A0A087Y3Y3_POEFO Loading...

Lectin, mannose-binding 2-like b

AlphaFold DB , UniProt , Accession A0A087Y3Y3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 353 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.5	Very low	37.8	Very low	252 Å²	252	147.2 Å²	147.2	100%	1.241	86%	0.859	S	S	*	*				0	141.3	0	-94.1	176.8	-173.5	0	0	108.8
2	A	42.7	Very low	38.4	Very low	101 Å²	101	153.9 Å²	153.9	84%	0.835	86%	0.859	S	S	*	*			trans	-69.5	163.4	-169.5	0	0	0	0	0	114.7
3	A	33.9	Very low	39.1	Very low	109 Å²	109	154.1 Å²	154.1	90%	0.901	86%	0.856	S	S	*	*			trans	-143.7	152.9	143.3	0	0	0	0	0	108.9
4	N	40.2	Very low	39.5	Very low	152 Å²	152	160.9 Å²	160.9	81%	0.813	86%	0.862	S	S	*	*			trans	-138.7	140.1	-155	-175.7	24.2	0	0	0	107.7
5	V	36.8	Very low	39.9	Very low	131 Å²	131	167 Å²	167	79%	0.794	87%	0.868	S	S	*	*			trans	-154.5	120.6	164.2	169.2	0	0	0	0	113
6	S	40.3	Very low	40.5	Very low	101 Å²	101	163.7 Å²	163.7	71%	0.706	86%	0.864	S	S	*	*			trans	53.4	139.5	141.5	81.7	0	0	0	0	125.1
7	K	35.2	Very low	41.2	Very low	212 Å²	212	159.3 Å²	159.3	92%	0.922	85%	0.85	S	S	*	*			trans	-160.5	155.2	132.2	-110.3	177	-173.7	179.9	0	114.2
8	L	37.7	Very low	41.6	Very low	152 Å²	152	156.2 Å²	156.2	80%	0.796	84%	0.837	S	S	*	*			trans	-69.9	150.8	-177	-133.4	81.5	0	0	0	114.6
9	N	37.3	Very low	41.8	Very low	132 Å²	132	157.6 Å²	157.6	71%	0.706	84%	0.835	S	S	*	*				173.7	135.8	114	-104	-21.7	0	0	0	117.8
10	M	38	Very low	42.3	Very low	165 Å²	165	153 Å²	153	81%	0.813	82%	0.817	S	S	*	*			trans	40.5	106.2	138.1	-71.7	174.6	66.9	0	0	122.2
11	A	38.1	Very low	42.9	Very low	112 Å²	112	149.4 Å²	149.4	93%	0.926	80%	0.8	S	S	*	*			trans	-123.2	102.6	148	0	0	0	0	0	109.6
12	R	44.7	Very low	43.7	Very low	228 Å²	228	145 Å²	145	86%	0.86	77%	0.774	S	S	*	*			trans	-133.8	143.8	170.1	-156.3	-178.9	-163.8	-178.5	4.6	107.5
13	L	48.6	Very low	44.4	Very low	156 Å²	156	146.5 Å²	146.5	82%	0.817	76%	0.764	S	S	*	*			trans	90.2	89.1	178	-71.4	93.4	0	0	0	117.7
14	R	44.1	Very low	45.6	Very low	250 Å²	250	147.4 Å²	147.4	94%	0.943	75%	0.753	S	S	*	*				176.4	82.8	128.4	-104.7	-178.3	170	-172.7	-1.7	110.4
15	R	45.9	Very low	46.8	Very low	252 Å²	252	143.9 Å²	143.9	95%	0.951	73%	0.734	S	S	*	*	S	Bend	trans	-170.1	68	163.9	-121.2	176.4	-177.1	-176.9	0.5	111.5
16	S	48.9	Very low	48.4	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	73%	0.726	S	S	*	*	S	Bend	trans	-158.1	23.1	174.2	66.4	0	0	0	0	115.6
17	S	52.5	Low	49.9	Very low	89 Å²	89	144.5 Å²	144.5	62%	0.622	72%	0.724	S	S	*	*	S	Bend	trans	-118.4	-6.6	-177.5	65.8	0	0	0	0	115.5
18	V	48.9	Very low	51.8	Low	104 Å²	104	142.2 Å²	142.2	63%	0.63	71%	0.71	S	S	*	*	S	Bend	trans	-96.1	-26.6	-178.6	-175	0	0	0	0	111.9
19	F	46.1	Very low	53.7	Low	182 Å²	182	141.1 Å²	141.1	80%	0.798	70%	0.7	S	S	*	*	H	α-helix	trans	-78.8	-25.6	179.9	-102.1	-90	0	0	0	114
20	S	51.7	Low	55.6	Low	66 Å²	66	140.2 Å²	140.2	46%	0.462	70%	0.695	S	S	.	*	H	α-helix	trans	-82.8	-27	-178.9	80.6	0	0	0	0	113.5	L24	S20-L24 PolarHBondContact O-N 3.16Å
21	V	53.7	Low	57.8	Low	78 Å²	78	137.6 Å²	137.6	47%	0.473	68%	0.684	S	S	.	*	H	α-helix	trans	-73.1	-44.1	-179.9	-179	0	0	0	0	110.4	Q23 L24 D25	V21-Q23 VanDerWaalsContact C-N 3.31Å; V21-Q23 PolarHBondContact O-N 3.33Å; V21-L24 PolarHBondContact O-N 3.24Å; V21-L24 VanDerWaalsContact O-N 3.14Å; V21-D25 PolarHBondContact O-N 3.05Å
22	F	52.8	Low	59.8	Low	158 Å²	158	135.9 Å²	135.9	69%	0.693	66%	0.664	S	S	*	*	H	α-helix	trans	-61.8	-35.2	175.8	-100.3	-84.4	0	0	0	113.5	L26	F22-L26 PolarHBondContact O-N 3.1Å
23	Q	57	Low	61.7	Low	134 Å²	134	129.6 Å²	129.6	63%	0.626	65%	0.65	S	S	*	*	H	α-helix	trans	-73.6	-32.7	175.3	-80	-172.1	-41.2	0	0	112.7	V21 L27	V21-Q23 VanDerWaalsContact C-N 3.31Å; V21-Q23 PolarHBondContact O-N 3.33Å; Q23-L27 WeakPolarHBondContact O-CB 3.38Å; Q23-L27 PolarHBondContact O-N 2.9Å
24	L	59.5	Low	63.1	Low	127 Å²	127	126.9 Å²	126.9	67%	0.665	64%	0.636	S	S	*	*	H	α-helix	trans	-70.6	-41.6	176.6	-113.5	87.7	0	0	0	112.2	S20 V21 L27 R28	S20-L24 PolarHBondContact O-N 3.16Å; V21-L24 PolarHBondContact O-N 3.24Å; V21-L24 VanDerWaalsContact O-N 3.14Å; L24-L27 PolarHBondContact O-N 3.41Å; L24-R28 WeakPolarHBondContact O-CB 3.49Å; L24-R28 PolarHBondContact O-N 3.13Å
25	D	65.1	Low	65	Low	79 Å²	79	118.9 Å²	118.9	42%	0.422	62%	0.615	S	S	.	*	H	α-helix	trans	-66.1	-40.7	-179.9	-73.1	-33.9	0	0	0	111.2	V21 L27 R28 E29	V21-D25 PolarHBondContact O-N 3.05Å; D25-L27 VanDerWaalsContact C-N 3.35Å; D25-L27 PolarHBondContact O-N 3.22Å; D25-R28 PolarHBondContact O-N 3.35Å; D25-E29 VanDerWaalsContact O-CG 3.31Å; D25-E29 WeakPolarHBondContact O-CG 3.48Å; D25-E29 PolarHBondContact O-N 3.43Å
26	L	69.8	Low	66.6	Low	118 Å²	118	109.2 Å²	109.2	62%	0.618	59%	0.589	S	S	*	*	H	α-helix	trans	-64.4	-38.4	175.2	-169.6	71.6	0	0	0	112.3	F22 L30	F22-L26 PolarHBondContact O-N 3.1Å; L26-L30 WeakPolarHBondContact O-CB 3.37Å; L26-L30 PolarHBondContact O-N 3.49Å
27	L	72.4	Confident	68	Low	126 Å²	126	110.1 Å²	110.1	66%	0.66	58%	0.579	S	S	*	*	H	α-helix	trans	-67.7	-36.6	176.2	-117.5	143.2	0	0	0	111.8	Q23 L24 D25 L30 L31	Q23-L27 WeakPolarHBondContact O-CB 3.38Å; Q23-L27 PolarHBondContact O-N 2.9Å; L24-L27 PolarHBondContact O-N 3.41Å; D25-L27 VanDerWaalsContact C-N 3.35Å; D25-L27 PolarHBondContact O-N 3.22Å; L27-L30 PolarHBondContact O-N 3.28Å; L27-L31 VanDerWaalsContact O-CB 3.3Å; L27-L31 WeakPolarHBondContact O-CB 3.35Å; L27-L31 PolarHBondContact O-N 2.84Å
28	R	74.8	Confident	69.1	Low	165 Å²	165	108.8 Å²	108.8	62%	0.623	57%	0.569	S	S	*	*	H	α-helix	trans	-68.1	-43.9	176.4	-159.2	178.6	90.3	-174.2	7	111.3	L24 D25 L31 C32	L24-R28 WeakPolarHBondContact O-CB 3.49Å; L24-R28 PolarHBondContact O-N 3.13Å; D25-R28 PolarHBondContact O-N 3.35Å; R28-L31 PolarHBondContact O-N 3.42Å; R28-C32 WeakPolarHBondContact O-CB 3.47Å; R28-C32 PolarHBondContact O-N 3.47Å; R28-C32 PolarHBondContact O-SG 3.41Å
29	E	77.3	Confident	70.4	Confident	128 Å²	128	108.1 Å²	108.1	60%	0.598	57%	0.565	S	S	*	*	H	α-helix	trans	-58.6	-48	172.9	-73.8	-83.3	147.4	0	0	110.9	D25 L31 C32 V33	D25-E29 VanDerWaalsContact O-CG 3.31Å; D25-E29 WeakPolarHBondContact O-CG 3.48Å; D25-E29 PolarHBondContact O-N 3.43Å; E29-L31 PolarHBondContact O-N 2.96Å; E29-C32 PolarHBondContact O-N 3.33Å; E29-V33 WeakPolarHBondContact O-CG2 3.48Å; E29-V33 PolarHBondContact O-N 2.98Å
30	L	78.7	Confident	71.6	Confident	113 Å²	113	106.4 Å²	106.4	59%	0.592	56%	0.563	S	S	*	*	H	α-helix	trans	-63.3	-42.2	179.1	-129	99.3	0	0	0	112.1	L26 L27 V33 L34	L26-L30 WeakPolarHBondContact O-CB 3.37Å; L26-L30 PolarHBondContact O-N 3.49Å; L27-L30 PolarHBondContact O-N 3.28Å; L30-V33 PolarHBondContact O-N 3.38Å; L30-L34 WeakPolarHBondContact O-CB 3.36Å; L30-L34 PolarHBondContact O-N 2.9Å
31	L	82.9	Confident	72.3	Confident	111 Å²	111	106.9 Å²	106.9	58%	0.581	56%	0.564	S	S	*	*	H	α-helix	trans	-65.3	-40.9	177.4	-167.4	78.9	0	0	0	111.1	L27 R28 E29 L34 V35	L27-L31 VanDerWaalsContact O-CB 3.3Å; L27-L31 WeakPolarHBondContact O-CB 3.35Å; L27-L31 PolarHBondContact O-N 2.84Å; R28-L31 PolarHBondContact O-N 3.42Å; E29-L31 PolarHBondContact O-N 2.96Å; L31-L34 PolarHBondContact O-N 2.88Å; L31-V35 WeakPolarHBondContact O-CB 3.32Å; L31-V35 VanDerWaalsContact O-CG2 3.27Å; L31-V35 WeakPolarHBondContact O-CG2 3.46Å; L31-V35 PolarHBondContact O-N 2.9Å
32	C	81.7	Confident	72.6	Confident	76 Å²	76	109.9 Å²	109.9	51%	0.514	57%	0.572	S	S	.	*	H	α-helix	trans	-62.7	-42.5	175.3	-74.7	0	0	0	0	111.8	R28 E29 L34 A36	R28-C32 WeakPolarHBondContact O-CB 3.47Å; R28-C32 PolarHBondContact O-N 3.47Å; R28-C32 PolarHBondContact O-SG 3.41Å; E29-C32 PolarHBondContact O-N 3.33Å; C32-L34 VanDerWaalsContact C-N 3.34Å; C32-A36 VanDerWaalsContact O-CB 3.26Å; C32-A36 WeakPolarHBondContact O-CB 3.2Å; C32-A36 PolarHBondContact O-N 3.47Å
33	V	83.2	Confident	72.7	Confident	95 Å²	95	111 Å²	111	58%	0.576	58%	0.58	S	S	*	*	H	α-helix	trans	-65.1	-39.4	175.4	172.1	0	0	0	0	111.1	E29 L30 A36 F37	E29-V33 WeakPolarHBondContact O-CG2 3.48Å; E29-V33 PolarHBondContact O-N 2.98Å; L30-V33 PolarHBondContact O-N 3.38Å; V33-A36 PolarHBondContact O-N 2.85Å; V33-F37 VanDerWaalsContact O-CB 3.26Å; V33-F37 WeakPolarHBondContact O-CB 3.29Å; V33-F37 PolarHBondContact O-N 3.35Å
34	L	78.9	Confident	72.5	Confident	99 Å²	99	109 Å²	109	52%	0.518	58%	0.581	S	S	.	*	H	α-helix	trans	-70.2	-39.9	179.9	-148.7	150	0	0	0	111.5	L30 L31 C32 F37 C38	L30-L34 WeakPolarHBondContact O-CB 3.36Å; L30-L34 PolarHBondContact O-N 2.9Å; L31-L34 PolarHBondContact O-N 2.88Å; C32-L34 VanDerWaalsContact C-N 3.34Å; L34-F37 PolarHBondContact O-N 3.04Å; L34-C38 WeakPolarHBondContact O-CB 3.41Å; L34-C38 PolarHBondContact O-N 3.34Å; L34-C38 PolarHBondContact O-SG 3.49Å
35	V	82.5	Confident	72.1	Confident	83 Å²	83	111.4 Å²	111.4	50%	0.503	59%	0.593	S	S	.	*	H	α-helix	trans	-65.7	-43.7	172.5	172.4	0	0	0	0	110.9	L31 F37 C38 V39	L31-V35 WeakPolarHBondContact O-CB 3.32Å; L31-V35 VanDerWaalsContact O-CG2 3.27Å; L31-V35 WeakPolarHBondContact O-CG2 3.46Å; L31-V35 PolarHBondContact O-N 2.9Å; V35-F37 VanDerWaalsContact C-N 3.32Å; V35-F37 PolarHBondContact O-N 3.25Å; V35-C38 PolarHBondContact O-N 2.9Å; V35-V39 HydrophobicContact CG1-CG2 4.38Å; V35-V39 WeakPolarHBondContact O-CB 3.38Å; V35-V39 VanDerWaalsContact O-CG2 3.28Å; V35-V39 WeakPolarHBondContact O-CG2 3.47Å; V35-V39 PolarHBondContact O-N 3.43Å
36	A	79.8	Confident	71.3	Confident	48 Å²	48	111.1 Å²	111.1	40%	0.397	60%	0.601	S	S	.	*	H	α-helix	trans	-61.9	-41.4	175	0	0	0	0	0	111.5	C32 V33 V39 L40	C32-A36 VanDerWaalsContact O-CB 3.26Å; C32-A36 WeakPolarHBondContact O-CB 3.2Å; C32-A36 PolarHBondContact O-N 3.47Å; V33-A36 PolarHBondContact O-N 2.85Å; A36-V39 PolarHBondContact O-N 2.95Å; A36-L40 VanDerWaalsContact O-CB 3.3Å; A36-L40 WeakPolarHBondContact O-CB 3.41Å; A36-L40 WeakPolarHBondContact O-CD1 3.38Å; A36-L40 WeakPolarHBondContact O-CG 3.29Å; A36-L40 PolarHBondContact O-N 3.23Å
37	F	78.6	Confident	70	Confident	134 Å²	134	111.9 Å²	111.9	59%	0.588	61%	0.606	S	S	*	*	H	α-helix	trans	-64.8	-41.2	174.5	-172.3	-98.4	0	0	0	111.5	V33 L34 V35 L40 T41	V33-F37 VanDerWaalsContact O-CB 3.26Å; V33-F37 WeakPolarHBondContact O-CB 3.29Å; V33-F37 PolarHBondContact O-N 3.35Å; L34-F37 PolarHBondContact O-N 3.04Å; V35-F37 VanDerWaalsContact C-N 3.32Å; V35-F37 PolarHBondContact O-N 3.25Å; F37-L40 PolarHBondContact O-N 3.42Å; F37-T41 HydrophobicContact CD1-CG2 4.03Å; F37-T41 HydrophobicContact CD2-CG2 4.34Å; F37-T41 HydrophobicContact CE1-CG2 3.68Å; F37-T41 HydrophobicContact CE2-CG2 4.01Å; F37-T41 HydrophobicContact CG-CG2 4.35Å; F37-T41 HydrophobicContact CZ-CG2 3.67Å; F37-T41 VanDerWaalsContact O-CB 3.3Å; F37-T41 WeakPolarHBondContact O-CB 3.35Å; F37-T41 VanDerWaalsContact O-CG2 3.28Å; F37-T41 WeakPolarHBondContact O-CG2 3.42Å; F37-T41 PolarHBondContact O-N 2.92Å; F37-T41 PolarHBondContact O-OG1 2.82Å
38	C	76.4	Confident	68.6	Low	61 Å²	61	114.5 Å²	114.5	41%	0.412	62%	0.615	S	S	.	*	H	α-helix	trans	-65.2	-37.9	174.9	-74.9	0	0	0	0	112.6	L34 V35 T41 Q42	L34-C38 WeakPolarHBondContact O-CB 3.41Å; L34-C38 PolarHBondContact O-N 3.34Å; L34-C38 PolarHBondContact O-SG 3.49Å; V35-C38 PolarHBondContact O-N 2.9Å; C38-T41 WeakPolarHBondContact CA-OG1 3.45Å; C38-T41 PolarHBondContact O-N 3.38Å; C38-T41 PolarHBondContact O-OG1 3.48Å; C38-Q42 WeakPolarHBondContact O-CG 3.41Å; C38-Q42 PolarHBondContact O-N 2.92Å
39	V	75.9	Confident	67.2	Low	90 Å²	90	114 Å²	114	55%	0.545	62%	0.62	S	S	.	*	H	α-helix	trans	-69.7	-37	174.7	171.5	0	0	0	0	111.2	V35 A36	V35-V39 HydrophobicContact CG1-CG2 4.38Å; V35-V39 WeakPolarHBondContact O-CB 3.38Å; V35-V39 VanDerWaalsContact O-CG2 3.28Å; V35-V39 WeakPolarHBondContact O-CG2 3.47Å; V35-V39 PolarHBondContact O-N 3.43Å; A36-V39 PolarHBondContact O-N 2.95Å
40	L	70.1	Confident	65.8	Low	146 Å²	146	113.7 Å²	113.7	76%	0.764	62%	0.618	S	S	*	*	H	α-helix	trans	-76.4	-22	176.8	-69.4	169.5	0	0	0	113.3	A36 F37	A36-L40 VanDerWaalsContact O-CB 3.3Å; A36-L40 WeakPolarHBondContact O-CB 3.41Å; A36-L40 WeakPolarHBondContact O-CD1 3.38Å; A36-L40 WeakPolarHBondContact O-CG 3.29Å; A36-L40 PolarHBondContact O-N 3.23Å; F37-L40 PolarHBondContact O-N 3.42Å
41	T	66.3	Low	64	Low	76 Å²	76	116.6 Å²	116.6	47%	0.466	63%	0.627	S	S	.	*	H	α-helix	trans	-101.6	-4.9	177.1	56.2	0	0	0	0	113.4	F37 C38 Q43	F37-T41 HydrophobicContact CD1-CG2 4.03Å; F37-T41 HydrophobicContact CD2-CG2 4.34Å; F37-T41 HydrophobicContact CE1-CG2 3.68Å; F37-T41 HydrophobicContact CE2-CG2 4.01Å; F37-T41 HydrophobicContact CG-CG2 4.35Å; F37-T41 HydrophobicContact CZ-CG2 3.67Å; F37-T41 VanDerWaalsContact O-CB 3.3Å; F37-T41 WeakPolarHBondContact O-CB 3.35Å; F37-T41 VanDerWaalsContact O-CG2 3.28Å; F37-T41 WeakPolarHBondContact O-CG2 3.42Å; F37-T41 PolarHBondContact O-N 2.92Å; F37-T41 PolarHBondContact O-OG1 2.82Å; C38-T41 WeakPolarHBondContact CA-OG1 3.45Å; C38-T41 PolarHBondContact O-N 3.38Å; C38-T41 PolarHBondContact O-OG1 3.48Å; T41-Q43 PolarHBondContact O-N 3.34Å
42	Q	61.6	Low	62.6	Low	140 Å²	140	113.3 Å²	113.3	65%	0.654	61%	0.608	S	S	*	*	S	Bend	trans	-61.1	107.9	161.9	-90.8	174	-19.1	0	0	107.4	C38 S44	C38-Q42 WeakPolarHBondContact O-CG 3.41Å; C38-Q42 PolarHBondContact O-N 2.92Å; Q42-S44 PolarHBondContact O-N 3.01Å; Q42-S44 VanDerWaalsContact O-N 3.1Å
43	Q	55.1	Low	61.4	Low	183 Å²	183	114.7 Å²	114.7	86%	0.855	61%	0.607	S	S	*	*			trans	-55	119.3	163.7	-71.6	178.6	-18.9	0	0	107.1	T41 L45	T41-Q43 PolarHBondContact O-N 3.34Å; Q43-L45 PolarHBondContact O-N 3.33Å; Q43-L45 VanDerWaalsContact O-N 3.07Å
44	S	51.8	Low	60.7	Low	92 Å²	92	112.8 Å²	112.8	64%	0.643	59%	0.593	S	S	*	*			trans	-49.2	116	168.7	172.2	0	0	0	0	108.5	Q42 A46	Q42-S44 PolarHBondContact O-N 3.01Å; Q42-S44 VanDerWaalsContact O-N 3.1Å; S44-A46 PolarHBondContact O-N 3.34Å; S44-A46 WeakPolarHBondContact OG-CB 3.5Å; S44-A46 PolarHBondContact OG-N 3.05Å; S44-A46 VanDerWaalsContact OG-N 3.14Å; S44-A46 PolarHBondContact OG-O 3.49Å
45	L	52.2	Low	61.1	Low	177 Å²	177	112.9 Å²	112.9	93%	0.927	59%	0.59	S	S	*	*	S	Bend	trans	-76.2	2.9	166.8	-100.4	163.3	0	0	0	112	Q43	Q43-L45 PolarHBondContact O-N 3.33Å; Q43-L45 VanDerWaalsContact O-N 3.07Å
46	A	46.6	Very low	61.6	Low	72 Å²	72	112.6 Å²	112.6	60%	0.595	59%	0.585	S	S	*	*	S	Bend	trans	-94	122.3	170	0	0	0	0	0	108.7	S44	S44-A46 PolarHBondContact O-N 3.34Å; S44-A46 WeakPolarHBondContact OG-CB 3.5Å; S44-A46 PolarHBondContact OG-N 3.05Å; S44-A46 VanDerWaalsContact OG-N 3.14Å; S44-A46 PolarHBondContact OG-O 3.49Å
47	D	42.8	Very low	62.4	Low	135 Å²	135	112.6 Å²	112.6	72%	0.722	58%	0.576	S	S	*	*			trans	90.4	57.7	172.1	-136.2	35.8	0	0	0	116.9	Q49	D47-Q49 PolarHBondContact O-N 2.69Å; D47-Q49 WeakPolarHBondContact OD1-CB 3.35Å
48	Q	42.8	Very low	63.1	Low	181 Å²	181	112.8 Å²	112.8	85%	0.846	57%	0.573	S	S	*	*			trans	-78.3	51.7	145.3	-116.4	-170.4	-44.3	0	0	109.4	E50	Q48-E50 PolarHBondContact O-N 3.47Å
49	Q	46.3	Very low	63.8	Low	154 Å²	154	113.4 Å²	113.4	72%	0.72	57%	0.57	S	S	*	*			trans	-73.6	92	153.3	-168.2	115.7	-5.3	0	0	103.8	D47 F51	D47-Q49 PolarHBondContact O-N 2.69Å; D47-Q49 WeakPolarHBondContact OD1-CB 3.35Å; Q49-F51 PolarHBondContact O-N 3.24Å
50	E	48	Very low	64.7	Low	121 Å²	121	110.1 Å²	110.1	57%	0.565	55%	0.547	S	S	*	.			trans	-44.4	111.8	168.8	-93.2	177.3	139.6	0	0	106.8	Q48 F52	Q48-E50 PolarHBondContact O-N 3.47Å; E50-F52 HydrophobicContact CB-CD2 3.79Å; E50-F52 HydrophobicContact CB-CE1 4.43Å; E50-F52 HydrophobicContact CB-CE2 3.34Å; E50-F52 HydrophobicContact CB-CZ 3.73Å; E50-F52 HydrophobicContact CG-CE2 4.28Å; E50-F52 HydrophobicContact CG-CZ 4.22Å; E50-F52 VanDerWaalsContact O-CD2 3.26Å; E50-F52 WeakPolarHBondContact O-CD2 3.12Å; E50-F52 PolarHBondContact O-N 3.46Å; E50-F52 WeakPolarHBondContact OE2-CE2 3.49Å; E50-F52 WeakPolarHBondContact OE2-CZ 3.4Å
51	F	41.5	Very low	66	Low	175 Å²	175	103.5 Å²	103.5	77%	0.768	51%	0.514	S	S	*	.			trans	-70.7	82.6	176.1	-178.2	-97.2	0	0	0	106.4	Q49 E53	Q49-F51 PolarHBondContact O-N 3.24Å; F51-E53 HydrophobicContact CD1-CG 4.05Å; F51-E53 HydrophobicContact CE1-CG 3.52Å; F51-E53 HydrophobicContact CZ-CG 4.41Å; F51-E53 PolarHBondContact O-N 2.93Å
52	F	52.9	Low	67.4	Low	41 Å²	41	100.1 Å²	100.1	18%	0.18	49%	0.493	C	S	.	.			trans	-71.5	114.4	169.4	-68	-73.6	0	0	0	107.1	E50 D54 L279 V281	E50-F52 HydrophobicContact CB-CD2 3.79Å; E50-F52 HydrophobicContact CB-CE1 4.43Å; E50-F52 HydrophobicContact CB-CE2 3.34Å; E50-F52 HydrophobicContact CB-CZ 3.73Å; E50-F52 HydrophobicContact CG-CE2 4.28Å; E50-F52 HydrophobicContact CG-CZ 4.22Å; E50-F52 VanDerWaalsContact O-CD2 3.26Å; E50-F52 WeakPolarHBondContact O-CD2 3.12Å; E50-F52 PolarHBondContact O-N 3.46Å; E50-F52 WeakPolarHBondContact OE2-CE2 3.49Å; E50-F52 WeakPolarHBondContact OE2-CZ 3.4Å; F52-D54 VanDerWaalsContact C-N 3.28Å; F52-D54 WeakPolarHBondContact CB-OD1 3.04Å; F52-D54 PolarHBondContact O-N 2.89Å; F52-L279 HydrophobicContact CB-CD2 4.15Å; F52-L279 HydrophobicContact CD1-CB 4.32Å; F52-L279 HydrophobicContact CD1-CD2 4.43Å; F52-L279 HydrophobicContact CG-CD2 4.3Å; F52-V281 HydrophobicContact CE1-CG2 4.2Å
53	E	55.9	Low	69	Low	106 Å²	106	94.4 Å²	94.4	50%	0.495	47%	0.467	S	S	.	.			trans	-67.9	95.5	162.7	-72.4	-161.8	166.2	0	0	108	F51 F55	F51-E53 HydrophobicContact CD1-CG 4.05Å; F51-E53 HydrophobicContact CE1-CG 3.52Å; F51-E53 HydrophobicContact CZ-CG 4.41Å; F51-E53 PolarHBondContact O-N 2.93Å; E53-F55 HydrophobicContact CB-CD2 4.41Å; E53-F55 HydrophobicContact CB-CE2 3.65Å; E53-F55 HydrophobicContact CB-CZ 3.97Å; E53-F55 WeakPolarHBondContact O-CD2 3.38Å; E53-F55 WeakPolarHBondContact O-CE2 3.43Å; E53-F55 PolarHBondContact O-N 3.33Å; E53-F55 WeakPolarHBondContact OE2-CZ 3.27Å
54	D	69	Low	70.8	Confident	55 Å²	55	89.9 Å²	89.9	29%	0.294	45%	0.445	S	S	.	.			trans	-77.3	106	-179.9	-72.4	-9	0	0	0	110.3	F52 R117 Y277 L279	F52-D54 VanDerWaalsContact C-N 3.28Å; F52-D54 WeakPolarHBondContact CB-OD1 3.04Å; F52-D54 PolarHBondContact O-N 2.89Å; D54-R117 IonicContact OD2-NH2 2.94Å; D54-R117 PolarHBondContact OD2-NH2 2.98Å; D54-R117 VanDerWaalsContact OD2-NH2 3.14Å; D54-Y277 HydrophobicContact CB-CD1 3.77Å; D54-Y277 HydrophobicContact CB-CG 4.22Å; D54-L279 VanDerWaalsContact OD1-CD2 3.23Å; D54-L279 WeakPolarHBondContact OD1-CD2 3.48Å
55	F	86.6	Confident	72.7	Confident	101 Å²	101	89.5 Å²	89.5	44%	0.443	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	111.8	176.7	-65.5	-80.4	0	0	0	111.4	E53 K57 Y277 Q278	E53-F55 HydrophobicContact CB-CD2 4.41Å; E53-F55 HydrophobicContact CB-CE2 3.65Å; E53-F55 HydrophobicContact CB-CZ 3.97Å; E53-F55 WeakPolarHBondContact O-CD2 3.38Å; E53-F55 WeakPolarHBondContact O-CE2 3.43Å; E53-F55 PolarHBondContact O-N 3.33Å; E53-F55 WeakPolarHBondContact OE2-CZ 3.27Å; F55-K57 PolarHBondContact O-N 3.42Å; F55-Y277 WeakPolarHBondContact O-CA 3.44Å; F55-Q278 PolarHBondContact N-O 3.35Å; F55-Q278 PolarHBondContact O-N 3.42Å
56	L	94.3	Very high	74.5	Confident	77 Å²	77	81.6 Å²	81.6	40%	0.403	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	119.2	175.8	-179	73.9	0	0	0	111.1	R58 K275 V276 Y277	L56-R58 PolarHBondContact O-N 2.95Å; L56-K275 HydrophobicContact CD1-CB 3.93Å; L56-K275 HydrophobicContact CD1-CG 4.35Å; L56-V276 CarbonylContact C-O 3.56Å; L56-V276 WeakPolarHBondContact CA-O 3.21Å; L56-Y277 HydrophobicContact CB-CD1 4.08Å; L56-Y277 HydrophobicContact CB-CE1 3.88Å; L56-Y277 HydrophobicContact CD1-CD1 4.37Å; L56-Y277 HydrophobicContact CD1-CE1 3.94Å; L56-Y277 HydrophobicContact CD1-CE2 4.17Å; L56-Y277 HydrophobicContact CG-CE1 4.5Å
57	K	95.3	Very high	76.1	Confident	47 Å²	47	88.2 Å²	88.2	20%	0.204	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	99.8	173.4	-61.6	-59.6	-175.5	172.8	0	110.5	F55 E59 Y60 S61 L111 V276 Q278	F55-K57 PolarHBondContact O-N 3.42Å; K57-E59 VanDerWaalsContact C-N 3.29Å; K57-E59 PolarHBondContact O-N 3.47Å; K57-Y60 HydrophobicContact CB-CD2 3.83Å; K57-Y60 HydrophobicContact CG-CD2 4.46Å; K57-Y60 PolarHBondContact O-N 3.43Å; K57-S61 WeakPolarHBondContact O-CB 3.42Å; K57-S61 PolarHBondContact O-N 3.02Å; K57-S61 PolarHBondContact O-OG 3.39Å; K57-L111 HydrophobicContact CB-CD1 4.41Å; K57-L111 HydrophobicContact CG-CD1 3.85Å; K57-L111 HydrophobicContact CG-CD2 4.45Å; K57-V276 HydrophobicContact CB-CG1 4.33Å; K57-V276 PolarHBondContact N-O 3.12Å; K57-Q278 HydrophobicContact CD-CB 4.47Å; K57-Q278 VanDerWaalsContact CE-CB 3.43Å; K57-Q278 HydrophobicContact CG-CB 4.15Å
58	R	92.9	Very high	77.8	Confident	139 Å²	139	83.1 Å²	83.1	53%	0.525	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	-38.1	-174.2	-170.7	76.5	-174.9	168.9	6.8	111.9	L56 Y60 S61	L56-R58 PolarHBondContact O-N 2.95Å; R58-Y60 VanDerWaalsContact C-N 3.29Å; R58-Y60 PolarHBondContact O-N 3Å; R58-S61 PolarHBondContact O-N 2.85Å; R58-S61 VanDerWaalsContact O-N 3.12Å
59	E	92.5	Very high	79.9	Confident	74 Å²	74	74.7 Å²	74.7	35%	0.346	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	-31.9	-178	64.2	-85.2	-157.5	0	0	113	K57 I107	K57-E59 VanDerWaalsContact C-N 3.29Å; K57-E59 PolarHBondContact O-N 3.47Å; E59-I107 HydrophobicContact CB-CD1 3.74Å; E59-I107 HydrophobicContact CG-CD1 3.96Å; E59-I107 WeakPolarHBondContact O-CD1 3.42Å
60	Y	95.1	Very high	81.1	Confident	20 Å²	20	69.5 Å²	69.5	8%	0.078	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	5.3	175	-55.7	-59.4	0	0	0	113.2	K57 R58 W77 I107 P108 F109 V110 L111 L256 V276	K57-Y60 HydrophobicContact CB-CD2 3.83Å; K57-Y60 HydrophobicContact CG-CD2 4.46Å; K57-Y60 PolarHBondContact O-N 3.43Å; R58-Y60 VanDerWaalsContact C-N 3.29Å; R58-Y60 PolarHBondContact O-N 3Å; Y60-W77 WeakPolarHBondContact O-CZ2 3.27Å; Y60-I107 HydrophobicContact CD1-CD1 3.61Å; Y60-I107 HydrophobicContact CD1-CG1 3.91Å; Y60-I107 HydrophobicContact CE1-CD1 3.38Å; Y60-I107 HydrophobicContact CE1-CG1 3.71Å; Y60-P108 VanDerWaalsContact CE1-O 3.3Å; Y60-P108 WeakPolarHBondContact CE1-O 3.43Å; Y60-P108 PolarHBondContact OH-O 3.43Å; Y60-F109 AromaticContact CD1-CD2 3.67Å; Y60-F109 HydrophobicContact CD1-CD2 3.67Å; Y60-F109 HydrophobicContact CD1-CE2 4.37Å; Y60-F109 HydrophobicContact CD1-CG 4.46Å; Y60-F109 HydrophobicContact CD2-CD2 4.21Å; Y60-F109 HydrophobicContact CD2-CE2 4.21Å; Y60-F109 HydrophobicContact CE1-CB 4.41Å; Y60-F109 HydrophobicContact CE1-CD2 4.19Å; Y60-F109 AromaticContact CG-CD2 3.7Å; Y60-F109 HydrophobicContact CG-CD2 3.7Å; Y60-F109 AromaticContact CG-CE2 3.93Å; Y60-F109 HydrophobicContact CG-CE2 3.93Å; Y60-V110 WeakPolarHBondContact OH-CG2 3.27Å; Y60-L111 HydrophobicContact CD2-CD1 3.97Å; Y60-L111 HydrophobicContact CD2-CG 4.19Å; Y60-L111 HydrophobicContact CE2-CD1 4.22Å; Y60-L111 HydrophobicContact CE2-CD2 4.12Å; Y60-L111 HydrophobicContact CE2-CG 3.95Å; Y60-L256 WeakPolarHBondContact O-CD2 3.32Å; Y60-V276 VanDerWaalsContact O-CG2 3.31Å; Y60-V276 WeakPolarHBondContact O-CG2 3.33Å
61	S	96.5	Very high	82.1	Confident	8 Å²	8	73.2 Å²	73.2	6%	0.056	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.6	-176.5	-64.3	0	0	0	0	111.7	K57 R58 W77 M274 V276	K57-S61 WeakPolarHBondContact O-CB 3.42Å; K57-S61 PolarHBondContact O-N 3.02Å; K57-S61 PolarHBondContact O-OG 3.39Å; R58-S61 PolarHBondContact O-N 2.85Å; R58-S61 VanDerWaalsContact O-N 3.12Å; S61-W77 PolarHBondContact O-NE1 3Å; S61-M274 CarbonylContact C-O 3.55Å; S61-M274 WeakPolarHBondContact CA-O 3.43Å; S61-M274 WeakPolarHBondContact CB-O 3.45Å; S61-V276 PolarHBondContact OG-N 3.04Å
62	L	96.1	Very high	83.9	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.026	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	108.8	169.7	-179.6	65.6	0	0	0	108.7	Y66 L69 W77 V90 V103 I271 S273 M274	L62-Y66 HydrophobicContact CD1-CD1 3.7Å; L62-Y66 HydrophobicContact CD1-CE1 4.33Å; L62-Y66 HydrophobicContact CG-CD1 4.03Å; L62-Y66 HydrophobicContact CG-CE1 4.16Å; L62-L69 HydrophobicContact CD1-CD2 3.73Å; L62-W77 HydrophobicContact CB-CD2 4.22Å; L62-W77 HydrophobicContact CB-CH2 4.22Å; L62-W77 HydrophobicContact CB-CZ2 3.72Å; L62-W77 HydrophobicContact CD1-CD2 4.32Å; L62-W77 HydrophobicContact CD1-CG 4.13Å; L62-V90 HydrophobicContact CD1-CG2 4.39Å; L62-V90 HydrophobicContact CD2-CG2 4.03Å; L62-V103 HydrophobicContact CD2-CG1 4.07Å; L62-V103 HydrophobicContact CD2-CG2 4.13Å; L62-I271 HydrophobicContact CD2-CG2 4.07Å; L62-S273 CarbonylContact O-C 3.49Å; L62-S273 WeakPolarHBondContact O-CA 3.43Å; L62-S273 WeakPolarHBondContact O-CB 3.45Å; L62-M274 HydrophobicContact CB-CB 4.1Å; L62-M274 HydrophobicContact CD2-SD 4.48Å; L62-M274 PolarHBondContact N-O 3.37Å; L62-M274 PolarHBondContact O-N 3.05Å
63	V	95.4	Very high	85	Confident	20 Å²	20	70.3 Å²	70.3	12%	0.121	36%	0.356	C	S	.	.			trans	-142	155.8	-179.1	-63.4	0	0	0	0	112.3	Y66 K275	V63-Y66 VanDerWaalsContact C-CD1 3.46Å; V63-Y66 VanDerWaalsContact C-CE1 3.45Å; V63-Y66 WeakPolarHBondContact O-CA 3.41Å; V63-Y66 WeakPolarHBondContact O-CD1 3.17Å; V63-Y66 PolarHBondContact O-N 2.89Å; V63-K275 HydrophobicContact CG1-CG 3.82Å
