A0A3Q0KJZ9_SCHMA Loading...

Pleiotropic regulator 1 AlphaSync

Involved in pre-mRNA splicing as component of the spliceosome. Component of the PRP19-CDC5L complex that forms an integral part of the spliceosome and is required for activating pre-mRNA splicing. As a component of the minor spliceosome, involved in the splicing of U12-type introns in pre-mRNAs.

AlphaFold DB , UniProt , Accession A0A3Q0KJZ9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 442 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	42.6	Very low	62.7	Low	234 Å²	234	141.6 Å²	141.6	100%	1.153	72%	0.717	S	S	*	*				0	112.7	0	-71.5	-178.8	-165.7	0	0	106.9	V3	M1-V3 PolarHBondContact O-N 3.39Å
2	E	46	Very low	64.1	Low	188 Å²	188	138.8 Å²	138.8	88%	0.879	70%	0.704	S	S	*	*			trans	-62.3	129.4	175	-74.4	-178.5	153.9	0	0	109.4	V4	E2-V4 PolarHBondContact O-N 2.99Å
3	V	46.4	Very low	65.3	Low	141 Å²	141	133.8 Å²	133.8	86%	0.855	69%	0.685	S	S	*	*			trans	-74.8	95.2	-177.2	-179.5	0	0	0	0	107.9	M1 Q5	M1-V3 PolarHBondContact O-N 3.39Å; V3-Q5 PolarHBondContact O-N 3.1Å; V3-Q5 VanDerWaalsContact O-N 3.1Å
4	V	56.1	Low	66.4	Low	124 Å²	124	133.6 Å²	133.6	75%	0.752	68%	0.677	S	S	*	*			trans	-67.8	108.9	176.5	-178.1	0	0	0	0	108.7	E2 R6	E2-V4 PolarHBondContact O-N 2.99Å; V4-R6 PolarHBondContact O-N 3.08Å; V4-R6 VanDerWaalsContact O-N 3.08Å
5	Q	63.9	Low	67.3	Low	157 Å²	157	136.2 Å²	136.2	73%	0.734	68%	0.675	S	S	*	*			trans	-67.4	107.4	179.4	-155.5	167.8	13.5	0	0	109.4	V3 H7	V3-Q5 PolarHBondContact O-N 3.1Å; V3-Q5 VanDerWaalsContact O-N 3.1Å; Q5-H7 PolarHBondContact O-N 2.89Å; Q5-H7 PolarHBondContact O-ND1 2.98Å
6	R	56.1	Low	68.1	Low	246 Å²	246	131.8 Å²	131.8	93%	0.928	66%	0.662	S	S	*	*			trans	-67.1	98.4	-178.8	-69.5	-174.6	178.8	179	-0.1	109.9	V4	V4-R6 PolarHBondContact O-N 3.08Å; V4-R6 VanDerWaalsContact O-N 3.08Å
7	H	66.8	Low	68.9	Low	89 Å²	89	130.3 Å²	130.3	41%	0.412	66%	0.655	S	S	.	*			trans	-78.4	146.3	170.2	-71.1	68.1	0	0	0	109.6	Q5	Q5-H7 PolarHBondContact O-N 2.89Å; Q5-H7 PolarHBondContact O-ND1 2.98Å
8	S	79.4	Confident	69.5	Low	67 Å²	67	130.6 Å²	130.6	47%	0.469	65%	0.652	S	S	.	*			trans	-63.1	147.1	177.2	96.7	0	0	0	0	110.3	H10 T11 L12	S8-H10 PolarHBondContact O-N 3.05Å; S8-H10 VanDerWaalsContact O-N 3.15Å; S8-H10 PolarHBondContact OG-N 3.48Å; S8-T11 WeakPolarHBondContact O-CB 3.47Å; S8-T11 PolarHBondContact O-N 3.38Å; S8-T11 PolarHBondContact OG-N 3.16Å; S8-T11 PolarHBondContact OG-OG1 2.95Å; S8-T11 VanDerWaalsContact OG-OG1 3.05Å; S8-L12 PolarHBondContact O-N 2.9Å; S8-L12 VanDerWaalsContact O-N 3.16Å
9	V	74.6	Confident	69.8	Low	115 Å²	115	134 Å²	134	70%	0.697	66%	0.656	S	S	*	*	H	α-helix	trans	-53.3	-37.4	179.4	177.8	0	0	0	0	110.9	T11 L12 V13	V9-T11 PolarHBondContact O-N 3.26Å; V9-L12 PolarHBondContact O-N 3.39Å; V9-V13 HydrophobicContact CG1-CG2 4.33Å; V9-V13 VanDerWaalsContact O-CG2 3.31Å; V9-V13 WeakPolarHBondContact O-CG2 3.43Å; V9-V13 PolarHBondContact O-N 3.02Å
10	H	75.6	Confident	70	Confident	132 Å²	132	130.5 Å²	130.5	61%	0.611	64%	0.643	S	S	*	*	H	α-helix	trans	-63.7	-39.9	178.6	-157.6	-94.2	0	0	0	112.3	S8 V13 F14	S8-H10 PolarHBondContact O-N 3.05Å; S8-H10 VanDerWaalsContact O-N 3.15Å; S8-H10 PolarHBondContact OG-N 3.48Å; H10-V13 PolarHBondContact O-N 2.97Å; H10-F14 AromaticContact CE1-CD2 3.58Å; H10-F14 AromaticContact CE1-CE2 3.21Å; H10-F14 WeakPolarHBondContact CE1-CE2 3.29Å; H10-F14 AromaticContact ND1-CD2 3.61Å; H10-F14 AromaticContact ND1-CE2 3.75Å; H10-F14 AromaticContact NE2-CE2 3.86Å; H10-F14 PolarHBondContact O-N 3.15Å
11	T	82.6	Confident	70.2	Confident	65 Å²	65	129.1 Å²	129.1	40%	0.399	64%	0.635	S	S	.	*	H	α-helix	trans	-68.4	-36.2	177.2	-41.7	0	0	0	0	111.7	S8 V9 R15	S8-T11 WeakPolarHBondContact O-CB 3.47Å; S8-T11 PolarHBondContact O-N 3.38Å; S8-T11 PolarHBondContact OG-N 3.16Å; S8-T11 PolarHBondContact OG-OG1 2.95Å; S8-T11 VanDerWaalsContact OG-OG1 3.05Å; V9-T11 PolarHBondContact O-N 3.26Å; T11-R15 WeakPolarHBondContact O-CB 3.31Å; T11-R15 PolarHBondContact O-N 3.45Å
12	L	78.9	Confident	71.5	Confident	108 Å²	108	122.1 Å²	122.1	57%	0.565	60%	0.602	S	S	*	*	H	α-helix	trans	-67.3	-42.7	175.4	-99.7	154.9	0	0	0	112.2	S8 V9 R15 S16	S8-L12 PolarHBondContact O-N 2.9Å; S8-L12 VanDerWaalsContact O-N 3.16Å; V9-L12 PolarHBondContact O-N 3.39Å; L12-R15 PolarHBondContact O-N 3.21Å; L12-S16 PolarHBondContact O-N 3.48Å
13	V	79.5	Confident	72.5	Confident	74 Å²	74	119.5 Å²	119.5	45%	0.448	59%	0.591	S	S	.	*	H	α-helix	trans	-64.7	-45.5	176.1	172.6	0	0	0	0	110.8	V9 H10 R15 S16 L17	V9-V13 HydrophobicContact CG1-CG2 4.33Å; V9-V13 VanDerWaalsContact O-CG2 3.31Å; V9-V13 WeakPolarHBondContact O-CG2 3.43Å; V9-V13 PolarHBondContact O-N 3.02Å; H10-V13 PolarHBondContact O-N 2.97Å; V13-R15 VanDerWaalsContact C-N 3.33Å; V13-R15 PolarHBondContact O-N 3.28Å; V13-S16 PolarHBondContact O-N 3.5Å; V13-S16 PolarHBondContact O-OG 2.88Å; V13-L17 VanDerWaalsContact O-CB 3.25Å; V13-L17 WeakPolarHBondContact O-CB 3.29Å; V13-L17 PolarHBondContact O-N 3.24Å
14	F	81.7	Confident	73.3	Confident	131 Å²	131	119.9 Å²	119.9	58%	0.575	58%	0.582	S	S	*	*	H	α-helix	trans	-63.4	-38	176.3	-98.3	-85.5	0	0	0	112.8	H10 K18	H10-F14 AromaticContact CE1-CD2 3.58Å; H10-F14 AromaticContact CE1-CE2 3.21Å; H10-F14 WeakPolarHBondContact CE1-CE2 3.29Å; H10-F14 AromaticContact ND1-CD2 3.61Å; H10-F14 AromaticContact ND1-CE2 3.75Å; H10-F14 AromaticContact NE2-CE2 3.86Å; H10-F14 PolarHBondContact O-N 3.15Å; F14-K18 WeakPolarHBondContact O-CB 3.12Å; F14-K18 PolarHBondContact O-N 3.15Å
15	R	79.1	Confident	73.4	Confident	172 Å²	172	120.1 Å²	120.1	65%	0.649	58%	0.575	S	S	*	*	H	α-helix	trans	-66	-41.6	174.2	-108.3	-178.2	170.3	163	-1.7	112	T11 L12 V13 R19	T11-R15 WeakPolarHBondContact O-CB 3.31Å; T11-R15 PolarHBondContact O-N 3.45Å; L12-R15 PolarHBondContact O-N 3.21Å; V13-R15 VanDerWaalsContact C-N 3.33Å; V13-R15 PolarHBondContact O-N 3.28Å; R15-R19 WeakPolarHBondContact O-CB 3.33Å; R15-R19 PolarHBondContact O-N 2.92Å
16	S	80.9	Confident	72.9	Confident	66 Å²	66	116 Å²	116	46%	0.462	57%	0.567	S	S	.	*	H	α-helix	trans	-69.3	-40.1	178.6	85.3	0	0	0	0	111.2	L12 V13 R19 T20	L12-S16 PolarHBondContact O-N 3.48Å; V13-S16 PolarHBondContact O-N 3.5Å; V13-S16 PolarHBondContact O-OG 2.88Å; S16-R19 CarbonylContact O-C 3.6Å; S16-R19 PolarHBondContact O-N 2.99Å; S16-R19 VanDerWaalsContact O-N 3.15Å; S16-T20 PolarHBondContact O-N 3Å; S16-T20 PolarHBondContact O-OG1 3.41Å
17	L	81.5	Confident	72.6	Confident	106 Å²	106	110.3 Å²	110.3	56%	0.555	56%	0.555	S	S	*	*	H	α-helix	trans	-66.4	-41	-179.2	-154.5	134.4	0	0	0	111.7	V13 T20 H21	V13-L17 VanDerWaalsContact O-CB 3.25Å; V13-L17 WeakPolarHBondContact O-CB 3.29Å; V13-L17 PolarHBondContact O-N 3.24Å; L17-T20 VanDerWaalsContact CA-OG1 3.28Å; L17-T20 WeakPolarHBondContact CA-OG1 3.25Å; L17-T20 PolarHBondContact O-N 3.04Å; L17-T20 PolarHBondContact O-OG1 2.86Å; L17-H21 VanDerWaalsContact O-CB 3.28Å; L17-H21 WeakPolarHBondContact O-CB 3.4Å; L17-H21 PolarHBondContact O-N 3.21Å
18	K	78.5	Confident	72.1	Confident	136 Å²	136	115.1 Å²	115.1	59%	0.591	58%	0.578	S	S	*	*	H	α-helix	trans	-63.6	-42.1	170.2	-176.4	172.8	-179.4	174.9	0	112	F14 T20 H21 D22	F14-K18 WeakPolarHBondContact O-CB 3.12Å; F14-K18 PolarHBondContact O-N 3.15Å; K18-T20 VanDerWaalsContact C-N 3.35Å; K18-T20 PolarHBondContact O-N 3.41Å; K18-H21 WeakPolarHBondContact O-CB 3.36Å; K18-H21 PolarHBondContact O-N 3.47Å; K18-D22 WeakPolarHBondContact O-CB 3.15Å; K18-D22 VanDerWaalsContact O-CG 3.23Å; K18-D22 PolarHBondContact O-N 2.99Å
19	R	75.7	Confident	70.9	Confident	195 Å²	195	117.5 Å²	117.5	74%	0.736	60%	0.595	S	S	*	*	H	α-helix	trans	-67	-35.8	179.2	-147	178.1	-164.4	176	2.7	112.3	R15 S16 M23	R15-R19 WeakPolarHBondContact O-CB 3.33Å; R15-R19 PolarHBondContact O-N 2.92Å; S16-R19 CarbonylContact O-C 3.6Å; S16-R19 PolarHBondContact O-N 2.99Å; S16-R19 VanDerWaalsContact O-N 3.15Å; R19-M23 WeakPolarHBondContact O-CB 3.32Å; R19-M23 PolarHBondContact O-N 3.46Å; R19-M23 VanDerWaalsContact O-N 3.08Å
20	T	73.6	Confident	69.9	Low	64 Å²	64	122 Å²	122	39%	0.393	60%	0.599	S	S	.	*	H	α-helix	trans	-70.5	-40.3	171.8	45.8	0	0	0	0	111.3	S16 L17 K18 M23 F24	S16-T20 PolarHBondContact O-N 3Å; S16-T20 PolarHBondContact O-OG1 3.41Å; L17-T20 VanDerWaalsContact CA-OG1 3.28Å; L17-T20 WeakPolarHBondContact CA-OG1 3.25Å; L17-T20 PolarHBondContact O-N 3.04Å; L17-T20 PolarHBondContact O-OG1 2.86Å; K18-T20 VanDerWaalsContact C-N 3.35Å; K18-T20 PolarHBondContact O-N 3.41Å; T20-M23 PolarHBondContact O-N 3.47Å; T20-F24 HydrophobicContact CG2-CE2 4.48Å; T20-F24 WeakPolarHBondContact O-CB 3.49Å; T20-F24 WeakPolarHBondContact O-CD2 3.28Å; T20-F24 PolarHBondContact O-N 3.48Å
21	H	74.9	Confident	69	Low	101 Å²	101	123.4 Å²	123.4	47%	0.468	61%	0.611	S	S	.	*	H	α-helix	trans	-60.8	-53.7	175.3	-171.2	-87.6	0	0	0	110.8	L17 K18 M23 F24 E25	L17-H21 VanDerWaalsContact O-CB 3.28Å; L17-H21 WeakPolarHBondContact O-CB 3.4Å; L17-H21 PolarHBondContact O-N 3.21Å; K18-H21 WeakPolarHBondContact O-CB 3.36Å; K18-H21 PolarHBondContact O-N 3.47Å; H21-M23 PolarHBondContact O-N 2.81Å; H21-F24 PolarHBondContact O-N 3.24Å; H21-F24 VanDerWaalsContact O-N 3.12Å; H21-E25 IonicContact CE1-OE1 3.85Å; H21-E25 PolarHBondContact CE1-OE1 3.15Å; H21-E25 IonicContact CE1-OE2 3.63Å; H21-E25 PolarHBondContact CE1-OE2 2.8Å; H21-E25 IonicContact ND1-OE2 3.97Å; H21-E25 PolarHBondContact ND1-OE2 3.23Å; H21-E25 WeakPolarHBondContact O-CB 3.07Å; H21-E25 PolarHBondContact O-N 3.08Å
22	D	69.9	Low	68.3	Low	88 Å²	88	125.4 Å²	125.4	47%	0.471	63%	0.625	S	S	.	*	H	α-helix	trans	-61.1	-30.8	178.6	-65.8	-12.2	0	0	0	112.3	K18	K18-D22 WeakPolarHBondContact O-CB 3.15Å; K18-D22 VanDerWaalsContact O-CG 3.23Å; K18-D22 PolarHBondContact O-N 2.99Å
23	M	66.3	Low	67.8	Low	132 Å²	132	129.5 Å²	129.5	65%	0.65	64%	0.641	S	S	*	*	H	α-helix	trans	-79.9	-26.9	177.9	-171.5	136.2	67.8	0	0	113.7	R19 T20 H21	R19-M23 WeakPolarHBondContact O-CB 3.32Å; R19-M23 PolarHBondContact O-N 3.46Å; R19-M23 VanDerWaalsContact O-N 3.08Å; T20-M23 PolarHBondContact O-N 3.47Å; H21-M23 PolarHBondContact O-N 2.81Å
24	F	64.4	Low	67.6	Low	150 Å²	150	130.7 Å²	130.7	66%	0.658	65%	0.648	S	S	*	*	H	α-helix	trans	-106.1	-13.9	-178.2	-68.5	-63.5	0	0	0	114.1	T20 H21	T20-F24 HydrophobicContact CG2-CE2 4.48Å; T20-F24 WeakPolarHBondContact O-CB 3.49Å; T20-F24 WeakPolarHBondContact O-CD2 3.28Å; T20-F24 PolarHBondContact O-N 3.48Å; H21-F24 PolarHBondContact O-N 3.24Å; H21-F24 VanDerWaalsContact O-N 3.12Å
25	E	58.5	Low	67.7	Low	129 Å²	129	128.8 Å²	128.8	60%	0.603	64%	0.644	S	S	*	*	H	α-helix	trans	-76.8	-23.8	176.9	-169.2	175.9	-156.4	0	0	112.2	H21	H21-E25 IonicContact CE1-OE1 3.85Å; H21-E25 PolarHBondContact CE1-OE1 3.15Å; H21-E25 IonicContact CE1-OE2 3.63Å; H21-E25 PolarHBondContact CE1-OE2 2.8Å; H21-E25 IonicContact ND1-OE2 3.97Å; H21-E25 PolarHBondContact ND1-OE2 3.23Å; H21-E25 WeakPolarHBondContact O-CB 3.07Å; H21-E25 PolarHBondContact O-N 3.08Å
26	A	52.5	Low	68	Low	69 Å²	69	128.4 Å²	128.4	57%	0.57	65%	0.65	S	S	*	*	S	Bend	trans	-85.9	-16.5	-169.7	0	0	0	0	0	116.6
27	D	50.6	Low	68.3	Low	128 Å²	128	133.2 Å²	133.2	68%	0.684	66%	0.662	S	S	*	*	S	Bend	trans	-132.4	9.6	-155.7	-134.2	16.6	0	0	0	117.8
28	Q	55.5	Low	68.4	Low	189 Å²	189	131.4 Å²	131.4	88%	0.883	66%	0.658	S	S	*	*	S	Bend	trans	-96.1	-6.7	176.3	-67.2	-151.3	0.7	0	0	115.3
29	S	54.9	Low	68.7	Low	118 Å²	118	128.5 Å²	128.5	83%	0.825	65%	0.649	S	S	*	*	S	Bend	trans	-131.8	-10.1	-175.2	62.3	0	0	0	0	116.3
30	R	52.7	Low	69.2	Low	209 Å²	209	122.8 Å²	122.8	79%	0.789	64%	0.639	S	S	*	*			trans	-110.4	105.7	171.4	-97	180	172.6	168	-2.7	109.4
31	L	57.9	Low	70	Confident	162 Å²	162	125.1 Å²	125.1	85%	0.848	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-57.4	139.4	162.4	-69.5	163.7	0	0	0	108
32	P	66.8	Low	70.6	Confident	107 Å²	107	127.2 Å²	127.2	70%	0.695	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-55.3	144.3	172.8	21.6	-30.7	0	0	0	109.7	V34	P32-V34 PolarHBondContact O-N 3.01Å
33	E	68.7	Low	71.4	Confident	193 Å²	193	127.6 Å²	127.6	90%	0.902	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-53.3	126.4	178.9	-70.5	-175.3	167.4	0	0	109.6	D35	E33-D35 PolarHBondContact O-N 2.82Å
34	V	74.4	Confident	72.5	Confident	100 Å²	100	124.1 Å²	124.1	61%	0.606	65%	0.654	S	S	*	*			trans	-71.4	102.1	-177.4	179.2	0	0	0	0	107.8	P32 E36 N39	P32-V34 PolarHBondContact O-N 3.01Å; V34-E36 PolarHBondContact O-N 3.24Å; V34-E36 VanDerWaalsContact O-N 3.08Å; V34-N39 HydrophobicContact CG1-CB 4.09Å; V34-N39 WeakPolarHBondContact CG1-ND2 3.45Å
35	D	83.7	Confident	73.7	Confident	90 Å²	90	122 Å²	122	48%	0.481	65%	0.648	S	S	.	*			trans	-62.9	110.9	171.5	172	26.7	0	0	0	109.6	E33 K37 S38 N39	E33-D35 PolarHBondContact O-N 2.82Å; D35-K37 PolarHBondContact O-N 3.21Å; D35-K37 PolarHBondContact OD1-N 3.14Å; D35-K37 VanDerWaalsContact OD1-N 3.14Å; D35-S38 WeakPolarHBondContact O-CB 3.36Å; D35-S38 PolarHBondContact O-N 3.34Å; D35-S38 VanDerWaalsContact OD2-CB 3.29Å; D35-S38 WeakPolarHBondContact OD2-CB 3.2Å; D35-S38 PolarHBondContact OD2-N 2.96Å; D35-N39 PolarHBondContact O-N 3.08Å
36	E	86.3	Confident	75	Confident	165 Å²	165	121.7 Å²	121.7	77%	0.771	65%	0.645	S	S	*	*	H	α-helix	trans	-57.5	-33	-178.3	-65	-171	158	0	0	112	V34 N39 S40	V34-E36 PolarHBondContact O-N 3.24Å; V34-E36 VanDerWaalsContact O-N 3.08Å; E36-N39 PolarHBondContact O-N 3.21Å; E36-S40 WeakPolarHBondContact O-CB 3.43Å; E36-S40 PolarHBondContact O-N 2.99Å; E36-S40 PolarHBondContact O-OG 3.46Å
37	K	86.6	Confident	76.4	Confident	166 Å²	166	120.2 Å²	120.2	72%	0.722	63%	0.633	S	S	*	*	H	α-helix	trans	-68.3	-51.3	178.3	-69.5	-179.4	179.9	174.3	0	110.9	D35 N39 S40 L41	D35-K37 PolarHBondContact O-N 3.21Å; D35-K37 PolarHBondContact OD1-N 3.14Å; D35-K37 VanDerWaalsContact OD1-N 3.14Å; K37-N39 VanDerWaalsContact C-N 3.3Å; K37-N39 PolarHBondContact O-N 3.49Å; K37-S40 PolarHBondContact O-N 3.32Å; K37-S40 PolarHBondContact O-OG 2.65Å; K37-L41 PolarHBondContact O-N 3.26Å
38	S	83.4	Confident	77.9	Confident	69 Å²	69	122 Å²	122	48%	0.483	64%	0.635	S	S	.	*	H	α-helix	trans	-53.2	-46.3	172.8	158.8	0	0	0	0	112.2	D35 L41 K42	D35-S38 WeakPolarHBondContact O-CB 3.36Å; D35-S38 PolarHBondContact O-N 3.34Å; D35-S38 VanDerWaalsContact OD2-CB 3.29Å; D35-S38 WeakPolarHBondContact OD2-CB 3.2Å; D35-S38 PolarHBondContact OD2-N 2.96Å; S38-L41 PolarHBondContact O-N 3.37Å; S38-K42 WeakPolarHBondContact O-CB 3.33Å; S38-K42 PolarHBondContact O-N 2.92Å
39	N	84.6	Confident	79.1	Confident	74 Å²	74	119.3 Å²	119.3	40%	0.396	63%	0.626	S	S	.	*	H	α-helix	trans	-68.9	-40.1	-177.2	-134.7	10.6	0	0	0	111.8	V34 D35 E36 K37 L41 K42 V43	V34-N39 HydrophobicContact CG1-CB 4.09Å; V34-N39 WeakPolarHBondContact CG1-ND2 3.45Å; D35-N39 PolarHBondContact O-N 3.08Å; E36-N39 PolarHBondContact O-N 3.21Å; K37-N39 VanDerWaalsContact C-N 3.3Å; K37-N39 PolarHBondContact O-N 3.49Å; N39-L41 VanDerWaalsContact C-N 3.34Å; N39-L41 PolarHBondContact O-N 2.96Å; N39-K42 PolarHBondContact O-N 2.68Å; N39-V43 VanDerWaalsContact O-CG2 3.29Å; N39-V43 WeakPolarHBondContact O-CG2 3.45Å; N39-V43 PolarHBondContact O-N 3.25Å
40	S	87.6	Confident	80.3	Confident	75 Å²	75	118.8 Å²	118.8	52%	0.524	61%	0.611	S	S	.	*	H	α-helix	trans	-61.3	-41.2	174.2	74.3	0	0	0	0	112.2	E36 K37 V43 A44	E36-S40 WeakPolarHBondContact O-CB 3.43Å; E36-S40 PolarHBondContact O-N 2.99Å; E36-S40 PolarHBondContact O-OG 3.46Å; K37-S40 PolarHBondContact O-N 3.32Å; K37-S40 PolarHBondContact O-OG 2.65Å; S40-V43 PolarHBondContact O-N 3.04Å; S40-A44 WeakPolarHBondContact O-CB 3.35Å; S40-A44 PolarHBondContact O-N 3.39Å
41	L	90.5	Very high	81.3	Confident	114 Å²	114	115.1 Å²	115.1	60%	0.597	60%	0.598	S	S	*	*	H	α-helix	trans	-65.7	-44.4	177.4	-163.5	104.1	0	0	0	111.2	K37 S38 N39 V43 A44 I45	K37-L41 PolarHBondContact O-N 3.26Å; S38-L41 PolarHBondContact O-N 3.37Å; N39-L41 VanDerWaalsContact C-N 3.34Å; N39-L41 PolarHBondContact O-N 2.96Å; L41-V43 PolarHBondContact O-N 3.32Å; L41-A44 PolarHBondContact O-N 3.04Å; L41-I45 HydrophobicContact CD2-CD1 3.86Å; L41-I45 HydrophobicContact CG-CD1 4.13Å; L41-I45 VanDerWaalsContact O-CG1 3.29Å; L41-I45 WeakPolarHBondContact O-CG1 3.29Å; L41-I45 PolarHBondContact O-N 2.73Å
42	K	87.5	Confident	82	Confident	144 Å²	144	108.6 Å²	108.6	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-61.5	-42.9	177.3	-172.3	178.3	-179.2	178.4	0	111.9	S38 N39 K46	S38-K42 WeakPolarHBondContact O-CB 3.33Å; S38-K42 PolarHBondContact O-N 2.92Å; N39-K42 PolarHBondContact O-N 2.68Å; K42-K46 WeakPolarHBondContact O-CB 3.36Å; K42-K46 PolarHBondContact O-N 3Å
43	V	86.2	Confident	82.1	Confident	96 Å²	96	108.3 Å²	108.3	58%	0.582	57%	0.568	S	S	*	*	H	α-helix	trans	-65.7	-42.9	175.8	173	0	0	0	0	110.9	N39 S40 L41 I45 K46 A47	N39-V43 VanDerWaalsContact O-CG2 3.29Å; N39-V43 WeakPolarHBondContact O-CG2 3.45Å; N39-V43 PolarHBondContact O-N 3.25Å; S40-V43 PolarHBondContact O-N 3.04Å; L41-V43 PolarHBondContact O-N 3.32Å; V43-I45 PolarHBondContact O-N 3.47Å; V43-K46 PolarHBondContact O-N 2.77Å; V43-A47 VanDerWaalsContact O-CB 3.28Å; V43-A47 WeakPolarHBondContact O-CB 3.46Å; V43-A47 PolarHBondContact O-N 3.44Å
44	A	88.4	Confident	81.9	Confident	60 Å²	60	103.4 Å²	103.4	50%	0.496	55%	0.551	S	S	.	*	H	α-helix	trans	-62.9	-42.7	178	0	0	0	0	0	112.5	S40 L41 A47 K48	S40-A44 WeakPolarHBondContact O-CB 3.35Å; S40-A44 PolarHBondContact O-N 3.39Å; L41-A44 PolarHBondContact O-N 3.04Å; A44-A47 PolarHBondContact O-N 2.96Å; A44-K48 WeakPolarHBondContact O-CB 3.29Å; A44-K48 PolarHBondContact O-N 3.35Å
45	I	89.8	Confident	81.2	Confident	104 Å²	104	105 Å²	105	53%	0.533	56%	0.555	S	S	.	*	H	α-helix	trans	-63.4	-47.8	175.7	-67.7	165.3	0	0	0	110.1	L41 V43 A47 K48 D49	L41-I45 HydrophobicContact CD2-CD1 3.86Å; L41-I45 HydrophobicContact CG-CD1 4.13Å; L41-I45 VanDerWaalsContact O-CG1 3.29Å; L41-I45 WeakPolarHBondContact O-CG1 3.29Å; L41-I45 PolarHBondContact O-N 2.73Å; V43-I45 PolarHBondContact O-N 3.47Å; I45-A47 VanDerWaalsContact C-N 3.33Å; I45-A47 PolarHBondContact O-N 2.92Å; I45-K48 PolarHBondContact O-N 3.01Å; I45-D49 WeakPolarHBondContact O-CB 3.47Å; I45-D49 PolarHBondContact O-N 3.06Å
46	K	86	Confident	79.9	Confident	123 Å²	123	109.5 Å²	109.5	54%	0.535	57%	0.571	S	S	.	*	H	α-helix	trans	-63.3	-38.7	179.3	-168.6	174.6	-178.6	179.7	0	112.2	K42 V43 D49 Q50	K42-K46 WeakPolarHBondContact O-CB 3.36Å; K42-K46 PolarHBondContact O-N 3Å; V43-K46 PolarHBondContact O-N 2.77Å; K46-D49 PolarHBondContact O-N 3.46Å; K46-Q50 HydrophobicContact CG-CG 4.28Å; K46-Q50 VanDerWaalsContact O-CB 3.32Å; K46-Q50 WeakPolarHBondContact O-CB 3.34Å; K46-Q50 WeakPolarHBondContact O-CG 3.28Å; K46-Q50 PolarHBondContact O-N 2.82Å
47	A	81.7	Confident	78.3	Confident	38 Å²	38	108.6 Å²	108.6	31%	0.314	57%	0.566	S	S	.	*	H	α-helix	trans	-66.1	-41.5	176.2	0	0	0	0	0	111.8	V43 A44 I45 Y51	V43-A47 VanDerWaalsContact O-CB 3.28Å; V43-A47 WeakPolarHBondContact O-CB 3.46Å; V43-A47 PolarHBondContact O-N 3.44Å; A44-A47 PolarHBondContact O-N 2.96Å; I45-A47 VanDerWaalsContact C-N 3.33Å; I45-A47 PolarHBondContact O-N 2.92Å; A47-Y51 HydrophobicContact CB-CD2 4.5Å; A47-Y51 WeakPolarHBondContact O-CA 3.46Å; A47-Y51 VanDerWaalsContact O-CB 3.31Å; A47-Y51 WeakPolarHBondContact O-CB 3.36Å; A47-Y51 PolarHBondContact O-N 3.29Å
48	K	82.8	Confident	76.3	Confident	166 Å²	166	106.7 Å²	106.7	72%	0.722	57%	0.571	S	S	*	*	H	α-helix	trans	-67.2	-38	176.6	-171.9	179.1	179.2	-177.3	0	112.4	A44 I45 G52	A44-K48 WeakPolarHBondContact O-CB 3.29Å; A44-K48 PolarHBondContact O-N 3.35Å; I45-K48 PolarHBondContact O-N 3.01Å; K48-G52 WeakPolarHBondContact O-CA 3.46Å; K48-G52 PolarHBondContact O-N 2.96Å
49	D	81.3	Confident	74.8	Confident	132 Å²	132	106.4 Å²	106.4	71%	0.706	58%	0.579	S	S	*	*	H	α-helix	trans	-72.4	-47	179.6	-169.4	50.1	0	0	0	111.8	I45 K46	I45-D49 WeakPolarHBondContact O-CB 3.47Å; I45-D49 PolarHBondContact O-N 3.06Å; K46-D49 PolarHBondContact O-N 3.46Å
50	Q	79.5	Confident	72.6	Confident	107 Å²	107	111.6 Å²	111.6	50%	0.5	60%	0.6	S	S	.	*	H	α-helix	trans	-81.7	-32.7	-176.3	-65.1	-172.5	-23.2	0	0	113.9	K46	K46-Q50 HydrophobicContact CG-CG 4.28Å; K46-Q50 VanDerWaalsContact O-CB 3.32Å; K46-Q50 WeakPolarHBondContact O-CB 3.34Å; K46-Q50 WeakPolarHBondContact O-CG 3.28Å; K46-Q50 PolarHBondContact O-N 2.82Å
51	Y	74.3	Confident	70.5	Confident	133 Å²	133	114.1 Å²	114.1	52%	0.522	61%	0.608	S	S	.	*	H	α-helix	trans	-117.8	2.7	-174.8	-52.8	-76.3	0	0	0	113.8	A47 P53 V54 L55	A47-Y51 HydrophobicContact CB-CD2 4.5Å; A47-Y51 WeakPolarHBondContact O-CA 3.46Å; A47-Y51 VanDerWaalsContact O-CB 3.31Å; A47-Y51 WeakPolarHBondContact O-CB 3.36Å; A47-Y51 PolarHBondContact O-N 3.29Å; Y51-P53 VanDerWaalsContact C-N 3.26Å; Y51-V54 PolarHBondContact O-N 3.34Å; Y51-L55 PolarHBondContact O-N 3.02Å
52	G	72.8	Confident	68	Low	25 Å²	25	113.4 Å²	113.4	26%	0.258	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-50.6	-36.4	174.9	0	0	0	0	0	115.1	K48	K48-G52 WeakPolarHBondContact O-CA 3.46Å; K48-G52 PolarHBondContact O-N 2.96Å
53	P	67.3	Low	65.6	Low	100 Å²	100	114.3 Å²	114.3	65%	0.649	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-29.9	174.2	-19.9	32.9	0	0	0	114.1	Y51	Y51-P53 VanDerWaalsContact C-N 3.26Å
54	V	64.6	Low	63.2	Low	91 Å²	91	118.8 Å²	118.8	55%	0.552	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-27.8	-174.2	-176.1	0	0	0	0	111.8	Y51 K56 E57	Y51-V54 PolarHBondContact O-N 3.34Å; V54-K56 PolarHBondContact O-N 3.34Å; V54-E57 PolarHBondContact O-N 3.01Å
55	L	60	Low	60.6	Low	132 Å²	132	121.9 Å²	121.9	69%	0.691	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-16.4	176.6	-90.4	154	0	0	0	114.3	Y51	Y51-L55 PolarHBondContact O-N 3.02Å
56	K	56.7	Low	58.2	Low	186 Å²	186	127 Å²	127	81%	0.809	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-1.5	178.8	-70.8	-174.2	179	-179	0	113.9	V54	V54-K56 PolarHBondContact O-N 3.34Å
57	E	53	Low	55.8	Low	145 Å²	145	129.7 Å²	129.7	68%	0.678	68%	0.681	S	S	*	*	S	Bend	trans	-73.2	131	170.2	-65.2	-161.2	162.4	0	0	109.3	V54 G59	V54-E57 PolarHBondContact O-N 3.01Å; E57-G59 PolarHBondContact O-N 2.78Å
58	P	45.5	Very low	53.3	Low	127 Å²	127	135 Å²	135	83%	0.825	70%	0.703	S	S	*	*			trans	-63.1	111.6	178.5	24.6	-30.8	0	0	0	108.7	H60	P58-H60 PolarHBondContact O-N 3.32Å; P58-H60 VanDerWaalsContact O-N 3.13Å
59	G	51.3	Low	51.1	Low	63 Å²	63	134 Å²	134	65%	0.649	71%	0.711	S	S	*	*			trans	-50	119.8	174.1	0	0	0	0	0	110.3	E57 N61	E57-G59 PolarHBondContact O-N 2.78Å; G59-N61 PolarHBondContact O-N 3.36Å
60	H	39.1	Very low	48.8	Very low	182 Å²	182	132.8 Å²	132.8	84%	0.843	71%	0.711	S	S	*	*			trans	-62.9	93.1	162.4	-166.4	65	0	0	0	106.9	P58 P62	P58-H60 PolarHBondContact O-N 3.32Å; P58-H60 VanDerWaalsContact O-N 3.13Å; H60-P62 WeakPolarHBondContact O-CD 3.5Å
61	N	41.6	Very low	46.5	Very low	129 Å²	129	135.2 Å²	135.2	69%	0.69	73%	0.727	S	S	*	*			trans	-73.8	108.8	170.3	-87.7	-12	0	0	0	108.5	G59	G59-N61 PolarHBondContact O-N 3.36Å
62	P	39.8	Very low	44.4	Very low	98 Å²	98	134.9 Å²	134.9	64%	0.636	74%	0.739	S	S	*	*	S	Bend	trans	-69.7	142.8	144.3	34	-29.3	0	0	0	106	H60	H60-P62 WeakPolarHBondContact O-CD 3.5Å
63	L	36.2	Very low	42.5	Very low	164 Å²	164	139.6 Å²	139.6	86%	0.859	77%	0.768	S	S	*	*			trans	90.8	67.6	180	-43.5	167.2	0	0	0	115
64	K	35.9	Very low	41.1	Very low	190 Å²	190	143.7 Å²	143.7	83%	0.826	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-94.3	126.7	142.1	-87.8	-174	176.3	-177.9	0	108.2
65	P	33.4	Very low	39.7	Very low	124 Å²	124	145.2 Å²	145.2	81%	0.805	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-77.6	133.5	172.3	25.9	-19.8	0	0	0	109.7
66	K	38.8	Very low	38.4	Very low	211 Å²	211	142.4 Å²	142.4	92%	0.917	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-80	133.6	172.6	-79.2	-177.5	173	-179.4	0	109.8
67	E	36.5	Very low	37.3	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.8	130.3	169.6	-71.9	173.7	144.6	0	0	111.7
68	N	29.6	Very low	36.1	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	81%	0.806	S	S	*	*			trans	45.1	107.8	140.5	-61.1	-13.6	0	0	0	122
69	V	36.6	Very low	35.8	Very low	146 Å²	146	140.1 Å²	140.1	89%	0.885	81%	0.805	S	S	*	*				-143.6	138.3	130	-179.2	0	0	0	0	107.6
70	P	32	Very low	34.8	Very low	107 Å²	107	142.4 Å²	142.4	70%	0.695	81%	0.809	S	S	*	*			trans	-96.7	152.9	-153.2	37.1	-31.2	0	0	0	113.3
71	D	32.6	Very low	34.4	Very low	158 Å²	158	139.5 Å²	139.5	85%	0.845	81%	0.809	S	S	*	*			trans	-158.8	121.4	145.6	-95.7	-24.8	0	0	0	112.1
72	T	28.9	Very low	33.9	Very low	125 Å²	125	141.9 Å²	141.9	77%	0.767	82%	0.816	S	S	*	*			trans	11.8	116.8	151.5	24	0	0	0	0	121.6
73	S	34.4	Very low	33.4	Very low	124 Å²	124	146.6 Å²	146.6	87%	0.867	83%	0.827	S	S	*	*				145.6	131.1	122	59.8	0	0	0	0	112.8
74	Q	37.1	Very low	33.1	Very low	187 Å²	187	144 Å²	144	87%	0.874	83%	0.828	S	S	*	*			trans	-88.9	-171.2	-175.7	-56.4	-177.2	-14.2	0	0	112.1
75	P	35.2	Very low	32.9	Very low	123 Å²	123	143.9 Å²	143.9	80%	0.799	83%	0.828	S	S	*	*				-131.7	170.5	-83.7	39.5	-21.3	0	0	0	112.7
76	G	32.6	Very low	32.7	Very low	73 Å²	73	144.2 Å²	144.2	75%	0.753	83%	0.83	S	S	*	*			trans	173.1	107.9	166.6	0	0	0	0	0	118.3
77	A	32.8	Very low	32.4	Very low	108 Å²	108	142.7 Å²	142.7	89%	0.893	82%	0.824	S	S	*	*			trans	77.7	124.7	148.3	0	0	0	0	0	121.3
78	I	28.6	Very low	32.1	Very low	166 Å²	166	138.4 Å²	138.4	85%	0.851	81%	0.813	S	S	*	*			trans	-82.9	135.1	175.8	-66.7	152.6	0	0	0	109.7
79	V	38.9	Very low	32.3	Very low	135 Å²	135	136.3 Å²	136.3	82%	0.818	82%	0.817	S	S	*	*			trans	-139.4	136	157.9	-175.4	0	0	0	0	109.8
80	P	30.2	Very low	32.1	Very low	111 Å²	111	137 Å²	137	72%	0.721	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-84.8	142.3	-170.6	-0.6	20.5	0	0	0	112.8	E82	P80-E82 PolarHBondContact O-N 3.32Å
81	S	30.5	Very low	32.1	Very low	122 Å²	122	139 Å²	139	85%	0.853	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.8	121.1	179.2	61.9	0	0	0	0	113
82	E	31.8	Very low	32.3	Very low	179 Å²	179	140.1 Å²	140.1	84%	0.836	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.4	133.3	169.4	-73.8	-172.8	129.4	0	0	113.1	P80	P80-E82 PolarHBondContact O-N 3.32Å
83	K	28.1	Very low	32.7	Very low	197 Å²	197	140.7 Å²	140.7	86%	0.857	81%	0.813	S	S	*	*			trans	28.3	95.8	143.5	-66.9	174.9	179.3	171	0	117.7	K85	K83-K85 PolarHBondContact O-N 2.78Å
84	A	31	Very low	32.9	Very low	108 Å²	108	137.1 Å²	137.1	89%	0.893	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-75.8	117.8	160.1	0	0	0	0	0	111.3
85	K	30.5	Very low	33.3	Very low	188 Å²	188	131 Å²	131	82%	0.817	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.5	151.8	166.2	-76.3	175.2	176.1	174.6	0	110.9	K83 K87	K83-K85 PolarHBondContact O-N 2.78Å; K85-K87 PolarHBondContact O-N 3.5Å
86	P	29.8	Very low	34	Very low	132 Å²	132	130.1 Å²	130.1	86%	0.857	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-73.3	122.7	-179.8	30.9	-31.5	0	0	0	109.9
87	K	32.5	Very low	34.8	Very low	179 Å²	179	130 Å²	130	78%	0.778	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-75.8	137.3	172.8	-75.2	-176.3	176.3	-177.6	0	110.5	K85	K85-K87 PolarHBondContact O-N 3.5Å
88	S	31.2	Very low	35.5	Very low	89 Å²	89	131.1 Å²	131.1	62%	0.622	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-47.8	144.7	179.3	47.1	0	0	0	0	115.6	L90	S88-L90 PolarHBondContact O-N 2.75Å
89	A	32.3	Very low	36.4	Very low	106 Å²	106	130.2 Å²	130.2	88%	0.876	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	45.2	178.5	0	0	0	0	0	115.5
90	L	32.8	Very low	37.7	Very low	159 Å²	159	126.5 Å²	126.5	83%	0.832	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	1.1	176	-116.9	112.7	0	0	0	114.8	S88	S88-L90 PolarHBondContact O-N 2.75Å
91	E	32.8	Very low	38.6	Very low	151 Å²	151	129.4 Å²	129.4	71%	0.706	72%	0.722	S	S	*	*			trans	-105.3	6.5	-173.7	-71.4	-175.6	164.5	0	0	115.4	N93	E91-N93 PolarHBondContact O-N 3.2Å
92	Q	37.4	Very low	39.3	Very low	181 Å²	181	131 Å²	131	85%	0.846	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	7.5	-176	-72.5	-173.5	-13.6	0	0	115.7
93	N	36.5	Very low	40.3	Very low	137 Å²	137	129.7 Å²	129.7	73%	0.733	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	24.3	-169.4	-85.5	-20.1	0	0	0	116.9	E91	E91-N93 PolarHBondContact O-N 3.2Å
94	A	39.3	Very low	41.3	Very low	48 Å²	48	125.8 Å²	125.8	40%	0.397	70%	0.695	S	S	.	*			trans	-125.3	127.3	172.6	0	0	0	0	0	112.4	L105	A94-L105 HydrophobicContact CB-CD2 3.41Å; A94-L105 VanDerWaalsContact CB-CD2 3.41Å
95	S	45.5	Very low	42.2	Very low	60 Å²	60	126.5 Å²	126.5	42%	0.42	68%	0.683	S	S	.	*			trans	-82.5	112.7	162.9	46.9	0	0	0	0	107.9
96	I	48.4	Very low	43.2	Very low	104 Å²	104	121.7 Å²	121.7	53%	0.533	67%	0.666	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.4	121.1	177.5	-62.3	167.6	0	0	0	107.5	K103	I96-K103 HydrophobicContact CG2-CD 4.48Å; I96-K103 HydrophobicContact CG2-CG 4.4Å
97	V	49.3	Very low	44.3	Very low	69 Å²	69	121 Å²	121	42%	0.418	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	123.3	167.1	-177	0	0	0	0	106.9	I99 L106	V97-I99 HydrophobicContact CG1-CG1 4.39Å; V97-L106 HydrophobicContact CB-CD1 4.05Å; V97-L106 HydrophobicContact CG2-CD1 3.81Å
98	Q	47.4	Very low	45.3	Very low	133 Å²	133	118.6 Å²	118.6	62%	0.621	65%	0.651	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.3	116.4	-177.4	-167.4	168.2	-10.2	0	0	109	G100	Q98-G100 WeakPolarHBondContact CG-O 3.38Å
