å²	125.8	58%	0.584	77%	0.77	S	S	*	*			cis	-139.7	175.9	-46.3	40.3	-23.2	0	0	0	113.7
211	N	31.8	Very low	39.6	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	77%	0.766	S	S	*	*			trans	68.4	116.1	153	-55.7	-28	0	0	0	119.9
212	N	32.8	Very low	40.6	Very low	166 Å²	166	128.7 Å²	128.7	89%	0.888	76%	0.757	S	S	*	*			trans	-145.5	90.6	142	-121.7	-9.3	0	0	0	112.4
213	M	35	Very low	41	Very low	181 Å²	181	127.8 Å²	127.8	89%	0.892	75%	0.751	S	S	*	*			trans	19.4	101.1	135.2	-145.2	72.3	161.2	0	0	118.1
214	G	37.2	Very low	42.1	Very low	74 Å²	74	130.3 Å²	130.3	76%	0.763	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-99.5	124.4	156.9	0	0	0	0	0	109.6
215	G	42.5	Very low	43.3	Very low	64 Å²	64	129.5 Å²	129.5	66%	0.66	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-65.6	170.9	-172.3	0	0	0	0	0	115.8
216	P	54.6	Low	43.5	Very low	124 Å²	124	130.2 Å²	130.2	81%	0.805	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-66.7	141.5	-176.3	26.8	-33.4	0	0	0	112
217	P	58.7	Low	43.9	Very low	105 Å²	105	127.1 Å²	127.1	68%	0.682	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-68.5	152.5	174.2	28.4	-33.6	0	0	0	111.6
218	P	50.7	Low	44.3	Very low	106 Å²	106	131 Å²	131	69%	0.688	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-63.2	150.7	-179	23.9	-32.4	0	0	0	112.6	G220	P218-G220 PolarHBondContact O-N 3.4Å
219	P	54.8	Low	44.7	Very low	142 Å²	142	131.8 Å²	131.8	92%	0.922	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	128.7	-175.6	-20.6	31.9	0	0	0	112.2
220	G	53.4	Low	45.1	Very low	81 Å²	81	127.3 Å²	127.3	84%	0.835	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	126.2	-4.2	174.5	0	0	0	0	0	115.8	P218	P218-G220 PolarHBondContact O-N 3.4Å
221	F	46.8	Very low	44.8	Very low	177 Å²	177	128 Å²	128	78%	0.776	78%	0.781	S	S	*	*			trans	-90.6	123.7	176.2	-130.7	-96.7	0	0	0	111.3
222	K	52.1	Low	44.9	Very low	156 Å²	156	128.4 Å²	128.4	68%	0.678	78%	0.782	S	S	*	*			trans	-75.9	132.9	176.1	-65.9	-173.3	176.6	-163.8	0	110	D224	K222-D224 PolarHBondContact O-N 2.87Å; K222-D224 VanDerWaalsContact O-N 3.13Å
223	P	49.4	Very low	45.4	Very low	102 Å²	102	126 Å²	126	66%	0.662	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-71.3	-1.3	-177.9	26.5	-32.2	0	0	0	114.7	Y225 T226	P223-Y225 PolarHBondContact O-N 2.87Å; P223-Y225 VanDerWaalsContact O-N 3.14Å; P223-T226 PolarHBondContact O-N 2.88Å; P223-T226 PolarHBondContact O-OG1 2.93Å
224	D	51.8	Low	45.1	Very low	134 Å²	134	120.4 Å²	120.4	72%	0.717	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-73.6	-3.8	-173.4	-51.6	-37	0	0	0	114.7	K222	K222-D224 PolarHBondContact O-N 2.87Å; K222-D224 VanDerWaalsContact O-N 3.13Å
225	Y	50.3	Low	44.8	Very low	212 Å²	212	128.7 Å²	128.7	83%	0.831	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-104.3	-7.2	180	-86.2	-86.7	0	0	0	114.9	P223	P223-Y225 PolarHBondContact O-N 2.87Å; P223-Y225 VanDerWaalsContact O-N 3.14Å