64	K	92.3	Very high	86	Confident	88 Å²	88	69.4 Å²	69.4	38%	0.383	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	142.5	171.6	-57.1	-176.3	-169.3	-157.7	0	110.9	Y66 D88	K64-Y66 HydrophobicContact CB-CE2 4.45Å; K64-Y66 HydrophobicContact CG-CE1 4.39Å; K64-Y66 HydrophobicContact CG-CE2 3.83Å; K64-Y66 VanDerWaalsContact CG-OH 3.31Å; K64-Y66 WeakPolarHBondContact CG-OH 3.38Å; K64-D88 WeakPolarHBondContact CE-O 3.48Å; K64-D88 VanDerWaalsContact NZ-CA 3.35Å; K64-D88 PolarHBondContact NZ-O 3.34Å; K64-D88 IonicContact NZ-OD1 2.95Å; K64-D88 PolarHBondContact NZ-OD1 3.32Å
65	P	92.1	Very high	86.9	Confident	83 Å²	83	67.2 Å²	67.2	54%	0.539	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.5	31	1.7	37.6	-35.8	0	0	0	113.5	R67	P65-R67 VanDerWaalsContact C-N 3.31Å; P65-R67 HydrophobicContact CG-CG 3.9Å; P65-R67 PolarHBondContact O-N 3.49Å
66	Y	90.6	Very high	87.2	Confident	11 Å²	11	66.4 Å²	66.4	4%	0.043	35%	0.349	C	S	.	.			trans	52.3	42	176.7	-41.2	-69.1	0	0	0	114.5	L62 V63 K64 G68 L69 V85 T86 D88 H89 V90 I272	L62-Y66 HydrophobicContact CD1-CD1 3.7Å; L62-Y66 HydrophobicContact CD1-CE1 4.33Å; L62-Y66 HydrophobicContact CG-CD1 4.03Å; L62-Y66 HydrophobicContact CG-CE1 4.16Å; V63-Y66 VanDerWaalsContact C-CD1 3.46Å; V63-Y66 VanDerWaalsContact C-CE1 3.45Å; V63-Y66 WeakPolarHBondContact O-CA 3.41Å; V63-Y66 WeakPolarHBondContact O-CD1 3.17Å; V63-Y66 PolarHBondContact O-N 2.89Å; K64-Y66 HydrophobicContact CB-CE2 4.45Å; K64-Y66 HydrophobicContact CG-CE1 4.39Å; K64-Y66 HydrophobicContact CG-CE2 3.83Å; K64-Y66 VanDerWaalsContact CG-OH 3.31Å; K64-Y66 WeakPolarHBondContact CG-OH 3.38Å; Y66-G68 PolarHBondContact O-N 2.99Å; Y66-G68 VanDerWaalsContact O-N 3.15Å; Y66-L69 WeakPolarHBondContact O-CB 3.43Å; Y66-L69 PolarHBondContact O-N 2.96Å; Y66-V85 HydrophobicContact CD2-CG1 3.73Å; Y66-V85 HydrophobicContact CG-CG1 4.07Å; Y66-T86 WeakPolarHBondContact CD2-O 3.26Å; Y66-T86 WeakPolarHBondContact CE2-O 3.48Å; Y66-D88 PolarHBondContact OH-O 3.32Å; Y66-H89 VanDerWaalsContact OH-CA 3.3Å; Y66-H89 WeakPolarHBondContact OH-CA 3.4Å; Y66-V90 HydrophobicContact CD1-CG2 3.95Å; Y66-V90 HydrophobicContact CD2-CG2 4.48Å; Y66-V90 HydrophobicContact CE1-CG2 4Å; Y66-V90 HydrophobicContact CG-CG2 4.2Å; Y66-I272 PolarHBondContact OH-O 3.02Å
67	R	78.3	Confident	87.2	Confident	211 Å²	211	63 Å²	63	80%	0.796	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	121.7	-171.3	-67.2	-172.6	179.2	167	-0.2	112.1	P65 L69	P65-R67 VanDerWaalsContact C-N 3.31Å; P65-R67 HydrophobicContact CG-CG 3.9Å; P65-R67 PolarHBondContact O-N 3.49Å; R67-L69 VanDerWaalsContact C-N 3.25Å; R67-L69 PolarHBondContact O-N 3.5Å
68	G	79.3	Confident	87.2	Confident	28 Å²	28	62.5 Å²	62.5	29%	0.289	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	-4.4	174.4	0	0	0	0	0	115.6	Y66 G70 F71 S72	Y66-G68 PolarHBondContact O-N 2.99Å; Y66-G68 VanDerWaalsContact O-N 3.15Å; G68-G70 PolarHBondContact O-N 3.4Å; G68-F71 PolarHBondContact O-N 3.04Å; G68-S72 WeakPolarHBondContact O-CB 3.29Å; G68-S72 PolarHBondContact O-N 3.03Å
69	L	86.4	Confident	87.4	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	128.4	177.5	-173.3	54.8	0	0	0	110.4	L62 Y66 R67 F71 W77 L79 V85 V90 V103	L62-L69 HydrophobicContact CD1-CD2 3.73Å; Y66-L69 WeakPolarHBondContact O-CB 3.43Å; Y66-L69 PolarHBondContact O-N 2.96Å; R67-L69 VanDerWaalsContact C-N 3.25Å; R67-L69 PolarHBondContact O-N 3.5Å; L69-F71 VanDerWaalsContact C-N 3.3Å; L69-F71 WeakPolarHBondContact O-CD2 3.3Å; L69-F71 PolarHBondContact O-N 3.05Å; L69-W77 HydrophobicContact CD1-CB 3.58Å; L69-W77 VanDerWaalsContact CD1-O 3.26Å; L69-W77 WeakPolarHBondContact CD1-O 3.46Å; L69-L79 HydrophobicContact CD1-CD2 4.12Å; L69-L79 HydrophobicContact CD1-CG 3.88Å; L69-L79 HydrophobicContact CD2-CD2 4.03Å; L69-L79 HydrophobicContact CG-CD1 4.18Å; L69-L79 HydrophobicContact CG-CD2 4.01Å; L69-L79 HydrophobicContact CG-CG 3.94Å; L69-V85 HydrophobicContact CB-CG2 4.1Å; L69-V85 HydrophobicContact CD2-CG2 3.54Å; L69-V85 HydrophobicContact CG-CG2 3.6Å; L69-V90 HydrophobicContact CD2-CG2 3.79Å; L69-V103 HydrophobicContact CD1-CG2 4.48Å; L69-V103 HydrophobicContact CD2-CG2 4.35Å
70	G	71.3	Confident	87.5	Confident	45 Å²	45	55.5 Å²	55.5	46%	0.464	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-11.2	-179.7	0	0	0	0	0	116.3	G68	G68-G70 PolarHBondContact O-N 3.4Å
71	F	70.4	Confident	87.5	Confident	199 Å²	199	57.4 Å²	57.4	87%	0.873	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	-25.3	-175	-58.7	-77.3	0	0	0	114.5	G68 L69	G68-F71 PolarHBondContact O-N 3.04Å; L69-F71 VanDerWaalsContact C-N 3.3Å; L69-F71 WeakPolarHBondContact O-CD2 3.3Å; L69-F71 PolarHBondContact O-N 3.05Å
72	S	78.6	Confident	87.5	Confident	38 Å²	38	59.1 Å²	59.1	27%	0.266	34%	0.34	S	S	.	.			trans	-117.2	135.7	-173.9	-171.7	0	0	0	0	112.5	G68 S74 S75 R106	G68-S72 WeakPolarHBondContact O-CB 3.29Å; G68-S72 PolarHBondContact O-N 3.03Å; S72-S74 PolarHBondContact O-N 2.98Å; S72-S74 PolarHBondContact OG-N 3.36Å; S72-S74 VanDerWaalsContact OG-N 3.1Å; S72-S74 PolarHBondContact OG-OG 2.74Å; S72-S75 PolarHBondContact O-N 2.73Å; S72-R106 PolarHBondContact O-NH1 2.94Å; S72-R106 PolarHBondContact O-NH2 3.41Å
73	S	75.7	Confident	87.6	Confident	117 Å²	117	59.5 Å²	59.5	82%	0.818	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-12.7	166.7	56.2	0	0	0	0	113	R106	S73-R106 VanDerWaalsContact CA-NH1 3.32Å; S73-R106 PolarHBondContact O-NH1 3.1Å
74	S	78.4	Confident	87.6	Confident	88 Å²	88	62.8 Å²	62.8	62%	0.615	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.3	176.1	68.2	0	0	0	0	115.1	S72	S72-S74 PolarHBondContact O-N 2.98Å; S72-S74 PolarHBondContact OG-N 3.36Å; S72-S74 VanDerWaalsContact OG-N 3.1Å; S72-S74 PolarHBondContact OG-OG 2.74Å
75	S	87.4	Confident	87.7	Confident	9 Å²	9	60.9 Å²	60.9	6%	0.063	36%	0.355	C	S	.	.			trans	-65.9	142.8	175.8	-167.3	0	0	0	0	111.1	S72 W77 R106	S72-S75 PolarHBondContact O-N 2.73Å; S75-W77 PolarHBondContact O-N 2.9Å; S75-W77 PolarHBondContact OG-N 2.91Å; S75-W77 PolarHBondContact OG-O 2.91Å; S75-R106 VanDerWaalsContact O-CD 3.25Å; S75-R106 WeakPolarHBondContact O-CD 3.19Å; S75-R106 PolarHBondContact O-NE 3.48Å; S75-R106 PolarHBondContact O-NH1 3.47Å
76	Q	92.1	Very high	87.8	Confident	84 Å²	84	58.5 Å²	58.5	39%	0.393	34%	0.339	S	S	.	.	S	Bend	trans	-77.8	0.2	170.4	-63.5	81.6	6.8	0	0	112.8	S105 R106	Q76-S105 CarbonylContact O-C 3.58Å; Q76-S105 WeakPolarHBondContact O-CA 3.41Å; Q76-R106 PolarHBondContact O-N 3.03Å
77	W	95.2	Very high	88	Confident	5 Å²	5	62.9 Å²	62.9	2%	0.019	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146.8	-174.4	-65.2	86.4	0	0	0	111.5	Y60 S61 L62 L69 S75 V103 W104 L256 M274	Y60-W77 WeakPolarHBondContact O-CZ2 3.27Å; S61-W77 PolarHBondContact O-NE1 3Å; L62-W77 HydrophobicContact CB-CD2 4.22Å; L62-W77 HydrophobicContact CB-CH2 4.22Å; L62-W77 HydrophobicContact CB-CZ2 3.72Å; L62-W77 HydrophobicContact CD1-CD2 4.32Å; L62-W77 HydrophobicContact CD1-CG 4.13Å; L69-W77 HydrophobicContact CD1-CB 3.58Å; L69-W77 VanDerWaalsContact CD1-O 3.26Å; L69-W77 WeakPolarHBondContact CD1-O 3.46Å; S75-W77 PolarHBondContact O-N 2.9Å; S75-W77 PolarHBondContact OG-N 2.91Å; S75-W77 PolarHBondContact OG-O 2.91Å; W77-V103 HydrophobicContact CB-CG2 4.3Å; W77-V103 HydrophobicContact CE3-CG2 3.91Å; W77-W104 CarbonylContact C-O 3.6Å; W77-W104 VanDerWaalsContact CA-O 3.24Å; W77-W104 WeakPolarHBondContact CA-O 3.34Å; W77-L256 HydrophobicContact CH2-CB 4.3Å; W77-L256 HydrophobicContact CH2-CD2 3.72Å; W77-L256 HydrophobicContact CH2-CG 3.89Å; W77-L256 HydrophobicContact CZ2-CD2 4.21Å; W77-M274 HydrophobicContact CH2-CE 4.23Å; W77-M274 HydrophobicContact CH2-SD 3.92Å; W77-M274 HydrophobicContact CZ3-SD 4.2Å
78	D	95.1	Very high	88.8	Confident	36 Å²	36	57.3 Å²	57.3	19%	0.193	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.6	174.4	-82	-38.4	0	0	0	110.9	V103 W104 R106 M144	D78-V103 CarbonylContact O-C 3.49Å; D78-V103 VanDerWaalsContact O-CA 3.24Å; D78-V103 WeakPolarHBondContact O-CA 3.47Å; D78-W104 PolarHBondContact N-O 3.34Å; D78-W104 PolarHBondContact O-N 3.2Å; D78-R106 IonicContact OD1-CZ 3.58Å; D78-R106 IonicContact OD1-NE 3.11Å; D78-R106 PolarHBondContact OD1-NE 3.38Å; D78-R106 IonicContact OD1-NH2 2.81Å; D78-R106 PolarHBondContact OD1-NH2 3.37Å; D78-R106 VanDerWaalsContact OD2-CG 3.24Å; D78-R106 WeakPolarHBondContact OD2-CG 3.35Å; D78-R106 IonicContact OD2-NE 3.99Å; D78-R106 PolarHBondContact OD2-NE 2.87Å; D78-R106 VanDerWaalsContact OD2-NE 3.11Å; D78-M144 HydrophobicContact CB-CE 4.16Å; D78-M144 HydrophobicContact CB-SD 3.89Å
79	L	95.8	Very high	89.6	Confident	42 Å²	42	57.5 Å²	57.5	22%	0.22	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	149.2	170.3	-61.9	170.6	0	0	0	109.8	L69 A83 V85 V90 V103	L69-L79 HydrophobicContact CD1-CD2 4.12Å; L69-L79 HydrophobicContact CD1-CG 3.88Å; L69-L79 HydrophobicContact CD2-CD2 4.03Å; L69-L79 HydrophobicContact CG-CD1 4.18Å; L69-L79 HydrophobicContact CG-CD2 4.01Å; L69-L79 HydrophobicContact CG-CG 3.94Å; L79-A83 HydrophobicContact CB-CB 4.41Å; L79-A83 HydrophobicContact CD2-CB 4.05Å; L79-V85 HydrophobicContact CD1-CG2 3.58Å; L79-V85 HydrophobicContact CD2-CG2 4.07Å; L79-V85 HydrophobicContact CG-CG2 4.33Å; L79-V90 HydrophobicContact CD2-CG1 3.78Å; L79-V103 HydrophobicContact CD2-CB 4.22Å; L79-V103 HydrophobicContact CD2-CG2 4Å
80	M	95.3	Very high	90.2	Very high	25 Å²	25	57.3 Å²	57.3	12%	0.123	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	149.6	179.1	-179	170.7	168.4	0	0	111.1	T82 A83 G101 A102 M144 N146	M80-T82 PolarHBondContact O-N 3.13Å; M80-A83 VanDerWaalsContact O-CB 3.28Å; M80-A83 WeakPolarHBondContact O-CB 3.27Å; M80-A83 PolarHBondContact O-N 3.01Å; M80-G101 VanDerWaalsContact O-CA 3.29Å; M80-G101 WeakPolarHBondContact O-CA 3.32Å; M80-A102 HydrophobicContact CB-CB 4.22Å; M80-A102 PolarHBondContact N-O 3.17Å; M80-A102 PolarHBondContact O-N 3.31Å; M80-M144 HydrophobicContact CB-CE 3.76Å; M80-M144 HydrophobicContact CB-SD 3.96Å; M80-M144 WeakPolarHBondContact CE-O 3.33Å; M80-M144 HydrophobicContact CG-CE 4.17Å; M80-M144 WeakPolarHBondContact SD-CA 3.23Å; M80-M144 HydrophobicContact SD-CB 4Å; M80-M144 HydrophobicContact SD-CE 4.13Å; M80-M144 HydrophobicContact SD-SD 4.05Å; M80-N146 HydrophobicContact CE-CB 3.9Å; M80-N146 VanDerWaalsContact CE-N 3.27Å; M80-N146 WeakPolarHBondContact CE-OD1 3.18Å
81	G	95.6	Very high	91.5	Very high	59 Å²	59	57.3 Å²	57.3	61%	0.608	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	63.9	-130.3	175.9	0	0	0	0	0	111.7	A83 Q100	G81-A83 PolarHBondContact O-N 3.14Å; G81-Q100 CarbonylContact C-O 3.44Å; G81-Q100 WeakPolarHBondContact CA-O 3.46Å
82	T	96.6	Very high	92.8	Very high	44 Å²	44	47.9 Å²	47.9	27%	0.27	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	3.9	-177.9	58.4	0	0	0	0	113.6	M80 M84 L92 R99 Q100	M80-T82 PolarHBondContact O-N 3.13Å; T82-M84 PolarHBondContact O-N 3.5Å; T82-L92 CarbonylContact C-O 3.47Å; T82-L92 PolarHBondContact OG1-O 3.48Å; T82-R99 HydrophobicContact CG2-CB 4.09Å; T82-R99 HydrophobicContact CG2-CG 4.34Å; T82-Q100 PolarHBondContact N-O 2.85Å; T82-Q100 PolarHBondContact OG1-O 3.11Å; T82-Q100 VanDerWaalsContact OG1-O 3.11Å
83	A	97.3	Very high	93.7	Very high	14 Å²	14	46 Å²	46	12%	0.116	28%	0.279	C	S	.	.			trans	-65.3	133.6	-175.5	0	0	0	0	0	111.3	L79 M80 G81 R91 L92 A102	L79-A83 HydrophobicContact CB-CB 4.41Å; L79-A83 HydrophobicContact CD2-CB 4.05Å; M80-A83 VanDerWaalsContact O-CB 3.28Å; M80-A83 WeakPolarHBondContact O-CB 3.27Å; M80-A83 PolarHBondContact O-N 3.01Å; G81-A83 PolarHBondContact O-N 3.14Å; A83-R91 CarbonylContact C-O 3.55Å; A83-R91 WeakPolarHBondContact CA-O 3.16Å; A83-L92 WeakPolarHBondContact CA-O 3.4Å; A83-L92 PolarHBondContact N-O 3.23Å; A83-A102 WeakPolarHBondContact CB-O 3.37Å
84	M	95.5	Very high	94.7	Very high	89 Å²	89	41.6 Å²	41.6	44%	0.438	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.5	179.5	66.6	168.7	179.9	0	0	111.9	T82 V90 R91	T82-M84 PolarHBondContact O-N 3.5Å; M84-V90 CarbonylContact O-C 3.55Å; M84-V90 WeakPolarHBondContact O-CA 3.43Å; M84-R91 HydrophobicContact CE-CB 4.21Å; M84-R91 HydrophobicContact CE-CG 4.32Å; M84-R91 HydrophobicContact CG-CB 3.98Å; M84-R91 PolarHBondContact N-O 3.26Å; M84-R91 PolarHBondContact O-N 2.99Å
85	V	95.5	Very high	95.6	Very high	47 Å²	47	39.4 Å²	39.4	29%	0.285	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	132.7	-177.9	-178.2	0	0	0	0	109.5	Y66 L69 L79 V90	Y66-V85 HydrophobicContact CD2-CG1 3.73Å; Y66-V85 HydrophobicContact CG-CG1 4.07Å; L69-V85 HydrophobicContact CB-CG2 4.1Å; L69-V85 HydrophobicContact CD2-CG2 3.54Å; L69-V85 HydrophobicContact CG-CG2 3.6Å; L79-V85 HydrophobicContact CD1-CG2 3.58Å; L79-V85 HydrophobicContact CD2-CG2 4.07Å; L79-V85 HydrophobicContact CG-CG2 4.33Å; V85-V90 HydrophobicContact CG2-CG1 4.49Å; V85-V90 HydrophobicContact CG2-CG2 4.22Å
86	T	94.1	Very high	96	Very high	33 Å²	33	43.6 Å²	43.6	20%	0.202	25%	0.247	C	C	.	.			trans	-115.6	171	168.2	76.7	0	0	0	0	109.2	Y66 D88 H89	Y66-T86 WeakPolarHBondContact CD2-O 3.26Å; Y66-T86 WeakPolarHBondContact CE2-O 3.48Å; T86-D88 PolarHBondContact O-N 3.48Å; T86-D88 VanDerWaalsContact O-N 3.17Å; T86-D88 PolarHBondContact OG1-N 3.05Å; T86-H89 PolarHBondContact N-O 3.13Å; T86-H89 PolarHBondContact OG1-CE1 3.19Å; T86-H89 PolarHBondContact OG1-N 3.23Å; T86-H89 PolarHBondContact OG1-ND1 3.37Å; T86-H89 VanDerWaalsContact OG1-ND1 3.16Å; T86-H89 PolarHBondContact OG1-O 3.43Å
87	P	93.4	Very high	96.1	Very high	104 Å²	104	45.1 Å²	45.1	68%	0.675	26%	0.255	S	S	*	.	S	Bend	trans	-58.7	-24.3	172.8	-25.6	36.4	0	0	0	113.8
88	D	95.1	Very high	96.1	Very high	94 Å²	94	49.2 Å²	49.2	50%	0.503	28%	0.284	S	S	.	.	S	Bend	trans	-110.2	-19.3	-169	-75.1	-52.7	0	0	0	115.6	K64 Y66 T86	K64-D88 WeakPolarHBondContact CE-O 3.48Å; K64-D88 VanDerWaalsContact NZ-CA 3.35Å; K64-D88 PolarHBondContact NZ-O 3.34Å; K64-D88 IonicContact NZ-OD1 2.95Å; K64-D88 PolarHBondContact NZ-OD1 3.32Å; Y66-D88 PolarHBondContact OH-O 3.32Å; T86-D88 PolarHBondContact O-N 3.48Å; T86-D88 VanDerWaalsContact O-N 3.17Å; T86-D88 PolarHBondContact OG1-N 3.05Å
89	H	97.3	Very high	96.2	Very high	32 Å²	32	52.1 Å²	52.1	15%	0.148	29%	0.292	C	S	.	.			trans	-166.3	160.6	-178.5	59.1	-83.3	0	0	0	111.1	Y66 T86 R91 D270 I271 I272	Y66-H89 VanDerWaalsContact OH-CA 3.3Å; Y66-H89 WeakPolarHBondContact OH-CA 3.4Å; T86-H89 PolarHBondContact N-O 3.13Å; T86-H89 PolarHBondContact OG1-CE1 3.19Å; T86-H89 PolarHBondContact OG1-N 3.23Å; T86-H89 PolarHBondContact OG1-ND1 3.37Å; T86-H89 VanDerWaalsContact OG1-ND1 3.16Å; T86-H89 PolarHBondContact OG1-O 3.43Å; H89-R91 PolarHBondContact NE2-NH2 2.86Å; H89-D270 HydrophobicContact CB-CB 4.12Å; H89-D270 IonicContact CD2-OD1 3.42Å; H89-D270 PolarHBondContact CD2-OD1 3.37Å; H89-D270 IonicContact CD2-OD2 2.7Å; H89-D270 IonicContact CE1-OD2 3.63Å; H89-D270 IonicContact NE2-OD1 2.76Å; H89-D270 PolarHBondContact NE2-OD1 3.07Å; H89-D270 IonicContact NE2-OD2 3.73Å; H89-D270 PolarHBondContact NE2-OD2 3.22Å; H89-I271 WeakPolarHBondContact CA-O 3.46Å; H89-I272 HydrophobicContact CB-CG1 4.3Å
90	V	98.1	Very high	96.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	113.8	162.9	-177.6	0	0	0	0	107.6	L62 Y66 L69 L79 M84 V85 V103 I271	L62-V90 HydrophobicContact CD1-CG2 4.39Å; L62-V90 HydrophobicContact CD2-CG2 4.03Å; Y66-V90 HydrophobicContact CD1-CG2 3.95Å; Y66-V90 HydrophobicContact CD2-CG2 4.48Å; Y66-V90 HydrophobicContact CE1-CG2 4Å; Y66-V90 HydrophobicContact CG-CG2 4.2Å; L69-V90 HydrophobicContact CD2-CG2 3.79Å; L79-V90 HydrophobicContact CD2-CG1 3.78Å; M84-V90 CarbonylContact O-C 3.55Å; M84-V90 WeakPolarHBondContact O-CA 3.43Å; V85-V90 HydrophobicContact CG2-CG1 4.49Å; V85-V90 HydrophobicContact CG2-CG2 4.22Å; V90-V103 HydrophobicContact CG1-CB 4.41Å; V90-I271 PolarHBondContact N-O 2.85Å; V90-I271 PolarHBondContact O-N 2.81Å
91	R	98.3	Very high	96.5	Very high	45 Å²	45	52.5 Å²	52.5	17%	0.17	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119	174.9	179	158.3	-65.1	165.6	2.3	109	A83 M84 H89 T93 D270	A83-R91 CarbonylContact C-O 3.55Å; A83-R91 WeakPolarHBondContact CA-O 3.16Å; M84-R91 HydrophobicContact CE-CB 4.21Å; M84-R91 HydrophobicContact CE-CG 4.32Å; M84-R91 HydrophobicContact CG-CB 3.98Å; M84-R91 PolarHBondContact N-O 3.26Å; M84-R91 PolarHBondContact O-N 2.99Å; H89-R91 PolarHBondContact NE2-NH2 2.86Å; R91-T93 VanDerWaalsContact CG-O 3.3Å; R91-T93 WeakPolarHBondContact CG-O 3.32Å; R91-D270 WeakPolarHBondContact CA-OD1 3.25Å; R91-D270 VanDerWaalsContact CB-OD1 3.25Å; R91-D270 WeakPolarHBondContact CB-OD1 3.36Å; R91-D270 VanDerWaalsContact CG-OD1 3.27Å; R91-D270 WeakPolarHBondContact CG-OD1 3.17Å; R91-D270 IonicContact CZ-OD1 3.09Å; R91-D270 IonicContact CZ-OD2 3.11Å; R91-D270 IonicContact NE-OD1 2.89Å; R91-D270 PolarHBondContact NE-OD1 3.07Å; R91-D270 IonicContact NE-OD2 2.71Å; R91-D270 IonicContact NH2-OD1 3.23Å; R91-D270 PolarHBondContact NH2-OD1 3.15Å; R91-D270 IonicContact NH2-OD2 2.75Å; R91-D270 PolarHBondContact NH2-OD2 3.31Å
92	L	98.4	Very high	96.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-52.2	176.7	-57.4	178.5	0	0	0	110.3	T82 A83 G101 V103 I135 A258 H269 I271	T82-L92 CarbonylContact C-O 3.47Å; T82-L92 PolarHBondContact OG1-O 3.48Å; A83-L92 WeakPolarHBondContact CA-O 3.4Å; A83-L92 PolarHBondContact N-O 3.23Å; L92-G101 WeakPolarHBondContact O-CA 3.45Å; L92-V103 HydrophobicContact CD2-CB 4.29Å; L92-V103 HydrophobicContact CD2-CG1 3.91Å; L92-I135 HydrophobicContact CD1-CG2 4.22Å; L92-A258 HydrophobicContact CD1-CB 4.19Å; L92-H269 HydrophobicContact CB-CB 4.4Å; L92-H269 PolarHBondContact N-O 2.87Å; L92-I271 HydrophobicContact CD1-CD1 4.27Å; L92-I271 HydrophobicContact CD1-CG1 3.81Å; L92-I271 HydrophobicContact CD2-CG1 4.35Å; L92-I271 HydrophobicContact CG-CG1 4.08Å
93	T	98.3	Very high	96.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.2	176.6	54.2	0	0	0	0	109.9	R91 R99 S260 N268 H269	R91-T93 VanDerWaalsContact CG-O 3.3Å; R91-T93 WeakPolarHBondContact CG-O 3.32Å; T93-R99 HydrophobicContact CG2-CB 4.03Å; T93-S260 VanDerWaalsContact CG2-O 3.3Å; T93-S260 WeakPolarHBondContact CG2-O 3.17Å; T93-S260 PolarHBondContact OG1-OG 2.83Å; T93-S260 VanDerWaalsContact OG1-OG 3.06Å; T93-N268 WeakPolarHBondContact O-CA 3.46Å; T93-H269 PolarHBondContact O-N 2.95Å; T93-H269 WeakPolarHBondContact OG1-CB 3.48Å; T93-H269 PolarHBondContact OG1-ND1 2.8Å
94	P	97.3	Very high	96.7	Very high	24 Å²	24	47 Å²	47	16%	0.156	25%	0.246	C	C	.	.			trans	-79	164.6	167.6	34.5	-34	0	0	0	111	Q96 R99 D267	P94-Q96 HydrophobicContact CB-CG 4.34Å; P94-Q96 HydrophobicContact CG-CB 4.19Å; P94-Q96 HydrophobicContact CG-CG 4.14Å; P94-Q96 PolarHBondContact O-N 3.25Å; P94-R99 HydrophobicContact CG-CG 4.12Å; P94-D267 CarbonylContact C-O 3.59Å
95	D	96.4	Very high	96.8	Very high	41 Å²	41	42.8 Å²	42.8	22%	0.219	23%	0.225	C	C	.	.	S	Bend	trans	-67.6	67.5	167.8	-169	7	0	0	0	110.8	G124 I125 S266 N268	D95-G124 WeakPolarHBondContact OD2-CA 3.39Å; D95-I125 PolarHBondContact OD2-N 2.81Å; D95-S266 WeakPolarHBondContact OD1-CB 3.49Å; D95-S266 PolarHBondContact OD1-OG 3.21Å; D95-N268 PolarHBondContact N-OD1 2.82Å
96	Q	95.4	Very high	96.7	Very high	97 Å²	97	43.5 Å²	43.5	45%	0.453	22%	0.223	S	C	.	.	S	Bend	trans	-142.7	144.8	174.6	-62.1	-179.3	14.9	0	0	108.2	P94 R99 T262 S266	P94-Q96 HydrophobicContact CB-CG 4.34Å; P94-Q96 HydrophobicContact CG-CB 4.19Å; P94-Q96 HydrophobicContact CG-CG 4.14Å; P94-Q96 PolarHBondContact O-N 3.25Å; Q96-R99 HydrophobicContact CB-CG 4.04Å; Q96-R99 WeakPolarHBondContact O-CG 3.35Å; Q96-T262 WeakPolarHBondContact O-CB 3.21Å; Q96-T262 PolarHBondContact O-OG1 3.38Å; Q96-S266 VanDerWaalsContact C-CB 3.44Å; Q96-S266 PolarHBondContact N-OG 3.25Å; Q96-S266 WeakPolarHBondContact O-CB 3.37Å
97	Q	95	Very high	96.8	Very high	117 Å²	117	44.3 Å²	44.3	55%	0.547	23%	0.225	S	C	.	.	S	Bend	trans	-64.9	154.8	178.4	-67.8	174.3	-18.1	0	0	112.7	R99 G263 D264	Q97-R99 PolarHBondContact O-N 3.16Å; Q97-G263 WeakPolarHBondContact CA-O 3.07Å; Q97-G263 WeakPolarHBondContact CB-O 3.33Å; Q97-D264 WeakPolarHBondContact CG-O 3.43Å; Q97-D264 PolarHBondContact NE2-O 3.05Å
98	S	95.2	Very high	96.9	Very high	90 Å²	90	42 Å²	42	63%	0.629	21%	0.21	S	C	*	.	S	Bend	trans	55.8	44.1	170.4	-58.2	0	0	0	0	113.9	T262 G263	S98-T262 WeakPolarHBondContact CA-O 3.41Å; S98-T262 PolarHBondContact N-O 2.89Å; S98-T262 VanDerWaalsContact N-O 3.12Å; S98-T262 PolarHBondContact N-OG1 3.36Å; S98-G263 PolarHBondContact N-O 3.11Å
99	R	97.6	Very high	97	Very high	98 Å²	98	37.8 Å²	37.8	37%	0.37	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	145.4	176.3	-58.6	-53.8	-171.8	-172.1	-0.2	110.2	T82 T93 P94 Q96 Q97 A261 T262	T82-R99 HydrophobicContact CG2-CB 4.09Å; T82-R99 HydrophobicContact CG2-CG 4.34Å; T93-R99 HydrophobicContact CG2-CB 4.03Å; P94-R99 HydrophobicContact CG-CG 4.12Å; Q96-R99 HydrophobicContact CB-CG 4.04Å; Q96-R99 WeakPolarHBondContact O-CG 3.35Å; Q97-R99 PolarHBondContact O-N 3.16Å; R99-A261 CarbonylContact O-C 3.43Å; R99-A261 VanDerWaalsContact O-CA 3.23Å; R99-A261 WeakPolarHBondContact O-CA 3.28Å; R99-T262 WeakPolarHBondContact CB-OG1 3.38Å; R99-T262 PolarHBondContact N-O 3.29Å; R99-T262 PolarHBondContact N-OG1 3.43Å; R99-T262 PolarHBondContact O-N 3.49Å
100	Q	97.9	Very high	96.9	Very high	72 Å²	72	40 Å²	40	34%	0.336	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	131.6	172.1	-62.9	-173.6	3.1	0	0	107.7	G81 T82 S260 A261	G81-Q100 CarbonylContact C-O 3.44Å; G81-Q100 WeakPolarHBondContact CA-O 3.46Å; T82-Q100 PolarHBondContact N-O 2.85Å; T82-Q100 PolarHBondContact OG1-O 3.11Å; T82-Q100 VanDerWaalsContact OG1-O 3.11Å; Q100-S260 WeakPolarHBondContact CA-O 3.26Å; Q100-A261 HydrophobicContact CG-CB 3.88Å
101	G	98.1	Very high	96.7	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	150.2	177.4	0	0	0	0	0	111.7	M80 L92 S259 S260	M80-G101 VanDerWaalsContact O-CA 3.29Å; M80-G101 WeakPolarHBondContact O-CA 3.32Å; L92-G101 WeakPolarHBondContact O-CA 3.45Å; G101-S259 CarbonylContact O-C 3.58Å; G101-S259 WeakPolarHBondContact O-CA 3.25Å; G101-S260 PolarHBondContact N-O 2.98Å; G101-S260 PolarHBondContact O-N 2.71Å
102	A	98.3	Very high	96.4	Very high	2 Å²	2	43.1 Å²	43.1	2%	0.017	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	159.2	-178.7	0	0	0	0	0	111.7	M80 A83 A258	M80-A102 HydrophobicContact CB-CB 4.22Å; M80-A102 PolarHBondContact N-O 3.17Å; M80-A102 PolarHBondContact O-N 3.31Å; A83-A102 WeakPolarHBondContact CB-O 3.37Å; A102-A258 CarbonylContact C-O 3.55Å; A102-A258 WeakPolarHBondContact CA-O 3.27Å; A102-A258 WeakPolarHBondContact CB-O 3.48Å
103	V	97.9	Very high	96.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.3	168.4	65.9	0	0	0	0	108.3	L62 L69 W77 D78 L79 V90 L92 G257 A258	L62-V103 HydrophobicContact CD2-CG1 4.07Å; L62-V103 HydrophobicContact CD2-CG2 4.13Å; L69-V103 HydrophobicContact CD1-CG2 4.48Å; L69-V103 HydrophobicContact CD2-CG2 4.35Å; W77-V103 HydrophobicContact CB-CG2 4.3Å; W77-V103 HydrophobicContact CE3-CG2 3.91Å; D78-V103 CarbonylContact O-C 3.49Å; D78-V103 VanDerWaalsContact O-CA 3.24Å; D78-V103 WeakPolarHBondContact O-CA 3.47Å; L79-V103 HydrophobicContact CD2-CB 4.22Å; L79-V103 HydrophobicContact CD2-CG2 4Å; V90-V103 HydrophobicContact CG1-CB 4.41Å; L92-V103 HydrophobicContact CD2-CB 4.29Å; L92-V103 HydrophobicContact CD2-CG1 3.91Å; V103-G257 CarbonylContact O-C 3.49Å; V103-G257 WeakPolarHBondContact O-CA 3.44Å; V103-A258 HydrophobicContact CG1-CB 4.07Å; V103-A258 PolarHBondContact N-O 3.04Å; V103-A258 PolarHBondContact O-N 2.85Å
104	W	97.9	Very high	96.1	Very high	1 Å²	1	44 Å²	44	0%	0.004	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.7	-172.8	-73.9	99.4	0	0	0	111.7	W77 D78 W138 T140 R143 M144 L256	W77-W104 CarbonylContact C-O 3.6Å; W77-W104 VanDerWaalsContact CA-O 3.24Å; W77-W104 WeakPolarHBondContact CA-O 3.34Å; D78-W104 PolarHBondContact N-O 3.34Å; D78-W104 PolarHBondContact O-N 3.2Å; W104-W138 HydrophobicContact CH2-CB 3.37Å; W104-W138 AromaticContact CH2-CD1 3.73Å; W104-W138 HydrophobicContact CH2-CD2 4.33Å; W104-W138 AromaticContact CH2-CG 3.53Å; W104-W138 HydrophobicContact CH2-CG 3.53Å; W104-W138 HydrophobicContact CZ2-CB 4.34Å; W104-W138 AromaticContact CZ2-CD1 3.86Å; W104-W138 HydrophobicContact CZ2-CG 4.1Å; W104-W138 HydrophobicContact CZ3-CB 3.63Å; W104-W138 HydrophobicContact CZ3-CG 4.27Å; W104-T140 VanDerWaalsContact CH2-OG1 3.26Å; W104-T140 WeakPolarHBondContact CH2-OG1 3.46Å; W104-T140 VanDerWaalsContact CZ3-OG1 3.28Å; W104-T140 WeakPolarHBondContact CZ3-OG1 3.23Å; W104-R143 HydrophobicContact CB-CB 4.32Å; W104-R143 HydrophobicContact CD2-CB 3.85Å; W104-R143 HydrophobicContact CE3-CB 3.74Å; W104-R143 HydrophobicContact CG-CB 4.12Å; W104-R143 HydrophobicContact CZ3-CB 4.34Å; W104-M144 HydrophobicContact CB-CG 4.46Å; W104-M144 HydrophobicContact CB-SD 4.03Å; W104-M144 HydrophobicContact CG-CG 4.49Å; W104-M144 HydrophobicContact CG-SD 4.12Å; W104-L256 CarbonylContact C-O 3.37Å