99	I	47.5	Very low	46.5	Very low	146 Å²	146	123.7 Å²	123.7	75%	0.749	66%	0.662	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120.3	101	170.8	-58.7	177	0	0	0	106.1	V97	V97-I99 HydrophobicContact CG1-CG1 4.39Å
100	G	66.1	Low	47.6	Very low	58 Å²	58	122.4 Å²	122.4	60%	0.598	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.7	-145.5	-174.1	0	0	0	0	0	114	Q98	Q98-G100 WeakPolarHBondContact CG-O 3.38Å
101	N	50.1	Low	48.9	Very low	172 Å²	172	121.1 Å²	121.1	92%	0.92	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	1.6	-177.5	-91.7	-4.2	0	0	0	114.4
102	E	45.4	Very low	50.3	Low	154 Å²	154	119.8 Å²	119.8	72%	0.72	66%	0.655	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.4	127.4	177.6	-65	-168.6	166	0	0	111.1	L104	E102-L104 PolarHBondContact O-N 3.34Å
103	K	53.3	Low	51.9	Low	152 Å²	152	115 Å²	115	66%	0.661	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.2	104.3	175.9	-70.9	-178.5	-179.6	178.4	0	109.1	I96	I96-K103 HydrophobicContact CG2-CD 4.48Å; I96-K103 HydrophobicContact CG2-CG 4.4Å
104	L	47.8	Very low	53.9	Low	116 Å²	116	111.7 Å²	111.7	61%	0.607	62%	0.62	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.6	120.6	172.5	-139.8	104.1	0	0	0	110	E102 L106	E102-L104 PolarHBondContact O-N 3.34Å; L104-L106 PolarHBondContact O-N 3.23Å
105	L	50	Low	56	Low	122 Å²	122	117.3 Å²	117.3	64%	0.639	64%	0.635	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.6	98.3	171.2	-77.3	160.9	0	0	0	108.7	A94 P107	A94-L105 HydrophobicContact CB-CD2 3.41Å; A94-L105 VanDerWaalsContact CB-CD2 3.41Å; L105-P107 WeakPolarHBondContact O-CD 3.37Å
106	L	52.6	Low	57.9	Low	88 Å²	88	114.8 Å²	114.8	46%	0.461	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-71.2	122.7	171	-82	157.9	0	0	0	109.2	V97 L104 K108	V97-L106 HydrophobicContact CB-CD1 4.05Å; V97-L106 HydrophobicContact CG2-CD1 3.81Å; L104-L106 PolarHBondContact O-N 3.23Å; L106-K108 PolarHBondContact O-N 3.02Å
107	P	53.3	Low	59.9	Low	118 Å²	118	112.3 Å²	112.3	77%	0.766	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-64.3	120.9	172.9	25.8	-31.3	0	0	0	108.7	L105 K109	L105-P107 WeakPolarHBondContact O-CD 3.37Å; P107-K109 PolarHBondContact O-N 3.32Å; P107-K109 VanDerWaalsContact O-N 3.16Å
108	K	53.3	Low	61.9	Low	128 Å²	128	112 Å²	112	56%	0.557	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-54.8	124.5	169.5	-78.4	-176.1	174.9	177.6	0	107.7	L106 A110	L106-K108 PolarHBondContact O-N 3.02Å; K108-A110 PolarHBondContact O-N 2.91Å
109	K	54.8	Low	64	Low	196 Å²	196	106.7 Å²	106.7	85%	0.852	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-46.1	127.9	172.8	-86.8	-179.9	175.5	176.4	0	107.9	P107	P107-K109 PolarHBondContact O-N 3.32Å; P107-K109 VanDerWaalsContact O-N 3.16Å
110	A	56.9	Low	66.1	Low	78 Å²	78	100.9 Å²	100.9	65%	0.645	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-49.4	138	175	0	0	0	0	0	108.6	K108 T112	K108-A110 PolarHBondContact O-N 2.91Å; A110-T112 PolarHBondContact O-N 2.92Å
111	P	58.8	Low	67.5	Low	133 Å²	133	99 Å²	99	86%	0.864	52%	0.523	S	S	*	.			trans	-56.2	107.8	-178.7	22.9	-32.3	0	0	0	108.4	M113	P111-M113 PolarHBondContact O-N 2.96Å
112	T	62.9	Low	69.6	Low	123 Å²	123	91 Å²	91	76%	0.755	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-72.9	122.8	178.7	50.8	0	0	0	0	106.9	A110	A110-T112 PolarHBondContact O-N 2.92Å
113	M	70	Confident	71.9	Confident	79 Å²	79	88.7 Å²	88.7	39%	0.389	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-52.6	129.8	172.6	-75.5	179.3	72.2	0	0	108.7	P111 K115 S371 W432	P111-M113 PolarHBondContact O-N 2.96Å; M113-K115 PolarHBondContact O-N 2.95Å; M113-S371 VanDerWaalsContact CE-O 3.29Å; M113-S371 WeakPolarHBondContact CE-O 3.38Å; M113-W432 HydrophobicContact CB-CZ2 4.25Å
114	P	79.1	Confident	73.8	Confident	68 Å²	68	85.1 Å²	85.1	44%	0.442	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-60	141.1	178	23.9	-30.2	0	0	0	109	S371	P114-S371 WeakPolarHBondContact O-CB 3.29Å
115	K	83.6	Confident	75.9	Confident	166 Å²	166	82.8 Å²	82.8	72%	0.722	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-58.1	131.3	176.5	-173.3	-176.4	176.5	-172	0	108.3	M113 W432	M113-K115 PolarHBondContact O-N 2.95Å; K115-W432 HydrophobicContact CG-CZ3 4.4Å
116	P	86.2	Confident	78	Confident	7 Å²	7	80.9 Å²	80.9	5%	0.045	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-59.5	140.9	176.4	23.5	-33	0	0	0	110.8	S371 Y373 L430 W432	P116-S371 WeakPolarHBondContact CA-OG 3.48Å; P116-S371 WeakPolarHBondContact CB-OG 3.24Å; P116-Y373 HydrophobicContact CB-CD1 4.18Å; P116-Y373 HydrophobicContact CB-CG 4.29Å; P116-Y373 HydrophobicContact CG-CD1 4.46Å; P116-Y373 HydrophobicContact CG-CG 4.48Å; P116-L430 HydrophobicContact CB-CD1 4.46Å; P116-L430 HydrophobicContact CG-CD1 4.27Å; P116-W432 VanDerWaalsContact CD-CD2 3.5Å; P116-W432 HydrophobicContact CG-CB 3.8Å; P116-W432 HydrophobicContact CG-CD2 3.99Å; P116-W432 HydrophobicContact CG-CG 3.58Å
117	T	89	Confident	80	Confident	53 Å²	53	80 Å²	80	33%	0.325	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-76.5	140.3	165.3	51.4	0	0	0	0	108.9	H119 D368	T117-H119 PolarHBondContact O-CD2 2.85Å; T117-H119 PolarHBondContact OG1-NE2 3.4Å; T117-D368 PolarHBondContact N-OD2 2.86Å; T117-D368 PolarHBondContact OG1-OD1 2.89Å
118	W	91.6	Very high	82	Confident	63 Å²	63	74.7 Å²	74.7	24%	0.239	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-71.3	135.7	172.6	-177.7	90.7	0	0	0	109.7	P120 A423 E425 H428 L430	W118-P120 HydrophobicContact CH2-CB 4.04Å; W118-P120 HydrophobicContact CZ3-CB 4.43Å; W118-A423 HydrophobicContact CH2-CB 4.33Å; W118-A423 WeakPolarHBondContact CH2-O 3.44Å; W118-A423 HydrophobicContact CZ2-CB 4.16Å; W118-E425 HydrophobicContact CB-CG 4.05Å; W118-E425 WeakPolarHBondContact CB-OE1 3.33Å; W118-E425 HydrophobicContact CD2-CG 3.73Å; W118-E425 HydrophobicContact CE3-CG 4.21Å; W118-E425 HydrophobicContact CG-CB 4.5Å; W118-E425 HydrophobicContact CG-CG 3.64Å; W118-H428 PolarHBondContact NE1-O 2.69Å; W118-L430 HydrophobicContact CB-CD1 3.89Å; W118-L430 HydrophobicContact CG-CD1 4.47Å
119	H	92.1	Very high	83.8	Confident	20 Å²	20	71.8 Å²	71.8	9%	0.093	39%	0.392	C	S	.	.			trans	-129.2	140.7	176.2	-67.3	-70	0	0	0	107.9	T117 D352 V354 D368 F375	T117-H119 PolarHBondContact O-CD2 2.85Å; T117-H119 PolarHBondContact OG1-NE2 3.4Å; H119-D352 PolarHBondContact CE1-O 3.43Å; H119-V354 HydrophobicContact CB-CG2 4.29Å; H119-V354 WeakPolarHBondContact ND1-CG2 3.26Å; H119-D368 IonicContact CD2-OD1 2.67Å; H119-D368 IonicContact NE2-OD1 3.94Å; H119-D368 PolarHBondContact NE2-OD1 3.16Å; H119-D368 VanDerWaalsContact NE2-OD1 3.11Å; H119-F375 HydrophobicContact CB-CD1 4.45Å; H119-F375 HydrophobicContact CB-CD2 4.38Å; H119-F375 HydrophobicContact CB-CE1 4.02Å; H119-F375 HydrophobicContact CB-CE2 3.95Å; H119-F375 HydrophobicContact CB-CZ 3.74Å
120	P	92.5	Very high	85.5	Confident	24 Å²	24	63.9 Å²	63.9	16%	0.156	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-64.7	145.8	175.8	28.2	-34.6	0	0	0	110.7	W118 E419	W118-P120 HydrophobicContact CH2-CB 4.04Å; W118-P120 HydrophobicContact CZ3-CB 4.43Å; P120-E419 HydrophobicContact CB-CB 4.33Å; P120-E419 HydrophobicContact CG-CB 3.97Å; P120-E419 HydrophobicContact CG-CG 4.03Å; P120-E419 WeakPolarHBondContact CG-OE2 3.01Å
121	P	93.5	Very high	87.4	Confident	20 Å²	20	60.5 Å²	60.5	13%	0.13	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-70	147.3	174.6	31.3	-34	0	0	0	110.8	D420 A423	P121-D420 HydrophobicContact CG-CB 4.17Å; P121-D420 WeakPolarHBondContact O-CB 3.31Å; P121-D420 PolarHBondContact O-N 2.96Å; P121-A423 HydrophobicContact CG-CB 3.83Å
122	W	94.2	Very high	89.1	Confident	4 Å²	4	59 Å²	59	2%	0.015	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133.5	177.6	-69.4	72.6	0	0	0	110.7	F366 Q376 F398 L405 F417 E419	W122-F366 HydrophobicContact CB-CD1 4.41Å; W122-F366 HydrophobicContact CB-CE1 3.7Å; W122-F366 HydrophobicContact CB-CE2 4.36Å; W122-F366 HydrophobicContact CB-CZ 3.68Å; W122-F366 AromaticContact CD1-CD1 3.47Å; W122-F366 VanDerWaalsContact CD1-CD1 3.47Å; W122-F366 AromaticContact CD1-CE1 3.47Å; W122-F366 VanDerWaalsContact CD1-CE1 3.47Å; W122-F366 HydrophobicContact CD2-CD1 4.44Å; W122-F366 AromaticContact CD2-CE1 3.79Å; W122-F366 HydrophobicContact CD2-CE1 3.79Å; W122-F366 AromaticContact CG-CD1 3.84Å; W122-F366 HydrophobicContact CG-CD1 3.84Å; W122-F366 AromaticContact CG-CE1 3.32Å; W122-F366 HydrophobicContact CG-CE1 3.32Å; W122-F366 AromaticContact CG-CZ 3.86Å; W122-F366 HydrophobicContact CG-CZ 3.86Å; W122-F366 AromaticContact NE1-CD1 3.89Å; W122-F366 AromaticContact NE1-CE1 3.99Å; W122-Q376 PolarHBondContact O-NE2 3.12Å; W122-F398 HydrophobicContact CH2-CD1 4.1Å; W122-F398 AromaticContact CH2-CE1 3.49Å; W122-F398 HydrophobicContact CH2-CE1 3.49Å; W122-F398 VanDerWaalsContact CH2-CE1 3.49Å; W122-F398 AromaticContact CZ2-CE1 3.72Å; W122-F398 HydrophobicContact CZ2-CE1 3.72Å; W122-F398 HydrophobicContact CZ2-CZ 4.37Å; W122-F398 HydrophobicContact CZ3-CE1 4.12Å; W122-L405 HydrophobicContact CE3-CB 3.96Å; W122-L405 HydrophobicContact CH2-CB 4.43Å; W122-L405 HydrophobicContact CZ3-CB 3.72Å; W122-F417 HydrophobicContact CE3-CB 3.93Å; W122-E419 HydrophobicContact CD2-CG 3.9Å; W122-E419 HydrophobicContact CE3-CG 4.19Å; W122-E419 HydrophobicContact CH2-CG 3.75Å; W122-E419 HydrophobicContact CZ2-CG 3.44Å; W122-E419 VanDerWaalsContact CZ2-CG 3.44Å; W122-E419 WeakPolarHBondContact CZ2-OE1 3.42Å; W122-E419 HydrophobicContact CZ3-CG 4.11Å
123	K	93.6	Very high	90.5	Very high	104 Å²	104	53.5 Å²	53.5	45%	0.452	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	149.5	176.3	64.3	-177.5	178.3	-171.2	0	111.3	C125 F417 K418 D420	K123-C125 PolarHBondContact O-N 3.26Å; K123-F417 CarbonylContact O-C 3.47Å; K123-F417 VanDerWaalsContact O-CA 3.22Å; K123-F417 WeakPolarHBondContact O-CA 3.31Å; K123-K418 WeakPolarHBondContact CG-O 2.95Å; K123-K418 PolarHBondContact N-O 2.71Å; K123-K418 PolarHBondContact O-N 2.81Å; K123-D420 HydrophobicContact CD-CB 4.12Å; K123-D420 WeakPolarHBondContact CE-OD1 3.28Å; K123-D420 IonicContact NZ-OD1 3.92Å; K123-D420 PolarHBondContact NZ-OD1 3.46Å
124	L	94.1	Very high	91.7	Very high	77 Å²	77	55.2 Å²	55.2	40%	0.403	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	121.1	174.7	-178.4	64.6	0	0	0	109	V127 K415 F417	L124-V127 HydrophobicContact CD1-CG2 4.14Å; L124-V127 HydrophobicContact CD2-CG2 3.81Å; L124-V127 HydrophobicContact CG-CG2 4.28Å; L124-K415 HydrophobicContact CD1-CB 3.68Å; L124-K415 HydrophobicContact CD1-CD 4.16Å; L124-K415 HydrophobicContact CD1-CG 4.18Å; L124-F417 HydrophobicContact CB-CD1 4.18Å; L124-F417 HydrophobicContact CB-CE1 4.03Å; L124-F417 HydrophobicContact CD1-CD1 4.36Å; L124-F417 HydrophobicContact CD1-CE1 4.02Å; L124-F417 HydrophobicContact CD1-CZ 4.11Å
125	C	92.6	Very high	92.6	Very high	68 Å²	68	52 Å²	52	46%	0.459	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-41.7	-178.6	178.5	0	0	0	0	111.6	K123 I416 K418	K123-C125 PolarHBondContact O-N 3.26Å; C125-I416 WeakPolarHBondContact CA-O 3.38Å; C125-I416 WeakPolarHBondContact CB-O 3.22Å; C125-I416 PolarHBondContact N-O 2.93Å; C125-K418 HydrophobicContact CB-CB 3.91Å
126	R	93.6	Very high	93.2	Very high	82 Å²	82	46.4 Å²	46.4	31%	0.309	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	145.3	-177.2	-170.4	176.8	-70	161.3	-6.9	110.9	V128 A162 S163 I416	R126-V128 HydrophobicContact CG-CG2 4.21Å; R126-A162 PolarHBondContact NH1-O 3.02Å; R126-A162 PolarHBondContact NH2-O 2.88Å; R126-S163 VanDerWaalsContact NH1-C 3.32Å; R126-S163 PolarHBondContact NH1-O 3.36Å; R126-I416 HydrophobicContact CB-CB 4.21Å; R126-I416 HydrophobicContact CB-CD1 4.4Å; R126-I416 HydrophobicContact CB-CG1 4.39Å; R126-I416 PolarHBondContact N-O 3.17Å; R126-I416 VanDerWaalsContact N-O 3.12Å; R126-I416 PolarHBondContact O-N 2.89Å
127	V	94.6	Very high	93.7	Very high	68 Å²	68	46.5 Å²	46.5	41%	0.412	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.6	168.5	-177.3	0	0	0	0	107.7	L124 K415	L124-V127 HydrophobicContact CD1-CG2 4.14Å; L124-V127 HydrophobicContact CD2-CG2 3.81Å; L124-V127 HydrophobicContact CG-CG2 4.28Å; V127-K415 HydrophobicContact CG1-CG 4.34Å; V127-K415 HydrophobicContact CG2-CD 4.47Å; V127-K415 HydrophobicContact CG2-CG 4.24Å
128	V	94.2	Very high	94.1	Very high	8 Å²	8	45 Å²	45	5%	0.048	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.4	175.7	179.4	0	0	0	0	107.1	R126 W159 I414 I416	R126-V128 HydrophobicContact CG-CG2 4.21Å; V128-W159 HydrophobicContact CG1-CD2 4.07Å; V128-W159 HydrophobicContact CG1-CE3 3.55Å; V128-W159 HydrophobicContact CG1-CH2 3.7Å; V128-W159 HydrophobicContact CG1-CZ2 4.2Å; V128-W159 HydrophobicContact CG1-CZ3 3.35Å; V128-I414 HydrophobicContact CB-CB 4.23Å; V128-I414 PolarHBondContact N-O 2.94Å; V128-I414 PolarHBondContact O-N 3.18Å; V128-I416 HydrophobicContact CG2-CD1 4.48Å
129	S	92.3	Very high	94.3	Very high	67 Å²	67	42.3 Å²	42.3	47%	0.469	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.9	173.5	-171.4	0	0	0	0	108.7
130	G	90.8	Very high	94.4	Very high	30 Å²	30	42.9 Å²	42.9	31%	0.309	23%	0.233	S	C	.	.			trans	173.9	-13.2	175.1	0	0	0	0	0	114.6	K157	G130-K157 PolarHBondContact O-NZ 2.82Å
131	H	95.4	Very high	94.6	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.032	23%	0.23	C	C	.	.			trans	-73.2	150	161.8	-72.9	-74.3	0	0	0	110.2	V135 T149 A151 K157 W159	H131-V135 HydrophobicContact CB-CG2 3.98Å; H131-T149 PolarHBondContact NE2-OG1 3.08Å; H131-A151 HydrophobicContact CB-CB 4.06Å; H131-A151 WeakPolarHBondContact ND1-CB 3.5Å; H131-K157 VanDerWaalsContact CE1-CD 3.43Å; H131-K157 WeakPolarHBondContact CE1-CD 3.29Å; H131-K157 VanDerWaalsContact CE1-CG 3.43Å; H131-K157 WeakPolarHBondContact CE1-CG 2.99Å; H131-K157 WeakPolarHBondContact ND1-CD 3.44Å; H131-W159 AromaticContact NE2-NE1 3.91Å
132	T	94.2	Very high	94.6	Very high	101 Å²	101	44.1 Å²	44.1	62%	0.62	24%	0.241	S	C	*	.	S	Bend	trans	-94.7	-7.5	176.5	53.7	0	0	0	0	112.9	D153 K412	T132-D153 WeakPolarHBondContact CA-OD2 3.44Å; T132-D153 PolarHBondContact N-OD2 2.78Å; T132-D153 PolarHBondContact OG1-OD1 2.97Å; T132-D153 PolarHBondContact OG1-OD2 2.85Å; T132-K412 VanDerWaalsContact O-CD 3.24Å; T132-K412 WeakPolarHBondContact O-CD 3.37Å; T132-K412 WeakPolarHBondContact O-CE 3.32Å; T132-K412 PolarHBondContact O-NZ 3.2Å
133	G	94.1	Very high	94.6	Very high	8 Å²	8	48 Å²	48	8%	0.082	27%	0.265	C	S	.	.	S	Bend	trans	-144.5	177.2	-176.2	0	0	0	0	0	112.2	V135 D153	G133-V135 PolarHBondContact O-N 2.89Å; G133-D153 VanDerWaalsContact CA-OD1 3.26Å; G133-D153 WeakPolarHBondContact CA-OD1 3.47Å; G133-D153 PolarHBondContact N-OD1 2.99Å; G133-D153 PolarHBondContact N-OD2 2.98Å
134	W	95.3	Very high	94.5	Very high	115 Å²	115	44.5 Å²	44.5	44%	0.436	25%	0.251	S	S	.	.			trans	-59.3	131.1	-172.1	-54.3	-18.1	0	0	0	111.9	A151 A152 F394 A410	W134-A151 CarbonylContact O-C 3.53Å; W134-A151 VanDerWaalsContact O-CA 3.23Å; W134-A151 WeakPolarHBondContact O-CA 3.41Å; W134-A152 HydrophobicContact CB-CB 4.19Å; W134-A152 PolarHBondContact O-N 2.92Å; W134-F394 HydrophobicContact CB-CD2 4.33Å; W134-F394 HydrophobicContact CB-CE2 3.96Å; W134-F394 HydrophobicContact CD2-CE2 4.2Å; W134-F394 HydrophobicContact CE3-CE2 4.14Å; W134-F394 HydrophobicContact CE3-CZ 4.3Å; W134-F394 HydrophobicContact CG-CE2 4.16Å; W134-A410 HydrophobicContact CG-CB 4.46Å
135	V	96.5	Very high	94.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.1	177.7	-166	0	0	0	0	108.6	H131 G133 T149 C408 E409 I414	H131-V135 HydrophobicContact CB-CG2 3.98Å; G133-V135 PolarHBondContact O-N 2.89Å; V135-T149 HydrophobicContact CG1-CG2 4.44Å; V135-C408 HydrophobicContact CB-CB 3.8Å; V135-C408 HydrophobicContact CG1-CB 3.7Å; V135-C408 WeakPolarHBondContact CG1-SG 3.47Å; V135-E409 PolarHBondContact N-O 3.03Å; V135-I414 HydrophobicContact CG1-CG1 4.4Å; V135-I414 HydrophobicContact CG2-CG1 4.22Å
136	R	96.7	Very high	94.7	Very high	49 Å²	49	43.9 Å²	43.9	19%	0.185	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-23.1	-167.8	-62.4	-60	-62.5	-80.6	11.6	114.1	G150 V177 R178	R136-G150 PolarHBondContact N-O 3.37Å; R136-V177 WeakPolarHBondContact CB-O 3.32Å; R136-R178 VanDerWaalsContact CZ-CZ 3.41Å; R136-R178 VanDerWaalsContact CZ-NE 3.32Å; R136-R178 VanDerWaalsContact NH2-NH1 3.12Å; R136-R178 VanDerWaalsContact NH2-NH2 3.19Å
137	C	96.5	Very high	94.9	Very high	9 Å²	9	40 Å²	40	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	153.8	-178.1	54	0	0	0	0	111.6	T149 G150 R178	C137-T149 WeakPolarHBondContact O-CA 3.39Å; C137-G150 PolarHBondContact N-O 2.86Å; C137-G150 PolarHBondContact O-N 2.89Å; C137-G150 WeakPolarHBondContact SG-CA 3.34Å; C137-R178 WeakPolarHBondContact CB-O 3.38Å
138	V	96.7	Very high	95	Very high	20 Å²	20	36.7 Å²	36.7	12%	0.121	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.9	176.6	-176	0	0	0	0	108.2	F140 F147 V148 T149 A395 A397 V406 C408	V138-F140 HydrophobicContact CG1-CE2 4.38Å; V138-F147 HydrophobicContact CG1-CD2 4.34Å; V138-V148 CarbonylContact C-O 3.46Å; V138-V148 VanDerWaalsContact CA-O 3.3Å; V138-V148 WeakPolarHBondContact CA-O 3.49Å; V138-T149 HydrophobicContact CG1-CG2 4.44Å; V138-T149 HydrophobicContact CG2-CG2 4.08Å; V138-A395 HydrophobicContact CG2-CB 4.3Å; V138-A397 HydrophobicContact CB-CB 4.27Å; V138-A397 HydrophobicContact CG1-CB 4.11Å; V138-V406 HydrophobicContact CG1-CG1 4.14Å; V138-V406 HydrophobicContact CG2-CG1 4.32Å; V138-C408 HydrophobicContact CG2-CB 3.84Å; V138-C408 WeakPolarHBondContact CG2-SG 3.48Å
139	A	96.3	Very high	95.1	Very high	8 Å²	8	36.3 Å²	36.3	7%	0.066	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.9	164.5	0	0	0	0	0	109.8	F147 V148 V180 V182	A139-F147 CarbonylContact O-C 3.52Å; A139-F147 WeakPolarHBondContact O-CA 3.42Å; A139-V148 PolarHBondContact N-O 2.87Å; A139-V148 PolarHBondContact O-N 2.86Å; A139-V180 HydrophobicContact CB-CG1 4.25Å; A139-V180 WeakPolarHBondContact CB-O 3.27Å; A139-V182 HydrophobicContact CB-CG2 4.23Å
140	F	95.7	Very high	95.3	Very high	31 Å²	31	33.1 Å²	33.1	14%	0.136	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	148.8	172	-77.7	-86.3	0	0	0	110.5	V138 F147 F161 A397 F398 D399 V406	V138-F140 HydrophobicContact CG1-CE2 4.38Å; F140-F147 HydrophobicContact CD1-CB 3.67Å; F140-F147 HydrophobicContact CE1-CB 3.81Å; F140-F147 HydrophobicContact CE1-CG 4.35Å; F140-F147 HydrophobicContact CG-CB 4.26Å; F140-F147 HydrophobicContact CZ-CB 4.5Å; F140-F161 AromaticContact CE1-CD2 3.79Å; F140-F161 HydrophobicContact CE1-CD2 3.79Å; F140-F161 AromaticContact CE1-CE2 3.55Å; F140-F161 HydrophobicContact CE1-CE2 3.55Å; F140-F161 HydrophobicContact CE1-CZ 4.09Å; F140-F161 HydrophobicContact CZ-CE2 4.1Å; F140-A397 HydrophobicContact CD2-CB 3.86Å; F140-A397 HydrophobicContact CE2-CB 3.6Å; F140-F398 WeakPolarHBondContact CD2-O 3.21Å; F140-F398 VanDerWaalsContact CE2-C 3.45Å; F140-F398 WeakPolarHBondContact CE2-O 3.28Å; F140-D399 HydrophobicContact CE1-CB 4.14Å; F140-D399 HydrophobicContact CZ-CB 4.25Å; F140-V406 HydrophobicContact CE1-CG2 4.27Å; F140-V406 HydrophobicContact CE2-CB 4.27Å; F140-V406 HydrophobicContact CE2-CG2 4.26Å; F140-V406 HydrophobicContact CZ-CB 3.95Å; F140-V406 HydrophobicContact CZ-CG2 3.45Å; F140-V406 VanDerWaalsContact CZ-CG2 3.45Å
141	D	94.9	Very high	95.6	Very high	15 Å²	15	31.7 Å²	31.7	8%	0.08	17%	0.168	C	C	.	.			trans	-71	144.4	166.3	-172.2	76.6	0	0	0	110.7	T143 N144 F146	D141-T143 PolarHBondContact O-N 3.12Å; D141-T143 WeakPolarHBondContact OD2-CB 3.18Å; D141-T143 WeakPolarHBondContact OD2-CG2 3.48Å; D141-T143 PolarHBondContact OD2-N 2.96Å; D141-T143 PolarHBondContact OD2-OG1 3.2Å; D141-N144 PolarHBondContact O-N 2.79Å; D141-F146 HydrophobicContact CB-CD1 4.02Å; D141-F146 HydrophobicContact CB-CD2 3.94Å; D141-F146 HydrophobicContact CB-CE1 3.8Å; D141-F146 HydrophobicContact CB-CE2 3.74Å; D141-F146 HydrophobicContact CB-CG 4.09Å; D141-F146 HydrophobicContact CB-CZ 3.67Å; D141-F146 VanDerWaalsContact CB-O 3.29Å; D141-F146 WeakPolarHBondContact CB-O 3.1Å; D141-F146 VanDerWaalsContact CG-CE1 3.46Å; D141-F146 VanDerWaalsContact CG-CZ 3.4Å; D141-F146 PolarHBondContact N-O 3.17Å; D141-F146 WeakPolarHBondContact OD1-CE1 3.43Å; D141-F146 WeakPolarHBondContact OD1-CZ 3.46Å
142	P	93.8	Very high	95.7	Very high	55 Å²	55	32.8 Å²	32.8	36%	0.357	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-32	173	23.3	-40.3	0	0	0	115.1	N144 A184	P142-N144 VanDerWaalsContact C-N 3.31Å; P142-A184 HydrophobicContact CB-CB 4.1Å
143	T	93.9	Very high	95.7	Very high	86 Å²	86	29.5 Å²	29.5	53%	0.528	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-10.6	178.6	74.5	0	0	0	0	113.1	D141 D145	D141-T143 PolarHBondContact O-N 3.12Å; D141-T143 WeakPolarHBondContact OD2-CB 3.18Å; D141-T143 WeakPolarHBondContact OD2-CG2 3.48Å; D141-T143 PolarHBondContact OD2-N 2.96Å; D141-T143 PolarHBondContact OD2-OG1 3.2Å; T143-D145 PolarHBondContact O-N 3.01Å; T143-D145 WeakPolarHBondContact OG1-CB 3.26Å; T143-D145 PolarHBondContact OG1-N 3.39Å; T143-D145 PolarHBondContact OG1-OD2 2.75Å
144	N	93.3	Very high	95.8	Very high	31 Å²	31	35.8 Å²	35.8	17%	0.166	18%	0.178	C	C	.	.	S	Bend	trans	66.5	15.8	-175.1	-153.9	31.5	0	0	0	114.9	D141 P142 F161 R400 S401	D141-N144 PolarHBondContact O-N 2.79Å; P142-N144 VanDerWaalsContact C-N 3.31Å; N144-F161 WeakPolarHBondContact O-CD1 3.41Å; N144-R400 HydrophobicContact CB-CB 4.18Å; N144-S401 PolarHBondContact ND2-OG 3.05Å
145	D	94.3	Very high	95.9	Very high	96 Å²	96	33.2 Å²	33.2	51%	0.513	17%	0.172	S	C	.	.	S	Bend	trans	-76.9	-34.8	179.3	-69.2	-36.9	0	0	0	112.7	T143 F161	T143-D145 PolarHBondContact O-N 3.01Å; T143-D145 WeakPolarHBondContact OG1-CB 3.26Å; T143-D145 PolarHBondContact OG1-N 3.39Å; T143-D145 PolarHBondContact OG1-OD2 2.75Å; D145-F161 WeakPolarHBondContact O-CB 3.46Å; D145-F161 PolarHBondContact O-N 3.43Å
146	F	95.6	Very high	95.9	Very high	35 Å²	35	33.3 Å²	33.3	15%	0.154	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	161.8	-179	63.6	-91.6	0	0	0	111	D141 V148 V158 W159 L203	D141-F146 HydrophobicContact CB-CD1 4.02Å; D141-F146 HydrophobicContact CB-CD2 3.94Å; D141-F146 HydrophobicContact CB-CE1 3.8Å; D141-F146 HydrophobicContact CB-CE2 3.74Å; D141-F146 HydrophobicContact CB-CG 4.09Å; D141-F146 HydrophobicContact CB-CZ 3.67Å; D141-F146 VanDerWaalsContact CB-O 3.29Å; D141-F146 WeakPolarHBondContact CB-O 3.1Å; D141-F146 VanDerWaalsContact CG-CE1 3.46Å; D141-F146 VanDerWaalsContact CG-CZ 3.4Å; D141-F146 PolarHBondContact N-O 3.17Å; D141-F146 WeakPolarHBondContact OD1-CE1 3.43Å; D141-F146 WeakPolarHBondContact OD1-CZ 3.46Å; F146-V148 HydrophobicContact CD2-CG2 3.96Å; F146-V148 HydrophobicContact CE2-CG2 3.96Å; F146-V158 HydrophobicContact CB-CG1 4.08Å; F146-V158 HydrophobicContact CD2-CG1 3.5Å; F146-V158 HydrophobicContact CE2-CG1 4.16Å; F146-V158 HydrophobicContact CG-CG1 3.96Å; F146-W159 CarbonylContact C-O 3.56Å; F146-W159 WeakPolarHBondContact CA-O 3.49Å; F146-W159 WeakPolarHBondContact CB-O 3.45Å; F146-L203 HydrophobicContact CZ-CD1 4.21Å
147	F	96.9	Very high	95.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	151.7	171	67.4	-83.5	0	0	0	109.4	V138 A139 F140 T149 W159 F161 I414	V138-F147 HydrophobicContact CG1-CD2 4.34Å; A139-F147 CarbonylContact O-C 3.52Å; A139-F147 WeakPolarHBondContact O-CA 3.42Å; F140-F147 HydrophobicContact CD1-CB 3.67Å; F140-F147 HydrophobicContact CE1-CB 3.81Å; F140-F147 HydrophobicContact CE1-CG 4.35Å; F140-F147 HydrophobicContact CG-CB 4.26Å; F140-F147 HydrophobicContact CZ-CB 4.5Å; F147-T149 HydrophobicContact CD2-CG2 3.74Å; F147-T149 HydrophobicContact CE2-CG2 3.73Å; F147-W159 HydrophobicContact CD1-CB 3.98Å; F147-W159 HydrophobicContact CD2-CB 4.25Å; F147-W159 HydrophobicContact CE1-CB 3.47Å; F147-W159 VanDerWaalsContact CE1-CB 3.47Å; F147-W159 HydrophobicContact CE1-CG 4.33Å; F147-W159 HydrophobicContact CE2-CB 3.75Å; F147-W159 AromaticContact CE2-CD1 3.57Å; F147-W159 AromaticContact CE2-CG 3.8Å; F147-W159 HydrophobicContact CE2-CG 3.8Å; F147-W159 HydrophobicContact CG-CB 4.35Å; F147-W159 HydrophobicContact CZ-CB 3.35Å; F147-W159 AromaticContact CZ-CD1 3.98Å; F147-W159 AromaticContact CZ-CG 3.72Å; F147-W159 HydrophobicContact CZ-CG 3.72Å; F147-W159 PolarHBondContact N-O 3.27Å; F147-W159 PolarHBondContact O-N 3.41Å; F147-F161 HydrophobicContact CD1-CB 4.14Å; F147-F161 AromaticContact CD1-CD2 3.74Å; F147-F161 HydrophobicContact CD1-CD2 3.74Å; F147-F161 HydrophobicContact CD1-CG 4.42Å; F147-F161 HydrophobicContact CE1-CD2 4.08Å; F147-I414 HydrophobicContact CE2-CD1 4.32Å; F147-I414 HydrophobicContact CE2-CG2 4.02Å; F147-I414 HydrophobicContact CZ-CG2 4.38Å
148	V	97.2	Very high	95.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	139.1	-176.1	-170.8	0	0	0	0	109.1	V138 A139 F146 I156 K157 V158 V180 V182 L189	V138-V148 CarbonylContact C-O 3.46Å; V138-V148 VanDerWaalsContact CA-O 3.3Å; V138-V148 WeakPolarHBondContact CA-O 3.49Å; A139-V148 PolarHBondContact N-O 2.87Å; A139-V148 PolarHBondContact O-N 2.86Å; F146-V148 HydrophobicContact CD2-CG2 3.96Å; F146-V148 HydrophobicContact CE2-CG2 3.96Å; V148-I156 HydrophobicContact CG1-CG2 3.19Å; V148-K157 WeakPolarHBondContact CA-O 3.48Å; V148-V158 HydrophobicContact CG1-CG2 4.23Å; V148-V158 HydrophobicContact CG2-CB 4.48Å; V148-V158 HydrophobicContact CG2-CG1 4.26Å; V148-V158 HydrophobicContact CG2-CG2 3.99Å; V148-V180 HydrophobicContact CB-CG1 4.17Å; V148-V180 HydrophobicContact CG1-CG1 3.93Å; V148-V182 HydrophobicContact CG2-CG2 4.35Å; V148-L189 HydrophobicContact CB-CD1 3.87Å; V148-L189 HydrophobicContact CG1-CD1 3.65Å; V148-L189 HydrophobicContact CG2-CD1 3.59Å
149	T	97.5	Very high	96	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	137.3	-179.1	55.3	0	0	0	0	110.4	H131 V135 C137 V138 F147 I156 K157 W159 I414	H131-T149 PolarHBondContact NE2-OG1 3.08Å; V135-T149 HydrophobicContact CG1-CG2 4.44Å; C137-T149 WeakPolarHBondContact O-CA 3.39Å; V138-T149 HydrophobicContact CG1-CG2 4.44Å; V138-T149 HydrophobicContact CG2-CG2 4.08Å; F147-T149 HydrophobicContact CD2-CG2 3.74Å; F147-T149 HydrophobicContact CE2-CG2 3.73Å; T149-I156 CarbonylContact O-C 3.46Å; T149-I156 WeakPolarHBondContact O-CA 3.2Å; T149-K157 PolarHBondContact N-O 3.48Å; T149-K157 PolarHBondContact O-N 2.89Å; T149-K157 PolarHBondContact OG1-O 3.22Å; T149-W159 PolarHBondContact OG1-NE1 2.87Å; T149-I414 HydrophobicContact CG2-CD1 3.67Å; T149-I414 HydrophobicContact CG2-CG1 4.36Å
150	G	96.8	Very high	95.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134.2	173.3	0	0	0	0	0	110.6	R136 C137	R136-G150 PolarHBondContact N-O 3.37Å; C137-G150 PolarHBondContact N-O 2.86Å; C137-G150 PolarHBondContact O-N 2.89Å; C137-G150 WeakPolarHBondContact SG-CA 3.34Å
151	A	96.5	Very high	95.8	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	171.3	-176.5	0	0	0	0	0	113.3	H131 W134 D153 R154 M155 V177	H131-A151 HydrophobicContact CB-CB 4.06Å; H131-A151 WeakPolarHBondContact ND1-CB 3.5Å; W134-A151 CarbonylContact O-C 3.53Å; W134-A151 VanDerWaalsContact O-CA 3.23Å; W134-A151 WeakPolarHBondContact O-CA 3.41Å; A151-D153 PolarHBondContact O-N 3.46Å; A151-R154 PolarHBondContact O-N 2.74Å; A151-M155 PolarHBondContact N-O 2.95Å; A151-V177 PolarHBondContact O-N 2.79Å
152	A	96.2	Very high	95.7	Very high	29 Å²	29	34.7 Å²	34.7	24%	0.24	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-15.1	173.2	0	0	0	0	0	113.2	W134 R154 T176	W134-A152 HydrophobicContact CB-CB 4.19Å; W134-A152 PolarHBondContact O-N 2.92Å; A152-R154 PolarHBondContact O-N 3.47Å; A152-R154 VanDerWaalsContact O-N 3.11Å; A152-T176 HydrophobicContact CB-CG2 3.92Å
153	D	95.3	Very high	95.7	Very high	33 Å²	33	34.6 Å²	34.6	18%	0.176	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	0.1	176	-54.5	-45.8	0	0	0	114.2	T132 G133 A151 M155	T132-D153 WeakPolarHBondContact CA-OD2 3.44Å; T132-D153 PolarHBondContact N-OD2 2.78Å; T132-D153 PolarHBondContact OG1-OD1 2.97Å; T132-D153 PolarHBondContact OG1-OD2 2.85Å; G133-D153 VanDerWaalsContact CA-OD1 3.26Å; G133-D153 WeakPolarHBondContact CA-OD1 3.47Å; G133-D153 PolarHBondContact N-OD1 2.99Å; G133-D153 PolarHBondContact N-OD2 2.98Å; A151-D153 PolarHBondContact O-N 3.46Å; D153-M155 HydrophobicContact CB-CG 4.25Å; D153-M155 PolarHBondContact O-N 3.15Å
154	R	96.1	Very high	95.5	Very high	139 Å²	139	31.1 Å²	31.1	53%	0.525	17%	0.171	S	C	.	.	S	Bend	trans	70.2	8.7	-176.1	-39.9	166	-76.2	-164.1	0.4	113.5	A151 A152 H173 I174 S175	A151-R154 PolarHBondContact O-N 2.74Å; A152-R154 PolarHBondContact O-N 3.47Å; A152-R154 VanDerWaalsContact O-N 3.11Å; R154-H173 WeakPolarHBondContact CB-O 3.44Å; R154-I174 WeakPolarHBondContact CD-O 3.43Å; R154-S175 WeakPolarHBondContact CB-O 3.15Å; R154-S175 WeakPolarHBondContact CG-O 3.39Å
155	M	96.5	Very high	95.6	Very high	62 Å²	62	33.4 Å²	33.4	31%	0.305	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	146.5	-179.7	-57.5	-61.2	-125.7	0	0	110.5	A151 D153 T169 T171	A151-M155 PolarHBondContact N-O 2.95Å; D153-M155 HydrophobicContact CB-CG 4.25Å; D153-M155 PolarHBondContact O-N 3.15Å; M155-T169 HydrophobicContact CB-CG2 4.25Å; M155-T169 HydrophobicContact CE-CG2 4.04Å; M155-T169 HydrophobicContact CG-CG2 4.46Å; M155-T169 HydrophobicContact SD-CG2 4.43Å; M155-T171 HydrophobicContact CE-CG2 3.31Å; M155-T171 HydrophobicContact SD-CG2 3.45Å; M155-T171 WeakPolarHBondContact SD-CG2 3.36Å