226	T	48.5	Very low	44.3	Very low	113 Å²	113	128.2 Å²	128.2	69%	0.693	77%	0.77	S	S	*	*			trans	-101.5	83.6	173.7	54.8	0	0	0	0	109.2	P223 Y228	P223-T226 PolarHBondContact O-N 2.88Å; P223-T226 PolarHBondContact O-OG1 2.93Å; T226-Y228 PolarHBondContact O-N 2.66Å
227	G	38.8	Very low	43.1	Very low	78 Å²	78	132.3 Å²	132.3	80%	0.804	78%	0.775	S	S	*	*			trans	-66.5	91.7	175.4	0	0	0	0	0	111.5
228	Y	37.5	Very low	41.9	Very low	222 Å²	222	135.5 Å²	135.5	87%	0.871	78%	0.78	S	S	*	*			trans	-105.3	117.2	163.8	-130	-91.1	0	0	0	108.1	T226 G230	T226-Y228 PolarHBondContact O-N 2.66Å; Y228-G230 PolarHBondContact O-N 3.27Å
229	P	38.4	Very low	41.2	Very low	129 Å²	129	137.5 Å²	137.5	84%	0.838	79%	0.786	S	S	*	*			trans	-84.1	99.3	-179.6	31.4	-28.6	0	0	0	109.1
230	G	39.6	Very low	40.5	Very low	71 Å²	71	136.6 Å²	136.6	73%	0.732	77%	0.773	S	S	*	*			trans	162.6	74.6	170.5	0	0	0	0	0	115.2	Y228	Y228-G230 PolarHBondContact O-N 3.27Å
231	A	35.3	Very low	39.7	Very low	105 Å²	105	142.7 Å²	142.7	87%	0.868	77%	0.772	S	S	*	*			trans	172	115.8	140.9	0	0	0	0	0	109.7
232	N	33.8	Very low	39.2	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	78%	0.776	S	S	*	*			trans	-99.8	161.4	150.8	-153.4	30.4	0	0	0	105.6
233	P	43.6	Very low	38.2	Very low	117 Å²	117	141.4 Å²	141.4	76%	0.76	78%	0.78	S	S	*	*			cis	-140.3	166	12.7	39.5	-19.7	0	0	0	116.4
234	G	29.6	Very low	37.3	Very low	62 Å²	62	140.1 Å²	140.1	64%	0.639	79%	0.786	S	S	*	*			trans	156.7	122.8	153.5	0	0	0	0	0	116.5
235	Y	30.4	Very low	36.4	Very low	248 Å²	248	140.8 Å²	140.8	97%	0.973	79%	0.785	S	S	*	*			trans	82	114.7	163.8	-77.1	-92.6	0	0	0	117.4
236	G	32	Very low	35.3	Very low	55 Å²	55	139.6 Å²	139.6	57%	0.567	78%	0.78	S	S	*	*			trans	-87.1	162.6	-168.2	0	0	0	0	0	114.2
237	F	30	Very low	34.3	Very low	210 Å²	210	145.4 Å²	145.4	92%	0.921	79%	0.791	S	S	*	*			trans	-147.9	119.9	133.3	-92.6	-82.3	0	0	0	106.4
238	H	33.7	Very low	34.1	Very low	171 Å²	171	150.9 Å²	150.9	79%	0.792	80%	0.796	S	S	*	*			trans	-76.7	136.3	167.2	-55.2	85.8	0	0	0	106.9
239	N	35.8	Very low	33.6	Very low	149 Å²	149	143.9 Å²	143.9	80%	0.797	79%	0.791	S	S	*	*			trans	-143.3	101.3	148.5	-92.1	-36	0	0	0	109.9	Y241	N239-Y241 PolarHBondContact O-N 3.47Å
240	N	39.4	Very low	33.1	Very low	123 Å²	123	149.1 Å²	149.1	66%	0.658	79%	0.794	S	S	*	*			trans	-71.5	86.4	172.6	-174.9	10.6	0	0	0	109
241	Y	36	Very low	32.6	Very low	208 Å²	208	157 Å²	157	82%	0.816	80%	0.802	S	S	*	*			trans	-147.8	82.6	161.5	-82.4	-75.8	0	0	0	108.8	N239	N239-Y241 PolarHBondContact O-N 3.47Å
242	T	36.1	Very low	32.5	Very low	139 Å²	139	157.9 Å²	157.9	85%	0.853	80%	0.801	S	S	*	*			trans	162.4	78.3	131.3	44.6	0	0	0	0	106.9	G244	T242-G244 PolarHBondContact O-N 3.07Å