105	S	96.8	Very high	96.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	139.6	172.2	74.3	0	0	0	0	110.4	Q76 I107 R143 Y255 L256	Q76-S105 CarbonylContact O-C 3.58Å; Q76-S105 WeakPolarHBondContact O-CA 3.41Å; S105-I107 PolarHBondContact OG-O 2.81Å; S105-R143 VanDerWaalsContact O-CD 3.26Å; S105-R143 WeakPolarHBondContact O-CD 3.3Å; S105-Y255 WeakPolarHBondContact O-CD1 3.22Å; S105-L256 WeakPolarHBondContact CB-O 3.5Å; S105-L256 PolarHBondContact N-O 3.33Å; S105-L256 PolarHBondContact OG-N 3.39Å; S105-L256 PolarHBondContact OG-O 3.43Å
106	R	94.5	Very high	96.3	Very high	61 Å²	61	41.1 Å²	41.1	23%	0.23	20%	0.204	C	C	.	.	S	Bend	trans	-79.1	-31.9	172.2	-68.8	-164.6	-173.8	148.6	2.2	112.1	S72 S73 S75 Q76 D78 R143	S72-R106 PolarHBondContact O-NH1 2.94Å; S72-R106 PolarHBondContact O-NH2 3.41Å; S73-R106 VanDerWaalsContact CA-NH1 3.32Å; S73-R106 PolarHBondContact O-NH1 3.1Å; S75-R106 VanDerWaalsContact O-CD 3.25Å; S75-R106 WeakPolarHBondContact O-CD 3.19Å; S75-R106 PolarHBondContact O-NE 3.48Å; S75-R106 PolarHBondContact O-NH1 3.47Å; Q76-R106 PolarHBondContact O-N 3.03Å; D78-R106 IonicContact OD1-CZ 3.58Å; D78-R106 IonicContact OD1-NE 3.11Å; D78-R106 PolarHBondContact OD1-NE 3.38Å; D78-R106 IonicContact OD1-NH2 2.81Å; D78-R106 PolarHBondContact OD1-NH2 3.37Å; D78-R106 VanDerWaalsContact OD2-CG 3.24Å; D78-R106 WeakPolarHBondContact OD2-CG 3.35Å; D78-R106 IonicContact OD2-NE 3.99Å; D78-R106 PolarHBondContact OD2-NE 2.87Å; D78-R106 VanDerWaalsContact OD2-NE 3.11Å; R106-R143 PolarHBondContact O-NH1 3.07Å
107	I	95.1	Very high	96.4	Very high	50 Å²	50	40 Å²	40	26%	0.256	20%	0.196	S	C	.	.	S	Bend	trans	-92.5	142.1	-178.1	61.1	172.3	0	0	0	110.3	E59 Y60 S105 Y255	E59-I107 HydrophobicContact CB-CD1 3.74Å; E59-I107 HydrophobicContact CG-CD1 3.96Å; E59-I107 WeakPolarHBondContact O-CD1 3.42Å; Y60-I107 HydrophobicContact CD1-CD1 3.61Å; Y60-I107 HydrophobicContact CD1-CG1 3.91Å; Y60-I107 HydrophobicContact CE1-CD1 3.38Å; Y60-I107 HydrophobicContact CE1-CG1 3.71Å; S105-I107 PolarHBondContact OG-O 2.81Å; I107-Y255 WeakPolarHBondContact O-CD1 3.46Å
108	P	96.3	Very high	96.6	Very high	55 Å²	55	34.5 Å²	34.5	36%	0.357	17%	0.17	S	C	.	.			trans	-69.5	140.2	172.8	30.3	-34.1	0	0	0	110.1	Y60 G253 Y254 Y255	Y60-P108 VanDerWaalsContact CE1-O 3.3Å; Y60-P108 WeakPolarHBondContact CE1-O 3.43Å; Y60-P108 PolarHBondContact OH-O 3.43Å; P108-G253 WeakPolarHBondContact CB-O 3.34Å; P108-Y254 CarbonylContact C-O 3.51Å; P108-Y254 WeakPolarHBondContact CA-O 3.32Å; P108-Y255 HydrophobicContact CB-CE1 4.17Å
109	F	96.5	Very high	96.7	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.026	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-89.5	112.1	-177.7	-170.6	-85.1	0	0	0	109.6	Y60 L111 W114 L139 G253 Y254 V276	Y60-F109 AromaticContact CD1-CD2 3.67Å; Y60-F109 HydrophobicContact CD1-CD2 3.67Å; Y60-F109 HydrophobicContact CD1-CE2 4.37Å; Y60-F109 HydrophobicContact CD1-CG 4.46Å; Y60-F109 HydrophobicContact CD2-CD2 4.21Å; Y60-F109 HydrophobicContact CD2-CE2 4.21Å; Y60-F109 HydrophobicContact CE1-CB 4.41Å; Y60-F109 HydrophobicContact CE1-CD2 4.19Å; Y60-F109 AromaticContact CG-CD2 3.7Å; Y60-F109 HydrophobicContact CG-CD2 3.7Å; Y60-F109 AromaticContact CG-CE2 3.93Å; Y60-F109 HydrophobicContact CG-CE2 3.93Å; F109-L111 HydrophobicContact CD1-CB 4.44Å; F109-L111 HydrophobicContact CE1-CB 3.72Å; F109-L111 HydrophobicContact CE1-CD1 4.42Å; F109-L111 HydrophobicContact CE1-CG 4.23Å; F109-L111 HydrophobicContact CE2-CD1 4.15Å; F109-L111 HydrophobicContact CZ-CB 3.93Å; F109-L111 HydrophobicContact CZ-CD1 3.79Å; F109-L111 HydrophobicContact CZ-CG 4.07Å; F109-W114 HydrophobicContact CE1-CB 4.45Å; F109-W114 AromaticContact CE1-CD1 3.53Å; F109-W114 AromaticContact CE1-CD2 3.99Å; F109-W114 HydrophobicContact CE1-CD2 3.99Å; F109-W114 AromaticContact CE1-CE2 3.93Å; F109-W114 AromaticContact CE1-CG 3.73Å; F109-W114 HydrophobicContact CE1-CG 3.73Å; F109-W114 AromaticContact CE1-NE1 3.62Å; F109-W114 HydrophobicContact CZ-CB 4.05Å; F109-W114 AromaticContact CZ-CD1 3.97Å; F109-W114 AromaticContact CZ-CD2 3.88Å; F109-W114 HydrophobicContact CZ-CD2 3.88Å; F109-W114 HydrophobicContact CZ-CE3 4.45Å; F109-W114 AromaticContact CZ-CG 3.67Å; F109-W114 HydrophobicContact CZ-CG 3.67Å; F109-L139 HydrophobicContact CB-CD1 3.86Å; F109-L139 HydrophobicContact CD1-CD1 4.09Å; F109-L139 HydrophobicContact CD1-CD2 4.24Å; F109-L139 HydrophobicContact CE1-CD2 4.44Å; F109-L139 HydrophobicContact CG-CD1 4Å; F109-G253 WeakPolarHBondContact O-CA 3.4Å; F109-G253 PolarHBondContact O-N 3.16Å; F109-Y254 VanDerWaalsContact CB-O 3.23Å; F109-Y254 WeakPolarHBondContact CB-O 3.26Å; F109-Y254 PolarHBondContact N-O 3.26Å; F109-V276 HydrophobicContact CE2-CB 4.44Å; F109-V276 HydrophobicContact CE2-CG1 3.65Å; F109-V276 HydrophobicContact CE2-CG2 4.01Å; F109-V276 HydrophobicContact CZ-CG1 3.84Å
110	V	95.3	Very high	96.7	Very high	79 Å²	79	26.8 Å²	26.8	48%	0.479	13%	0.128	S	C	.	.			trans	-114.6	9.9	-172	-58.1	0	0	0	0	114.1	Y60	Y60-V110 WeakPolarHBondContact OH-CG2 3.27Å
111	L	94.4	Very high	96.7	Very high	18 Å²	18	26.8 Å²	26.8	9%	0.094	13%	0.127	C	C	.	.			trans	-75	136.2	177.6	-53.2	179.7	0	0	0	110.1	K57 Y60 F109 W114 V276 Q278	K57-L111 HydrophobicContact CB-CD1 4.41Å; K57-L111 HydrophobicContact CG-CD1 3.85Å; K57-L111 HydrophobicContact CG-CD2 4.45Å; Y60-L111 HydrophobicContact CD2-CD1 3.97Å; Y60-L111 HydrophobicContact CD2-CG 4.19Å; Y60-L111 HydrophobicContact CE2-CD1 4.22Å; Y60-L111 HydrophobicContact CE2-CD2 4.12Å; Y60-L111 HydrophobicContact CE2-CG 3.95Å; F109-L111 HydrophobicContact CD1-CB 4.44Å; F109-L111 HydrophobicContact CE1-CB 3.72Å; F109-L111 HydrophobicContact CE1-CD1 4.42Å; F109-L111 HydrophobicContact CE1-CG 4.23Å; F109-L111 HydrophobicContact CE2-CD1 4.15Å; F109-L111 HydrophobicContact CZ-CB 3.93Å; F109-L111 HydrophobicContact CZ-CD1 3.79Å; F109-L111 HydrophobicContact CZ-CG 4.07Å; L111-W114 HydrophobicContact CB-CB 4.16Å; L111-W114 HydrophobicContact CB-CG 4.43Å; L111-W114 HydrophobicContact CD1-CB 4.21Å; L111-V276 HydrophobicContact CD1-CG1 3.53Å; L111-Q278 HydrophobicContact CD1-CB 4.34Å; L111-Q278 HydrophobicContact CD2-CG 4.45Å
112	R	91.8	Very high	96.7	Very high	92 Å²	92	26.7 Å²	26.7	35%	0.347	13%	0.126	S	C	.	.	S	Bend	trans	-84.2	-53.2	178.5	-58.4	-173.9	-157.6	178.2	2.9	111.3	Y222	R112-Y222 WeakPolarHBondContact O-CD1 3.21Å; R112-Y222 WeakPolarHBondContact O-CE1 3.22Å
113	D	94.3	Very high	96.6	Very high	13 Å²	13	28.8 Å²	28.8	7%	0.07	14%	0.135	C	C	.	.	S	Bend	trans	-113.5	124.3	175.7	-44.2	-86.1	0	0	0	110	Y222 S223 K224 L279 V281 R283	D113-Y222 VanDerWaalsContact CA-O 3.31Å; D113-Y222 WeakPolarHBondContact CA-O 3.39Å; D113-S223 WeakPolarHBondContact OD1-CA 3.33Å; D113-S223 PolarHBondContact OD1-OG 3.31Å; D113-K224 PolarHBondContact OD1-N 3.21Å; D113-L279 HydrophobicContact CB-CB 3.92Å; D113-L279 PolarHBondContact O-N 3.5Å; D113-V281 HydrophobicContact CB-CB 4.47Å; D113-V281 HydrophobicContact CB-CG2 3.74Å; D113-R283 IonicContact OD1-CZ 3.73Å; D113-R283 IonicContact OD1-NH1 3.33Å; D113-R283 PolarHBondContact OD1-NH1 3.03Å; D113-R283 IonicContact OD1-NH2 3.49Å; D113-R283 PolarHBondContact OD1-NH2 3Å; D113-R283 IonicContact OD2-CZ 3.72Å; D113-R283 IonicContact OD2-NH1 3.38Å; D113-R283 PolarHBondContact OD2-NH1 2.77Å; D113-R283 IonicContact OD2-NH2 2.84Å; D113-R283 PolarHBondContact OD2-NH2 2.93Å
114	W	96.8	Very high	96.4	Very high	7 Å²	7	29.4 Å²	29.4	3%	0.027	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	157.6	-170.5	54.8	-89.4	0	0	0	112.2	F109 L111 L116 L139 L159 V220 Y222 Y277	F109-W114 HydrophobicContact CE1-CB 4.45Å; F109-W114 AromaticContact CE1-CD1 3.53Å; F109-W114 AromaticContact CE1-CD2 3.99Å; F109-W114 HydrophobicContact CE1-CD2 3.99Å; F109-W114 AromaticContact CE1-CE2 3.93Å; F109-W114 AromaticContact CE1-CG 3.73Å; F109-W114 HydrophobicContact CE1-CG 3.73Å; F109-W114 AromaticContact CE1-NE1 3.62Å; F109-W114 HydrophobicContact CZ-CB 4.05Å; F109-W114 AromaticContact CZ-CD1 3.97Å; F109-W114 AromaticContact CZ-CD2 3.88Å; F109-W114 HydrophobicContact CZ-CD2 3.88Å; F109-W114 HydrophobicContact CZ-CE3 4.45Å; F109-W114 AromaticContact CZ-CG 3.67Å; F109-W114 HydrophobicContact CZ-CG 3.67Å; L111-W114 HydrophobicContact CB-CB 4.16Å; L111-W114 HydrophobicContact CB-CG 4.43Å; L111-W114 HydrophobicContact CD1-CB 4.21Å; W114-L116 HydrophobicContact CE3-CB 3.92Å; W114-L116 HydrophobicContact CZ3-CB 3.62Å; W114-L139 HydrophobicContact CH2-CD2 4.15Å; W114-L139 HydrophobicContact CZ2-CD2 3.5Å; W114-L139 VanDerWaalsContact CZ2-CD2 3.5Å; W114-L159 HydrophobicContact CH2-CD2 4.47Å; W114-V220 HydrophobicContact CH2-CG1 3.94Å; W114-V220 HydrophobicContact CZ3-CB 4.14Å; W114-V220 HydrophobicContact CZ3-CG1 3.94Å; W114-Y222 HydrophobicContact CZ2-CG 4.35Å; W114-Y222 PolarHBondContact N-O 3.11Å; W114-Y222 AromaticContact NE1-CD1 3.6Å; W114-Y222 PolarHBondContact O-N 2.66Å; W114-Y277 CarbonylContact C-O 3.56Å; W114-Y277 WeakPolarHBondContact CA-O 3.4Å; W114-Y277 WeakPolarHBondContact CB-O 3.43Å
115	E	97.9	Very high	96	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.9	170.7	-172.6	176.6	100.8	0	0	109.6	R117 L219 V220 R221 V276 Y277 L279	E115-R117 HydrophobicContact CG-CG 4.47Å; E115-R117 IonicContact OE1-CZ 3.79Å; E115-R117 IonicContact OE1-NE 3.99Å; E115-R117 PolarHBondContact OE1-NE 3.32Å; E115-R117 IonicContact OE1-NH2 2.65Å; E115-R117 PolarHBondContact OE1-NH2 3.29Å; E115-L219 HydrophobicContact CG-CD1 4.21Å; E115-L219 HydrophobicContact CG-CD2 3.72Å; E115-L219 HydrophobicContact CG-CG 3.77Å; E115-L219 WeakPolarHBondContact OE1-CD1 3.42Å; E115-V220 CarbonylContact C-O 3.55Å; E115-V220 WeakPolarHBondContact CA-O 3.45Å; E115-R221 HydrophobicContact CG-CB 4.48Å; E115-R221 IonicContact OE2-CZ 2.97Å; E115-R221 VanDerWaalsContact OE2-CZ 3.23Å; E115-R221 IonicContact OE2-NE 2.69Å; E115-R221 PolarHBondContact OE2-NE 2.83Å; E115-R221 IonicContact OE2-NH2 3.88Å; E115-R221 PolarHBondContact OE2-NH2 3.44Å; E115-V276 CarbonylContact O-C 3.59Å; E115-V276 WeakPolarHBondContact O-CA 3.37Å; E115-Y277 PolarHBondContact N-O 3.24Å; E115-Y277 PolarHBondContact O-N 3.29Å; E115-L279 HydrophobicContact CB-CD2 4.31Å
116	L	98.5	Very high	95.3	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.5	174.9	173.4	69.1	0	0	0	108.8	W114 V118 I137 L219 V220 L256 M274 K275 V276	W114-L116 HydrophobicContact CE3-CB 3.92Å; W114-L116 HydrophobicContact CZ3-CB 3.62Å; L116-V118 HydrophobicContact CD1-CG2 4.21Å; L116-V118 HydrophobicContact CD2-CG2 3.84Å; L116-V118 HydrophobicContact CG-CG2 3.74Å; L116-I137 HydrophobicContact CD2-CG2 3.83Å; L116-L219 WeakPolarHBondContact O-CA 3.31Å; L116-V220 HydrophobicContact CB-CB 4.24Å; L116-V220 HydrophobicContact CD2-CG2 4.48Å; L116-V220 PolarHBondContact N-O 2.88Å; L116-V220 PolarHBondContact O-N 3.48Å; L116-L256 HydrophobicContact CD1-CD1 4.45Å; L116-L256 HydrophobicContact CD1-CD2 4.12Å; L116-L256 HydrophobicContact CD2-CD1 3.79Å; L116-M274 HydrophobicContact CD1-CB 4.1Å; L116-M274 HydrophobicContact CD1-CE 4.39Å; L116-M274 HydrophobicContact CD2-CE 4.38Å; L116-K275 CarbonylContact C-O 3.55Å; L116-K275 WeakPolarHBondContact CA-O 3.49Å; L116-V276 HydrophobicContact CD1-CG2 3.73Å
117	R	98.2	Very high	94.2	Very high	74 Å²	74	43 Å²	43	28%	0.279	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	113.3	171.1	-59.2	-174.2	-172.2	166.7	10.9	109.3	D54 E115 L218 L219 K275 Y277	D54-R117 IonicContact OD2-NH2 2.94Å; D54-R117 PolarHBondContact OD2-NH2 2.98Å; D54-R117 VanDerWaalsContact OD2-NH2 3.14Å; E115-R117 HydrophobicContact CG-CG 4.47Å; E115-R117 IonicContact OE1-CZ 3.79Å; E115-R117 IonicContact OE1-NE 3.99Å; E115-R117 PolarHBondContact OE1-NE 3.32Å; E115-R117 IonicContact OE1-NH2 2.65Å; E115-R117 PolarHBondContact OE1-NH2 3.29Å; R117-L218 CarbonylContact C-O 3.52Å; R117-L218 WeakPolarHBondContact CA-O 3.4Å; R117-L219 HydrophobicContact CG-CD1 4.32Å; R117-L219 HydrophobicContact CG-CG 4.31Å; R117-K275 HydrophobicContact CB-CB 4.47Å; R117-K275 PolarHBondContact N-O 3.06Å; R117-K275 PolarHBondContact O-N 2.7Å; R117-Y277 HydrophobicContact CG-CD2 4.42Å; R117-Y277 HydrophobicContact CG-CE2 4.17Å
118	V	98.6	Very high	93.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.4	177.7	-172.7	0	0	0	0	108.8	L116 F120 I137 F217 L218 I271 S273 M274	L116-V118 HydrophobicContact CD1-CG2 4.21Å; L116-V118 HydrophobicContact CD2-CG2 3.84Å; L116-V118 HydrophobicContact CG-CG2 3.74Å; V118-F120 HydrophobicContact CG1-CB 4.32Å; V118-F120 HydrophobicContact CG1-CD1 4.4Å; V118-I137 HydrophobicContact CG1-CD1 3.97Å; V118-I137 HydrophobicContact CG2-CD1 4.41Å; V118-I137 HydrophobicContact CG2-CG1 4.36Å; V118-I137 HydrophobicContact CG2-CG2 4.32Å; V118-F217 CarbonylContact O-C 3.24Å; V118-F217 WeakPolarHBondContact O-CA 3.49Å; V118-L218 HydrophobicContact CB-CB 4.27Å; V118-L218 PolarHBondContact N-O 2.75Å; V118-L218 PolarHBondContact O-N 3.06Å; V118-I271 HydrophobicContact CG1-CD1 4.32Å; V118-S273 CarbonylContact C-O 3.51Å; V118-S273 WeakPolarHBondContact CA-O 3.33Å; V118-M274 HydrophobicContact CG1-CG 4.25Å; V118-M274 HydrophobicContact CG2-CG 4.4Å
119	H	98.3	Very high	91.9	Very high	25 Å²	25	52.8 Å²	52.8	12%	0.116	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115.9	166.4	-175.6	-174.2	0	0	0	107.5	D215 T216 F217 I272 S273	H119-D215 IonicContact CE1-OD1 3.14Å; H119-D215 IonicContact CE1-OD2 2.71Å; H119-D215 IonicContact NE2-OD1 3.13Å; H119-D215 IonicContact NE2-OD2 2.7Å; H119-T216 PolarHBondContact CD2-O 2.84Å; H119-F217 HydrophobicContact CB-CD1 3.68Å; H119-F217 HydrophobicContact CB-CE1 3.54Å; H119-F217 AromaticContact CD2-CE1 3.81Å; H119-F217 AromaticContact CG-CD1 3.91Å; H119-F217 AromaticContact CG-CE1 3.39Å; H119-F217 AromaticContact ND1-CE1 3.69Å; H119-I272 HydrophobicContact CB-CB 4.13Å; H119-I272 WeakPolarHBondContact ND1-CG2 3.2Å; H119-I272 WeakPolarHBondContact O-CA 3.35Å; H119-I272 PolarHBondContact O-N 3.33Å; H119-S273 WeakPolarHBondContact CB-OG 3.21Å; H119-S273 PolarHBondContact N-O 2.79Å; H119-S273 PolarHBondContact O-N 3.14Å
120	F	98.4	Very high	91.1	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.009	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	170.9	-178.1	69.2	-75.5	0	0	0	110	V118 I122 I135 V163 T209 T216 L218 D270 I271	V118-F120 HydrophobicContact CG1-CB 4.32Å; V118-F120 HydrophobicContact CG1-CD1 4.4Å; F120-I122 HydrophobicContact CD2-CD1 4.29Å; F120-I122 HydrophobicContact CD2-CG1 3.98Å; F120-I122 HydrophobicContact CE2-CD1 4.02Å; F120-I122 HydrophobicContact CE2-CG1 4.09Å; F120-I135 HydrophobicContact CB-CD1 4.35Å; F120-I135 HydrophobicContact CD2-CD1 4.11Å; F120-V163 HydrophobicContact CE2-CG1 4.11Å; F120-V163 HydrophobicContact CE2-CG2 4.37Å; F120-V163 HydrophobicContact CZ-CG1 4.39Å; F120-V163 HydrophobicContact CZ-CG2 4.26Å; F120-T209 HydrophobicContact CE2-CG2 4.05Å; F120-T209 HydrophobicContact CZ-CG2 3.66Å; F120-T216 WeakPolarHBondContact CD1-O 2.88Å; F120-T216 PolarHBondContact N-O 3.38Å; F120-T216 VanDerWaalsContact N-O 3.1Å; F120-T216 PolarHBondContact O-OG1 3.15Å; F120-L218 HydrophobicContact CD1-CG 4.24Å; F120-L218 HydrophobicContact CE1-CD1 4.27Å; F120-L218 HydrophobicContact CE1-CD2 4.13Å; F120-L218 HydrophobicContact CE1-CG 3.61Å; F120-L218 HydrophobicContact CZ-CD2 4.43Å; F120-L218 HydrophobicContact CZ-CG 4.27Å; F120-D270 CarbonylContact C-O 3.21Å; F120-D270 WeakPolarHBondContact CA-O 3.35Å; F120-D270 WeakPolarHBondContact CB-O 3.32Å; F120-I271 HydrophobicContact CB-CD1 3.96Å
121	K	97.9	Very high	90.6	Very high	71 Å²	71	54.4 Å²	54.4	31%	0.309	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	132.2	171	-165.6	168.5	-171.5	137.4	0	109.7	D270 I272	K121-D270 HydrophobicContact CB-CB 4.48Å; K121-D270 PolarHBondContact N-O 2.8Å; K121-D270 PolarHBondContact O-N 3.05Å; K121-I272 HydrophobicContact CB-CD1 3.83Å
122	I	97.6	Very high	90.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.3	172.7	-51.8	177.3	0	0	0	107.6	F120 I135 V163 T165 R210 N211 D267 N268	F120-I122 HydrophobicContact CD2-CD1 4.29Å; F120-I122 HydrophobicContact CD2-CG1 3.98Å; F120-I122 HydrophobicContact CE2-CD1 4.02Å; F120-I122 HydrophobicContact CE2-CG1 4.09Å; I122-I135 HydrophobicContact CD1-CD1 4.21Å; I122-I135 HydrophobicContact CD1-CG1 4.03Å; I122-I135 HydrophobicContact CG1-CD1 3.82Å; I122-I135 HydrophobicContact CG1-CG1 4.11Å; I122-V163 HydrophobicContact CD1-CB 4.36Å; I122-V163 HydrophobicContact CD1-CG1 3.76Å; I122-T165 HydrophobicContact CD1-CG2 3.79Å; I122-T165 HydrophobicContact CG2-CG2 4.17Å; I122-R210 HydrophobicContact CG2-CG 4.38Å; I122-R210 WeakPolarHBondContact O-CA 3.26Å; I122-N211 PolarHBondContact O-N 3.48Å; I122-D267 HydrophobicContact CG2-CB 3.98Å; I122-N268 WeakPolarHBondContact CA-O 3.4Å
123	H	96.3	Very high	90	Very high	47 Å²	47	50.2 Å²	50.2	22%	0.218	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	147.4	-177.3	64.4	98.6	0	0	0	112.7	N211 N268 D270	H123-N211 WeakPolarHBondContact CA-OD1 3.38Å; H123-N211 VanDerWaalsContact CB-OD1 3.28Å; H123-N211 WeakPolarHBondContact CB-OD1 3.33Å; H123-N268 PolarHBondContact CE1-ND2 3.45Å; H123-N268 PolarHBondContact N-O 3.38Å; H123-N268 PolarHBondContact ND1-ND2 3.37Å; H123-N268 WeakPolarHBondContact O-CA 3.48Å; H123-N268 VanDerWaalsContact O-CB 3.24Å; H123-N268 WeakPolarHBondContact O-CB 3.47Å; H123-N268 PolarHBondContact O-N 3.1Å; H123-N268 PolarHBondContact O-ND2 3.31Å; H123-D270 IonicContact CD2-OD2 3.84Å; H123-D270 IonicContact CE1-OD2 3.21Å; H123-D270 IonicContact NE2-OD2 3.67Å; H123-D270 PolarHBondContact NE2-OD2 2.79Å
124	G	93.8	Very high	90	Very high	12 Å²	12	49.6 Å²	49.6	12%	0.124	24%	0.242	C	C	.	.			trans	-171.1	170.3	179.7	0	0	0	0	0	112.8	D95 N211 D267	D95-G124 WeakPolarHBondContact OD2-CA 3.39Å; G124-N211 PolarHBondContact N-OD1 2.84Å; G124-N211 VanDerWaalsContact N-OD1 3.09Å; G124-N211 PolarHBondContact O-ND2 3.11Å; G124-D267 WeakPolarHBondContact CA-OD1 3.22Å; G124-D267 PolarHBondContact N-OD1 3.37Å
125	I	89.8	Confident	90.1	Very high	152 Å²	152	49.4 Å²	49.4	78%	0.779	24%	0.241	S	C	*	.	S	Bend	trans	-84.8	-18.8	-171.1	-53	170.9	0	0	0	111	D95 K127	D95-I125 PolarHBondContact OD2-N 2.81Å; I125-K127 PolarHBondContact O-N 2.87Å; I125-K127 VanDerWaalsContact O-N 3.16Å
126	G	80.4	Confident	90.1	Very high	23 Å²	23	49.4 Å²	49.4	24%	0.237	24%	0.241	C	C	.	.			trans	-49.7	118.4	177.4	0	0	0	0	0	112.1	R210	G126-R210 PolarHBondContact O-NH1 2.81Å; G126-R210 PolarHBondContact O-NH2 2.81Å; G126-R210 VanDerWaalsContact O-NH2 3.11Å
127	K	73.1	Confident	90.2	Very high	174 Å²	174	49.4 Å²	49.4	76%	0.757	24%	0.241	S	C	*	.			trans	-80.4	146.7	176.6	-66	-176.1	-178.9	179.1	0	109.9	I125	I125-K127 PolarHBondContact O-N 2.87Å; I125-K127 VanDerWaalsContact O-N 3.16Å
128	K	72.1	Confident	90.2	Very high	192 Å²	192	46 Å²	46	84%	0.835	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	-136.5	-177.7	-52.2	179.7	178.5	-178.5	0	110.7	L130 N131	K128-L130 VanDerWaalsContact C-N 3.33Å; K128-N131 PolarHBondContact O-OD1 3.44Å
129	N	70.1	Confident	90.2	Very high	117 Å²	117	46.3 Å²	46.3	63%	0.626	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	20	-176.7	-54.8	-7.1	0	0	0	112.8	N131	N129-N131 WeakPolarHBondContact CA-OD1 3.3Å; N129-N131 PolarHBondContact O-N 2.85Å; N129-N131 VanDerWaalsContact O-N 3.16Å
130	L	79.5	Confident	90.2	Very high	113 Å²	113	45.2 Å²	45.2	59%	0.592	23%	0.225	S	C	*	.			trans	-88	66.5	175.6	-63.8	176	0	0	0	109	K128 L265	K128-L130 VanDerWaalsContact C-N 3.33Å; L130-L265 HydrophobicContact CB-CD2 4.07Å; L130-L265 HydrophobicContact CD2-CD2 4.05Å
131	N	85.4	Confident	90.1	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.037	25%	0.247	C	C	.	.			trans	-147.3	157.8	-176.8	62	-96.2	0	0	0	110.3	K128 N129 T165 Y166 L265 D267	K128-N131 PolarHBondContact O-OD1 3.44Å; N129-N131 WeakPolarHBondContact CA-OD1 3.3Å; N129-N131 PolarHBondContact O-N 2.85Å; N129-N131 VanDerWaalsContact O-N 3.16Å; N131-T165 WeakPolarHBondContact ND2-CB 3.39Å; N131-T165 PolarHBondContact ND2-O 3.3Å; N131-T165 PolarHBondContact ND2-OG1 2.84Å; N131-Y166 WeakPolarHBondContact O-CD2 3.44Å; N131-L265 VanDerWaalsContact C-CB 3.47Å; N131-L265 VanDerWaalsContact O-CD1 3.3Å; N131-L265 WeakPolarHBondContact O-CD1 3.42Å; N131-D267 WeakPolarHBondContact CB-OD2 3.37Å
132	G	84.8	Confident	90.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.247	C	C	.	.			trans	169.4	169.5	176	0	0	0	0	0	114.3	S266 D267	G132-S266 CarbonylContact O-C 3.45Å; G132-S266 WeakPolarHBondContact O-CA 3.42Å; G132-D267 PolarHBondContact O-N 2.89Å
133	D	87.8	Confident	90	Very high	22 Å²	22	53.6 Å²	53.6	12%	0.118	26%	0.259	C	S	.	.			cis	-98.5	-40.3	-6.9	-62.4	-17.4	0	0	0	110.2	F150 T165 H193 A261	D133-F150 HydrophobicContact CB-CE1 4.29Å; D133-T165 PolarHBondContact O-N 2.96Å; D133-T165 PolarHBondContact O-OG1 3.19Å; D133-H193 IonicContact OD2-CE1 3.45Å; D133-H193 IonicContact OD2-NE2 2.74Å; D133-A261 PolarHBondContact N-O 2.86Å
134	G	95.8	Very high	90	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.3	-157.8	174.3	0	0	0	0	0	113.7	V163 S260 H269	G134-V163 VanDerWaalsContact CA-O 3.23Å; G134-V163 WeakPolarHBondContact CA-O 3.45Å; G134-S260 VanDerWaalsContact O-CB 3.29Å; G134-S260 WeakPolarHBondContact O-CB 3.43Å; G134-S260 PolarHBondContact O-OG 3.38Å; G134-H269 WeakPolarHBondContact CA-NE2 3.41Å; G134-H269 PolarHBondContact O-CD2 2.83Å; G134-H269 PolarHBondContact O-NE2 2.71Å
135	I	98.3	Very high	90.1	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.1	177.4	-58.9	-173.4	0	0	0	109.6	L92 F120 I122 I137 V163 H269 I271	L92-I135 HydrophobicContact CD1-CG2 4.22Å; F120-I135 HydrophobicContact CB-CD1 4.35Å; F120-I135 HydrophobicContact CD2-CD1 4.11Å; I122-I135 HydrophobicContact CD1-CD1 4.21Å; I122-I135 HydrophobicContact CD1-CG1 4.03Å; I122-I135 HydrophobicContact CG1-CD1 3.82Å; I122-I135 HydrophobicContact CG1-CG1 4.11Å; I135-I137 HydrophobicContact CG2-CD1 4Å; I135-V163 PolarHBondContact N-O 2.87Å; I135-V163 VanDerWaalsContact N-O 3.1Å; I135-V163 PolarHBondContact O-N 2.88Å; I135-H269 HydrophobicContact CD1-CB 3.82Å; I135-H269 HydrophobicContact CG1-CB 3.81Å; I135-I271 HydrophobicContact CD1-CD1 4.36Å; I135-I271 HydrophobicContact CG2-CD1 4.19Å
136	A	98.6	Very high	90.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.1	166.7	0	0	0	0	0	111.2	W138 F150 I161 F162 A258 S259	A136-W138 HydrophobicContact CB-CD2 4.38Å; A136-W138 VanDerWaalsContact CB-CE2 3.43Å; A136-W138 HydrophobicContact CB-CH2 4.36Å; A136-W138 HydrophobicContact CB-CZ2 3.42Å; A136-W138 VanDerWaalsContact CB-CZ2 3.42Å; A136-F150 HydrophobicContact CB-CB 3.62Å; A136-F150 HydrophobicContact CB-CD2 4.2Å; A136-F150 HydrophobicContact CB-CG 4.05Å; A136-I161 CarbonylContact C-O 3.6Å; A136-I161 VanDerWaalsContact CA-O 3.29Å; A136-I161 WeakPolarHBondContact CA-O 3.48Å; A136-F162 HydrophobicContact CB-CD1 3.65Å; A136-F162 HydrophobicContact CB-CE1 3.9Å; A136-A258 CarbonylContact O-C 3.41Å; A136-A258 WeakPolarHBondContact O-CA 3.3Å; A136-S259 PolarHBondContact N-O 2.89Å; A136-S259 PolarHBondContact O-N 3.4Å
137	I	98.8	Very high	91.2	Very high	4 Å²	4	55 Å²	55	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.7	169.9	-50.9	-58.7	0	0	0	108	L116 V118 I135 I161 L218 A258 I271 M274	L116-I137 HydrophobicContact CD2-CG2 3.83Å; V118-I137 HydrophobicContact CG1-CD1 3.97Å; V118-I137 HydrophobicContact CG2-CD1 4.41Å; V118-I137 HydrophobicContact CG2-CG1 4.36Å; V118-I137 HydrophobicContact CG2-CG2 4.32Å; I135-I137 HydrophobicContact CG2-CD1 4Å; I137-I161 HydrophobicContact CB-CB 4.36Å; I137-I161 PolarHBondContact N-O 3.15Å; I137-I161 PolarHBondContact O-N 3.45Å; I137-L218 HydrophobicContact CG1-CD1 4.35Å; I137-A258 HydrophobicContact CD1-CB 3.69Å; I137-I271 HydrophobicContact CD1-CD1 4.22Å; I137-M274 HydrophobicContact CG2-CE 4.01Å