156	I	97.4	Very high	95.7	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.2	168.2	-59.2	172.5	0	0	0	106.5	V148 T149 L170 V177 V180 L189 W201	V148-I156 HydrophobicContact CG1-CG2 3.19Å; T149-I156 CarbonylContact O-C 3.46Å; T149-I156 WeakPolarHBondContact O-CA 3.2Å; I156-L170 HydrophobicContact CB-CB 4.12Å; I156-L170 HydrophobicContact CG2-CD1 4.45Å; I156-L170 PolarHBondContact N-O 2.85Å; I156-L170 PolarHBondContact O-N 2.9Å; I156-V177 HydrophobicContact CD1-CG1 4.27Å; I156-V177 HydrophobicContact CD1-CG2 4.43Å; I156-V177 HydrophobicContact CG1-CB 4.44Å; I156-V177 HydrophobicContact CG1-CG1 4.06Å; I156-V177 HydrophobicContact CG1-CG2 3.89Å; I156-V180 HydrophobicContact CD1-CG2 4.39Å; I156-V180 HydrophobicContact CG1-CG2 4.5Å; I156-L189 HydrophobicContact CD1-CD2 4.43Å; I156-W201 HydrophobicContact CD1-CZ2 4.06Å
157	K	97.1	Very high	95.7	Very high	33 Å²	33	35.6 Å²	35.6	14%	0.143	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131	179.5	-68.3	-174.1	172.6	-159.6	0	110	G130 H131 V148 T149 W159 L166 T169	G130-K157 PolarHBondContact O-NZ 2.82Å; H131-K157 VanDerWaalsContact CE1-CD 3.43Å; H131-K157 WeakPolarHBondContact CE1-CD 3.29Å; H131-K157 VanDerWaalsContact CE1-CG 3.43Å; H131-K157 WeakPolarHBondContact CE1-CG 2.99Å; H131-K157 WeakPolarHBondContact ND1-CD 3.44Å; V148-K157 WeakPolarHBondContact CA-O 3.48Å; T149-K157 PolarHBondContact N-O 3.48Å; T149-K157 PolarHBondContact O-N 2.89Å; T149-K157 PolarHBondContact OG1-O 3.22Å; K157-W159 HydrophobicContact CB-CZ2 4.14Å; K157-W159 HydrophobicContact CD-CZ2 3.84Å; K157-L166 HydrophobicContact CB-CD1 4.09Å; K157-L166 HydrophobicContact CD-CD1 3.5Å; K157-L166 HydrophobicContact CG-CD1 3.93Å; K157-T169 HydrophobicContact CG-CG2 4.22Å
158	V	97	Very high	95.6	Very high	6 Å²	6	38.8 Å²	38.8	4%	0.036	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.3	174.7	-175.7	0	0	0	0	108	F146 V148 K167 L168 L170	F146-V158 HydrophobicContact CB-CG1 4.08Å; F146-V158 HydrophobicContact CD2-CG1 3.5Å; F146-V158 HydrophobicContact CE2-CG1 4.16Å; F146-V158 HydrophobicContact CG-CG1 3.96Å; V148-V158 HydrophobicContact CG1-CG2 4.23Å; V148-V158 HydrophobicContact CG2-CB 4.48Å; V148-V158 HydrophobicContact CG2-CG1 4.26Å; V148-V158 HydrophobicContact CG2-CG2 3.99Å; V158-K167 HydrophobicContact CG1-CB 4.48Å; V158-K167 PolarHBondContact O-N 2.67Å; V158-L168 HydrophobicContact CB-CB 4.09Å; V158-L168 HydrophobicContact CG2-CB 4.2Å; V158-L168 PolarHBondContact N-O 3.01Å; V158-L168 PolarHBondContact O-N 2.82Å; V158-L170 HydrophobicContact CG2-CD1 4.46Å
159	W	96.8	Very high	95.6	Very high	9 Å²	9	41.5 Å²	41.5	3%	0.034	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.1	-176.6	-58.5	93.7	0	0	0	109.8	V128 H131 F146 F147 T149 K157 F161 T165 L166 I414	V128-W159 HydrophobicContact CG1-CD2 4.07Å; V128-W159 HydrophobicContact CG1-CE3 3.55Å; V128-W159 HydrophobicContact CG1-CH2 3.7Å; V128-W159 HydrophobicContact CG1-CZ2 4.2Å; V128-W159 HydrophobicContact CG1-CZ3 3.35Å; H131-W159 AromaticContact NE2-NE1 3.91Å; F146-W159 CarbonylContact C-O 3.56Å; F146-W159 WeakPolarHBondContact CA-O 3.49Å; F146-W159 WeakPolarHBondContact CB-O 3.45Å; F147-W159 HydrophobicContact CD1-CB 3.98Å; F147-W159 HydrophobicContact CD2-CB 4.25Å; F147-W159 HydrophobicContact CE1-CB 3.47Å; F147-W159 VanDerWaalsContact CE1-CB 3.47Å; F147-W159 HydrophobicContact CE1-CG 4.33Å; F147-W159 HydrophobicContact CE2-CB 3.75Å; F147-W159 AromaticContact CE2-CD1 3.57Å; F147-W159 AromaticContact CE2-CG 3.8Å; F147-W159 HydrophobicContact CE2-CG 3.8Å; F147-W159 HydrophobicContact CG-CB 4.35Å; F147-W159 HydrophobicContact CZ-CB 3.35Å; F147-W159 AromaticContact CZ-CD1 3.98Å; F147-W159 AromaticContact CZ-CG 3.72Å; F147-W159 HydrophobicContact CZ-CG 3.72Å; F147-W159 PolarHBondContact N-O 3.27Å; F147-W159 PolarHBondContact O-N 3.41Å; T149-W159 PolarHBondContact OG1-NE1 2.87Å; K157-W159 HydrophobicContact CB-CZ2 4.14Å; K157-W159 HydrophobicContact CD-CZ2 3.84Å; W159-F161 PolarHBondContact O-N 2.96Å; W159-T165 CarbonylContact C-O 3.52Å; W159-T165 WeakPolarHBondContact CA-O 3.13Å; W159-L166 HydrophobicContact CE3-CB 3.87Å; W159-L166 HydrophobicContact CH2-CB 4.23Å; W159-L166 HydrophobicContact CH2-CD1 3.84Å; W159-L166 HydrophobicContact CZ2-CD1 4.01Å; W159-L166 HydrophobicContact CZ3-CB 3.65Å; W159-L166 HydrophobicContact CZ3-CD1 4.11Å; W159-L166 HydrophobicContact CZ3-CG 4.45Å; W159-I414 HydrophobicContact CZ2-CD1 4.09Å
160	D	95.9	Very high	95.5	Very high	29 Å²	29	41.9 Å²	41.9	16%	0.155	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.6	168.1	-170.7	48.8	0	0	0	110.1	S163 G164 T165 K167	D160-S163 VanDerWaalsContact CB-OG 3.32Å; D160-S163 WeakPolarHBondContact CB-OG 3.16Å; D160-S163 VanDerWaalsContact OD2-CB 3.26Å; D160-S163 WeakPolarHBondContact OD2-CB 3.34Å; D160-S163 PolarHBondContact OD2-N 2.95Å; D160-S163 VanDerWaalsContact OD2-N 3.09Å; D160-S163 PolarHBondContact OD2-OG 3.36Å; D160-G164 WeakPolarHBondContact O-CA 3.46Å; D160-G164 PolarHBondContact O-N 3.34Å; D160-T165 PolarHBondContact N-O 3.13Å; D160-K167 HydrophobicContact CB-CD 4.04Å; D160-K167 HydrophobicContact CB-CG 4.08Å; D160-K167 WeakPolarHBondContact OD1-CE 3.36Å; D160-K167 IonicContact OD1-NZ 3.06Å; D160-K167 PolarHBondContact OD1-NZ 2.94Å
161	F	93.7	Very high	95.5	Very high	13 Å²	13	46.1 Å²	46.1	6%	0.057	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-40.1	-173.6	-176	-121.3	0	0	0	112.3	F140 N144 D145 F147 W159 D399 R404 V406	F140-F161 AromaticContact CE1-CD2 3.79Å; F140-F161 HydrophobicContact CE1-CD2 3.79Å; F140-F161 AromaticContact CE1-CE2 3.55Å; F140-F161 HydrophobicContact CE1-CE2 3.55Å; F140-F161 HydrophobicContact CE1-CZ 4.09Å; F140-F161 HydrophobicContact CZ-CE2 4.1Å; N144-F161 WeakPolarHBondContact O-CD1 3.41Å; D145-F161 WeakPolarHBondContact O-CB 3.46Å; D145-F161 PolarHBondContact O-N 3.43Å; F147-F161 HydrophobicContact CD1-CB 4.14Å; F147-F161 AromaticContact CD1-CD2 3.74Å; F147-F161 HydrophobicContact CD1-CD2 3.74Å; F147-F161 HydrophobicContact CD1-CG 4.42Å; F147-F161 HydrophobicContact CE1-CD2 4.08Å; W159-F161 PolarHBondContact O-N 2.96Å; F161-D399 HydrophobicContact CE1-CB 4.11Å; F161-D399 HydrophobicContact CE2-CB 4.49Å; F161-D399 HydrophobicContact CZ-CB 3.65Å; F161-R404 HydrophobicContact CZ-CB 3.85Å; F161-R404 VanDerWaalsContact CZ-CD 3.46Å; F161-R404 HydrophobicContact CZ-CG 4.2Å; F161-V406 HydrophobicContact CE2-CG2 4.35Å
162	A	92.6	Very high	95.3	Very high	71 Å²	71	47.7 Å²	47.7	59%	0.587	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-52.9	-178.7	0	0	0	0	0	111.8	R126	R126-A162 PolarHBondContact NH1-O 3.02Å; R126-A162 PolarHBondContact NH2-O 2.88Å
163	S	92.5	Very high	95.3	Very high	54 Å²	54	46.9 Å²	46.9	38%	0.378	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-24.9	-178.5	66.9	0	0	0	0	113.9	R126 D160 T165	R126-S163 VanDerWaalsContact NH1-C 3.32Å; R126-S163 PolarHBondContact NH1-O 3.36Å; D160-S163 VanDerWaalsContact CB-OG 3.32Å; D160-S163 WeakPolarHBondContact CB-OG 3.16Å; D160-S163 VanDerWaalsContact OD2-CB 3.26Å; D160-S163 WeakPolarHBondContact OD2-CB 3.34Å; D160-S163 PolarHBondContact OD2-N 2.95Å; D160-S163 VanDerWaalsContact OD2-N 3.09Å; D160-S163 PolarHBondContact OD2-OG 3.36Å; S163-T165 PolarHBondContact OG-N 2.93Å; S163-T165 PolarHBondContact OG-OG1 2.9Å
164	G	90.9	Very high	95.3	Very high	12 Å²	12	51.3 Å²	51.3	12%	0.124	29%	0.286	C	S	.	.			trans	73.3	14.4	-171.5	0	0	0	0	0	113.5	D160	D160-G164 WeakPolarHBondContact O-CA 3.46Å; D160-G164 PolarHBondContact O-N 3.34Å
165	T	95.1	Very high	95.4	Very high	79 Å²	79	46.4 Å²	46.4	49%	0.485	27%	0.273	S	S	.	.			trans	-88.6	152.9	-179.2	61.9	0	0	0	0	111.7	W159 D160 S163 K167	W159-T165 CarbonylContact C-O 3.52Å; W159-T165 WeakPolarHBondContact CA-O 3.13Å; D160-T165 PolarHBondContact N-O 3.13Å; S163-T165 PolarHBondContact OG-N 2.93Å; S163-T165 PolarHBondContact OG-OG1 2.9Å; T165-K167 PolarHBondContact O-N 2.78Å
166	L	96.4	Very high	95.4	Very high	75 Å²	75	44.5 Å²	44.5	39%	0.393	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	119.4	175.8	-177.7	128.5	0	0	0	109.8	K157 W159	K157-L166 HydrophobicContact CB-CD1 4.09Å; K157-L166 HydrophobicContact CD-CD1 3.5Å; K157-L166 HydrophobicContact CG-CD1 3.93Å; W159-L166 HydrophobicContact CE3-CB 3.87Å; W159-L166 HydrophobicContact CH2-CB 4.23Å; W159-L166 HydrophobicContact CH2-CD1 3.84Å; W159-L166 HydrophobicContact CZ2-CD1 4.01Å; W159-L166 HydrophobicContact CZ3-CB 3.65Å; W159-L166 HydrophobicContact CZ3-CD1 4.11Å; W159-L166 HydrophobicContact CZ3-CG 4.45Å
167	K	95.1	Very high	95.4	Very high	102 Å²	102	44.5 Å²	44.5	44%	0.443	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-53.9	175.5	-80.3	179.2	169.4	162.8	0	111.5	V158 D160 T165	V158-K167 HydrophobicContact CG1-CB 4.48Å; V158-K167 PolarHBondContact O-N 2.67Å; D160-K167 HydrophobicContact CB-CD 4.04Å; D160-K167 HydrophobicContact CB-CG 4.08Å; D160-K167 WeakPolarHBondContact OD1-CE 3.36Å; D160-K167 IonicContact OD1-NZ 3.06Å; D160-K167 PolarHBondContact OD1-NZ 2.94Å; T165-K167 PolarHBondContact O-N 2.78Å
168	L	95.4	Very high	95.4	Very high	67 Å²	67	44.9 Å²	44.9	35%	0.351	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.1	-170.8	-72.9	153.7	0	0	0	110.4	V158	V158-L168 HydrophobicContact CB-CB 4.09Å; V158-L168 HydrophobicContact CG2-CB 4.2Å; V158-L168 PolarHBondContact N-O 3.01Å; V158-L168 PolarHBondContact O-N 2.82Å
169	T	96.6	Very high	95.4	Very high	57 Å²	57	44.7 Å²	44.7	35%	0.35	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	118.3	168.2	-58.1	0	0	0	0	108.3	M155 K157 T171	M155-T169 HydrophobicContact CB-CG2 4.25Å; M155-T169 HydrophobicContact CE-CG2 4.04Å; M155-T169 HydrophobicContact CG-CG2 4.46Å; M155-T169 HydrophobicContact SD-CG2 4.43Å; K157-T169 HydrophobicContact CG-CG2 4.22Å; T169-T171 HydrophobicContact CG2-CG2 4.39Å
170	L	96	Very high	95.4	Very high	9 Å²	9	44.6 Å²	44.6	5%	0.047	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127	178.7	-62.7	175.2	0	0	0	109.2	I156 V158 W201 N206	I156-L170 HydrophobicContact CB-CB 4.12Å; I156-L170 HydrophobicContact CG2-CD1 4.45Å; I156-L170 PolarHBondContact N-O 2.85Å; I156-L170 PolarHBondContact O-N 2.9Å; V158-L170 HydrophobicContact CG2-CD1 4.46Å; L170-W201 HydrophobicContact CB-CE3 4.1Å; L170-W201 HydrophobicContact CB-CH2 3.98Å; L170-W201 HydrophobicContact CB-CZ3 3.71Å; L170-W201 HydrophobicContact CD1-CD2 4.22Å; L170-W201 HydrophobicContact CD1-CE3 3.97Å; L170-W201 HydrophobicContact CD1-CZ3 4.44Å; L170-W201 HydrophobicContact CD2-CE3 4.08Å; L170-W201 HydrophobicContact CD2-CZ3 4.12Å; L170-W201 HydrophobicContact CG-CE3 4.28Å; L170-W201 HydrophobicContact CG-CZ3 4.31Å; L170-N206 HydrophobicContact CD2-CB 4.12Å
171	T	95.6	Very high	95.4	Very high	88 Å²	88	44.5 Å²	44.5	54%	0.54	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.9	-176.3	78.5	0	0	0	0	109.1	M155 T169 W201	M155-T171 HydrophobicContact CE-CG2 3.31Å; M155-T171 HydrophobicContact SD-CG2 3.45Å; M155-T171 WeakPolarHBondContact SD-CG2 3.36Å; T169-T171 HydrophobicContact CG2-CG2 4.39Å; T171-W201 VanDerWaalsContact O-CH2 3.32Å; T171-W201 WeakPolarHBondContact O-CH2 3.32Å
172	G	93	Very high	95.6	Very high	34 Å²	34	44.8 Å²	44.8	35%	0.351	27%	0.268	S	S	.	.			trans	165	-23.6	-179.1	0	0	0	0	0	114.8	R199	G172-R199 PolarHBondContact O-NH1 3.25Å; G172-R199 PolarHBondContact O-NH2 3.31Å
173	H	96.2	Very high	95.7	Very high	12 Å²	12	41.7 Å²	41.7	6%	0.056	24%	0.242	C	C	.	.			trans	-73	142.6	171.2	-81	-86.4	0	0	0	112.2	R154 V177 S191 D195 R199	R154-H173 WeakPolarHBondContact CB-O 3.44Å; H173-V177 HydrophobicContact CB-CG2 3.87Å; H173-S191 PolarHBondContact NE2-OG 2.78Å; H173-D195 IonicContact CE1-OD1 3.86Å; H173-D195 IonicContact CE1-OD2 3.53Å; H173-D195 IonicContact CG-OD2 3.78Å; H173-D195 IonicContact ND1-OD1 2.67Å; H173-D195 PolarHBondContact ND1-OD1 2.89Å; H173-D195 IonicContact ND1-OD2 3.26Å; H173-D195 PolarHBondContact ND1-OD2 3.46Å; H173-R199 VanDerWaalsContact CA-NH1 3.28Å; H173-R199 PolarHBondContact CE1-NH1 2.85Å; H173-R199 PolarHBondContact ND1-NH1 3.27Å
174	I	96.5	Very high	95.7	Very high	125 Å²	125	43 Å²	43	64%	0.641	26%	0.256	S	S	*	.	S	Bend	trans	-89.4	-28.3	-179.8	-58.5	166.8	0	0	0	110.3	R154 D195	R154-I174 WeakPolarHBondContact CD-O 3.43Å; I174-D195 HydrophobicContact CB-CB 4.05Å; I174-D195 PolarHBondContact N-OD2 2.85Å
175	S	96.7	Very high	95.9	Very high	37 Å²	37	48.1 Å²	48.1	26%	0.259	27%	0.272	S	S	.	.	S	Bend	trans	-127.9	-175.8	179	-163	0	0	0	0	110.8	R154	R154-S175 WeakPolarHBondContact CB-O 3.15Å; R154-S175 WeakPolarHBondContact CG-O 3.39Å
176	T	97	Very high	95.8	Very high	22 Å²	22	47.1 Å²	47.1	14%	0.135	26%	0.262	C	S	.	.			trans	-56.1	138.3	-177.3	72.4	0	0	0	0	111.3	A152 G193 E194	A152-T176 HydrophobicContact CB-CG2 3.92Å; T176-G193 WeakPolarHBondContact O-CA 3.39Å; T176-E194 PolarHBondContact O-N 2.87Å; T176-E194 WeakPolarHBondContact OG1-CG 3.13Å; T176-E194 PolarHBondContact OG1-OE1 3.4Å; T176-E194 PolarHBondContact OG1-OE2 3.06Å
177	V	97.3	Very high	95.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.9	174.9	-175.9	0	0	0	0	107.8	R136 A151 I156 H173 V180	R136-V177 WeakPolarHBondContact CB-O 3.32Å; A151-V177 PolarHBondContact O-N 2.79Å; I156-V177 HydrophobicContact CD1-CG1 4.27Å; I156-V177 HydrophobicContact CD1-CG2 4.43Å; I156-V177 HydrophobicContact CG1-CB 4.44Å; I156-V177 HydrophobicContact CG1-CG1 4.06Å; I156-V177 HydrophobicContact CG1-CG2 3.89Å; H173-V177 HydrophobicContact CB-CG2 3.87Å; V177-V180 HydrophobicContact CG1-CG2 3.65Å
178	R	96.8	Very high	95.8	Very high	42 Å²	42	44.4 Å²	44.4	16%	0.158	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-31.2	-170.4	-72	-57.6	-53.5	-90.6	-13.3	113.8	R136 C137 C192 E194 V219 Y220	R136-R178 VanDerWaalsContact CZ-CZ 3.41Å; R136-R178 VanDerWaalsContact CZ-NE 3.32Å; R136-R178 VanDerWaalsContact NH2-NH1 3.12Å; R136-R178 VanDerWaalsContact NH2-NH2 3.19Å; C137-R178 WeakPolarHBondContact CB-O 3.38Å; R178-C192 PolarHBondContact N-O 3.04Å; R178-E194 HydrophobicContact CG-CG 3.74Å; R178-E194 IonicContact NH1-OE1 3.88Å; R178-E194 PolarHBondContact NH1-OE1 2.97Å; R178-V219 WeakPolarHBondContact CB-O 3.32Å; R178-Y220 CarbonylContact C-O 3.56Å; R178-Y220 VanDerWaalsContact NH2-CD1 3.25Å
179	G	96.6	Very high	95.9	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.7	175.6	0	0	0	0	0	110.1	S191 C192	G179-S191 CarbonylContact O-C 3.6Å; G179-S191 WeakPolarHBondContact O-CA 3.44Å; G179-C192 WeakPolarHBondContact CA-SG 3.46Å; G179-C192 PolarHBondContact N-O 2.78Å; G179-C192 PolarHBondContact N-SG 2.89Å; G179-C192 VanDerWaalsContact N-SG 3.37Å; G179-C192 PolarHBondContact O-N 3.48Å
180	V	97.2	Very high	95.9	Very high	7 Å²	7	38.5 Å²	38.5	4%	0.042	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.4	173.5	173.9	0	0	0	0	106.4	A139 V148 I156 V177 L189 F190	A139-V180 HydrophobicContact CB-CG1 4.25Å; A139-V180 WeakPolarHBondContact CB-O 3.27Å; V148-V180 HydrophobicContact CB-CG1 4.17Å; V148-V180 HydrophobicContact CG1-CG1 3.93Å; I156-V180 HydrophobicContact CD1-CG2 4.39Å; I156-V180 HydrophobicContact CG1-CG2 4.5Å; V177-V180 HydrophobicContact CG1-CG2 3.65Å; V180-L189 HydrophobicContact CG1-CD1 3.81Å; V180-L189 HydrophobicContact CG1-CD2 4.11Å; V180-L189 HydrophobicContact CG1-CG 4.01Å; V180-F190 CarbonylContact C-O 3.6Å; V180-F190 VanDerWaalsContact CA-O 3.3Å; V180-F190 WeakPolarHBondContact CA-O 3.47Å
181	V	97.1	Very high	96	Very high	27 Å²	27	38 Å²	38	16%	0.164	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	141.5	174	119.2	0	0	0	0	109.3	F190 I222 I224	V181-F190 PolarHBondContact N-O 2.89Å; V181-F190 PolarHBondContact O-N 2.71Å; V181-I222 HydrophobicContact CB-CG2 4.42Å; V181-I224 HydrophobicContact CG1-CB 4.13Å; V181-I224 HydrophobicContact CG1-CD1 3.19Å; V181-I224 HydrophobicContact CG1-CG1 3.4Å
182	V	96.5	Very high	96.1	Very high	19 Å²	19	33.9 Å²	33.9	12%	0.115	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	177.6	-174.8	0	0	0	0	108.3	A139 V148 L189 L203	A139-V182 HydrophobicContact CB-CG2 4.23Å; V148-V182 HydrophobicContact CG2-CG2 4.35Å; V182-L189 HydrophobicContact CG2-CD1 3.98Å; V182-L203 HydrophobicContact CG1-CD1 4.25Å
183	S	95.7	Very high	96.2	Very high	6 Å²	6	32.2 Å²	32.2	4%	0.042	17%	0.173	C	C	.	.			trans	-74.1	132.7	174	177.1	0	0	0	0	110.2	R185 H186 Y188	S183-R185 VanDerWaalsContact C-N 3.34Å; S183-R185 PolarHBondContact OG-N 2.93Å; S183-H186 WeakPolarHBondContact CB-O 3.45Å; S183-H186 VanDerWaalsContact O-O 3.13Å; S183-H186 PolarHBondContact OG-N 3.33Å; S183-H186 PolarHBondContact OG-O 2.76Å; S183-Y188 WeakPolarHBondContact CB-O 3.27Å; S183-Y188 PolarHBondContact N-O 3.31Å
184	A	93.2	Very high	96.2	Very high	82 Å²	82	34.8 Å²	34.8	68%	0.678	19%	0.185	S	C	*	.	S	Bend	trans	-78.3	-20.3	174.3	0	0	0	0	0	113.3	P142	P142-A184 HydrophobicContact CB-CB 4.1Å
185	R	93.3	Very high	96.2	Very high	120 Å²	120	30.1 Å²	30.1	45%	0.453	16%	0.162	S	C	.	.	S	Bend	trans	-99.9	-29.2	-172.2	-71.8	176.8	55.2	-167.1	-8.7	113.8	S183 P226 T227 D229	S183-R185 VanDerWaalsContact C-N 3.34Å; S183-R185 PolarHBondContact OG-N 2.93Å; R185-P226 WeakPolarHBondContact CD-O 3.49Å; R185-T227 PolarHBondContact NH1-O 2.78Å; R185-D229 IonicContact CZ-OD1 3.99Å; R185-D229 VanDerWaalsContact CZ-OD1 3.23Å; R185-D229 IonicContact CZ-OD2 3.89Å; R185-D229 IonicContact NE-OD1 2.95Å; R185-D229 IonicContact NH1-OD1 3.86Å; R185-D229 PolarHBondContact NH1-OD1 2.8Å; R185-D229 IonicContact NH2-OD1 3.15Å; R185-D229 PolarHBondContact NH2-OD1 2.71Å; R185-D229 VanDerWaalsContact NH2-OD1 3.15Å; R185-D229 IonicContact NH2-OD2 3.8Å; R185-D229 PolarHBondContact NH2-OD2 2.89Å
186	H	93.8	Very high	96.2	Very high	58 Å²	58	33.3 Å²	33.3	27%	0.269	17%	0.171	S	C	.	.	S	Bend	trans	-127.9	148.2	-175	-52.2	-67.5	0	0	0	107.8	S183 Y188 D229	S183-H186 WeakPolarHBondContact CB-O 3.45Å; S183-H186 VanDerWaalsContact O-O 3.13Å; S183-H186 PolarHBondContact OG-N 3.33Å; S183-H186 PolarHBondContact OG-O 2.76Å; H186-Y188 HydrophobicContact CB-CD2 3.7Å; H186-Y188 HydrophobicContact CB-CE2 4.15Å; H186-Y188 HydrophobicContact CB-CG 4.2Å; H186-Y188 PolarHBondContact O-N 3.33Å; H186-D229 IonicContact CD2-OD1 2.89Å; H186-D229 IonicContact CE1-OD1 3.78Å; H186-D229 IonicContact NE2-OD1 3.83Å; H186-D229 PolarHBondContact NE2-OD1 2.85Å; H186-D229 IonicContact NE2-OD2 2.68Å
187	P	95	Very high	96.1	Very high	60 Å²	60	33.8 Å²	33.8	39%	0.39	17%	0.174	S	C	.	.	S	Bend	trans	-75	48.4	178.1	33.1	-36.7	0	0	0	112	L203 E204	P187-L203 WeakPolarHBondContact O-CB 3.47Å; P187-L203 PolarHBondContact O-N 2.93Å; P187-E204 HydrophobicContact CB-CG 4.24Å; P187-E204 HydrophobicContact CG-CG 4.34Å
188	Y	96.4	Very high	96.1	Very high	59 Å²	59	33.8 Å²	33.8	23%	0.231	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.7	-176	-64.2	-29.1	0	0	0	111.7	S183 H186 W201 I209	S183-Y188 WeakPolarHBondContact CB-O 3.27Å; S183-Y188 PolarHBondContact N-O 3.31Å; H186-Y188 HydrophobicContact CB-CD2 3.7Å; H186-Y188 HydrophobicContact CB-CE2 4.15Å; H186-Y188 HydrophobicContact CB-CG 4.2Å; H186-Y188 PolarHBondContact O-N 3.33Å; Y188-W201 WeakPolarHBondContact CA-O 3.14Å; Y188-I209 HydrophobicContact CD1-CD1 4.04Å; Y188-I209 HydrophobicContact CE1-CD1 3.5Å; Y188-I209 VanDerWaalsContact CE1-CD1 3.5Å
189	L	97.2	Very high	96.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132.6	169.3	177.2	141.8	0	0	0	109.4	V148 I156 V180 V182 C200 W201 L203	V148-L189 HydrophobicContact CB-CD1 3.87Å; V148-L189 HydrophobicContact CG1-CD1 3.65Å; V148-L189 HydrophobicContact CG2-CD1 3.59Å; I156-L189 HydrophobicContact CD1-CD2 4.43Å; V180-L189 HydrophobicContact CG1-CD1 3.81Å; V180-L189 HydrophobicContact CG1-CD2 4.11Å; V180-L189 HydrophobicContact CG1-CG 4.01Å; V182-L189 HydrophobicContact CG2-CD1 3.98Å; L189-C200 CarbonylContact O-C 3.59Å; L189-W201 HydrophobicContact CB-CB 4.19Å; L189-W201 HydrophobicContact CD2-CB 4.16Å; L189-W201 HydrophobicContact CD2-CG 3.91Å; L189-W201 PolarHBondContact N-O 3.12Å; L189-W201 PolarHBondContact O-N 3.09Å; L189-L203 HydrophobicContact CB-CD1 4.38Å; L189-L203 HydrophobicContact CB-CD2 3.9Å; L189-L203 HydrophobicContact CB-CG 4.13Å; L189-L203 HydrophobicContact CD1-CD2 4.43Å
190	F	97.5	Very high	96.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.3	176.6	-68.6	-95	0	0	0	109.7	V180 V181 R199 C200 Y212 I222 I224 V231 M245	V180-F190 CarbonylContact C-O 3.6Å; V180-F190 VanDerWaalsContact CA-O 3.3Å; V180-F190 WeakPolarHBondContact CA-O 3.47Å; V181-F190 PolarHBondContact N-O 2.89Å; V181-F190 PolarHBondContact O-N 2.71Å; F190-R199 WeakPolarHBondContact CA-O 3.3Å; F190-C200 HydrophobicContact CD1-CB 4.12Å; F190-C200 HydrophobicContact CE1-CB 3.81Å; F190-C200 VanDerWaalsContact CE1-SG 3.58Å; F190-C200 HydrophobicContact CZ-CB 4.39Å; F190-C200 VanDerWaalsContact CZ-SG 3.54Å; F190-Y212 HydrophobicContact CD1-CE2 4.07Å; F190-Y212 AromaticContact CE1-CE2 3.74Å; F190-Y212 HydrophobicContact CE1-CE2 3.74Å; F190-Y212 AromaticContact CE1-CZ 3.94Å; F190-Y212 WeakPolarHBondContact CE1-OH 3.35Å; F190-I222 HydrophobicContact CB-CD1 3.71Å; F190-I224 HydrophobicContact CD2-CD1 3.41Å; F190-I224 VanDerWaalsContact CD2-CD1 3.41Å; F190-I224 HydrophobicContact CD2-CG1 4.23Å; F190-I224 HydrophobicContact CE2-CD1 3.76Å; F190-I224 HydrophobicContact CG-CD1 4.23Å; F190-V231 HydrophobicContact CD1-CG1 4.33Å; F190-V231 HydrophobicContact CD1-CG2 3.72Å; F190-V231 HydrophobicContact CD2-CG2 4.46Å; F190-V231 HydrophobicContact CE1-CG2 3.47Å; F190-V231 VanDerWaalsContact CE1-CG2 3.47Å; F190-V231 HydrophobicContact CE2-CG2 4.24Å; F190-V231 HydrophobicContact CG-CG2 4.21Å; F190-V231 HydrophobicContact CZ-CG2 3.75Å; F190-M245 HydrophobicContact CE1-CG 4.45Å; F190-M245 HydrophobicContact CE1-SD 4.37Å; F190-M245 HydrophobicContact CE2-SD 3.75Å; F190-M245 HydrophobicContact CZ-CG 3.96Å; F190-M245 HydrophobicContact CZ-SD 3.39Å; F190-M245 WeakPolarHBondContact CZ-SD 3.37Å
191	S	97.5	Very high	96.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.4	177.1	65.9	0	0	0	0	111.3	H173 G179 V198 R199 W201	H173-S191 PolarHBondContact NE2-OG 2.78Å; G179-S191 CarbonylContact O-C 3.6Å; G179-S191 WeakPolarHBondContact O-CA 3.44Å; S191-V198 CarbonylContact O-C 3.59Å; S191-V198 VanDerWaalsContact O-CA 3.32Å; S191-V198 WeakPolarHBondContact O-CA 3.39Å; S191-R199 PolarHBondContact N-O 2.82Å; S191-R199 PolarHBondContact O-N 3.07Å; S191-W201 PolarHBondContact OG-NE1 2.85Å
192	C	97	Very high	96.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	152.4	175.3	73	0	0	0	0	110.6	R178 G179 V198 V219 I222	R178-C192 PolarHBondContact N-O 3.04Å; G179-C192 WeakPolarHBondContact CA-SG 3.46Å; G179-C192 PolarHBondContact N-O 2.78Å; G179-C192 PolarHBondContact N-SG 2.89Å; G179-C192 VanDerWaalsContact N-SG 3.37Å; G179-C192 PolarHBondContact O-N 3.48Å; C192-V198 HydrophobicContact CB-CG2 4.03Å; C192-V219 HydrophobicContact CB-CB 3.89Å; C192-V219 HydrophobicContact CB-CG1 3.57Å; C192-I222 HydrophobicContact CB-CB 4.19Å; C192-I222 HydrophobicContact CB-CD1 4.3Å; C192-I222 HydrophobicContact CB-CG2 4.36Å
193	G	95.7	Very high	95.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	178.4	-176.4	0	0	0	0	0	114.7	T176 D195 K196 T197 V219	T176-G193 WeakPolarHBondContact O-CA 3.39Å; G193-D195 PolarHBondContact O-N 3.33Å; G193-K196 PolarHBondContact O-N 3.43Å; G193-T197 PolarHBondContact N-O 3.47Å; G193-V219 PolarHBondContact O-N 2.98Å; G193-V219 VanDerWaalsContact O-N 3.13Å
194	E	96.8	Very high	95.9	Very high	66 Å²	66	39.6 Å²	39.6	31%	0.308	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-10	176.7	-73.2	173.9	179.5	0	0	112.8	T176 R178 K196 A218	T176-E194 PolarHBondContact O-N 2.87Å; T176-E194 WeakPolarHBondContact OG1-CG 3.13Å; T176-E194 PolarHBondContact OG1-OE1 3.4Å; T176-E194 PolarHBondContact OG1-OE2 3.06Å; R178-E194 HydrophobicContact CG-CG 3.74Å; R178-E194 IonicContact NH1-OE1 3.88Å; R178-E194 PolarHBondContact NH1-OE1 2.97Å; E194-K196 PolarHBondContact O-N 2.98Å; E194-A218 HydrophobicContact CB-CB 4.12Å; E194-A218 HydrophobicContact CG-CB 3.98Å
195	D	95.9	Very high	96	Very high	26 Å²	26	41.6 Å²	41.6	14%	0.139	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	6.2	172.3	63.7	1.3	0	0	0	113.6	H173 I174 G193 T197 R199	H173-D195 IonicContact CE1-OD1 3.86Å; H173-D195 IonicContact CE1-OD2 3.53Å; H173-D195 IonicContact CG-OD2 3.78Å; H173-D195 IonicContact ND1-OD1 2.67Å; H173-D195 PolarHBondContact ND1-OD1 2.89Å; H173-D195 IonicContact ND1-OD2 3.26Å; H173-D195 PolarHBondContact ND1-OD2 3.46Å; I174-D195 HydrophobicContact CB-CB 4.05Å; I174-D195 PolarHBondContact N-OD2 2.85Å; G193-D195 PolarHBondContact O-N 3.33Å; D195-T197 WeakPolarHBondContact O-CG2 3.18Å; D195-T197 PolarHBondContact O-N 2.83Å; D195-T197 VanDerWaalsContact O-N 3.15Å; D195-T197 PolarHBondContact OD1-N 3.09Å; D195-T197 PolarHBondContact OD1-OG1 3.15Å; D195-T197 PolarHBondContact OD2-OG1 3.31Å; D195-T197 VanDerWaalsContact OD2-OG1 3.07Å; D195-R199 IonicContact OD2-CZ 2.92Å; D195-R199 IonicContact OD2-NH1 2.89Å; D195-R199 PolarHBondContact OD2-NH1 2.77Å; D195-R199 IonicContact OD2-NH2 2.65Å
196	K	96.4	Very high	96	Very high	104 Å²	104	38.7 Å²	38.7	45%	0.452	19%	0.188	S	C	.	.	S	Bend	trans	66.2	6.5	-179.1	-38.2	-178.5	-178.2	-170.5	0	113.7	G193 E194 M216	G193-K196 PolarHBondContact O-N 3.43Å; E194-K196 PolarHBondContact O-N 2.98Å; K196-M216 PolarHBondContact NZ-O 3.01Å
197	T	95.7	Very high	96.1	Very high	32 Å²	32	42.6 Å²	42.6	20%	0.196	20%	0.203	C	C	.	.			trans	-99.5	143.9	-177.7	70.8	0	0	0	0	110.6	G193 D195 R199	G193-T197 PolarHBondContact N-O 3.47Å; D195-T197 WeakPolarHBondContact O-CG2 3.18Å; D195-T197 PolarHBondContact O-N 2.83Å; D195-T197 VanDerWaalsContact O-N 3.15Å; D195-T197 PolarHBondContact OD1-N 3.09Å; D195-T197 PolarHBondContact OD1-OG1 3.15Å; D195-T197 PolarHBondContact OD2-OG1 3.31Å; D195-T197 VanDerWaalsContact OD2-OG1 3.07Å; T197-R199 PolarHBondContact OG1-NH1 2.56Å
198	V	97.3	Very high	96.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122	166.6	178.5	0	0	0	0	106.2	S191 C192 Y212 V219 I222 T233	S191-V198 CarbonylContact O-C 3.59Å; S191-V198 VanDerWaalsContact O-CA 3.32Å; S191-V198 WeakPolarHBondContact O-CA 3.39Å; C192-V198 HydrophobicContact CB-CG2 4.03Å; V198-Y212 HydrophobicContact CB-CD2 4.2Å; V198-Y212 HydrophobicContact CG1-CD2 3.82Å; V198-Y212 HydrophobicContact CG1-CG 4.49Å; V198-Y212 PolarHBondContact O-N 3.1Å; V198-V219 HydrophobicContact CG2-CG1 4.3Å; V198-V219 HydrophobicContact CG2-CG2 4.13Å; V198-I222 HydrophobicContact CG1-CD1 3.53Å; V198-T233 HydrophobicContact CG1-CG2 4.05Å; V198-T233 HydrophobicContact CG2-CG2 3.74Å
199	R	96.8	Very high	96.1	Very high	20 Å²	20	42.3 Å²	42.3	8%	0.075	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.2	-176.1	-67.5	-170.9	171.6	85.8	1.7	109.8	G172 H173 F190 S191 D195 T197 V208 R210	G172-R199 PolarHBondContact O-NH1 3.25Å; G172-R199 PolarHBondContact O-NH2 3.31Å; H173-R199 VanDerWaalsContact CA-NH1 3.28Å; H173-R199 PolarHBondContact CE1-NH1 2.85Å; H173-R199 PolarHBondContact ND1-NH1 3.27Å; F190-R199 WeakPolarHBondContact CA-O 3.3Å; S191-R199 PolarHBondContact N-O 2.82Å; S191-R199 PolarHBondContact O-N 3.07Å; D195-R199 IonicContact OD2-CZ 2.92Å; D195-R199 IonicContact OD2-NH1 2.89Å; D195-R199 PolarHBondContact OD2-NH1 2.77Å; D195-R199 IonicContact OD2-NH2 2.65Å; T197-R199 PolarHBondContact OG1-NH1 2.56Å; R199-V208 HydrophobicContact CB-CG1 4.09Å; R199-V208 HydrophobicContact CG-CG1 4.22Å; R199-R210 WeakPolarHBondContact CA-O 3.49Å
200	C	97.1	Very high	96.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.7	166.8	-170.7	0	0	0	0	108.2	L189 F190 V208 I209 R210 Y212	L189-C200 CarbonylContact O-C 3.59Å; F190-C200 HydrophobicContact CD1-CB 4.12Å; F190-C200 HydrophobicContact CE1-CB 3.81Å; F190-C200 VanDerWaalsContact CE1-SG 3.58Å; F190-C200 HydrophobicContact CZ-CB 4.39Å; F190-C200 VanDerWaalsContact CZ-SG 3.54Å; C200-V208 WeakPolarHBondContact O-CA 2.99Å; C200-I209 PolarHBondContact O-N 2.87Å; C200-R210 HydrophobicContact CB-CB 3.77Å; C200-R210 HydrophobicContact CB-CG 4.28Å; C200-R210 PolarHBondContact N-O 3.11Å; C200-R210 PolarHBondContact O-N 2.8Å; C200-Y212 HydrophobicContact CB-CE2 4.07Å
201	W	97.1	Very high	96	Very high	6 Å²	6	49.8 Å²	49.8	2%	0.023	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.7	177.6	-58	77.4	0	0	0	109	I156 L170 T171 Y188 L189 S191 K207 V208	I156-W201 HydrophobicContact CD1-CZ2 4.06Å; L170-W201 HydrophobicContact CB-CE3 4.1Å; L170-W201 HydrophobicContact CB-CH2 3.98Å; L170-W201 HydrophobicContact CB-CZ3 3.71Å; L170-W201 HydrophobicContact CD1-CD2 4.22Å; L170-W201 HydrophobicContact CD1-CE3 3.97Å; L170-W201 HydrophobicContact CD1-CZ3 4.44Å; L170-W201 HydrophobicContact CD2-CE3 4.08Å; L170-W201 HydrophobicContact CD2-CZ3 4.12Å; L170-W201 HydrophobicContact CG-CE3 4.28Å; L170-W201 HydrophobicContact CG-CZ3 4.31Å; T171-W201 VanDerWaalsContact O-CH2 3.32Å; T171-W201 WeakPolarHBondContact O-CH2 3.32Å; Y188-W201 WeakPolarHBondContact CA-O 3.14Å; L189-W201 HydrophobicContact CB-CB 4.19Å; L189-W201 HydrophobicContact CD2-CB 4.16Å; L189-W201 HydrophobicContact CD2-CG 3.91Å; L189-W201 PolarHBondContact N-O 3.12Å; L189-W201 PolarHBondContact O-N 3.09Å; S191-W201 PolarHBondContact OG-NE1 2.85Å; W201-K207 WeakPolarHBondContact CA-O 3.04Å; W201-V208 HydrophobicContact CD2-CG2 3.7Å; W201-V208 HydrophobicContact CE3-CG2 3.57Å; W201-V208 HydrophobicContact CH2-CG2 3.53Å; W201-V208 HydrophobicContact CZ2-CG2 3.66Å; W201-V208 HydrophobicContact CZ3-CG2 3.47Å; W201-V208 VanDerWaalsContact CZ3-CG2 3.47Å