243	H	32.7	Very low	32.3	Very low	167 Å²	167	154.2 Å²	154.2	77%	0.773	80%	0.801	S	S	*	*			trans	-61.6	121.6	158.7	-115.9	-86.8	0	0	0	108.1
244	G	29.6	Very low	31.8	Very low	76 Å²	76	154.2 Å²	154.2	78%	0.784	81%	0.81	S	S	*	*			trans	-162.3	49.1	172.1	0	0	0	0	0	109.1	T242	T242-G244 PolarHBondContact O-N 3.07Å
245	Q	32.4	Very low	31.9	Very low	147 Å²	147	154.8 Å²	154.8	69%	0.687	82%	0.816	S	S	*	*			trans	-71.4	126.2	178.6	-83.6	-123.9	-8.1	0	0	111.5
246	Y	28.9	Very low	32.2	Very low	187 Å²	187	150 Å²	150	73%	0.733	81%	0.813	S	S	*	*			trans	59.7	105	131.4	-73.5	-97.2	0	0	0	119.7
247	Y	26.8	Very low	32.2	Very low	235 Å²	235	150.8 Å²	150.8	92%	0.922	82%	0.821	S	S	*	*			trans	-82.8	123.3	132.3	-93.4	-82.6	0	0	0	109.6
248	Q	34.2	Very low	32.6	Very low	193 Å²	193	149.5 Å²	149.5	90%	0.902	82%	0.818	S	S	*	*			trans	-76	117.2	174.3	-152.9	-179.7	15.4	0	0	108.9
249	G	27.3	Very low	33.1	Very low	76 Å²	76	145.4 Å²	145.4	78%	0.784	82%	0.822	S	S	*	*			trans	-137.4	92.4	-178.8	0	0	0	0	0	111.3
250	R	28.1	Very low	33.9	Very low	239 Å²	239	142.3 Å²	142.3	90%	0.902	83%	0.825	S	S	*	*			trans	-63.4	129.3	176	-167	-176.2	-163.4	-160.7	5.2	111.1
251	R	27.8	Very low	34.1	Very low	237 Å²	237	139.3 Å²	139.3	89%	0.894	82%	0.823	S	S	*	*				173.9	138.4	128.2	-96.1	169.2	-174.8	-179.4	2.8	113.1
252	S	33.8	Very low	35.1	Very low	122 Å²	122	131.9 Å²	131.9	85%	0.853	81%	0.81	S	S	*	*			trans	-53.3	145.4	174.8	38.4	0	0	0	0	115.9
253	G	29.3	Very low	36.3	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	80%	0.801	S	S	*	*			trans	-174.5	116.4	164	0	0	0	0	0	110.9
254	A	34	Very low	37.1	Very low	116 Å²	116	134.2 Å²	134.2	96%	0.959	80%	0.801	S	S	*	*			trans	-63	140.2	-178.9	0	0	0	0	0	112.2
255	G	31.2	Very low	38.4	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	79%	0.787	S	S	*	*			trans	-166.9	95.1	173.7	0	0	0	0	0	110.6
256	T	36	Very low	39.5	Very low	147 Å²	147	129.7 Å²	129.7	90%	0.902	78%	0.777	S	S	*	*			trans	-51	130.7	162.4	22.8	0	0	0	0	110.5
257	G	33.3	Very low	41	Very low	73 Å²	73	127.5 Å²	127.5	75%	0.753	78%	0.776	S	S	*	*			trans	-165.8	93.9	178.5	0	0	0	0	0	112.4
258	H	38.8	Very low	42.5	Very low	183 Å²	183	118.8 Å²	118.8	85%	0.847	76%	0.757	S	S	*	*			trans	-60.4	139	179.1	-71.9	54.3	0	0	0	111.1
259	G	43.4	Very low	43.8	Very low	85 Å²	85	113.4 Å²	113.4	88%	0.876	74%	0.737	S	S	*	*	S	Bend	trans	-59.5	135.8	163.9	0	0	0	0	0	110.5
260	G	52.2	Low	45.3	Very low	84 Å²	84	112 Å²	112	87%	0.866	72%	0.723	S	S	*	*			trans	139.2	67.4	172.9	0	0	0	0	0	114
261	G	44.7	Very low	46.8	Very low	59 Å²	59	103.1 Å²	103.1	61%	0.608	71%	0.706	S	S	*	*			trans	-135.7	92.1	170	0	0	0	0	0	109.9
262	G	56.6	Low	48.2	Very low	53 Å²	53	98.8 Å²	98.8	55%	0.546	70%	0.698	S	S	.	*			trans	-72	177.4	180	0	0	0	0	0	113.7	W264 T265	G262-W264 PolarHBondContact O-N 2.8Å; G262-T265 PolarHBondContact O-N 3.25Å; G262-T265 PolarHBondContact O-OG1 3.37Å