138	W	98.7	Very high	92.2	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.008	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.8	-167.4	-59.1	105.9	0	0	0	111.9	W104 A136 T140 V149 N152 F156 L159 F162 L256 G257 S259	W104-W138 HydrophobicContact CH2-CB 3.37Å; W104-W138 AromaticContact CH2-CD1 3.73Å; W104-W138 HydrophobicContact CH2-CD2 4.33Å; W104-W138 AromaticContact CH2-CG 3.53Å; W104-W138 HydrophobicContact CH2-CG 3.53Å; W104-W138 HydrophobicContact CZ2-CB 4.34Å; W104-W138 AromaticContact CZ2-CD1 3.86Å; W104-W138 HydrophobicContact CZ2-CG 4.1Å; W104-W138 HydrophobicContact CZ3-CB 3.63Å; W104-W138 HydrophobicContact CZ3-CG 4.27Å; A136-W138 HydrophobicContact CB-CD2 4.38Å; A136-W138 VanDerWaalsContact CB-CE2 3.43Å; A136-W138 HydrophobicContact CB-CH2 4.36Å; A136-W138 HydrophobicContact CB-CZ2 3.42Å; A136-W138 VanDerWaalsContact CB-CZ2 3.42Å; W138-T140 HydrophobicContact CB-CG2 4.22Å; W138-T140 HydrophobicContact CE3-CG2 3.79Å; W138-V149 HydrophobicContact CH2-CB 4.28Å; W138-V149 HydrophobicContact CH2-CG1 3.71Å; W138-V149 HydrophobicContact CZ2-CG1 4.2Å; W138-N152 HydrophobicContact CH2-CB 4.08Å; W138-N152 HydrophobicContact CZ2-CB 3.42Å; W138-N152 VanDerWaalsContact CZ2-CB 3.42Å; W138-F156 HydrophobicContact CE3-CD2 4.38Å; W138-F156 HydrophobicContact CE3-CE2 4.42Å; W138-F156 HydrophobicContact CH2-CD1 4.04Å; W138-F156 AromaticContact CH2-CE1 3.98Å; W138-F156 HydrophobicContact CH2-CE1 3.98Å; W138-F156 HydrophobicContact CH2-CZ 4.44Å; W138-F156 AromaticContact CZ3-CD1 3.64Å; W138-F156 HydrophobicContact CZ3-CD1 3.64Å; W138-F156 AromaticContact CZ3-CD2 3.92Å; W138-F156 HydrophobicContact CZ3-CD2 3.92Å; W138-F156 AromaticContact CZ3-CE1 3.58Å; W138-F156 HydrophobicContact CZ3-CE1 3.58Å; W138-F156 AromaticContact CZ3-CE2 3.84Å; W138-F156 HydrophobicContact CZ3-CE2 3.84Å; W138-F156 AromaticContact CZ3-CG 3.83Å; W138-F156 HydrophobicContact CZ3-CG 3.83Å; W138-F156 AromaticContact CZ3-CZ 3.68Å; W138-F156 HydrophobicContact CZ3-CZ 3.68Å; W138-L159 WeakPolarHBondContact CA-O 3.35Å; W138-F162 AromaticContact CH2-CE1 3.46Å; W138-F162 HydrophobicContact CH2-CE1 3.46Å; W138-F162 VanDerWaalsContact CH2-CE1 3.46Å; W138-F162 AromaticContact CH2-CZ 3.89Å; W138-F162 HydrophobicContact CH2-CZ 3.89Å; W138-F162 AromaticContact CZ2-CE1 3.89Å; W138-F162 HydrophobicContact CZ2-CE1 3.89Å; W138-F162 AromaticContact CZ3-CE1 3.99Å; W138-F162 HydrophobicContact CZ3-CE1 3.99Å; W138-F162 HydrophobicContact CZ3-CZ 4.12Å; W138-L256 CarbonylContact O-C 3.58Å; W138-L256 WeakPolarHBondContact O-CA 3.48Å; W138-L256 WeakPolarHBondContact O-CD1 3.16Å; W138-G257 PolarHBondContact N-O 2.78Å; W138-G257 PolarHBondContact O-N 2.87Å; W138-S259 PolarHBondContact NE1-OG 2.88Å
139	L	98.5	Very high	93.4	Very high	8 Å²	8	41.4 Å²	41.4	4%	0.042	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	91.8	157.5	179.7	58.4	0	0	0	107.5	F109 W114 G158 L159 L250 Y254 Y255	F109-L139 HydrophobicContact CB-CD1 3.86Å; F109-L139 HydrophobicContact CD1-CD1 4.09Å; F109-L139 HydrophobicContact CD1-CD2 4.24Å; F109-L139 HydrophobicContact CE1-CD2 4.44Å; F109-L139 HydrophobicContact CG-CD1 4Å; W114-L139 HydrophobicContact CH2-CD2 4.15Å; W114-L139 HydrophobicContact CZ2-CD2 3.5Å; W114-L139 VanDerWaalsContact CZ2-CD2 3.5Å; L139-G158 CarbonylContact O-C 3.44Å; L139-G158 WeakPolarHBondContact O-CA 3.37Å; L139-L159 HydrophobicContact CB-CB 4.29Å; L139-L159 PolarHBondContact N-O 3.35Å; L139-L159 PolarHBondContact O-N 3.3Å; L139-L250 HydrophobicContact CD2-CD2 3.58Å; L139-L250 HydrophobicContact CG-CD2 4.25Å; L139-Y254 WeakPolarHBondContact O-CD2 3.02Å; L139-Y255 WeakPolarHBondContact CA-O 3.49Å
140	T	98.3	Very high	94.7	Very high	1 Å²	1	36 Å²	36	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	151.8	-166.6	55.6	0	0	0	0	113.2	W104 W138 D142 F156 V157 Y254 Y255	W104-T140 VanDerWaalsContact CH2-OG1 3.26Å; W104-T140 WeakPolarHBondContact CH2-OG1 3.46Å; W104-T140 VanDerWaalsContact CZ3-OG1 3.28Å; W104-T140 WeakPolarHBondContact CZ3-OG1 3.23Å; W138-T140 HydrophobicContact CB-CG2 4.22Å; W138-T140 HydrophobicContact CE3-CG2 3.79Å; T140-D142 PolarHBondContact OG1-O 3.46Å; T140-F156 HydrophobicContact CG2-CB 4.31Å; T140-F156 HydrophobicContact CG2-CD2 3.82Å; T140-F156 HydrophobicContact CG2-CG 4.37Å; T140-V157 CarbonylContact C-O 3.58Å; T140-V157 VanDerWaalsContact CA-O 3.29Å; T140-V157 WeakPolarHBondContact CA-O 3.43Å; T140-V157 WeakPolarHBondContact CB-O 3.3Å; T140-Y254 CarbonylContact O-C 3.36Å; T140-Y254 WeakPolarHBondContact O-CB 3.38Å; T140-Y255 PolarHBondContact N-O 2.84Å; T140-Y255 PolarHBondContact O-N 3.1Å
141	R	97.3	Very high	95.6	Very high	127 Å²	127	30.7 Å²	30.7	48%	0.479	15%	0.154	S	C	.	.	S	Bend	trans	-59.7	-48.2	176.8	-176.6	-173.1	66.2	-160.3	-5.2	112	V157 Y254 Y255	R141-V157 HydrophobicContact CB-CB 4.17Å; R141-V157 HydrophobicContact CB-CG1 4.45Å; R141-V157 PolarHBondContact N-O 3.2Å; R141-Y254 HydrophobicContact CB-CD1 3.9Å; R141-Y254 HydrophobicContact CB-CE1 3.67Å; R141-Y254 HydrophobicContact CG-CD1 4.47Å; R141-Y254 HydrophobicContact CG-CE1 4.2Å; R141-Y255 WeakPolarHBondContact O-CD2 3.16Å; R141-Y255 WeakPolarHBondContact O-CE2 3.49Å
142	D	97.2	Very high	96.2	Very high	56 Å²	56	30.5 Å²	30.5	30%	0.299	15%	0.152	S	C	.	.	S	Bend	trans	-92.9	141.3	-179.2	-59.4	-62	0	0	0	109.4	T140 Q145 M153	T140-D142 PolarHBondContact OG1-O 3.46Å; D142-Q145 HydrophobicContact CB-CG 4.48Å; D142-M153 HydrophobicContact CB-SD 4.13Å
143	R	96.4	Very high	96.7	Very high	66 Å²	66	33 Å²	33	25%	0.249	16%	0.164	C	C	.	.			trans	-129.5	164.8	177	71.7	170	-160.4	-127.5	9.3	110.2	W104 S105 R106 Q145 Y255	W104-R143 HydrophobicContact CB-CB 4.32Å; W104-R143 HydrophobicContact CD2-CB 3.85Å; W104-R143 HydrophobicContact CE3-CB 3.74Å; W104-R143 HydrophobicContact CG-CB 4.12Å; W104-R143 HydrophobicContact CZ3-CB 4.34Å; S105-R143 VanDerWaalsContact O-CD 3.26Å; S105-R143 WeakPolarHBondContact O-CD 3.3Å; R106-R143 PolarHBondContact O-NH1 3.07Å; R143-Q145 VanDerWaalsContact C-N 3.26Å; R143-Q145 PolarHBondContact O-N 3.34Å; R143-Y255 HydrophobicContact CB-CD2 4.1Å; R143-Y255 HydrophobicContact CB-CG 4.1Å; R143-Y255 HydrophobicContact CG-CD2 4.08Å; R143-Y255 HydrophobicContact CG-CG 4.16Å
144	M	95.6	Very high	97.2	Very high	62 Å²	62	34 Å²	34	31%	0.305	17%	0.17	S	C	.	.	S	Bend	trans	59.2	35.2	175	-56.7	-70.1	-69.8	0	0	113.7	D78 M80 W104	D78-M144 HydrophobicContact CB-CE 4.16Å; D78-M144 HydrophobicContact CB-SD 3.89Å; M80-M144 HydrophobicContact CB-CE 3.76Å; M80-M144 HydrophobicContact CB-SD 3.96Å; M80-M144 WeakPolarHBondContact CE-O 3.33Å; M80-M144 HydrophobicContact CG-CE 4.17Å; M80-M144 WeakPolarHBondContact SD-CA 3.23Å; M80-M144 HydrophobicContact SD-CB 4Å; M80-M144 HydrophobicContact SD-CE 4.13Å; M80-M144 HydrophobicContact SD-SD 4.05Å; W104-M144 HydrophobicContact CB-CG 4.46Å; W104-M144 HydrophobicContact CB-SD 4.03Å; W104-M144 HydrophobicContact CG-CG 4.49Å; W104-M144 HydrophobicContact CG-SD 4.12Å
145	Q	96.8	Very high	97.2	Very high	95 Å²	95	38.5 Å²	38.5	44%	0.444	19%	0.191	S	C	.	.			trans	-110.9	125.3	176.4	-60.1	-58.9	-40.3	0	0	109.5	D142 R143 N152 M153	D142-Q145 HydrophobicContact CB-CG 4.48Å; R143-Q145 VanDerWaalsContact C-N 3.26Å; R143-Q145 PolarHBondContact O-N 3.34Å; Q145-N152 WeakPolarHBondContact O-CA 3.48Å; Q145-N152 PolarHBondContact O-OD1 3.45Å; Q145-N152 VanDerWaalsContact O-OD1 3.07Å; Q145-M153 HydrophobicContact CB-CB 3.91Å; Q145-M153 HydrophobicContact CB-CG 3.93Å; Q145-M153 HydrophobicContact CB-SD 3.87Å; Q145-M153 HydrophobicContact CG-SD 3.82Å; Q145-M153 PolarHBondContact O-N 3.03Å
146	N	95.5	Very high	97.2	Very high	93 Å²	93	38.5 Å²	38.5	50%	0.497	19%	0.191	S	C	.	.			trans	-77.4	153.7	174	-81.6	-35.5	0	0	0	109.9	M80	M80-N146 HydrophobicContact CE-CB 3.9Å; M80-N146 VanDerWaalsContact CE-N 3.27Å; M80-N146 WeakPolarHBondContact CE-OD1 3.18Å
147	G	96	Very high	97.1	Very high	15 Å²	15	39 Å²	39	16%	0.155	19%	0.194	C	C	.	.			trans	176.9	-172.9	170.9	0	0	0	0	0	114.4	V149 G151 N152	G147-V149 VanDerWaalsContact C-N 3.3Å; G147-V149 PolarHBondContact O-N 3.49Å; G147-G151 PolarHBondContact N-O 2.88Å; G147-G151 CarbonylContact O-C 3.52Å; G147-G151 WeakPolarHBondContact O-CA 3.36Å; G147-G151 PolarHBondContact O-N 3.42Å; G147-N152 CarbonylContact C-O 3.54Å; G147-N152 WeakPolarHBondContact CA-O 3.23Å; G147-N152 PolarHBondContact N-O 3Å
148	P	95.8	Very high	97.1	Very high	80 Å²	80	38.8 Å²	38.8	52%	0.519	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.6	-170.8	32.2	-35.9	0	0	0	113.6	F150 N154	P148-F150 PolarHBondContact O-N 3.44Å; P148-N154 HydrophobicContact CG-CB 4.1Å
149	V	97.3	Very high	97.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-92.7	87.4	-173.9	-169.7	0	0	0	0	109	W138 G147 G151 N152 N154 F162 Y191	W138-V149 HydrophobicContact CH2-CB 4.28Å; W138-V149 HydrophobicContact CH2-CG1 3.71Å; W138-V149 HydrophobicContact CZ2-CG1 4.2Å; G147-V149 VanDerWaalsContact C-N 3.3Å; G147-V149 PolarHBondContact O-N 3.49Å; V149-G151 PolarHBondContact O-N 2.8Å; V149-N152 PolarHBondContact N-O 2.82Å; V149-N152 PolarHBondContact O-N 2.76Å; V149-N154 HydrophobicContact CG2-CB 3.8Å; V149-F162 HydrophobicContact CG1-CE1 3.76Å; V149-F162 HydrophobicContact CG1-CZ 4Å; V149-Y191 HydrophobicContact CB-CD1 4.41Å; V149-Y191 HydrophobicContact CG1-CD1 3.76Å; V149-Y191 HydrophobicContact CG1-CD2 4.18Å; V149-Y191 HydrophobicContact CG1-CE1 4.29Å; V149-Y191 HydrophobicContact CG1-CG 3.7Å; V149-Y191 HydrophobicContact CG2-CD1 4.04Å; V149-Y191 HydrophobicContact CG2-CG 4.17Å
150	F	97.6	Very high	97.1	Very high	3 Å²	3	38.5 Å²	38.5	1%	0.013	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	37.4	-176.1	-61.8	-88.5	0	0	0	112.9	D133 A136 P148 F162 D164 Y191 S259 S260	D133-F150 HydrophobicContact CB-CE1 4.29Å; A136-F150 HydrophobicContact CB-CB 3.62Å; A136-F150 HydrophobicContact CB-CD2 4.2Å; A136-F150 HydrophobicContact CB-CG 4.05Å; P148-F150 PolarHBondContact O-N 3.44Å; F150-F162 AromaticContact CD2-CD1 3.51Å; F150-F162 HydrophobicContact CD2-CD1 3.51Å; F150-F162 HydrophobicContact CD2-CE1 4.04Å; F150-F162 HydrophobicContact CD2-CG 4.28Å; F150-F162 HydrophobicContact CE2-CB 3.93Å; F150-F162 AromaticContact CE2-CD1 3.62Å; F150-F162 HydrophobicContact CE2-CD1 3.62Å; F150-F162 HydrophobicContact CE2-CE1 4.4Å; F150-F162 AromaticContact CE2-CG 3.92Å; F150-F162 HydrophobicContact CE2-CG 3.92Å; F150-F162 HydrophobicContact CG-CD1 4.49Å; F150-F162 HydrophobicContact CZ-CB 4.32Å; F150-D164 HydrophobicContact CZ-CB 4.03Å; F150-Y191 HydrophobicContact CE2-CE1 4.24Å; F150-Y191 HydrophobicContact CE2-CE2 4.49Å; F150-Y191 AromaticContact CE2-CZ 3.82Å; F150-Y191 WeakPolarHBondContact CE2-OH 3.25Å; F150-S259 CarbonylContact O-C 3.56Å; F150-S259 VanDerWaalsContact O-C 3.24Å; F150-S259 VanDerWaalsContact O-CB 3.23Å; F150-S259 WeakPolarHBondContact O-CB 3.39Å; F150-S259 PolarHBondContact O-OG 2.86Å; F150-S260 CarbonylContact O-C 3.51Å; F150-S260 WeakPolarHBondContact O-CA 3.36Å; F150-S260 PolarHBondContact O-N 2.89Å
151	G	96.7	Very high	97.1	Very high	2 Å²	2	38.6 Å²	38.6	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	0.5	-179.8	0	0	0	0	0	115.4	G147 V149	G147-G151 PolarHBondContact N-O 2.88Å; G147-G151 CarbonylContact O-C 3.52Å; G147-G151 WeakPolarHBondContact O-CA 3.36Å; G147-G151 PolarHBondContact O-N 3.42Å; V149-G151 PolarHBondContact O-N 2.8Å
152	N	97.8	Very high	97.1	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.011	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-107.9	162.9	173.2	-165.9	23.1	0	0	0	112	W138 Q145 G147 V149	W138-N152 HydrophobicContact CH2-CB 4.08Å; W138-N152 HydrophobicContact CZ2-CB 3.42Å; W138-N152 VanDerWaalsContact CZ2-CB 3.42Å; Q145-N152 WeakPolarHBondContact O-CA 3.48Å; Q145-N152 PolarHBondContact O-OD1 3.45Å; Q145-N152 VanDerWaalsContact O-OD1 3.07Å; G147-N152 CarbonylContact C-O 3.54Å; G147-N152 WeakPolarHBondContact CA-O 3.23Å; G147-N152 PolarHBondContact N-O 3Å; V149-N152 PolarHBondContact N-O 2.82Å; V149-N152 PolarHBondContact O-N 2.76Å
153	M	97.3	Very high	97.2	Very high	52 Å²	52	30 Å²	30	26%	0.256	16%	0.155	S	C	.	.			trans	-58.4	145	175.1	67.2	176.9	-72.9	0	0	112.5	D142 Q145	D142-M153 HydrophobicContact CB-SD 4.13Å; Q145-M153 HydrophobicContact CB-CB 3.91Å; Q145-M153 HydrophobicContact CB-CG 3.93Å; Q145-M153 HydrophobicContact CB-SD 3.87Å; Q145-M153 HydrophobicContact CG-SD 3.82Å; Q145-M153 PolarHBondContact O-N 3.03Å
154	N	96.6	Very high	97.2	Very high	44 Å²	44	27 Å²	27	24%	0.235	14%	0.144	C	C	.	.	S	Bend	trans	-75.9	167.1	166.1	-151.6	-20.1	0	0	0	109.9	P148 V149 F156 T190 Y191	P148-N154 HydrophobicContact CG-CB 4.1Å; V149-N154 HydrophobicContact CG2-CB 3.8Å; N154-F156 PolarHBondContact O-N 3.23Å; N154-T190 WeakPolarHBondContact OD1-CA 3.26Å; N154-Y191 PolarHBondContact ND2-O 2.94Å; N154-Y191 PolarHBondContact OD1-N 2.85Å
155	Q	96.8	Very high	97.1	Very high	95 Å²	95	24.3 Å²	24.3	44%	0.444	13%	0.131	S	C	.	.	S	Bend	trans	54.1	43.1	-178.4	-59.4	-179.9	-56.4	0	0	112.1	G187 T188 L189 T190	Q155-G187 WeakPolarHBondContact O-CA 3.47Å; Q155-T188 PolarHBondContact NE2-O 3.31Å; Q155-L189 WeakPolarHBondContact CA-O 3.24Å; Q155-T190 HydrophobicContact CG-CG2 3.69Å
156	F	97.6	Very high	96.8	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.009	12%	0.123	C	C	.	.			trans	-70.9	158.9	176.1	60.9	-88.8	0	0	0	111	W138 T140 N154 G158 F162 M183 G185 G187	W138-F156 HydrophobicContact CE3-CD2 4.38Å; W138-F156 HydrophobicContact CE3-CE2 4.42Å; W138-F156 HydrophobicContact CH2-CD1 4.04Å; W138-F156 AromaticContact CH2-CE1 3.98Å; W138-F156 HydrophobicContact CH2-CE1 3.98Å; W138-F156 HydrophobicContact CH2-CZ 4.44Å; W138-F156 AromaticContact CZ3-CD1 3.64Å; W138-F156 HydrophobicContact CZ3-CD1 3.64Å; W138-F156 AromaticContact CZ3-CD2 3.92Å; W138-F156 HydrophobicContact CZ3-CD2 3.92Å; W138-F156 AromaticContact CZ3-CE1 3.58Å; W138-F156 HydrophobicContact CZ3-CE1 3.58Å; W138-F156 AromaticContact CZ3-CE2 3.84Å; W138-F156 HydrophobicContact CZ3-CE2 3.84Å; W138-F156 AromaticContact CZ3-CG 3.83Å; W138-F156 HydrophobicContact CZ3-CG 3.83Å; W138-F156 AromaticContact CZ3-CZ 3.68Å; W138-F156 HydrophobicContact CZ3-CZ 3.68Å; T140-F156 HydrophobicContact CG2-CB 4.31Å; T140-F156 HydrophobicContact CG2-CD2 3.82Å; T140-F156 HydrophobicContact CG2-CG 4.37Å; N154-F156 PolarHBondContact O-N 3.23Å; F156-G158 WeakPolarHBondContact CE2-O 3.2Å; F156-F162 HydrophobicContact CE1-CZ 4.26Å; F156-F162 HydrophobicContact CZ-CZ 4.19Å; F156-M183 HydrophobicContact CE1-CE 4.22Å; F156-M183 HydrophobicContact CE1-SD 4.04Å; F156-M183 HydrophobicContact CZ-CB 4.38Å; F156-M183 HydrophobicContact CZ-CE 4.24Å; F156-M183 HydrophobicContact CZ-CG 4.01Å; F156-M183 HydrophobicContact CZ-SD 3.89Å; F156-G185 CarbonylContact O-C 3.49Å; F156-G185 VanDerWaalsContact O-C 3.22Å; F156-G185 VanDerWaalsContact O-CA 3.27Å; F156-G185 WeakPolarHBondContact O-CA 3.16Å; F156-G187 PolarHBondContact O-N 3.04Å; F156-G187 VanDerWaalsContact O-N 3.13Å
157	V	97.8	Very high	96.5	Very high	9 Å²	9	20.6 Å²	20.6	6%	0.055	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	111.4	171.7	-175.4	0	0	0	0	108.5	T140 R141 G185 Y254 P297	T140-V157 CarbonylContact C-O 3.58Å; T140-V157 VanDerWaalsContact CA-O 3.29Å; T140-V157 WeakPolarHBondContact CA-O 3.43Å; T140-V157 WeakPolarHBondContact CB-O 3.3Å; R141-V157 HydrophobicContact CB-CB 4.17Å; R141-V157 HydrophobicContact CB-CG1 4.45Å; R141-V157 PolarHBondContact N-O 3.2Å; V157-G185 CarbonylContact C-O 3.59Å; V157-G185 WeakPolarHBondContact CA-O 3.29Å; V157-Y254 WeakPolarHBondContact CG1-OH 2.98Å; V157-P297 HydrophobicContact CG1-CG 3.7Å
158	G	97.6	Very high	96	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	134.8	-157	179.7	0	0	0	0	0	113.5	L139 F156 G185	L139-G158 CarbonylContact O-C 3.44Å; L139-G158 WeakPolarHBondContact O-CA 3.37Å; F156-G158 WeakPolarHBondContact CE2-O 3.2Å; G158-G185 PolarHBondContact N-O 3.42Å; G158-G185 PolarHBondContact O-N 3.15Å
159	L	98.4	Very high	95.3	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.8	-175.3	-176.5	68.7	0	0	0	110.8	W114 W138 L139 I161 V182 L184 L227	W114-L159 HydrophobicContact CH2-CD2 4.47Å; W138-L159 WeakPolarHBondContact CA-O 3.35Å; L139-L159 HydrophobicContact CB-CB 4.29Å; L139-L159 PolarHBondContact N-O 3.35Å; L139-L159 PolarHBondContact O-N 3.3Å; L159-I161 HydrophobicContact CD2-CD1 4.22Å; L159-I161 HydrophobicContact CG-CG1 4.4Å; L159-V182 HydrophobicContact CD1-CG2 3.54Å; L159-L184 HydrophobicContact CB-CD1 4.5Å; L159-L184 HydrophobicContact CD1-CD1 4.4Å; L159-L227 HydrophobicContact CD1-CD2 3.84Å; L159-L227 HydrophobicContact CD2-CD1 4.03Å; L159-L227 HydrophobicContact CD2-CD2 4.22Å
160	G	98.4	Very high	93.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.3	169.8	0	0	0	0	0	110.8	V182 M183	G160-V182 WeakPolarHBondContact O-CA 3.31Å; G160-M183 PolarHBondContact N-O 2.77Å; G160-M183 PolarHBondContact O-N 3.44Å
161	I	98.7	Very high	91.6	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121	174.6	-61.3	165.3	0	0	0	107.4	A136 I137 L159 V180 S181 V182 L218 V220 L229	A136-I161 CarbonylContact C-O 3.6Å; A136-I161 VanDerWaalsContact CA-O 3.29Å; A136-I161 WeakPolarHBondContact CA-O 3.48Å; I137-I161 HydrophobicContact CB-CB 4.36Å; I137-I161 PolarHBondContact N-O 3.15Å; I137-I161 PolarHBondContact O-N 3.45Å; L159-I161 HydrophobicContact CD2-CD1 4.22Å; L159-I161 HydrophobicContact CG-CG1 4.4Å; I161-V180 HydrophobicContact CG2-CG1 4.31Å; I161-S181 CarbonylContact C-O 3.52Å; I161-S181 WeakPolarHBondContact CA-O 3.33Å; I161-V182 HydrophobicContact CG1-CB 4.45Å; I161-V182 HydrophobicContact CG1-CG2 4.18Å; I161-L218 HydrophobicContact CG2-CD1 4.32Å; I161-V220 HydrophobicContact CD1-CB 4.08Å; I161-V220 HydrophobicContact CD1-CG1 3.54Å; I161-V220 HydrophobicContact CD1-CG2 3.38Å; I161-L229 HydrophobicContact CD1-CD1 4.44Å; I161-L229 HydrophobicContact CG2-CD1 4.15Å; I161-L229 HydrophobicContact CG2-CD2 4.08Å
162	F	98.5	Very high	89.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.4	-171.4	-51.5	-62.8	0	0	0	109.8	A136 W138 V149 F150 F156 V180 S181 M183 Y191	A136-F162 HydrophobicContact CB-CD1 3.65Å; A136-F162 HydrophobicContact CB-CE1 3.9Å; W138-F162 AromaticContact CH2-CE1 3.46Å; W138-F162 HydrophobicContact CH2-CE1 3.46Å; W138-F162 VanDerWaalsContact CH2-CE1 3.46Å; W138-F162 AromaticContact CH2-CZ 3.89Å; W138-F162 HydrophobicContact CH2-CZ 3.89Å; W138-F162 AromaticContact CZ2-CE1 3.89Å; W138-F162 HydrophobicContact CZ2-CE1 3.89Å; W138-F162 AromaticContact CZ3-CE1 3.99Å; W138-F162 HydrophobicContact CZ3-CE1 3.99Å; W138-F162 HydrophobicContact CZ3-CZ 4.12Å; V149-F162 HydrophobicContact CG1-CE1 3.76Å; V149-F162 HydrophobicContact CG1-CZ 4Å; F150-F162 AromaticContact CD2-CD1 3.51Å; F150-F162 HydrophobicContact CD2-CD1 3.51Å; F150-F162 HydrophobicContact CD2-CE1 4.04Å; F150-F162 HydrophobicContact CD2-CG 4.28Å; F150-F162 HydrophobicContact CE2-CB 3.93Å; F150-F162 AromaticContact CE2-CD1 3.62Å; F150-F162 HydrophobicContact CE2-CD1 3.62Å; F150-F162 HydrophobicContact CE2-CE1 4.4Å; F150-F162 AromaticContact CE2-CG 3.92Å; F150-F162 HydrophobicContact CE2-CG 3.92Å; F150-F162 HydrophobicContact CG-CD1 4.49Å; F150-F162 HydrophobicContact CZ-CB 4.32Å; F156-F162 HydrophobicContact CE1-CZ 4.26Å; F156-F162 HydrophobicContact CZ-CZ 4.19Å; F162-V180 CarbonylContact O-C 3.42Å; F162-V180 WeakPolarHBondContact O-CA 3.45Å; F162-S181 PolarHBondContact N-O 3.32Å; F162-S181 PolarHBondContact O-N 3.2Å; F162-M183 HydrophobicContact CE2-CB 3.6Å; F162-M183 HydrophobicContact CE2-SD 4.23Å; F162-M183 HydrophobicContact CZ-CB 4.36Å; F162-Y191 HydrophobicContact CD2-CD2 4.26Å; F162-Y191 AromaticContact CD2-CE2 3.72Å; F162-Y191 HydrophobicContact CD2-CE2 3.72Å; F162-Y191 AromaticContact CE2-CD2 3.66Å; F162-Y191 HydrophobicContact CE2-CD2 3.66Å; F162-Y191 AromaticContact CE2-CE2 3.61Å; F162-Y191 HydrophobicContact CE2-CE2 3.61Å; F162-Y191 HydrophobicContact CG-CE2 4.23Å; F162-Y191 AromaticContact CZ-CD2 3.91Å; F162-Y191 HydrophobicContact CZ-CD2 3.91Å; F162-Y191 HydrophobicContact CZ-CE2 4.1Å
163	V	98.1	Very high	87.9	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	91.2	165.1	-175.1	0	0	0	0	106.1	F120 I122 G134 I135 V180 T209 L218	F120-V163 HydrophobicContact CE2-CG1 4.11Å; F120-V163 HydrophobicContact CE2-CG2 4.37Å; F120-V163 HydrophobicContact CZ-CG1 4.39Å; F120-V163 HydrophobicContact CZ-CG2 4.26Å; I122-V163 HydrophobicContact CD1-CB 4.36Å; I122-V163 HydrophobicContact CD1-CG1 3.76Å; G134-V163 VanDerWaalsContact CA-O 3.23Å; G134-V163 WeakPolarHBondContact CA-O 3.45Å; I135-V163 PolarHBondContact N-O 2.87Å; I135-V163 VanDerWaalsContact N-O 3.1Å; I135-V163 PolarHBondContact O-N 2.88Å; V163-V180 HydrophobicContact CG1-CG2 4.31Å; V163-V180 HydrophobicContact CG2-CG2 4.2Å; V163-T209 HydrophobicContact CG1-CG2 4.03Å; V163-L218 HydrophobicContact CG2-CD1 3.74Å; V163-L218 HydrophobicContact CG2-CD2 4.48Å
164	D	96.1	Very high	86.8	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.2	-176.8	-164	-20.8	0	0	0	110.3	F150 Y166 F177 P178 Y179	F150-D164 HydrophobicContact CZ-CB 4.03Å; D164-Y166 PolarHBondContact OD1-N 3.41Å; D164-Y166 VanDerWaalsContact OD1-O 3.1Å; D164-F177 HydrophobicContact CB-CD1 4.3Å; D164-F177 HydrophobicContact CB-CE1 4.01Å; D164-P178 CarbonylContact O-C 3.57Å; D164-P178 WeakPolarHBondContact O-CA 3.28Å; D164-P178 VanDerWaalsContact O-CB 3.28Å; D164-P178 WeakPolarHBondContact O-CB 3.09Å; D164-Y179 PolarHBondContact N-O 3.49Å; D164-Y179 PolarHBondContact O-N 2.63Å
165	T	94	Very high	86.2	Confident	6 Å²	6	50.6 Å²	50.6	4%	0.037	25%	0.251	C	S	.	.			trans	-107.5	-8	-176.2	65.5	0	0	0	0	113.6	I122 N131 D133 P178	I122-T165 HydrophobicContact CD1-CG2 3.79Å; I122-T165 HydrophobicContact CG2-CG2 4.17Å; N131-T165 WeakPolarHBondContact ND2-CB 3.39Å; N131-T165 PolarHBondContact ND2-O 3.3Å; N131-T165 PolarHBondContact ND2-OG1 2.84Å; D133-T165 PolarHBondContact O-N 2.96Å; D133-T165 PolarHBondContact O-OG1 3.19Å; T165-P178 HydrophobicContact CG2-CB 4.21Å; T165-P178 HydrophobicContact CG2-CG 4.36Å
166	Y	89.9	Confident	85.9	Confident	71 Å²	71	49.8 Å²	49.8	28%	0.278	25%	0.252	S	S	.	.	S	Bend	trans	-128.5	123.2	-173.2	-174.2	-104	0	0	0	110.9	N131 D164 N168 F177 L265	N131-Y166 WeakPolarHBondContact O-CD2 3.44Å; D164-Y166 PolarHBondContact OD1-N 3.41Å; D164-Y166 VanDerWaalsContact OD1-O 3.1Å; Y166-N168 PolarHBondContact O-N 2.81Å; Y166-N168 PolarHBondContact O-OD1 2.9Å; Y166-F177 WeakPolarHBondContact O-CE1 3.17Å; Y166-L265 HydrophobicContact CD2-CD1 3.58Å; Y166-L265 HydrophobicContact CE2-CD1 3.27Å; Y166-L265 HydrophobicContact CG-CD1 4.36Å
167	P	90.1	Very high	85.6	Confident	39 Å²	39	51.4 Å²	51.4	25%	0.253	26%	0.259	S	S	.	.			trans	-75.5	107.8	173.2	28.8	-30.7	0	0	0	110.2	F177	P167-F177 HydrophobicContact CB-CD2 3.7Å; P167-F177 HydrophobicContact CB-CE2 3.71Å; P167-F177 HydrophobicContact CB-CG 4.13Å; P167-F177 HydrophobicContact CB-CZ 4.13Å; P167-F177 HydrophobicContact CG-CD2 4.4Å
168	N	85.9	Confident	85.5	Confident	43 Å²	43	51.6 Å²	51.6	23%	0.23	26%	0.26	C	S	.	.			trans	-76	-25.6	175.5	-69.3	78.9	0	0	0	112.4	Y166 H193 D196	Y166-N168 PolarHBondContact O-N 2.81Å; Y166-N168 PolarHBondContact O-OD1 2.9Å; N168-H193 WeakPolarHBondContact CB-O 3.28Å; N168-H193 PolarHBondContact ND2-NE2 2.89Å; N168-H193 VanDerWaalsContact ND2-NE2 3.2Å; N168-D196 VanDerWaalsContact CB-OD1 3.27Å; N168-D196 WeakPolarHBondContact CB-OD1 3.24Å; N168-D196 PolarHBondContact N-OD1 3.16Å; N168-D196 PolarHBondContact OD1-OD1 3.24Å
169	T	79.8	Confident	85.4	Confident	43 Å²	43	52.9 Å²	52.9	26%	0.264	27%	0.266	S	S	.	.			trans	-97.9	110.9	177.8	-167.3	0	0	0	0	113.1	K171 D196	T169-K171 PolarHBondContact O-N 2.94Å; T169-K171 VanDerWaalsContact O-N 3.15Å; T169-D196 WeakPolarHBondContact CG2-OD2 3.24Å
170	D	60.3	Low	85.4	Confident	149 Å²	149	52.7 Å²	52.7	80%	0.797	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-7.7	-178.6	-80.1	-34	0	0	0	114.9
171	K	57.4	Low	85.3	Confident	190 Å²	190	52.9 Å²	52.9	83%	0.826	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	-3.8	-157.9	-68.1	-174.9	-177.4	175.6	0	116.8	T169	T169-K171 PolarHBondContact O-N 2.94Å; T169-K171 VanDerWaalsContact O-N 3.15Å
172	T	55.2	Low	85.3	Confident	59 Å²	59	52.7 Å²	52.7	36%	0.362	27%	0.265	S	S	.	.			trans	-130.9	104.9	179.7	56.7	0	0	0	0	111	D174 R198	T172-D174 PolarHBondContact O-N 2.9Å; T172-R198 PolarHBondContact OG1-NH1 2.83Å
173	H	60.7	Low	85.3	Confident	189 Å²	189	52.8 Å²	52.8	88%	0.875	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	13.9	174.5	-72	-66.4	0	0	0	114.4	R175	H173-R175 VanDerWaalsContact C-N 3.3Å; H173-R175 PolarHBondContact O-N 3.11Å
174	D	74.2	Confident	85.3	Confident	115 Å²	115	52.8 Å²	52.8	62%	0.615	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-24.1	-175.1	-60.4	-13.1	0	0	0	112.6	T172 R198	T172-D174 PolarHBondContact O-N 2.9Å; D174-R198 IonicContact OD2-CZ 3.59Å; D174-R198 IonicContact OD2-NH1 2.81Å; D174-R198 IonicContact OD2-NH2 3.47Å; D174-R198 PolarHBondContact OD2-NH2 2.87Å
175	R	84.9	Confident	85.3	Confident	41 Å²	41	52.6 Å²	52.6	16%	0.155	27%	0.265	C	S	.	.			trans	-118.2	136.4	-177.3	-66.4	-179.5	-176.2	-171.6	-10.6	111.1	H173 F177 Y179 E201	H173-R175 VanDerWaalsContact C-N 3.3Å; H173-R175 PolarHBondContact O-N 3.11Å; R175-F177 HydrophobicContact CB-CD2 4.43Å; R175-F177 HydrophobicContact CB-CE2 3.91Å; R175-Y179 HydrophobicContact CB-CD2 4.39Å; R175-Y179 HydrophobicContact CG-CD2 4.44Å; R175-Y179 HydrophobicContact CG-CE2 4.22Å; R175-E201 IonicContact CZ-OE1 3.3Å; R175-E201 IonicContact CZ-OE2 3.38Å; R175-E201 IonicContact NH1-OE2 2.84Å; R175-E201 PolarHBondContact NH1-OE2 3.23Å; R175-E201 IonicContact NH2-OE1 3.64Å; R175-E201 PolarHBondContact NH2-OE1 2.94Å; R175-E201 IonicContact NH2-OE2 3.47Å; R175-E201 PolarHBondContact NH2-OE2 2.94Å
176	T	90.6	Very high	85.3	Confident	78 Å²	78	54.1 Å²	54.1	48%	0.479	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-102.6	128.5	170	-60.1	0	0	0	0	108.5	T206 M208	T176-T206 HydrophobicContact CG2-CG2 3.86Å; T176-T206 WeakPolarHBondContact O-CB 3.46Å; T176-T206 VanDerWaalsContact O-CG2 3.28Å; T176-T206 WeakPolarHBondContact O-CG2 3.35Å; T176-T206 PolarHBondContact O-OG1 2.85Å; T176-M208 HydrophobicContact CG2-CE 3.81Å