202	D	96.3	Very high	96	Very high	12 Å²	12	50 Å²	50	6%	0.064	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.1	164.1	-149	-24.3	0	0	0	109	E204 Q205 N206 K207 I209	D202-E204 VanDerWaalsContact C-N 3.32Å; D202-E204 PolarHBondContact OD1-N 2.79Å; D202-Q205 HydrophobicContact CB-CB 4.03Å; D202-Q205 HydrophobicContact CB-CG 4.37Å; D202-N206 WeakPolarHBondContact O-CA 3.26Å; D202-N206 PolarHBondContact O-N 2.55Å; D202-K207 PolarHBondContact N-O 3.39Å; D202-K207 PolarHBondContact O-N 3.39Å; D202-I209 HydrophobicContact CB-CD1 3.31Å; D202-I209 HydrophobicContact CB-CG1 3.66Å; D202-I209 WeakPolarHBondContact OD2-CD1 3.12Å
203	L	93	Very high	95.8	Very high	36 Å²	36	58.1 Å²	58.1	19%	0.188	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-22.4	173.6	-67.2	173.6	0	0	0	111.7	F146 V182 P187 L189 N206	F146-L203 HydrophobicContact CZ-CD1 4.21Å; V182-L203 HydrophobicContact CG1-CD1 4.25Å; P187-L203 WeakPolarHBondContact O-CB 3.47Å; P187-L203 PolarHBondContact O-N 2.93Å; L189-L203 HydrophobicContact CB-CD1 4.38Å; L189-L203 HydrophobicContact CB-CD2 3.9Å; L189-L203 HydrophobicContact CB-CG 4.13Å; L189-L203 HydrophobicContact CD1-CD2 4.43Å; L203-N206 PolarHBondContact O-OD1 3.37Å
204	E	94.5	Very high	95.8	Very high	151 Å²	151	59.2 Å²	59.2	71%	0.706	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-41.5	176.2	-62.6	-174.1	169.1	0	0	111.5	P187 D202	P187-E204 HydrophobicContact CB-CG 4.24Å; P187-E204 HydrophobicContact CG-CG 4.34Å; D202-E204 VanDerWaalsContact C-N 3.32Å; D202-E204 PolarHBondContact OD1-N 2.79Å
205	Q	94.8	Very high	95.7	Very high	123 Å²	123	56.6 Å²	56.6	58%	0.575	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-11	-177.8	-55.1	-175.6	8.7	0	0	113.7	D202 K207	D202-Q205 HydrophobicContact CB-CB 4.03Å; D202-Q205 HydrophobicContact CB-CG 4.37Å; Q205-K207 PolarHBondContact O-N 2.83Å
206	N	94.9	Very high	95.7	Very high	60 Å²	60	62 Å²	62	32%	0.321	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	36.4	-174.3	-64.1	-54.5	0	0	0	113.5	L170 D202 L203	L170-N206 HydrophobicContact CD2-CB 4.12Å; D202-N206 WeakPolarHBondContact O-CA 3.26Å; D202-N206 PolarHBondContact O-N 2.55Å; L203-N206 PolarHBondContact O-OD1 3.37Å
207	K	95.6	Very high	95.8	Very high	139 Å²	139	58.6 Å²	58.6	60%	0.604	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	155.8	-177.1	-73	177	-174.1	177.2	0	111.3	W201 D202 Q205 I209	W201-K207 WeakPolarHBondContact CA-O 3.04Å; D202-K207 PolarHBondContact N-O 3.39Å; D202-K207 PolarHBondContact O-N 3.39Å; Q205-K207 PolarHBondContact O-N 2.83Å; K207-I209 PolarHBondContact O-N 3.22Å
208	V	96.2	Very high	95.8	Very high	45 Å²	45	57.6 Å²	57.6	27%	0.273	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	123.9	172.4	-175.1	0	0	0	0	109.1	R199 C200 W201	R199-V208 HydrophobicContact CB-CG1 4.09Å; R199-V208 HydrophobicContact CG-CG1 4.22Å; C200-V208 WeakPolarHBondContact O-CA 2.99Å; W201-V208 HydrophobicContact CD2-CG2 3.7Å; W201-V208 HydrophobicContact CE3-CG2 3.57Å; W201-V208 HydrophobicContact CH2-CG2 3.53Å; W201-V208 HydrophobicContact CZ2-CG2 3.66Å; W201-V208 HydrophobicContact CZ3-CG2 3.47Å; W201-V208 VanDerWaalsContact CZ3-CG2 3.47Å
209	I	95.7	Very high	95.9	Very high	69 Å²	69	57.6 Å²	57.6	35%	0.354	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-40.3	176.7	-49.9	165.7	0	0	0	110.6	Y188 C200 D202 K207	Y188-I209 HydrophobicContact CD1-CD1 4.04Å; Y188-I209 HydrophobicContact CE1-CD1 3.5Å; Y188-I209 VanDerWaalsContact CE1-CD1 3.5Å; C200-I209 PolarHBondContact O-N 2.87Å; D202-I209 HydrophobicContact CB-CD1 3.31Å; D202-I209 HydrophobicContact CB-CG1 3.66Å; D202-I209 WeakPolarHBondContact OD2-CD1 3.12Å; K207-I209 PolarHBondContact O-N 3.22Å
210	R	95.7	Very high	95.9	Very high	53 Å²	53	58.3 Å²	58.3	20%	0.2	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	142.1	-168.5	-51.2	167.1	-177.8	-114.1	-6.7	111.1	R199 C200 Y212 M245 R246 K248	R199-R210 WeakPolarHBondContact CA-O 3.49Å; C200-R210 HydrophobicContact CB-CB 3.77Å; C200-R210 HydrophobicContact CB-CG 4.28Å; C200-R210 PolarHBondContact N-O 3.11Å; C200-R210 PolarHBondContact O-N 2.8Å; R210-Y212 HydrophobicContact CB-CE2 4.47Å; R210-M245 PolarHBondContact NH1-O 3.2Å; R210-R246 PolarHBondContact NH1-O 2.81Å; R210-K248 HydrophobicContact CB-CD 3.93Å; R210-K248 HydrophobicContact CB-CG 4.29Å; R210-K248 HydrophobicContact CG-CD 4.2Å; R210-K248 HydrophobicContact CG-CG 4.49Å
211	H	96	Very high	95.9	Very high	104 Å²	104	59.3 Å²	59.3	48%	0.481	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.4	167.7	-60.5	-78.5	0	0	0	108.4
212	Y	96.6	Very high	95.9	Very high	5 Å²	5	59 Å²	59	2%	0.02	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	123.4	168.7	-53.1	-94.4	0	0	0	108.3	F190 V198 C200 R210 W243 M245 K248	F190-Y212 HydrophobicContact CD1-CE2 4.07Å; F190-Y212 AromaticContact CE1-CE2 3.74Å; F190-Y212 HydrophobicContact CE1-CE2 3.74Å; F190-Y212 AromaticContact CE1-CZ 3.94Å; F190-Y212 WeakPolarHBondContact CE1-OH 3.35Å; V198-Y212 HydrophobicContact CB-CD2 4.2Å; V198-Y212 HydrophobicContact CG1-CD2 3.82Å; V198-Y212 HydrophobicContact CG1-CG 4.49Å; V198-Y212 PolarHBondContact O-N 3.1Å; C200-Y212 HydrophobicContact CB-CE2 4.07Å; R210-Y212 HydrophobicContact CB-CE2 4.47Å; Y212-W243 HydrophobicContact CD1-CB 3.8Å; Y212-W243 HydrophobicContact CD1-CD2 4.09Å; Y212-W243 AromaticContact CD1-CE3 3.97Å; Y212-W243 HydrophobicContact CD1-CE3 3.97Å; Y212-W243 HydrophobicContact CD1-CG 4.03Å; Y212-W243 HydrophobicContact CE1-CB 4.06Å; Y212-W243 HydrophobicContact CG-CD2 4.34Å; Y212-W243 HydrophobicContact CG-CE3 4.41Å; Y212-W243 HydrophobicContact CG-CG 4.38Å; Y212-M245 WeakPolarHBondContact OH-CA 3.17Å; Y212-M245 PolarHBondContact OH-O 2.8Å; Y212-K248 HydrophobicContact CD1-CB 3.99Å; Y212-K248 HydrophobicContact CD1-CG 4.41Å; Y212-K248 HydrophobicContact CE1-CB 4.07Å; Y212-K248 HydrophobicContact CE1-CG 4.11Å
213	H	94.8	Very high	95.9	Very high	169 Å²	169	59.8 Å²	59.8	78%	0.782	30%	0.295	S	S	*	.			trans	-118.7	137	-176.8	-174.8	74.9	0	0	0	110.4	W243	H213-W243 WeakPolarHBondContact O-CH2 3.43Å; H213-W243 WeakPolarHBondContact O-CZ3 3.17Å
214	G	93.9	Very high	96.1	Very high	24 Å²	24	59 Å²	59	25%	0.247	29%	0.291	C	S	.	.			trans	145.8	-6.4	176.5	0	0	0	0	0	114.6	R241	G214-R241 PolarHBondContact O-NE 3.02Å; G214-R241 VanDerWaalsContact O-NE 3.12Å; G214-R241 PolarHBondContact O-NH2 3.12Å; G214-R241 VanDerWaalsContact O-NH2 3.1Å
215	H	96.5	Very high	96.2	Very high	10 Å²	10	51.9 Å²	51.9	5%	0.046	26%	0.258	C	S	.	.			trans	-68.9	133.6	165.7	-92.9	-74.7	0	0	0	111.1	V219 T233 D237 R241	H215-V219 HydrophobicContact CB-CG2 3.9Å; H215-V219 VanDerWaalsContact CD2-CG2 3.49Å; H215-V219 WeakPolarHBondContact CD2-CG2 3.46Å; H215-T233 WeakPolarHBondContact NE2-CB 3.2Å; H215-T233 PolarHBondContact NE2-OG1 2.69Å; H215-D237 IonicContact CE1-OD1 3.92Å; H215-D237 IonicContact CE1-OD2 3.78Å; H215-D237 IonicContact CG-OD2 3.33Å; H215-D237 IonicContact ND1-OD1 3.84Å; H215-D237 PolarHBondContact ND1-OD1 2.89Å; H215-D237 IonicContact ND1-OD2 3.95Å; H215-D237 PolarHBondContact ND1-OD2 3.45Å; H215-R241 PolarHBondContact CE1-NH1 2.86Å; H215-R241 PolarHBondContact ND1-NH1 2.86Å
216	M	95.9	Very high	96.2	Very high	140 Å²	140	48.6 Å²	48.6	69%	0.69	25%	0.247	S	C	*	.	S	Bend	trans	-84.9	-23.6	-178.2	-63.3	-59.6	-67.3	0	0	111.8	K196 D237	K196-M216 PolarHBondContact NZ-O 3.01Å; M216-D237 HydrophobicContact CB-CB 4.12Å; M216-D237 PolarHBondContact N-OD2 2.8Å
217	S	97.1	Very high	96.2	Very high	32 Å²	32	49.1 Å²	49.1	22%	0.224	25%	0.253	C	S	.	.	S	Bend	trans	-140.8	-176	-176.7	-160.5	0	0	0	0	111.4	R236	S217-R236 WeakPolarHBondContact OG-CB 3.47Å
218	A	97.1	Very high	96.2	Very high	11 Å²	11	45.7 Å²	45.7	9%	0.091	24%	0.24	C	C	.	.			trans	-54.2	137.7	179.6	0	0	0	0	0	111.9	E194 G235 R236	E194-A218 HydrophobicContact CB-CB 4.12Å; E194-A218 HydrophobicContact CG-CB 3.98Å; A218-G235 CarbonylContact O-C 3.57Å; A218-G235 WeakPolarHBondContact O-CA 3.43Å; A218-R236 HydrophobicContact CB-CB 4.41Å; A218-R236 PolarHBondContact O-N 2.68Å
219	V	97.7	Very high	96.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.6	175	-169.4	0	0	0	0	107.9	R178 C192 G193 V198 H215 T233 C234	R178-V219 WeakPolarHBondContact CB-O 3.32Å; C192-V219 HydrophobicContact CB-CB 3.89Å; C192-V219 HydrophobicContact CB-CG1 3.57Å; G193-V219 PolarHBondContact O-N 2.98Å; G193-V219 VanDerWaalsContact O-N 3.13Å; V198-V219 HydrophobicContact CG2-CG1 4.3Å; V198-V219 HydrophobicContact CG2-CG2 4.13Å; H215-V219 HydrophobicContact CB-CG2 3.9Å; H215-V219 VanDerWaalsContact CD2-CG2 3.49Å; H215-V219 WeakPolarHBondContact CD2-CG2 3.46Å; V219-T233 HydrophobicContact CG1-CG2 4.49Å; V219-C234 CarbonylContact C-O 3.57Å; V219-C234 WeakPolarHBondContact CA-O 3.49Å; V219-C234 WeakPolarHBondContact CG1-O 3.39Å
220	Y	96.9	Very high	96.2	Very high	35 Å²	35	43.8 Å²	43.8	14%	0.137	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-35.7	-174.4	-75.8	-47.2	0	0	0	113.8	R178 C234 R236 T260	R178-Y220 CarbonylContact C-O 3.56Å; R178-Y220 VanDerWaalsContact NH2-CD1 3.25Å; Y220-C234 PolarHBondContact N-O 3.06Å; Y220-R236 HydrophobicContact CD2-CB 4.44Å; Y220-R236 HydrophobicContact CE2-CB 3.67Å; Y220-R236 HydrophobicContact CE2-CG 4.43Å; Y220-T260 HydrophobicContact CE2-CG2 4.36Å
221	D	97.1	Very high	96.3	Very high	21 Å²	21	41.2 Å²	41.2	11%	0.112	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	158.4	-177.8	-156.2	8	0	0	0	110.3	C234 T263 V264 R265	D221-C234 WeakPolarHBondContact CB-SG 3.19Å; D221-C234 PolarHBondContact N-O 3.26Å; D221-C234 PolarHBondContact O-N 2.95Å; D221-C234 VanDerWaalsContact O-N 3.11Å; D221-T263 VanDerWaalsContact OD2-CA 3.31Å; D221-T263 WeakPolarHBondContact OD2-CA 2.95Å; D221-V264 PolarHBondContact OD2-N 3.47Å; D221-V264 VanDerWaalsContact OD2-N 3.09Å; D221-R265 IonicContact OD1-NH1 2.95Å; D221-R265 IonicContact OD2-CZ 2.7Å; D221-R265 IonicContact OD2-NH1 3.11Å; D221-R265 PolarHBondContact OD2-NH1 3.39Å; D221-R265 IonicContact OD2-NH2 3.65Å
222	I	97.2	Very high	96.3	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	139.3	179.7	-173.6	162.6	0	0	0	109	V181 F190 C192 V198 V231 L232 T233	V181-I222 HydrophobicContact CB-CG2 4.42Å; F190-I222 HydrophobicContact CB-CD1 3.71Å; C192-I222 HydrophobicContact CB-CB 4.19Å; C192-I222 HydrophobicContact CB-CD1 4.3Å; C192-I222 HydrophobicContact CB-CG2 4.36Å; V198-I222 HydrophobicContact CG1-CD1 3.53Å; I222-V231 HydrophobicContact CD1-CG1 3.75Å; I222-V231 HydrophobicContact CG1-CG1 3.81Å; I222-L232 CarbonylContact C-O 3.55Å; I222-L232 WeakPolarHBondContact CA-O 3.4Å; I222-T233 HydrophobicContact CB-CG2 4.24Å; I222-T233 HydrophobicContact CD1-CG2 3.79Å; I222-T233 HydrophobicContact CG1-CG2 3.75Å
223	D	97.2	Very high	96.4	Very high	27 Å²	27	36 Å²	36	14%	0.144	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.3	175.3	-165	16.1	0	0	0	110.2	L232 R265 C266	D223-L232 PolarHBondContact N-O 3.07Å; D223-L232 PolarHBondContact O-N 3.34Å; D223-R265 VanDerWaalsContact OD2-CA 3.27Å; D223-R265 WeakPolarHBondContact OD2-CA 3.49Å; D223-C266 WeakPolarHBondContact OD2-CB 3.39Å; D223-C266 PolarHBondContact OD2-N 2.84Å; D223-C266 PolarHBondContact OD2-SG 3.13Å
224	I	96.7	Very high	96.5	Very high	20 Å²	20	28 Å²	28	10%	0.103	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.2	-178.6	-69	167.1	0	0	0	108.7	V181 F190 P226 V231 M245	V181-I224 HydrophobicContact CG1-CB 4.13Å; V181-I224 HydrophobicContact CG1-CD1 3.19Å; V181-I224 HydrophobicContact CG1-CG1 3.4Å; F190-I224 HydrophobicContact CD2-CD1 3.41Å; F190-I224 VanDerWaalsContact CD2-CD1 3.41Å; F190-I224 HydrophobicContact CD2-CG1 4.23Å; F190-I224 HydrophobicContact CE2-CD1 3.76Å; F190-I224 HydrophobicContact CG-CD1 4.23Å; I224-P226 WeakPolarHBondContact O-CD 3.4Å; I224-V231 HydrophobicContact CG1-CG2 4.04Å; I224-M245 HydrophobicContact CG2-CE 4.4Å
225	H	96.8	Very high	96.6	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.009	15%	0.147	C	C	.	.			trans	-70.9	127	171.6	-167.7	-91.9	0	0	0	110.4	T227 I228 V230 Q267	H225-T227 PolarHBondContact CE1-OG1 3.4Å; H225-T227 PolarHBondContact ND1-N 2.76Å; H225-T227 PolarHBondContact ND1-OG1 2.71Å; H225-T227 PolarHBondContact O-N 3.12Å; H225-I228 HydrophobicContact CB-CB 4.32Å; H225-I228 VanDerWaalsContact CE1-CD1 3.46Å; H225-I228 WeakPolarHBondContact CE1-CD1 3.45Å; H225-I228 VanDerWaalsContact CE1-CG1 3.5Å; H225-I228 WeakPolarHBondContact CE1-CG1 3.38Å; H225-I228 VanDerWaalsContact ND1-CB 3.29Å; H225-I228 WeakPolarHBondContact ND1-CB 3.12Å; H225-I228 WeakPolarHBondContact ND1-CG1 3.46Å; H225-I228 PolarHBondContact ND1-N 3.18Å; H225-V230 HydrophobicContact CB-CB 4.43Å; H225-V230 PolarHBondContact N-O 3.21Å; H225-Q267 PolarHBondContact NE2-O 3.28Å; H225-Q267 VanDerWaalsContact NE2-O 3.15Å
226	P	94.7	Very high	96.6	Very high	53 Å²	53	33.5 Å²	33.5	34%	0.344	17%	0.172	S	C	.	.	S	Bend	trans	-60.5	-37.7	-174.6	17.8	-31.5	0	0	0	114.6	R185 I224 E268	R185-P226 WeakPolarHBondContact CD-O 3.49Å; I224-P226 WeakPolarHBondContact O-CD 3.4Å; P226-E268 HydrophobicContact CB-CG 3.78Å; P226-E268 HydrophobicContact CG-CB 4.35Å; P226-E268 HydrophobicContact CG-CG 3.3Å
227	T	95	Very high	96.6	Very high	71 Å²	71	28.4 Å²	28.4	44%	0.436	15%	0.148	S	C	.	.	S	Bend	trans	-109.4	-13.5	-174.8	52.3	0	0	0	0	115	R185 H225 E268	R185-T227 PolarHBondContact NH1-O 2.78Å; H225-T227 PolarHBondContact CE1-OG1 3.4Å; H225-T227 PolarHBondContact ND1-N 2.76Å; H225-T227 PolarHBondContact ND1-OG1 2.71Å; H225-T227 PolarHBondContact O-N 3.12Å; T227-E268 HydrophobicContact CG2-CB 4.38Å; T227-E268 VanDerWaalsContact CG2-CD 3.47Å; T227-E268 HydrophobicContact CG2-CG 3.61Å; T227-E268 WeakPolarHBondContact CG2-OE1 3.36Å
228	I	94.9	Very high	96.6	Very high	68 Å²	68	27.9 Å²	27.9	35%	0.349	15%	0.145	S	C	.	.	S	Bend	trans	-119.3	142	-174.2	-57.7	169.9	0	0	0	106.6	H225 V230 L287	H225-I228 HydrophobicContact CB-CB 4.32Å; H225-I228 VanDerWaalsContact CE1-CD1 3.46Å; H225-I228 WeakPolarHBondContact CE1-CD1 3.45Å; H225-I228 VanDerWaalsContact CE1-CG1 3.5Å; H225-I228 WeakPolarHBondContact CE1-CG1 3.38Å; H225-I228 VanDerWaalsContact ND1-CB 3.29Å; H225-I228 WeakPolarHBondContact ND1-CB 3.12Å; H225-I228 WeakPolarHBondContact ND1-CG1 3.46Å; H225-I228 PolarHBondContact ND1-N 3.18Å; I228-V230 HydrophobicContact CG2-CB 4.24Å; I228-V230 HydrophobicContact CG2-CG2 3.74Å; I228-V230 PolarHBondContact O-N 2.88Å; I228-L287 HydrophobicContact CD1-CD2 4.43Å
229	D	95.9	Very high	96.6	Very high	58 Å²	58	28.2 Å²	28.2	31%	0.31	15%	0.146	S	C	.	.	S	Bend	trans	-78.8	59.3	-175.8	-69	-43.9	0	0	0	112.9	R185 H186 M245	R185-D229 IonicContact CZ-OD1 3.99Å; R185-D229 VanDerWaalsContact CZ-OD1 3.23Å; R185-D229 IonicContact CZ-OD2 3.89Å; R185-D229 IonicContact NE-OD1 2.95Å; R185-D229 IonicContact NH1-OD1 3.86Å; R185-D229 PolarHBondContact NH1-OD1 2.8Å; R185-D229 IonicContact NH2-OD1 3.15Å; R185-D229 PolarHBondContact NH2-OD1 2.71Å; R185-D229 VanDerWaalsContact NH2-OD1 3.15Å; R185-D229 IonicContact NH2-OD2 3.8Å; R185-D229 PolarHBondContact NH2-OD2 2.89Å; H186-D229 IonicContact CD2-OD1 2.89Å; H186-D229 IonicContact CE1-OD1 3.78Å; H186-D229 IonicContact NE2-OD1 3.83Å; H186-D229 PolarHBondContact NE2-OD1 2.85Å; H186-D229 IonicContact NE2-OD2 2.68Å; D229-M245 VanDerWaalsContact C-CE 3.43Å; D229-M245 HydrophobicContact CB-CE 3.64Å; D229-M245 WeakPolarHBondContact O-CB 3.38Å; D229-M245 WeakPolarHBondContact O-CG 3.44Å; D229-M245 PolarHBondContact O-N 2.84Å; D229-M245 VanDerWaalsContact O-N 3.08Å; D229-M245 WeakPolarHBondContact OD1-CE 3.35Å
230	V	96.1	Very high	96.5	Very high	15 Å²	15	28.2 Å²	28.2	9%	0.091	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.1	-172.9	165	0	0	0	0	110.5	H225 I228 L232 V242 W243	H225-V230 HydrophobicContact CB-CB 4.43Å; H225-V230 PolarHBondContact N-O 3.21Å; I228-V230 HydrophobicContact CG2-CB 4.24Å; I228-V230 HydrophobicContact CG2-CG2 3.74Å; I228-V230 PolarHBondContact O-N 2.88Å; V230-L232 HydrophobicContact CG1-CG 4.44Å; V230-V242 HydrophobicContact CG1-CG1 3.22Å; V230-W243 CarbonylContact C-O 3.59Å; V230-W243 VanDerWaalsContact CA-O 3.26Å; V230-W243 WeakPolarHBondContact CA-O 3.49Å
231	V	97.3	Very high	96.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.5	175.2	172.4	0	0	0	0	108.8	F190 I222 I224 T233 W243 M245	F190-V231 HydrophobicContact CD1-CG1 4.33Å; F190-V231 HydrophobicContact CD1-CG2 3.72Å; F190-V231 HydrophobicContact CD2-CG2 4.46Å; F190-V231 HydrophobicContact CE1-CG2 3.47Å; F190-V231 VanDerWaalsContact CE1-CG2 3.47Å; F190-V231 HydrophobicContact CE2-CG2 4.24Å; F190-V231 HydrophobicContact CG-CG2 4.21Å; F190-V231 HydrophobicContact CZ-CG2 3.75Å; I222-V231 HydrophobicContact CD1-CG1 3.75Å; I222-V231 HydrophobicContact CG1-CG1 3.81Å; I224-V231 HydrophobicContact CG1-CG2 4.04Å; V231-T233 HydrophobicContact CG1-CG2 4.05Å; V231-W243 HydrophobicContact CB-CB 4.34Å; V231-W243 PolarHBondContact N-O 2.9Å; V231-W243 PolarHBondContact O-N 3.18Å; V231-M245 HydrophobicContact CG2-CG 3.48Å; V231-M245 VanDerWaalsContact CG2-CG 3.48Å; V231-M245 HydrophobicContact CG2-SD 3.87Å
232	L	97.3	Very high	96.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.8	179.4	-81.6	156.9	0	0	0	109.7	I222 D223 V230 R241 V242 L254 V264 C266 V273	I222-L232 CarbonylContact C-O 3.55Å; I222-L232 WeakPolarHBondContact CA-O 3.4Å; D223-L232 PolarHBondContact N-O 3.07Å; D223-L232 PolarHBondContact O-N 3.34Å; V230-L232 HydrophobicContact CG1-CG 4.44Å; L232-R241 WeakPolarHBondContact CA-O 3.43Å; L232-V242 HydrophobicContact CD2-CB 4.06Å; L232-V242 HydrophobicContact CD2-CG1 4.15Å; L232-V242 HydrophobicContact CD2-CG2 3.44Å; L232-V242 VanDerWaalsContact CD2-CG2 3.44Å; L232-L254 HydrophobicContact CD2-CD1 4.39Å; L232-V264 HydrophobicContact CB-CG1 3.97Å; L232-C266 HydrophobicContact CD1-CB 4.19Å; L232-C266 WeakPolarHBondContact CD1-SG 3.38Å; L232-V273 HydrophobicContact CD1-CB 4.38Å; L232-V273 HydrophobicContact CD1-CG1 4.14Å; L232-V273 HydrophobicContact CD1-CG2 3.36Å; L232-V273 HydrophobicContact CD2-CG1 4.24Å; L232-V273 HydrophobicContact CD2-CG2 4.2Å; L232-V273 HydrophobicContact CG-CG2 4.47Å
233	T	97.9	Very high	96.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.9	-177.8	57.7	0	0	0	0	110.2	V198 H215 V219 I222 V231 A240 R241 W243	V198-T233 HydrophobicContact CG1-CG2 4.05Å; V198-T233 HydrophobicContact CG2-CG2 3.74Å; H215-T233 WeakPolarHBondContact NE2-CB 3.2Å; H215-T233 PolarHBondContact NE2-OG1 2.69Å; V219-T233 HydrophobicContact CG1-CG2 4.49Å; I222-T233 HydrophobicContact CB-CG2 4.24Å; I222-T233 HydrophobicContact CD1-CG2 3.79Å; I222-T233 HydrophobicContact CG1-CG2 3.75Å; V231-T233 HydrophobicContact CG1-CG2 4.05Å; T233-A240 CarbonylContact O-C 3.53Å; T233-A240 WeakPolarHBondContact O-CA 3.34Å; T233-R241 PolarHBondContact N-O 2.84Å; T233-R241 PolarHBondContact O-N 2.85Å; T233-W243 PolarHBondContact OG1-NE1 2.87Å
234	C	97	Very high	96.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	155.4	172.7	63	0	0	0	0	112.5	V219 Y220 D221 A240 V261 V264	V219-C234 CarbonylContact C-O 3.57Å; V219-C234 WeakPolarHBondContact CA-O 3.49Å; V219-C234 WeakPolarHBondContact CG1-O 3.39Å; Y220-C234 PolarHBondContact N-O 3.06Å; D221-C234 WeakPolarHBondContact CB-SG 3.19Å; D221-C234 PolarHBondContact N-O 3.26Å; D221-C234 PolarHBondContact O-N 2.95Å; D221-C234 VanDerWaalsContact O-N 3.11Å; C234-A240 HydrophobicContact CB-CB 4.27Å; C234-V261 HydrophobicContact CB-CB 3.73Å; C234-V261 HydrophobicContact CB-CG1 3.4Å; C234-V261 VanDerWaalsContact CB-CG1 3.4Å; C234-V261 PolarHBondContact SG-O 3.15Å; C234-V264 HydrophobicContact CB-CG2 3.3Å; C234-V264 WeakPolarHBondContact SG-CG2 3.49Å
235	G	96.1	Very high	96.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	-172.9	-175.4	0	0	0	0	0	115.5	A218 D237 A238 T239 V261	A218-G235 CarbonylContact O-C 3.57Å; A218-G235 WeakPolarHBondContact O-CA 3.43Å; G235-D237 WeakPolarHBondContact CA-OD1 3.3Å; G235-D237 PolarHBondContact O-N 2.88Å; G235-A238 PolarHBondContact O-N 3.11Å; G235-T239 PolarHBondContact N-O 3.37Å; G235-V261 PolarHBondContact O-N 3.5Å
236	R	97.1	Very high	96.4	Very high	150 Å²	150	35.1 Å²	35.1	57%	0.566	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-14.4	176.8	-179.6	165.7	-170.4	164	3	113.2	S217 A218 Y220 A238 T260	S217-R236 WeakPolarHBondContact OG-CB 3.47Å; A218-R236 HydrophobicContact CB-CB 4.41Å; A218-R236 PolarHBondContact O-N 2.68Å; Y220-R236 HydrophobicContact CD2-CB 4.44Å; Y220-R236 HydrophobicContact CE2-CB 3.67Å; Y220-R236 HydrophobicContact CE2-CG 4.43Å; R236-A238 PolarHBondContact O-N 2.88Å; R236-T260 HydrophobicContact CB-CG2 4.09Å; R236-T260 HydrophobicContact CG-CG2 3.66Å
237	D	96.2	Very high	96.4	Very high	33 Å²	33	35.1 Å²	35.1	18%	0.176	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	10.4	175.3	46.3	0.9	0	0	0	114.1	H215 M216 G235 T239 R241	H215-D237 IonicContact CE1-OD1 3.92Å; H215-D237 IonicContact CE1-OD2 3.78Å; H215-D237 IonicContact CG-OD2 3.33Å; H215-D237 IonicContact ND1-OD1 3.84Å; H215-D237 PolarHBondContact ND1-OD1 2.89Å; H215-D237 IonicContact ND1-OD2 3.95Å; H215-D237 PolarHBondContact ND1-OD2 3.45Å; M216-D237 HydrophobicContact CB-CB 4.12Å; M216-D237 PolarHBondContact N-OD2 2.8Å; G235-D237 WeakPolarHBondContact CA-OD1 3.3Å; G235-D237 PolarHBondContact O-N 2.88Å; D237-T239 PolarHBondContact O-N 2.78Å; D237-T239 VanDerWaalsContact O-N 3.12Å; D237-T239 PolarHBondContact OD1-OG1 3.23Å; D237-R241 IonicContact OD1-NH1 3.7Å; D237-R241 IonicContact OD2-CZ 3.23Å; D237-R241 IonicContact OD2-NH1 2.78Å; D237-R241 PolarHBondContact OD2-NH1 2.87Å; D237-R241 IonicContact OD2-NH2 3.32Å
238	A	96.6	Very high	96.4	Very high	20 Å²	20	36.7 Å²	36.7	17%	0.165	17%	0.17	C	C	.	.	S	Bend	trans	60.4	17.3	178.7	0	0	0	0	0	114.3	G235 R236 N259	G235-A238 PolarHBondContact O-N 3.11Å; R236-A238 PolarHBondContact O-N 2.88Å; A238-N259 WeakPolarHBondContact CA-O 3.12Å; A238-N259 VanDerWaalsContact CB-O 3.24Å; A238-N259 WeakPolarHBondContact CB-O 3.43Å
239	T	96.5	Very high	96.5	Very high	18 Å²	18	37.6 Å²	37.6	11%	0.11	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	144	-179.3	56.5	0	0	0	0	110.6	G235 D237 R241 T253 T255	G235-T239 PolarHBondContact N-O 3.37Å; D237-T239 PolarHBondContact O-N 2.78Å; D237-T239 VanDerWaalsContact O-N 3.12Å; D237-T239 PolarHBondContact OD1-OG1 3.23Å; T239-R241 PolarHBondContact OG1-NH1 3.22Å; T239-T253 HydrophobicContact CG2-CG2 4.18Å; T239-T255 HydrophobicContact CG2-CG2 3.94Å
240	A	97	Very high	96.5	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	137.4	160.1	0	0	0	0	0	108.9	T233 C234 L254 V264 T275	T233-A240 CarbonylContact O-C 3.53Å; T233-A240 WeakPolarHBondContact O-CA 3.34Å; C234-A240 HydrophobicContact CB-CB 4.27Å; A240-L254 HydrophobicContact CB-CB 4.11Å; A240-L254 HydrophobicContact CB-CD1 4.13Å; A240-L254 PolarHBondContact N-O 2.97Å; A240-L254 WeakPolarHBondContact O-CA 3.34Å; A240-L254 WeakPolarHBondContact O-CB 3.4Å; A240-L254 PolarHBondContact O-N 3Å; A240-V264 HydrophobicContact CB-CG2 4.23Å; A240-T275 HydrophobicContact CB-CG2 4.13Å
241	R	97.1	Very high	96.4	Very high	21 Å²	21	39.9 Å²	39.9	8%	0.079	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	146.4	179.3	-75.3	-174.1	178.3	75.5	1	110.3	G214 H215 L232 T233 D237 T239 W243 T253	G214-R241 PolarHBondContact O-NE 3.02Å; G214-R241 VanDerWaalsContact O-NE 3.12Å; G214-R241 PolarHBondContact O-NH2 3.12Å; G214-R241 VanDerWaalsContact O-NH2 3.1Å; H215-R241 PolarHBondContact CE1-NH1 2.86Å; H215-R241 PolarHBondContact ND1-NH1 2.86Å; L232-R241 WeakPolarHBondContact CA-O 3.43Å; T233-R241 PolarHBondContact N-O 2.84Å; T233-R241 PolarHBondContact O-N 2.85Å; D237-R241 IonicContact OD1-NH1 3.7Å; D237-R241 IonicContact OD2-CZ 3.23Å; D237-R241 IonicContact OD2-NH1 2.78Å; D237-R241 PolarHBondContact OD2-NH1 2.87Å; D237-R241 IonicContact OD2-NH2 3.32Å; T239-R241 PolarHBondContact OG1-NH1 3.22Å; R241-W243 HydrophobicContact CB-CZ2 3.98Å; R241-W243 VanDerWaalsContact CD-CZ2 3.48Å; R241-W243 HydrophobicContact CG-CZ2 4.39Å; R241-T253 HydrophobicContact CG-CG2 4.19Å
242	V	97.5	Very high	96.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.3	-177.4	-171.1	0	0	0	0	107.4	V230 L232 N250 V251 H252 L254 L287	V230-V242 HydrophobicContact CG1-CG1 3.22Å; L232-V242 HydrophobicContact CD2-CB 4.06Å; L232-V242 HydrophobicContact CD2-CG1 4.15Å; L232-V242 HydrophobicContact CD2-CG2 3.44Å; L232-V242 VanDerWaalsContact CD2-CG2 3.44Å; V242-N250 CarbonylContact O-C 3.58Å; V242-N250 WeakPolarHBondContact O-CA 3.45Å; V242-N250 PolarHBondContact O-OD1 3.42Å; V242-V251 HydrophobicContact CG1-CB 4.37Å; V242-V251 PolarHBondContact O-N 3.13Å; V242-H252 HydrophobicContact CB-CB 3.94Å; V242-H252 HydrophobicContact CG2-CB 3.64Å; V242-H252 WeakPolarHBondContact CG2-O 3.48Å; V242-H252 PolarHBondContact N-O 3.37Å; V242-L254 HydrophobicContact CG2-CD1 4.09Å; V242-L254 HydrophobicContact CG2-CD2 4.45Å; V242-L254 HydrophobicContact CG2-CG 4.03Å; V242-L287 HydrophobicContact CB-CD1 4.48Å; V242-L287 HydrophobicContact CG1-CD1 3.74Å; V242-L287 HydrophobicContact CG2-CD1 3.94Å
243	W	97.3	Very high	96.3	Very high	3 Å²	3	45.6 Å²	45.6	1%	0.011	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.7	-176.6	-55	94	0	0	0	110.2	Y212 H213 V230 V231 T233 R241 M245 N250	Y212-W243 HydrophobicContact CD1-CB 3.8Å; Y212-W243 HydrophobicContact CD1-CD2 4.09Å; Y212-W243 AromaticContact CD1-CE3 3.97Å; Y212-W243 HydrophobicContact CD1-CE3 3.97Å; Y212-W243 HydrophobicContact CD1-CG 4.03Å; Y212-W243 HydrophobicContact CE1-CB 4.06Å; Y212-W243 HydrophobicContact CG-CD2 4.34Å; Y212-W243 HydrophobicContact CG-CE3 4.41Å; Y212-W243 HydrophobicContact CG-CG 4.38Å; H213-W243 WeakPolarHBondContact O-CH2 3.43Å; H213-W243 WeakPolarHBondContact O-CZ3 3.17Å; V230-W243 CarbonylContact C-O 3.59Å; V230-W243 VanDerWaalsContact CA-O 3.26Å; V230-W243 WeakPolarHBondContact CA-O 3.49Å; V231-W243 HydrophobicContact CB-CB 4.34Å; V231-W243 PolarHBondContact N-O 2.9Å; V231-W243 PolarHBondContact O-N 3.18Å; T233-W243 PolarHBondContact OG1-NE1 2.87Å; R241-W243 HydrophobicContact CB-CZ2 3.98Å; R241-W243 VanDerWaalsContact CD-CZ2 3.48Å; R241-W243 HydrophobicContact CG-CZ2 4.39Å; W243-M245 PolarHBondContact O-N 3.07Å; W243-N250 HydrophobicContact CE3-CB 3.87Å; W243-N250 HydrophobicContact CH2-CB 4.06Å; W243-N250 HydrophobicContact CZ3-CB 3.6Å
244	D	96.7	Very high	96.3	Very high	35 Å²	35	45.7 Å²	45.7	19%	0.187	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	122.3	165	170.7	6	0	0	0	108.9	R246 T247 K248 V249 V251	D244-R246 PolarHBondContact O-N 3.08Å; D244-R246 PolarHBondContact OD1-N 2.98Å; D244-T247 WeakPolarHBondContact CB-OG1 3.18Å; D244-T247 WeakPolarHBondContact OD2-CB 3.28Å; D244-T247 WeakPolarHBondContact OD2-CG2 3.25Å; D244-T247 PolarHBondContact OD2-OG1 3.13Å; D244-K248 WeakPolarHBondContact O-CA 3.12Å; D244-K248 PolarHBondContact O-N 2.83Å; D244-V249 PolarHBondContact N-O 2.93Å; D244-V251 HydrophobicContact CB-CG2 3.8Å
245	M	94.9	Very high	96.2	Very high	14 Å²	14	50.1 Å²	50.1	7%	0.069	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-38.3	-176.4	-74.4	-158	-88.2	0	0	112.4	F190 R210 Y212 I224 D229 V231 W243	F190-M245 HydrophobicContact CE1-CG 4.45Å; F190-M245 HydrophobicContact CE1-SD 4.37Å; F190-M245 HydrophobicContact CE2-SD 3.75Å; F190-M245 HydrophobicContact CZ-CG 3.96Å; F190-M245 HydrophobicContact CZ-SD 3.39Å; F190-M245 WeakPolarHBondContact CZ-SD 3.37Å; R210-M245 PolarHBondContact NH1-O 3.2Å; Y212-M245 WeakPolarHBondContact OH-CA 3.17Å; Y212-M245 PolarHBondContact OH-O 2.8Å; I224-M245 HydrophobicContact CG2-CE 4.4Å; D229-M245 VanDerWaalsContact C-CE 3.43Å; D229-M245 HydrophobicContact CB-CE 3.64Å; D229-M245 WeakPolarHBondContact O-CB 3.38Å; D229-M245 WeakPolarHBondContact O-CG 3.44Å; D229-M245 PolarHBondContact O-N 2.84Å; D229-M245 VanDerWaalsContact O-N 3.08Å; D229-M245 WeakPolarHBondContact OD1-CE 3.35Å; V231-M245 HydrophobicContact CG2-CG 3.48Å; V231-M245 VanDerWaalsContact CG2-CG 3.48Å; V231-M245 HydrophobicContact CG2-SD 3.87Å; W243-M245 PolarHBondContact O-N 3.07Å
246	R	94.6	Very high	96.1	Very high	177 Å²	177	51.7 Å²	51.7	67%	0.668	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-41.7	-172.4	-174.1	177.4	53.8	73.7	10.5	112.3	R210 D244	R210-R246 PolarHBondContact NH1-O 2.81Å; D244-R246 PolarHBondContact O-N 3.08Å; D244-R246 PolarHBondContact OD1-N 2.98Å
