A0A087XJQ0_POEFO Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession A0A087XJQ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 986 aa.

						>A0A087XJQ0_POEFO|A0A087XJQ0
MDCNPRSLLFILHLLMSCVVPAFFIIYPPNEVNLLDSKASQGELGWISYPSHGWEEISGVDEHYTPIRTFQVCNVMEYSQNNWLRTNWIPRQSAQKIYVELKFTLRDCNSIPLVLGTCKETFNLLYLETDDDQGSHFREHQFQKIDTIAADESFTQTDLGDRILKLNTEVREVGPLSKKGFYLAFQDVGACVALVSVRVYFKKCPQTVKNLASFPDTVPMDSQSLVEVKGLCVNYSKEEEPPRMYCSTEGEWLVPIGKCLCNPGYEERISTCQMCRAGFYKSTHGNMECSKCPPHSFSHHEGSLHCGCEKNYFRAEGDPASMACTRPPSAPRNVISSINETSVILDWSWPEDTGGRRDITFNVLCKRCRGAAANVSTSGTLNCEPCRSNVRFLPRATGLHNTTVTVGDLLAHTNYTFEIEAQNGVSSLAPKMRQYAAVTITTNQAAPSPVTVIRKEKTSRNSVSLSWQEPDRPNGIILDYEIKYYEKEEQETSYTILRARGCNVTLNGLKPNTAYLLQIRARTAAGYGASSPSFQFETSPDSAFSISSENSQVVLIAISCAVAIILLTVLLYVLIGRFCCRSKSKHPDEKRLHFGNGHLRLPGIRTYVDPHTYEDPSQAVHEFAKELDASCIAIDKVVGAGEFGEVCSGRLKLPSKKEICVAIKTLKGGYTDKQRRDFLAEASIMGQFDHPNIIRLEGVVTRSKPVMIVTEYMENGSLDSFLRKNDAQFTGIQLVGMLRGIASGMKYLSDMGYVHRDLAARNILVNSNLVCKVSDFGLSRVLEDDPEAAYTTRGGKIPIRWTAPEAIAYRKFTSASDAWSYGIVLWEVMSYGERPYWEMSNQDVIKAVDKGYPLPPPMDCPATLYQLMLDCWQKERNNRPKFDQIVSILDKLIRNPCSLKITANTTSRPANLLLDRSSAEVPPVGTMGDWMDAMRTLPCKEAFSGVSYSSCDTLAKTSTDRVVLTEVHITPATCPEWEPSMGITTL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	46.2	Very low	237 Å²	237	138.2 Å²	138.2	100%	1.167	72%	0.721	S	S	*	*				0	110.7	0	-80.8	178.1	170.5	0	0	106.3	C3	M1-C3 PolarHBondContact O-N 2.97Å
2	D	37.3	Very low	46.5	Very low	167 Å²	167	136.3 Å²	136.3	89%	0.893	71%	0.711	S	S	*	*			trans	-66.5	119.1	-167.9	-62.6	-55.3	0	0	0	112.4	N4	D2-N4 PolarHBondContact O-N 2.81Å
3	C	33.5	Very low	46.7	Very low	129 Å²	129	136 Å²	136	87%	0.872	70%	0.704	S	S	*	*			trans	-82.4	97	170	-87.9	0	0	0	0	109.4	M1 P5	M1-C3 PolarHBondContact O-N 2.97Å; C3-P5 WeakPolarHBondContact O-CD 3.17Å
4	N	42	Very low	46.9	Very low	101 Å²	101	134.2 Å²	134.2	54%	0.54	70%	0.695	S	S	.	*			trans	-78.5	119.5	175.4	-167.4	-13.3	0	0	0	110.2	D2 R6 S7	D2-N4 PolarHBondContact O-N 2.81Å; N4-R6 PolarHBondContact O-N 3.41Å; N4-S7 PolarHBondContact O-N 3.02Å
5	P	48.8	Very low	46.8	Very low	97 Å²	97	133.3 Å²	133.3	63%	0.63	69%	0.691	S	S	*	*	H	α-helix	trans	-66	-7.6	-175.6	24.3	-33	0	0	0	114.2	C3	C3-P5 WeakPolarHBondContact O-CD 3.17Å
6	R	49.2	Very low	46.5	Very low	203 Å²	203	134.2 Å²	134.2	77%	0.766	69%	0.693	S	S	*	*	H	α-helix	trans	-75.9	-25.5	175.2	-75	-176.9	168.7	-179.7	-2.9	114.3	N4 F10	N4-R6 PolarHBondContact O-N 3.41Å; R6-F10 PolarHBondContact O-N 2.79Å
7	S	48.8	Very low	46.1	Very low	78 Å²	78	131.2 Å²	131.2	55%	0.545	69%	0.686	S	S	.	*	H	α-helix	trans	-74.8	-29.7	177.5	-81	0	0	0	0	113	N4 I11	N4-S7 PolarHBondContact O-N 3.02Å; S7-I11 WeakPolarHBondContact O-CG1 3.31Å; S7-I11 PolarHBondContact O-N 3.34Å
8	L	50.3	Low	45.8	Very low	135 Å²	135	130 Å²	130	71%	0.707	69%	0.69	S	S	*	*	H	α-helix	trans	-70.8	-38	175.1	-104.4	100.6	0	0	0	112.1	F10 I11 L12	L8-F10 VanDerWaalsContact C-N 3.33Å; L8-F10 PolarHBondContact O-N 2.9Å; L8-I11 PolarHBondContact O-N 3.4Å; L8-L12 WeakPolarHBondContact O-CB 3.17Å; L8-L12 PolarHBondContact O-N 3.05Å
9	L	51.9	Low	45.5	Very low	114 Å²	114	128.6 Å²	128.6	60%	0.597	69%	0.686	S	S	*	*	H	α-helix	trans	-67.5	-33.6	176.9	-110.3	90.9	0	0	0	112.6	L12 H13	L9-L12 PolarHBondContact O-N 2.82Å; L9-H13 WeakPolarHBondContact O-CB 3.24Å; L9-H13 PolarHBondContact O-N 2.8Å
10	F	54.1	Low	45.1	Very low	152 Å²	152	128.4 Å²	128.4	67%	0.667	69%	0.69	S	S	*	*	H	α-helix	trans	-71.5	-36.4	178.2	-130.4	-89.2	0	0	0	112.1	R6 L8 L14	R6-F10 PolarHBondContact O-N 2.79Å; L8-F10 VanDerWaalsContact C-N 3.33Å; L8-F10 PolarHBondContact O-N 2.9Å; F10-L14 HydrophobicContact CD1-CD1 4.48Å; F10-L14 WeakPolarHBondContact O-CB 2.91Å; F10-L14 PolarHBondContact O-N 3.27Å
11	I	54.9	Low	44.7	Very low	107 Å²	107	126.7 Å²	126.7	55%	0.549	69%	0.685	S	S	.	*	H	α-helix	trans	-71	-37.1	174.4	-66.6	169.8	0	0	0	110.8	S7 L8 L14 L15	S7-I11 WeakPolarHBondContact O-CG1 3.31Å; S7-I11 PolarHBondContact O-N 3.34Å; L8-I11 PolarHBondContact O-N 3.4Å; I11-L14 PolarHBondContact O-N 3.3Å; I11-L15 HydrophobicContact CG2-CD1 3.85Å; I11-L15 WeakPolarHBondContact O-CB 3.46Å; I11-L15 WeakPolarHBondContact O-CG 3.39Å; I11-L15 PolarHBondContact O-N 2.62Å