177	F	91.6	Very high	85.5	Confident	36 Å²	36	52 Å²	52	16%	0.158	27%	0.272	C	S	.	.	S	Bend	trans	-96.8	148.9	179	-74.4	-108.6	0	0	0	110.7	D164 Y166 P167 R175 D196	D164-F177 HydrophobicContact CB-CD1 4.3Å; D164-F177 HydrophobicContact CB-CE1 4.01Å; Y166-F177 WeakPolarHBondContact O-CE1 3.17Å; P167-F177 HydrophobicContact CB-CD2 3.7Å; P167-F177 HydrophobicContact CB-CE2 3.71Å; P167-F177 HydrophobicContact CB-CG 4.13Å; P167-F177 HydrophobicContact CB-CZ 4.13Å; P167-F177 HydrophobicContact CG-CD2 4.4Å; R175-F177 HydrophobicContact CB-CD2 4.43Å; R175-F177 HydrophobicContact CB-CE2 3.91Å; F177-D196 HydrophobicContact CE1-CB 4.37Å; F177-D196 HydrophobicContact CZ-CB 4.03Å
178	P	94.5	Very high	85.6	Confident	12 Å²	12	54.6 Å²	54.6	8%	0.078	29%	0.287	C	S	.	.	S	Bend	cis	-68.1	145.5	2.4	-18.2	31.5	0	0	0	114.2	D164 T165 A207 R210	D164-P178 CarbonylContact O-C 3.57Å; D164-P178 WeakPolarHBondContact O-CA 3.28Å; D164-P178 VanDerWaalsContact O-CB 3.28Å; D164-P178 WeakPolarHBondContact O-CB 3.09Å; T165-P178 HydrophobicContact CG2-CB 4.21Å; T165-P178 HydrophobicContact CG2-CG 4.36Å; P178-A207 WeakPolarHBondContact CB-O 3.41Å; P178-A207 PolarHBondContact O-N 2.69Å; P178-R210 HydrophobicContact CG-CB 4.1Å
179	Y	96.1	Very high	86	Confident	27 Å²	27	53.8 Å²	53.8	11%	0.106	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.4	-174.8	-164.1	-103.1	0	0	0	110.1	D164 R175 E201 G204 C205	D164-Y179 PolarHBondContact N-O 3.49Å; D164-Y179 PolarHBondContact O-N 2.63Å; R175-Y179 HydrophobicContact CB-CD2 4.39Å; R175-Y179 HydrophobicContact CG-CD2 4.44Å; R175-Y179 HydrophobicContact CG-CE2 4.22Å; Y179-E201 PolarHBondContact OH-OE1 2.65Å; Y179-G204 VanDerWaalsContact OH-C 3.23Å; Y179-G204 PolarHBondContact OH-O 3.25Å; Y179-C205 WeakPolarHBondContact CD2-O 3.28Å; Y179-C205 VanDerWaalsContact CE2-C 3.44Å
180	V	98.1	Very high	86.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.3	175.6	-176.7	0	0	0	0	108.2	I161 F162 V163 G204 C205 A207 L218 L229 V231	I161-V180 HydrophobicContact CG2-CG1 4.31Å; F162-V180 CarbonylContact O-C 3.42Å; F162-V180 WeakPolarHBondContact O-CA 3.45Å; V163-V180 HydrophobicContact CG1-CG2 4.31Å; V163-V180 HydrophobicContact CG2-CG2 4.2Å; V180-G204 CarbonylContact O-C 3.53Å; V180-G204 WeakPolarHBondContact O-CA 3.05Å; V180-C205 PolarHBondContact N-O 3.22Å; V180-C205 PolarHBondContact O-N 3.17Å; V180-A207 HydrophobicContact CG2-CB 3.9Å; V180-L218 HydrophobicContact CG1-CD2 4.22Å; V180-L218 HydrophobicContact CG2-CD2 4.42Å; V180-L229 HydrophobicContact CG1-CD2 3.76Å; V180-V231 HydrophobicContact CG2-CG1 4.38Å
181	S	97.8	Very high	88.5	Confident	4 Å²	4	48.2 Å²	48.2	3%	0.028	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	159.7	179.8	65.1	0	0	0	0	112.1	I161 F162 G203	I161-S181 CarbonylContact C-O 3.52Å; I161-S181 WeakPolarHBondContact CA-O 3.33Å; F162-S181 PolarHBondContact N-O 3.32Å; F162-S181 PolarHBondContact O-N 3.2Å; S181-G203 WeakPolarHBondContact CA-O 2.92Å
182	V	98.1	Very high	90.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138	176.1	56.3	0	0	0	0	111.1	L159 G160 I161 L202 G203 L227 A243 V245	L159-V182 HydrophobicContact CD1-CG2 3.54Å; G160-V182 WeakPolarHBondContact O-CA 3.31Å; I161-V182 HydrophobicContact CG1-CB 4.45Å; I161-V182 HydrophobicContact CG1-CG2 4.18Å; V182-L202 HydrophobicContact CG1-CB 4.13Å; V182-L202 PolarHBondContact O-N 3.49Å; V182-G203 WeakPolarHBondContact CG1-O 3.48Å; V182-G203 PolarHBondContact N-O 2.95Å; V182-L227 HydrophobicContact CG2-CD2 3.74Å; V182-A243 HydrophobicContact CG1-CB 3.95Å; V182-V245 HydrophobicContact CG1-CG2 4.3Å
183	M	97.7	Very high	91.9	Very high	3 Å²	3	41 Å²	41	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140.4	176.5	178.7	178.5	173.3	0	0	109.8	F156 G160 F162 L189 Y191 T200	F156-M183 HydrophobicContact CE1-CE 4.22Å; F156-M183 HydrophobicContact CE1-SD 4.04Å; F156-M183 HydrophobicContact CZ-CB 4.38Å; F156-M183 HydrophobicContact CZ-CE 4.24Å; F156-M183 HydrophobicContact CZ-CG 4.01Å; F156-M183 HydrophobicContact CZ-SD 3.89Å; G160-M183 PolarHBondContact N-O 2.77Å; G160-M183 PolarHBondContact O-N 3.44Å; F162-M183 HydrophobicContact CE2-CB 3.6Å; F162-M183 HydrophobicContact CE2-SD 4.23Å; F162-M183 HydrophobicContact CZ-CB 4.36Å; M183-L189 HydrophobicContact CE-CB 3.91Å; M183-Y191 HydrophobicContact SD-CD2 3.86Å; M183-Y191 HydrophobicContact SD-CG 4.47Å; M183-T200 HydrophobicContact CE-CG2 4.15Å; M183-T200 WeakPolarHBondContact CE-OG1 3.49Å; M183-T200 WeakPolarHBondContact CG-O 3.41Å; M183-T200 PolarHBondContact SD-OG1 2.79Å; M183-T200 VanDerWaalsContact SD-OG1 3.34Å
184	L	97.7	Very high	93.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	118.7	169.1	-170.4	74.6	0	0	0	108.8	L159 L202 L248 L250 P297 R298 V299 F305	L159-L184 HydrophobicContact CB-CD1 4.5Å; L159-L184 HydrophobicContact CD1-CD1 4.4Å; L184-L202 HydrophobicContact CB-CD1 3.59Å; L184-L248 HydrophobicContact CD1-CD1 4.41Å; L184-L248 HydrophobicContact CD2-CD1 4.46Å; L184-L248 HydrophobicContact CD2-CG 4.26Å; L184-L250 HydrophobicContact CD1-CD1 4.05Å; L184-P297 HydrophobicContact CD1-CB 3.94Å; L184-P297 HydrophobicContact CD2-CB 4.18Å; L184-P297 HydrophobicContact CG-CB 4.06Å; L184-R298 VanDerWaalsContact CD2-C 3.42Å; L184-R298 WeakPolarHBondContact CD2-O 2.99Å; L184-V299 HydrophobicContact CD2-CG2 3.75Å; L184-F305 HydrophobicContact CB-CZ 3.95Å; L184-F305 HydrophobicContact CD2-CE1 4.37Å; L184-F305 HydrophobicContact CD2-CE2 4.48Å; L184-F305 HydrophobicContact CD2-CZ 4.09Å; L184-F305 HydrophobicContact CG-CZ 4.34Å; L184-F305 WeakPolarHBondContact O-CZ 3.37Å
185	G	96.4	Very high	94.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.1	176.5	0	0	0	0	0	111.1	F156 V157 G158 P297	F156-G185 CarbonylContact O-C 3.49Å; F156-G185 VanDerWaalsContact O-C 3.22Å; F156-G185 VanDerWaalsContact O-CA 3.27Å; F156-G185 WeakPolarHBondContact O-CA 3.16Å; V157-G185 CarbonylContact C-O 3.59Å; V157-G185 WeakPolarHBondContact CA-O 3.29Å; G158-G185 PolarHBondContact N-O 3.42Å; G158-G185 PolarHBondContact O-N 3.15Å; G185-P297 WeakPolarHBondContact O-CG 3.33Å
186	N	93.9	Very high	94.4	Very high	37 Å²	37	37.1 Å²	37.1	20%	0.198	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	8.2	172.7	65.1	-5.9	0	0	0	112.6	T188 L189 V296 F305	N186-T188 PolarHBondContact ND2-OG1 3.34Å; N186-T188 PolarHBondContact OD1-N 2.94Å; N186-T188 PolarHBondContact OD1-OG1 3Å; N186-L189 PolarHBondContact OD1-N 3.4Å; N186-V296 HydrophobicContact CB-CG1 4.38Å; N186-F305 HydrophobicContact CB-CD1 4.34Å; N186-F305 HydrophobicContact CB-CE1 4.35Å
187	G	94.4	Very high	94.5	Very high	27 Å²	27	33.6 Å²	33.6	28%	0.278	18%	0.177	S	C	.	.	S	Bend	trans	90.2	-6.2	-175.9	0	0	0	0	0	115.2	Q155 F156	Q155-G187 WeakPolarHBondContact O-CA 3.47Å; F156-G187 PolarHBondContact O-N 3.04Å; F156-G187 VanDerWaalsContact O-N 3.13Å
188	T	92.3	Very high	94.5	Very high	93 Å²	93	36.2 Å²	36.2	57%	0.571	19%	0.186	S	C	*	.	S	Bend	trans	-111.1	-36.5	175.8	66.7	0	0	0	0	112.1	Q155 N186 T190	Q155-T188 PolarHBondContact NE2-O 3.31Å; N186-T188 PolarHBondContact ND2-OG1 3.34Å; N186-T188 PolarHBondContact OD1-N 2.94Å; N186-T188 PolarHBondContact OD1-OG1 3Å; T188-T190 PolarHBondContact O-N 3.12Å
189	L	94.1	Very high	94.3	Very high	27 Å²	27	39.8 Å²	39.8	14%	0.141	21%	0.208	C	C	.	.			trans	-64.4	131.1	178.8	-61.9	179.7	0	0	0	112	Q155 M183 N186 T200 Q304 F305	Q155-L189 WeakPolarHBondContact CA-O 3.24Å; M183-L189 HydrophobicContact CE-CB 3.91Å; N186-L189 PolarHBondContact OD1-N 3.4Å; L189-T200 HydrophobicContact CB-CG2 4.18Å; L189-T200 HydrophobicContact CD2-CG2 4.31Å; L189-Q304 HydrophobicContact CD1-CG 4.49Å; L189-Q304 HydrophobicContact CD2-CB 4.47Å; L189-F305 HydrophobicContact CD1-CD1 4.42Å; L189-F305 HydrophobicContact CD1-CE1 3.56Å; L189-F305 HydrophobicContact CD1-CZ 3.8Å
190	T	95.6	Very high	94.2	Very high	70 Å²	70	38.9 Å²	38.9	43%	0.429	21%	0.205	S	C	.	.			trans	-100.3	129.6	177.6	53	0	0	0	0	110.6	N154 Q155 T188 D192	N154-T190 WeakPolarHBondContact OD1-CA 3.26Å; Q155-T190 HydrophobicContact CG-CG2 3.69Å; T188-T190 PolarHBondContact O-N 3.12Å; T190-D192 PolarHBondContact O-N 2.82Å
191	Y	96.4	Very high	94	Very high	5 Å²	5	40.6 Å²	40.6	2%	0.02	21%	0.213	C	C	.	.			trans	-73.5	116	164.2	-177.5	-87.4	0	0	0	108.7	V149 F150 N154 F162 M183 H193 G197	V149-Y191 HydrophobicContact CB-CD1 4.41Å; V149-Y191 HydrophobicContact CG1-CD1 3.76Å; V149-Y191 HydrophobicContact CG1-CD2 4.18Å; V149-Y191 HydrophobicContact CG1-CE1 4.29Å; V149-Y191 HydrophobicContact CG1-CG 3.7Å; V149-Y191 HydrophobicContact CG2-CD1 4.04Å; V149-Y191 HydrophobicContact CG2-CG 4.17Å; F150-Y191 HydrophobicContact CE2-CE1 4.24Å; F150-Y191 HydrophobicContact CE2-CE2 4.49Å; F150-Y191 AromaticContact CE2-CZ 3.82Å; F150-Y191 WeakPolarHBondContact CE2-OH 3.25Å; N154-Y191 PolarHBondContact ND2-O 2.94Å; N154-Y191 PolarHBondContact OD1-N 2.85Å; F162-Y191 HydrophobicContact CD2-CD2 4.26Å; F162-Y191 AromaticContact CD2-CE2 3.72Å; F162-Y191 HydrophobicContact CD2-CE2 3.72Å; F162-Y191 AromaticContact CE2-CD2 3.66Å; F162-Y191 HydrophobicContact CE2-CD2 3.66Å; F162-Y191 AromaticContact CE2-CE2 3.61Å; F162-Y191 HydrophobicContact CE2-CE2 3.61Å; F162-Y191 HydrophobicContact CG-CE2 4.23Å; F162-Y191 AromaticContact CZ-CD2 3.91Å; F162-Y191 HydrophobicContact CZ-CD2 3.91Å; F162-Y191 HydrophobicContact CZ-CE2 4.1Å; M183-Y191 HydrophobicContact SD-CD2 3.86Å; M183-Y191 HydrophobicContact SD-CG 4.47Å; Y191-H193 HydrophobicContact CD1-CB 4.38Å; Y191-H193 HydrophobicContact CE1-CB 4.14Å; Y191-H193 PolarHBondContact O-N 3.06Å; Y191-G197 VanDerWaalsContact CE2-CA 3.43Å
192	D	94.4	Very high	94	Very high	45 Å²	45	41.9 Å²	41.9	24%	0.241	22%	0.219	C	C	.	.			trans	-88.3	99.8	176.2	-176.2	-2	0	0	0	109.7	T190 D194 R195 D196 G197	T190-D192 PolarHBondContact O-N 2.82Å; D192-D194 VanDerWaalsContact C-N 3.29Å; D192-D194 PolarHBondContact O-N 2.88Å; D192-D194 PolarHBondContact OD1-N 2.7Å; D192-D194 VanDerWaalsContact OD1-N 3.16Å; D192-R195 HydrophobicContact CB-CB 4.39Å; D192-R195 CarbonylContact O-C 3.56Å; D192-R195 PolarHBondContact O-N 2.9Å; D192-R195 WeakPolarHBondContact OD2-CD 3.29Å; D192-R195 VanDerWaalsContact OD2-CG 3.26Å; D192-R195 WeakPolarHBondContact OD2-CG 3.37Å; D192-R195 IonicContact OD2-NE 3.5Å; D192-D196 PolarHBondContact O-N 3.36Å; D192-D196 VanDerWaalsContact O-N 3.17Å; D192-G197 PolarHBondContact O-N 3.03Å
193	H	90.9	Very high	93.9	Very high	51 Å²	51	42.7 Å²	42.7	24%	0.236	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-65.6	-31.1	-178.8	-178.4	69.7	0	0	0	112.6	D133 N168 Y191 R195 D196	D133-H193 IonicContact OD2-CE1 3.45Å; D133-H193 IonicContact OD2-NE2 2.74Å; N168-H193 WeakPolarHBondContact CB-O 3.28Å; N168-H193 PolarHBondContact ND2-NE2 2.89Å; N168-H193 VanDerWaalsContact ND2-NE2 3.2Å; Y191-H193 HydrophobicContact CD1-CB 4.38Å; Y191-H193 HydrophobicContact CE1-CB 4.14Å; Y191-H193 PolarHBondContact O-N 3.06Å; H193-R195 PolarHBondContact O-N 2.8Å; H193-R195 VanDerWaalsContact O-N 3.15Å; H193-D196 PolarHBondContact O-N 2.64Å
194	D	89.8	Confident	93.8	Very high	118 Å²	118	43.5 Å²	43.5	63%	0.631	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-70	-13.3	178.6	-63.9	-25.3	0	0	0	112.3	D192	D192-D194 VanDerWaalsContact C-N 3.29Å; D192-D194 PolarHBondContact O-N 2.88Å; D192-D194 PolarHBondContact OD1-N 2.7Å; D192-D194 VanDerWaalsContact OD1-N 3.16Å
195	R	90.6	Very high	93.8	Very high	142 Å²	142	44.5 Å²	44.5	54%	0.536	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-125.8	22.2	179	-58	-172.6	-176.2	-170.3	0.5	112.7	D192 H193 G197 R198	D192-R195 HydrophobicContact CB-CB 4.39Å; D192-R195 CarbonylContact O-C 3.56Å; D192-R195 PolarHBondContact O-N 2.9Å; D192-R195 WeakPolarHBondContact OD2-CD 3.29Å; D192-R195 VanDerWaalsContact OD2-CG 3.26Å; D192-R195 WeakPolarHBondContact OD2-CG 3.37Å; D192-R195 IonicContact OD2-NE 3.5Å; H193-R195 PolarHBondContact O-N 2.8Å; H193-R195 VanDerWaalsContact O-N 3.15Å; R195-G197 PolarHBondContact O-N 3.2Å; R195-R198 WeakPolarHBondContact O-CB 3.37Å; R195-R198 PolarHBondContact O-N 2.86Å
196	D	91.6	Very high	93.8	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.027	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	29.8	175.3	-37	-59.2	0	0	0	113.2	N168 T169 F177 D192 H193 R198	N168-D196 VanDerWaalsContact CB-OD1 3.27Å; N168-D196 WeakPolarHBondContact CB-OD1 3.24Å; N168-D196 PolarHBondContact N-OD1 3.16Å; N168-D196 PolarHBondContact OD1-OD1 3.24Å; T169-D196 WeakPolarHBondContact CG2-OD2 3.24Å; F177-D196 HydrophobicContact CE1-CB 4.37Å; F177-D196 HydrophobicContact CZ-CB 4.03Å; D192-D196 PolarHBondContact O-N 3.36Å; D192-D196 VanDerWaalsContact O-N 3.17Å; H193-D196 PolarHBondContact O-N 2.64Å; D196-R198 VanDerWaalsContact C-N 3.26Å; D196-R198 PolarHBondContact O-N 2.82Å
197	G	92.6	Very high	93.9	Very high	3 Å²	3	45 Å²	45	3%	0.031	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	12.8	-178	0	0	0	0	0	115.7	Y191 D192 R195 T199 T200 E201	Y191-G197 VanDerWaalsContact CE2-CA 3.43Å; D192-G197 PolarHBondContact O-N 3.03Å; R195-G197 PolarHBondContact O-N 3.2Å; G197-T199 VanDerWaalsContact C-N 3.26Å; G197-T199 PolarHBondContact O-N 2.81Å; G197-T199 VanDerWaalsContact O-N 3.11Å; G197-T200 PolarHBondContact O-N 2.83Å; G197-T200 VanDerWaalsContact O-N 3.14Å; G197-T200 PolarHBondContact O-OG1 2.84Å; G197-E201 PolarHBondContact O-N 2.91Å
198	R	90.9	Very high	93.8	Very high	92 Å²	92	48.7 Å²	48.7	35%	0.347	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-56.6	-31.8	-169.6	-177.6	162.3	-173.2	155.2	-3.4	115.3	T172 D174 R195 D196 T200	T172-R198 PolarHBondContact OG1-NH1 2.83Å; D174-R198 IonicContact OD2-CZ 3.59Å; D174-R198 IonicContact OD2-NH1 2.81Å; D174-R198 IonicContact OD2-NH2 3.47Å; D174-R198 PolarHBondContact OD2-NH2 2.87Å; R195-R198 WeakPolarHBondContact O-CB 3.37Å; R195-R198 PolarHBondContact O-N 2.86Å; D196-R198 VanDerWaalsContact C-N 3.26Å; D196-R198 PolarHBondContact O-N 2.82Å; R198-T200 VanDerWaalsContact C-N 3.31Å; R198-T200 PolarHBondContact O-N 2.92Å
199	T	91	Very high	94	Very high	86 Å²	86	44.2 Å²	44.2	53%	0.528	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-73.3	-22.7	-176.9	48.6	0	0	0	0	113.8	G197	G197-T199 VanDerWaalsContact C-N 3.26Å; G197-T199 PolarHBondContact O-N 2.81Å; G197-T199 VanDerWaalsContact O-N 3.11Å
200	T	93.9	Very high	94	Very high	9 Å²	9	45 Å²	45	6%	0.055	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-119.7	13.1	-173.9	50.3	0	0	0	0	112.3	M183 L189 G197 R198	M183-T200 HydrophobicContact CE-CG2 4.15Å; M183-T200 WeakPolarHBondContact CE-OG1 3.49Å; M183-T200 WeakPolarHBondContact CG-O 3.41Å; M183-T200 PolarHBondContact SD-OG1 2.79Å; M183-T200 VanDerWaalsContact SD-OG1 3.34Å; L189-T200 HydrophobicContact CB-CG2 4.18Å; L189-T200 HydrophobicContact CD2-CG2 4.31Å; G197-T200 PolarHBondContact O-N 2.83Å; G197-T200 VanDerWaalsContact O-N 3.14Å; G197-T200 PolarHBondContact O-OG1 2.84Å; R198-T200 VanDerWaalsContact C-N 3.31Å; R198-T200 PolarHBondContact O-N 2.92Å
201	E	94.8	Very high	93.9	Very high	35 Å²	35	45 Å²	45	16%	0.164	23%	0.231	C	C	.	.			trans	-75.5	136	178.5	178.2	179.4	144.1	0	0	111.4	R175 Y179 G197	R175-E201 IonicContact CZ-OE1 3.3Å; R175-E201 IonicContact CZ-OE2 3.38Å; R175-E201 IonicContact NH1-OE2 2.84Å; R175-E201 PolarHBondContact NH1-OE2 3.23Å; R175-E201 IonicContact NH2-OE1 3.64Å; R175-E201 PolarHBondContact NH2-OE1 2.94Å; R175-E201 IonicContact NH2-OE2 3.47Å; R175-E201 PolarHBondContact NH2-OE2 2.94Å; Y179-E201 PolarHBondContact OH-OE1 2.65Å; G197-E201 PolarHBondContact O-N 2.91Å
202	L	96.4	Very high	93.8	Very high	31 Å²	31	45.7 Å²	45.7	16%	0.162	24%	0.236	C	C	.	.			trans	-93.9	-23.9	173.9	-56.6	178.9	0	0	0	112.5	V182 L184 V245 L248 V299 M302 F305	V182-L202 HydrophobicContact CG1-CB 4.13Å; V182-L202 PolarHBondContact O-N 3.49Å; L184-L202 HydrophobicContact CB-CD1 3.59Å; L202-V245 HydrophobicContact CB-CG2 3.8Å; L202-V245 HydrophobicContact CD1-CG1 4.3Å; L202-V245 HydrophobicContact CD1-CG2 4.46Å; L202-L248 HydrophobicContact CD1-CD1 4.43Å; L202-V299 HydrophobicContact CD1-CG2 3.91Å; L202-V299 HydrophobicContact CD2-CG2 4.26Å; L202-M302 HydrophobicContact CD2-CE 3.64Å; L202-M302 HydrophobicContact CD2-SD 3.55Å; L202-M302 VanDerWaalsContact CD2-SD 3.55Å; L202-F305 HydrophobicContact CD2-CE2 4.24Å
203	G	96.1	Very high	93.7	Very high	18 Å²	18	50.2 Å²	50.2	19%	0.186	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.6	169.6	175.4	0	0	0	0	0	111.6	S181 V182	S181-G203 WeakPolarHBondContact CA-O 2.92Å; V182-G203 WeakPolarHBondContact CG1-O 3.48Å; V182-G203 PolarHBondContact N-O 2.95Å
204	G	96.9	Very high	93.8	Very high	19 Å²	19	53.1 Å²	53.1	20%	0.196	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.8	172.6	-178.8	0	0	0	0	0	114.2	Y179 V180 C242	Y179-G204 VanDerWaalsContact OH-C 3.23Å; Y179-G204 PolarHBondContact OH-O 3.25Å; V180-G204 CarbonylContact O-C 3.53Å; V180-G204 WeakPolarHBondContact O-CA 3.05Å; G204-C242 CarbonylContact C-O 3.54Å
205	C	96.9	Very high	94.1	Very high	21 Å²	21	51.9 Å²	51.9	14%	0.142	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	158.2	-179.8	74.1	0	0	0	0	112.1	Y179 V180 C242	Y179-C205 WeakPolarHBondContact CD2-O 3.28Å; Y179-C205 VanDerWaalsContact CE2-C 3.44Å; V180-C205 PolarHBondContact N-O 3.22Å; V180-C205 PolarHBondContact O-N 3.17Å; C205-C242 HydrophobicContact CB-CB 3.88Å; C205-C242 WeakPolarHBondContact CB-SG 3.43Å; C205-C242 PolarHBondContact N-SG 3.04Å; C205-C242 VanDerWaalsContact N-SG 3.38Å; C205-C242 WeakPolarHBondContact SG-CA 3.5Å; C205-C242 WeakPolarHBondContact SG-CB 3.39Å; C205-C242 CovalentContact SG-SG 2.03Å; C205-C242 PolarHBondContact SG-SG 2.75Å
206	T	96.4	Very high	94.4	Very high	46 Å²	46	45.1 Å²	45.1	28%	0.282	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	132.7	169	-65.4	0	0	0	0	110.5	T176 M208 R240	T176-T206 HydrophobicContact CG2-CG2 3.86Å; T176-T206 WeakPolarHBondContact O-CB 3.46Å; T176-T206 VanDerWaalsContact O-CG2 3.28Å; T176-T206 WeakPolarHBondContact O-CG2 3.35Å; T176-T206 PolarHBondContact O-OG1 2.85Å; T206-M208 HydrophobicContact CG2-CE 4.01Å; T206-R240 PolarHBondContact O-NH1 2.79Å
207	A	95.3	Very high	94.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.008	25%	0.246	C	C	.	.			trans	-143.4	124.4	175.9	0	0	0	0	0	110.9	P178 V180 T209 V231 V233	P178-A207 WeakPolarHBondContact CB-O 3.41Å; P178-A207 PolarHBondContact O-N 2.69Å; V180-A207 HydrophobicContact CG2-CB 3.9Å; A207-T209 HydrophobicContact CB-CG2 3.99Å; A207-T209 PolarHBondContact O-N 2.84Å; A207-V231 HydrophobicContact CB-CG2 4.27Å; A207-V233 HydrophobicContact CB-CG1 4.41Å; A207-V233 HydrophobicContact CB-CG2 4.29Å
208	M	93.8	Very high	94.9	Very high	105 Å²	105	47.3 Å²	47.3	52%	0.517	25%	0.245	S	C	.	.			trans	-78.8	71.3	-177.6	-62.8	-62	171	0	0	111.4	T176 T206	T176-M208 HydrophobicContact CG2-CE 3.81Å; T206-M208 HydrophobicContact CG2-CE 4.01Å
209	T	94.7	Very high	95.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.			trans	-84.9	-28.8	-172.8	53.9	0	0	0	0	113.7	F120 V163 A207 V233	F120-T209 HydrophobicContact CE2-CG2 4.05Å; F120-T209 HydrophobicContact CZ-CG2 3.66Å; V163-T209 HydrophobicContact CG1-CG2 4.03Å; A207-T209 HydrophobicContact CB-CG2 3.99Å; A207-T209 PolarHBondContact O-N 2.84Å; T209-V233 HydrophobicContact CG2-CG1 3.74Å
210	R	94.8	Very high	95.6	Very high	42 Å²	42	38.9 Å²	38.9	16%	0.158	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-76.4	133.6	-175.2	-174.4	-178.2	-177.4	-102.6	-8.4	111.8	I122 G126 P178 S212 D267	I122-R210 HydrophobicContact CG2-CG 4.38Å; I122-R210 WeakPolarHBondContact O-CA 3.26Å; G126-R210 PolarHBondContact O-NH1 2.81Å; G126-R210 PolarHBondContact O-NH2 2.81Å; G126-R210 VanDerWaalsContact O-NH2 3.11Å; P178-R210 HydrophobicContact CG-CB 4.1Å; R210-S212 PolarHBondContact O-N 2.9Å; R210-S212 VanDerWaalsContact O-N 3.09Å; R210-D267 WeakPolarHBondContact CD-OD2 3.4Å; R210-D267 IonicContact CZ-OD1 3.72Å; R210-D267 IonicContact CZ-OD2 3.78Å; R210-D267 IonicContact NE-OD1 3.99Å; R210-D267 PolarHBondContact NE-OD1 3.31Å; R210-D267 IonicContact NE-OD2 2.79Å; R210-D267 PolarHBondContact NE-OD2 2.7Å; R210-D267 IonicContact NH2-OD1 3.22Å; R210-D267 PolarHBondContact NH2-OD1 2.84Å; R210-D267 IonicContact NH2-OD2 2.63Å
211	N	94.1	Very high	95.8	Very high	72 Å²	72	42.1 Å²	42.1	39%	0.385	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	28.5	179.4	-73.6	-32.9	0	0	0	112.9	I122 H123 G124 I213	I122-N211 PolarHBondContact O-N 3.48Å; H123-N211 WeakPolarHBondContact CA-OD1 3.38Å; H123-N211 VanDerWaalsContact CB-OD1 3.28Å; H123-N211 WeakPolarHBondContact CB-OD1 3.33Å; G124-N211 PolarHBondContact N-OD1 2.84Å; G124-N211 VanDerWaalsContact N-OD1 3.09Å; G124-N211 PolarHBondContact O-ND2 3.11Å; N211-I213 PolarHBondContact O-N 2.81Å
212	S	92.8	Very high	96	Very high	19 Å²	19	40.6 Å²	40.6	13%	0.133	21%	0.208	C	C	.	.			trans	-63.9	136.3	174.7	-171.9	0	0	0	0	110.1	R210 Y214 V233	R210-S212 PolarHBondContact O-N 2.9Å; R210-S212 VanDerWaalsContact O-N 3.09Å; S212-Y214 PolarHBondContact OG-N 3.01Å; S212-Y214 PolarHBondContact OG-O 3.38Å; S212-V233 PolarHBondContact OG-O 2.7Å
213	I	92.6	Very high	95.9	Very high	140 Å²	140	40.1 Å²	40.1	72%	0.718	21%	0.207	S	C	*	.	S	Bend	trans	-76.3	-17.5	171.9	61.8	172.4	0	0	0	111.6	N211	N211-I213 PolarHBondContact O-N 2.81Å
214	Y	94.2	Very high	95.7	Very high	112 Å²	112	44.4 Å²	44.4	44%	0.439	22%	0.221	S	C	.	.	S	Bend	trans	-94.9	163.4	177.4	-51.7	-64.1	0	0	0	110.6	S212 D234	S212-Y214 PolarHBondContact OG-N 3.01Å; S212-Y214 PolarHBondContact OG-O 3.38Å; Y214-D234 WeakPolarHBondContact CE2-O 3.48Å
215	D	95	Very high	95.6	Very high	91 Å²	91	45 Å²	45	49%	0.487	22%	0.22	S	C	.	.			trans	-68.4	137.3	168.5	-72.1	-14.8	0	0	0	109.1	H119 F217	H119-D215 IonicContact CE1-OD1 3.14Å; H119-D215 IonicContact CE1-OD2 2.71Å; H119-D215 IonicContact NE2-OD1 3.13Å; H119-D215 IonicContact NE2-OD2 2.7Å; D215-F217 HydrophobicContact CB-CD2 4.34Å; D215-F217 HydrophobicContact CB-CE2 3.41Å; D215-F217 VanDerWaalsContact CB-CE2 3.41Å; D215-F217 HydrophobicContact CB-CZ 3.65Å
216	T	97.3	Very high	95.6	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.9	-177.9	48.6	0	0	0	0	111	H119 F120 D232 V233	H119-T216 PolarHBondContact CD2-O 2.84Å; F120-T216 WeakPolarHBondContact CD1-O 2.88Å; F120-T216 PolarHBondContact N-O 3.38Å; F120-T216 VanDerWaalsContact N-O 3.1Å; F120-T216 PolarHBondContact O-OG1 3.15Å; T216-D232 WeakPolarHBondContact CA-O 3.45Å; T216-V233 HydrophobicContact CG2-CB 4.13Å; T216-V233 HydrophobicContact CG2-CG1 4.02Å
217	F	97.8	Very high	95.7	Very high	52 Å²	52	45.5 Å²	45.5	23%	0.228	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.7	-176.7	-55.5	-88.3	0	0	0	112.8	V118 H119 D215 V231 D232 W239	V118-F217 CarbonylContact O-C 3.24Å; V118-F217 WeakPolarHBondContact O-CA 3.49Å; H119-F217 HydrophobicContact CB-CD1 3.68Å; H119-F217 HydrophobicContact CB-CE1 3.54Å; H119-F217 AromaticContact CD2-CE1 3.81Å; H119-F217 AromaticContact CG-CD1 3.91Å; H119-F217 AromaticContact CG-CE1 3.39Å; H119-F217 AromaticContact ND1-CE1 3.69Å; D215-F217 HydrophobicContact CB-CD2 4.34Å; D215-F217 HydrophobicContact CB-CE2 3.41Å; D215-F217 VanDerWaalsContact CB-CE2 3.41Å; D215-F217 HydrophobicContact CB-CZ 3.65Å; F217-V231 WeakPolarHBondContact O-CA 3.33Å; F217-D232 HydrophobicContact CB-CB 4.34Å; F217-D232 HydrophobicContact CD2-CB 4.37Å; F217-D232 PolarHBondContact N-O 2.75Å; F217-D232 PolarHBondContact O-N 2.03Å; F217-W239 HydrophobicContact CB-CH2 3.54Å; F217-W239 HydrophobicContact CB-CZ3 3.7Å; F217-W239 HydrophobicContact CG-CH2 4.34Å
218	L	98.1	Very high	95.8	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	140.5	160.3	-59.6	177.2	0	0	0	108.7	R117 V118 F120 I137 I161 V163 V180 V231	R117-L218 CarbonylContact C-O 3.52Å; R117-L218 WeakPolarHBondContact CA-O 3.4Å; V118-L218 HydrophobicContact CB-CB 4.27Å; V118-L218 PolarHBondContact N-O 2.75Å; V118-L218 PolarHBondContact O-N 3.06Å; F120-L218 HydrophobicContact CD1-CG 4.24Å; F120-L218 HydrophobicContact CE1-CD1 4.27Å; F120-L218 HydrophobicContact CE1-CD2 4.13Å; F120-L218 HydrophobicContact CE1-CG 3.61Å; F120-L218 HydrophobicContact CZ-CD2 4.43Å; F120-L218 HydrophobicContact CZ-CG 4.27Å; I137-L218 HydrophobicContact CG1-CD1 4.35Å; I161-L218 HydrophobicContact CG2-CD1 4.32Å; V163-L218 HydrophobicContact CG2-CD1 3.74Å; V163-L218 HydrophobicContact CG2-CD2 4.48Å; V180-L218 HydrophobicContact CG1-CD2 4.22Å; V180-L218 HydrophobicContact CG2-CD2 4.42Å; L218-V231 HydrophobicContact CD2-CB 4.44Å; L218-V231 HydrophobicContact CD2-CG1 3.59Å