247	T	95.2	Very high	96.1	Very high	53 Å²	53	45.2 Å²	45.2	33%	0.325	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-16.4	-174.2	60.8	0	0	0	0	113.1	D244 V249	D244-T247 WeakPolarHBondContact CB-OG1 3.18Å; D244-T247 WeakPolarHBondContact OD2-CB 3.28Å; D244-T247 WeakPolarHBondContact OD2-CG2 3.25Å; D244-T247 PolarHBondContact OD2-OG1 3.13Å; T247-V249 PolarHBondContact O-N 2.89Å; T247-V249 PolarHBondContact OG1-N 3.41Å
248	K	95	Very high	96.1	Very high	104 Å²	104	48.6 Å²	48.6	45%	0.452	27%	0.27	S	S	.	.			trans	64	11.2	-172.4	-48.5	173.1	-68.5	-178	0	113.8	R210 Y212 D244	R210-K248 HydrophobicContact CB-CD 3.93Å; R210-K248 HydrophobicContact CB-CG 4.29Å; R210-K248 HydrophobicContact CG-CD 4.2Å; R210-K248 HydrophobicContact CG-CG 4.49Å; Y212-K248 HydrophobicContact CD1-CB 3.99Å; Y212-K248 HydrophobicContact CD1-CG 4.41Å; Y212-K248 HydrophobicContact CE1-CB 4.07Å; Y212-K248 HydrophobicContact CE1-CG 4.11Å; D244-K248 WeakPolarHBondContact O-CA 3.12Å; D244-K248 PolarHBondContact O-N 2.83Å
249	V	96.2	Very high	96.1	Very high	87 Å²	87	51.1 Å²	51.1	53%	0.527	28%	0.281	S	S	.	.			trans	-85.3	142	-179.9	179.2	0	0	0	0	109.2	D244 T247 V251	D244-V249 PolarHBondContact N-O 2.93Å; T247-V249 PolarHBondContact O-N 2.89Å; T247-V249 PolarHBondContact OG1-N 3.41Å; V249-V251 PolarHBondContact O-N 3.32Å
250	N	95.9	Very high	96.2	Very high	47 Å²	47	51.1 Å²	51.1	25%	0.251	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	112.6	169.6	-175.4	11.1	0	0	0	109	V242 W243 H252 T253	V242-N250 CarbonylContact O-C 3.58Å; V242-N250 WeakPolarHBondContact O-CA 3.45Å; V242-N250 PolarHBondContact O-OD1 3.42Å; W243-N250 HydrophobicContact CE3-CB 3.87Å; W243-N250 HydrophobicContact CH2-CB 4.06Å; W243-N250 HydrophobicContact CZ3-CB 3.6Å; N250-H252 PolarHBondContact OD1-O 2.93Å; N250-T253 PolarHBondContact ND2-OG1 2.84Å
251	V	95.6	Very high	96.2	Very high	74 Å²	74	51.1 Å²	51.1	45%	0.448	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-50.6	-179.9	-179	0	0	0	0	110.3	V242 D244 V249	V242-V251 HydrophobicContact CG1-CB 4.37Å; V242-V251 PolarHBondContact O-N 3.13Å; D244-V251 HydrophobicContact CB-CG2 3.8Å; V249-V251 PolarHBondContact O-N 3.32Å
252	H	96	Very high	96.2	Very high	59 Å²	59	50.7 Å²	50.7	27%	0.273	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.5	-178.1	-70	-53.6	0	0	0	111.2	V242 N250 L254 L287	V242-H252 HydrophobicContact CB-CB 3.94Å; V242-H252 HydrophobicContact CG2-CB 3.64Å; V242-H252 WeakPolarHBondContact CG2-O 3.48Å; V242-H252 PolarHBondContact N-O 3.37Å; N250-H252 PolarHBondContact OD1-O 2.93Å; H252-L254 HydrophobicContact CB-CD2 4.36Å; H252-L287 PolarHBondContact CD2-O 2.82Å; H252-L287 PolarHBondContact NE2-O 2.82Å
253	T	96.3	Very high	96.2	Very high	61 Å²	61	51.1 Å²	51.1	37%	0.374	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	103.5	168	-49.4	0	0	0	0	107.7	T239 R241 N250 T255	T239-T253 HydrophobicContact CG2-CG2 4.18Å; R241-T253 HydrophobicContact CG-CG2 4.19Å; N250-T253 PolarHBondContact ND2-OG1 2.84Å; T253-T255 HydrophobicContact CG2-CG2 3.98Å; T253-T255 PolarHBondContact O-N 2.97Å; T253-T255 VanDerWaalsContact O-N 3.11Å
254	L	96.6	Very high	96.1	Very high	1 Å²	1	51 Å²	51	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	97.6	179.9	-55.3	178.4	0	0	0	108.5	L232 A240 V242 H252 V273 W285	L232-L254 HydrophobicContact CD2-CD1 4.39Å; A240-L254 HydrophobicContact CB-CB 4.11Å; A240-L254 HydrophobicContact CB-CD1 4.13Å; A240-L254 PolarHBondContact N-O 2.97Å; A240-L254 WeakPolarHBondContact O-CA 3.34Å; A240-L254 WeakPolarHBondContact O-CB 3.4Å; A240-L254 PolarHBondContact O-N 3Å; V242-L254 HydrophobicContact CG2-CD1 4.09Å; V242-L254 HydrophobicContact CG2-CD2 4.45Å; V242-L254 HydrophobicContact CG2-CG 4.03Å; H252-L254 HydrophobicContact CB-CD2 4.36Å; L254-V273 HydrophobicContact CD1-CG1 4.28Å; L254-W285 HydrophobicContact CB-CD2 4.05Å; L254-W285 HydrophobicContact CB-CE3 3.81Å; L254-W285 HydrophobicContact CB-CH2 3.92Å; L254-W285 HydrophobicContact CB-CZ2 4.17Å; L254-W285 HydrophobicContact CB-CZ3 3.72Å; L254-W285 HydrophobicContact CD1-CB 4.31Å; L254-W285 HydrophobicContact CD1-CD2 4.07Å; L254-W285 HydrophobicContact CD1-CE3 4.37Å; L254-W285 HydrophobicContact CD1-CG 4.04Å; L254-W285 HydrophobicContact CD2-CD2 4.26Å; L254-W285 HydrophobicContact CD2-CE3 3.74Å; L254-W285 HydrophobicContact CD2-CZ3 4.25Å; L254-W285 HydrophobicContact CG-CD2 4.35Å; L254-W285 HydrophobicContact CG-CE3 4.16Å
255	T	95.3	Very high	96.1	Very high	93 Å²	93	52.6 Å²	52.6	57%	0.571	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	138.3	-179.9	59	0	0	0	0	110.5	T239 T253 W285	T239-T255 HydrophobicContact CG2-CG2 3.94Å; T253-T255 HydrophobicContact CG2-CG2 3.98Å; T253-T255 PolarHBondContact O-N 2.97Å; T253-T255 VanDerWaalsContact O-N 3.11Å; T255-W285 VanDerWaalsContact O-CH2 3.25Å; T255-W285 WeakPolarHBondContact O-CH2 3.31Å
256	G	93.9	Very high	96.2	Very high	34 Å²	34	52.6 Å²	52.6	35%	0.351	29%	0.289	S	S	.	.			trans	158.3	-26.9	175.4	0	0	0	0	0	114.5	R283	G256-R283 VanDerWaalsContact C-NH1 3.29Å; G256-R283 VanDerWaalsContact CA-NH1 3.3Å; G256-R283 PolarHBondContact O-NH1 2.87Å; G256-R283 PolarHBondContact O-NH2 3Å
257	H	97.2	Very high	96.2	Very high	13 Å²	13	45.2 Å²	45.2	6%	0.06	26%	0.261	C	S	.	.			trans	-66.2	142.9	169.3	-78	-64.7	0	0	0	110.7	V261 T275 S277 D279 T281 R283	H257-V261 HydrophobicContact CB-CG2 3.84Å; H257-T275 PolarHBondContact NE2-OG1 3.29Å; H257-S277 VanDerWaalsContact CE1-CB 3.42Å; H257-S277 WeakPolarHBondContact CE1-CB 3.49Å; H257-S277 WeakPolarHBondContact ND1-CB 3.39Å; H257-D279 WeakPolarHBondContact CA-OD2 3.19Å; H257-D279 WeakPolarHBondContact CB-OD2 3.25Å; H257-D279 IonicContact CE1-OD1 3.41Å; H257-D279 IonicContact CE1-OD2 2.79Å; H257-D279 IonicContact CG-OD2 3.95Å; H257-D279 IonicContact ND1-OD1 3Å; H257-D279 PolarHBondContact ND1-OD1 2.88Å; H257-D279 IonicContact ND1-OD2 3.5Å; H257-D279 PolarHBondContact ND1-OD2 2.88Å; H257-T281 PolarHBondContact CE1-OG1 2.78Å; H257-T281 PolarHBondContact ND1-OG1 2.65Å; H257-R283 VanDerWaalsContact CE1-CD 3.47Å; H257-R283 WeakPolarHBondContact CE1-CD 3.38Å; H257-R283 VanDerWaalsContact CE1-CG 3.49Å; H257-R283 WeakPolarHBondContact CE1-CG 3.32Å
258	S	96.6	Very high	96.1	Very high	104 Å²	104	48.6 Å²	48.6	73%	0.727	27%	0.273	S	S	*	.	S	Bend	trans	-91.4	-12.6	178.8	61.4	0	0	0	0	112.9	D279	S258-D279 PolarHBondContact N-OD2 2.65Å; S258-D279 VanDerWaalsContact N-OD2 3.14Å; S258-D279 WeakPolarHBondContact OG-CB 3.47Å
259	N	97.1	Very high	95.9	Very high	74 Å²	74	46 Å²	46	40%	0.396	27%	0.268	S	S	.	.	S	Bend	trans	-139.1	177.9	-178.2	-154.3	-8.4	0	0	0	110.9	A238 V261 S277 H278 D279	A238-N259 WeakPolarHBondContact CA-O 3.12Å; A238-N259 VanDerWaalsContact CB-O 3.24Å; A238-N259 WeakPolarHBondContact CB-O 3.43Å; N259-V261 PolarHBondContact O-N 3.02Å; N259-S277 PolarHBondContact O-OG 2.95Å; N259-S277 VanDerWaalsContact O-OG 3.08Å; N259-H278 HydrophobicContact CB-CB 4.22Å; N259-D279 HydrophobicContact CB-CB 3.92Å
260	T	97.3	Very high	95.7	Very high	18 Å²	18	46.4 Å²	46.4	11%	0.11	27%	0.268	C	S	.	.			trans	-51.4	130.6	-176.9	59.7	0	0	0	0	112	Y220 R236 A262 S277 H278	Y220-T260 HydrophobicContact CE2-CG2 4.36Å; R236-T260 HydrophobicContact CB-CG2 4.09Å; R236-T260 HydrophobicContact CG-CG2 3.66Å; T260-A262 PolarHBondContact O-N 3.22Å; T260-S277 WeakPolarHBondContact O-CA 3.31Å; T260-S277 PolarHBondContact O-OG 2.92Å; T260-H278 PolarHBondContact O-CD2 2.98Å; T260-H278 VanDerWaalsContact O-CD2 3.29Å; T260-H278 PolarHBondContact O-N 2.78Å; T260-H278 WeakPolarHBondContact OG1-CB 3.49Å; T260-H278 PolarHBondContact OG1-CD2 3.09Å
261	V	97.7	Very high	95.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.7	176.8	-178.6	0	0	0	0	107.2	C234 G235 H257 N259 V264	C234-V261 HydrophobicContact CB-CB 3.73Å; C234-V261 HydrophobicContact CB-CG1 3.4Å; C234-V261 VanDerWaalsContact CB-CG1 3.4Å; C234-V261 PolarHBondContact SG-O 3.15Å; G235-V261 PolarHBondContact O-N 3.5Å; H257-V261 HydrophobicContact CB-CG2 3.84Å; N259-V261 PolarHBondContact O-N 3.02Å; V261-V264 HydrophobicContact CG1-CG2 4.39Å
262	A	96.8	Very high	95.5	Very high	12 Å²	12	42.2 Å²	42.2	10%	0.099	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-38.2	-171.9	0	0	0	0	0	112.3	T260 G276 V303	T260-A262 PolarHBondContact O-N 3.22Å; A262-G276 PolarHBondContact N-O 3.19Å; A262-V303 WeakPolarHBondContact CB-O 3.47Å
263	T	97	Very high	95.5	Very high	10 Å²	10	39.4 Å²	39.4	6%	0.061	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	149.3	-174.6	48	0	0	0	0	112.2	D221 T275 G276 R304 V306	D221-T263 VanDerWaalsContact OD2-CA 3.31Å; D221-T263 WeakPolarHBondContact OD2-CA 2.95Å; T263-T275 WeakPolarHBondContact O-CA 3.47Å; T263-G276 PolarHBondContact N-O 3.39Å; T263-G276 PolarHBondContact O-N 3.11Å; T263-R304 WeakPolarHBondContact CG2-O 3.44Å; T263-V306 WeakPolarHBondContact OG1-CG2 3.47Å
264	V	96.9	Very high	95.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.3	172.3	171.7	0	0	0	0	108.5	D221 L232 C234 A240 V261 V273 I274 T275	D221-V264 PolarHBondContact OD2-N 3.47Å; D221-V264 VanDerWaalsContact OD2-N 3.09Å; L232-V264 HydrophobicContact CB-CG1 3.97Å; C234-V264 HydrophobicContact CB-CG2 3.3Å; C234-V264 WeakPolarHBondContact SG-CG2 3.49Å; A240-V264 HydrophobicContact CB-CG2 4.23Å; V261-V264 HydrophobicContact CG1-CG2 4.39Å; V264-V273 HydrophobicContact CG1-CG1 4.03Å; V264-I274 CarbonylContact C-O 3.09Å; V264-I274 WeakPolarHBondContact CA-O 3.41Å; V264-T275 HydrophobicContact CG2-CG2 3.85Å
265	R	96.9	Very high	95.6	Very high	70 Å²	70	36.4 Å²	36.4	26%	0.264	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	142.5	168.9	-65.3	-67.2	176.2	-100.2	0.8	110.9	D221 D223 I274 V306 I308	D221-R265 IonicContact OD1-NH1 2.95Å; D221-R265 IonicContact OD2-CZ 2.7Å; D221-R265 IonicContact OD2-NH1 3.11Å; D221-R265 PolarHBondContact OD2-NH1 3.39Å; D221-R265 IonicContact OD2-NH2 3.65Å; D223-R265 VanDerWaalsContact OD2-CA 3.27Å; D223-R265 WeakPolarHBondContact OD2-CA 3.49Å; R265-I274 PolarHBondContact N-O 3.24Å; R265-I274 PolarHBondContact O-N 2.77Å; R265-V306 HydrophobicContact CB-CG1 4.49Å; R265-V306 HydrophobicContact CG-CB 4.41Å; R265-V306 HydrophobicContact CG-CG1 4.15Å; R265-V306 WeakPolarHBondContact CG-O 3.45Å; R265-V306 PolarHBondContact NE-O 3.33Å; R265-I308 HydrophobicContact CB-CD1 3.68Å; R265-I308 HydrophobicContact CB-CG1 3.84Å; R265-I308 HydrophobicContact CG-CG1 4.49Å
266	C	95.8	Very high	95.7	Very high	14 Å²	14	32 Å²	32	10%	0.095	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	146.3	-176.6	-46.7	0	0	0	0	109.8	D223 L232 Q272	D223-C266 WeakPolarHBondContact OD2-CB 3.39Å; D223-C266 PolarHBondContact OD2-N 2.84Å; D223-C266 PolarHBondContact OD2-SG 3.13Å; L232-C266 HydrophobicContact CD1-CB 4.19Å; L232-C266 WeakPolarHBondContact CD1-SG 3.38Å; C266-Q272 CarbonylContact C-O 3.55Å; C266-Q272 VanDerWaalsContact CA-O 3.27Å; C266-Q272 WeakPolarHBondContact CA-O 3.29Å
267	Q	94.7	Very high	95.9	Very high	21 Å²	21	30.4 Å²	30.4	10%	0.098	17%	0.167	C	C	.	.			trans	-148.2	165	173.5	55	165	9.3	0	0	110.6	H225 S269 P271 Q272 I308	H225-Q267 PolarHBondContact NE2-O 3.28Å; H225-Q267 VanDerWaalsContact NE2-O 3.15Å; Q267-S269 WeakPolarHBondContact CG-O 3.49Å; Q267-S269 PolarHBondContact NE2-O 3.21Å; Q267-S269 PolarHBondContact NE2-OG 3.24Å; Q267-P271 WeakPolarHBondContact CG-O 3.44Å; Q267-P271 PolarHBondContact NE2-O 3.02Å; Q267-Q272 PolarHBondContact N-O 3.43Å; Q267-Q272 WeakPolarHBondContact O-CA 3.16Å; Q267-I308 HydrophobicContact CB-CD1 3.85Å; Q267-I308 HydrophobicContact CG-CD1 4.03Å
268	E	92.9	Very high	95.9	Very high	124 Å²	124	32.4 Å²	32.4	58%	0.579	18%	0.176	S	C	*	.	S	Bend	trans	-70.9	-36.4	-179	-59.3	179	179.9	0	0	113	P226 T227	P226-E268 HydrophobicContact CB-CG 3.78Å; P226-E268 HydrophobicContact CG-CB 4.35Å; P226-E268 HydrophobicContact CG-CG 3.3Å; T227-E268 HydrophobicContact CG2-CB 4.38Å; T227-E268 VanDerWaalsContact CG2-CD 3.47Å; T227-E268 HydrophobicContact CG2-CG 3.61Å; T227-E268 WeakPolarHBondContact CG2-OE1 3.36Å
269	S	92.2	Very high	95.9	Very high	49 Å²	49	28.9 Å²	28.9	34%	0.343	15%	0.149	S	C	.	.	S	Bend	trans	-89	153.4	-174.7	76.4	0	0	0	0	112.4	Q267 P271 Q272	Q267-S269 WeakPolarHBondContact CG-O 3.49Å; Q267-S269 PolarHBondContact NE2-O 3.21Å; Q267-S269 PolarHBondContact NE2-OG 3.24Å; S269-P271 CarbonylContact O-C 3.56Å; S269-P271 VanDerWaalsContact O-O 3.11Å; S269-Q272 WeakPolarHBondContact O-CA 3.45Å; S269-Q272 PolarHBondContact O-N 3.49Å
270	D	90.3	Very high	95.9	Very high	97 Å²	97	26.1 Å²	26.1	52%	0.519	14%	0.137	S	C	.	.	S	Bend	trans	-69	134	174.2	-68.7	-32	0	0	0	111.1
271	P	94.2	Very high	95.9	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	14%	0.137	C	C	.	.	S	Bend	cis	-74.5	127.2	-2.3	30.9	-36.2	0	0	0	112.6	Q267 S269 V273 L284 I293 L328 P329	Q267-P271 WeakPolarHBondContact CG-O 3.44Å; Q267-P271 PolarHBondContact NE2-O 3.02Å; S269-P271 CarbonylContact O-C 3.56Å; S269-P271 VanDerWaalsContact O-O 3.11Å; P271-V273 VanDerWaalsContact C-N 3.3Å; P271-V273 PolarHBondContact O-N 2.75Å; P271-L284 HydrophobicContact CB-CB 3.86Å; P271-L284 HydrophobicContact CB-CD2 4.42Å; P271-L284 HydrophobicContact CG-CB 4.04Å; P271-L284 HydrophobicContact CG-CD1 4.04Å; P271-L284 HydrophobicContact CG-CD2 3.83Å; P271-L284 HydrophobicContact CG-CG 4.17Å; P271-I293 HydrophobicContact CB-CD1 3.82Å; P271-L328 HydrophobicContact CG-CD2 3.58Å; P271-P329 WeakPolarHBondContact CD-O 3.35Å
272	Q	94	Very high	95.8	Very high	31 Å²	31	26.2 Å²	26.2	15%	0.145	14%	0.137	C	C	.	.			trans	-68.8	-27.1	-174.7	-72.3	-178.8	-21	0	0	113.8	C266 Q267 S269 L287	C266-Q272 CarbonylContact C-O 3.55Å; C266-Q272 VanDerWaalsContact CA-O 3.27Å; C266-Q272 WeakPolarHBondContact CA-O 3.29Å; Q267-Q272 PolarHBondContact N-O 3.43Å; Q267-Q272 WeakPolarHBondContact O-CA 3.16Å; S269-Q272 WeakPolarHBondContact O-CA 3.45Å; S269-Q272 PolarHBondContact O-N 3.49Å; Q272-L287 HydrophobicContact CB-CB 4.25Å
273	V	96.9	Very high	95.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	132	-177.3	-173	0	0	0	0	110.9	L232 L254 V264 P271 T275 W285 L287	L232-V273 HydrophobicContact CD1-CB 4.38Å; L232-V273 HydrophobicContact CD1-CG1 4.14Å; L232-V273 HydrophobicContact CD1-CG2 3.36Å; L232-V273 HydrophobicContact CD2-CG1 4.24Å; L232-V273 HydrophobicContact CD2-CG2 4.2Å; L232-V273 HydrophobicContact CG-CG2 4.47Å; L254-V273 HydrophobicContact CD1-CG1 4.28Å; V264-V273 HydrophobicContact CG1-CG1 4.03Å; P271-V273 VanDerWaalsContact C-N 3.3Å; P271-V273 PolarHBondContact O-N 2.75Å; V273-T275 HydrophobicContact CG1-CG2 4.09Å; V273-W285 HydrophobicContact CB-CB 4.17Å; V273-W285 PolarHBondContact O-N 3.35Å; V273-L287 HydrophobicContact CG2-CD1 4.02Å
274	I	97.2	Very high	95.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.9	178.5	-51.2	-178.6	0	0	0	107.9	V264 R265 V282 L284 V306 I308 F315 L328	V264-I274 CarbonylContact C-O 3.09Å; V264-I274 WeakPolarHBondContact CA-O 3.41Å; R265-I274 PolarHBondContact N-O 3.24Å; R265-I274 PolarHBondContact O-N 2.77Å; I274-V282 HydrophobicContact CG2-CG1 3.71Å; I274-L284 HydrophobicContact CB-CD2 4.24Å; I274-L284 HydrophobicContact CD1-CD2 4.16Å; I274-L284 HydrophobicContact CG1-CD2 3.73Å; I274-L284 HydrophobicContact CG2-CD2 3.9Å; I274-V306 HydrophobicContact CG2-CG1 3.86Å; I274-I308 HydrophobicContact CD1-CD1 4.16Å; I274-I308 HydrophobicContact CD1-CG1 4.18Å; I274-F315 HydrophobicContact CD1-CB 4.22Å; I274-F315 HydrophobicContact CD1-CD1 3.76Å; I274-F315 HydrophobicContact CD1-CE1 4.22Å; I274-F315 HydrophobicContact CD1-CG 3.92Å; I274-F315 HydrophobicContact CG2-CD2 4.35Å; I274-F315 HydrophobicContact CG2-CE2 4.16Å; I274-F315 HydrophobicContact CG2-CZ 4.35Å; I274-L328 HydrophobicContact CD1-CD1 4.19Å; I274-L328 HydrophobicContact CD1-CD2 4.39Å
275	T	97.6	Very high	95.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.5	179.4	63	0	0	0	0	111.5	A240 H257 T263 V264 V273 V282 R283 W285	A240-T275 HydrophobicContact CB-CG2 4.13Å; H257-T275 PolarHBondContact NE2-OG1 3.29Å; T263-T275 WeakPolarHBondContact O-CA 3.47Å; V264-T275 HydrophobicContact CG2-CG2 3.85Å; V273-T275 HydrophobicContact CG1-CG2 4.09Å; T275-V282 CarbonylContact O-C 3.59Å; T275-V282 VanDerWaalsContact O-CA 3.29Å; T275-V282 WeakPolarHBondContact O-CA 3.02Å; T275-V282 WeakPolarHBondContact O-CG1 3.33Å; T275-R283 PolarHBondContact N-O 2.99Å; T275-R283 PolarHBondContact O-N 3.01Å; T275-W285 PolarHBondContact OG1-NE1 2.88Å
276	G	97	Very high	95.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.2	173.6	0	0	0	0	0	110.8	A262 T263	A262-G276 PolarHBondContact N-O 3.19Å; T263-G276 PolarHBondContact N-O 3.39Å; T263-G276 PolarHBondContact O-N 3.11Å
277	S	97.4	Very high	95.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	160.3	-176.3	173.4	0	0	0	0	113.6	H257 N259 T260 D279 A280 T281 V303	H257-S277 VanDerWaalsContact CE1-CB 3.42Å; H257-S277 WeakPolarHBondContact CE1-CB 3.49Å; H257-S277 WeakPolarHBondContact ND1-CB 3.39Å; N259-S277 PolarHBondContact O-OG 2.95Å; N259-S277 VanDerWaalsContact O-OG 3.08Å; T260-S277 WeakPolarHBondContact O-CA 3.31Å; T260-S277 PolarHBondContact O-OG 2.92Å; S277-D279 WeakPolarHBondContact CB-OD1 3.22Å; S277-D279 PolarHBondContact O-N 2.7Å; S277-D279 VanDerWaalsContact OG-CG 3.22Å; S277-D279 PolarHBondContact OG-N 2.9Å; S277-D279 VanDerWaalsContact OG-N 3.17Å; S277-D279 PolarHBondContact OG-OD1 3.32Å; S277-D279 PolarHBondContact OG-OD2 3.47Å; S277-A280 PolarHBondContact O-N 3.33Å; S277-T281 PolarHBondContact N-O 2.93Å; S277-V303 PolarHBondContact O-N 2.95Å
278	H	97	Very high	95.5	Very high	56 Å²	56	29.7 Å²	29.7	26%	0.259	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-8	169.8	-72	-100.5	0	0	0	113.8	N259 T260 A280 S302	N259-H278 HydrophobicContact CB-CB 4.22Å; T260-H278 PolarHBondContact O-CD2 2.98Å; T260-H278 VanDerWaalsContact O-CD2 3.29Å; T260-H278 PolarHBondContact O-N 2.78Å; T260-H278 WeakPolarHBondContact OG1-CB 3.49Å; T260-H278 PolarHBondContact OG1-CD2 3.09Å; H278-A280 PolarHBondContact O-N 2.95Å; H278-S302 PolarHBondContact CE1-OG 3.12Å; H278-S302 VanDerWaalsContact CG-OG 3.3Å; H278-S302 PolarHBondContact ND1-OG 3.23Å
279	D	96.8	Very high	95.6	Very high	30 Å²	30	26.1 Å²	26.1	16%	0.16	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	8.8	170.5	66.4	11.3	0	0	0	114	H257 S258 N259 S277 T281	H257-D279 WeakPolarHBondContact CA-OD2 3.19Å; H257-D279 WeakPolarHBondContact CB-OD2 3.25Å; H257-D279 IonicContact CE1-OD1 3.41Å; H257-D279 IonicContact CE1-OD2 2.79Å; H257-D279 IonicContact CG-OD2 3.95Å; H257-D279 IonicContact ND1-OD1 3Å; H257-D279 PolarHBondContact ND1-OD1 2.88Å; H257-D279 IonicContact ND1-OD2 3.5Å; H257-D279 PolarHBondContact ND1-OD2 2.88Å; S258-D279 PolarHBondContact N-OD2 2.65Å; S258-D279 VanDerWaalsContact N-OD2 3.14Å; S258-D279 WeakPolarHBondContact OG-CB 3.47Å; N259-D279 HydrophobicContact CB-CB 3.92Å; S277-D279 WeakPolarHBondContact CB-OD1 3.22Å; S277-D279 PolarHBondContact O-N 2.7Å; S277-D279 VanDerWaalsContact OG-CG 3.22Å; S277-D279 PolarHBondContact OG-N 2.9Å; S277-D279 VanDerWaalsContact OG-N 3.17Å; S277-D279 PolarHBondContact OG-OD1 3.32Å; S277-D279 PolarHBondContact OG-OD2 3.47Å; D279-T281 PolarHBondContact O-N 3.35Å; D279-T281 WeakPolarHBondContact OD1-CB 3.31Å; D279-T281 PolarHBondContact OD1-N 3.24Å; D279-T281 PolarHBondContact OD1-OG1 3.42Å; D279-T281 PolarHBondContact OD2-OG1 2.89Å
280	A	96.4	Very high	95.6	Very high	16 Å²	16	24.7 Å²	24.7	13%	0.132	15%	0.151	C	C	.	.	S	Bend	trans	64.2	18.3	-177.2	0	0	0	0	0	114.3	S277 H278 H299 K301	S277-A280 PolarHBondContact O-N 3.33Å; H278-A280 PolarHBondContact O-N 2.95Å; A280-H299 WeakPolarHBondContact O-CB 3.23Å; A280-K301 WeakPolarHBondContact CA-O 3.49Å; A280-K301 VanDerWaalsContact CB-C 3.5Å; A280-K301 VanDerWaalsContact CB-O 3.22Å; A280-K301 WeakPolarHBondContact CB-O 3.15Å
281	T	97.2	Very high	95.7	Very high	20 Å²	20	29 Å²	29	12%	0.123	16%	0.16	C	C	.	.			trans	-114.7	150.8	175.5	72.8	0	0	0	0	112	H257 S277 D279 L296 T297	H257-T281 PolarHBondContact CE1-OG1 2.78Å; H257-T281 PolarHBondContact ND1-OG1 2.65Å; S277-T281 PolarHBondContact N-O 2.93Å; D279-T281 PolarHBondContact O-N 3.35Å; D279-T281 WeakPolarHBondContact OD1-CB 3.31Å; D279-T281 PolarHBondContact OD1-N 3.24Å; D279-T281 PolarHBondContact OD1-OG1 3.42Å; D279-T281 PolarHBondContact OD2-OG1 2.89Å; T281-L296 WeakPolarHBondContact CA-O 3.39Å; T281-T297 HydrophobicContact CG2-CG2 4.25Å
282	V	97.3	Very high	95.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.6	164.4	-179.9	0	0	0	0	107.5	I274 T275 L296 V303 F315	I274-V282 HydrophobicContact CG2-CG1 3.71Å; T275-V282 CarbonylContact O-C 3.59Å; T275-V282 VanDerWaalsContact O-CA 3.29Å; T275-V282 WeakPolarHBondContact O-CA 3.02Å; T275-V282 WeakPolarHBondContact O-CG1 3.33Å; V282-L296 HydrophobicContact CB-CB 4.15Å; V282-L296 HydrophobicContact CB-CD1 4.19Å; V282-L296 HydrophobicContact CG1-CD1 4.2Å; V282-L296 PolarHBondContact N-O 2.85Å; V282-L296 WeakPolarHBondContact O-CB 3.25Å; V282-L296 PolarHBondContact O-N 2.81Å; V282-V303 HydrophobicContact CG2-CB 4.33Å; V282-V303 HydrophobicContact CG2-CG1 3.94Å; V282-V303 HydrophobicContact CG2-CG2 3.97Å; V282-F315 HydrophobicContact CG1-CE2 3.97Å; V282-F315 HydrophobicContact CG1-CZ 4.11Å
283	R	96.9	Very high	95.8	Very high	47 Å²	47	34.3 Å²	34.3	18%	0.177	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.5	178	-70.3	179.4	176.4	-131.8	0.4	110.5	G256 H257 T275 W285 T292 C295	G256-R283 VanDerWaalsContact C-NH1 3.29Å; G256-R283 VanDerWaalsContact CA-NH1 3.3Å; G256-R283 PolarHBondContact O-NH1 2.87Å; G256-R283 PolarHBondContact O-NH2 3Å; H257-R283 VanDerWaalsContact CE1-CD 3.47Å; H257-R283 WeakPolarHBondContact CE1-CD 3.38Å; H257-R283 VanDerWaalsContact CE1-CG 3.49Å; H257-R283 WeakPolarHBondContact CE1-CG 3.32Å; T275-R283 PolarHBondContact N-O 2.99Å; T275-R283 PolarHBondContact O-N 3.01Å; R283-W285 HydrophobicContact CB-CZ2 4.07Å; R283-T292 HydrophobicContact CB-CG2 4.32Å; R283-T292 HydrophobicContact CG-CG2 4.4Å; R283-C295 HydrophobicContact CG-CB 4.45Å
284	L	97.1	Very high	95.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.2	172.2	-57.4	178.7	0	0	0	107.2	P271 I274 T292 I293 A294 L296 F315 L328	P271-L284 HydrophobicContact CB-CB 3.86Å; P271-L284 HydrophobicContact CB-CD2 4.42Å; P271-L284 HydrophobicContact CG-CB 4.04Å; P271-L284 HydrophobicContact CG-CD1 4.04Å; P271-L284 HydrophobicContact CG-CD2 3.83Å; P271-L284 HydrophobicContact CG-CG 4.17Å; I274-L284 HydrophobicContact CB-CD2 4.24Å; I274-L284 HydrophobicContact CD1-CD2 4.16Å; I274-L284 HydrophobicContact CG1-CD2 3.73Å; I274-L284 HydrophobicContact CG2-CD2 3.9Å; L284-T292 CarbonylContact O-C 3.56Å; L284-T292 WeakPolarHBondContact O-CA 2.99Å; L284-I293 PolarHBondContact O-N 2.98Å; L284-A294 HydrophobicContact CB-CB 4.44Å; L284-A294 HydrophobicContact CD1-CB 4.19Å; L284-A294 PolarHBondContact N-O 3.48Å; L284-A294 PolarHBondContact O-N 2.84Å; L284-L296 HydrophobicContact CD1-CD1 4.29Å; L284-L296 HydrophobicContact CG-CD1 4.33Å; L284-F315 HydrophobicContact CD2-CE1 4.05Å; L284-F315 HydrophobicContact CD2-CZ 4.24Å; L284-L328 HydrophobicContact CD1-CD2 4.26Å; L284-L328 HydrophobicContact CD2-CD2 4.26Å
285	W	96.5	Very high	95.6	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.011	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.4	-175.6	-54.5	80.7	0	0	0	111.3	L254 T255 V273 T275 R283 R291 T292	L254-W285 HydrophobicContact CB-CD2 4.05Å; L254-W285 HydrophobicContact CB-CE3 3.81Å; L254-W285 HydrophobicContact CB-CH2 3.92Å; L254-W285 HydrophobicContact CB-CZ2 4.17Å; L254-W285 HydrophobicContact CB-CZ3 3.72Å; L254-W285 HydrophobicContact CD1-CB 4.31Å; L254-W285 HydrophobicContact CD1-CD2 4.07Å; L254-W285 HydrophobicContact CD1-CE3 4.37Å; L254-W285 HydrophobicContact CD1-CG 4.04Å; L254-W285 HydrophobicContact CD2-CD2 4.26Å; L254-W285 HydrophobicContact CD2-CE3 3.74Å; L254-W285 HydrophobicContact CD2-CZ3 4.25Å; L254-W285 HydrophobicContact CG-CD2 4.35Å; L254-W285 HydrophobicContact CG-CE3 4.16Å; T255-W285 VanDerWaalsContact O-CH2 3.25Å; T255-W285 WeakPolarHBondContact O-CH2 3.31Å; V273-W285 HydrophobicContact CB-CB 4.17Å; V273-W285 PolarHBondContact O-N 3.35Å; T275-W285 PolarHBondContact OG1-NE1 2.88Å; R283-W285 HydrophobicContact CB-CZ2 4.07Å; W285-R291 WeakPolarHBondContact CA-O 3.37Å; W285-T292 HydrophobicContact CD2-CG2 3.78Å; W285-T292 HydrophobicContact CE3-CG2 3.5Å; W285-T292 VanDerWaalsContact CE3-CG2 3.5Å; W285-T292 HydrophobicContact CH2-CG2 3.37Å; W285-T292 HydrophobicContact CZ2-CG2 3.65Å; W285-T292 HydrophobicContact CZ3-CG2 3.3Å
286	D	94.6	Very high	95.6	Very high	50 Å²	50	38.9 Å²	38.9	27%	0.267	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.2	163.3	-178.9	-6.9	0	0	0	107.6	A288 A289 G290 R291 I293	D286-A288 PolarHBondContact OD1-N 3.49Å; D286-A289 HydrophobicContact CB-CB 4.18Å; D286-A289 PolarHBondContact OD1-N 2.78Å; D286-A289 WeakPolarHBondContact OD2-CB 3.45Å; D286-G290 WeakPolarHBondContact O-CA 3.27Å; D286-G290 PolarHBondContact O-N 2.79Å; D286-R291 PolarHBondContact N-O 2.87Å; D286-R291 PolarHBondContact O-N 3.25Å; D286-I293 HydrophobicContact CB-CD1 3.84Å; D286-I293 HydrophobicContact CB-CG1 3.73Å
287	L	94	Very high	95.5	Very high	14 Å²	14	43.6 Å²	43.6	7%	0.073	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-34.2	-178.4	-169.2	62.8	0	0	0	111.7	I228 V242 H252 Q272 V273	I228-L287 HydrophobicContact CD1-CD2 4.43Å; V242-L287 HydrophobicContact CB-CD1 4.48Å; V242-L287 HydrophobicContact CG1-CD1 3.74Å; V242-L287 HydrophobicContact CG2-CD1 3.94Å; H252-L287 PolarHBondContact CD2-O 2.82Å; H252-L287 PolarHBondContact NE2-O 2.82Å; Q272-L287 HydrophobicContact CB-CB 4.25Å; V273-L287 HydrophobicContact CG2-CD1 4.02Å
288	A	93	Very high	95.3	Very high	85 Å²	85	46.8 Å²	46.8	70%	0.702	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-40.3	-177	0	0	0	0	0	111.6	D286	D286-A288 PolarHBondContact OD1-N 3.49Å
289	A	93.4	Very high	95.3	Very high	50 Å²	50	44.6 Å²	44.6	41%	0.413	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-19.4	176.2	0	0	0	0	0	113.3	D286 R291	D286-A289 HydrophobicContact CB-CB 4.18Å; D286-A289 PolarHBondContact OD1-N 2.78Å; D286-A289 WeakPolarHBondContact OD2-CB 3.45Å; A289-R291 HydrophobicContact CB-CB 4.31Å; A289-R291 HydrophobicContact CB-CG 4.45Å; A289-R291 PolarHBondContact O-N 3.12Å
290	G	92.2	Very high	95.2	Very high	18 Å²	18	52.2 Å²	52.2	19%	0.186	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	26.5	-171.6	0	0	0	0	0	113.2	D286	D286-G290 WeakPolarHBondContact O-CA 3.27Å; D286-G290 PolarHBondContact O-N 2.79Å
291	R	93.7	Very high	95.2	Very high	189 Å²	189	56.6 Å²	56.6	71%	0.713	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	155.1	-174.8	-69.5	-178.3	-175.8	-174	1.1	111.3	W285 D286 A289 I293	W285-R291 WeakPolarHBondContact CA-O 3.37Å; D286-R291 PolarHBondContact N-O 2.87Å; D286-R291 PolarHBondContact O-N 3.25Å; A289-R291 HydrophobicContact CB-CB 4.31Å; A289-R291 HydrophobicContact CB-CG 4.45Å; A289-R291 PolarHBondContact O-N 3.12Å; R291-I293 PolarHBondContact O-N 3.36Å
292	T	95	Very high	95.1	Very high	57 Å²	57	56.6 Å²	56.6	35%	0.35	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	127.3	171.9	52.8	0	0	0	0	110.8	R283 L284 W285	R283-T292 HydrophobicContact CB-CG2 4.32Å; R283-T292 HydrophobicContact CG-CG2 4.4Å; L284-T292 CarbonylContact O-C 3.56Å; L284-T292 WeakPolarHBondContact O-CA 2.99Å; W285-T292 HydrophobicContact CD2-CG2 3.78Å; W285-T292 HydrophobicContact CE3-CG2 3.5Å; W285-T292 VanDerWaalsContact CE3-CG2 3.5Å; W285-T292 HydrophobicContact CH2-CG2 3.37Å; W285-T292 HydrophobicContact CZ2-CG2 3.65Å; W285-T292 HydrophobicContact CZ3-CG2 3.3Å
293	I	94.5	Very high	95.1	Very high	86 Å²	86	56.6 Å²	56.6	44%	0.441	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-49.1	170.4	-61.8	161.4	0	0	0	109.6	P271 L284 D286 R291	P271-I293 HydrophobicContact CB-CD1 3.82Å; L284-I293 PolarHBondContact O-N 2.98Å; D286-I293 HydrophobicContact CB-CD1 3.84Å; D286-I293 HydrophobicContact CB-CG1 3.73Å; R291-I293 PolarHBondContact O-N 3.36Å
294	A	94.8	Very high	95.1	Very high	24 Å²	24	58 Å²	58	20%	0.198	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	146.5	-176.9	0	0	0	0	0	111.3	L284	L284-A294 HydrophobicContact CB-CB 4.44Å; L284-A294 HydrophobicContact CD1-CB 4.19Å; L284-A294 PolarHBondContact N-O 3.48Å; L284-A294 PolarHBondContact O-N 2.84Å
295	C	95.8	Very high	95.1	Very high	56 Å²	56	58.1 Å²	58.1	38%	0.378	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.6	173.1	-173.3	0	0	0	0	108.6	R283	R283-C295 HydrophobicContact CG-CB 4.45Å
296	L	96.1	Very high	95.1	Very high	16 Å²	16	58 Å²	58	8%	0.084	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	113.1	-176.6	-53.3	175.5	0	0	0	109.1	T281 V282 L284 F315 W326 G331	T281-L296 WeakPolarHBondContact CA-O 3.39Å; V282-L296 HydrophobicContact CB-CB 4.15Å; V282-L296 HydrophobicContact CB-CD1 4.19Å; V282-L296 HydrophobicContact CG1-CD1 4.2Å; V282-L296 PolarHBondContact N-O 2.85Å; V282-L296 WeakPolarHBondContact O-CB 3.25Å; V282-L296 PolarHBondContact O-N 2.81Å; L284-L296 HydrophobicContact CD1-CD1 4.29Å; L284-L296 HydrophobicContact CG-CD1 4.33Å; L296-F315 HydrophobicContact CD1-CE1 4.39Å; L296-F315 HydrophobicContact CD1-CZ 3.64Å; L296-W326 HydrophobicContact CB-CH2 3.63Å; L296-W326 HydrophobicContact CB-CZ2 4.23Å; L296-W326 HydrophobicContact CB-CZ3 3.92Å; L296-W326 HydrophobicContact CD1-CD2 3.99Å; L296-W326 HydrophobicContact CD1-CE3 3.81Å; L296-W326 HydrophobicContact CD1-CH2 4.15Å; L296-W326 HydrophobicContact CD1-CZ2 4.42Å; L296-W326 HydrophobicContact CD1-CZ3 3.89Å; L296-W326 HydrophobicContact CD2-CE3 4.27Å; L296-W326 HydrophobicContact CD2-CH2 4.43Å; L296-W326 HydrophobicContact CD2-CZ3 3.83Å; L296-W326 HydrophobicContact CG-CE3 4.47Å; L296-W326 HydrophobicContact CG-CH2 4.28Å; L296-W326 HydrophobicContact CG-CZ3 4.09Å; L296-G331 VanDerWaalsContact CD2-O 3.31Å; L296-G331 WeakPolarHBondContact CD2-O 3.26Å