12	L	50.2	Low	44.8	Very low	115 Å²	115	118.2 Å²	118.2	60%	0.602	65%	0.653	S	S	*	*	H	α-helix	trans	-67.4	-37.7	175.5	-144.4	83	0	0	0	111.9	L8 L9 M16	L8-L12 WeakPolarHBondContact O-CB 3.17Å; L8-L12 PolarHBondContact O-N 3.05Å; L9-L12 PolarHBondContact O-N 2.82Å; L12-M16 WeakPolarHBondContact O-CB 3.11Å; L12-M16 WeakPolarHBondContact O-CG 3.48Å; L12-M16 PolarHBondContact O-N 2.91Å
13	H	49.2	Very low	44.9	Very low	133 Å²	133	119.4 Å²	119.4	62%	0.616	65%	0.651	S	S	*	*	H	α-helix	trans	-71.2	-36.2	174.7	-95.3	-56.9	0	0	0	113.1	L9 M16 S17	L9-H13 WeakPolarHBondContact O-CB 3.24Å; L9-H13 PolarHBondContact O-N 2.8Å; H13-M16 PolarHBondContact O-N 2.84Å; H13-S17 WeakPolarHBondContact O-CB 3.22Å; H13-S17 PolarHBondContact O-N 3.26Å; H13-S17 PolarHBondContact O-OG 2.95Å; H13-S17 VanDerWaalsContact O-OG 3.1Å
14	L	48.8	Very low	45.5	Very low	111 Å²	111	121.7 Å²	121.7	58%	0.581	65%	0.646	S	S	*	*	H	α-helix	trans	-69	-34.2	174.9	-126.6	86.7	0	0	0	112.5	F10 I11 S17	F10-L14 HydrophobicContact CD1-CD1 4.48Å; F10-L14 WeakPolarHBondContact O-CB 2.91Å; F10-L14 PolarHBondContact O-N 3.27Å; I11-L14 PolarHBondContact O-N 3.3Å; L14-S17 PolarHBondContact O-OG 2.8Å
15	L	45.8	Very low	46.3	Very low	120 Å²	120	121 Å²	121	63%	0.628	64%	0.642	S	S	*	*	H	α-helix	trans	-75	-30.9	175.5	-77.7	164.3	0	0	0	112.4	I11	I11-L15 HydrophobicContact CG2-CD1 3.85Å; I11-L15 WeakPolarHBondContact O-CB 3.46Å; I11-L15 WeakPolarHBondContact O-CG 3.39Å; I11-L15 PolarHBondContact O-N 2.62Å
16	M	41.6	Very low	46.8	Very low	148 Å²	148	124 Å²	124	73%	0.729	65%	0.651	S	S	*	*	H	α-helix	trans	-82.5	-18.5	175.5	-80.2	-66.6	-159.8	0	0	114.1	L12 H13	L12-M16 WeakPolarHBondContact O-CB 3.11Å; L12-M16 WeakPolarHBondContact O-CG 3.48Å; L12-M16 PolarHBondContact O-N 2.91Å; H13-M16 PolarHBondContact O-N 2.84Å
17	S	40.1	Very low	48	Very low	83 Å²	83	117 Å²	117	58%	0.58	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-7.3	178.2	60.4	0	0	0	0	114.8	H13 L14	H13-S17 WeakPolarHBondContact O-CB 3.22Å; H13-S17 PolarHBondContact O-N 3.26Å; H13-S17 PolarHBondContact O-OG 2.95Å; H13-S17 VanDerWaalsContact O-OG 3.1Å; L14-S17 PolarHBondContact O-OG 2.8Å
18	C	40.8	Very low	49.6	Very low	110 Å²	110	116 Å²	116	74%	0.743	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	9.8	179.1	-78.6	0	0	0	0	114.2
19	V	40.3	Very low	51.1	Low	104 Å²	104	114.3 Å²	114.3	63%	0.63	61%	0.614	S	S	*	*			trans	-115.6	79.6	171	-169.3	0	0	0	0	107.9	P21	V19-P21 WeakPolarHBondContact O-CD 3.28Å
20	V	37.1	Very low	52.8	Low	124 Å²	124	110 Å²	110	75%	0.752	59%	0.591	S	S	*	*			trans	-60.9	123.6	148.4	-179	0	0	0	0	104.6	A22	V20-A22 PolarHBondContact O-N 3.25Å
21	P	36.5	Very low	54.6	Low	92 Å²	92	104.3 Å²	104.3	60%	0.597	57%	0.567	S	S	*	*			trans	-70.9	85.3	170.6	30.1	-29.3	0	0	0	106.2	V19 F23	V19-P21 WeakPolarHBondContact O-CD 3.28Å; P21-F23 PolarHBondContact O-N 2.86Å
22	A	39.7	Very low	56.3	Low	60 Å²	60	100.8 Å²	100.8	50%	0.496	55%	0.55	S	S	.	.			trans	-61.1	103.8	149.1	0	0	0	0	0	103.9	V20 F24	V20-A22 PolarHBondContact O-N 3.25Å; A22-F24 HydrophobicContact CB-CD2 4.32Å; A22-F24 HydrophobicContact CB-CE2 4.02Å; A22-F24 HydrophobicContact CB-CZ 4.41Å; A22-F24 WeakPolarHBondContact O-CD2 3.33Å; A22-F24 PolarHBondContact O-N 2.87Å
23	F	40.6	Very low	58.3	Low	191 Å²	191	97.3 Å²	97.3	84%	0.838	53%	0.532	S	S	*	.			trans	-58.2	92	166.9	-84.7	-93.6	0	0	0	106.3	P21 I25	P21-F23 PolarHBondContact O-N 2.86Å; F23-I25 PolarHBondContact O-N 2.84Å; F23-I25 VanDerWaalsContact O-N 3.07Å
24	F	45.8	Very low	60.4	Low	178 Å²	178	92 Å²	92	78%	0.781	51%	0.508	S	S	*	.			trans	-68.6	108.2	170.9	-78.1	-79.6	0	0	0	105.9	A22 I26	A22-F24 HydrophobicContact CB-CD2 4.32Å; A22-F24 HydrophobicContact CB-CE2 4.02Å; A22-F24 HydrophobicContact CB-CZ 4.41Å; A22-F24 WeakPolarHBondContact O-CD2 3.33Å; A22-F24 PolarHBondContact O-N 2.87Å; F24-I26 PolarHBondContact O-N 3.39Å