219	L	98.1	Very high	96	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.8	167.5	-175.8	161.5	0	0	0	108.5	E115 L116 R117 R221 L229 M230 W239	E115-L219 HydrophobicContact CG-CD1 4.21Å; E115-L219 HydrophobicContact CG-CD2 3.72Å; E115-L219 HydrophobicContact CG-CG 3.77Å; E115-L219 WeakPolarHBondContact OE1-CD1 3.42Å; L116-L219 WeakPolarHBondContact O-CA 3.31Å; R117-L219 HydrophobicContact CG-CD1 4.32Å; R117-L219 HydrophobicContact CG-CG 4.31Å; L219-R221 HydrophobicContact CD2-CB 3.97Å; L219-L229 WeakPolarHBondContact O-CA 3.35Å; L219-M230 HydrophobicContact CB-CB 4.35Å; L219-M230 HydrophobicContact CB-CE 4.44Å; L219-M230 HydrophobicContact CD1-CE 3.89Å; L219-M230 HydrophobicContact CD2-CE 3.21Å; L219-M230 HydrophobicContact CG-CE 4.01Å; L219-M230 PolarHBondContact N-O 2.79Å; L219-M230 PolarHBondContact O-N 2.85Å; L219-W239 HydrophobicContact CB-CD2 4.13Å; L219-W239 HydrophobicContact CB-CE3 3.74Å; L219-W239 HydrophobicContact CB-CH2 3.62Å; L219-W239 HydrophobicContact CB-CZ2 4.01Å; L219-W239 HydrophobicContact CB-CZ3 3.48Å; L219-W239 VanDerWaalsContact CB-CZ3 3.48Å; L219-W239 HydrophobicContact CD1-CD2 3.94Å; L219-W239 HydrophobicContact CD1-CE3 4.41Å; L219-W239 HydrophobicContact CD1-CG 4.45Å; L219-W239 HydrophobicContact CD1-CH2 4.16Å; L219-W239 HydrophobicContact CD1-CZ2 3.65Å; L219-W239 HydrophobicContact CG-CZ2 4.46Å
220	V	98.5	Very high	96.2	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	114.5	178.6	-170.3	0	0	0	0	107	W114 E115 L116 I161 L227 L229	W114-V220 HydrophobicContact CH2-CG1 3.94Å; W114-V220 HydrophobicContact CZ3-CB 4.14Å; W114-V220 HydrophobicContact CZ3-CG1 3.94Å; E115-V220 CarbonylContact C-O 3.55Å; E115-V220 WeakPolarHBondContact CA-O 3.45Å; L116-V220 HydrophobicContact CB-CB 4.24Å; L116-V220 HydrophobicContact CD2-CG2 4.48Å; L116-V220 PolarHBondContact N-O 2.88Å; L116-V220 PolarHBondContact O-N 3.48Å; I161-V220 HydrophobicContact CD1-CB 4.08Å; I161-V220 HydrophobicContact CD1-CG1 3.54Å; I161-V220 HydrophobicContact CD1-CG2 3.38Å; V220-L227 HydrophobicContact CG1-CD1 3.69Å; V220-L229 HydrophobicContact CG2-CD1 3.92Å
221	R	98.1	Very high	96.4	Very high	76 Å²	76	40.5 Å²	40.5	29%	0.287	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.6	178.4	-176.3	179.7	-65.9	177.3	-1.5	109	E115 L219 L227 T228 L279	E115-R221 HydrophobicContact CG-CB 4.48Å; E115-R221 IonicContact OE2-CZ 2.97Å; E115-R221 VanDerWaalsContact OE2-CZ 3.23Å; E115-R221 IonicContact OE2-NE 2.69Å; E115-R221 PolarHBondContact OE2-NE 2.83Å; E115-R221 IonicContact OE2-NH2 3.88Å; E115-R221 PolarHBondContact OE2-NH2 3.44Å; L219-R221 HydrophobicContact CD2-CB 3.97Å; R221-L227 CarbonylContact O-C 3.53Å; R221-L227 VanDerWaalsContact O-CA 3.31Å; R221-L227 WeakPolarHBondContact O-CA 3.38Å; R221-T228 PolarHBondContact N-O 3.43Å; R221-T228 PolarHBondContact O-N 3.42Å; R221-L279 HydrophobicContact CG-CD1 3.92Å
222	Y	97.4	Very high	96.5	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.016	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	119	171.2	180	-105.4	0	0	0	108.7	R112 D113 W114 N225 K226 L227 L248 L250	R112-Y222 WeakPolarHBondContact O-CD1 3.21Å; R112-Y222 WeakPolarHBondContact O-CE1 3.22Å; D113-Y222 VanDerWaalsContact CA-O 3.31Å; D113-Y222 WeakPolarHBondContact CA-O 3.39Å; W114-Y222 HydrophobicContact CZ2-CG 4.35Å; W114-Y222 PolarHBondContact N-O 3.11Å; W114-Y222 AromaticContact NE1-CD1 3.6Å; W114-Y222 PolarHBondContact O-N 2.66Å; Y222-N225 PolarHBondContact OH-OD1 2.81Å; Y222-K226 WeakPolarHBondContact CA-O 3.37Å; Y222-L227 HydrophobicContact CD2-CB 4.38Å; Y222-L227 HydrophobicContact CD2-CD1 4.29Å; Y222-L248 HydrophobicContact CD2-CD2 4.03Å; Y222-L248 HydrophobicContact CE2-CB 4.38Å; Y222-L248 HydrophobicContact CE2-CD2 3.46Å; Y222-L248 VanDerWaalsContact CE2-CD2 3.46Å; Y222-L248 WeakPolarHBondContact CE2-O 3.23Å; Y222-L248 PolarHBondContact OH-O 3.06Å; Y222-L250 PolarHBondContact OH-N 2.91Å
223	S	95.1	Very high	96.5	Very high	21 Å²	21	36.9 Å²	36.9	15%	0.147	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	138.9	-179.7	176.2	0	0	0	0	109.5	D113 N225 K226	D113-S223 WeakPolarHBondContact OD1-CA 3.33Å; D113-S223 PolarHBondContact OD1-OG 3.31Å; S223-N225 VanDerWaalsContact C-N 3.32Å; S223-N225 PolarHBondContact O-N 3.34Å; S223-K226 PolarHBondContact N-O 3.11Å; S223-K226 WeakPolarHBondContact O-CA 3.46Å; S223-K226 WeakPolarHBondContact O-CB 3.39Å; S223-K226 PolarHBondContact O-N 3.48Å
224	K	92.3	Very high	96.4	Very high	108 Å²	108	33.4 Å²	33.4	47%	0.47	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.7	50.1	180	-58.8	-166.9	175.7	-164.9	0	113.9	D113 K226 V281 E282	D113-K224 PolarHBondContact OD1-N 3.21Å; K224-K226 PolarHBondContact O-N 3.04Å; K224-K226 VanDerWaalsContact O-N 3.11Å; K224-V281 HydrophobicContact CD-CG1 4.12Å; K224-V281 HydrophobicContact CG-CG1 3.86Å; K224-E282 PolarHBondContact NZ-O 2.75Å
225	N	93.9	Very high	96	Very high	32 Å²	32	29.7 Å²	29.7	17%	0.171	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	22.5	-178.5	-53.2	-39.2	0	0	0	114.6	Y222 S223 G247 L248 R249	Y222-N225 PolarHBondContact OH-OD1 2.81Å; S223-N225 VanDerWaalsContact C-N 3.32Å; S223-N225 PolarHBondContact O-N 3.34Å; N225-G247 CarbonylContact O-C 3.57Å; N225-G247 PolarHBondContact O-N 3.03Å; N225-L248 CarbonylContact C-O 3.22Å; N225-L248 VanDerWaalsContact CA-O 3.25Å; N225-L248 WeakPolarHBondContact CA-O 3.2Å; N225-L248 WeakPolarHBondContact CB-O 3.35Å; N225-L248 PolarHBondContact O-N 3.07Å; N225-R249 PolarHBondContact ND2-NH1 2.71Å
226	K	96.6	Very high	95.7	Very high	75 Å²	75	31.8 Å²	31.8	33%	0.326	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.4	177.1	-177	179.8	175.7	174.6	0	109.5	Y222 S223 K224 E244 V245	Y222-K226 WeakPolarHBondContact CA-O 3.37Å; S223-K226 PolarHBondContact N-O 3.11Å; S223-K226 WeakPolarHBondContact O-CA 3.46Å; S223-K226 WeakPolarHBondContact O-CB 3.39Å; S223-K226 PolarHBondContact O-N 3.48Å; K224-K226 PolarHBondContact O-N 3.04Å; K224-K226 VanDerWaalsContact O-N 3.11Å; K226-E244 VanDerWaalsContact CE-CG 3.4Å; K226-E244 WeakPolarHBondContact CE-OE1 3.31Å; K226-E244 WeakPolarHBondContact CE-OE2 3.42Å; K226-E244 IonicContact NZ-OE1 3.41Å; K226-E244 PolarHBondContact NZ-OE1 2.86Å; K226-E244 IonicContact NZ-OE2 3.34Å; K226-E244 PolarHBondContact NZ-OE2 3.38Å; K226-V245 WeakPolarHBondContact CA-O 3.35Å
227	L	98.3	Very high	95.2	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.6	173.6	-172.8	78.6	0	0	0	109.7	L159 V182 V220 R221 Y222 E244 V245 L248	L159-L227 HydrophobicContact CD1-CD2 3.84Å; L159-L227 HydrophobicContact CD2-CD1 4.03Å; L159-L227 HydrophobicContact CD2-CD2 4.22Å; V182-L227 HydrophobicContact CG2-CD2 3.74Å; V220-L227 HydrophobicContact CG1-CD1 3.69Å; R221-L227 CarbonylContact O-C 3.53Å; R221-L227 VanDerWaalsContact O-CA 3.31Å; R221-L227 WeakPolarHBondContact O-CA 3.38Å; Y222-L227 HydrophobicContact CD2-CB 4.38Å; Y222-L227 HydrophobicContact CD2-CD1 4.29Å; L227-E244 CarbonylContact O-C 2.97Å; L227-E244 WeakPolarHBondContact O-CA 3.39Å; L227-V245 HydrophobicContact CB-CB 4.32Å; L227-V245 PolarHBondContact N-O 2.73Å; L227-V245 PolarHBondContact O-N 3.27Å; L227-L248 HydrophobicContact CB-CD1 4.09Å; L227-L248 HydrophobicContact CD2-CD1 4.04Å
228	T	98.4	Very high	94.9	Very high	22 Å²	22	43.9 Å²	43.9	14%	0.135	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.2	172.4	-57.6	0	0	0	0	109	R221 M230	R221-T228 PolarHBondContact N-O 3.43Å; R221-T228 PolarHBondContact O-N 3.42Å; T228-M230 HydrophobicContact CG2-CG 4.08Å; T228-M230 HydrophobicContact CG2-SD 4.47Å
229	L	98.6	Very high	94.8	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.1	176.9	179.4	61.6	0	0	0	109.1	I161 V180 L219 V220 C242 A243	I161-L229 HydrophobicContact CD1-CD1 4.44Å; I161-L229 HydrophobicContact CG2-CD1 4.15Å; I161-L229 HydrophobicContact CG2-CD2 4.08Å; V180-L229 HydrophobicContact CG1-CD2 3.76Å; L219-L229 WeakPolarHBondContact O-CA 3.35Å; V220-L229 HydrophobicContact CG2-CD1 3.92Å; L229-C242 HydrophobicContact CB-CB 4.45Å; L229-C242 HydrophobicContact CD2-CB 4.43Å; L229-C242 HydrophobicContact CG-CB 4.06Å; L229-C242 WeakPolarHBondContact O-CA 3.19Å; L229-C242 WeakPolarHBondContact O-CB 3.23Å; L229-C242 PolarHBondContact O-N 2.87Å; L229-A243 HydrophobicContact CB-CB 4.09Å; L229-A243 HydrophobicContact CD2-CB 4.28Å; L229-A243 PolarHBondContact N-O 3.03Å; L229-A243 PolarHBondContact O-N 2.62Å; L229-A243 VanDerWaalsContact O-N 3.15Å
230	M	98.4	Very high	94.7	Very high	19 Å²	19	52.6 Å²	52.6	9%	0.094	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	155.5	178.3	-61.7	-179.4	-74.7	0	0	110.9	L219 T228 W239 R240	L219-M230 HydrophobicContact CB-CB 4.35Å; L219-M230 HydrophobicContact CB-CE 4.44Å; L219-M230 HydrophobicContact CD1-CE 3.89Å; L219-M230 HydrophobicContact CD2-CE 3.21Å; L219-M230 HydrophobicContact CG-CE 4.01Å; L219-M230 PolarHBondContact N-O 2.79Å; L219-M230 PolarHBondContact O-N 2.85Å; T228-M230 HydrophobicContact CG2-CG 4.08Å; T228-M230 HydrophobicContact CG2-SD 4.47Å; M230-W239 HydrophobicContact CB-CB 4.13Å; M230-W239 HydrophobicContact CB-CE3 4.12Å; M230-W239 HydrophobicContact SD-CB 3.85Å; M230-W239 HydrophobicContact SD-CG 4.49Å; M230-R240 CarbonylContact C-O 3.59Å; M230-R240 WeakPolarHBondContact CA-O 3.41Å; M230-R240 WeakPolarHBondContact CB-O 3.29Å
231	V	98	Very high	94.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144.5	-179.5	-55.1	0	0	0	0	111.2	V180 A207 F217 L218 V233 R240 C242	V180-V231 HydrophobicContact CG2-CG1 4.38Å; A207-V231 HydrophobicContact CB-CG2 4.27Å; F217-V231 WeakPolarHBondContact O-CA 3.33Å; L218-V231 HydrophobicContact CD2-CB 4.44Å; L218-V231 HydrophobicContact CD2-CG1 3.59Å; V231-V233 HydrophobicContact CB-CG1 4.41Å; V231-R240 HydrophobicContact CG2-CB 4.18Å; V231-R240 PolarHBondContact N-O 2.92Å; V231-R240 PolarHBondContact O-N 2.91Å; V231-C242 HydrophobicContact CG1-CB 4.08Å
232	D	96.4	Very high	94.6	Very high	12 Å²	12	55.7 Å²	55.7	6%	0.064	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	108.2	165.2	176.9	16.9	0	0	0	108.2	T216 F217 Q237 W239	T216-D232 WeakPolarHBondContact CA-O 3.45Å; F217-D232 HydrophobicContact CB-CB 4.34Å; F217-D232 HydrophobicContact CD2-CB 4.37Å; F217-D232 PolarHBondContact N-O 2.75Å; F217-D232 PolarHBondContact O-N 2.03Å; D232-Q237 VanDerWaalsContact OD2-CA 3.29Å; D232-Q237 WeakPolarHBondContact OD2-CA 3.49Å; D232-W239 HydrophobicContact CB-CE3 3.97Å; D232-W239 HydrophobicContact CB-CZ3 4.01Å
233	V	94.3	Very high	94.7	Very high	3 Å²	3	56 Å²	56	2%	0.018	27%	0.274	C	S	.	.			trans	-134.5	-6.7	-173.9	-57.9	0	0	0	0	112.9	A207 T209 S212 T216 V231	A207-V233 HydrophobicContact CB-CG1 4.41Å; A207-V233 HydrophobicContact CB-CG2 4.29Å; T209-V233 HydrophobicContact CG2-CG1 3.74Å; S212-V233 PolarHBondContact OG-O 2.7Å; T216-V233 HydrophobicContact CG2-CB 4.13Å; T216-V233 HydrophobicContact CG2-CG1 4.02Å; V231-V233 HydrophobicContact CB-CG1 4.41Å
234	D	90.2	Very high	94.8	Very high	66 Å²	66	60.5 Å²	60.5	35%	0.353	29%	0.292	S	S	.	.	S	Bend	trans	-97.6	0.3	-174.1	-58.5	-30.2	0	0	0	112.2	Y214 K236 R240	Y214-D234 WeakPolarHBondContact CE2-O 3.48Å; D234-K236 HydrophobicContact CB-CD 4.39Å; D234-K236 HydrophobicContact CB-CG 4.22Å; D234-K236 PolarHBondContact O-N 2.76Å; D234-R240 IonicContact OD1-NH2 2.66Å; D234-R240 PolarHBondContact OD1-NH2 3.05Å; D234-R240 IonicContact OD2-CZ 2.75Å; D234-R240 IonicContact OD2-NE 3.6Å; D234-R240 IonicContact OD2-NH2 2.88Å; D234-R240 PolarHBondContact OD2-NH2 2.83Å
235	G	85.5	Confident	95	Very high	34 Å²	34	55.9 Å²	55.9	35%	0.351	27%	0.273	S	S	.	.	S	Bend	trans	70.9	15.6	-179	0	0	0	0	0	114.3
236	K	88.6	Confident	95.1	Very high	136 Å²	136	57.9 Å²	57.9	59%	0.591	29%	0.29	S	S	*	.	S	Bend	trans	-84.5	-12.3	179.3	-67.1	-178.5	-179.2	175.9	0	113.2	D234 E238	D234-K236 HydrophobicContact CB-CD 4.39Å; D234-K236 HydrophobicContact CB-CG 4.22Å; D234-K236 PolarHBondContact O-N 2.76Å; K236-E238 HydrophobicContact CB-CB 4.17Å; K236-E238 HydrophobicContact CB-CG 4.28Å; K236-E238 PolarHBondContact O-N 2.66Å
237	Q	86.8	Confident	95	Very high	175 Å²	175	55.3 Å²	55.3	82%	0.818	28%	0.284	S	S	*	.	S	Bend	trans	59	32.1	-171	-54.2	177.4	33.4	0	0	111.7	D232	D232-Q237 VanDerWaalsContact OD2-CA 3.29Å; D232-Q237 WeakPolarHBondContact OD2-CA 3.49Å
238	E	92.3	Very high	94.9	Very high	132 Å²	132	55.2 Å²	55.2	62%	0.617	28%	0.284	S	S	*	.			trans	-123.1	127.7	-180	-72.4	179	168.6	0	0	108.7	K236	K236-E238 HydrophobicContact CB-CB 4.17Å; K236-E238 HydrophobicContact CB-CG 4.28Å; K236-E238 PolarHBondContact O-N 2.66Å
239	W	95.3	Very high	94.7	Very high	97 Å²	97	55.8 Å²	55.8	37%	0.367	28%	0.283	S	S	.	.			trans	-74.7	130	175.8	-64.8	110.1	0	0	0	110.5	F217 L219 M230 D232	F217-W239 HydrophobicContact CB-CH2 3.54Å; F217-W239 HydrophobicContact CB-CZ3 3.7Å; F217-W239 HydrophobicContact CG-CH2 4.34Å; L219-W239 HydrophobicContact CB-CD2 4.13Å; L219-W239 HydrophobicContact CB-CE3 3.74Å; L219-W239 HydrophobicContact CB-CH2 3.62Å; L219-W239 HydrophobicContact CB-CZ2 4.01Å; L219-W239 HydrophobicContact CB-CZ3 3.48Å; L219-W239 VanDerWaalsContact CB-CZ3 3.48Å; L219-W239 HydrophobicContact CD1-CD2 3.94Å; L219-W239 HydrophobicContact CD1-CE3 4.41Å; L219-W239 HydrophobicContact CD1-CG 4.45Å; L219-W239 HydrophobicContact CD1-CH2 4.16Å; L219-W239 HydrophobicContact CD1-CZ2 3.65Å; L219-W239 HydrophobicContact CG-CZ2 4.46Å; M230-W239 HydrophobicContact CB-CB 4.13Å; M230-W239 HydrophobicContact CB-CE3 4.12Å; M230-W239 HydrophobicContact SD-CB 3.85Å; M230-W239 HydrophobicContact SD-CG 4.49Å; D232-W239 HydrophobicContact CB-CE3 3.97Å; D232-W239 HydrophobicContact CB-CZ3 4.01Å
240	R	96.6	Very high	94.4	Very high	87 Å²	87	56.1 Å²	56.1	33%	0.328	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.9	173	-162.7	-160.1	-41.5	136.6	2.8	109.7	T206 M230 V231 D234	T206-R240 PolarHBondContact O-NH1 2.79Å; M230-R240 CarbonylContact C-O 3.59Å; M230-R240 WeakPolarHBondContact CA-O 3.41Å; M230-R240 WeakPolarHBondContact CB-O 3.29Å; V231-R240 HydrophobicContact CG2-CB 4.18Å; V231-R240 PolarHBondContact N-O 2.92Å; V231-R240 PolarHBondContact O-N 2.91Å; D234-R240 IonicContact OD1-NH2 2.66Å; D234-R240 PolarHBondContact OD1-NH2 3.05Å; D234-R240 IonicContact OD2-CZ 2.75Å; D234-R240 IonicContact OD2-NE 3.6Å; D234-R240 IonicContact OD2-NH2 2.88Å; D234-R240 PolarHBondContact OD2-NH2 2.83Å
241	D	97.3	Very high	94.1	Very high	127 Å²	127	55.8 Å²	55.8	68%	0.679	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	138	175	-63.6	-30	0	0	0	111.4
242	C	97.4	Very high	93.9	Very high	15 Å²	15	59.6 Å²	59.6	10%	0.101	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	-52.5	-178.3	-167.8	0	0	0	0	112.3	G204 C205 L229 V231	G204-C242 CarbonylContact C-O 3.54Å; C205-C242 HydrophobicContact CB-CB 3.88Å; C205-C242 WeakPolarHBondContact CB-SG 3.43Å; C205-C242 PolarHBondContact N-SG 3.04Å; C205-C242 VanDerWaalsContact N-SG 3.38Å; C205-C242 WeakPolarHBondContact SG-CA 3.5Å; C205-C242 WeakPolarHBondContact SG-CB 3.39Å; C205-C242 CovalentContact SG-SG 2.03Å; C205-C242 PolarHBondContact SG-SG 2.75Å; L229-C242 HydrophobicContact CB-CB 4.45Å; L229-C242 HydrophobicContact CD2-CB 4.43Å; L229-C242 HydrophobicContact CG-CB 4.06Å; L229-C242 WeakPolarHBondContact O-CA 3.19Å; L229-C242 WeakPolarHBondContact O-CB 3.23Å; L229-C242 PolarHBondContact O-N 2.87Å; V231-C242 HydrophobicContact CG1-CB 4.08Å
243	A	97.9	Very high	93.8	Very high	12 Å²	12	60.3 Å²	60.3	10%	0.099	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	149.4	175.8	0	0	0	0	0	110.8	V182 L229	V182-A243 HydrophobicContact CG1-CB 3.95Å; L229-A243 HydrophobicContact CB-CB 4.09Å; L229-A243 HydrophobicContact CD2-CB 4.28Å; L229-A243 PolarHBondContact N-O 3.03Å; L229-A243 PolarHBondContact O-N 2.62Å; L229-A243 VanDerWaalsContact O-N 3.15Å
244	E	97.6	Very high	93.9	Very high	114 Å²	114	60.9 Å²	60.9	53%	0.533	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	126.5	174.5	-178.2	171.5	118.5	0	0	109	K226 L227	K226-E244 VanDerWaalsContact CE-CG 3.4Å; K226-E244 WeakPolarHBondContact CE-OE1 3.31Å; K226-E244 WeakPolarHBondContact CE-OE2 3.42Å; K226-E244 IonicContact NZ-OE1 3.41Å; K226-E244 PolarHBondContact NZ-OE1 2.86Å; K226-E244 IonicContact NZ-OE2 3.34Å; K226-E244 PolarHBondContact NZ-OE2 3.38Å; L227-E244 CarbonylContact O-C 2.97Å; L227-E244 WeakPolarHBondContact O-CA 3.39Å
245	V	97.2	Very high	94.3	Very high	11 Å²	11	60.4 Å²	60.4	7%	0.067	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	112.6	-179.5	-171.4	0	0	0	0	108.4	V182 L202 K226 L227 L248 V299	V182-V245 HydrophobicContact CG1-CG2 4.3Å; L202-V245 HydrophobicContact CB-CG2 3.8Å; L202-V245 HydrophobicContact CD1-CG1 4.3Å; L202-V245 HydrophobicContact CD1-CG2 4.46Å; K226-V245 WeakPolarHBondContact CA-O 3.35Å; L227-V245 HydrophobicContact CB-CB 4.32Å; L227-V245 PolarHBondContact N-O 2.73Å; L227-V245 PolarHBondContact O-N 3.27Å; V245-L248 HydrophobicContact CB-CD1 4.38Å; V245-L248 HydrophobicContact CG1-CB 4.26Å; V245-L248 HydrophobicContact CG1-CD1 4.14Å; V245-V299 HydrophobicContact CG1-CG1 3.93Å; V245-V299 HydrophobicContact CG1-CG2 4.08Å
246	S	96.1	Very high	94.9	Very high	74 Å²	74	59 Å²	59	52%	0.517	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	152.7	175.1	-62.6	0	0	0	0	110.7	L248	S246-L248 VanDerWaalsContact C-N 3.27Å; S246-L248 PolarHBondContact O-N 3.35Å
247	G	94.6	Very high	95.4	Very high	21 Å²	21	52.5 Å²	52.5	22%	0.216	27%	0.27	C	S	.	.	S	Bend	trans	72.4	19.2	-179.2	0	0	0	0	0	113.6	N225 R249 V299 D300	N225-G247 CarbonylContact O-C 3.57Å; N225-G247 PolarHBondContact O-N 3.03Å; G247-R249 PolarHBondContact O-N 3.46Å; G247-V299 CarbonylContact O-C 3.41Å; G247-V299 WeakPolarHBondContact O-CA 3.41Å; G247-D300 PolarHBondContact O-N 3Å
248	L	95.1	Very high	95.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117.9	176.2	-171.1	149	0	0	0	108.9	L184 L202 Y222 N225 L227 V245 S246 L250 V299	L184-L248 HydrophobicContact CD1-CD1 4.41Å; L184-L248 HydrophobicContact CD2-CD1 4.46Å; L184-L248 HydrophobicContact CD2-CG 4.26Å; L202-L248 HydrophobicContact CD1-CD1 4.43Å; Y222-L248 HydrophobicContact CD2-CD2 4.03Å; Y222-L248 HydrophobicContact CE2-CB 4.38Å; Y222-L248 HydrophobicContact CE2-CD2 3.46Å; Y222-L248 VanDerWaalsContact CE2-CD2 3.46Å; Y222-L248 WeakPolarHBondContact CE2-O 3.23Å; Y222-L248 PolarHBondContact OH-O 3.06Å; N225-L248 CarbonylContact C-O 3.22Å; N225-L248 VanDerWaalsContact CA-O 3.25Å; N225-L248 WeakPolarHBondContact CA-O 3.2Å; N225-L248 WeakPolarHBondContact CB-O 3.35Å; N225-L248 PolarHBondContact O-N 3.07Å; L227-L248 HydrophobicContact CB-CD1 4.09Å; L227-L248 HydrophobicContact CD2-CD1 4.04Å; V245-L248 HydrophobicContact CB-CD1 4.38Å; V245-L248 HydrophobicContact CG1-CB 4.26Å; V245-L248 HydrophobicContact CG1-CD1 4.14Å; S246-L248 VanDerWaalsContact C-N 3.27Å; S246-L248 PolarHBondContact O-N 3.35Å; L248-L250 HydrophobicContact CD2-CB 3.82Å; L248-V299 HydrophobicContact CB-CG2 4.49Å; L248-V299 HydrophobicContact CD1-CG2 4.44Å; L248-V299 HydrophobicContact CG-CG2 4.38Å
249	R	94.2	Very high	96.3	Very high	34 Å²	34	37.9 Å²	37.9	13%	0.128	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	112.6	176.7	-63	-74.1	-171.9	154.4	2.6	108.3	N225 G247 E290 I294 P297 R298 D300	N225-R249 PolarHBondContact ND2-NH1 2.71Å; G247-R249 PolarHBondContact O-N 3.46Å; R249-E290 IonicContact CZ-OE2 3.67Å; R249-E290 IonicContact NH1-OE2 2.7Å; R249-E290 PolarHBondContact NH1-OE2 3.32Å; R249-E290 IonicContact NH2-OE2 3.21Å; R249-E290 PolarHBondContact NH2-OE2 3.21Å; R249-I294 HydrophobicContact CB-CD1 4.18Å; R249-I294 HydrophobicContact CB-CG2 4.06Å; R249-P297 VanDerWaalsContact O-CA 3.27Å; R249-P297 WeakPolarHBondContact O-CA 3.3Å; R249-R298 HydrophobicContact CB-CG 3.99Å; R249-R298 HydrophobicContact CG-CG 4.33Å; R249-R298 PolarHBondContact N-O 2.85Å; R249-R298 PolarHBondContact O-N 3.09Å; R249-R298 VanDerWaalsContact O-N 3.07Å; R249-D300 IonicContact NE-OD2 3.22Å; R249-D300 PolarHBondContact NE-OD2 3.38Å
250	L	92.9	Very high	96.4	Very high	10 Å²	10	33.3 Å²	33.3	5%	0.052	18%	0.184	C	C	.	.			trans	-119.2	122.5	-178.9	-172	67.3	0	0	0	111.1	L139 L184 Y222 L248 Y254 P297	L139-L250 HydrophobicContact CD2-CD2 3.58Å; L139-L250 HydrophobicContact CG-CD2 4.25Å; L184-L250 HydrophobicContact CD1-CD1 4.05Å; Y222-L250 PolarHBondContact OH-N 2.91Å; L248-L250 HydrophobicContact CD2-CB 3.82Å; L250-Y254 HydrophobicContact CD1-CD2 4.09Å; L250-Y254 HydrophobicContact CD1-CE2 3.78Å; L250-P297 HydrophobicContact CD1-CB 4.2Å
251	P	92.6	Very high	96.4	Very high	12 Å²	12	29.4 Å²	29.4	8%	0.078	17%	0.171	C	C	.	.			trans	-61.7	148.7	173.3	-24.1	33.8	0	0	0	112.8	Y254 I294	P251-Y254 HydrophobicContact CB-CE1 3.95Å; P251-Y254 HydrophobicContact CB-CE2 4.47Å; P251-Y254 HydrophobicContact CG-CE1 4.46Å; P251-Y254 VanDerWaalsContact CG-OH 3.3Å; P251-Y254 WeakPolarHBondContact CG-OH 3.22Å; P251-I294 HydrophobicContact CG-CG2 3.98Å
252	T	92.6	Very high	96.4	Very high	79 Å²	79	23.7 Å²	23.7	49%	0.485	14%	0.141	S	C	.	.	S	Bend	trans	-81.3	168.2	169.6	62.1	0	0	0	0	111.2
253	G	94.6	Very high	96.1	Very high	27 Å²	27	24.1 Å²	24.1	28%	0.278	15%	0.147	S	C	.	.	S	Bend	trans	89.4	6.9	175.8	0	0	0	0	0	114.7	P108 F109	P108-G253 WeakPolarHBondContact CB-O 3.34Å; F109-G253 WeakPolarHBondContact O-CA 3.4Å; F109-G253 PolarHBondContact O-N 3.16Å
254	Y	97.1	Very high	95.7	Very high	15 Å²	15	29.9 Å²	29.9	6%	0.059	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-76.7	172.5	176.1	-72.6	3.3	0	0	0	112.2	P108 F109 L139 T140 R141 V157 L250 P251	P108-Y254 CarbonylContact C-O 3.51Å; P108-Y254 WeakPolarHBondContact CA-O 3.32Å; F109-Y254 VanDerWaalsContact CB-O 3.23Å; F109-Y254 WeakPolarHBondContact CB-O 3.26Å; F109-Y254 PolarHBondContact N-O 3.26Å; L139-Y254 WeakPolarHBondContact O-CD2 3.02Å; T140-Y254 CarbonylContact O-C 3.36Å; T140-Y254 WeakPolarHBondContact O-CB 3.38Å; R141-Y254 HydrophobicContact CB-CD1 3.9Å; R141-Y254 HydrophobicContact CB-CE1 3.67Å; R141-Y254 HydrophobicContact CG-CD1 4.47Å; R141-Y254 HydrophobicContact CG-CE1 4.2Å; V157-Y254 WeakPolarHBondContact CG1-OH 2.98Å; L250-Y254 HydrophobicContact CD1-CD2 4.09Å; L250-Y254 HydrophobicContact CD1-CE2 3.78Å; P251-Y254 HydrophobicContact CB-CE1 3.95Å; P251-Y254 HydrophobicContact CB-CE2 4.47Å; P251-Y254 HydrophobicContact CG-CE1 4.46Å; P251-Y254 VanDerWaalsContact CG-OH 3.3Å; P251-Y254 WeakPolarHBondContact CG-OH 3.22Å
255	Y	98.3	Very high	95.5	Very high	57 Å²	57	26.2 Å²	26.2	22%	0.224	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.2	178.6	-60.6	-77.1	0	0	0	110.5	S105 I107 P108 L139 T140 R141 R143	S105-Y255 WeakPolarHBondContact O-CD1 3.22Å; I107-Y255 WeakPolarHBondContact O-CD1 3.46Å; P108-Y255 HydrophobicContact CB-CE1 4.17Å; L139-Y255 WeakPolarHBondContact CA-O 3.49Å; T140-Y255 PolarHBondContact N-O 2.84Å; T140-Y255 PolarHBondContact O-N 3.1Å; R141-Y255 WeakPolarHBondContact O-CD2 3.16Å; R141-Y255 WeakPolarHBondContact O-CE2 3.49Å; R143-Y255 HydrophobicContact CB-CD2 4.1Å; R143-Y255 HydrophobicContact CB-CG 4.1Å; R143-Y255 HydrophobicContact CG-CD2 4.08Å; R143-Y255 HydrophobicContact CG-CG 4.16Å
256	L	98.3	Very high	95.4	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.3	174.4	-176.9	65.8	0	0	0	108.5	Y60 W77 W104 S105 L116 W138 M274 V276	Y60-L256 WeakPolarHBondContact O-CD2 3.32Å; W77-L256 HydrophobicContact CH2-CB 4.3Å; W77-L256 HydrophobicContact CH2-CD2 3.72Å; W77-L256 HydrophobicContact CH2-CG 3.89Å; W77-L256 HydrophobicContact CZ2-CD2 4.21Å; W104-L256 CarbonylContact C-O 3.37Å; S105-L256 WeakPolarHBondContact CB-O 3.5Å; S105-L256 PolarHBondContact N-O 3.33Å; S105-L256 PolarHBondContact OG-N 3.39Å; S105-L256 PolarHBondContact OG-O 3.43Å; L116-L256 HydrophobicContact CD1-CD1 4.45Å; L116-L256 HydrophobicContact CD1-CD2 4.12Å; L116-L256 HydrophobicContact CD2-CD1 3.79Å; W138-L256 CarbonylContact O-C 3.58Å; W138-L256 WeakPolarHBondContact O-CA 3.48Å; W138-L256 WeakPolarHBondContact O-CD1 3.16Å; L256-M274 HydrophobicContact CD1-CE 3.85Å; L256-M274 HydrophobicContact CD2-CE 4.05Å; L256-M274 HydrophobicContact CG-CE 3.74Å; L256-V276 HydrophobicContact CD2-CG2 3.81Å
257	G	98.3	Very high	95.4	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	169.4	179.5	0	0	0	0	0	113.7	V103 W138	V103-G257 CarbonylContact O-C 3.49Å; V103-G257 WeakPolarHBondContact O-CA 3.44Å; W138-G257 PolarHBondContact N-O 2.78Å; W138-G257 PolarHBondContact O-N 2.87Å
258	A	98.8	Very high	95.6	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	139.1	167.8	0	0	0	0	0	109	L92 A102 V103 A136 I137 I271 M274	L92-A258 HydrophobicContact CD1-CB 4.19Å; A102-A258 CarbonylContact C-O 3.55Å; A102-A258 WeakPolarHBondContact CA-O 3.27Å; A102-A258 WeakPolarHBondContact CB-O 3.48Å; V103-A258 HydrophobicContact CG1-CB 4.07Å; V103-A258 PolarHBondContact N-O 3.04Å; V103-A258 PolarHBondContact O-N 2.85Å; A136-A258 CarbonylContact O-C 3.41Å; A136-A258 WeakPolarHBondContact O-CA 3.3Å; I137-A258 HydrophobicContact CD1-CB 3.69Å; A258-I271 HydrophobicContact CB-CD1 4.09Å; A258-I271 HydrophobicContact CB-CG1 4.06Å; A258-M274 HydrophobicContact CB-SD 4.13Å