297	T	95.8	Very high	95.2	Very high	98 Å²	98	56.4 Å²	56.4	60%	0.601	31%	0.305	S	S	*	.			trans	-107.7	20.2	-171.3	60	0	0	0	0	113.3	T281 H299	T281-T297 HydrophobicContact CG2-CG2 4.25Å; T297-H299 VanDerWaalsContact C-N 3.33Å; T297-H299 PolarHBondContact O-N 2.82Å
298	N	94	Very high	95.3	Very high	68 Å²	68	57.3 Å²	57.3	36%	0.364	31%	0.31	S	S	.	.			trans	-77.4	-18.2	-173	-67.3	-27.1	0	0	0	113	K324 W326	N298-K324 HydrophobicContact CB-CD 3.96Å; N298-K324 WeakPolarHBondContact O-CE 3.48Å; N298-K324 PolarHBondContact O-NZ 3.17Å; N298-W326 HydrophobicContact CB-CH2 3.51Å; N298-W326 HydrophobicContact CB-CZ2 4.03Å; N298-W326 HydrophobicContact CB-CZ3 4.46Å; N298-W326 WeakPolarHBondContact ND2-CH2 3.34Å; N298-W326 WeakPolarHBondContact ND2-CZ3 3.4Å
299	H	95.7	Very high	95.4	Very high	10 Å²	10	53.5 Å²	53.5	5%	0.046	28%	0.277	C	S	.	.			trans	-80.3	145.2	176.8	-70.7	-82.9	0	0	0	110.7	A280 T297 V303 S317 S319 N322	A280-H299 WeakPolarHBondContact O-CB 3.23Å; T297-H299 VanDerWaalsContact C-N 3.33Å; T297-H299 PolarHBondContact O-N 2.82Å; H299-V303 HydrophobicContact CB-CG2 3.85Å; H299-S317 PolarHBondContact CE1-OG 3.14Å; H299-S317 PolarHBondContact NE2-OG 3.38Å; H299-S319 VanDerWaalsContact ND1-CB 3.27Å; H299-S319 WeakPolarHBondContact ND1-CB 3.39Å; H299-S319 PolarHBondContact ND1-OG 3.03Å; H299-N322 PolarHBondContact CE1-O 2.9Å
300	K	95.2	Very high	95.4	Very high	190 Å²	190	54.2 Å²	54.2	83%	0.826	28%	0.278	S	S	*	.	S	Bend	trans	-97	-28	176	-58.9	178.2	176.5	-177.9	0	111.6	D321	K300-D321 VanDerWaalsContact CB-OD2 3.31Å; K300-D321 WeakPolarHBondContact CB-OD2 3.42Å
301	K	96.3	Very high	95.3	Very high	108 Å²	108	58 Å²	58	47%	0.47	30%	0.297	S	S	.	.	S	Bend	trans	-114.2	171	174.3	-68.9	179.7	-168	141.7	0	112.1	A280 V303 P320 D321	A280-K301 WeakPolarHBondContact CA-O 3.49Å; A280-K301 VanDerWaalsContact CB-C 3.5Å; A280-K301 VanDerWaalsContact CB-O 3.22Å; A280-K301 WeakPolarHBondContact CB-O 3.15Å; K301-V303 PolarHBondContact O-N 3.26Å; K301-P320 HydrophobicContact CB-CG 4.47Å; K301-P320 HydrophobicContact CD-CB 4.01Å; K301-P320 HydrophobicContact CD-CG 4.43Å; K301-D321 VanDerWaalsContact CB-OD2 3.22Å; K301-D321 WeakPolarHBondContact CB-OD2 3.05Å; K301-D321 WeakPolarHBondContact CD-OD1 3.42Å; K301-D321 WeakPolarHBondContact CE-OD1 3.18Å; K301-D321 WeakPolarHBondContact CG-OD1 3.22Å; K301-D321 WeakPolarHBondContact CG-OD2 3.44Å; K301-D321 PolarHBondContact N-OD2 2.8Å; K301-D321 IonicContact NZ-OD1 2.71Å; K301-D321 PolarHBondContact NZ-OD1 3.34Å
302	S	96.4	Very high	95.2	Very high	19 Å²	19	52.4 Å²	52.4	13%	0.133	28%	0.279	C	S	.	.			trans	-44.9	132.3	174.8	160.2	0	0	0	0	113.1	H278 S319 P320	H278-S302 PolarHBondContact CE1-OG 3.12Å; H278-S302 VanDerWaalsContact CG-OG 3.3Å; H278-S302 PolarHBondContact ND1-OG 3.23Å; S302-S319 WeakPolarHBondContact O-CA 3.48Å; S302-S319 WeakPolarHBondContact O-CB 3.47Å; S302-P320 WeakPolarHBondContact O-CD 3.37Å
303	V	96.9	Very high	95.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.282	C	S	.	.			trans	-92.4	114	171.3	-177.7	0	0	0	0	107.8	A262 S277 V282 H299 K301 V306 G318	A262-V303 WeakPolarHBondContact CB-O 3.47Å; S277-V303 PolarHBondContact O-N 2.95Å; V282-V303 HydrophobicContact CG2-CB 4.33Å; V282-V303 HydrophobicContact CG2-CG1 3.94Å; V282-V303 HydrophobicContact CG2-CG2 3.97Å; H299-V303 HydrophobicContact CB-CG2 3.85Å; K301-V303 PolarHBondContact O-N 3.26Å; V303-V306 HydrophobicContact CG1-CG2 3.97Å; V303-G318 WeakPolarHBondContact CA-O 3.46Å
304	R	96.5	Very high	95.1	Very high	76 Å²	76	49.4 Å²	49.4	29%	0.287	26%	0.263	S	S	.	.			trans	-107.6	-19.1	-176.8	-71.9	-172.7	-179.5	-165.9	4.4	113.7	T263 G318 I343 I344 N345 D360	T263-R304 WeakPolarHBondContact CG2-O 3.44Å; R304-G318 PolarHBondContact N-O 3.34Å; R304-G318 VanDerWaalsContact N-O 3.08Å; R304-I343 VanDerWaalsContact CZ-CG2 3.44Å; R304-I343 VanDerWaalsContact NH1-CG2 3.26Å; R304-I344 VanDerWaalsContact CB-O 3.28Å; R304-I344 WeakPolarHBondContact CB-O 3.48Å; R304-N345 PolarHBondContact NH1-OD1 2.62Å; R304-D360 IonicContact NH1-OD2 3.68Å; R304-D360 PolarHBondContact NH1-OD2 3.14Å
305	A	96.4	Very high	95.2	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.025	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	135	-178.8	0	0	0	0	0	109.8	S317 G318 I344 I347	A305-S317 CarbonylContact O-C 3.58Å; A305-S317 WeakPolarHBondContact O-CA 3.24Å; A305-G318 PolarHBondContact N-O 3.21Å; A305-G318 PolarHBondContact O-N 3.08Å; A305-I344 HydrophobicContact CB-CG2 4.43Å; A305-I347 HydrophobicContact CB-CB 4.02Å; A305-I347 HydrophobicContact CB-CD1 4.14Å; A305-I347 HydrophobicContact CB-CG1 3.75Å
306	V	96.7	Very high	95.3	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.9	168.7	175.9	0	0	0	0	107.6	T263 R265 I274 V303 F315 V316	T263-V306 WeakPolarHBondContact OG1-CG2 3.47Å; R265-V306 HydrophobicContact CB-CG1 4.49Å; R265-V306 HydrophobicContact CG-CB 4.41Å; R265-V306 HydrophobicContact CG-CG1 4.15Å; R265-V306 WeakPolarHBondContact CG-O 3.45Å; R265-V306 PolarHBondContact NE-O 3.33Å; I274-V306 HydrophobicContact CG2-CG1 3.86Å; V303-V306 HydrophobicContact CG1-CG2 3.97Å; V306-F315 HydrophobicContact CG1-CD2 4.05Å; V306-V316 WeakPolarHBondContact CA-O 3.4Å
307	C	96.2	Very high	95.3	Very high	16 Å²	16	44.8 Å²	44.8	11%	0.108	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	133.4	177.3	-174.2	0	0	0	0	109.7	F315 V316 I347 V349	C307-F315 CarbonylContact O-C 3.56Å; C307-F315 WeakPolarHBondContact O-CA 3.49Å; C307-F315 WeakPolarHBondContact O-CB 3.47Å; C307-V316 PolarHBondContact N-O 3.11Å; C307-V316 PolarHBondContact O-N 2.79Å; C307-I347 HydrophobicContact CB-CG2 4.27Å; C307-I347 WeakPolarHBondContact CB-O 3.34Å; C307-V349 HydrophobicContact CB-CG2 4.21Å
308	I	96	Very high	95.3	Very high	33 Å²	33	40.1 Å²	40.1	17%	0.169	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	140.1	176.5	-59.7	178.4	0	0	0	108.2	R265 Q267 I274 F315	R265-I308 HydrophobicContact CB-CD1 3.68Å; R265-I308 HydrophobicContact CB-CG1 3.84Å; R265-I308 HydrophobicContact CG-CG1 4.49Å; Q267-I308 HydrophobicContact CB-CD1 3.85Å; Q267-I308 HydrophobicContact CG-CD1 4.03Å; I274-I308 HydrophobicContact CD1-CD1 4.16Å; I274-I308 HydrophobicContact CD1-CG1 4.18Å; I308-F315 HydrophobicContact CG1-CB 4.34Å
309	H	95.7	Very high	95.3	Very high	5 Å²	5	36.9 Å²	36.9	2%	0.023	19%	0.185	C	C	.	.			trans	-73.2	133.6	173.9	-171.8	-68.7	0	0	0	109.5	T311 Q312 A314 N353 W369	H309-T311 PolarHBondContact CE1-OG1 3.09Å; H309-T311 PolarHBondContact ND1-N 2.83Å; H309-T311 VanDerWaalsContact ND1-N 3.15Å; H309-T311 PolarHBondContact ND1-OG1 2.87Å; H309-T311 PolarHBondContact O-N 3.03Å; H309-Q312 HydrophobicContact CB-CB 4.4Å; H309-Q312 PolarHBondContact ND1-N 3.21Å; H309-A314 VanDerWaalsContact CB-O 3.28Å; H309-A314 WeakPolarHBondContact CB-O 3.49Å; H309-A314 PolarHBondContact N-O 2.91Å; H309-N353 PolarHBondContact CE1-OD1 3.4Å; H309-N353 PolarHBondContact NE2-OD1 3.34Å; H309-N353 VanDerWaalsContact NE2-OD1 3.13Å; H309-W369 HydrophobicContact CB-CH2 3.94Å; H309-W369 HydrophobicContact CB-CZ2 4.24Å; H309-W369 HydrophobicContact CB-CZ3 4.24Å; H309-W369 AromaticContact CD2-CD2 3.51Å; H309-W369 AromaticContact CD2-CE2 3.58Å; H309-W369 AromaticContact CD2-CE3 3.61Å; H309-W369 AromaticContact CD2-CH2 3.97Å; H309-W369 AromaticContact CD2-CZ2 3.87Å; H309-W369 AromaticContact CD2-CZ3 3.79Å
310	P	93	Very high	95.3	Very high	66 Å²	66	37.6 Å²	37.6	43%	0.429	19%	0.19	S	C	.	.	S	Bend	trans	-67.1	-34.7	-172.2	23.8	-34.7	0	0	0	114.4	Q351	P310-Q351 HydrophobicContact CB-CG 4.11Å; P310-Q351 HydrophobicContact CG-CB 4.38Å; P310-Q351 HydrophobicContact CG-CG 3.93Å
311	T	91.2	Very high	95	Very high	97 Å²	97	30.5 Å²	30.5	60%	0.595	16%	0.161	S	C	*	.	S	Bend	trans	-110.7	-41.1	-175.8	61.9	0	0	0	0	114.5	H309	H309-T311 PolarHBondContact CE1-OG1 3.09Å; H309-T311 PolarHBondContact ND1-N 2.83Å; H309-T311 VanDerWaalsContact ND1-N 3.15Å; H309-T311 PolarHBondContact ND1-OG1 2.87Å; H309-T311 PolarHBondContact O-N 3.03Å
312	Q	91.5	Very high	94.8	Very high	71 Å²	71	27.8 Å²	27.8	33%	0.332	15%	0.152	S	C	.	.	S	Bend	trans	-82	142.5	176.6	-57.1	178.6	31.2	0	0	111.2	H309 A314 N353	H309-Q312 HydrophobicContact CB-CB 4.4Å; H309-Q312 PolarHBondContact ND1-N 3.21Å; Q312-A314 HydrophobicContact CB-CB 4.46Å; Q312-A314 PolarHBondContact O-N 3.13Å; Q312-N353 PolarHBondContact NE2-OD1 2.67Å
313	N	92.7	Very high	94.8	Very high	76 Å²	76	26.9 Å²	26.9	41%	0.406	15%	0.146	S	C	.	.	S	Bend	trans	-76.5	72.2	174.5	-161.7	5.2	0	0	0	111.1	L328	N313-L328 PolarHBondContact O-N 3Å; N313-L328 VanDerWaalsContact O-N 3.08Å; N313-L328 WeakPolarHBondContact OD1-CB 3.38Å; N313-L328 WeakPolarHBondContact OD1-CD1 3.47Å
314	A	95.2	Very high	94.8	Very high	4 Å²	4	28.1 Å²	28.1	3%	0.033	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	161.3	-173.7	0	0	0	0	0	110.3	H309 Q312 W326 W369	H309-A314 VanDerWaalsContact CB-O 3.28Å; H309-A314 WeakPolarHBondContact CB-O 3.49Å; H309-A314 PolarHBondContact N-O 2.91Å; Q312-A314 HydrophobicContact CB-CB 4.46Å; Q312-A314 PolarHBondContact O-N 3.13Å; A314-W326 CarbonylContact C-O 3.55Å; A314-W326 WeakPolarHBondContact CA-O 3.35Å; A314-W326 WeakPolarHBondContact CB-O 3.37Å; A314-W369 HydrophobicContact CB-CH2 3.96Å; A314-W369 HydrophobicContact CB-CZ2 3.52Å
315	F	96.6	Very high	94.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	161.8	175.8	74	-87.8	0	0	0	111	I274 V282 L284 L296 V306 C307 I308 W326 L328	I274-F315 HydrophobicContact CD1-CB 4.22Å; I274-F315 HydrophobicContact CD1-CD1 3.76Å; I274-F315 HydrophobicContact CD1-CE1 4.22Å; I274-F315 HydrophobicContact CD1-CG 3.92Å; I274-F315 HydrophobicContact CG2-CD2 4.35Å; I274-F315 HydrophobicContact CG2-CE2 4.16Å; I274-F315 HydrophobicContact CG2-CZ 4.35Å; V282-F315 HydrophobicContact CG1-CE2 3.97Å; V282-F315 HydrophobicContact CG1-CZ 4.11Å; L284-F315 HydrophobicContact CD2-CE1 4.05Å; L284-F315 HydrophobicContact CD2-CZ 4.24Å; L296-F315 HydrophobicContact CD1-CE1 4.39Å; L296-F315 HydrophobicContact CD1-CZ 3.64Å; V306-F315 HydrophobicContact CG1-CD2 4.05Å; C307-F315 CarbonylContact O-C 3.56Å; C307-F315 WeakPolarHBondContact O-CA 3.49Å; C307-F315 WeakPolarHBondContact O-CB 3.47Å; I308-F315 HydrophobicContact CG1-CB 4.34Å; F315-W326 HydrophobicContact CD1-CB 3.75Å; F315-W326 HydrophobicContact CD1-CG 4.49Å; F315-W326 HydrophobicContact CD2-CB 4.33Å; F315-W326 AromaticContact CD2-CD1 3.79Å; F315-W326 HydrophobicContact CD2-CG 4.33Å; F315-W326 HydrophobicContact CE1-CB 3.33Å; F315-W326 AromaticContact CE1-CG 3.88Å; F315-W326 HydrophobicContact CE1-CG 3.88Å; F315-W326 HydrophobicContact CE2-CB 3.96Å; F315-W326 AromaticContact CE2-CD1 3.25Å; F315-W326 AromaticContact CE2-CG 3.67Å; F315-W326 HydrophobicContact CE2-CG 3.67Å; F315-W326 AromaticContact CE2-NE1 3.87Å; F315-W326 HydrophobicContact CG-CB 4.24Å; F315-W326 HydrophobicContact CZ-CB 3.44Å; F315-W326 VanDerWaalsContact CZ-CB 3.44Å; F315-W326 AromaticContact CZ-CD1 3.53Å; F315-W326 HydrophobicContact CZ-CD2 4.12Å; F315-W326 AromaticContact CZ-CG 3.41Å; F315-W326 HydrophobicContact CZ-CG 3.41Å; F315-W326 VanDerWaalsContact CZ-CG 3.41Å; F315-W326 PolarHBondContact N-O 3.12Å; F315-W326 PolarHBondContact O-N 2.84Å; F315-L328 HydrophobicContact CD1-CD1 4Å; F315-L328 HydrophobicContact CD1-CD2 3.6Å; F315-L328 HydrophobicContact CD1-CG 3.78Å; F315-L328 HydrophobicContact CE1-CD2 3.57Å; F315-L328 HydrophobicContact CE1-CG 4.22Å
316	V	96.5	Very high	94.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.3	174.1	164.2	0	0	0	0	109.9	V306 C307 I323 K324 Q325 I347 W369	V306-V316 WeakPolarHBondContact CA-O 3.4Å; C307-V316 PolarHBondContact N-O 3.11Å; C307-V316 PolarHBondContact O-N 2.79Å; V316-I323 HydrophobicContact CG1-CG2 3.26Å; V316-K324 VanDerWaalsContact CA-O 3.31Å; V316-K324 WeakPolarHBondContact CA-O 3.35Å; V316-Q325 HydrophobicContact CG2-CB 4.47Å; V316-Q325 HydrophobicContact CG2-CG 3.54Å; V316-I347 HydrophobicContact CB-CG2 4.5Å; V316-I347 HydrophobicContact CG1-CD1 3.79Å; V316-I347 HydrophobicContact CG1-CG2 3.81Å; V316-W369 HydrophobicContact CB-CZ3 4.25Å; V316-W369 HydrophobicContact CG2-CE3 4Å; V316-W369 HydrophobicContact CG2-CH2 3.7Å; V316-W369 HydrophobicContact CG2-CZ3 3.16Å
317	S	96.7	Very high	94.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.5	168.5	57.5	0	0	0	0	111.2	H299 A305 I323 K324 W326	H299-S317 PolarHBondContact CE1-OG 3.14Å; H299-S317 PolarHBondContact NE2-OG 3.38Å; A305-S317 CarbonylContact O-C 3.58Å; A305-S317 WeakPolarHBondContact O-CA 3.24Å; S317-I323 CarbonylContact O-C 3.56Å; S317-I323 WeakPolarHBondContact O-CA 3.37Å; S317-K324 PolarHBondContact N-O 2.91Å; S317-K324 PolarHBondContact O-N 3.41Å; S317-W326 PolarHBondContact OG-NE1 3.29Å
318	G	95.5	Very high	94.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.9	-179.8	0	0	0	0	0	111.6	V303 R304 A305	V303-G318 WeakPolarHBondContact CA-O 3.46Å; R304-G318 PolarHBondContact N-O 3.34Å; R304-G318 VanDerWaalsContact N-O 3.08Å; A305-G318 PolarHBondContact N-O 3.21Å; A305-G318 PolarHBondContact O-N 3.08Å
319	S	95.3	Very high	94.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.171	C	C	.	.			trans	-130.2	160.6	168.4	69.9	0	0	0	0	109.4	H299 S302 D321 N322 I344	H299-S319 VanDerWaalsContact ND1-CB 3.27Å; H299-S319 WeakPolarHBondContact ND1-CB 3.39Å; H299-S319 PolarHBondContact ND1-OG 3.03Å; S302-S319 WeakPolarHBondContact O-CA 3.48Å; S302-S319 WeakPolarHBondContact O-CB 3.47Å; S319-D321 PolarHBondContact O-N 3.39Å; S319-D321 PolarHBondContact OG-N 3.32Å; S319-N322 PolarHBondContact N-O 3.44Å; S319-N322 PolarHBondContact O-N 3.49Å; S319-N322 PolarHBondContact OG-N 3.26Å; S319-N322 PolarHBondContact OG-O 2.62Å; S319-I344 VanDerWaalsContact O-CD1 3.3Å; S319-I344 WeakPolarHBondContact O-CD1 3.2Å
320	P	94	Very high	93.9	Very high	24 Å²	24	36.9 Å²	36.9	16%	0.156	20%	0.201	C	C	.	.	S	Bend	trans	-61.4	-13.6	175	-21.6	32	0	0	0	114.8	K301 S302 A342 I343	K301-P320 HydrophobicContact CB-CG 4.47Å; K301-P320 HydrophobicContact CD-CB 4.01Å; K301-P320 HydrophobicContact CD-CG 4.43Å; S302-P320 WeakPolarHBondContact O-CD 3.37Å; P320-A342 WeakPolarHBondContact CA-O 3.18Å; P320-I343 HydrophobicContact CB-CB 4.42Å; P320-I343 HydrophobicContact CB-CG1 4.05Å; P320-I343 HydrophobicContact CG-CB 4.26Å; P320-I343 HydrophobicContact CG-CG1 4.1Å; P320-I343 HydrophobicContact CG-CG2 4.03Å
321	D	90.1	Very high	93.8	Very high	41 Å²	41	34 Å²	34	22%	0.219	18%	0.184	C	C	.	.	S	Bend	trans	-84.6	-59	177	-62.5	-41.8	0	0	0	111.4	K300 K301 S319	K300-D321 VanDerWaalsContact CB-OD2 3.31Å; K300-D321 WeakPolarHBondContact CB-OD2 3.42Å; K301-D321 VanDerWaalsContact CB-OD2 3.22Å; K301-D321 WeakPolarHBondContact CB-OD2 3.05Å; K301-D321 WeakPolarHBondContact CD-OD1 3.42Å; K301-D321 WeakPolarHBondContact CE-OD1 3.18Å; K301-D321 WeakPolarHBondContact CG-OD1 3.22Å; K301-D321 WeakPolarHBondContact CG-OD2 3.44Å; K301-D321 PolarHBondContact N-OD2 2.8Å; K301-D321 IonicContact NZ-OD1 2.71Å; K301-D321 PolarHBondContact NZ-OD1 3.34Å; S319-D321 PolarHBondContact O-N 3.39Å; S319-D321 PolarHBondContact OG-N 3.32Å
322	N	92.6	Very high	93.9	Very high	52 Å²	52	33.3 Å²	33.3	28%	0.278	18%	0.179	S	C	.	.			trans	-154.5	152.6	-175.8	-85.1	-30.6	0	0	0	109	H299 S319	H299-N322 PolarHBondContact CE1-O 2.9Å; S319-N322 PolarHBondContact N-O 3.44Å; S319-N322 PolarHBondContact O-N 3.49Å; S319-N322 PolarHBondContact OG-N 3.26Å; S319-N322 PolarHBondContact OG-O 2.62Å
323	I	95.9	Very high	94	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.6	166	-54.5	166.7	0	0	0	107.4	V316 S317 N336 L337 I344 I347	V316-I323 HydrophobicContact CG1-CG2 3.26Å; S317-I323 CarbonylContact O-C 3.56Å; S317-I323 WeakPolarHBondContact O-CA 3.37Å; I323-N336 WeakPolarHBondContact O-CA 3.43Å; I323-L337 HydrophobicContact CB-CB 4.01Å; I323-L337 HydrophobicContact CB-CD1 4.35Å; I323-L337 HydrophobicContact CB-CG 4.41Å; I323-L337 HydrophobicContact CG2-CB 4.4Å; I323-L337 HydrophobicContact CG2-CD1 3.84Å; I323-L337 HydrophobicContact CG2-CG 4.29Å; I323-L337 PolarHBondContact N-O 2.79Å; I323-L337 PolarHBondContact O-N 3.25Å; I323-I344 HydrophobicContact CD1-CD1 3.66Å; I323-I344 HydrophobicContact CG1-CD1 3.19Å; I323-I347 HydrophobicContact CB-CD1 4.47Å; I323-I347 HydrophobicContact CD1-CD1 4.26Å; I323-I347 HydrophobicContact CG1-CD1 4.02Å; I323-I347 HydrophobicContact CG2-CD1 3.73Å
324	K	95.7	Very high	94	Very high	25 Å²	25	33.9 Å²	33.9	11%	0.109	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.2	-177.5	-62.5	-166.3	176.3	-152.6	0	110.8	N298 V316 S317 W326 F333 N336	N298-K324 HydrophobicContact CB-CD 3.96Å; N298-K324 WeakPolarHBondContact O-CE 3.48Å; N298-K324 PolarHBondContact O-NZ 3.17Å; V316-K324 VanDerWaalsContact CA-O 3.31Å; V316-K324 WeakPolarHBondContact CA-O 3.35Å; S317-K324 PolarHBondContact N-O 2.91Å; S317-K324 PolarHBondContact O-N 3.41Å; K324-W326 HydrophobicContact CB-CZ2 4.19Å; K324-W326 HydrophobicContact CD-CZ2 4.12Å; K324-F333 HydrophobicContact CB-CE2 4.2Å; K324-F333 HydrophobicContact CD-CD2 4.36Å; K324-F333 HydrophobicContact CD-CE2 4Å; K324-F333 HydrophobicContact CG-CE2 4.16Å; K324-N336 WeakPolarHBondContact CE-OD1 3.39Å; K324-N336 WeakPolarHBondContact CG-OD1 2.99Å
325	Q	95.8	Very high	93.8	Very high	3 Å²	3	35.9 Å²	35.9	1%	0.014	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	141.1	171.7	-74.6	179.9	1	0	0	110.5	V316 L334 Q335 W369	V316-Q325 HydrophobicContact CG2-CB 4.47Å; V316-Q325 HydrophobicContact CG2-CG 3.54Å; Q325-L334 HydrophobicContact CB-CB 4.06Å; Q325-L334 HydrophobicContact CB-CD1 4.42Å; Q325-L334 PolarHBondContact O-N 2.95Å; Q325-Q335 HydrophobicContact CB-CG 4.14Å; Q325-Q335 HydrophobicContact CG-CG 4.35Å; Q325-Q335 PolarHBondContact N-O 2.96Å; Q325-W369 HydrophobicContact CG-CH2 4.22Å; Q325-W369 HydrophobicContact CG-CZ2 4.47Å; Q325-W369 HydrophobicContact CG-CZ3 4.31Å; Q325-W369 PolarHBondContact NE2-O 2.9Å; Q325-W369 PolarHBondContact OE1-O 3.49Å
326	W	96	Very high	93.6	Very high	2 Å²	2	39 Å²	39	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.3	-175.8	-54.5	90.7	0	0	0	110.3	L296 N298 A314 F315 S317 K324 G331 V332 F333	L296-W326 HydrophobicContact CB-CH2 3.63Å; L296-W326 HydrophobicContact CB-CZ2 4.23Å; L296-W326 HydrophobicContact CB-CZ3 3.92Å; L296-W326 HydrophobicContact CD1-CD2 3.99Å; L296-W326 HydrophobicContact CD1-CE3 3.81Å; L296-W326 HydrophobicContact CD1-CH2 4.15Å; L296-W326 HydrophobicContact CD1-CZ2 4.42Å; L296-W326 HydrophobicContact CD1-CZ3 3.89Å; L296-W326 HydrophobicContact CD2-CE3 4.27Å; L296-W326 HydrophobicContact CD2-CH2 4.43Å; L296-W326 HydrophobicContact CD2-CZ3 3.83Å; L296-W326 HydrophobicContact CG-CE3 4.47Å; L296-W326 HydrophobicContact CG-CH2 4.28Å; L296-W326 HydrophobicContact CG-CZ3 4.09Å; N298-W326 HydrophobicContact CB-CH2 3.51Å; N298-W326 HydrophobicContact CB-CZ2 4.03Å; N298-W326 HydrophobicContact CB-CZ3 4.46Å; N298-W326 WeakPolarHBondContact ND2-CH2 3.34Å; N298-W326 WeakPolarHBondContact ND2-CZ3 3.4Å; A314-W326 CarbonylContact C-O 3.55Å; A314-W326 WeakPolarHBondContact CA-O 3.35Å; A314-W326 WeakPolarHBondContact CB-O 3.37Å; F315-W326 HydrophobicContact CD1-CB 3.75Å; F315-W326 HydrophobicContact CD1-CG 4.49Å; F315-W326 HydrophobicContact CD2-CB 4.33Å; F315-W326 AromaticContact CD2-CD1 3.79Å; F315-W326 HydrophobicContact CD2-CG 4.33Å; F315-W326 HydrophobicContact CE1-CB 3.33Å; F315-W326 AromaticContact CE1-CG 3.88Å; F315-W326 HydrophobicContact CE1-CG 3.88Å; F315-W326 HydrophobicContact CE2-CB 3.96Å; F315-W326 AromaticContact CE2-CD1 3.25Å; F315-W326 AromaticContact CE2-CG 3.67Å; F315-W326 HydrophobicContact CE2-CG 3.67Å; F315-W326 AromaticContact CE2-NE1 3.87Å; F315-W326 HydrophobicContact CG-CB 4.24Å; F315-W326 HydrophobicContact CZ-CB 3.44Å; F315-W326 VanDerWaalsContact CZ-CB 3.44Å; F315-W326 AromaticContact CZ-CD1 3.53Å; F315-W326 HydrophobicContact CZ-CD2 4.12Å; F315-W326 AromaticContact CZ-CG 3.41Å; F315-W326 HydrophobicContact CZ-CG 3.41Å; F315-W326 VanDerWaalsContact CZ-CG 3.41Å; F315-W326 PolarHBondContact N-O 3.12Å; F315-W326 PolarHBondContact O-N 2.84Å; S317-W326 PolarHBondContact OG-NE1 3.29Å; K324-W326 HydrophobicContact CB-CZ2 4.19Å; K324-W326 HydrophobicContact CD-CZ2 4.12Å; W326-G331 VanDerWaalsContact CE3-O 3.3Å; W326-V332 CarbonylContact C-O 3.56Å; W326-V332 WeakPolarHBondContact CA-O 3.32Å; W326-F333 HydrophobicContact CE3-CB 4.12Å; W326-F333 HydrophobicContact CZ3-CB 4.03Å
327	K	94.8	Very high	93.4	Very high	120 Å²	120	39 Å²	39	52%	0.522	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131.4	172.8	-173.4	174.3	-179.5	179.7	0	109.9	G331 V332 L334	K327-G331 CarbonylContact O-C 3.56Å; K327-G331 VanDerWaalsContact O-CA 3.25Å; K327-G331 WeakPolarHBondContact O-CA 3.47Å; K327-G331 PolarHBondContact O-N 3.41Å; K327-G331 VanDerWaalsContact O-N 3.12Å; K327-V332 HydrophobicContact CB-CB 4.36Å; K327-V332 PolarHBondContact N-O 3.05Å; K327-V332 PolarHBondContact O-N 3.47Å; K327-L334 HydrophobicContact CB-CD1 3.96Å; K327-L334 HydrophobicContact CB-CD2 3.93Å; K327-L334 HydrophobicContact CB-CG 3.87Å; K327-L334 HydrophobicContact CD-CD2 4.39Å
328	L	92.3	Very high	92.9	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	156.3	173.7	-64.8	172.3	0	0	0	109.5	P271 I274 L284 N313 F315	P271-L328 HydrophobicContact CG-CD2 3.58Å; I274-L328 HydrophobicContact CD1-CD1 4.19Å; I274-L328 HydrophobicContact CD1-CD2 4.39Å; L284-L328 HydrophobicContact CD1-CD2 4.26Å; L284-L328 HydrophobicContact CD2-CD2 4.26Å; N313-L328 PolarHBondContact O-N 3Å; N313-L328 VanDerWaalsContact O-N 3.08Å; N313-L328 WeakPolarHBondContact OD1-CB 3.38Å; N313-L328 WeakPolarHBondContact OD1-CD1 3.47Å; F315-L328 HydrophobicContact CD1-CD1 4Å; F315-L328 HydrophobicContact CD1-CD2 3.6Å; F315-L328 HydrophobicContact CD1-CG 3.78Å; F315-L328 HydrophobicContact CE1-CD2 3.57Å; F315-L328 HydrophobicContact CE1-CG 4.22Å
329	P	91.2	Very high	92.4	Very high	69 Å²	69	44.3 Å²	44.3	45%	0.448	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86.2	-27.6	11.1	31.1	-34.7	0	0	0	115.5	P271 G331	P271-P329 WeakPolarHBondContact CD-O 3.35Å; P329-G331 VanDerWaalsContact C-N 3.26Å; P329-G331 PolarHBondContact O-N 2.8Å
330	N	89.2	Confident	92.3	Very high	119 Å²	119	44.7 Å²	44.7	64%	0.636	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-3	-170.4	-63.9	-8.6	0	0	0	114.4	V332	N330-V332 HydrophobicContact CB-CG2 4.28Å
331	G	90.5	Very high	92.1	Very high	7 Å²	7	50.6 Å²	50.6	7%	0.072	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	43.1	-174.4	0	0	0	0	0	112.8	L296 W326 K327 P329 F333	L296-G331 VanDerWaalsContact CD2-O 3.31Å; L296-G331 WeakPolarHBondContact CD2-O 3.26Å; W326-G331 VanDerWaalsContact CE3-O 3.3Å; K327-G331 CarbonylContact O-C 3.56Å; K327-G331 VanDerWaalsContact O-CA 3.25Å; K327-G331 WeakPolarHBondContact O-CA 3.47Å; K327-G331 PolarHBondContact O-N 3.41Å; K327-G331 VanDerWaalsContact O-N 3.12Å; P329-G331 VanDerWaalsContact C-N 3.26Å; P329-G331 PolarHBondContact O-N 2.8Å; G331-F333 PolarHBondContact O-N 3.48Å
332	V	93.9	Very high	92.3	Very high	82 Å²	82	49.3 Å²	49.3	50%	0.497	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.1	177.4	177.1	0	0	0	0	109.4	W326 K327 N330 L334	W326-V332 CarbonylContact C-O 3.56Å; W326-V332 WeakPolarHBondContact CA-O 3.32Å; K327-V332 HydrophobicContact CB-CB 4.36Å; K327-V332 PolarHBondContact N-O 3.05Å; K327-V332 PolarHBondContact O-N 3.47Å; N330-V332 HydrophobicContact CB-CG2 4.28Å; V332-L334 PolarHBondContact O-N 3.19Å
333	F	94.4	Very high	92.5	Very high	79 Å²	79	50 Å²	50	35%	0.346	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	127.2	175.6	173.9	-104.7	0	0	0	111.2	K324 W326 G331 Q335 N336	K324-F333 HydrophobicContact CB-CE2 4.2Å; K324-F333 HydrophobicContact CD-CD2 4.36Å; K324-F333 HydrophobicContact CD-CE2 4Å; K324-F333 HydrophobicContact CG-CE2 4.16Å; W326-F333 HydrophobicContact CE3-CB 4.12Å; W326-F333 HydrophobicContact CZ3-CB 4.03Å; G331-F333 PolarHBondContact O-N 3.48Å; F333-Q335 WeakPolarHBondContact CE2-O 3.19Å; F333-Q335 VanDerWaalsContact CZ-C 3.49Å; F333-N336 VanDerWaalsContact CE2-OD1 3.23Å; F333-N336 WeakPolarHBondContact CE2-OD1 3.24Å; F333-N336 WeakPolarHBondContact CZ-OD1 3.12Å
334	L	92.1	Very high	92.5	Very high	80 Å²	80	50 Å²	50	42%	0.419	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-66.9	178.4	-70.9	174.1	0	0	0	111.4	Q325 K327 V332	Q325-L334 HydrophobicContact CB-CB 4.06Å; Q325-L334 HydrophobicContact CB-CD1 4.42Å; Q325-L334 PolarHBondContact O-N 2.95Å; K327-L334 HydrophobicContact CB-CD1 3.96Å; K327-L334 HydrophobicContact CB-CD2 3.93Å; K327-L334 HydrophobicContact CB-CG 3.87Å; K327-L334 HydrophobicContact CD-CD2 4.39Å; V332-L334 PolarHBondContact O-N 3.19Å
335	Q	91.6	Very high	92.5	Very high	45 Å²	45	49.9 Å²	49.9	21%	0.21	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	165.5	-175.5	61.3	-179.4	-9	0	0	112.4	Q325 F333 W369 K370	Q325-Q335 HydrophobicContact CB-CG 4.14Å; Q325-Q335 HydrophobicContact CG-CG 4.35Å; Q325-Q335 PolarHBondContact N-O 2.96Å; F333-Q335 WeakPolarHBondContact CE2-O 3.19Å; F333-Q335 VanDerWaalsContact CZ-C 3.49Å; Q335-W369 PolarHBondContact NE2-O 3.16Å; Q335-K370 PolarHBondContact NE2-O 3.49Å; Q335-K370 VanDerWaalsContact NE2-O 3.12Å
336	N	92.5	Very high	92.5	Very high	66 Å²	66	50.1 Å²	50.1	35%	0.353	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	137.4	171.5	-64.6	-43.9	0	0	0	109.5	I323 K324 F333	I323-N336 WeakPolarHBondContact O-CA 3.43Å; K324-N336 WeakPolarHBondContact CE-OD1 3.39Å; K324-N336 WeakPolarHBondContact CG-OD1 2.99Å; F333-N336 VanDerWaalsContact CE2-OD1 3.23Å; F333-N336 WeakPolarHBondContact CE2-OD1 3.24Å; F333-N336 WeakPolarHBondContact CZ-OD1 3.12Å
337	L	91.4	Very high	92.5	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	98.7	163.8	-42.5	175.2	0	0	0	107.5	I323 W367	I323-L337 HydrophobicContact CB-CB 4.01Å; I323-L337 HydrophobicContact CB-CD1 4.35Å; I323-L337 HydrophobicContact CB-CG 4.41Å; I323-L337 HydrophobicContact CG2-CB 4.4Å; I323-L337 HydrophobicContact CG2-CD1 3.84Å; I323-L337 HydrophobicContact CG2-CG 4.29Å; I323-L337 PolarHBondContact N-O 2.79Å; I323-L337 PolarHBondContact O-N 3.25Å; L337-W367 HydrophobicContact CB-CD2 4.1Å; L337-W367 HydrophobicContact CB-CE3 3.81Å; L337-W367 HydrophobicContact CB-CZ3 4.08Å; L337-W367 HydrophobicContact CD1-CB 4.19Å; L337-W367 HydrophobicContact CD1-CD2 4.44Å; L337-W367 HydrophobicContact CD1-CG 4.17Å
338	S	85.9	Confident	92.6	Very high	81 Å²	81	45.4 Å²	45.4	57%	0.566	26%	0.262	S	S	*	.			trans	-100.1	142.5	-176.4	58.5	0	0	0	0	111.5	W367	S338-W367 WeakPolarHBondContact O-CH2 3.31Å; S338-W367 WeakPolarHBondContact O-CZ3 3.16Å
339	G	86.1	Confident	92.8	Very high	30 Å²	30	45.8 Å²	45.8	31%	0.309	26%	0.264	S	S	.	.			trans	130.6	-11.9	175	0	0	0	0	0	114.1	N341	G339-N341 PolarHBondContact O-N 3.08Å
340	H	91.8	Very high	92.9	Very high	7 Å²	7	42.7 Å²	42.7	3%	0.032	24%	0.243	C	C	.	.			trans	-84.8	88.3	172.8	-155.6	171.6	0	0	0	110.6	A342 I344 S357 S363 H365 W367	H340-A342 PolarHBondContact O-N 2.8Å; H340-I344 HydrophobicContact CB-CD1 4.4Å; H340-S357 PolarHBondContact CE1-O 2.87Å; H340-S357 PolarHBondContact CE1-OG 3.41Å; H340-S357 WeakPolarHBondContact ND1-CB 3.45Å; H340-S357 PolarHBondContact ND1-OG 3.47Å; H340-S363 PolarHBondContact NE2-OG 3.37Å; H340-H365 AromaticContact CD2-CD2 3.88Å; H340-H365 AromaticContact CD2-NE2 3.94Å; H340-H365 AromaticContact CG-CD2 3.94Å; H340-W367 HydrophobicContact CB-CZ2 3.96Å
341	N	91.2	Very high	93.1	Very high	149 Å²	149	41.2 Å²	41.2	80%	0.797	23%	0.233	S	C	*	.			trans	-82.5	62.6	177.8	-68	-17.7	0	0	0	111.3	G339	G339-N341 PolarHBondContact O-N 3.08Å
342	A	93.8	Very high	93.1	Very high	13 Å²	13	44.8 Å²	44.8	11%	0.107	25%	0.25	C	S	.	.	S	Bend	trans	-149.1	163	177.5	0	0	0	0	0	111	P320 H340 I344 N361	P320-A342 WeakPolarHBondContact CA-O 3.18Å; H340-A342 PolarHBondContact O-N 2.8Å; A342-I344 PolarHBondContact O-N 2.99Å; A342-N361 WeakPolarHBondContact CB-OD1 3.28Å
343	I	95.6	Very high	93.1	Very high	66 Å²	66	42.1 Å²	42.1	34%	0.338	23%	0.233	S	C	.	.			trans	-72.7	118.2	168.2	-62.7	165.7	0	0	0	107.7	R304 P320 G359 D360	R304-I343 VanDerWaalsContact CZ-CG2 3.44Å; R304-I343 VanDerWaalsContact NH1-CG2 3.26Å; P320-I343 HydrophobicContact CB-CB 4.42Å; P320-I343 HydrophobicContact CB-CG1 4.05Å; P320-I343 HydrophobicContact CG-CB 4.26Å; P320-I343 HydrophobicContact CG-CG1 4.1Å; P320-I343 HydrophobicContact CG-CG2 4.03Å; I343-G359 CarbonylContact O-C 3.51Å; I343-G359 VanDerWaalsContact O-CA 3.27Å; I343-G359 WeakPolarHBondContact O-CA 3.38Å; I343-D360 HydrophobicContact CB-CB 4.07Å; I343-D360 VanDerWaalsContact CB-OD2 3.28Å; I343-D360 WeakPolarHBondContact CB-OD2 3.35Å; I343-D360 WeakPolarHBondContact CG2-OD2 3.47Å; I343-D360 PolarHBondContact O-N 2.79Å