25	I	57.9	Low	62.5	Low	86 Å²	86	88.3 Å²	88.3	44%	0.441	49%	0.489	S	S	.	.			trans	-59.2	113.7	166.5	-57.6	171.7	0	0	0	105.6	F23 Y27	F23-I25 PolarHBondContact O-N 2.84Å; F23-I25 VanDerWaalsContact O-N 3.07Å; I25-Y27 HydrophobicContact CB-CD2 4.46Å; I25-Y27 HydrophobicContact CB-CE1 4.36Å; I25-Y27 HydrophobicContact CB-CE2 3.66Å; I25-Y27 WeakPolarHBondContact CD1-OH 3.22Å; I25-Y27 HydrophobicContact CG2-CD1 4.07Å; I25-Y27 HydrophobicContact CG2-CD2 4.24Å; I25-Y27 HydrophobicContact CG2-CE1 3.49Å; I25-Y27 VanDerWaalsContact CG2-CE1 3.49Å; I25-Y27 HydrophobicContact CG2-CE2 3.65Å; I25-Y27 HydrophobicContact CG2-CG 4.45Å; I25-Y27 WeakPolarHBondContact CG2-OH 3.46Å; I25-Y27 WeakPolarHBondContact O-CD2 3.47Å; I25-Y27 VanDerWaalsContact O-CE2 3.23Å; I25-Y27 WeakPolarHBondContact O-CE2 3.04Å; I25-Y27 PolarHBondContact O-N 2.85Å
26	I	59.3	Low	64.6	Low	160 Å²	160	83.6 Å²	83.6	82%	0.821	46%	0.464	S	S	*	.			trans	-84.8	106.7	-179.9	-58.2	176.2	0	0	0	106.9	F24	F24-I26 PolarHBondContact O-N 3.39Å
27	Y	74.1	Confident	66.8	Low	57 Å²	57	76.7 Å²	76.7	22%	0.224	43%	0.43	C	S	.	.			trans	-89.6	158.4	174	-54.8	-85.1	0	0	0	110.6	I25 N33 D36	I25-Y27 HydrophobicContact CB-CD2 4.46Å; I25-Y27 HydrophobicContact CB-CE1 4.36Å; I25-Y27 HydrophobicContact CB-CE2 3.66Å; I25-Y27 WeakPolarHBondContact CD1-OH 3.22Å; I25-Y27 HydrophobicContact CG2-CD1 4.07Å; I25-Y27 HydrophobicContact CG2-CD2 4.24Å; I25-Y27 HydrophobicContact CG2-CE1 3.49Å; I25-Y27 VanDerWaalsContact CG2-CE1 3.49Å; I25-Y27 HydrophobicContact CG2-CE2 3.65Å; I25-Y27 HydrophobicContact CG2-CG 4.45Å; I25-Y27 WeakPolarHBondContact CG2-OH 3.46Å; I25-Y27 WeakPolarHBondContact O-CD2 3.47Å; I25-Y27 VanDerWaalsContact O-CE2 3.23Å; I25-Y27 WeakPolarHBondContact O-CE2 3.04Å; I25-Y27 PolarHBondContact O-N 2.85Å; Y27-N33 VanDerWaalsContact CD1-ND2 3.3Å; Y27-N33 WeakPolarHBondContact CD1-ND2 2.98Å; Y27-N33 WeakPolarHBondContact CD2-ND2 3.16Å; Y27-N33 VanDerWaalsContact CE1-ND2 3.29Å; Y27-N33 WeakPolarHBondContact CE1-ND2 3.3Å; Y27-N33 WeakPolarHBondContact CE2-ND2 3.38Å; Y27-D36 PolarHBondContact OH-OD2 3.18Å
28	P	82.8	Confident	68.9	Low	57 Å²	57	74.8 Å²	74.8	37%	0.37	41%	0.411	S	S	.	.			trans	-52.5	140.2	173.2	-27	36.2	0	0	0	112	N30 E31	P28-N30 WeakPolarHBondContact CB-OD1 3.27Å; P28-N30 PolarHBondContact O-N 3.23Å; P28-N30 VanDerWaalsContact O-N 3.14Å; P28-E31 HydrophobicContact CB-CG 4.28Å; P28-E31 PolarHBondContact O-N 3.18Å
29	P	81.5	Confident	70.7	Confident	99 Å²	99	72.4 Å²	72.4	64%	0.643	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.7	-175.4	27.6	-35.4	0	0	0	113.9
30	N	88.2	Confident	72	Confident	24 Å²	24	69.9 Å²	69.9	13%	0.128	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-5	173.6	61.8	-34.5	0	0	0	113.1	P28 K202 K203 E249	P28-N30 WeakPolarHBondContact CB-OD1 3.27Å; P28-N30 PolarHBondContact O-N 3.23Å; P28-N30 VanDerWaalsContact O-N 3.14Å; N30-K202 CarbonylContact O-C 3.52Å; N30-K202 VanDerWaalsContact O-CA 3.23Å; N30-K202 WeakPolarHBondContact O-CA 3.3Å; N30-K203 VanDerWaalsContact CA-O 3.23Å; N30-K203 WeakPolarHBondContact CA-O 3.22Å; N30-K203 VanDerWaalsContact CB-O 3.3Å; N30-K203 WeakPolarHBondContact CB-O 3.36Å; N30-K203 PolarHBondContact O-N 3.16Å; N30-E249 PolarHBondContact ND2-O 3.36Å
31	E	91.4	Very high	73.2	Confident	32 Å²	32	72.3 Å²	72.3	15%	0.15	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.6	178.5	-66.2	-178	176.3	0	0	111.4	P28 R198 Y200 K202	P28-E31 HydrophobicContact CB-CG 4.28Å; P28-E31 PolarHBondContact O-N 3.18Å; E31-R198 IonicContact OE2-CZ 3.13Å; E31-R198 IonicContact OE2-NH1 3.4Å; E31-R198 PolarHBondContact OE2-NH1 3.25Å; E31-R198 VanDerWaalsContact OE2-NH1 3.1Å; E31-R198 IonicContact OE2-NH2 3.97Å; E31-R198 PolarHBondContact OE2-NH2 2.71Å; E31-Y200 HydrophobicContact CB-CD2 4.04Å; E31-Y200 VanDerWaalsContact CD-CE2 3.48Å; E31-Y200 HydrophobicContact CG-CD2 3.8Å; E31-Y200 HydrophobicContact CG-CE2 3.87Å; E31-Y200 WeakPolarHBondContact OE1-CE2 3.38Å; E31-K202 HydrophobicContact CG-CG 4.49Å