259	S	98.8	Very high	95.8	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	161	176.7	71.6	0	0	0	0	111.5	G101 A136 W138 F150	G101-S259 CarbonylContact O-C 3.58Å; G101-S259 WeakPolarHBondContact O-CA 3.25Å; A136-S259 PolarHBondContact N-O 2.89Å; A136-S259 PolarHBondContact O-N 3.4Å; W138-S259 PolarHBondContact NE1-OG 2.88Å; F150-S259 CarbonylContact O-C 3.56Å; F150-S259 VanDerWaalsContact O-C 3.24Å; F150-S259 VanDerWaalsContact O-CB 3.23Å; F150-S259 WeakPolarHBondContact O-CB 3.39Å; F150-S259 PolarHBondContact O-OG 2.86Å
260	S	98.4	Very high	96	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	153.3	171.5	175.3	0	0	0	0	109.7	T93 Q100 G101 G134 F150 H269	T93-S260 VanDerWaalsContact CG2-O 3.3Å; T93-S260 WeakPolarHBondContact CG2-O 3.17Å; T93-S260 PolarHBondContact OG1-OG 2.83Å; T93-S260 VanDerWaalsContact OG1-OG 3.06Å; Q100-S260 WeakPolarHBondContact CA-O 3.26Å; G101-S260 PolarHBondContact N-O 2.98Å; G101-S260 PolarHBondContact O-N 2.71Å; G134-S260 VanDerWaalsContact O-CB 3.29Å; G134-S260 WeakPolarHBondContact O-CB 3.43Å; G134-S260 PolarHBondContact O-OG 3.38Å; F150-S260 CarbonylContact O-C 3.51Å; F150-S260 WeakPolarHBondContact O-CA 3.36Å; F150-S260 PolarHBondContact O-N 2.89Å; S260-H269 WeakPolarHBondContact OG-CB 3.17Å; S260-H269 PolarHBondContact OG-ND1 3.27Å; S260-H269 VanDerWaalsContact OG-ND1 3.07Å
261	A	97.1	Very high	96.2	Very high	6 Å²	6	21.2 Å²	21.2	5%	0.05	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	152.4	169.5	0	0	0	0	0	110.7	R99 Q100 D133	R99-A261 CarbonylContact O-C 3.43Å; R99-A261 VanDerWaalsContact O-CA 3.23Å; R99-A261 WeakPolarHBondContact O-CA 3.28Å; Q100-A261 HydrophobicContact CG-CB 3.88Å; D133-A261 PolarHBondContact N-O 2.86Å
262	T	96.1	Very high	96.5	Very high	7 Å²	7	21.8 Å²	21.8	4%	0.043	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.9	169	59.8	0	0	0	0	108.8	Q96 S98 R99 L265	Q96-T262 WeakPolarHBondContact O-CB 3.21Å; Q96-T262 PolarHBondContact O-OG1 3.38Å; S98-T262 WeakPolarHBondContact CA-O 3.41Å; S98-T262 PolarHBondContact N-O 2.89Å; S98-T262 VanDerWaalsContact N-O 3.12Å; S98-T262 PolarHBondContact N-OG1 3.36Å; R99-T262 WeakPolarHBondContact CB-OG1 3.38Å; R99-T262 PolarHBondContact N-O 3.29Å; R99-T262 PolarHBondContact N-OG1 3.43Å; R99-T262 PolarHBondContact O-N 3.49Å; T262-L265 WeakPolarHBondContact CB-O 3.24Å
263	G	92	Very high	96.8	Very high	23 Å²	23	18.6 Å²	18.6	24%	0.237	11%	0.11	C	C	.	.	S	Bend	trans	-96.5	-127.3	175.5	0	0	0	0	0	112	Q97 S98 L265	Q97-G263 WeakPolarHBondContact CA-O 3.07Å; Q97-G263 WeakPolarHBondContact CB-O 3.33Å; S98-G263 PolarHBondContact N-O 3.11Å; G263-L265 CarbonylContact C-O 3.54Å; G263-L265 PolarHBondContact N-O 3.29Å; G263-L265 VanDerWaalsContact N-O 3.16Å
264	D	90	Very high	96.9	Very high	134 Å²	134	17.3 Å²	17.3	72%	0.717	10%	0.096	S	C	*	.	S	Bend	trans	-70.5	-22.2	169.7	-70.9	-23.2	0	0	0	112.2	Q97	Q97-D264 WeakPolarHBondContact CG-O 3.43Å; Q97-D264 PolarHBondContact NE2-O 3.05Å
265	L	92.4	Very high	97	Very high	36 Å²	36	20.3 Å²	20.3	19%	0.188	11%	0.11	C	C	.	.	S	Bend	trans	-106.4	157.8	171.1	-57.2	175.6	0	0	0	109.4	L130 N131 Y166 T262 G263	L130-L265 HydrophobicContact CB-CD2 4.07Å; L130-L265 HydrophobicContact CD2-CD2 4.05Å; N131-L265 VanDerWaalsContact C-CB 3.47Å; N131-L265 VanDerWaalsContact O-CD1 3.3Å; N131-L265 WeakPolarHBondContact O-CD1 3.42Å; Y166-L265 HydrophobicContact CD2-CD1 3.58Å; Y166-L265 HydrophobicContact CE2-CD1 3.27Å; Y166-L265 HydrophobicContact CG-CD1 4.36Å; T262-L265 WeakPolarHBondContact CB-O 3.24Å; G263-L265 CarbonylContact C-O 3.54Å; G263-L265 PolarHBondContact N-O 3.29Å; G263-L265 VanDerWaalsContact N-O 3.16Å
266	S	95.3	Very high	97	Very high	19 Å²	19	17.6 Å²	17.6	13%	0.133	10%	0.099	C	C	.	.			trans	-144.9	157.6	-176.8	58.6	0	0	0	0	112.3	D95 Q96 G132	D95-S266 WeakPolarHBondContact OD1-CB 3.49Å; D95-S266 PolarHBondContact OD1-OG 3.21Å; Q96-S266 VanDerWaalsContact C-CB 3.44Å; Q96-S266 PolarHBondContact N-OG 3.25Å; Q96-S266 WeakPolarHBondContact O-CB 3.37Å; G132-S266 CarbonylContact O-C 3.45Å; G132-S266 WeakPolarHBondContact O-CA 3.42Å
267	D	97.1	Very high	96.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.105	C	C	.	.			trans	-150.3	164.1	166.7	-92.9	-29.6	0	0	0	108.1	P94 I122 G124 N131 G132 R210 H269	P94-D267 CarbonylContact C-O 3.59Å; I122-D267 HydrophobicContact CG2-CB 3.98Å; G124-D267 WeakPolarHBondContact CA-OD1 3.22Å; G124-D267 PolarHBondContact N-OD1 3.37Å; N131-D267 WeakPolarHBondContact CB-OD2 3.37Å; G132-D267 PolarHBondContact O-N 2.89Å; R210-D267 WeakPolarHBondContact CD-OD2 3.4Å; R210-D267 IonicContact CZ-OD1 3.72Å; R210-D267 IonicContact CZ-OD2 3.78Å; R210-D267 IonicContact NE-OD1 3.99Å; R210-D267 PolarHBondContact NE-OD1 3.31Å; R210-D267 IonicContact NE-OD2 2.79Å; R210-D267 PolarHBondContact NE-OD2 2.7Å; R210-D267 IonicContact NH2-OD1 3.22Å; R210-D267 PolarHBondContact NH2-OD1 2.84Å; R210-D267 IonicContact NH2-OD2 2.63Å; D267-H269 PolarHBondContact O-CE1 3.47Å; D267-H269 PolarHBondContact O-ND1 3.39Å
268	N	97.9	Very high	96.8	Very high	20 Å²	20	22.2 Å²	22.2	11%	0.107	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.2	163.1	-54.7	-78.5	0	0	0	109.4	T93 D95 I122 H123	T93-N268 WeakPolarHBondContact O-CA 3.46Å; D95-N268 PolarHBondContact N-OD1 2.82Å; I122-N268 WeakPolarHBondContact CA-O 3.4Å; H123-N268 PolarHBondContact CE1-ND2 3.45Å; H123-N268 PolarHBondContact N-O 3.38Å; H123-N268 PolarHBondContact ND1-ND2 3.37Å; H123-N268 WeakPolarHBondContact O-CA 3.48Å; H123-N268 VanDerWaalsContact O-CB 3.24Å; H123-N268 WeakPolarHBondContact O-CB 3.47Å; H123-N268 PolarHBondContact O-N 3.1Å; H123-N268 PolarHBondContact O-ND2 3.31Å
269	H	98.6	Very high	96.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	103.4	179.3	-61.2	94.3	0	0	0	109.3	L92 T93 G134 I135 S260 D267	L92-H269 HydrophobicContact CB-CB 4.4Å; L92-H269 PolarHBondContact N-O 2.87Å; T93-H269 PolarHBondContact O-N 2.95Å; T93-H269 WeakPolarHBondContact OG1-CB 3.48Å; T93-H269 PolarHBondContact OG1-ND1 2.8Å; G134-H269 WeakPolarHBondContact CA-NE2 3.41Å; G134-H269 PolarHBondContact O-CD2 2.83Å; G134-H269 PolarHBondContact O-NE2 2.71Å; I135-H269 HydrophobicContact CD1-CB 3.82Å; I135-H269 HydrophobicContact CG1-CB 3.81Å; S260-H269 WeakPolarHBondContact OG-CB 3.17Å; S260-H269 PolarHBondContact OG-ND1 3.27Å; S260-H269 VanDerWaalsContact OG-ND1 3.07Å; D267-H269 PolarHBondContact O-CE1 3.47Å; D267-H269 PolarHBondContact O-ND1 3.39Å
270	D	98.5	Very high	96.1	Very high	6 Å²	6	26.6 Å²	26.6	3%	0.032	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.1	-170	-65.6	-28.1	0	0	0	110.6	H89 R91 F120 K121 H123	H89-D270 HydrophobicContact CB-CB 4.12Å; H89-D270 IonicContact CD2-OD1 3.42Å; H89-D270 PolarHBondContact CD2-OD1 3.37Å; H89-D270 IonicContact CD2-OD2 2.7Å; H89-D270 IonicContact CE1-OD2 3.63Å; H89-D270 IonicContact NE2-OD1 2.76Å; H89-D270 PolarHBondContact NE2-OD1 3.07Å; H89-D270 IonicContact NE2-OD2 3.73Å; H89-D270 PolarHBondContact NE2-OD2 3.22Å; R91-D270 WeakPolarHBondContact CA-OD1 3.25Å; R91-D270 VanDerWaalsContact CB-OD1 3.25Å; R91-D270 WeakPolarHBondContact CB-OD1 3.36Å; R91-D270 VanDerWaalsContact CG-OD1 3.27Å; R91-D270 WeakPolarHBondContact CG-OD1 3.17Å; R91-D270 IonicContact CZ-OD1 3.09Å; R91-D270 IonicContact CZ-OD2 3.11Å; R91-D270 IonicContact NE-OD1 2.89Å; R91-D270 PolarHBondContact NE-OD1 3.07Å; R91-D270 IonicContact NE-OD2 2.71Å; R91-D270 IonicContact NH2-OD1 3.23Å; R91-D270 PolarHBondContact NH2-OD1 3.15Å; R91-D270 IonicContact NH2-OD2 2.75Å; R91-D270 PolarHBondContact NH2-OD2 3.31Å; F120-D270 CarbonylContact C-O 3.21Å; F120-D270 WeakPolarHBondContact CA-O 3.35Å; F120-D270 WeakPolarHBondContact CB-O 3.32Å; K121-D270 HydrophobicContact CB-CB 4.48Å; K121-D270 PolarHBondContact N-O 2.8Å; K121-D270 PolarHBondContact O-N 3.05Å; H123-D270 IonicContact CD2-OD2 3.84Å; H123-D270 IonicContact CE1-OD2 3.21Å; H123-D270 IonicContact NE2-OD2 3.67Å; H123-D270 PolarHBondContact NE2-OD2 2.79Å
271	I	98.5	Very high	95.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	113	169	-58.8	-62.4	0	0	0	108.4	L62 H89 V90 L92 V118 F120 I135 I137 A258 M274	L62-I271 HydrophobicContact CD2-CG2 4.07Å; H89-I271 WeakPolarHBondContact CA-O 3.46Å; V90-I271 PolarHBondContact N-O 2.85Å; V90-I271 PolarHBondContact O-N 2.81Å; L92-I271 HydrophobicContact CD1-CD1 4.27Å; L92-I271 HydrophobicContact CD1-CG1 3.81Å; L92-I271 HydrophobicContact CD2-CG1 4.35Å; L92-I271 HydrophobicContact CG-CG1 4.08Å; V118-I271 HydrophobicContact CG1-CD1 4.32Å; F120-I271 HydrophobicContact CB-CD1 3.96Å; I135-I271 HydrophobicContact CD1-CD1 4.36Å; I135-I271 HydrophobicContact CG2-CD1 4.19Å; I137-I271 HydrophobicContact CD1-CD1 4.22Å; A258-I271 HydrophobicContact CB-CD1 4.09Å; A258-I271 HydrophobicContact CB-CG1 4.06Å; I271-M274 HydrophobicContact CG2-CG 3.84Å; I271-M274 HydrophobicContact CG2-SD 4.29Å
272	I	98.2	Very high	95.2	Very high	24 Å²	24	36.2 Å²	36.2	12%	0.123	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-45.2	177.5	-62.3	82.1	0	0	0	109.3	Y66 H89 H119 K121	Y66-I272 PolarHBondContact OH-O 3.02Å; H89-I272 HydrophobicContact CB-CG1 4.3Å; H119-I272 HydrophobicContact CB-CB 4.13Å; H119-I272 WeakPolarHBondContact ND1-CG2 3.2Å; H119-I272 WeakPolarHBondContact O-CA 3.35Å; H119-I272 PolarHBondContact O-N 3.33Å; K121-I272 HydrophobicContact CB-CD1 3.83Å
273	S	98.2	Very high	94.7	Very high	13 Å²	13	38.1 Å²	38.1	9%	0.091	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	150.6	172.1	61.7	0	0	0	0	113.6	L62 V118 H119	L62-S273 CarbonylContact O-C 3.49Å; L62-S273 WeakPolarHBondContact O-CA 3.43Å; L62-S273 WeakPolarHBondContact O-CB 3.45Å; V118-S273 CarbonylContact C-O 3.51Å; V118-S273 WeakPolarHBondContact CA-O 3.33Å; H119-S273 WeakPolarHBondContact CB-OG 3.21Å; H119-S273 PolarHBondContact N-O 2.79Å; H119-S273 PolarHBondContact O-N 3.14Å
274	M	98.4	Very high	94.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	114.5	162.8	-61.8	174	74.5	0	0	106.7	S61 L62 W77 L116 V118 I137 L256 A258 I271	S61-M274 CarbonylContact C-O 3.55Å; S61-M274 WeakPolarHBondContact CA-O 3.43Å; S61-M274 WeakPolarHBondContact CB-O 3.45Å; L62-M274 HydrophobicContact CB-CB 4.1Å; L62-M274 HydrophobicContact CD2-SD 4.48Å; L62-M274 PolarHBondContact N-O 3.37Å; L62-M274 PolarHBondContact O-N 3.05Å; W77-M274 HydrophobicContact CH2-CE 4.23Å; W77-M274 HydrophobicContact CH2-SD 3.92Å; W77-M274 HydrophobicContact CZ3-SD 4.2Å; L116-M274 HydrophobicContact CD1-CB 4.1Å; L116-M274 HydrophobicContact CD1-CE 4.39Å; L116-M274 HydrophobicContact CD2-CE 4.38Å; V118-M274 HydrophobicContact CG1-CG 4.25Å; V118-M274 HydrophobicContact CG2-CG 4.4Å; I137-M274 HydrophobicContact CG2-CE 4.01Å; L256-M274 HydrophobicContact CD1-CE 3.85Å; L256-M274 HydrophobicContact CD2-CE 4.05Å; L256-M274 HydrophobicContact CG-CE 3.74Å; A258-M274 HydrophobicContact CB-SD 4.13Å; I271-M274 HydrophobicContact CG2-CG 3.84Å; I271-M274 HydrophobicContact CG2-SD 4.29Å
275	K	98.1	Very high	94.3	Very high	77 Å²	77	38.1 Å²	38.1	34%	0.335	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.5	-179.3	-65	178.4	-173.4	172.8	0	109.1	L56 V63 L116 R117 Y277	L56-K275 HydrophobicContact CD1-CB 3.93Å; L56-K275 HydrophobicContact CD1-CG 4.35Å; V63-K275 HydrophobicContact CG1-CG 3.82Å; L116-K275 CarbonylContact C-O 3.55Å; L116-K275 WeakPolarHBondContact CA-O 3.49Å; R117-K275 HydrophobicContact CB-CB 4.47Å; R117-K275 PolarHBondContact N-O 3.06Å; R117-K275 PolarHBondContact O-N 2.7Å; K275-Y277 HydrophobicContact CB-CD2 4.49Å; K275-Y277 HydrophobicContact CB-CE2 3.69Å
276	V	98.1	Very high	93.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.4	179.4	175.2	0	0	0	0	108.9	L56 K57 Y60 S61 F109 L111 E115 L116 L256	L56-V276 CarbonylContact C-O 3.56Å; L56-V276 WeakPolarHBondContact CA-O 3.21Å; K57-V276 HydrophobicContact CB-CG1 4.33Å; K57-V276 PolarHBondContact N-O 3.12Å; Y60-V276 VanDerWaalsContact O-CG2 3.31Å; Y60-V276 WeakPolarHBondContact O-CG2 3.33Å; S61-V276 PolarHBondContact OG-N 3.04Å; F109-V276 HydrophobicContact CE2-CB 4.44Å; F109-V276 HydrophobicContact CE2-CG1 3.65Å; F109-V276 HydrophobicContact CE2-CG2 4.01Å; F109-V276 HydrophobicContact CZ-CG1 3.84Å; L111-V276 HydrophobicContact CD1-CG1 3.53Å; E115-V276 CarbonylContact O-C 3.59Å; E115-V276 WeakPolarHBondContact O-CA 3.37Å; L116-V276 HydrophobicContact CD1-CG2 3.73Å; L256-V276 HydrophobicContact CD2-CG2 3.81Å
277	Y	97.3	Very high	93.3	Very high	36 Å²	36	46.1 Å²	46.1	14%	0.141	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.2	173.5	-61.4	-93.9	0	0	0	108.4	D54 F55 L56 W114 E115 R117 K275	D54-Y277 HydrophobicContact CB-CD1 3.77Å; D54-Y277 HydrophobicContact CB-CG 4.22Å; F55-Y277 WeakPolarHBondContact O-CA 3.44Å; L56-Y277 HydrophobicContact CB-CD1 4.08Å; L56-Y277 HydrophobicContact CB-CE1 3.88Å; L56-Y277 HydrophobicContact CD1-CD1 4.37Å; L56-Y277 HydrophobicContact CD1-CE1 3.94Å; L56-Y277 HydrophobicContact CD1-CE2 4.17Å; L56-Y277 HydrophobicContact CG-CE1 4.5Å; W114-Y277 CarbonylContact C-O 3.56Å; W114-Y277 WeakPolarHBondContact CA-O 3.4Å; W114-Y277 WeakPolarHBondContact CB-O 3.43Å; E115-Y277 PolarHBondContact N-O 3.24Å; E115-Y277 PolarHBondContact O-N 3.29Å; R117-Y277 HydrophobicContact CG-CD2 4.42Å; R117-Y277 HydrophobicContact CG-CE2 4.17Å; K275-Y277 HydrophobicContact CB-CD2 4.49Å; K275-Y277 HydrophobicContact CB-CE2 3.69Å
278	Q	95.6	Very high	92.5	Very high	66 Å²	66	50.6 Å²	50.6	31%	0.308	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	133.6	168.3	-179.6	177.4	2.7	0	0	108.5	F55 K57 L111	F55-Q278 PolarHBondContact N-O 3.35Å; F55-Q278 PolarHBondContact O-N 3.42Å; K57-Q278 HydrophobicContact CD-CB 4.47Å; K57-Q278 VanDerWaalsContact CE-CB 3.43Å; K57-Q278 HydrophobicContact CG-CB 4.15Å; L111-Q278 HydrophobicContact CD1-CB 4.34Å; L111-Q278 HydrophobicContact CD2-CG 4.45Å
279	L	93.8	Very high	91.7	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.01	28%	0.283	C	S	.	.			trans	-93.9	137.9	173.7	-55.2	175.9	0	0	0	109	F52 D54 D113 E115 R221 V281	F52-L279 HydrophobicContact CB-CD2 4.15Å; F52-L279 HydrophobicContact CD1-CB 4.32Å; F52-L279 HydrophobicContact CD1-CD2 4.43Å; F52-L279 HydrophobicContact CG-CD2 4.3Å; D54-L279 VanDerWaalsContact OD1-CD2 3.23Å; D54-L279 WeakPolarHBondContact OD1-CD2 3.48Å; D113-L279 HydrophobicContact CB-CB 3.92Å; D113-L279 PolarHBondContact O-N 3.5Å; E115-L279 HydrophobicContact CB-CD2 4.31Å; R221-L279 HydrophobicContact CG-CD1 3.92Å; L279-V281 HydrophobicContact CB-CG2 4.05Å
280	T	89.8	Confident	90.7	Very high	89 Å²	89	61.3 Å²	61.3	55%	0.546	31%	0.307	S	S	.	.			trans	-91.7	110	173.4	-54.4	0	0	0	0	108
281	V	89.2	Confident	89.5	Confident	29 Å²	29	62.1 Å²	62.1	18%	0.176	31%	0.31	C	S	.	.			trans	-127.8	126.1	-174.5	-176.9	0	0	0	0	109.2	F52 D113 K224 L279	F52-V281 HydrophobicContact CE1-CG2 4.2Å; D113-V281 HydrophobicContact CB-CB 4.47Å; D113-V281 HydrophobicContact CB-CG2 3.74Å; K224-V281 HydrophobicContact CD-CG1 4.12Å; K224-V281 HydrophobicContact CG-CG1 3.86Å; L279-V281 HydrophobicContact CB-CG2 4.05Å
282	E	87.3	Confident	88.3	Confident	179 Å²	179	69.6 Å²	69.6	84%	0.836	35%	0.345	S	S	*	.			trans	-74.9	129.8	173.6	-63.9	-175.5	173.9	0	0	110.4	K224	K224-E282 PolarHBondContact NZ-O 2.75Å
283	R	84.6	Confident	87.4	Confident	47 Å²	47	73.6 Å²	73.6	18%	0.177	37%	0.371	C	S	.	.			trans	-123.3	154	176.5	-81	-176.8	170.6	59	-6	111	D113 E287 E288 E291	D113-R283 IonicContact OD1-CZ 3.73Å; D113-R283 IonicContact OD1-NH1 3.33Å; D113-R283 PolarHBondContact OD1-NH1 3.03Å; D113-R283 IonicContact OD1-NH2 3.49Å; D113-R283 PolarHBondContact OD1-NH2 3Å; D113-R283 IonicContact OD2-CZ 3.72Å; D113-R283 IonicContact OD2-NH1 3.38Å; D113-R283 PolarHBondContact OD2-NH1 2.77Å; D113-R283 IonicContact OD2-NH2 2.84Å; D113-R283 PolarHBondContact OD2-NH2 2.93Å; R283-E287 WeakPolarHBondContact CA-OE2 3.44Å; R283-E287 HydrophobicContact CB-CB 4.33Å; R283-E287 HydrophobicContact CG-CB 4.34Å; R283-E288 HydrophobicContact CB-CG 4.22Å; R283-E291 IonicContact CZ-OE2 3.71Å; R283-E291 IonicContact NE-OE2 2.89Å; R283-E291 PolarHBondContact NE-OE2 3.43Å; R283-E291 IonicContact NH2-OE1 3.87Å; R283-E291 PolarHBondContact NH2-OE1 3.1Å; R283-E291 IonicContact NH2-OE2 3.55Å; R283-E291 PolarHBondContact NH2-OE2 2.9Å
284	T	88.1	Confident	86.6	Confident	76 Å²	76	74.4 Å²	74.4	47%	0.466	37%	0.374	S	S	.	.			trans	-82.2	160.4	167.3	62.9	0	0	0	0	110.6	E286 E287 E288	T284-E286 PolarHBondContact O-N 2.83Å; T284-E287 PolarHBondContact N-OE2 2.82Å; T284-E287 PolarHBondContact O-N 2.79Å; T284-E287 VanDerWaalsContact OG1-CG 3.32Å; T284-E287 WeakPolarHBondContact OG1-CG 3.43Å; T284-E287 PolarHBondContact OG1-N 3.03Å; T284-E287 PolarHBondContact OG1-OE2 3.07Å; T284-E288 PolarHBondContact O-N 2.86Å
285	S	84.6	Confident	85.9	Confident	82 Å²	82	80.1 Å²	80.1	57%	0.573	41%	0.408	S	S	*	.	H	α-helix	trans	-61.3	-33.4	178	53	0	0	0	0	113	E288 E289	S285-E288 PolarHBondContact O-N 2.79Å; S285-E289 PolarHBondContact O-N 2.82Å; S285-E289 VanDerWaalsContact O-N 3.11Å
286	E	83.4	Confident	85.5	Confident	147 Å²	147	80.4 Å²	80.4	69%	0.687	42%	0.417	S	S	*	.	H	α-helix	trans	-65.4	-41.8	177.6	-64.3	177.2	178.6	0	0	111.3	T284 E288 E289 E290	T284-E286 PolarHBondContact O-N 2.83Å; E286-E288 VanDerWaalsContact C-N 3.3Å; E286-E288 PolarHBondContact O-N 2.79Å; E286-E289 PolarHBondContact O-N 3.21Å; E286-E290 PolarHBondContact O-N 2.7Å; E286-E290 VanDerWaalsContact O-N 3.07Å
287	E	83.4	Confident	85.2	Confident	76 Å²	76	80.5 Å²	80.5	36%	0.355	42%	0.417	S	S	.	.	H	α-helix	trans	-64.8	-34.1	175.6	-71.1	168.8	150.1	0	0	112.1	R283 T284 E291	R283-E287 WeakPolarHBondContact CA-OE2 3.44Å; R283-E287 HydrophobicContact CB-CB 4.33Å; R283-E287 HydrophobicContact CG-CB 4.34Å; T284-E287 PolarHBondContact N-OE2 2.82Å; T284-E287 PolarHBondContact O-N 2.79Å; T284-E287 VanDerWaalsContact OG1-CG 3.32Å; T284-E287 WeakPolarHBondContact OG1-CG 3.43Å; T284-E287 PolarHBondContact OG1-N 3.03Å; T284-E287 PolarHBondContact OG1-OE2 3.07Å; E287-E291 WeakPolarHBondContact O-CB 3.38Å; E287-E291 PolarHBondContact O-N 2.82Å
288	E	81.6	Confident	85.1	Confident	93 Å²	93	84.9 Å²	84.9	44%	0.435	43%	0.433	S	S	.	.	H	α-helix	trans	-67.7	-43.4	175.9	-68.3	-175.5	157.1	0	0	112	R283 T284 S285 E286 E291 E292	R283-E288 HydrophobicContact CB-CG 4.22Å; T284-E288 PolarHBondContact O-N 2.86Å; S285-E288 PolarHBondContact O-N 2.79Å; E286-E288 VanDerWaalsContact C-N 3.3Å; E286-E288 PolarHBondContact O-N 2.79Å; E288-E291 PolarHBondContact O-N 2.63Å; E288-E292 PolarHBondContact O-N 2.83Å
289	E	81.1	Confident	85	Confident	138 Å²	138	82.1 Å²	82.1	65%	0.645	42%	0.421	S	S	*	.	H	α-helix	trans	-65.5	-43.3	178.2	-72.6	-178.7	-173.7	0	0	112.2	S285 E286 E291 E292 V293	S285-E289 PolarHBondContact O-N 2.82Å; S285-E289 VanDerWaalsContact O-N 3.11Å; E286-E289 PolarHBondContact O-N 3.21Å; E289-E291 VanDerWaalsContact C-N 3.28Å; E289-E291 PolarHBondContact O-N 3.11Å; E289-E292 PolarHBondContact O-N 2.76Å; E289-V293 WeakPolarHBondContact O-CG2 3.42Å
290	E	77.3	Confident	84.9	Confident	107 Å²	107	84.4 Å²	84.4	50%	0.5	43%	0.434	S	S	.	.	H	α-helix	trans	-61	-37.7	176.3	-77.3	-167.3	179.8	0	0	112.6	R249 E286 V293	R249-E290 IonicContact CZ-OE2 3.67Å; R249-E290 IonicContact NH1-OE2 2.7Å; R249-E290 PolarHBondContact NH1-OE2 3.32Å; R249-E290 IonicContact NH2-OE2 3.21Å; R249-E290 PolarHBondContact NH2-OE2 3.21Å; E286-E290 PolarHBondContact O-N 2.7Å; E286-E290 VanDerWaalsContact O-N 3.07Å; E290-V293 PolarHBondContact O-N 2.7Å
291	E	73.6	Confident	84.6	Confident	23 Å²	23	87.9 Å²	87.9	11%	0.107	45%	0.449	C	S	.	.	H	α-helix	trans	-71.8	-33.6	-176.3	-164.7	167.9	-171	0	0	112.1	R283 E287 E288 E289 V293 I294	R283-E291 IonicContact CZ-OE2 3.71Å; R283-E291 IonicContact NE-OE2 2.89Å; R283-E291 PolarHBondContact NE-OE2 3.43Å; R283-E291 IonicContact NH2-OE1 3.87Å; R283-E291 PolarHBondContact NH2-OE1 3.1Å; R283-E291 IonicContact NH2-OE2 3.55Å; R283-E291 PolarHBondContact NH2-OE2 2.9Å; E287-E291 WeakPolarHBondContact O-CB 3.38Å; E287-E291 PolarHBondContact O-N 2.82Å; E288-E291 PolarHBondContact O-N 2.63Å; E289-E291 VanDerWaalsContact C-N 3.28Å; E289-E291 PolarHBondContact O-N 3.11Å; E291-V293 PolarHBondContact O-N 3.25Å; E291-I294 HydrophobicContact CB-CD1 4.47Å; E291-I294 HydrophobicContact CG-CD1 4.07Å; E291-I294 PolarHBondContact O-N 3.31Å
292	E	72.1	Confident	84.4	Confident	158 Å²	158	89.4 Å²	89.4	74%	0.738	46%	0.455	S	S	*	.	H	α-helix	trans	-63.3	-21.8	174	-73.8	-168.4	170.9	0	0	113.4	E288 E289	E288-E292 PolarHBondContact O-N 2.83Å; E289-E292 PolarHBondContact O-N 2.76Å
293	V	79.8	Confident	84	Confident	108 Å²	108	90.3 Å²	90.3	66%	0.655	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-7.1	-176.4	-177.1	0	0	0	0	112.9	E289 E290 E291 T295	E289-V293 WeakPolarHBondContact O-CG2 3.42Å; E290-V293 PolarHBondContact O-N 2.7Å; E291-V293 PolarHBondContact O-N 3.25Å; V293-T295 PolarHBondContact O-N 2.94Å
294	I	81.6	Confident	83.9	Confident	30 Å²	30	90.7 Å²	90.7	15%	0.154	46%	0.455	C	S	.	.			trans	-71.8	105.7	-175.8	-52.5	172.7	0	0	0	110.8	R249 P251 E291	R249-I294 HydrophobicContact CB-CD1 4.18Å; R249-I294 HydrophobicContact CB-CG2 4.06Å; P251-I294 HydrophobicContact CG-CG2 3.98Å; E291-I294 HydrophobicContact CB-CD1 4.47Å; E291-I294 HydrophobicContact CG-CD1 4.07Å; E291-I294 PolarHBondContact O-N 3.31Å
295	T	84.8	Confident	83.5	Confident	119 Å²	119	87.8 Å²	87.8	73%	0.73	44%	0.437	S	S	*	.			trans	-104.8	-27.7	-179.7	51	0	0	0	0	114	V293	V293-T295 PolarHBondContact O-N 2.94Å
296	V	88	Confident	83	Confident	84 Å²	84	89.1 Å²	89.1	51%	0.509	43%	0.434	S	S	.	.	S	Bend	trans	-126.6	133.1	-176.6	-178.4	0	0	0	0	109.1	N186 R298	N186-V296 HydrophobicContact CB-CG1 4.38Å; V296-R298 PolarHBondContact O-N 3.17Å
297	P	93.5	Very high	82.1	Confident	2 Å²	2	88.1 Å²	88.1	1%	0.013	44%	0.437	C	S	.	.			trans	-68.4	132.3	177.2	28.5	-33.3	0	0	0	110.8	V157 L184 G185 R249 L250	V157-P297 HydrophobicContact CG1-CG 3.7Å; L184-P297 HydrophobicContact CD1-CB 3.94Å; L184-P297 HydrophobicContact CD2-CB 4.18Å; L184-P297 HydrophobicContact CG-CB 4.06Å; G185-P297 WeakPolarHBondContact O-CG 3.33Å; R249-P297 VanDerWaalsContact O-CA 3.27Å; R249-P297 WeakPolarHBondContact O-CA 3.3Å; L250-P297 HydrophobicContact CD1-CB 4.2Å
298	R	93.9	Very high	81	Confident	127 Å²	127	91.7 Å²	91.7	48%	0.479	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	166.6	176.7	67.4	177.1	-167.4	-153.9	-4.6	111.7	L184 R249 V296 D300 F305	L184-R298 VanDerWaalsContact CD2-C 3.42Å; L184-R298 WeakPolarHBondContact CD2-O 2.99Å; R249-R298 HydrophobicContact CB-CG 3.99Å; R249-R298 HydrophobicContact CG-CG 4.33Å; R249-R298 PolarHBondContact N-O 2.85Å; R249-R298 PolarHBondContact O-N 3.09Å; R249-R298 VanDerWaalsContact O-N 3.07Å; V296-R298 PolarHBondContact O-N 3.17Å; R298-D300 IonicContact CZ-OD1 3.83Å; R298-D300 IonicContact NE-OD1 3.19Å; R298-D300 PolarHBondContact NE-OD1 2.84Å; R298-D300 IonicContact NH2-OD1 3.72Å; R298-F305 HydrophobicContact CB-CB 3.93Å; R298-F305 HydrophobicContact CB-CD1 4.45Å; R298-F305 HydrophobicContact CB-CG 4.18Å
299	V	93.8	Very high	80	Confident	8 Å²	8	93.1 Å²	93.1	5%	0.048	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.9	163.8	-174	0	0	0	0	107.4	L184 L202 V245 G247 L248 M302 F305	L184-V299 HydrophobicContact CD2-CG2 3.75Å; L202-V299 HydrophobicContact CD1-CG2 3.91Å; L202-V299 HydrophobicContact CD2-CG2 4.26Å; V245-V299 HydrophobicContact CG1-CG1 3.93Å; V245-V299 HydrophobicContact CG1-CG2 4.08Å; G247-V299 CarbonylContact O-C 3.41Å; G247-V299 WeakPolarHBondContact O-CA 3.41Å; L248-V299 HydrophobicContact CB-CG2 4.49Å; L248-V299 HydrophobicContact CD1-CG2 4.44Å; L248-V299 HydrophobicContact CG-CG2 4.38Å; V299-M302 HydrophobicContact CB-CB 4.33Å; V299-M302 HydrophobicContact CB-CG 3.97Å; V299-M302 HydrophobicContact CB-SD 3.58Å; V299-M302 VanDerWaalsContact CB-SD 3.58Å; V299-M302 HydrophobicContact CG1-CG 3.86Å; V299-M302 HydrophobicContact CG1-SD 3.61Å; V299-M302 HydrophobicContact CG2-SD 4.04Å; V299-F305 HydrophobicContact CB-CD2 3.99Å; V299-F305 HydrophobicContact CB-CE2 4.01Å; V299-F305 HydrophobicContact CG2-CD2 4.26Å; V299-F305 HydrophobicContact CG2-CE2 3.8Å
300	D	91.2	Very high	79	Confident	51 Å²	51	95 Å²	95	27%	0.273	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	146.4	177.7	-61.9	-30.2	0	0	0	109.7	G247 R249 R298 M302	G247-D300 PolarHBondContact O-N 3Å; R249-D300 IonicContact NE-OD2 3.22Å; R249-D300 PolarHBondContact NE-OD2 3.38Å; R298-D300 IonicContact CZ-OD1 3.83Å; R298-D300 IonicContact NE-OD1 3.19Å; R298-D300 PolarHBondContact NE-OD1 2.84Å; R298-D300 IonicContact NH2-OD1 3.72Å; D300-M302 PolarHBondContact O-N 2.71Å; D300-M302 VanDerWaalsContact O-N 3.15Å
301	D	84.7	Confident	78.2	Confident	162 Å²	162	98.3 Å²	98.3	87%	0.866	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	17.6	-178.8	-57.8	-39.8	0	0	0	117.4