344	I	96.1	Very high	93.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	122.2	-177	-53	179.2	0	0	0	108.4	R304 A305 S319 I323 H340 A342 I347	R304-I344 VanDerWaalsContact CB-O 3.28Å; R304-I344 WeakPolarHBondContact CB-O 3.48Å; A305-I344 HydrophobicContact CB-CG2 4.43Å; S319-I344 VanDerWaalsContact O-CD1 3.3Å; S319-I344 WeakPolarHBondContact O-CD1 3.2Å; I323-I344 HydrophobicContact CD1-CD1 3.66Å; I323-I344 HydrophobicContact CG1-CD1 3.19Å; H340-I344 HydrophobicContact CB-CD1 4.4Å; A342-I344 PolarHBondContact O-N 2.99Å; I344-I347 HydrophobicContact CG2-CD1 3.96Å; I344-I347 HydrophobicContact CG2-CG1 3.64Å
345	N	95.6	Very high	93.3	Very high	23 Å²	23	34.6 Å²	34.6	12%	0.123	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-35.6	175.7	-65.1	-42.2	0	0	0	112.7	R304 G358 D360 V393 F394	R304-N345 PolarHBondContact NH1-OD1 2.62Å; N345-G358 PolarHBondContact N-O 2.68Å; N345-D360 VanDerWaalsContact ND2-CG 3.29Å; N345-D360 PolarHBondContact ND2-OD1 2.92Å; N345-D360 PolarHBondContact OD1-OD1 2.66Å; N345-V393 WeakPolarHBondContact CB-O 3.23Å; N345-V393 PolarHBondContact ND2-O 2.86Å; N345-F394 WeakPolarHBondContact ND2-CD1 3.35Å
346	A	95.7	Very high	93.6	Very high	9 Å²	9	32.4 Å²	32.4	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.2	-173.8	0	0	0	0	0	110.3	G358 L396	A346-G358 PolarHBondContact O-N 3.39Å; A346-L396 HydrophobicContact CB-CB 4.03Å; A346-L396 HydrophobicContact CB-CD1 4.05Å; A346-L396 HydrophobicContact CB-CG 3.98Å
347	I	96.7	Very high	93.8	Very high	10 Å²	10	29.3 Å²	29.3	5%	0.051	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	136.9	168.5	-63.5	-178.6	0	0	0	107.2	A305 C307 V316 I323 I344 V355 V356	A305-I347 HydrophobicContact CB-CB 4.02Å; A305-I347 HydrophobicContact CB-CD1 4.14Å; A305-I347 HydrophobicContact CB-CG1 3.75Å; C307-I347 HydrophobicContact CB-CG2 4.27Å; C307-I347 WeakPolarHBondContact CB-O 3.34Å; V316-I347 HydrophobicContact CB-CG2 4.5Å; V316-I347 HydrophobicContact CG1-CD1 3.79Å; V316-I347 HydrophobicContact CG1-CG2 3.81Å; I323-I347 HydrophobicContact CB-CD1 4.47Å; I323-I347 HydrophobicContact CD1-CD1 4.26Å; I323-I347 HydrophobicContact CG1-CD1 4.02Å; I323-I347 HydrophobicContact CG2-CD1 3.73Å; I344-I347 HydrophobicContact CG2-CD1 3.96Å; I344-I347 HydrophobicContact CG2-CG1 3.64Å; I347-V355 HydrophobicContact CG2-CG1 3.69Å; I347-V356 VanDerWaalsContact CA-O 3.27Å; I347-V356 WeakPolarHBondContact CA-O 3.4Å
348	T	96.6	Very high	94	Very high	13 Å²	13	29.2 Å²	29.2	8%	0.08	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	152.5	172.7	-175.1	0	0	0	0	109.7	V355 V356 L396 F398 L405	T348-V355 WeakPolarHBondContact O-CA 3.3Å; T348-V356 HydrophobicContact CG2-CB 3.94Å; T348-V356 HydrophobicContact CG2-CG2 4.47Å; T348-V356 PolarHBondContact N-O 2.95Å; T348-V356 PolarHBondContact O-N 3.37Å; T348-L396 HydrophobicContact CG2-CB 3.7Å; T348-F398 HydrophobicContact CG2-CD2 3.68Å; T348-F398 HydrophobicContact CG2-CE2 3.55Å; T348-F398 HydrophobicContact CG2-CZ 4.35Å; T348-F398 VanDerWaalsContact OG1-CD2 3.25Å; T348-F398 WeakPolarHBondContact OG1-CD2 3.37Å; T348-L405 HydrophobicContact CG2-CD1 3.65Å
349	V	96.3	Very high	94.4	Very high	13 Å²	13	25.4 Å²	25.4	8%	0.079	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.1	-177.5	-177.2	0	0	0	0	108.8	C307 V354 V355 W369	C307-V349 HydrophobicContact CB-CG2 4.21Å; V349-V354 WeakPolarHBondContact CA-O 3.19Å; V349-V355 HydrophobicContact CG1-CG2 4.37Å; V349-V355 HydrophobicContact CG2-CG1 4.19Å; V349-V355 HydrophobicContact CG2-CG2 4.09Å; V349-W369 HydrophobicContact CG1-CE3 4.21Å; V349-W369 HydrophobicContact CG1-CZ3 4.41Å; V349-W369 HydrophobicContact CG2-CZ3 4.22Å
350	N	94.5	Very high	94.8	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	14%	0.14	C	C	.	.			trans	-88.3	161.6	175.9	-166.3	13.5	0	0	0	111.6	D352 N353 V354 F398 G402	N350-D352 PolarHBondContact ND2-OD2 2.76Å; N350-D352 PolarHBondContact O-N 2.65Å; N350-N353 PolarHBondContact O-N 3.43Å; N350-N353 VanDerWaalsContact O-N 3.13Å; N350-V354 HydrophobicContact CB-CB 4.2Å; N350-V354 PolarHBondContact N-O 3.36Å; N350-F398 HydrophobicContact CB-CD1 4.39Å; N350-F398 HydrophobicContact CB-CD2 3.87Å; N350-F398 HydrophobicContact CB-CE1 4.17Å; N350-F398 HydrophobicContact CB-CE2 3.62Å; N350-F398 HydrophobicContact CB-CG 4.25Å; N350-F398 HydrophobicContact CB-CZ 3.78Å; N350-G402 PolarHBondContact ND2-O 2.96Å; N350-G402 WeakPolarHBondContact OD1-CA 3.47Å
351	Q	92.3	Very high	94.9	Very high	89 Å²	89	29.6 Å²	29.6	42%	0.416	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-30.3	172.2	-61.1	-177.6	20.5	0	0	112.4	P310 N353 R400	P310-Q351 HydrophobicContact CB-CG 4.11Å; P310-Q351 HydrophobicContact CG-CB 4.38Å; P310-Q351 HydrophobicContact CG-CG 3.93Å; Q351-N353 PolarHBondContact O-N 2.76Å; Q351-N353 VanDerWaalsContact O-N 3.12Å; Q351-R400 PolarHBondContact NE2-O 3.05Å
352	D	91.9	Very high	94.9	Very high	82 Å²	82	22.5 Å²	22.5	44%	0.439	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	7.1	176	-56.4	-47.3	0	0	0	113.6	H119 N350 V354	H119-D352 PolarHBondContact CE1-O 3.43Å; N350-D352 PolarHBondContact ND2-OD2 2.76Å; N350-D352 PolarHBondContact O-N 2.65Å; D352-V354 VanDerWaalsContact C-N 3.3Å
353	N	93.6	Very high	95	Very high	26 Å²	26	22.2 Å²	22.2	14%	0.139	12%	0.118	C	C	.	.	S	Bend	trans	64.9	30.5	-177.1	-29.2	-94.6	0	0	0	113.5	H309 Q312 N350 Q351 W369	H309-N353 PolarHBondContact CE1-OD1 3.4Å; H309-N353 PolarHBondContact NE2-OD1 3.34Å; H309-N353 VanDerWaalsContact NE2-OD1 3.13Å; Q312-N353 PolarHBondContact NE2-OD1 2.67Å; N350-N353 PolarHBondContact O-N 3.43Å; N350-N353 VanDerWaalsContact O-N 3.13Å; Q351-N353 PolarHBondContact O-N 2.76Å; Q351-N353 VanDerWaalsContact O-N 3.12Å; N353-W369 HydrophobicContact CB-CB 3.51Å; N353-W369 HydrophobicContact CB-CG 4.12Å; N353-W369 WeakPolarHBondContact O-CB 3.42Å; N353-W369 PolarHBondContact O-N 3.25Å
354	V	95	Very high	95	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.6	167	178	0	0	0	0	108.9	H119 V349 N350 D352 V356 F366 F375	H119-V354 HydrophobicContact CB-CG2 4.29Å; H119-V354 WeakPolarHBondContact ND1-CG2 3.26Å; V349-V354 WeakPolarHBondContact CA-O 3.19Å; N350-V354 HydrophobicContact CB-CB 4.2Å; N350-V354 PolarHBondContact N-O 3.36Å; D352-V354 VanDerWaalsContact C-N 3.3Å; V354-V356 HydrophobicContact CG1-CG2 4.24Å; V354-F366 HydrophobicContact CG1-CD1 4.19Å; V354-F375 HydrophobicContact CG1-CE1 4.04Å; V354-F375 HydrophobicContact CG1-CZ 3.9Å; V354-F375 HydrophobicContact CG2-CE1 4.49Å; V354-F375 HydrophobicContact CG2-CZ 4.39Å
355	V	96.1	Very high	95	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.5	173	-174.2	0	0	0	0	108.8	I347 T348 V349 F366 W367 W369	I347-V355 HydrophobicContact CG2-CG1 3.69Å; T348-V355 WeakPolarHBondContact O-CA 3.3Å; V349-V355 HydrophobicContact CG1-CG2 4.37Å; V349-V355 HydrophobicContact CG2-CG1 4.19Å; V349-V355 HydrophobicContact CG2-CG2 4.09Å; V355-F366 CarbonylContact O-C 3.5Å; V355-F366 WeakPolarHBondContact O-CA 3.2Å; V355-W367 HydrophobicContact CB-CB 4.16Å; V355-W367 PolarHBondContact N-O 3.35Å; V355-W367 PolarHBondContact O-N 2.86Å; V355-W369 HydrophobicContact CG2-CB 4.25Å; V355-W369 HydrophobicContact CG2-CD2 4.47Å; V355-W369 HydrophobicContact CG2-CE3 3.53Å; V355-W369 HydrophobicContact CG2-CZ3 4.31Å
356	V	96.6	Very high	95	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.6	175.5	-170.6	0	0	0	0	109.1	I347 T348 V354 V364 H365 F366 L396 F398 L405	I347-V356 VanDerWaalsContact CA-O 3.27Å; I347-V356 WeakPolarHBondContact CA-O 3.4Å; T348-V356 HydrophobicContact CG2-CB 3.94Å; T348-V356 HydrophobicContact CG2-CG2 4.47Å; T348-V356 PolarHBondContact N-O 2.95Å; T348-V356 PolarHBondContact O-N 3.37Å; V354-V356 HydrophobicContact CG1-CG2 4.24Å; V356-V364 HydrophobicContact CG1-CG1 3.5Å; V356-V364 VanDerWaalsContact CG1-CG1 3.5Å; V356-H365 WeakPolarHBondContact CA-O 3.45Å; V356-F366 HydrophobicContact CB-CD1 4.41Å; V356-F366 HydrophobicContact CB-CE1 4.4Å; V356-F366 HydrophobicContact CG1-CD1 4.23Å; V356-F366 HydrophobicContact CG1-CE1 3.94Å; V356-F366 HydrophobicContact CG1-CZ 4.12Å; V356-F366 HydrophobicContact CG2-CD1 3.45Å; V356-F366 VanDerWaalsContact CG2-CD1 3.45Å; V356-F366 HydrophobicContact CG2-CE1 3.53Å; V356-F366 HydrophobicContact CG2-CG 4.35Å; V356-F366 HydrophobicContact CG2-CZ 4.49Å; V356-L396 HydrophobicContact CB-CD1 4.49Å; V356-L396 HydrophobicContact CG1-CD1 3.97Å; V356-F398 HydrophobicContact CG2-CE1 4.44Å; V356-F398 HydrophobicContact CG2-CE2 3.95Å; V356-F398 HydrophobicContact CG2-CZ 3.45Å; V356-F398 VanDerWaalsContact CG2-CZ 3.45Å; V356-L405 HydrophobicContact CB-CD2 4.46Å; V356-L405 HydrophobicContact CG1-CD2 3.87Å; V356-L405 HydrophobicContact CG2-CD1 4.45Å; V356-L405 HydrophobicContact CG2-CD2 4.25Å
357	S	96.7	Very high	94.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.2	174.9	59.3	0	0	0	0	111	H340 V364 H365 W367	H340-S357 PolarHBondContact CE1-O 2.87Å; H340-S357 PolarHBondContact CE1-OG 3.41Å; H340-S357 WeakPolarHBondContact ND1-CB 3.45Å; H340-S357 PolarHBondContact ND1-OG 3.47Å; S357-V364 WeakPolarHBondContact O-CA 3.39Å; S357-H365 PolarHBondContact N-O 3.39Å; S357-H365 PolarHBondContact O-N 3.38Å; S357-H365 PolarHBondContact OG-O 2.98Å; S357-W367 PolarHBondContact OG-NE1 3.4Å
358	G	96.2	Very high	94.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.3	178.4	0	0	0	0	0	111.4	N345 A346	N345-G358 PolarHBondContact N-O 2.68Å; A346-G358 PolarHBondContact O-N 3.39Å
359	G	95.1	Very high	94.6	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	153.8	179.1	0	0	0	0	0	114.1	I343 N361 G362 S363 V393	I343-G359 CarbonylContact O-C 3.51Å; I343-G359 VanDerWaalsContact O-CA 3.27Å; I343-G359 WeakPolarHBondContact O-CA 3.38Å; G359-N361 PolarHBondContact O-N 2.93Å; G359-G362 PolarHBondContact O-N 2.95Å; G359-G362 VanDerWaalsContact O-N 3.12Å; G359-S363 PolarHBondContact N-O 2.99Å; G359-V393 PolarHBondContact O-N 3.01Å
360	D	93.9	Very high	94.3	Very high	47 Å²	47	22.2 Å²	22.2	25%	0.251	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.9	171.1	-94	-33.6	0	0	0	112.9	R304 I343 N345 G362 G392	R304-D360 IonicContact NH1-OD2 3.68Å; R304-D360 PolarHBondContact NH1-OD2 3.14Å; I343-D360 HydrophobicContact CB-CB 4.07Å; I343-D360 VanDerWaalsContact CB-OD2 3.28Å; I343-D360 WeakPolarHBondContact CB-OD2 3.35Å; I343-D360 WeakPolarHBondContact CG2-OD2 3.47Å; I343-D360 PolarHBondContact O-N 2.79Å; N345-D360 VanDerWaalsContact ND2-CG 3.29Å; N345-D360 PolarHBondContact ND2-OD1 2.92Å; N345-D360 PolarHBondContact OD1-OD1 2.66Å; D360-G362 VanDerWaalsContact C-N 3.31Å; D360-G392 WeakPolarHBondContact O-CA 3.5Å
361	N	93	Very high	94	Very high	78 Å²	78	22 Å²	22	42%	0.417	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	7.8	179	66.4	-13.4	0	0	0	113.8	A342 G359 S363 Q379	A342-N361 WeakPolarHBondContact CB-OD1 3.28Å; G359-N361 PolarHBondContact O-N 2.93Å; N361-S363 VanDerWaalsContact C-N 3.27Å; N361-S363 PolarHBondContact ND2-OG 3.24Å; N361-S363 PolarHBondContact O-N 2.87Å; N361-S363 VanDerWaalsContact OD1-CB 3.3Å; N361-S363 WeakPolarHBondContact OD1-CB 3.41Å; N361-S363 PolarHBondContact OD1-N 3.12Å; N361-S363 PolarHBondContact OD1-OG 2.57Å; N361-Q379 PolarHBondContact O-NE2 2.9Å
362	G	92.4	Very high	93.9	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	77.6	6.3	-176.2	0	0	0	0	0	116	G359 D360 A380 A391	G359-G362 PolarHBondContact O-N 2.95Å; G359-G362 VanDerWaalsContact O-N 3.12Å; D360-G362 VanDerWaalsContact C-N 3.31Å; G362-A380 PolarHBondContact O-N 3.42Å; G362-A391 WeakPolarHBondContact CA-O 3.46Å; G362-A391 PolarHBondContact N-O 3.39Å
363	S	94.8	Very high	93.8	Very high	8 Å²	8	17 Å²	17	6%	0.056	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.2	170.7	65.4	0	0	0	0	110.7	H340 G359 N361	H340-S363 PolarHBondContact NE2-OG 3.37Å; G359-S363 PolarHBondContact N-O 2.99Å; N361-S363 VanDerWaalsContact C-N 3.27Å; N361-S363 PolarHBondContact ND2-OG 3.24Å; N361-S363 PolarHBondContact O-N 2.87Å; N361-S363 VanDerWaalsContact OD1-CB 3.3Å; N361-S363 WeakPolarHBondContact OD1-CB 3.41Å; N361-S363 PolarHBondContact OD1-N 3.12Å; N361-S363 PolarHBondContact OD1-OG 2.57Å
364	V	95.7	Very high	93.7	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.012	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.6	171.9	-178	0	0	0	0	107.6	V356 S357 F366 L378 V393	V356-V364 HydrophobicContact CG1-CG1 3.5Å; V356-V364 VanDerWaalsContact CG1-CG1 3.5Å; S357-V364 WeakPolarHBondContact O-CA 3.39Å; V364-F366 HydrophobicContact CB-CE2 4.48Å; V364-F366 HydrophobicContact CG1-CD2 4.39Å; V364-F366 HydrophobicContact CG1-CE2 3.65Å; V364-F366 HydrophobicContact CG1-CZ 3.93Å; V364-L378 HydrophobicContact CB-CB 4.3Å; V364-L378 PolarHBondContact N-O 3Å; V364-L378 PolarHBondContact O-N 3.19Å; V364-L378 VanDerWaalsContact O-O 3.12Å; V364-V393 HydrophobicContact CG2-CG2 3.8Å
365	H	95.8	Very high	93.6	Very high	16 Å²	16	18.6 Å²	18.6	7%	0.074	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.2	-179.5	-72.1	24.5	0	0	0	109.7	H340 V356 S357 W367 N374	H340-H365 AromaticContact CD2-CD2 3.88Å; H340-H365 AromaticContact CD2-NE2 3.94Å; H340-H365 AromaticContact CG-CD2 3.94Å; V356-H365 WeakPolarHBondContact CA-O 3.45Å; S357-H365 PolarHBondContact N-O 3.39Å; S357-H365 PolarHBondContact O-N 3.38Å; S357-H365 PolarHBondContact OG-O 2.98Å; H365-W367 HydrophobicContact CB-CZ2 3.83Å; H365-W367 AromaticContact CD2-CZ2 3.83Å; H365-N374 PolarHBondContact CD2-ND2 2.9Å
366	F	95.5	Very high	93.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.3	177	-60.1	-104.3	0	0	0	109.2	W122 V354 V355 V356 V364 N374 F375 Q376 L378 L405	W122-F366 HydrophobicContact CB-CD1 4.41Å; W122-F366 HydrophobicContact CB-CE1 3.7Å; W122-F366 HydrophobicContact CB-CE2 4.36Å; W122-F366 HydrophobicContact CB-CZ 3.68Å; W122-F366 AromaticContact CD1-CD1 3.47Å; W122-F366 VanDerWaalsContact CD1-CD1 3.47Å; W122-F366 AromaticContact CD1-CE1 3.47Å; W122-F366 VanDerWaalsContact CD1-CE1 3.47Å; W122-F366 HydrophobicContact CD2-CD1 4.44Å; W122-F366 AromaticContact CD2-CE1 3.79Å; W122-F366 HydrophobicContact CD2-CE1 3.79Å; W122-F366 AromaticContact CG-CD1 3.84Å; W122-F366 HydrophobicContact CG-CD1 3.84Å; W122-F366 AromaticContact CG-CE1 3.32Å; W122-F366 HydrophobicContact CG-CE1 3.32Å; W122-F366 AromaticContact CG-CZ 3.86Å; W122-F366 HydrophobicContact CG-CZ 3.86Å; W122-F366 AromaticContact NE1-CD1 3.89Å; W122-F366 AromaticContact NE1-CE1 3.99Å; V354-F366 HydrophobicContact CG1-CD1 4.19Å; V355-F366 CarbonylContact O-C 3.5Å; V355-F366 WeakPolarHBondContact O-CA 3.2Å; V356-F366 HydrophobicContact CB-CD1 4.41Å; V356-F366 HydrophobicContact CB-CE1 4.4Å; V356-F366 HydrophobicContact CG1-CD1 4.23Å; V356-F366 HydrophobicContact CG1-CE1 3.94Å; V356-F366 HydrophobicContact CG1-CZ 4.12Å; V356-F366 HydrophobicContact CG2-CD1 3.45Å; V356-F366 VanDerWaalsContact CG2-CD1 3.45Å; V356-F366 HydrophobicContact CG2-CE1 3.53Å; V356-F366 HydrophobicContact CG2-CG 4.35Å; V356-F366 HydrophobicContact CG2-CZ 4.49Å; V364-F366 HydrophobicContact CB-CE2 4.48Å; V364-F366 HydrophobicContact CG1-CD2 4.39Å; V364-F366 HydrophobicContact CG1-CE2 3.65Å; V364-F366 HydrophobicContact CG1-CZ 3.93Å; F366-N374 VanDerWaalsContact O-CA 3.32Å; F366-N374 WeakPolarHBondContact O-CA 3.29Å; F366-N374 PolarHBondContact O-OD1 2.94Å; F366-F375 HydrophobicContact CB-CD1 4.28Å; F366-F375 HydrophobicContact CB-CD2 4.5Å; F366-F375 HydrophobicContact CB-CE1 3.67Å; F366-F375 HydrophobicContact CB-CE2 3.92Å; F366-F375 HydrophobicContact CB-CZ 3.47Å; F366-F375 VanDerWaalsContact CB-CZ 3.47Å; F366-F375 HydrophobicContact CD1-CZ 4.41Å; F366-F375 HydrophobicContact CG-CZ 4.28Å; F366-F375 PolarHBondContact O-N 3.48Å; F366-F375 VanDerWaalsContact O-N 3.16Å; F366-Q376 HydrophobicContact CB-CB 4.03Å; F366-Q376 HydrophobicContact CD2-CB 3.93Å; F366-Q376 HydrophobicContact CD2-CG 4.14Å; F366-Q376 HydrophobicContact CG-CB 4.23Å; F366-Q376 PolarHBondContact N-O 3.5Å; F366-L378 HydrophobicContact CE2-CB 4.45Å; F366-L378 HydrophobicContact CE2-CD1 3.59Å; F366-L378 HydrophobicContact CE2-CG 3.99Å; F366-L378 HydrophobicContact CZ-CD1 4.06Å; F366-L405 HydrophobicContact CE1-CD2 3.91Å; F366-L405 HydrophobicContact CZ-CD2 3.93Å
367	W	94.6	Very high	93.2	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.008	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141.2	-175	-46.7	79.3	0	0	0	109.8	L337 S338 H340 V355 S357 H365 Y373 N374	L337-W367 HydrophobicContact CB-CD2 4.1Å; L337-W367 HydrophobicContact CB-CE3 3.81Å; L337-W367 HydrophobicContact CB-CZ3 4.08Å; L337-W367 HydrophobicContact CD1-CB 4.19Å; L337-W367 HydrophobicContact CD1-CD2 4.44Å; L337-W367 HydrophobicContact CD1-CG 4.17Å; S338-W367 WeakPolarHBondContact O-CH2 3.31Å; S338-W367 WeakPolarHBondContact O-CZ3 3.16Å; H340-W367 HydrophobicContact CB-CZ2 3.96Å; V355-W367 HydrophobicContact CB-CB 4.16Å; V355-W367 PolarHBondContact N-O 3.35Å; V355-W367 PolarHBondContact O-N 2.86Å; S357-W367 PolarHBondContact OG-NE1 3.4Å; H365-W367 HydrophobicContact CB-CZ2 3.83Å; H365-W367 AromaticContact CD2-CZ2 3.83Å; W367-Y373 CarbonylContact C-O 3.58Å; W367-Y373 VanDerWaalsContact CA-O 3.31Å; W367-Y373 WeakPolarHBondContact CA-O 3.44Å; W367-N374 HydrophobicContact CD2-CB 4.14Å; W367-N374 HydrophobicContact CE3-CB 3.64Å; W367-N374 HydrophobicContact CH2-CB 3.91Å; W367-N374 HydrophobicContact CZ2-CB 4.35Å; W367-N374 HydrophobicContact CZ3-CB 3.56Å
368	D	93.7	Very high	93.1	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.8	163.5	173.3	33.7	0	0	0	109.2	T117 H119 K370 S371 G372 Y373	T117-D368 PolarHBondContact N-OD2 2.86Å; T117-D368 PolarHBondContact OG1-OD1 2.89Å; H119-D368 IonicContact CD2-OD1 2.67Å; H119-D368 IonicContact NE2-OD1 3.94Å; H119-D368 PolarHBondContact NE2-OD1 3.16Å; H119-D368 VanDerWaalsContact NE2-OD1 3.11Å; D368-K370 VanDerWaalsContact C-N 3.32Å; D368-K370 PolarHBondContact O-N 2.89Å; D368-K370 PolarHBondContact OD1-N 3.2Å; D368-S371 WeakPolarHBondContact CB-OG 3.32Å; D368-S371 WeakPolarHBondContact OD2-CB 3.41Å; D368-S371 PolarHBondContact OD2-N 3.19Å; D368-S371 PolarHBondContact OD2-OG 2.78Å; D368-G372 WeakPolarHBondContact O-CA 3.19Å; D368-G372 PolarHBondContact O-N 2.83Å; D368-Y373 PolarHBondContact N-O 3.4Å
369	W	93.1	Very high	92.9	Very high	6 Å²	6	35.7 Å²	35.7	2%	0.023	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-41.5	-178.5	174.8	-93.7	0	0	0	113	H309 A314 V316 Q325 Q335 V349 N353 V355	H309-W369 HydrophobicContact CB-CH2 3.94Å; H309-W369 HydrophobicContact CB-CZ2 4.24Å; H309-W369 HydrophobicContact CB-CZ3 4.24Å; H309-W369 AromaticContact CD2-CD2 3.51Å; H309-W369 AromaticContact CD2-CE2 3.58Å; H309-W369 AromaticContact CD2-CE3 3.61Å; H309-W369 AromaticContact CD2-CH2 3.97Å; H309-W369 AromaticContact CD2-CZ2 3.87Å; H309-W369 AromaticContact CD2-CZ3 3.79Å; A314-W369 HydrophobicContact CB-CH2 3.96Å; A314-W369 HydrophobicContact CB-CZ2 3.52Å; V316-W369 HydrophobicContact CB-CZ3 4.25Å; V316-W369 HydrophobicContact CG2-CE3 4Å; V316-W369 HydrophobicContact CG2-CH2 3.7Å; V316-W369 HydrophobicContact CG2-CZ3 3.16Å; Q325-W369 HydrophobicContact CG-CH2 4.22Å; Q325-W369 HydrophobicContact CG-CZ2 4.47Å; Q325-W369 HydrophobicContact CG-CZ3 4.31Å; Q325-W369 PolarHBondContact NE2-O 2.9Å; Q325-W369 PolarHBondContact OE1-O 3.49Å; Q335-W369 PolarHBondContact NE2-O 3.16Å; V349-W369 HydrophobicContact CG1-CE3 4.21Å; V349-W369 HydrophobicContact CG1-CZ3 4.41Å; V349-W369 HydrophobicContact CG2-CZ3 4.22Å; N353-W369 HydrophobicContact CB-CB 3.51Å; N353-W369 HydrophobicContact CB-CG 4.12Å; N353-W369 WeakPolarHBondContact O-CB 3.42Å; N353-W369 PolarHBondContact O-N 3.25Å; V355-W369 HydrophobicContact CG2-CB 4.25Å; V355-W369 HydrophobicContact CG2-CD2 4.47Å; V355-W369 HydrophobicContact CG2-CE3 3.53Å; V355-W369 HydrophobicContact CG2-CZ3 4.31Å
370	K	90.5	Very high	92.4	Very high	106 Å²	106	36.1 Å²	36.1	46%	0.461	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-52.9	-172	-69.8	179	-178.6	171.2	0	111.4	Q335 D368	Q335-K370 PolarHBondContact NE2-O 3.49Å; Q335-K370 VanDerWaalsContact NE2-O 3.12Å; D368-K370 VanDerWaalsContact C-N 3.32Å; D368-K370 PolarHBondContact O-N 2.89Å; D368-K370 PolarHBondContact OD1-N 3.2Å
371	S	88.6	Confident	92.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-20.8	-177.1	62.4	0	0	0	0	114.1	M113 P114 P116 D368 Y373	M113-S371 VanDerWaalsContact CE-O 3.29Å; M113-S371 WeakPolarHBondContact CE-O 3.38Å; P114-S371 WeakPolarHBondContact O-CB 3.29Å; P116-S371 WeakPolarHBondContact CA-OG 3.48Å; P116-S371 WeakPolarHBondContact CB-OG 3.24Å; D368-S371 WeakPolarHBondContact CB-OG 3.32Å; D368-S371 WeakPolarHBondContact OD2-CB 3.41Å; D368-S371 PolarHBondContact OD2-N 3.19Å; D368-S371 PolarHBondContact OD2-OG 2.78Å; S371-Y373 PolarHBondContact O-N 3.16Å; S371-Y373 VanDerWaalsContact OG-CB 3.29Å; S371-Y373 WeakPolarHBondContact OG-CB 3.4Å; S371-Y373 PolarHBondContact OG-N 3.48Å; S371-Y373 VanDerWaalsContact OG-N 3.16Å
372	G	88.4	Confident	91.9	Very high	13 Å²	13	39.8 Å²	39.8	13%	0.134	19%	0.186	C	C	.	.			trans	66.4	16.5	-168.4	0	0	0	0	0	114.2	D368	D368-G372 WeakPolarHBondContact O-CA 3.19Å; D368-G372 PolarHBondContact O-N 2.83Å
373	Y	91	Very high	91.7	Very high	53 Å²	53	42.3 Å²	42.3	21%	0.208	20%	0.197	C	C	.	.			trans	-76.1	132.3	178.3	179.1	-109.8	0	0	0	110.8	P116 W367 D368 S371 F375 L430 Y431 W432	P116-Y373 HydrophobicContact CB-CD1 4.18Å; P116-Y373 HydrophobicContact CB-CG 4.29Å; P116-Y373 HydrophobicContact CG-CD1 4.46Å; P116-Y373 HydrophobicContact CG-CG 4.48Å; W367-Y373 CarbonylContact C-O 3.58Å; W367-Y373 VanDerWaalsContact CA-O 3.31Å; W367-Y373 WeakPolarHBondContact CA-O 3.44Å; D368-Y373 PolarHBondContact N-O 3.4Å; S371-Y373 PolarHBondContact O-N 3.16Å; S371-Y373 VanDerWaalsContact OG-CB 3.29Å; S371-Y373 WeakPolarHBondContact OG-CB 3.4Å; S371-Y373 PolarHBondContact OG-N 3.48Å; S371-Y373 VanDerWaalsContact OG-N 3.16Å; Y373-F375 HydrophobicContact CD1-CB 3.92Å; Y373-F375 HydrophobicContact CE1-CB 3.85Å; Y373-F375 PolarHBondContact O-N 2.76Å; Y373-L430 HydrophobicContact CD1-CD2 4.06Å; Y373-L430 HydrophobicContact CE1-CD2 3.65Å; Y373-Y431 VanDerWaalsContact OH-C 3.25Å; Y373-Y431 PolarHBondContact OH-O 3.3Å; Y373-W432 AromaticContact CD2-CD1 3.68Å; Y373-W432 HydrophobicContact CE2-CB 4.43Å
374	N	91.5	Very high	91.4	Very high	21 Å²	21	47.8 Å²	47.8	11%	0.112	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	106.1	169.9	-175	-32.3	0	0	0	109.1	H365 F366 W367 Q376 R377	H365-N374 PolarHBondContact CD2-ND2 2.9Å; F366-N374 VanDerWaalsContact O-CA 3.32Å; F366-N374 WeakPolarHBondContact O-CA 3.29Å; F366-N374 PolarHBondContact O-OD1 2.94Å; W367-N374 HydrophobicContact CD2-CB 4.14Å; W367-N374 HydrophobicContact CE3-CB 3.64Å; W367-N374 HydrophobicContact CH2-CB 3.91Å; W367-N374 HydrophobicContact CZ2-CB 4.35Å; W367-N374 HydrophobicContact CZ3-CB 3.56Å; N374-Q376 VanDerWaalsContact OD1-C 3.26Å; N374-Q376 PolarHBondContact OD1-N 3Å; N374-Q376 PolarHBondContact OD1-O 3.03Å; N374-R377 PolarHBondContact ND2-NE 3.04Å
375	F	91.7	Very high	91	Very high	38 Å²	38	52 Å²	52	17%	0.167	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-19.8	-179.7	67.8	-91.8	0	0	0	112.9	H119 V354 F366 Y373 L430	H119-F375 HydrophobicContact CB-CD1 4.45Å; H119-F375 HydrophobicContact CB-CD2 4.38Å; H119-F375 HydrophobicContact CB-CE1 4.02Å; H119-F375 HydrophobicContact CB-CE2 3.95Å; H119-F375 HydrophobicContact CB-CZ 3.74Å; V354-F375 HydrophobicContact CG1-CE1 4.04Å; V354-F375 HydrophobicContact CG1-CZ 3.9Å; V354-F375 HydrophobicContact CG2-CE1 4.49Å; V354-F375 HydrophobicContact CG2-CZ 4.39Å; F366-F375 HydrophobicContact CB-CD1 4.28Å; F366-F375 HydrophobicContact CB-CD2 4.5Å; F366-F375 HydrophobicContact CB-CE1 3.67Å; F366-F375 HydrophobicContact CB-CE2 3.92Å; F366-F375 HydrophobicContact CB-CZ 3.47Å; F366-F375 VanDerWaalsContact CB-CZ 3.47Å; F366-F375 HydrophobicContact CD1-CZ 4.41Å; F366-F375 HydrophobicContact CG-CZ 4.28Å; F366-F375 PolarHBondContact O-N 3.48Å; F366-F375 VanDerWaalsContact O-N 3.16Å; Y373-F375 HydrophobicContact CD1-CB 3.92Å; Y373-F375 HydrophobicContact CE1-CB 3.85Å; Y373-F375 PolarHBondContact O-N 2.76Å; F375-L430 HydrophobicContact CB-CD2 4.21Å
376	Q	92.1	Very high	90.8	Very high	26 Å²	26	52.4 Å²	52.4	12%	0.121	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	134.5	-178.8	-168.6	-179.1	8.4	0	0	112.5	W122 F366 N374 L378	W122-Q376 PolarHBondContact O-NE2 3.12Å; F366-Q376 HydrophobicContact CB-CB 4.03Å; F366-Q376 HydrophobicContact CD2-CB 3.93Å; F366-Q376 HydrophobicContact CD2-CG 4.14Å; F366-Q376 HydrophobicContact CG-CB 4.23Å; F366-Q376 PolarHBondContact N-O 3.5Å; N374-Q376 VanDerWaalsContact OD1-C 3.26Å; N374-Q376 PolarHBondContact OD1-N 3Å; N374-Q376 PolarHBondContact OD1-O 3.03Å; Q376-L378 HydrophobicContact CG-CD2 4.42Å; Q376-L378 HydrophobicContact CG-CG 4.21Å
377	R	93.8	Very high	90.5	Very high	169 Å²	169	57.8 Å²	57.8	64%	0.638	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.6	172	-60.8	-179.2	-175.5	169	0.5	108.4	N374	N374-R377 PolarHBondContact ND2-NE 3.04Å
378	L	93.1	Very high	90	Very high	48 Å²	48	64 Å²	64	25%	0.251	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.7	173.7	-67.5	-179.3	0	0	0	109.3	V364 F366 Q376 F417	V364-L378 HydrophobicContact CB-CB 4.3Å; V364-L378 PolarHBondContact N-O 3Å; V364-L378 PolarHBondContact O-N 3.19Å; V364-L378 VanDerWaalsContact O-O 3.12Å; F366-L378 HydrophobicContact CE2-CB 4.45Å; F366-L378 HydrophobicContact CE2-CD1 3.59Å; F366-L378 HydrophobicContact CE2-CG 3.99Å; F366-L378 HydrophobicContact CZ-CD1 4.06Å; Q376-L378 HydrophobicContact CG-CD2 4.42Å; Q376-L378 HydrophobicContact CG-CG 4.21Å; L378-F417 HydrophobicContact CD1-CD1 4.2Å; L378-F417 HydrophobicContact CD1-CE1 4.08Å
379	Q	91.8	Very high	89.7	Confident	115 Å²	115	69.3 Å²	69.3	54%	0.537	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122	165.1	-174.7	65.4	28.4	0	0	106.7	N361 Q381	N361-Q379 PolarHBondContact O-NE2 2.9Å; Q379-Q381 PolarHBondContact O-N 3.2Å
380	A	85.4	Confident	89.4	Confident	10 Å²	10	71.5 Å²	71.5	8%	0.083	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-62.8	126.3	176.4	0	0	0	0	0	109.5	G362	G362-A380 PolarHBondContact O-N 3.42Å
381	Q	86.8	Confident	89.3	Confident	155 Å²	155	66.7 Å²	66.7	72%	0.724	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-78.1	127.3	175.1	-69.3	-177	-19.5	0	0	109	Q379 K415	Q379-Q381 PolarHBondContact O-N 3.2Å; Q381-K415 WeakPolarHBondContact O-CE 3.47Å; Q381-K415 PolarHBondContact O-NZ 3.2Å
382	V	89.2	Confident	89.5	Confident	47 Å²	47	66.9 Å²	66.9	29%	0.285	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-71.1	146.2	-178.7	-68.9	0	0	0	0	112.4	A391	V382-A391 HydrophobicContact CG1-CB 3.57Å
383	Q	87.9	Confident	89.9	Confident	53 Å²	53	66.2 Å²	66.2	25%	0.248	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-59	140.1	170	-172.4	92.4	27.3	0	0	110.5	G385 S386 D411	Q383-G385 PolarHBondContact O-N 3.35Å; Q383-S386 VanDerWaalsContact O-CB 3.28Å; Q383-S386 WeakPolarHBondContact O-CB 3.22Å; Q383-S386 PolarHBondContact O-N 3.13Å; Q383-D411 HydrophobicContact CB-CB 4.12Å; Q383-D411 PolarHBondContact N-OD2 2.79Å
384	P	89.1	Confident	90.1	Very high	123 Å²	123	65.5 Å²	65.5	80%	0.799	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	130.7	173.5	22.6	-33.3	0	0	0	111.2
385	G	88.2	Confident	90.4	Very high	90 Å²	90	65.1 Å²	65.1	93%	0.928	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-8.6	-176.7	0	0	0	0	0	114.8	Q383	Q383-G385 PolarHBondContact O-N 3.35Å
386	S	90	Very high	90.6	Very high	24 Å²	24	64.1 Å²	64.1	17%	0.168	36%	0.359	C	S	.	.	S	Bend	trans	-85.7	155	169	-172.4	0	0	0	0	110.4	Q383 E390	Q383-S386 VanDerWaalsContact O-CB 3.28Å; Q383-S386 WeakPolarHBondContact O-CB 3.22Å; Q383-S386 PolarHBondContact O-N 3.13Å; S386-E390 VanDerWaalsContact OG-CB 3.27Å; S386-E390 WeakPolarHBondContact OG-CB 3.38Å; S386-E390 PolarHBondContact OG-OE2 2.81Å
387	I	90.8	Very high	90.8	Very high	113 Å²	113	63.6 Å²	63.6	58%	0.579	36%	0.359	S	S	*	.			trans	-85.3	147.8	177.8	-55.7	170.5	0	0	0	108.4	S389 E390	I387-S389 PolarHBondContact O-N 3.3Å; I387-E390 HydrophobicContact CB-CG 4.43Å; I387-E390 PolarHBondContact N-OE2 3.45Å; I387-E390 WeakPolarHBondContact O-CB 3.13Å; I387-E390 PolarHBondContact O-N 3.3Å
388	D	84.1	Confident	90.9	Very high	134 Å²	134	56.6 Å²	56.6	72%	0.717	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-53.9	-27.8	178.5	-63	-29.5	0	0	0	113.9	E390 A391	D388-E390 VanDerWaalsContact C-N 3.25Å; D388-E390 PolarHBondContact O-N 3.23Å; D388-A391 PolarHBondContact O-N 3.47Å
389	S	85.8	Confident	91	Very high	111 Å²	111	54.6 Å²	54.6	78%	0.776	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-73.3	-13.6	177.1	-57.4	0	0	0	0	114	I387 A391	I387-S389 PolarHBondContact O-N 3.3Å; S389-A391 VanDerWaalsContact C-N 3.31Å