32	V	91.2	Very high	74.5	Confident	33 Å²	33	69.9 Å²	69.9	20%	0.2	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	114.1	174.9	-178.2	0	0	0	0	108.6	Y200 F201 K203	V32-Y200 CarbonylContact O-C 3.56Å; V32-Y200 VanDerWaalsContact O-CA 3.23Å; V32-Y200 WeakPolarHBondContact O-CA 3.44Å; V32-Y200 WeakPolarHBondContact O-CB 3.34Å; V32-F201 HydrophobicContact CB-CD1 3.86Å; V32-F201 HydrophobicContact CB-CE1 3.41Å; V32-F201 VanDerWaalsContact CB-CE1 3.41Å; V32-F201 HydrophobicContact CB-CE2 4.13Å; V32-F201 HydrophobicContact CB-CG 4.42Å; V32-F201 HydrophobicContact CB-CZ 3.56Å; V32-F201 HydrophobicContact CG1-CD1 4.2Å; V32-F201 HydrophobicContact CG1-CE1 3.39Å; V32-F201 HydrophobicContact CG1-CZ 3.69Å; V32-F201 HydrophobicContact CG2-CE1 4.27Å; V32-F201 HydrophobicContact CG2-CE2 4.19Å; V32-F201 HydrophobicContact CG2-CZ 3.89Å; V32-F201 PolarHBondContact N-O 3.16Å; V32-F201 WeakPolarHBondContact O-CD1 3.42Å; V32-F201 PolarHBondContact O-N 3.2Å; V32-K203 HydrophobicContact CG2-CD 3.74Å; V32-K203 HydrophobicContact CG2-CG 4.09Å
33	N	91.9	Very high	75.9	Confident	41 Å²	41	74.8 Å²	74.8	22%	0.219	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.6	179.3	-66.5	-42.8	0	0	0	111.7	Y27 R198 Y200	Y27-N33 VanDerWaalsContact CD1-ND2 3.3Å; Y27-N33 WeakPolarHBondContact CD1-ND2 2.98Å; Y27-N33 WeakPolarHBondContact CD2-ND2 3.16Å; Y27-N33 VanDerWaalsContact CE1-ND2 3.29Å; Y27-N33 WeakPolarHBondContact CE1-ND2 3.3Å; Y27-N33 WeakPolarHBondContact CE2-ND2 3.38Å; N33-R198 VanDerWaalsContact OD1-CZ 3.24Å; N33-R198 PolarHBondContact OD1-NE 3.07Å; N33-R198 PolarHBondContact OD1-NH2 3.05Å; N33-Y200 WeakPolarHBondContact OD1-CB 3.25Å
34	L	92.5	Very high	77.5	Confident	23 Å²	23	66.1 Å²	66.1	12%	0.12	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-32.8	171.6	-57.3	-178.9	0	0	0	111.5	I89 Q92 A94 I97 F181 V199 F201	L34-I89 HydrophobicContact CB-CG2 3.67Å; L34-Q92 HydrophobicContact CD2-CB 4.37Å; L34-Q92 HydrophobicContact CD2-CG 3.95Å; L34-A94 HydrophobicContact CD1-CB 4.25Å; L34-I97 HydrophobicContact CD1-CG2 3.7Å; L34-F181 HydrophobicContact CD1-CE1 4.2Å; L34-F181 HydrophobicContact CD1-CZ 4.15Å; L34-V199 HydrophobicContact CB-CB 4.48Å; L34-V199 HydrophobicContact CB-CG1 4.37Å; L34-V199 HydrophobicContact CD1-CG1 4.44Å; L34-V199 PolarHBondContact N-O 3.34Å; L34-F201 HydrophobicContact CD1-CD1 4.19Å; L34-F201 HydrophobicContact CD2-CD1 3.81Å; L34-F201 HydrophobicContact CD2-CE1 3.78Å; L34-F201 HydrophobicContact CG-CD1 4Å; L34-F201 HydrophobicContact CG-CE1 4.46Å
35	L	92.4	Very high	79.3	Confident	33 Å²	33	59.8 Å²	59.8	17%	0.173	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	137.9	175.5	175.7	67.3	0	0	0	109.6	W46 T86 I89 R198 V199	L35-W46 HydrophobicContact CD2-CZ2 4.09Å; L35-T86 HydrophobicContact CD2-CG2 4.27Å; L35-I89 HydrophobicContact CB-CD1 4.07Å; L35-I89 HydrophobicContact CB-CG1 4.47Å; L35-I89 HydrophobicContact CD2-CD1 3.6Å; L35-I89 HydrophobicContact CD2-CG1 4.31Å; L35-I89 HydrophobicContact CG-CD1 4.44Å; L35-R198 CarbonylContact O-C 3.54Å; L35-R198 WeakPolarHBondContact O-CA 3.32Å; L35-V199 HydrophobicContact CB-CB 3.98Å; L35-V199 HydrophobicContact CB-CG2 4.01Å; L35-V199 HydrophobicContact CD2-CG2 4.14Å; L35-V199 PolarHBondContact N-O 2.89Å; L35-V199 VanDerWaalsContact N-O 3.09Å; L35-V199 PolarHBondContact O-N 3.28Å
36	D	90.6	Very high	80.8	Confident	20 Å²	20	56.8 Å²	56.8	11%	0.107	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	114.8	164.6	-170.6	-30.3	0	0	0	109	Y27 K38 A39	Y27-D36 PolarHBondContact OH-OD2 3.18Å; D36-K38 VanDerWaalsContact C-N 3.28Å; D36-K38 PolarHBondContact O-N 2.78Å; D36-K38 WeakPolarHBondContact OD1-CB 3.16Å; D36-K38 PolarHBondContact OD1-N 3.44Å; D36-A39 HydrophobicContact CB-CB 4Å; D36-A39 PolarHBondContact O-N 2.77Å; D36-A39 PolarHBondContact OD1-N 2.88Å