263	F	60.1	Low	49.3	Very low	152 Å²	152	97.7 Å²	97.7	67%	0.667	68%	0.681	S	S	*	*	H	α-helix	trans	-35.4	-38.4	179.1	168.8	-101.8	0	0	0	115.6	G266	F263-G266 PolarHBondContact O-N 3.44Å
264	W	49.8	Very low	50.6	Low	202 Å²	202	96.5 Å²	96.5	77%	0.765	67%	0.669	S	S	*	*	H	α-helix	trans	-73.1	-26.8	-178.4	-63.5	103.3	0	0	0	114.6	G262 G266	G262-W264 PolarHBondContact O-N 2.8Å; W264-G266 VanDerWaalsContact C-N 3.31Å
265	T	57.8	Low	51.7	Low	81 Å²	81	101.3 Å²	101.3	50%	0.497	66%	0.664	S	S	.	*	H	α-helix	trans	-74.5	-25.3	177.1	-39.2	0	0	0	0	111.6	G262 T269	G262-T265 PolarHBondContact O-N 3.25Å; G262-T265 PolarHBondContact O-OG1 3.37Å; T265-T269 PolarHBondContact O-N 3.28Å; T265-T269 PolarHBondContact O-OG1 3.38Å
266	G	54.6	Low	52.9	Low	47 Å²	47	104.2 Å²	104.2	49%	0.485	66%	0.661	S	S	.	*	H	α-helix	trans	-73.5	-32.4	179.9	0	0	0	0	0	114.6	F263 W264 G270	F263-G266 PolarHBondContact O-N 3.44Å; W264-G266 VanDerWaalsContact C-N 3.31Å; G266-G270 WeakPolarHBondContact O-CA 2.99Å; G266-G270 PolarHBondContact O-N 3.01Å
267	M	60.3	Low	53.9	Low	142 Å²	142	104.5 Å²	104.5	70%	0.7	65%	0.651	S	S	*	*	H	α-helix	trans	-71.5	-39.3	175.2	-99.6	-173.7	164.6	0	0	112.3	G271	M267-G271 PolarHBondContact O-N 3.06Å
268	G	58.3	Low	54.6	Low	51 Å²	51	104.2 Å²	104.2	53%	0.526	65%	0.648	S	S	.	*	H	α-helix	trans	-70.2	-39	-178.5	0	0	0	0	0	113.7
269	T	62.7	Low	55.3	Low	80 Å²	80	106.9 Å²	106.9	49%	0.491	65%	0.65	S	S	.	*	H	α-helix	trans	-87.6	-31.4	179.7	44.1	0	0	0	0	113.2	T265 G271 L273	T265-T269 PolarHBondContact O-N 3.28Å; T265-T269 PolarHBondContact O-OG1 3.38Å; T269-G271 PolarHBondContact O-N 3.31Å; T269-L273 PolarHBondContact O-N 2.97Å
270	G	57.7	Low	55.2	Low	46 Å²	46	111.3 Å²	111.3	47%	0.474	65%	0.648	S	S	.	*	H	α-helix	trans	-65.8	-35.6	176	0	0	0	0	0	113.5	G266 G274	G266-G270 WeakPolarHBondContact O-CA 2.99Å; G266-G270 PolarHBondContact O-N 3.01Å; G270-G274 PolarHBondContact O-N 3.46Å
271	G	59.6	Low	54.9	Low	53 Å²	53	118.6 Å²	118.6	55%	0.546	65%	0.649	S	S	.	*	H	α-helix	trans	-69.1	-35.5	178.9	0	0	0	0	0	114.3	M267 T269	M267-G271 PolarHBondContact O-N 3.06Å; T269-G271 PolarHBondContact O-N 3.31Å
272	M	56.9	Low	54.5	Low	147 Å²	147	123.6 Å²	123.6	72%	0.724	66%	0.661	S	S	*	*	H	α-helix	trans	-83	-36	-179.6	-75.8	-172.3	172.2	0	0	113.1	Y275	M272-Y275 PolarHBondContact O-N 2.99Å
273	L	57.2	Low	53.9	Low	98 Å²	98	127.4 Å²	127.4	51%	0.513	67%	0.674	S	S	.	*	H	α-helix	trans	-73.8	-31.9	178.6	-71.4	167.8	0	0	0	112.5	T269 Y275 L276 F277	T269-L273 PolarHBondContact O-N 2.97Å; L273-Y275 VanDerWaalsContact C-N 3.26Å; L273-Y275 PolarHBondContact O-N 3Å; L273-L276 PolarHBondContact O-N 3.47Å; L273-F277 HydrophobicContact CD2-CD2 4.32Å; L273-F277 HydrophobicContact CD2-CE2 3.92Å; L273-F277 WeakPolarHBondContact O-CD2 3.1Å; L273-F277 PolarHBondContact O-N 3.46Å; L273-F277 VanDerWaalsContact O-N 3.13Å