302	M	85	Confident	77.5	Confident	61 Å²	61	106.5 Å²	106.5	30%	0.3	54%	0.536	S	S	.	.			trans	-106.1	122.1	174.1	-71.3	-165.2	81.2	0	0	112.8	L202 V299 D300 Q304 F305 Q306	L202-M302 HydrophobicContact CD2-CE 3.64Å; L202-M302 HydrophobicContact CD2-SD 3.55Å; L202-M302 VanDerWaalsContact CD2-SD 3.55Å; V299-M302 HydrophobicContact CB-CB 4.33Å; V299-M302 HydrophobicContact CB-CG 3.97Å; V299-M302 HydrophobicContact CB-SD 3.58Å; V299-M302 VanDerWaalsContact CB-SD 3.58Å; V299-M302 HydrophobicContact CG1-CG 3.86Å; V299-M302 HydrophobicContact CG1-SD 3.61Å; V299-M302 HydrophobicContact CG2-SD 4.04Å; D300-M302 PolarHBondContact O-N 2.71Å; D300-M302 VanDerWaalsContact O-N 3.15Å; M302-Q304 VanDerWaalsContact C-N 3.25Å; M302-Q304 HydrophobicContact CB-CG 4.48Å; M302-Q304 HydrophobicContact CE-CG 4.5Å; M302-Q304 PolarHBondContact O-N 3.14Å; M302-Q304 VanDerWaalsContact O-N 3.14Å; M302-F305 HydrophobicContact CB-CD2 3.9Å; M302-F305 PolarHBondContact O-N 3.3Å; M302-F305 HydrophobicContact SD-CD2 4.48Å; M302-F305 HydrophobicContact SD-CE2 4.23Å; M302-Q306 PolarHBondContact O-N 2.88Å
303	Y	79.1	Confident	77.1	Confident	197 Å²	197	102.1 Å²	102.1	77%	0.773	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-52	-37.9	-179.5	-68	-79	0	0	0	114.2	F305 Q306	Y303-F305 PolarHBondContact O-N 2.78Å; Y303-F305 VanDerWaalsContact O-N 3.11Å; Y303-Q306 PolarHBondContact O-N 2.86Å; Y303-Q306 VanDerWaalsContact O-N 3.13Å
304	Q	81.9	Confident	76.6	Confident	55 Å²	55	101 Å²	101	26%	0.257	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-65.7	-14.1	-178.8	69.2	-178.2	-16.9	0	0	114.4	L189 M302	L189-Q304 HydrophobicContact CD1-CG 4.49Å; L189-Q304 HydrophobicContact CD2-CB 4.47Å; M302-Q304 VanDerWaalsContact C-N 3.25Å; M302-Q304 HydrophobicContact CB-CG 4.48Å; M302-Q304 HydrophobicContact CE-CG 4.5Å; M302-Q304 PolarHBondContact O-N 3.14Å; M302-Q304 VanDerWaalsContact O-N 3.14Å
305	F	80	Confident	76.5	Confident	16 Å²	16	103 Å²	103	7%	0.07	54%	0.539	C	S	.	.	G	3₁₀ helix	trans	-113.3	4.1	177	-58.1	-69.2	0	0	0	113.1	L184 N186 L189 L202 R298 V299 M302 Y303 V307	L184-F305 HydrophobicContact CB-CZ 3.95Å; L184-F305 HydrophobicContact CD2-CE1 4.37Å; L184-F305 HydrophobicContact CD2-CE2 4.48Å; L184-F305 HydrophobicContact CD2-CZ 4.09Å; L184-F305 HydrophobicContact CG-CZ 4.34Å; L184-F305 WeakPolarHBondContact O-CZ 3.37Å; N186-F305 HydrophobicContact CB-CD1 4.34Å; N186-F305 HydrophobicContact CB-CE1 4.35Å; L189-F305 HydrophobicContact CD1-CD1 4.42Å; L189-F305 HydrophobicContact CD1-CE1 3.56Å; L189-F305 HydrophobicContact CD1-CZ 3.8Å; L202-F305 HydrophobicContact CD2-CE2 4.24Å; R298-F305 HydrophobicContact CB-CB 3.93Å; R298-F305 HydrophobicContact CB-CD1 4.45Å; R298-F305 HydrophobicContact CB-CG 4.18Å; V299-F305 HydrophobicContact CB-CD2 3.99Å; V299-F305 HydrophobicContact CB-CE2 4.01Å; V299-F305 HydrophobicContact CG2-CD2 4.26Å; V299-F305 HydrophobicContact CG2-CE2 3.8Å; M302-F305 HydrophobicContact CB-CD2 3.9Å; M302-F305 PolarHBondContact O-N 3.3Å; M302-F305 HydrophobicContact SD-CD2 4.48Å; M302-F305 HydrophobicContact SD-CE2 4.23Å; Y303-F305 PolarHBondContact O-N 2.78Å; Y303-F305 VanDerWaalsContact O-N 3.11Å; F305-V307 PolarHBondContact O-N 3.07Å
306	Q	73.1	Confident	76.2	Confident	110 Å²	110	100.1 Å²	100.1	51%	0.514	53%	0.532	S	S	.	.			trans	-71.2	124.2	174.4	-74.4	178.5	-22.4	0	0	109.4	M302 Y303	M302-Q306 PolarHBondContact O-N 2.88Å; Y303-Q306 PolarHBondContact O-N 2.86Å; Y303-Q306 VanDerWaalsContact O-N 3.13Å
307	V	63.8	Low	75.7	Confident	125 Å²	125	101.5 Å²	101.5	76%	0.758	54%	0.536	S	S	*	.			trans	-85.1	110.8	169.5	-179.1	0	0	0	0	106.2	F305 V309	F305-V307 PolarHBondContact O-N 3.07Å; V307-V309 PolarHBondContact O-N 2.7Å
308	D	60.7	Low	75.1	Confident	152 Å²	152	106.6 Å²	106.6	81%	0.813	56%	0.56	S	S	*	*			trans	-62.7	107	166.3	-78.8	-35.7	0	0	0	107.2	E310	D308-E310 PolarHBondContact O-N 3.21Å
309	V	61.8	Low	74.6	Confident	122 Å²	122	104.4 Å²	104.4	74%	0.739	56%	0.557	S	S	*	*			trans	-71.2	92.7	170	-178.2	0	0	0	0	105.7	V307 E311	V307-V309 PolarHBondContact O-N 2.7Å; V309-E311 VanDerWaalsContact C-N 3.29Å; V309-E311 PolarHBondContact O-N 3.2Å
310	E	59.7	Low	74.3	Confident	179 Å²	179	109.8 Å²	109.8	84%	0.836	58%	0.58	S	S	*	*			trans	-64.1	98.9	166.4	-143.6	176.6	-173.9	0	0	105.7	D308 E312	D308-E310 PolarHBondContact O-N 3.21Å; E310-E312 PolarHBondContact O-N 2.85Å
311	E	60.1	Low	74.2	Confident	176 Å²	176	111.7 Å²	111.7	82%	0.822	59%	0.586	S	S	*	*			trans	-57.4	108.5	172.2	-71.3	-164.8	167.2	0	0	106.4	V309 G313	V309-E311 VanDerWaalsContact C-N 3.29Å; V309-E311 PolarHBondContact O-N 3.2Å; E311-G313 VanDerWaalsContact C-N 3.29Å; E311-G313 PolarHBondContact O-N 3.14Å
312	E	59	Low	74.4	Confident	195 Å²	195	107 Å²	107	91%	0.911	56%	0.564	S	S	*	*			trans	-57.3	99.1	175.1	-74.2	-169.9	169.4	0	0	107.5	E310 M314	E310-E312 PolarHBondContact O-N 2.85Å; E312-M314 PolarHBondContact O-N 3.37Å
313	G	63.5	Low	74.6	Confident	66 Å²	66	109 Å²	109	68%	0.68	58%	0.575	S	S	*	*			trans	-53.6	136.7	177.1	0	0	0	0	0	109	E311 S315	E311-G313 VanDerWaalsContact C-N 3.29Å; E311-G313 PolarHBondContact O-N 3.14Å; G313-S315 PolarHBondContact O-N 3.1Å; G313-S315 VanDerWaalsContact O-N 3.1Å
314	M	70	Confident	75.3	Confident	83 Å²	83	103 Å²	103	41%	0.409	56%	0.556	S	S	.	*			trans	-44.8	122.9	-179.7	-70	173.1	68.9	0	0	110.2	E312 G316 Q318 L319 T322	E312-M314 PolarHBondContact O-N 3.37Å; M314-G316 PolarHBondContact O-N 3.07Å; M314-Q318 HydrophobicContact CB-CB 4.47Å; M314-Q318 HydrophobicContact CE-CB 4.47Å; M314-Q318 HydrophobicContact CE-CG 3.87Å; M314-L319 HydrophobicContact CB-CD1 4.31Å; M314-L319 HydrophobicContact CB-CG 3.89Å; M314-L319 WeakPolarHBondContact O-CD1 3.31Å; M314-L319 HydrophobicContact SD-CD2 4.43Å; M314-T322 HydrophobicContact CE-CG2 3.69Å
315	S	79.9	Confident	75.8	Confident	74 Å²	74	106.9 Å²	106.9	52%	0.517	57%	0.572	S	S	.	*			trans	-47.4	139.6	177.3	168.5	0	0	0	0	109.9	G313 L317 Q318 L319	G313-S315 PolarHBondContact O-N 3.1Å; G313-S315 VanDerWaalsContact O-N 3.1Å; S315-L317 CarbonylContact O-C 3.56Å; S315-L317 PolarHBondContact O-N 3Å; S315-Q318 WeakPolarHBondContact O-CA 3.39Å; S315-Q318 VanDerWaalsContact O-CB 3.27Å; S315-Q318 WeakPolarHBondContact O-CB 3.46Å; S315-Q318 PolarHBondContact O-N 2.66Å; S315-L319 PolarHBondContact O-N 3.3Å
316	G	76.9	Confident	76.3	Confident	57 Å²	57	108.9 Å²	108.9	59%	0.588	59%	0.588	S	S	*	*	H	α-helix	trans	-52.8	-27.5	-177.4	0	0	0	0	0	113.6	M314 F320	M314-G316 PolarHBondContact O-N 3.07Å; G316-F320 WeakPolarHBondContact O-CB 3.33Å; G316-F320 PolarHBondContact O-N 3.05Å
317	L	78.7	Confident	77.3	Confident	114 Å²	114	108.8 Å²	108.8	60%	0.597	59%	0.59	S	S	*	*	H	α-helix	trans	-69.6	-41.2	172.6	-157.9	88.2	0	0	0	112.4	S315 F320 F321	S315-L317 CarbonylContact O-C 3.56Å; S315-L317 PolarHBondContact O-N 3Å; L317-F320 WeakPolarHBondContact O-CB 3.47Å; L317-F320 PolarHBondContact O-N 3.33Å; L317-F321 HydrophobicContact CD1-CE2 4.35Å; L317-F321 HydrophobicContact CD2-CD2 4.34Å; L317-F321 HydrophobicContact CD2-CE2 3.79Å; L317-F321 HydrophobicContact CG-CD2 4.04Å; L317-F321 HydrophobicContact CG-CE2 3.68Å; L317-F321 WeakPolarHBondContact O-CD2 3.28Å; L317-F321 PolarHBondContact O-N 2.88Å
318	Q	80.7	Confident	78.8	Confident	108 Å²	108	107.2 Å²	107.2	51%	0.505	58%	0.577	S	S	.	*	H	α-helix	trans	-67.5	-41.9	177.2	-163.3	176.7	-9.5	0	0	110.9	M314 S315 F320 F321 T322	M314-Q318 HydrophobicContact CB-CB 4.47Å; M314-Q318 HydrophobicContact CE-CB 4.47Å; M314-Q318 HydrophobicContact CE-CG 3.87Å; S315-Q318 WeakPolarHBondContact O-CA 3.39Å; S315-Q318 VanDerWaalsContact O-CB 3.27Å; S315-Q318 WeakPolarHBondContact O-CB 3.46Å; S315-Q318 PolarHBondContact O-N 2.66Å; Q318-F320 VanDerWaalsContact C-N 3.33Å; Q318-F320 PolarHBondContact O-N 3.15Å; Q318-F321 PolarHBondContact O-N 2.9Å; Q318-T322 WeakPolarHBondContact O-CG2 3.49Å; Q318-T322 PolarHBondContact O-N 3.24Å; Q318-T322 PolarHBondContact O-OG1 3.45Å
319	L	83.6	Confident	80.3	Confident	82 Å²	82	101.5 Å²	101.5	43%	0.429	55%	0.554	S	S	.	*	H	α-helix	trans	-60.4	-40.6	170.9	-87.7	163.4	0	0	0	112.5	M314 S315 T322 L323	M314-L319 HydrophobicContact CB-CD1 4.31Å; M314-L319 HydrophobicContact CB-CG 3.89Å; M314-L319 WeakPolarHBondContact O-CD1 3.31Å; M314-L319 HydrophobicContact SD-CD2 4.43Å; S315-L319 PolarHBondContact O-N 3.3Å; L319-T322 WeakPolarHBondContact CA-OG1 3.3Å; L319-T322 PolarHBondContact O-OG1 2.89Å; L319-L323 WeakPolarHBondContact O-CB 3.5Å; L319-L323 PolarHBondContact O-N 3.47Å
320	F	86.7	Confident	81.8	Confident	121 Å²	121	101.4 Å²	101.4	53%	0.531	55%	0.549	S	S	.	.	H	α-helix	trans	-63.4	-47.7	176.9	176.3	-98.8	0	0	0	111.7	G316 L317 Q318 L323 L324	G316-F320 WeakPolarHBondContact O-CB 3.33Å; G316-F320 PolarHBondContact O-N 3.05Å; L317-F320 WeakPolarHBondContact O-CB 3.47Å; L317-F320 PolarHBondContact O-N 3.33Å; Q318-F320 VanDerWaalsContact C-N 3.33Å; Q318-F320 PolarHBondContact O-N 3.15Å; F320-L323 PolarHBondContact O-N 2.87Å; F320-L324 HydrophobicContact CZ-CD1 4.49Å; F320-L324 WeakPolarHBondContact O-CB 3.29Å; F320-L324 PolarHBondContact O-N 3.34Å
321	F	90.1	Very high	83.3	Confident	91 Å²	91	95.6 Å²	95.6	40%	0.399	53%	0.528	S	S	.	.	H	α-helix	trans	-67.2	-39.1	179.4	-76.2	-60.8	0	0	0	112.6	L317 Q318 L323 L324 F325	L317-F321 HydrophobicContact CD1-CE2 4.35Å; L317-F321 HydrophobicContact CD2-CD2 4.34Å; L317-F321 HydrophobicContact CD2-CE2 3.79Å; L317-F321 HydrophobicContact CG-CD2 4.04Å; L317-F321 HydrophobicContact CG-CE2 3.68Å; L317-F321 WeakPolarHBondContact O-CD2 3.28Å; L317-F321 PolarHBondContact O-N 2.88Å; Q318-F321 PolarHBondContact O-N 2.9Å; F321-L323 PolarHBondContact O-N 3.2Å; F321-L324 HydrophobicContact CD1-CD2 4.36Å; F321-L324 PolarHBondContact O-N 3.11Å; F321-F325 HydrophobicContact CB-CD2 4.32Å; F321-F325 HydrophobicContact CB-CE2 4.19Å; F321-F325 HydrophobicContact CD1-CE2 4.18Å; F321-F325 WeakPolarHBondContact O-CD2 3.42Å; F321-F325 PolarHBondContact O-N 2.86Å
322	T	87.6	Confident	84.9	Confident	64 Å²	64	91.4 Å²	91.4	39%	0.393	51%	0.514	S	S	.	.	H	α-helix	trans	-64.9	-39.6	176.1	52.8	0	0	0	0	112.2	M314 Q318 L319 S326	M314-T322 HydrophobicContact CE-CG2 3.69Å; Q318-T322 WeakPolarHBondContact O-CG2 3.49Å; Q318-T322 PolarHBondContact O-N 3.24Å; Q318-T322 PolarHBondContact O-OG1 3.45Å; L319-T322 WeakPolarHBondContact CA-OG1 3.3Å; L319-T322 PolarHBondContact O-OG1 2.89Å; T322-S326 WeakPolarHBondContact O-CB 3.49Å; T322-S326 PolarHBondContact O-N 3.3Å; T322-S326 PolarHBondContact O-OG 3.49Å; T322-S326 VanDerWaalsContact O-OG 3.04Å
323	L	89.9	Confident	86.5	Confident	103 Å²	103	87.9 Å²	87.9	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-44.8	172.6	-85.4	165.5	0	0	0	112.2	L319 F320 F321 F325 S326 I327	L319-L323 WeakPolarHBondContact O-CB 3.5Å; L319-L323 PolarHBondContact O-N 3.47Å; F320-L323 PolarHBondContact O-N 2.87Å; F321-L323 PolarHBondContact O-N 3.2Å; L323-F325 PolarHBondContact O-N 3.02Å; L323-S326 WeakPolarHBondContact CA-OG 3.16Å; L323-S326 PolarHBondContact O-N 2.74Å; L323-S326 PolarHBondContact O-OG 3.45Å; L323-I327 VanDerWaalsContact O-CG1 3.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.28Å; L323-I327 PolarHBondContact O-N 3.34Å
324	L	92.8	Very high	87.9	Confident	69 Å²	69	87.3 Å²	87.3	36%	0.361	49%	0.49	S	S	.	.	H	α-helix	trans	-58	-50.5	178.1	-173.7	87.5	0	0	0	111.7	F320 F321 I327 L328	F320-L324 HydrophobicContact CZ-CD1 4.49Å; F320-L324 WeakPolarHBondContact O-CB 3.29Å; F320-L324 PolarHBondContact O-N 3.34Å; F321-L324 HydrophobicContact CD1-CD2 4.36Å; F321-L324 PolarHBondContact O-N 3.11Å; L324-I327 PolarHBondContact O-N 2.85Å; L324-L328 HydrophobicContact CD2-CD1 4.42Å; L324-L328 HydrophobicContact CG-CD1 4.11Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 WeakPolarHBondContact O-CG 3.26Å; L324-L328 PolarHBondContact O-N 3.16Å
325	F	92.9	Very high	89	Confident	137 Å²	137	87.3 Å²	87.3	60%	0.601	49%	0.494	S	S	*	.	H	α-helix	trans	-69.3	-33.6	-178	-72.3	-58.9	0	0	0	112.8	F321 L323 G329	F321-F325 HydrophobicContact CB-CD2 4.32Å; F321-F325 HydrophobicContact CB-CE2 4.19Å; F321-F325 HydrophobicContact CD1-CE2 4.18Å; F321-F325 WeakPolarHBondContact O-CD2 3.42Å; F321-F325 PolarHBondContact O-N 2.86Å; L323-F325 PolarHBondContact O-N 3.02Å; F325-G329 PolarHBondContact O-N 2.59Å
326	S	91.4	Very high	89.6	Confident	58 Å²	58	87.1 Å²	87.1	41%	0.406	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-41.6	175	63.1	0	0	0	0	112.4	T322 L323 G329 L330	T322-S326 WeakPolarHBondContact O-CB 3.49Å; T322-S326 PolarHBondContact O-N 3.3Å; T322-S326 PolarHBondContact O-OG 3.49Å; T322-S326 VanDerWaalsContact O-OG 3.04Å; L323-S326 WeakPolarHBondContact CA-OG 3.16Å; L323-S326 PolarHBondContact O-N 2.74Å; L323-S326 PolarHBondContact O-OG 3.45Å; S326-G329 PolarHBondContact O-N 3.44Å; S326-L330 WeakPolarHBondContact O-CB 3.28Å; S326-L330 WeakPolarHBondContact O-CG 3.3Å; S326-L330 PolarHBondContact O-N 3.27Å
327	I	94.1	Very high	90.4	Very high	109 Å²	109	86.2 Å²	86.2	56%	0.559	48%	0.48	S	S	*	.	H	α-helix	trans	-64.9	-45	175.8	-67.9	167.9	0	0	0	110.6	L323 L324 G329 L330 S331	L323-I327 VanDerWaalsContact O-CG1 3.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.28Å; L323-I327 PolarHBondContact O-N 3.34Å; L324-I327 PolarHBondContact O-N 2.85Å; I327-G329 PolarHBondContact O-N 2.98Å; I327-L330 PolarHBondContact O-N 2.79Å; I327-S331 WeakPolarHBondContact O-CB 3.46Å; I327-S331 PolarHBondContact O-N 3.16Å
328	L	94.1	Very high	91	Very high	91 Å²	91	87 Å²	87	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-45.7	175.6	-76.2	168.3	0	0	0	111.1	L324 L330 S331 V332	L324-L328 HydrophobicContact CD2-CD1 4.42Å; L324-L328 HydrophobicContact CG-CD1 4.11Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 WeakPolarHBondContact O-CG 3.26Å; L324-L328 PolarHBondContact O-N 3.16Å; L328-L330 PolarHBondContact O-N 3.09Å; L328-S331 PolarHBondContact O-N 3.46Å; L328-S331 PolarHBondContact O-OG 3.48Å; L328-V332 WeakPolarHBondContact O-CG2 3.32Å; L328-V332 PolarHBondContact O-N 3.32Å
329	G	93	Very high	91.5	Very high	33 Å²	33	85.5 Å²	85.5	34%	0.34	48%	0.481	S	S	.	.	H	α-helix	trans	-58.1	-46.3	175.7	0	0	0	0	0	113	F325 S326 I327 S331 V332 L333	F325-G329 PolarHBondContact O-N 2.59Å; S326-G329 PolarHBondContact O-N 3.44Å; I327-G329 PolarHBondContact O-N 2.98Å; G329-S331 PolarHBondContact O-N 3.21Å; G329-V332 PolarHBondContact O-N 3.38Å; G329-L333 WeakPolarHBondContact O-CG 3.27Å; G329-L333 PolarHBondContact O-N 3.32Å
330	L	93.3	Very high	91.7	Very high	119 Å²	119	86.6 Å²	86.6	62%	0.623	49%	0.487	S	S	*	.	H	α-helix	trans	-63.8	-39.3	176.9	-76.3	169.2	0	0	0	112.4	S326 I327 L328 V332 L333 A334	S326-L330 WeakPolarHBondContact O-CB 3.28Å; S326-L330 WeakPolarHBondContact O-CG 3.3Å; S326-L330 PolarHBondContact O-N 3.27Å; I327-L330 PolarHBondContact O-N 2.79Å; L328-L330 PolarHBondContact O-N 3.09Å; L330-V332 PolarHBondContact O-N 2.83Å; L330-L333 PolarHBondContact O-N 2.86Å; L330-A334 WeakPolarHBondContact O-CB 3.3Å; L330-A334 PolarHBondContact O-N 3.36Å
331	S	90.8	Very high	91.9	Very high	58 Å²	58	87.4 Å²	87.4	41%	0.406	49%	0.487	S	S	.	.	H	α-helix	trans	-63.3	-41.9	177.2	76.5	0	0	0	0	112	I327 L328 G329 A334 V335	I327-S331 WeakPolarHBondContact O-CB 3.46Å; I327-S331 PolarHBondContact O-N 3.16Å; L328-S331 PolarHBondContact O-N 3.46Å; L328-S331 PolarHBondContact O-OG 3.48Å; G329-S331 PolarHBondContact O-N 3.21Å; S331-A334 PolarHBondContact O-N 3.45Å; S331-V335 WeakPolarHBondContact O-CG2 3.47Å; S331-V335 PolarHBondContact O-N 2.84Å
332	V	93.8	Very high	91.7	Very high	88 Å²	88	84.6 Å²	84.6	53%	0.533	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-44.5	176.2	173.6	0	0	0	0	110.4	L328 G329 L330 A334 V335 V336	L328-V332 WeakPolarHBondContact O-CG2 3.32Å; L328-V332 PolarHBondContact O-N 3.32Å; G329-V332 PolarHBondContact O-N 3.38Å; L330-V332 PolarHBondContact O-N 2.83Å; V332-A334 VanDerWaalsContact C-N 3.33Å; V332-A334 PolarHBondContact O-N 3.48Å; V332-V335 PolarHBondContact O-N 3.23Å; V332-V336 HydrophobicContact CG1-CG2 4.34Å; V332-V336 VanDerWaalsContact O-CG2 3.32Å; V332-V336 WeakPolarHBondContact O-CG2 3.48Å; V332-V336 PolarHBondContact O-N 2.8Å
333	L	93.3	Very high	91.5	Very high	120 Å²	120	89.6 Å²	89.6	63%	0.628	50%	0.495	S	S	*	.	H	α-helix	trans	-61.2	-39.8	176.7	-73.4	172.5	0	0	0	112.5	G329 L330 V336 G337	G329-L333 WeakPolarHBondContact O-CG 3.27Å; G329-L333 PolarHBondContact O-N 3.32Å; L330-L333 PolarHBondContact O-N 2.86Å; L333-V336 PolarHBondContact O-N 3.43Å; L333-G337 PolarHBondContact O-N 2.87Å
334	A	92.9	Very high	91.1	Very high	55 Å²	55	91.2 Å²	91.2	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-42.3	176	0	0	0	0	0	112.1	L330 S331 V332 G337 M338	L330-A334 WeakPolarHBondContact O-CB 3.3Å; L330-A334 PolarHBondContact O-N 3.36Å; S331-A334 PolarHBondContact O-N 3.45Å; V332-A334 VanDerWaalsContact C-N 3.33Å; V332-A334 PolarHBondContact O-N 3.48Å; A334-G337 PolarHBondContact O-N 2.85Å; A334-M338 PolarHBondContact O-N 3.28Å
335	V	92.8	Very high	90.5	Very high	82 Å²	82	92.4 Å²	92.4	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-47.1	176.7	172.7	0	0	0	0	110.9	S331 V332 G337 M338 V339	S331-V335 WeakPolarHBondContact O-CG2 3.47Å; S331-V335 PolarHBondContact O-N 2.84Å; V332-V335 PolarHBondContact O-N 3.23Å; V335-G337 VanDerWaalsContact C-N 3.31Å; V335-G337 PolarHBondContact O-N 2.83Å; V335-M338 PolarHBondContact O-N 3.46Å; V335-V339 WeakPolarHBondContact O-CG2 2.87Å; V335-V339 PolarHBondContact O-N 3.38Å
336	V	93.1	Very high	89.7	Confident	71 Å²	71	91.8 Å²	91.8	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-60.2	-44	176	172.4	0	0	0	0	110.4	V332 L333 M338 V339 L340	V332-V336 HydrophobicContact CG1-CG2 4.34Å; V332-V336 VanDerWaalsContact O-CG2 3.32Å; V332-V336 WeakPolarHBondContact O-CG2 3.48Å; V332-V336 PolarHBondContact O-N 2.8Å; L333-V336 PolarHBondContact O-N 3.43Å; V336-M338 PolarHBondContact O-N 2.91Å; V336-V339 PolarHBondContact O-N 2.9Å; V336-L340 HydrophobicContact CG1-CD1 3.83Å; V336-L340 HydrophobicContact CG1-CG 4.27Å; V336-L340 WeakPolarHBondContact O-CB 3.48Å; V336-L340 VanDerWaalsContact O-CG 3.29Å; V336-L340 WeakPolarHBondContact O-CG 3.26Å; V336-L340 PolarHBondContact O-N 2.93Å
337	G	92.6	Very high	88.7	Confident	37 Å²	37	93.9 Å²	93.9	38%	0.381	50%	0.502	S	S	.	.	H	α-helix	trans	-58.2	-45.2	175.1	0	0	0	0	0	112.8	L333 A334 V335 L340 Y341	L333-G337 PolarHBondContact O-N 2.87Å; A334-G337 PolarHBondContact O-N 2.85Å; V335-G337 VanDerWaalsContact C-N 3.31Å; V335-G337 PolarHBondContact O-N 2.83Å; G337-L340 PolarHBondContact O-N 3.41Å; G337-Y341 WeakPolarHBondContact O-CB 3.46Å; G337-Y341 PolarHBondContact O-N 2.96Å
338	M	91.2	Very high	87.4	Confident	131 Å²	131	94.1 Å²	94.1	65%	0.645	50%	0.499	S	S	*	.	H	α-helix	trans	-63.6	-42.7	175.8	-82.2	-167	-73.1	0	0	112.6	A334 V335 V336 Y341 G342	A334-M338 PolarHBondContact O-N 3.28Å; V335-M338 PolarHBondContact O-N 3.46Å; V336-M338 PolarHBondContact O-N 2.91Å; M338-Y341 PolarHBondContact O-N 3.37Å; M338-G342 PolarHBondContact O-N 2.93Å
339	V	90.6	Very high	85.8	Confident	76 Å²	76	98.1 Å²	98.1	46%	0.461	51%	0.508	S	S	.	.	H	α-helix	trans	-65.1	-44.6	178.4	171.6	0	0	0	0	110.9	V335 V336 G342 R343	V335-V339 WeakPolarHBondContact O-CG2 2.87Å; V335-V339 PolarHBondContact O-N 3.38Å; V336-V339 PolarHBondContact O-N 2.9Å; V339-G342 PolarHBondContact O-N 2.95Å; V339-R343 WeakPolarHBondContact O-CG 3.43Å; V339-R343 PolarHBondContact O-N 3.47Å
340	L	88.9	Confident	84.1	Confident	106 Å²	106	104 Å²	104	56%	0.555	52%	0.524	S	S	*	.	H	α-helix	trans	-65	-41.7	176.7	-70.2	176.5	0	0	0	111.6	V336 G337 R343 W344	V336-L340 HydrophobicContact CG1-CD1 3.83Å; V336-L340 HydrophobicContact CG1-CG 4.27Å; V336-L340 WeakPolarHBondContact O-CB 3.48Å; V336-L340 VanDerWaalsContact O-CG 3.29Å; V336-L340 WeakPolarHBondContact O-CG 3.26Å; V336-L340 PolarHBondContact O-N 2.93Å; G337-L340 PolarHBondContact O-N 3.41Å; L340-R343 PolarHBondContact O-N 3.14Å; L340-W344 WeakPolarHBondContact O-CB 3.14Å; L340-W344 PolarHBondContact O-N 3.49Å
341	Y	89.7	Confident	82.3	Confident	138 Å²	138	108.9 Å²	108.9	54%	0.541	53%	0.534	S	S	.	.	H	α-helix	trans	-63.6	-41.5	175.4	-178.9	-99.7	0	0	0	112.1	G337 M338 W344 K345	G337-Y341 WeakPolarHBondContact O-CB 3.46Å; G337-Y341 PolarHBondContact O-N 2.96Å; M338-Y341 PolarHBondContact O-N 3.37Å; Y341-W344 HydrophobicContact CD2-CE3 4.39Å; Y341-W344 HydrophobicContact CE2-CE3 4.25Å; Y341-W344 HydrophobicContact CE2-CZ3 4.21Å; Y341-W344 PolarHBondContact O-N 3.17Å; Y341-K345 HydrophobicContact CE1-CD 4.37Å; Y341-K345 WeakPolarHBondContact O-CB 3.36Å; Y341-K345 PolarHBondContact O-N 2.95Å
342	G	87.4	Confident	80.6	Confident	31 Å²	31	114.6 Å²	114.6	32%	0.32	55%	0.552	S	S	.	*	H	α-helix	trans	-59.4	-50.5	174.4	0	0	0	0	0	112	M338 V339 W344 K345 E346	M338-G342 PolarHBondContact O-N 2.93Å; V339-G342 PolarHBondContact O-N 2.95Å; G342-W344 VanDerWaalsContact C-N 3.32Å; G342-W344 PolarHBondContact O-N 3.27Å; G342-K345 PolarHBondContact O-N 3.32Å; G342-E346 PolarHBondContact O-N 3.21Å
343	R	83.3	Confident	78.4	Confident	170 Å²	170	124 Å²	124	64%	0.642	58%	0.58	S	S	*	*	H	α-helix	trans	-60.6	-40	176.1	-74.9	-174.7	175.5	-177.3	0.4	112.5	V339 L340 N347	V339-R343 WeakPolarHBondContact O-CG 3.43Å; V339-R343 PolarHBondContact O-N 3.47Å; L340-R343 PolarHBondContact O-N 3.14Å; R343-N347 PolarHBondContact O-N 3.18Å; R343-N347 VanDerWaalsContact O-N 3.1Å
344	W	80.6	Confident	77.6	Confident	137 Å²	137	124.3 Å²	124.3	52%	0.519	58%	0.578	S	S	.	*	H	α-helix	trans	-64.8	-43.8	176.4	179.7	83.7	0	0	0	112.1	L340 Y341 G342 E346 N347 K348	L340-W344 WeakPolarHBondContact O-CB 3.14Å; L340-W344 PolarHBondContact O-N 3.49Å; Y341-W344 HydrophobicContact CD2-CE3 4.39Å; Y341-W344 HydrophobicContact CE2-CE3 4.25Å; Y341-W344 HydrophobicContact CE2-CZ3 4.21Å; Y341-W344 PolarHBondContact O-N 3.17Å; G342-W344 VanDerWaalsContact C-N 3.32Å; G342-W344 PolarHBondContact O-N 3.27Å; W344-E346 PolarHBondContact O-N 2.95Å; W344-N347 PolarHBondContact O-N 3.23Å; W344-K348 HydrophobicContact CH2-CD 3.74Å; W344-K348 HydrophobicContact CZ2-CD 3.79Å; W344-K348 HydrophobicContact CZ3-CD 4.22Å; W344-K348 WeakPolarHBondContact O-CB 3.35Å; W344-K348 PolarHBondContact O-N 3.45Å
345	K	81.3	Confident	76.8	Confident	94 Å²	94	127.9 Å²	127.9	41%	0.409	58%	0.584	S	S	.	*	H	α-helix	trans	-63.3	-40.4	178.7	-173.4	176.2	-179.4	176.5	0	112.4	Y341 G342 K348 R349	Y341-K345 HydrophobicContact CE1-CD 4.37Å; Y341-K345 WeakPolarHBondContact O-CB 3.36Å; Y341-K345 PolarHBondContact O-N 2.95Å; G342-K345 PolarHBondContact O-N 3.32Å; K345-K348 PolarHBondContact O-N 3.28Å; K345-R349 PolarHBondContact O-N 2.94Å; K345-R349 VanDerWaalsContact O-N 3.13Å
346	E	76.1	Confident	75.9	Confident	124 Å²	124	130.4 Å²	130.4	58%	0.579	59%	0.589	S	S	*	*	H	α-helix	trans	-65.2	-44.7	174.3	-76.7	-174.1	163.8	0	0	112.4	G342 W344 K348 R349 K350	G342-E346 PolarHBondContact O-N 3.21Å; W344-E346 PolarHBondContact O-N 2.95Å; E346-K348 VanDerWaalsContact C-N 3.27Å; E346-K348 PolarHBondContact O-N 3.2Å; E346-R349 PolarHBondContact O-N 3.33Å; E346-K350 WeakPolarHBondContact O-CG 3.31Å; E346-K350 PolarHBondContact O-N 3.01Å; E346-K350 VanDerWaalsContact O-N 3.16Å
347	N	70.9	Confident	74.9	Confident	102 Å²	102	133.9 Å²	133.9	55%	0.545	60%	0.598	S	S	.	*	H	α-helix	trans	-63.6	-32	176.4	-83.9	-8.3	0	0	0	112.8	R343 W344	R343-N347 PolarHBondContact O-N 3.18Å; R343-N347 VanDerWaalsContact O-N 3.1Å; W344-N347 PolarHBondContact O-N 3.23Å
348	K	65.9	Low	73.8	Confident	114 Å²	114	140 Å²	140	50%	0.496	61%	0.612	S	S	.	*	H	α-helix	trans	-73	-34	176.1	-151.6	177.6	-174.7	-179	0	112.4	W344 K345 E346	W344-K348 HydrophobicContact CH2-CD 3.74Å; W344-K348 HydrophobicContact CZ2-CD 3.79Å; W344-K348 HydrophobicContact CZ3-CD 4.22Å; W344-K348 WeakPolarHBondContact O-CB 3.35Å; W344-K348 PolarHBondContact O-N 3.45Å; K345-K348 PolarHBondContact O-N 3.28Å; E346-K348 VanDerWaalsContact C-N 3.27Å; E346-K348 PolarHBondContact O-N 3.2Å
349	R	60.9	Low	72.7	Confident	175 Å²	175	140.6 Å²	140.6	66%	0.66	61%	0.61	S	S	*	*	H	α-helix	trans	-69.7	-30.7	174.6	-77.3	-178.6	179.2	-176.2	-2.9	113.1	K345 E346 R351	K345-R349 PolarHBondContact O-N 2.94Å; K345-R349 VanDerWaalsContact O-N 3.13Å; E346-R349 PolarHBondContact O-N 3.33Å; R349-R351 PolarHBondContact O-N 3.35Å
350	K	56.4	Low	71.4	Confident	157 Å²	157	145.2 Å²	145.2	68%	0.683	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-4.3	177.6	-69.4	178.9	-177.7	177.7	0	114.9	E346	E346-K350 WeakPolarHBondContact O-CG 3.31Å; E346-K350 PolarHBondContact O-N 3.01Å; E346-K350 VanDerWaalsContact O-N 3.16Å
351	R	56.9	Low	70	Confident	220 Å²	220	148.2 Å²	148.2	83%	0.83	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	3.6	177.4	-73.1	-172.7	-175.1	178.8	1.1	114.5	R349	R349-R351 PolarHBondContact O-N 3.35Å
352	F	53.5	Low	68.4	Low	179 Å²	179	149.1 Å²	149.1	79%	0.785	63%	0.632	S	S	*	*			trans	-118	16.9	-177.5	-84.6	-76.2	0	0	0	114.2
353	Y	47.4	Very low	66.6	Low	286 Å²	286	159.8 Å²	159.8	100%	1.122	66%	0.661	S	S	*	*			trans	-119.2	0	166	-82.6	-77.5	0	0	0	110.3

Retrieved 353 of 353 residues in 291.8 ms (Link to these results)

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