37	S	89.1	Confident	82.3	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.021	30%	0.297	C	S	.	.	S	Bend	trans	-68.2	-24.7	-179.5	68.8	0	0	0	0	113.3	S196 V197	S37-S196 WeakPolarHBondContact OG-CA 3.4Å; S37-V197 PolarHBondContact N-O 2.98Å; S37-V197 PolarHBondContact OG-N 2.7Å; S37-V197 PolarHBondContact OG-O 3.29Å
38	K	83.8	Confident	83.1	Confident	43 Å²	43	50 Å²	50	19%	0.187	30%	0.295	C	S	.	.	S	Bend	trans	-79.3	-26.7	178	-71.4	-176.6	168.1	-174.3	0	112.9	D36 S40 I67 S196	D36-K38 VanDerWaalsContact C-N 3.28Å; D36-K38 PolarHBondContact O-N 2.78Å; D36-K38 WeakPolarHBondContact OD1-CB 3.16Å; D36-K38 PolarHBondContact OD1-N 3.44Å; K38-S40 PolarHBondContact O-N 2.81Å; K38-I67 HydrophobicContact CB-CG2 4.38Å; K38-I67 HydrophobicContact CG-CG2 4.07Å; K38-S196 WeakPolarHBondContact CD-OG 3.47Å; K38-S196 WeakPolarHBondContact CE-OG 2.71Å; K38-S196 WeakPolarHBondContact CG-OG 3.24Å
39	A	77.3	Confident	83.4	Confident	60 Å²	60	53 Å²	53	50%	0.496	30%	0.301	S	S	.	.	S	Bend	trans	-70.9	-15.2	178.6	0	0	0	0	0	113	D36	D36-A39 HydrophobicContact CB-CB 4Å; D36-A39 PolarHBondContact O-N 2.77Å; D36-A39 PolarHBondContact OD1-N 2.88Å
40	S	67.9	Low	83.6	Confident	51 Å²	51	51.1 Å²	51.1	36%	0.357	29%	0.288	S	S	.	.			trans	-94.7	116.5	-178	-60	0	0	0	0	111	K38	K38-S40 PolarHBondContact O-N 2.81Å
41	Q	62.3	Low	83.4	Confident	175 Å²	175	54.2 Å²	54.2	82%	0.818	31%	0.311	S	S	*	.			trans	-86.2	-5.9	178.8	-66.4	-176.1	-17.4	0	0	114
42	G	64.9	Low	82.8	Confident	42 Å²	42	59.5 Å²	59.5	43%	0.433	34%	0.336	S	S	.	.	S	Bend	trans	-103.4	-175.5	177.4	0	0	0	0	0	113.5	L44	G42-L44 PolarHBondContact O-N 2.78Å
43	E	67.6	Low	82.6	Confident	163 Å²	163	58 Å²	58	76%	0.762	33%	0.327	S	S	*	.			trans	-58.9	130.9	170.4	-68.9	177.6	-179.5	0	0	109.9	G45	E43-G45 PolarHBondContact O-N 2.87Å
44	L	76.1	Confident	82.6	Confident	9 Å²	9	56.3 Å²	56.3	5%	0.047	32%	0.318	C	S	.	.			trans	-71	-20	-177.9	-74.2	166.4	0	0	0	112.4	G42 W46 R68 F70 N87	G42-L44 PolarHBondContact O-N 2.78Å; L44-W46 VanDerWaalsContact C-N 3.25Å; L44-W46 HydrophobicContact CB-CG 4.3Å; L44-W46 VanDerWaalsContact O-CD1 3.25Å; L44-W46 PolarHBondContact O-N 2.88Å; L44-R68 HydrophobicContact CD1-CB 3.77Å; L44-R68 HydrophobicContact CG-CB 4.2Å; L44-F70 HydrophobicContact CB-CE2 4.24Å; L44-F70 HydrophobicContact CB-CZ 4.34Å; L44-F70 HydrophobicContact CD1-CE2 3.69Å; L44-N87 PolarHBondContact O-ND2 2.9Å
45	G	81.9	Confident	82.6	Confident	45 Å²	45	60.1 Å²	60.1	46%	0.464	34%	0.335	S	S	.	.			trans	70.6	17.6	175.7	0	0	0	0	0	114.4	E43 N87	E43-G45 PolarHBondContact O-N 2.87Å; G45-N87 PolarHBondContact O-OD1 2.79Å; G45-N87 VanDerWaalsContact O-OD1 3.11Å
46	W	90.8	Very high	82.5	Confident	22 Å²	22	61.7 Å²	61.7	8%	0.083	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-72.8	149.5	179.1	-66.5	7.4	0	0	0	111.2	L35 L44 F70 L84 R85 T86 F185 V197	L35-W46 HydrophobicContact CD2-CZ2 4.09Å; L44-W46 VanDerWaalsContact C-N 3.25Å; L44-W46 HydrophobicContact CB-CG 4.3Å; L44-W46 VanDerWaalsContact O-CD1 3.25Å; L44-W46 PolarHBondContact O-N 2.88Å; W46-F70 HydrophobicContact CB-CE1 4.44Å; W46-F70 HydrophobicContact CB-CE2 4.36Å; W46-F70 HydrophobicContact CB-CZ 3.84Å; W46-F70 AromaticContact CD2-CE2 3.91Å; W46-F70 HydrophobicContact CD2-CE2 3.91Å; W46-F70 HydrophobicContact CD2-CZ 4.29Å; W46-F70 AromaticContact CE3-CD2 3.87Å; W46-F70 HydrophobicContact CE3-CD2 3.87Å; W46-F70 AromaticContact CE3-CE2 3.51Å; W46-F70 HydrophobicContact CE3-CE2 3.51Å; W46-F70 HydrophobicContact CE3-CZ 4.13Å; W46-F70 HydrophobicContact CG-CE2 4.32Å; W46-F70 HydrophobicContact CG-CZ 4.23Å; W46-F70 AromaticContact CZ3-CD2 4Å; W46-F70 HydrophobicContact CZ3-CD2 4Å; W46-F70 AromaticContact CZ3-CE2 3.96Å; W46-F70 HydrophobicContact CZ3-CE2 3.96Å; W46-L84 HydrophobicContact CB-CD1 3.89Å; W46-L84 HydrophobicContact CE3-CD1 4.19Å; W46-L84 HydrophobicContact CE3-CD2 3.87Å; W46-L84 HydrophobicContact CE3-CG 3.95Å; W46-L84 