274	G	57.5	Low	52.7	Low	53 Å²	53	128.6 Å²	128.6	55%	0.546	68%	0.679	S	S	.	*	H	α-helix	trans	-62.9	-29.7	174	0	0	0	0	0	113.8	G270 G278	G270-G274 PolarHBondContact O-N 3.46Å; G274-G278 PolarHBondContact O-N 3.27Å
275	Y	56.8	Low	52	Low	217 Å²	217	125 Å²	125	85%	0.851	68%	0.679	S	S	*	*	H	α-helix	trans	-80.6	-25.6	178.3	-132.4	-92.9	0	0	0	113.2	M272 L273	M272-Y275 PolarHBondContact O-N 2.99Å; L273-Y275 VanDerWaalsContact C-N 3.26Å; L273-Y275 PolarHBondContact O-N 3Å
276	L	56	Low	51.2	Low	135 Å²	135	130.1 Å²	130.1	71%	0.707	70%	0.697	S	S	*	*	H	α-helix	trans	-88.8	-30.2	-179.5	-80.9	161.6	0	0	0	113.5	L273	L273-L276 PolarHBondContact O-N 3.47Å
277	F	57.2	Low	50.6	Low	154 Å²	154	133.3 Å²	133.3	68%	0.675	71%	0.71	S	S	*	*	H	α-helix	trans	-101.6	-3.2	-178	-71.4	-79.3	0	0	0	115.1	L273 R279	L273-F277 HydrophobicContact CD2-CD2 4.32Å; L273-F277 HydrophobicContact CD2-CE2 3.92Å; L273-F277 WeakPolarHBondContact O-CD2 3.1Å; L273-F277 PolarHBondContact O-N 3.46Å; L273-F277 VanDerWaalsContact O-N 3.13Å; F277-R279 PolarHBondContact O-N 2.99Å; F277-R279 VanDerWaalsContact O-N 3.07Å
278	G	49	Very low	49.3	Very low	67 Å²	67	132.5 Å²	132.5	69%	0.691	72%	0.717	S	S	*	*			trans	-73.5	10.4	178.1	0	0	0	0	0	116	G274	G274-G278 PolarHBondContact O-N 3.27Å
279	R	52	Low	48.3	Very low	239 Å²	239	135.7 Å²	135.7	90%	0.902	73%	0.731	S	S	*	*			trans	-113.4	59.2	-176.6	-128.8	-179.6	-169.2	-168.6	3.7	111.6	F277	F277-R279 PolarHBondContact O-N 2.99Å; F277-R279 VanDerWaalsContact O-N 3.07Å
280	Q	42.3	Very low	47.5	Very low	177 Å²	177	136.9 Å²	136.9	83%	0.827	74%	0.74	S	S	*	*			trans	-124.6	129.8	165.8	-67.9	-170.6	-8.6	0	0	110.9
281	R	44.9	Very low	47	Very low	237 Å²	237	140.2 Å²	140.2	89%	0.894	75%	0.753	S	S	*	*			trans	-69	127.1	-165.9	-55.5	174.8	-173.1	-174.8	0.3	110.1
282	L	37.3	Very low	46	Very low	165 Å²	165	144 Å²	144	86%	0.864	77%	0.768	S	S	*	*			trans	-93.7	102.4	154.6	-158.6	78.4	0	0	0	107.6	K284	L282-K284 PolarHBondContact O-N 3.48Å
283	V	44.3	Very low	45.3	Very low	132 Å²	132	142 Å²	142	80%	0.8	78%	0.775	S	S	*	*			trans	-73	113.5	164.9	172.5	0	0	0	0	106.9
284	K	33.9	Very low	44.5	Very low	178 Å²	178	140.4 Å²	140.4	77%	0.774	78%	0.782	S	S	*	*			trans	-145.6	103.2	159.4	-148.9	173.9	-177.1	-176.3	0	108.7	L282	L282-K284 PolarHBondContact O-N 3.48Å
285	T	35.4	Very low	43.7	Very low	126 Å²	126	146.3 Å²	146.3	77%	0.773	80%	0.795	S	S	*	*			trans	40.7	114.9	153.9	38.1	0	0	0	0	119.3
286	Q	41.4	Very low	42.6	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	79%	0.789	S	S	*	*			trans	-34.4	149.5	158.2	-85.5	178.5	-22.8	0	0	114.6
287	P	41.3	Very low	41.7	Very low	114 Å²	114	145.8 Å²	145.8	74%	0.74	80%	0.801	S	S	*	*				-138.4	161.7	73.3	29.8	-9	0	0	0	117.3