390	E	87.4	Confident	90.9	Very high	53 Å²	53	57.2 Å²	57.2	25%	0.248	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-91.2	12.5	177.3	-63.9	-174.2	143	0	0	112.6	S386 I387 D388 G392 A410 D411	S386-E390 VanDerWaalsContact OG-CB 3.27Å; S386-E390 WeakPolarHBondContact OG-CB 3.38Å; S386-E390 PolarHBondContact OG-OE2 2.81Å; I387-E390 HydrophobicContact CB-CG 4.43Å; I387-E390 PolarHBondContact N-OE2 3.45Å; I387-E390 WeakPolarHBondContact O-CB 3.13Å; I387-E390 PolarHBondContact O-N 3.3Å; D388-E390 VanDerWaalsContact C-N 3.25Å; D388-E390 PolarHBondContact O-N 3.23Å; E390-G392 PolarHBondContact O-N 3.22Å; E390-A410 CarbonylContact O-C 3.49Å; E390-A410 WeakPolarHBondContact O-CB 2.82Å; E390-D411 PolarHBondContact O-N 2.87Å; E390-D411 VanDerWaalsContact O-N 3.14Å
391	A	88.5	Confident	91.3	Very high	5 Å²	5	60.1 Å²	60.1	4%	0.041	35%	0.347	C	S	.	.			trans	-69.4	3.1	176.6	0	0	0	0	0	114.3	G362 V382 D388 S389	G362-A391 WeakPolarHBondContact CA-O 3.46Å; G362-A391 PolarHBondContact N-O 3.39Å; V382-A391 HydrophobicContact CG1-CB 3.57Å; D388-A391 PolarHBondContact O-N 3.47Å; S389-A391 VanDerWaalsContact C-N 3.31Å
392	G	93.9	Very high	91.5	Very high	3 Å²	3	52.8 Å²	52.8	3%	0.031	31%	0.313	C	S	.	.			trans	-65.9	137.4	-170	0	0	0	0	0	114.8	D360 E390 E409 A410	D360-G392 WeakPolarHBondContact O-CA 3.5Å; E390-G392 PolarHBondContact O-N 3.22Å; G392-E409 CarbonylContact O-C 3.53Å; G392-E409 VanDerWaalsContact O-CA 3.26Å; G392-E409 WeakPolarHBondContact O-CA 3.44Å; G392-A410 PolarHBondContact O-N 3.08Å
393	V	95.9	Very high	91.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	120.4	175.2	-177	0	0	0	0	108.9	N345 G359 V364 L396 E409	N345-V393 WeakPolarHBondContact CB-O 3.23Å; N345-V393 PolarHBondContact ND2-O 2.86Å; G359-V393 PolarHBondContact O-N 3.01Å; V364-V393 HydrophobicContact CG2-CG2 3.8Å; V393-L396 HydrophobicContact CG1-CD1 4.27Å; V393-L396 HydrophobicContact CG1-CD2 3.89Å; V393-L396 HydrophobicContact CG1-CG 3.81Å; V393-E409 HydrophobicContact CG2-CG 4.12Å
394	F	95.9	Very high	92	Very high	37 Å²	37	53.4 Å²	53.4	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-33	-177.9	-70.2	-50	0	0	0	114	W134 N345 C408 A410	W134-F394 HydrophobicContact CB-CD2 4.33Å; W134-F394 HydrophobicContact CB-CE2 3.96Å; W134-F394 HydrophobicContact CD2-CE2 4.2Å; W134-F394 HydrophobicContact CE3-CE2 4.14Å; W134-F394 HydrophobicContact CE3-CZ 4.3Å; W134-F394 HydrophobicContact CG-CE2 4.16Å; N345-F394 WeakPolarHBondContact ND2-CD1 3.35Å; F394-C408 PolarHBondContact N-O 2.66Å; F394-A410 HydrophobicContact CD2-CB 4.04Å; F394-A410 HydrophobicContact CE2-CB 3.3Å; F394-A410 HydrophobicContact CZ-CB 3.86Å
395	A	96.3	Very high	92.3	Very high	13 Å²	13	47.5 Å²	47.5	11%	0.107	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	147.1	177.8	0	0	0	0	0	110.8	V138 C408	V138-A395 HydrophobicContact CG2-CB 4.3Å; A395-C408 HydrophobicContact CB-CB 4.06Å; A395-C408 PolarHBondContact N-O 2.86Å; A395-C408 PolarHBondContact O-N 3.48Å
396	L	96.4	Very high	92.7	Very high	18 Å²	18	43.2 Å²	43.2	9%	0.094	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.2	176.1	-71.4	166.8	0	0	0	107.8	A346 T348 V356 V393 L405 V406	A346-L396 HydrophobicContact CB-CB 4.03Å; A346-L396 HydrophobicContact CB-CD1 4.05Å; A346-L396 HydrophobicContact CB-CG 3.98Å; T348-L396 HydrophobicContact CG2-CB 3.7Å; V356-L396 HydrophobicContact CB-CD1 4.49Å; V356-L396 HydrophobicContact CG1-CD1 3.97Å; V393-L396 HydrophobicContact CG1-CD1 4.27Å; V393-L396 HydrophobicContact CG1-CD2 3.89Å; V393-L396 HydrophobicContact CG1-CG 3.81Å; L396-L405 HydrophobicContact CB-CD1 4.44Å; L396-L405 HydrophobicContact CD2-CD1 4.16Å; L396-L405 HydrophobicContact CD2-CD2 4.3Å; L396-L405 HydrophobicContact CD2-CG 4.38Å; L396-V406 WeakPolarHBondContact CA-O 3.33Å
397	A	96.3	Very high	93	Very high	14 Å²	14	42.1 Å²	42.1	12%	0.116	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	140.3	173.8	0	0	0	0	0	109.9	V138 F140 V406	V138-A397 HydrophobicContact CB-CB 4.27Å; V138-A397 HydrophobicContact CG1-CB 4.11Å; F140-A397 HydrophobicContact CD2-CB 3.86Å; F140-A397 HydrophobicContact CE2-CB 3.6Å; A397-V406 PolarHBondContact N-O 3.05Å; A397-V406 PolarHBondContact O-N 2.72Å
398	F	96.1	Very high	93.2	Very high	22 Å²	22	36.7 Å²	36.7	10%	0.096	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	149.6	167.5	-76.9	-69.7	0	0	0	110.1	W122 F140 T348 N350 V356 R404 L405	W122-F398 HydrophobicContact CH2-CD1 4.1Å; W122-F398 AromaticContact CH2-CE1 3.49Å; W122-F398 HydrophobicContact CH2-CE1 3.49Å; W122-F398 VanDerWaalsContact CH2-CE1 3.49Å; W122-F398 AromaticContact CZ2-CE1 3.72Å; W122-F398 HydrophobicContact CZ2-CE1 3.72Å; W122-F398 HydrophobicContact CZ2-CZ 4.37Å; W122-F398 HydrophobicContact CZ3-CE1 4.12Å; F140-F398 WeakPolarHBondContact CD2-O 3.21Å; F140-F398 VanDerWaalsContact CE2-C 3.45Å; F140-F398 WeakPolarHBondContact CE2-O 3.28Å; T348-F398 HydrophobicContact CG2-CD2 3.68Å; T348-F398 HydrophobicContact CG2-CE2 3.55Å; T348-F398 HydrophobicContact CG2-CZ 4.35Å; T348-F398 VanDerWaalsContact OG1-CD2 3.25Å; T348-F398 WeakPolarHBondContact OG1-CD2 3.37Å; N350-F398 HydrophobicContact CB-CD1 4.39Å; N350-F398 HydrophobicContact CB-CD2 3.87Å; N350-F398 HydrophobicContact CB-CE1 4.17Å; N350-F398 HydrophobicContact CB-CE2 3.62Å; N350-F398 HydrophobicContact CB-CG 4.25Å; N350-F398 HydrophobicContact CB-CZ 3.78Å; V356-F398 HydrophobicContact CG2-CE1 4.44Å; V356-F398 HydrophobicContact CG2-CE2 3.95Å; V356-F398 HydrophobicContact CG2-CZ 3.45Å; V356-F398 VanDerWaalsContact CG2-CZ 3.45Å; F398-R404 WeakPolarHBondContact CA-O 3.48Å; F398-L405 HydrophobicContact CD1-CB 4.02Å; F398-L405 HydrophobicContact CD1-CD1 4.05Å; F398-L405 HydrophobicContact CE1-CB 3.79Å; F398-L405 HydrophobicContact CE1-CD1 3.87Å; F398-L405 HydrophobicContact CE1-CG 4.37Å; F398-L405 HydrophobicContact CE2-CD1 4.36Å; F398-L405 HydrophobicContact CG-CD1 4.37Å; F398-L405 HydrophobicContact CZ-CD1 4.05Å
399	D	94.5	Very high	93.7	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.032	16%	0.163	C	C	.	.			trans	-62.2	164.6	165.1	68.1	-29.3	0	0	0	111	F140 F161 S401 G402 S403 R404	F140-D399 HydrophobicContact CE1-CB 4.14Å; F140-D399 HydrophobicContact CZ-CB 4.25Å; F161-D399 HydrophobicContact CE1-CB 4.11Å; F161-D399 HydrophobicContact CE2-CB 4.49Å; F161-D399 HydrophobicContact CZ-CB 3.65Å; D399-S401 PolarHBondContact O-N 3.34Å; D399-S401 PolarHBondContact OD2-OG 2.84Å; D399-G402 PolarHBondContact O-N 3.48Å; D399-G402 WeakPolarHBondContact OD1-CA 3.27Å; D399-G402 PolarHBondContact OD1-N 2.64Å; D399-S403 PolarHBondContact OD1-N 2.78Å; D399-S403 PolarHBondContact OD2-N 2.81Å; D399-S403 PolarHBondContact OD2-OG 2.84Å; D399-R404 HydrophobicContact CB-CB 4.26Å; D399-R404 VanDerWaalsContact CG-N 3.31Å; D399-R404 PolarHBondContact N-O 3.46Å; D399-R404 PolarHBondContact OD1-N 3.37Å; D399-R404 PolarHBondContact OD2-N 3.5Å
400	R	91.5	Very high	94.2	Very high	171 Å²	171	25.3 Å²	25.3	65%	0.645	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-28.6	-178.3	-167	58.1	175.4	160.2	1.3	112.9	N144 Q351	N144-R400 HydrophobicContact CB-CB 4.18Å; Q351-R400 PolarHBondContact NE2-O 3.05Å
401	S	92.3	Very high	94.4	Very high	70 Å²	70	23 Å²	23	49%	0.49	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-17.3	174.2	23.8	0	0	0	0	114.8	N144 D399 S403	N144-S401 PolarHBondContact ND2-OG 3.05Å; D399-S401 PolarHBondContact O-N 3.34Å; D399-S401 PolarHBondContact OD2-OG 2.84Å; S401-S403 PolarHBondContact O-N 3.31Å
402	G	91.4	Very high	94.7	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.01	13%	0.132	C	C	.	.	S	Bend	trans	78.9	-3.9	-174.4	0	0	0	0	0	115.5	N350 D399	N350-G402 PolarHBondContact ND2-O 2.96Å; N350-G402 WeakPolarHBondContact OD1-CA 3.47Å; D399-G402 PolarHBondContact O-N 3.48Å; D399-G402 WeakPolarHBondContact OD1-CA 3.27Å; D399-G402 PolarHBondContact OD1-N 2.64Å
403	S	92.4	Very high	94.8	Very high	48 Å²	48	26.4 Å²	26.4	34%	0.336	13%	0.131	S	C	.	.	S	Bend	trans	-80.5	-17.3	-174.5	71.1	0	0	0	0	114.7	D399 S401	D399-S403 PolarHBondContact OD1-N 2.78Å; D399-S403 PolarHBondContact OD2-N 2.81Å; D399-S403 PolarHBondContact OD2-OG 2.84Å; S401-S403 PolarHBondContact O-N 3.31Å
404	R	94.8	Very high	94.8	Very high	65 Å²	65	26.5 Å²	26.5	25%	0.245	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	136.7	-172.8	-64	-175	-167.6	-161.6	4.2	110.8	F161 F398 D399 I416 F417	F161-R404 HydrophobicContact CZ-CB 3.85Å; F161-R404 VanDerWaalsContact CZ-CD 3.46Å; F161-R404 HydrophobicContact CZ-CG 4.2Å; F398-R404 WeakPolarHBondContact CA-O 3.48Å; D399-R404 HydrophobicContact CB-CB 4.26Å; D399-R404 VanDerWaalsContact CG-N 3.31Å; D399-R404 PolarHBondContact N-O 3.46Å; D399-R404 PolarHBondContact OD1-N 3.37Å; D399-R404 PolarHBondContact OD2-N 3.5Å; R404-I416 HydrophobicContact CB-CG2 4.34Å; R404-F417 WeakPolarHBondContact CA-O 3.27Å
405	L	96	Very high	94.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.9	176.1	172.7	75	0	0	0	108.7	W122 T348 V356 F366 L396 F398 I416 F417	W122-L405 HydrophobicContact CE3-CB 3.96Å; W122-L405 HydrophobicContact CH2-CB 4.43Å; W122-L405 HydrophobicContact CZ3-CB 3.72Å; T348-L405 HydrophobicContact CG2-CD1 3.65Å; V356-L405 HydrophobicContact CB-CD2 4.46Å; V356-L405 HydrophobicContact CG1-CD2 3.87Å; V356-L405 HydrophobicContact CG2-CD1 4.45Å; V356-L405 HydrophobicContact CG2-CD2 4.25Å; F366-L405 HydrophobicContact CE1-CD2 3.91Å; F366-L405 HydrophobicContact CZ-CD2 3.93Å; L396-L405 HydrophobicContact CB-CD1 4.44Å; L396-L405 HydrophobicContact CD2-CD1 4.16Å; L396-L405 HydrophobicContact CD2-CD2 4.3Å; L396-L405 HydrophobicContact CD2-CG 4.38Å; F398-L405 HydrophobicContact CD1-CB 4.02Å; F398-L405 HydrophobicContact CD1-CD1 4.05Å; F398-L405 HydrophobicContact CE1-CB 3.79Å; F398-L405 HydrophobicContact CE1-CD1 3.87Å; F398-L405 HydrophobicContact CE1-CG 4.37Å; F398-L405 HydrophobicContact CE2-CD1 4.36Å; F398-L405 HydrophobicContact CG-CD1 4.37Å; F398-L405 HydrophobicContact CZ-CD1 4.05Å; L405-I416 CarbonylContact O-C 3.58Å; L405-I416 WeakPolarHBondContact O-CA 3.22Å; L405-F417 HydrophobicContact CB-CB 4.22Å; L405-F417 HydrophobicContact CD2-CB 4.48Å; L405-F417 HydrophobicContact CD2-CD2 4.11Å; L405-F417 HydrophobicContact CG-CD2 4.46Å; L405-F417 PolarHBondContact N-O 3.46Å; L405-F417 PolarHBondContact O-N 2.85Å
406	V	96.3	Very high	94.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.7	169.9	173.8	0	0	0	0	108.9	V138 F140 F161 L396 A397 I414 K415 I416	V138-V406 HydrophobicContact CG1-CG1 4.14Å; V138-V406 HydrophobicContact CG2-CG1 4.32Å; F140-V406 HydrophobicContact CE1-CG2 4.27Å; F140-V406 HydrophobicContact CE2-CB 4.27Å; F140-V406 HydrophobicContact CE2-CG2 4.26Å; F140-V406 HydrophobicContact CZ-CB 3.95Å; F140-V406 HydrophobicContact CZ-CG2 3.45Å; F140-V406 VanDerWaalsContact CZ-CG2 3.45Å; F161-V406 HydrophobicContact CE2-CG2 4.35Å; L396-V406 WeakPolarHBondContact CA-O 3.33Å; A397-V406 PolarHBondContact N-O 3.05Å; A397-V406 PolarHBondContact O-N 2.72Å; V406-I414 HydrophobicContact CG1-CG2 3.51Å; V406-K415 CarbonylContact C-O 3.59Å; V406-K415 WeakPolarHBondContact CA-O 3.41Å; V406-I416 HydrophobicContact CG2-CG1 4.16Å; V406-I416 HydrophobicContact CG2-CG2 4.31Å
407	S	95.9	Very high	94.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	146.3	167.1	72.7	0	0	0	0	110.8	E409 I414 K415 F417	S407-E409 PolarHBondContact OG-OE1 2.79Å; S407-I414 WeakPolarHBondContact O-CA 3.39Å; S407-K415 PolarHBondContact N-O 3.47Å; S407-K415 PolarHBondContact O-N 3.12Å; S407-K415 WeakPolarHBondContact OG-CB 3.46Å; S407-K415 PolarHBondContact OG-O 2.85Å; S407-F417 WeakPolarHBondContact OG-CE2 3Å
408	C	95.9	Very high	94.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.6	172.5	-84	0	0	0	0	109.5	V135 V138 F394 A395	V135-C408 HydrophobicContact CB-CB 3.8Å; V135-C408 HydrophobicContact CG1-CB 3.7Å; V135-C408 WeakPolarHBondContact CG1-SG 3.47Å; V138-C408 HydrophobicContact CG2-CB 3.84Å; V138-C408 WeakPolarHBondContact CG2-SG 3.48Å; F394-C408 PolarHBondContact N-O 2.66Å; A395-C408 HydrophobicContact CB-CB 4.06Å; A395-C408 PolarHBondContact N-O 2.86Å; A395-C408 PolarHBondContact O-N 3.48Å
409	E	95.3	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	159.6	-163.6	-66.3	-178	-158.3	0	0	111.2	V135 G392 V393 S407 D411 K412 S413 K415	V135-E409 PolarHBondContact N-O 3.03Å; G392-E409 CarbonylContact O-C 3.53Å; G392-E409 VanDerWaalsContact O-CA 3.26Å; G392-E409 WeakPolarHBondContact O-CA 3.44Å; V393-E409 HydrophobicContact CG2-CG 4.12Å; S407-E409 PolarHBondContact OG-OE1 2.79Å; E409-D411 WeakPolarHBondContact CB-OD1 3.3Å; E409-D411 PolarHBondContact O-N 3.38Å; E409-K412 PolarHBondContact O-N 3.14Å; E409-S413 PolarHBondContact N-O 3.22Å; E409-K415 WeakPolarHBondContact OE1-CD 3.1Å; E409-K415 IonicContact OE1-NZ 3.22Å; E409-K415 IonicContact OE2-NZ 2.62Å; E409-K415 PolarHBondContact OE2-NZ 3.18Å
410	A	94.3	Very high	94.3	Very high	5 Å²	5	28.5 Å²	28.5	4%	0.041	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-19.8	178.4	0	0	0	0	0	111.7	W134 E390 G392 F394 K412	W134-A410 HydrophobicContact CG-CB 4.46Å; E390-A410 CarbonylContact O-C 3.49Å; E390-A410 WeakPolarHBondContact O-CB 2.82Å; G392-A410 PolarHBondContact O-N 3.08Å; F394-A410 HydrophobicContact CD2-CB 4.04Å; F394-A410 HydrophobicContact CE2-CB 3.3Å; F394-A410 HydrophobicContact CZ-CB 3.86Å; A410-K412 PolarHBondContact O-N 2.87Å
411	D	93.4	Very high	94.3	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.021	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	10.5	172.3	74.9	-7.2	0	0	0	113.9	Q383 E390 E409 S413 K415	Q383-D411 HydrophobicContact CB-CB 4.12Å; Q383-D411 PolarHBondContact N-OD2 2.79Å; E390-D411 PolarHBondContact O-N 2.87Å; E390-D411 VanDerWaalsContact O-N 3.14Å; E409-D411 WeakPolarHBondContact CB-OD1 3.3Å; E409-D411 PolarHBondContact O-N 3.38Å; D411-S413 PolarHBondContact O-N 2.82Å; D411-S413 WeakPolarHBondContact OD1-CB 3.36Å; D411-S413 PolarHBondContact OD1-N 2.89Å; D411-S413 PolarHBondContact OD1-OG 2.62Å; D411-S413 PolarHBondContact OD2-OG 3.32Å; D411-S413 VanDerWaalsContact OD2-OG 3.12Å; D411-K415 IonicContact OD2-NZ 2.79Å; D411-K415 PolarHBondContact OD2-NZ 3.33Å
412	K	94.5	Very high	94.2	Very high	81 Å²	81	28.6 Å²	28.6	35%	0.352	15%	0.146	S	C	.	.	S	Bend	trans	69.1	7.7	177.9	-42.1	163.4	178.8	-165	0	113.2	T132 E409 A410	T132-K412 VanDerWaalsContact O-CD 3.24Å; T132-K412 WeakPolarHBondContact O-CD 3.37Å; T132-K412 WeakPolarHBondContact O-CE 3.32Å; T132-K412 PolarHBondContact O-NZ 3.2Å; E409-K412 PolarHBondContact O-N 3.14Å; A410-K412 PolarHBondContact O-N 2.87Å
413	S	94.8	Very high	94.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	156.9	178.3	82.5	0	0	0	0	111.6	E409 D411 K415	E409-S413 PolarHBondContact N-O 3.22Å; D411-S413 PolarHBondContact O-N 2.82Å; D411-S413 WeakPolarHBondContact OD1-CB 3.36Å; D411-S413 PolarHBondContact OD1-N 2.89Å; D411-S413 PolarHBondContact OD1-OG 2.62Å; D411-S413 PolarHBondContact OD2-OG 3.32Å; D411-S413 VanDerWaalsContact OD2-OG 3.12Å; S413-K415 VanDerWaalsContact OG-CE 3.3Å; S413-K415 WeakPolarHBondContact OG-CE 3.36Å; S413-K415 PolarHBondContact OG-NZ 2.65Å
414	I	95.8	Very high	94	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119.4	170.1	-56.6	161.3	0	0	0	105.7	V128 V135 F147 T149 W159 V406 S407	V128-I414 HydrophobicContact CB-CB 4.23Å; V128-I414 PolarHBondContact N-O 2.94Å; V128-I414 PolarHBondContact O-N 3.18Å; V135-I414 HydrophobicContact CG1-CG1 4.4Å; V135-I414 HydrophobicContact CG2-CG1 4.22Å; F147-I414 HydrophobicContact CE2-CD1 4.32Å; F147-I414 HydrophobicContact CE2-CG2 4.02Å; F147-I414 HydrophobicContact CZ-CG2 4.38Å; T149-I414 HydrophobicContact CG2-CD1 3.67Å; T149-I414 HydrophobicContact CG2-CG1 4.36Å; W159-I414 HydrophobicContact CZ2-CD1 4.09Å; V406-I414 HydrophobicContact CG1-CG2 3.51Å; S407-I414 WeakPolarHBondContact O-CA 3.39Å
415	K	95.3	Very high	93.6	Very high	7 Å²	7	33 Å²	33	3%	0.03	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136	-179	-61	-172	-180	122.9	0	110	L124 V127 Q381 V406 S407 E409 D411 S413 F417	L124-K415 HydrophobicContact CD1-CB 3.68Å; L124-K415 HydrophobicContact CD1-CD 4.16Å; L124-K415 HydrophobicContact CD1-CG 4.18Å; V127-K415 HydrophobicContact CG1-CG 4.34Å; V127-K415 HydrophobicContact CG2-CD 4.47Å; V127-K415 HydrophobicContact CG2-CG 4.24Å; Q381-K415 WeakPolarHBondContact O-CE 3.47Å; Q381-K415 PolarHBondContact O-NZ 3.2Å; V406-K415 CarbonylContact C-O 3.59Å; V406-K415 WeakPolarHBondContact CA-O 3.41Å; S407-K415 PolarHBondContact N-O 3.47Å; S407-K415 PolarHBondContact O-N 3.12Å; S407-K415 WeakPolarHBondContact OG-CB 3.46Å; S407-K415 PolarHBondContact OG-O 2.85Å; E409-K415 WeakPolarHBondContact OE1-CD 3.1Å; E409-K415 IonicContact OE1-NZ 3.22Å; E409-K415 IonicContact OE2-NZ 2.62Å; E409-K415 PolarHBondContact OE2-NZ 3.18Å; D411-K415 IonicContact OD2-NZ 2.79Å; D411-K415 PolarHBondContact OD2-NZ 3.33Å; S413-K415 VanDerWaalsContact OG-CE 3.3Å; S413-K415 WeakPolarHBondContact OG-CE 3.36Å; S413-K415 PolarHBondContact OG-NZ 2.65Å; K415-F417 HydrophobicContact CB-CE2 3.89Å; K415-F417 HydrophobicContact CB-CZ 4.21Å
416	I	95.6	Very high	93.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.7	180	-46	-172.5	0	0	0	107.7	C125 R126 V128 R404 L405 V406	C125-I416 WeakPolarHBondContact CA-O 3.38Å; C125-I416 WeakPolarHBondContact CB-O 3.22Å; C125-I416 PolarHBondContact N-O 2.93Å; R126-I416 HydrophobicContact CB-CB 4.21Å; R126-I416 HydrophobicContact CB-CD1 4.4Å; R126-I416 HydrophobicContact CB-CG1 4.39Å; R126-I416 PolarHBondContact N-O 3.17Å; R126-I416 VanDerWaalsContact N-O 3.12Å; R126-I416 PolarHBondContact O-N 2.89Å; V128-I416 HydrophobicContact CG2-CD1 4.48Å; R404-I416 HydrophobicContact CB-CG2 4.34Å; L405-I416 CarbonylContact O-C 3.58Å; L405-I416 WeakPolarHBondContact O-CA 3.22Å; V406-I416 HydrophobicContact CG2-CG1 4.16Å; V406-I416 HydrophobicContact CG2-CG2 4.31Å
417	F	95.5	Very high	92.4	Very high	13 Å²	13	45.5 Å²	45.5	6%	0.057	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	145.8	175.1	-57.3	-96	0	0	0	109.9	W122 K123 L124 L378 R404 L405 S407 K415	W122-F417 HydrophobicContact CE3-CB 3.93Å; K123-F417 CarbonylContact O-C 3.47Å; K123-F417 VanDerWaalsContact O-CA 3.22Å; K123-F417 WeakPolarHBondContact O-CA 3.31Å; L124-F417 HydrophobicContact CB-CD1 4.18Å; L124-F417 HydrophobicContact CB-CE1 4.03Å; L124-F417 HydrophobicContact CD1-CD1 4.36Å; L124-F417 HydrophobicContact CD1-CE1 4.02Å; L124-F417 HydrophobicContact CD1-CZ 4.11Å; L378-F417 HydrophobicContact CD1-CD1 4.2Å; L378-F417 HydrophobicContact CD1-CE1 4.08Å; R404-F417 WeakPolarHBondContact CA-O 3.27Å; L405-F417 HydrophobicContact CB-CB 4.22Å; L405-F417 HydrophobicContact CD2-CB 4.48Å; L405-F417 HydrophobicContact CD2-CD2 4.11Å; L405-F417 HydrophobicContact CG-CD2 4.46Å; L405-F417 PolarHBondContact N-O 3.46Å; L405-F417 PolarHBondContact O-N 2.85Å; S407-F417 WeakPolarHBondContact OG-CE2 3Å; K415-F417 HydrophobicContact CB-CE2 3.89Å; K415-F417 HydrophobicContact CB-CZ 4.21Å
418	K	94.8	Very high	91.9	Very high	58 Å²	58	49.6 Å²	49.6	25%	0.252	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148	173.9	-170.1	-173.6	172.5	-171.2	0	108.2	K123 C125 E421	K123-K418 WeakPolarHBondContact CG-O 2.95Å; K123-K418 PolarHBondContact N-O 2.71Å; K123-K418 PolarHBondContact O-N 2.81Å; C125-K418 HydrophobicContact CB-CB 3.91Å; K418-E421 WeakPolarHBondContact CE-OE1 3.46Å; K418-E421 IonicContact NZ-OE1 3.59Å; K418-E421 PolarHBondContact NZ-OE1 3.06Å; K418-E421 IonicContact NZ-OE2 3.34Å
419	E	93.3	Very high	91.2	Very high	43 Å²	43	52.4 Å²	52.4	20%	0.201	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	146	168.9	-62.5	-175.1	159.8	0	0	111.4	P120 W122 E421	P120-E419 HydrophobicContact CB-CB 4.33Å; P120-E419 HydrophobicContact CG-CB 3.97Å; P120-E419 HydrophobicContact CG-CG 4.03Å; P120-E419 WeakPolarHBondContact CG-OE2 3.01Å; W122-E419 HydrophobicContact CD2-CG 3.9Å; W122-E419 HydrophobicContact CE3-CG 4.19Å; W122-E419 HydrophobicContact CH2-CG 3.75Å; W122-E419 HydrophobicContact CZ2-CG 3.44Å; W122-E419 VanDerWaalsContact CZ2-CG 3.44Å; W122-E419 WeakPolarHBondContact CZ2-OE1 3.42Å; W122-E419 HydrophobicContact CZ3-CG 4.11Å; E419-E421 PolarHBondContact O-N 3.45Å
420	D	92.3	Very high	90.4	Very high	29 Å²	29	55 Å²	55	16%	0.155	28%	0.284	C	S	.	.			trans	-82.6	102.8	174.8	-162.2	11.6	0	0	0	110.9	P121 K123 S422 A423	P121-D420 HydrophobicContact CG-CB 4.17Å; P121-D420 WeakPolarHBondContact O-CB 3.31Å; P121-D420 PolarHBondContact O-N 2.96Å; K123-D420 HydrophobicContact CD-CB 4.12Å; K123-D420 WeakPolarHBondContact CE-OD1 3.28Å; K123-D420 IonicContact NZ-OD1 3.92Å; K123-D420 PolarHBondContact NZ-OD1 3.46Å; D420-S422 PolarHBondContact O-N 2.6Å; D420-S422 PolarHBondContact OD1-OG 3.06Å; D420-S422 VanDerWaalsContact OD1-OG 3.13Å; D420-A423 HydrophobicContact CB-CB 4.19Å; D420-A423 WeakPolarHBondContact O-CB 3.39Å; D420-A423 PolarHBondContact O-N 2.99Å; D420-A423 VanDerWaalsContact O-N 3.09Å
421	E	89.7	Confident	89.7	Confident	155 Å²	155	63.7 Å²	63.7	72%	0.724	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-19	-178.9	-66.9	174	-178.5	0	0	113.2	K418 E419	K418-E421 WeakPolarHBondContact CE-OE1 3.46Å; K418-E421 IonicContact NZ-OE1 3.59Å; K418-E421 PolarHBondContact NZ-OE1 3.06Å; K418-E421 IonicContact NZ-OE2 3.34Å; E419-E421 PolarHBondContact O-N 3.45Å
422	S	90.4	Very high	88.9	Confident	88 Å²	88	66.7 Å²	66.7	62%	0.615	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.9	175.5	57.2	0	0	0	0	113.9	D420	D420-S422 PolarHBondContact O-N 2.6Å; D420-S422 PolarHBondContact OD1-OG 3.06Å; D420-S422 VanDerWaalsContact OD1-OG 3.13Å
423	A	89.4	Confident	87.7	Confident	10 Å²	10	73.7 Å²	73.7	8%	0.083	35%	0.353	C	S	.	.			trans	-76.5	143.7	178.9	0	0	0	0	0	111.4	W118 P121 D420	W118-A423 HydrophobicContact CH2-CB 4.33Å; W118-A423 WeakPolarHBondContact CH2-O 3.44Å; W118-A423 HydrophobicContact CZ2-CB 4.16Å; P121-A423 HydrophobicContact CG-CB 3.83Å; D420-A423 HydrophobicContact CB-CB 4.19Å; D420-A423 WeakPolarHBondContact O-CB 3.39Å; D420-A423 PolarHBondContact O-N 2.99Å; D420-A423 VanDerWaalsContact O-N 3.09Å
424	T	89.7	Confident	86.4	Confident	65 Å²	65	77.9 Å²	77.9	40%	0.399	38%	0.38	S	S	.	.			trans	-138	164.7	177.2	58.3	0	0	0	0	109.1	E426 T427 H428	T424-E426 PolarHBondContact O-N 2.85Å; T424-E426 VanDerWaalsContact O-N 3.13Å; T424-T427 PolarHBondContact N-OG1 2.59Å; T424-T427 PolarHBondContact O-N 3.39Å; T424-T427 PolarHBondContact O-OG1 3.4Å; T424-T427 WeakPolarHBondContact OG1-CG2 3.27Å; T424-T427 PolarHBondContact OG1-N 3.48Å; T424-T427 PolarHBondContact OG1-OG1 2.84Å; T424-T427 VanDerWaalsContact OG1-OG1 3.12Å; T424-H428 PolarHBondContact O-N 2.98Å
425	E	87.4	Confident	84.6	Confident	131 Å²	131	80.3 Å²	80.3	61%	0.612	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.7	176.4	-58	-163.6	158.8	0	0	112.8	W118 H428 P429	W118-E425 HydrophobicContact CB-CG 4.05Å; W118-E425 WeakPolarHBondContact CB-OE1 3.33Å; W118-E425 HydrophobicContact CD2-CG 3.73Å; W118-E425 HydrophobicContact CE3-CG 4.21Å; W118-E425 HydrophobicContact CG-CB 4.5Å; W118-E425 HydrophobicContact CG-CG 3.64Å; E425-H428 CarbonylContact O-C 3.44Å; E425-P429 VanDerWaalsContact O-CA 3.24Å; E425-P429 WeakPolarHBondContact O-CA 3.38Å
426	E	84.6	Confident	82.5	Confident	180 Å²	180	87.9 Å²	87.9	84%	0.841	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-40.2	179.4	-60.9	-175.5	168.1	0	0	112.6	T424	T424-E426 PolarHBondContact O-N 2.85Å; T424-E426 VanDerWaalsContact O-N 3.13Å
427	T	83.1	Confident	80.2	Confident	83 Å²	83	95.2 Å²	95.2	51%	0.509	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-35.9	179.6	52.7	0	0	0	0	111.5	T424 P429	T424-T427 PolarHBondContact N-OG1 2.59Å; T424-T427 PolarHBondContact O-N 3.39Å; T424-T427 PolarHBondContact O-OG1 3.4Å; T424-T427 WeakPolarHBondContact OG1-CG2 3.27Å; T424-T427 PolarHBondContact OG1-N 3.48Å; T424-T427 PolarHBondContact OG1-OG1 2.84Å; T424-T427 VanDerWaalsContact OG1-OG1 3.12Å; T427-P429 WeakPolarHBondContact O-CD 3.3Å
428	H	83.8	Confident	77.7	Confident	87 Å²	87	104 Å²	104	40%	0.403	52%	0.522	S	S	.	.	S	Bend	trans	-126.7	75.2	-179.1	-64.9	76.7	0	0	0	110.1	W118 T424 E425	W118-H428 PolarHBondContact NE1-O 2.69Å; T424-H428 PolarHBondContact O-N 2.98Å; E425-H428 CarbonylContact O-C 3.44Å
429	P	81.6	Confident	75	Confident	58 Å²	58	110.4 Å²	110.4	38%	0.377	55%	0.55	S	S	.	.			trans	-69.9	141.9	-177.3	27.5	-34.3	0	0	0	111.8	E425 T427 Y431	E425-P429 VanDerWaalsContact O-CA 3.24Å; E425-P429 WeakPolarHBondContact O-CA 3.38Å; T427-P429 WeakPolarHBondContact O-CD 3.3Å; P429-Y431 HydrophobicContact CG-CE2 4.02Å; P429-Y431 WeakPolarHBondContact O-CD2 3.28Å; P429-Y431 PolarHBondContact O-N 3.05Å
430	L	80	Confident	72.3	Confident	54 Å²	54	112.2 Å²	112.2	28%	0.283	57%	0.567	S	S	.	*			trans	-71.7	108.1	172.3	-72.1	166.1	0	0	0	110	P116 W118 Y373 F375 W432	P116-L430 HydrophobicContact CB-CD1 4.46Å; P116-L430 HydrophobicContact CG-CD1 4.27Å; W118-L430 HydrophobicContact CB-CD1 3.89Å; W118-L430 HydrophobicContact CG-CD1 4.47Å; Y373-L430 HydrophobicContact CD1-CD2 4.06Å; Y373-L430 HydrophobicContact CE1-CD2 3.65Å; F375-L430 HydrophobicContact CB-CD2 4.21Å; L430-W432 PolarHBondContact O-N 3.24Å
431	Y	78.4	Confident	69.4	Low	189 Å²	189	120.5 Å²	120.5	74%	0.741	60%	0.602	S	S	*	*			trans	-78.4	64.8	168.8	-63.5	-77	0	0	0	110.6	Y373 P429	Y373-Y431 VanDerWaalsContact OH-C 3.25Å; Y373-Y431 PolarHBondContact OH-O 3.3Å; P429-Y431 HydrophobicContact CG-CE2 4.02Å; P429-Y431 WeakPolarHBondContact O-CD2 3.28Å; P429-Y431 PolarHBondContact O-N 3.05Å
432	W	76.2	Confident	66.8	Low	66 Å²	66	126.4 Å²	126.4	25%	0.25	62%	0.619	C	S	.	*			trans	-96.4	120.1	176.9	-176.1	74.9	0	0	0	110.6	M113 K115 P116 Y373 L430 P434	M113-W432 HydrophobicContact CB-CZ2 4.25Å; K115-W432 HydrophobicContact CG-CZ3 4.4Å; P116-W432 VanDerWaalsContact CD-CD2 3.5Å; P116-W432 HydrophobicContact CG-CB 3.8Å; P116-W432 HydrophobicContact CG-CD2 3.99Å; P116-W432 HydrophobicContact CG-CG 3.58Å; Y373-W432 AromaticContact CD2-CD1 3.68Å; Y373-W432 HydrophobicContact CE2-CB 4.43Å; L430-W432 PolarHBondContact O-N 3.24Å; W432-P434 HydrophobicContact CH2-CB 3.85Å; W432-P434 HydrophobicContact CH2-CG 4.33Å; W432-P434 HydrophobicContact CZ2-CB 3.99Å; W432-P434 HydrophobicContact CZ3-CB 4.32Å; W432-P434 HydrophobicContact CZ3-CG 4.33Å
433	R	71.1	Confident	65.6	Low	228 Å²	228	128.3 Å²	128.3	86%	0.86	62%	0.619	S	S	*	*			trans	-114.1	124.3	166.1	-64.2	-175.4	-178.2	-174.6	0.8	106.9	G435	R433-G435 VanDerWaalsContact C-N 3.34Å; R433-G435 PolarHBondContact O-N 2.85Å
434	P	66.2	Low	64.4	Low	89 Å²	89	134.5 Å²	134.5	58%	0.578	65%	0.648	S	S	*	*			trans	-61	102	173.9	23.3	-30.3	0	0	0	107.6	W432 L436	W432-P434 HydrophobicContact CH2-CB 3.85Å; W432-P434 HydrophobicContact CH2-CG 4.33Å; W432-P434 HydrophobicContact CZ2-CB 3.99Å; W432-P434 HydrophobicContact CZ3-CB 4.32Å; W432-P434 HydrophobicContact CZ3-CG 4.33Å; P434-L436 PolarHBondContact O-N 2.92Å; P434-L436 VanDerWaalsContact O-N 3.08Å
435	G	58.8	Low	63	Low	52 Å²	52	138.4 Å²	138.4	54%	0.536	66%	0.662	S	S	.	*			trans	-63.4	114	175.5	0	0	0	0	0	107.6	R433 L437	R433-G435 VanDerWaalsContact C-N 3.34Å; R433-G435 PolarHBondContact O-N 2.85Å; G435-L437 VanDerWaalsContact C-N 3.31Å; G435-L437 PolarHBondContact O-N 3.08Å
436	L	50	Low	61.5	Low	167 Å²	167	138.8 Å²	138.8	87%	0.874	66%	0.664	S	S	*	*			trans	-56.3	106.7	154.7	-84.6	151.8	0	0	0	104.8	P434 K438	P434-L436 PolarHBondContact O-N 2.92Å; P434-L436 VanDerWaalsContact O-N 3.08Å; L436-K438 PolarHBondContact O-N 2.8Å
437	L	48.3	Very low	60.1	Low	155 Å²	155	136.3 Å²	136.3	81%	0.812	65%	0.653	S	S	*	*			trans	-53.2	92.4	167.5	-94.3	138.4	0	0	0	106.4	G435 K439	G435-L437 VanDerWaalsContact C-N 3.31Å; G435-L437 PolarHBondContact O-N 3.08Å; L437-K439 VanDerWaalsContact C-N 3.27Å; L437-K439 PolarHBondContact O-N 2.81Å
438	K	42	Very low	58.6	Low	196 Å²	196	139.8 Å²	139.8	85%	0.852	66%	0.663	S	S	*	*			trans	-58.2	104.8	163	-91.3	-176.3	174.9	178.9	0	103	L436 S440	L436-K438 PolarHBondContact O-N 2.8Å; K438-S440 VanDerWaalsContact C-N 3.27Å; K438-S440 PolarHBondContact O-N 2.67Å
439	K	38.2	Very low	56.8	Low	194 Å²	194	143.6 Å²	143.6	84%	0.843	68%	0.682	S	S	*	*			trans	-49.6	106	161.7	-86.2	-177.2	174	-179.8	0	104.7	L437 K441	L437-K439 VanDerWaalsContact C-N 3.27Å; L437-K439 PolarHBondContact O-N 2.81Å; K439-K441 PolarHBondContact O-N 3.02Å
440	S	37.3	Very low	54.9	Low	80 Å²	80	150.2 Å²	150.2	56%	0.559	71%	0.705	S	S	*	*			trans	-58.8	102.9	163.2	178.5	0	0	0	0	103.9	K438 Y442	K438-S440 VanDerWaalsContact C-N 3.27Å; K438-S440 PolarHBondContact O-N 2.67Å; S440-Y442 VanDerWaalsContact C-N 3.27Å; S440-Y442 PolarHBondContact O-N 2.87Å
441	K	32	Very low	52.8	Low	204 Å²	204	158.2 Å²	158.2	89%	0.887	74%	0.74	S	S	*	*			trans	-65.5	100.4	166.1	-86.7	-175.7	172.6	-177.2	0	104.2	K439	K439-K441 PolarHBondContact O-N 3.02Å
442	Y	34.7	Very low	50.4	Low	278 Å²	278	155.4 Å²	155.4	100%	1.09	74%	0.74	S	S	*	*			trans	-75.9	0	156.2	-70	-76.5	0	0	0	108.5	S440	S440-Y442 VanDerWaalsContact C-N 3.27Å; S440-Y442 PolarHBondContact O-N 2.87Å

Retrieved 442 of 442 residues in 193.2 ms (Link to these results)

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