HydrophobicContact CZ3-CD2 4.18Å; W46-R85 CarbonylContact C-O 3.45Å; W46-R85 WeakPolarHBondContact CA-O 3.27Å; W46-R85 VanDerWaalsContact CB-O 3.25Å; W46-R85 WeakPolarHBondContact CB-O 3.45Å; W46-T86 HydrophobicContact CD2-CG2 4Å; W46-T86 HydrophobicContact CE3-CG2 4.17Å; W46-T86 HydrophobicContact CH2-CG2 4.09Å; W46-T86 HydrophobicContact CZ2-CG2 3.87Å; W46-T86 HydrophobicContact CZ3-CG2 4.21Å; W46-F185 AromaticContact CZ3-CE2 3.97Å; W46-F185 HydrophobicContact CZ3-CE2 3.97Å; W46-V197 HydrophobicContact CH2-CB 3.71Å; W46-V197 HydrophobicContact CH2-CG1 4.34Å; W46-V197 HydrophobicContact CH2-CG2 3.56Å; W46-V197 HydrophobicContact CZ3-CG2 3.96Å
47	I	90.1	Very high	82.3	Confident	48 Å²	48	63.5 Å²	63.5	25%	0.246	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.5	-173.7	-56.2	-170.3	0	0	0	109.8	L84 R85	I47-L84 WeakPolarHBondContact O-CA 3.47Å; I47-R85 PolarHBondContact N-O 3.03Å; I47-R85 PolarHBondContact O-N 3.2Å
48	S	91	Very high	82	Confident	26 Å²	26	66.9 Å²	66.9	18%	0.182	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.8	168.4	-179	0	0	0	0	111.3	P50 W54 W83	S48-P50 CarbonylContact C-O 3.43Å; S48-P50 PolarHBondContact OG-O 3.27Å; S48-W54 WeakPolarHBondContact CB-O 3.38Å; S48-W54 PolarHBondContact OG-N 3.12Å; S48-W54 PolarHBondContact OG-O 2.55Å; S48-W83 CarbonylContact C-O 3.59Å; S48-W83 VanDerWaalsContact CA-O 3.29Å; S48-W83 WeakPolarHBondContact CA-O 3.46Å
49	Y	88.6	Confident	81.7	Confident	122 Å²	122	66 Å²	66	48%	0.478	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	120.3	173	-179	-95.9	0	0	0	111.2	W83 F137 E139	Y49-W83 PolarHBondContact N-O 2.94Å; Y49-W83 PolarHBondContact O-N 2.84Å; Y49-F137 HydrophobicContact CD1-CD1 4.05Å; Y49-F137 AromaticContact CD1-CE1 3.76Å; Y49-F137 HydrophobicContact CD1-CE1 3.76Å; Y49-F137 AromaticContact CG-CD1 3.96Å; Y49-F137 HydrophobicContact CG-CD1 3.96Å; Y49-F137 HydrophobicContact CG-CE1 4.03Å; Y49-E139 WeakPolarHBondContact CE1-OE1 3.27Å
50	P	87	Confident	81.6	Confident	59 Å²	59	67.7 Å²	67.7	38%	0.383	38%	0.381	S	S	.	.	S	Bend	cis	-61.8	164.8	-8	27.9	-34.3	0	0	0	112	S48 H52 G53	S48-P50 CarbonylContact C-O 3.43Å; S48-P50 PolarHBondContact OG-O 3.27Å; P50-H52 PolarHBondContact O-N 3.3Å; P50-G53 PolarHBondContact O-N 3.01Å
51	S	82.3	Confident	81.7	Confident	88 Å²	88	66.6 Å²	66.6	62%	0.615	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.7	-176	52.3	0	0	0	0	114.6
52	H	80.3	Confident	82.1	Confident	144 Å²	144	64.7 Å²	64.7	67%	0.667	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	13.6	179.1	-52.9	-63.4	0	0	0	112.8	P50	P50-H52 PolarHBondContact O-N 3.3Å
53	G	85.8	Confident	82.5	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.01	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-73.9	177.2	0	0	0	0	0	111.4	P50 V72 N82	P50-G53 PolarHBondContact O-N 3.01Å; G53-V72 VanDerWaalsContact O-CG2 3.25Å; G53-V72 WeakPolarHBondContact O-CG2 3.48Å; G53-N82 WeakPolarHBondContact CA-OD1 3.45Å
54	W	93	Very high	82.6	Confident	6 Å²	6	71.3 Å²	71.3	2%	0.023	37%	0.374	C	S	.	.	S	Bend	trans	-93.7	128.1	175.5	-72.6	88.5	0	0	0	110.8	S48 F70 V72 N82 W83 L84 F185 D187 V192 L194	S48-W54 WeakPolarHBondContact CB-O 3.38Å; S48-W54 PolarHBondContact OG-N 3.12Å; S48-W54 PolarHBondContact OG-O 2.55Å; W54-F70 HydrophobicContact CE3-CB 3.92Å; W54-F70 HydrophobicContact CZ3-CB 4.4Å; W54-V72 HydrophobicContact CD2-CB 4.02Å; W54-V72 HydrophobicContact CD2-CG1 3.78Å; W54-V72 HydrophobicContact CE3-CB 4.08Å; W54-V72 HydrophobicContact CE3-CG1 3.79Å; W54-V72 HydrophobicContact CG-CB 4.42Å; W54-V72 HydrophobicContact CH2-CG1 3.7Å; W54-V72 HydrophobicContact CZ2-CG1 3.65Å; W54-V72 HydrophobicContact CZ3-CB 4.48Å; W54-V72 HydrophobicContact CZ3-CG1 3.75Å; W54-N82 PolarHBondContact NE1-O 3.04Å; W54-W83 VanDerWaalsContact CD1-C 3.49Å; W54-L84 HydrophobicContact CB-CB 4.07Å; W54-L84 HydrophobicContact CB-CD1 4.24Å; W54-L84 HydrophobicContact CB-CD2 4.47Å; W54-L84 HydrophobicContact CD2-CB 3.97Å; W54-L84 