288	C	33.9	Very low	40.6	Very low	125 Å²	125	143.9 Å²	143.9	85%	0.845	81%	0.807	S	S	*	*			trans	54.2	109.5	164	-58.3	0	0	0	0	117.9
289	S	37.1	Very low	40.3	Very low	118 Å²	118	146.9 Å²	146.9	83%	0.825	82%	0.817	S	S	*	*			trans	-131.6	132.1	168.9	-59.2	0	0	0	0	108.6
290	P	46	Very low	39.2	Very low	105 Å²	105	138.7 Å²	138.7	68%	0.682	81%	0.808	S	S	*	*			trans	-79.9	160.4	-179.9	31.9	-33.3	0	0	0	111.9
291	P	46.4	Very low	39.2	Very low	115 Å²	115	137.2 Å²	137.2	75%	0.747	81%	0.811	S	S	*	*			trans	-74.1	155.6	175	31.6	-33.1	0	0	0	111.5	A293	P291-A293 PolarHBondContact O-N 3.04Å
292	P	40.1	Very low	38.8	Very low	133 Å²	133	133 Å²	133	86%	0.864	81%	0.806	S	S	*	*			trans	-74.7	112.2	177.7	29.1	-30.6	0	0	0	110.4	G294	P292-G294 PolarHBondContact O-N 3.49Å
293	A	41.3	Very low	39.1	Very low	105 Å²	105	132.8 Å²	132.8	87%	0.868	81%	0.811	S	S	*	*			trans	-75	113.7	166.1	0	0	0	0	0	109.3	P291	P291-A293 PolarHBondContact O-N 3.04Å
294	G	41.3	Very low	38.9	Very low	65 Å²	65	130.2 Å²	130.2	67%	0.67	80%	0.8	S	S	*	*			trans	-79.3	139.4	164.5	0	0	0	0	0	110.3	P292	P292-G294 PolarHBondContact O-N 3.49Å
295	Q	39.1	Very low	39.9	Very low	176 Å²	176	127.3 Å²	127.3	82%	0.822	80%	0.802	S	S	*	*				178.7	138.4	118.5	-95.5	177.4	38.3	0	0	113.8
296	N	33.7	Very low	40.6	Very low	135 Å²	135	121.9 Å²	121.9	72%	0.722	77%	0.77	S	S	*	*			trans	68.9	104.2	136.7	-63	-14.6	0	0	0	120.5
297	H	38.7	Very low	41.3	Very low	207 Å²	207	118 Å²	118	96%	0.958	76%	0.76	S	S	*	*			trans	-63.5	125.1	156.8	-76.8	-63.2	0	0	0	111.5
298	S	32.3	Very low	43	Very low	114 Å²	114	117.5 Å²	117.5	80%	0.797	74%	0.743	S	S	*	*			trans	-125.3	111	148.8	50.8	0	0	0	0	107.7	G300	S298-G300 PolarHBondContact O-N 3.12Å
299	S	42.8	Very low	45	Very low	129 Å²	129	115.5 Å²	115.5	90%	0.902	73%	0.727	S	S	*	*			trans	-70.1	113.6	177.5	47.6	0	0	0	0	110.6
300	G	30.5	Very low	46.4	Very low	68 Å²	68	110.2 Å²	110.2	70%	0.701	69%	0.691	S	S	*	*			trans	-138.1	100.6	166.3	0	0	0	0	0	109.1	S298 N302	S298-G300 PolarHBondContact O-N 3.12Å; G300-N302 PolarHBondContact O-N 3.35Å
301	T	42.5	Very low	47.5	Very low	146 Å²	146	108 Å²	108	90%	0.896	68%	0.677	S	S	*	*			trans	-67.9	103.9	169.1	31.2	0	0	0	0	109.3
302	N	34.7	Very low	48.2	Very low	149 Å²	149	102.8 Å²	102.8	80%	0.797	65%	0.645	S	S	*	*			trans	-136.7	112.4	158.4	-85.9	-29.1	0	0	0	108	G300 S304	G300-N302 PolarHBondContact O-N 3.35Å; N302-S304 PolarHBondContact O-N 2.94Å
303	T	44.3	Very low	48.6	Very low	159 Å²	159	101.3 Å²	101.3	98%	0.975	63%	0.633	S	S	*	*			trans	-69	81.1	166.2	35.7	0	0	0	0	108.9
304	S	41.2	Very low	49	Very low	79 Å²	79	102.7 Å²	102.7	55%	0.552	62%	0.622	S	S	*	*			trans	-93.9	131.4	161.1	56.2	0	0	0	0	108.2	N302 G306	N302-S304 PolarHBondContact O-N 2.94Å; S304-G306 PolarHBondContact O-N 3.34Å
305	S	53.4	Low	49.2	Very low	117 Å²	117	99.7 Å²	99.7	82%	0.818	59%	0.591	S	S	*	*			trans	-63.5	72.1	153.7	54.5	0	0	0	0	107.7	T307	S305-T307 PolarHBondContact O-N 3.41Å
306	G	51.5	Low	49.3	Very low	11 Å²	11	95.2 Å²	95.2	11%	0.113	58%	0.578	C	S	.	*			trans	-83.3	117.2	-167.4	0	0	0	0	0	109.4	N92 S304	N92-G306 PolarHBondContact N-O 3.08Å; N92-G306 PolarHBondContact ND2-O 2.96Å; N92-G306 PolarHBondContact OD1-O 3.3Å; S304-G306 PolarHBondContact O-N 3.34Å
307	T	55	Low	49.7	Very low	109 Å²	109	89.5 Å²	89.5	67%	0.669	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	137.6	149.7	39.9	0	0	0	0	107.8	M90 S305	M90-T307 CarbonylContact O-C 3.51Å; M90-T307 WeakPolarHBondContact O-CA 3.39Å; S305-T307 PolarHBondContact O-N 3.41Å
308	R	77.8	Confident	50	Low	103 Å²	103	87.9 Å²	87.9	39%	0.389	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.2	173.3	66.8	177.8	179.1	147.6	7.5	109.9	M90 N92 Y94 A310	M90-R308 PolarHBondContact N-O 2.83Å; M90-R308 VanDerWaalsContact N-O 3.17Å; M90-R308 PolarHBondContact O-N 3.48Å; N92-R308 VanDerWaalsContact OD1-CB 3.29Å; N92-R308 WeakPolarHBondContact OD1-CB 3.25Å; N92-R308 WeakPolarHBondContact OD1-CD 3.29Å; N92-R308 WeakPolarHBondContact OD1-CG 3.3Å; Y94-R308 PolarHBondContact O-NH2 3.36Å; R308-A310 PolarHBondContact O-N 3.01Å
309	T	74.5	Confident	50.4	Low	83 Å²	83	88.6 Å²	88.6	51%	0.509	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	112.9	167.7	-49.3	0	0	0	0	108.3	K87 T88	K87-T309 HydrophobicContact CB-CG2 3.79Å; K87-T309 HydrophobicContact CD-CG2 4.06Å; K87-T309 HydrophobicContact CG-CG2 3.92Å; T88-T309 WeakPolarHBondContact O-CA 3.31Å
310	A	67.9	Low	50.8	Low	6 Å²	6	86.6 Å²	86.6	5%	0.05	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.7	173.6	0	0	0	0	0	109.1	K87 T88 M90 F96 R308	K87-A310 WeakPolarHBondContact CA-O 3.43Å; T88-A310 PolarHBondContact N-O 3.47Å; T88-A310 PolarHBondContact O-N 2.88Å; M90-A310 HydrophobicContact CE-CB 3.74Å; M90-A310 HydrophobicContact CG-CB 3.6Å; M90-A310 HydrophobicContact SD-CB 3.45Å; M90-A310 WeakPolarHBondContact SD-CB 3.22Å; F96-A310 HydrophobicContact CD2-CB 4.27Å; R308-A310 PolarHBondContact O-N 3.01Å
311	S	67.6	Low	51.8	Low	58 Å²	58	87.5 Å²	87.5	41%	0.406	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.3	170.1	-68.4	0	0	0	0	110.3	E85 C86 K87	E85-S311 WeakPolarHBondContact OE1-CB 3.41Å; E85-S311 PolarHBondContact OE1-OG 3.06Å; C86-S311 CarbonylContact O-C 3.6Å; C86-S311 VanDerWaalsContact O-CA 3.29Å; C86-S311 WeakPolarHBondContact O-CA 3.34Å; K87-S311 WeakPolarHBondContact CE-OG 3.36Å; K87-S311 WeakPolarHBondContact CG-OG 3.47Å