HydrophobicContact CD2-CD2 4.11Å; W54-L84 HydrophobicContact CE3-CD2 4.11Å; W54-L84 HydrophobicContact CG-CB 3.63Å; W54-L84 HydrophobicContact CG-CD2 4.31Å; W54-L84 HydrophobicContact CG-CG 4.42Å; W54-F185 HydrophobicContact CZ2-CB 4.21Å; W54-D187 HydrophobicContact CZ2-CB 3.87Å; W54-V192 HydrophobicContact CH2-CG1 3.48Å; W54-V192 VanDerWaalsContact CH2-CG1 3.48Å; W54-V192 HydrophobicContact CZ2-CG1 4.23Å; W54-V192 HydrophobicContact CZ3-CG1 4.02Å; W54-L194 HydrophobicContact CE3-CD1 4.4Å; W54-L194 HydrophobicContact CH2-CD1 3.68Å; W54-L194 HydrophobicContact CH2-CG 3.91Å; W54-L194 HydrophobicContact CZ2-CD1 4.46Å; W54-L194 HydrophobicContact CZ3-CB 4.49Å; W54-L194 HydrophobicContact CZ3-CD1 3.66Å; W54-L194 HydrophobicContact CZ3-CG 3.8Å
55	E	91.5	Very high	82.6	Confident	103 Å²	103	73.6 Å²	73.6	48%	0.481	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.8	179.9	-63.3	-173.2	160.7	0	0	110.9	F70 Q71	E55-F70 CarbonylContact O-C 3.48Å; E55-F70 WeakPolarHBondContact O-CA 3.47Å; E55-Q71 PolarHBondContact N-O 3.22Å; E55-Q71 PolarHBondContact O-N 3.19Å
56	E	89.8	Confident	82.5	Confident	65 Å²	65	75.9 Å²	75.9	30%	0.304	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.7	174.1	-170.3	175.6	173.5	0	0	110.4	R68 F70	E56-R68 WeakPolarHBondContact OE1-CD 3.47Å; E56-F70 HydrophobicContact CB-CD1 4.01Å; E56-F70 HydrophobicContact CB-CE1 3.63Å; E56-F70 HydrophobicContact CB-CZ 4.18Å; E56-F70 HydrophobicContact CG-CD1 4.46Å; E56-F70 HydrophobicContact CG-CE1 3.96Å; E56-F70 HydrophobicContact CG-CZ 3.99Å
57	I	86.5	Confident	82.2	Confident	59 Å²	59	75.1 Å²	75.1	30%	0.303	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	146.6	-178.2	-57.3	-167.2	0	0	0	110.1	T69 Q71	I57-T69 PolarHBondContact N-O 2.04Å; I57-T69 PolarHBondContact O-N 3.44Å; I57-T69 VanDerWaalsContact O-O 3.13Å; I57-T69 PolarHBondContact O-OG1 2.65Å; I57-Q71 HydrophobicContact CD1-CG 3.48Å; I57-Q71 VanDerWaalsContact CD1-CG 3.48Å; I57-Q71 HydrophobicContact CG1-CG 4.11Å
58	S	84.1	Confident	82.1	Confident	74 Å²	74	76.5 Å²	76.5	52%	0.517	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	119.9	170.5	-58.4	0	0	0	0	110.1	R68	S58-R68 VanDerWaalsContact OG-CZ 3.31Å; S58-R68 PolarHBondContact OG-NH1 3.04Å
59	G	76.6	Confident	82	Confident	24 Å²	24	76 Å²	76	25%	0.247	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-177	172.2	0	0	0	0	0	111.6	P66 I67	G59-P66 WeakPolarHBondContact O-CA 3.4Å; G59-I67 PolarHBondContact N-O 2.85Å; G59-I67 PolarHBondContact O-N 2.88Å
60	V	76.1	Confident	82.2	Confident	95 Å²	95	70.6 Å²	70.6	58%	0.576	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	144	167.2	-67.1	0	0	0	0	109.1	T65	V60-T65 CarbonylContact C-O 3.56Å; V60-T65 VanDerWaalsContact CA-O 3.29Å; V60-T65 WeakPolarHBondContact CA-O 3.4Å
61	D	69.9	Low	82.5	Confident	29 Å²	29	71.5 Å²	71.5	16%	0.155	37%	0.369	C	S	.	.			trans	-80.8	179.2	172.3	76	-1.2	0	0	0	112	H63 Y64 T65 I67	D61-H63 PolarHBondContact O-N 3.49Å; D61-H63 VanDerWaalsContact OD1-C 3.28Å; D61-H63 WeakPolarHBondContact OD1-CA 3.49Å; D61-H63 WeakPolarHBondContact OD1-CB 3.37Å; D61-H63 PolarHBondContact OD1-N 3.27Å; D61-Y64 PolarHBondContact O-N 3.07Å; D61-Y64 PolarHBondContact OD1-N 3.16Å; D61-Y64 VanDerWaalsContact OD1-N 3.14Å; D61-T65 PolarHBondContact N-O 2.97Å; D61-T65 WeakPolarHBondContact OD1-CA 3.3Å; D61-T65 VanDerWaalsContact OD1-CB 3.25Å; D61-T65 WeakPolarHBondContact OD1-CB 3.23Å; D61-T65 PolarHBondContact OD1-N 3.39Å; D61-T65 PolarHBondContact OD1-OG1 2.87Å; D61-I67 HydrophobicContact CB-CD1 4.01Å; D61-I67 HydrophobicContact CB-CG1 4.43Å; D61-I67 HydrophobicContact CB-CG2 3.98Å
62	E	71.1	Confident	83.1	Confident	135 Å²	135	67.6 Å²	67.6	63%	0.631	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-19.8	176.9	-66.6	167.2	-165	0	0	113.7	L166	E62-L166 WeakPolarHBondContact OE1-CD2 3.48Å