312	G	61.2	Low	52.4	Low	6 Å²	6	84.3 Å²	84.3	6%	0.062	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	138.1	157.6	0	0	0	0	0	109.2	C86 I99	C86-G312 PolarHBondContact N-O 3.23Å; C86-G312 PolarHBondContact O-N 3.28Å; I99-G312 VanDerWaalsContact CD1-C 3.41Å; I99-G312 VanDerWaalsContact CD1-O 3.26Å; I99-G312 WeakPolarHBondContact CD1-O 3.41Å
313	T	49.2	Very low	53.4	Low	102 Å²	102	80.5 Å²	80.5	63%	0.626	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	143.5	173.4	53.2	0	0	0	0	108.3	E85	E85-T313 HydrophobicContact CG-CG2 4.34Å
314	E	49.1	Very low	54	Low	134 Å²	134	75.6 Å²	75.6	63%	0.626	42%	0.419	S	S	*	.			trans	86.2	95.5	-174.5	-56.8	-178.7	158.8	0	0	113.5	I99	I99-E314 WeakPolarHBondContact CG1-O 3.42Å
315	A	45.6	Very low	54.8	Low	3 Å²	3	75.3 Å²	75.3	3%	0.025	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111	164.4	0	0	0	0	0	108.2	W84 I99 V101	W84-A315 HydrophobicContact CB-CB 3.93Å; W84-A315 HydrophobicContact CG-CB 4.32Å; I99-A315 HydrophobicContact CD1-CB 4.43Å; I99-A315 HydrophobicContact CG1-CB 4.24Å; I99-A315 WeakPolarHBondContact O-CA 3.47Å; V101-A315 HydrophobicContact CB-CB 3.99Å; V101-A315 HydrophobicContact CG2-CB 3.73Å
316	C	41.4	Very low	54.9	Low	81 Å²	81	72.4 Å²	72.4	55%	0.547	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	150.6	168.7	-71.8	0	0	0	0	109.8	E100 V101	E100-C316 WeakPolarHBondContact CG-O 3.45Å; V101-C316 PolarHBondContact N-O 2.94Å; V101-C316 VanDerWaalsContact O-O 3.11Å
317	V	43.1	Very low	55.2	Low	15 Å²	15	77.1 Å²	77.1	9%	0.091	40%	0.401	C	S	.	.			trans	-94.3	111.4	171.2	-177.4	0	0	0	0	107.8	L28 V101 F319	L28-V317 HydrophobicContact CD2-CG1 4.39Å; L28-V317 HydrophobicContact CD2-CG2 4.05Å; V101-V317 WeakPolarHBondContact O-CA 3.46Å; V317-F319 HydrophobicContact CG1-CD1 4.17Å; V317-F319 HydrophobicContact CG1-CE1 3.89Å; V317-F319 HydrophobicContact CG1-CE2 4.23Å; V317-F319 HydrophobicContact CG1-CZ 3.93Å
318	R	44.5	Very low	55.2	Low	173 Å²	173	74.4 Å²	74.4	65%	0.653	38%	0.379	S	S	*	.			trans	-87.7	127.3	164.4	-121.9	178.2	179.5	158.9	1.4	109.4	E100 S102	E100-R318 VanDerWaalsContact OE1-CB 3.3Å; E100-R318 WeakPolarHBondContact OE1-CB 3.09Å; E100-R318 WeakPolarHBondContact OE1-CD 3.13Å; E100-R318 WeakPolarHBondContact OE1-CG 3.5Å; S102-R318 WeakPolarHBondContact CB-O 3.3Å; S102-R318 PolarHBondContact OG-O 3.08Å
319	F	40.4	Very low	53.1	Low	129 Å²	129	71.8 Å²	71.8	57%	0.566	38%	0.378	S	S	*	.			trans	-95	0	166.6	-63.5	-63.5	0	0	0	111.1	P109 V317	P109-F319 HydrophobicContact CB-CB 3.86Å; P109-F319 WeakPolarHBondContact O-CD1 3.45Å; P109-F319 WeakPolarHBondContact O-CE1 3.4Å; P109-F319 WeakPolarHBondContact O-CG 3.27Å; V317-F319 HydrophobicContact CG1-CD1 4.17Å; V317-F319 HydrophobicContact CG1-CE1 3.89Å; V317-F319 HydrophobicContact CG1-CE2 4.23Å; V317-F319 HydrophobicContact CG1-CZ 3.93Å

Retrieved 319 of 319 residues in 403.3 ms (Link to these results)

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