63	H	71.6	Confident	83.6	Confident	148 Å²	148	63.4 Å²	63.4	69%	0.685	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	13.5	179.9	-58.4	85	0	0	0	112.3	D61 T65	D61-H63 PolarHBondContact O-N 3.49Å; D61-H63 VanDerWaalsContact OD1-C 3.28Å; D61-H63 WeakPolarHBondContact OD1-CA 3.49Å; D61-H63 WeakPolarHBondContact OD1-CB 3.37Å; D61-H63 PolarHBondContact OD1-N 3.27Å; H63-T65 PolarHBondContact O-N 3.27Å
64	Y	70.9	Confident	83.8	Confident	195 Å²	195	65.9 Å²	65.9	77%	0.765	34%	0.341	S	S	*	.			trans	62.1	20.1	-176.4	-60.5	-86	0	0	0	114.7	D61	D61-Y64 PolarHBondContact O-N 3.07Å; D61-Y64 PolarHBondContact OD1-N 3.16Å; D61-Y64 VanDerWaalsContact OD1-N 3.14Å
65	T	76.5	Confident	83.6	Confident	57 Å²	57	66 Å²	66	35%	0.35	34%	0.342	S	S	.	.			trans	-77.2	131.7	174.3	-47.4	0	0	0	0	108.9	V60 D61 H63 I67	V60-T65 CarbonylContact C-O 3.56Å; V60-T65 VanDerWaalsContact CA-O 3.29Å; V60-T65 WeakPolarHBondContact CA-O 3.4Å; D61-T65 PolarHBondContact N-O 2.97Å; D61-T65 WeakPolarHBondContact OD1-CA 3.3Å; D61-T65 VanDerWaalsContact OD1-CB 3.25Å; D61-T65 WeakPolarHBondContact OD1-CB 3.23Å; D61-T65 PolarHBondContact OD1-N 3.39Å; D61-T65 PolarHBondContact OD1-OG1 2.87Å; H63-T65 PolarHBondContact O-N 3.27Å; T65-I67 PolarHBondContact O-N 3.42Å
66	P	79.5	Confident	83.3	Confident	93 Å²	93	66.6 Å²	66.6	60%	0.604	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	122.7	174.9	26.5	-33.1	0	0	0	109.7	G59	G59-P66 WeakPolarHBondContact O-CA 3.4Å
67	I	85.1	Confident	83.1	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	153.9	178.5	57.4	165.9	0	0	0	110.3	K38 G59 D61 T65 T69 V195	K38-I67 HydrophobicContact CB-CG2 4.38Å; K38-I67 HydrophobicContact CG-CG2 4.07Å; G59-I67 PolarHBondContact N-O 2.85Å; G59-I67 PolarHBondContact O-N 2.88Å; D61-I67 HydrophobicContact CB-CD1 4.01Å; D61-I67 HydrophobicContact CB-CG1 4.43Å; D61-I67 HydrophobicContact CB-CG2 3.98Å; T65-I67 PolarHBondContact O-N 3.42Å; I67-T69 HydrophobicContact CD1-CG2 3.83Å; I67-T69 HydrophobicContact CG1-CG2 4.07Å; I67-V195 HydrophobicContact CD1-CG1 3.71Å
68	R	86.8	Confident	82.6	Confident	78 Å²	78	76.3 Å²	76.3	29%	0.294	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128	171.2	-64.3	-65	177.7	161.2	-4.8	109.5	L44 E56 S58	L44-R68 HydrophobicContact CD1-CB 3.77Å; L44-R68 HydrophobicContact CG-CB 4.2Å; E56-R68 WeakPolarHBondContact OE1-CD 3.47Å; S58-R68 VanDerWaalsContact OG-CZ 3.31Å; S58-R68 PolarHBondContact OG-NH1 3.04Å
69	T	88.6	Confident	82.6	Confident	16 Å²	16	77.7 Å²	77.7	10%	0.098	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	151.9	-178.6	62.5	0	0	0	0	109.5	I57 I67 L194 V195	I57-T69 PolarHBondContact N-O 2.04Å; I57-T69 PolarHBondContact O-N 3.44Å; I57-T69 VanDerWaalsContact O-O 3.13Å; I57-T69 PolarHBondContact O-OG1 2.65Å; I67-T69 HydrophobicContact CD1-CG2 3.83Å; I67-T69 HydrophobicContact CG1-CG2 4.07Å; T69-L194 VanDerWaalsContact CA-O 3.27Å; T69-L194 WeakPolarHBondContact CA-O 3.25Å; T69-L194 VanDerWaalsContact CB-O 3.31Å; T69-L194 WeakPolarHBondContact CB-O 3.07Å; T69-V195 HydrophobicContact CG2-CG1 4.5Å
70	F	92.8	Very high	83.1	Confident	8 Å²	8	77.5 Å²	77.5	4%	0.035	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.6	174.9	-72.8	-88.6	0	0	0	110.2	L44 W46 W54 E55 E56 L84 A193 L194	L44-F70 HydrophobicContact CB-CE2 4.24Å; L44-F70 HydrophobicContact CB-CZ 4.34Å; L44-F70 HydrophobicContact CD1-CE2 3.69Å; W46-F70 HydrophobicContact CB-CE1 4.44Å; W46-F70 HydrophobicContact CB-CE2 4.36Å; W46-F70 HydrophobicContact CB-CZ 3.84Å; W46-F70 AromaticContact CD2-CE2 3.91Å; W46-F70 HydrophobicContact CD2-CE2 3.91Å; W46-F70 HydrophobicContact CD2-CZ 4.29Å; W46-F70 AromaticContact CE3-CD2 3.87Å; W46-F70 HydrophobicContact CE3-CD2 3.87Å; W46-F70 AromaticContact CE3-CE2 3.51Å; W46-F70 HydrophobicContact CE3-CE2 3.51Å; W46-F70 HydrophobicContact CE3-CZ 4.13Å; W46-F70 HydrophobicContact CG-CE2 4.32Å; W46-F70 HydrophobicContact CG-CZ 4.23Å; W46-F70 AromaticContact CZ3-CD2 4Å; W46-F70 HydrophobicContact CZ3-CD2 4Å; W46-F70 AromaticContact CZ3-CE2 3.96Å; W46-F70 HydrophobicContact CZ3-CE2 3.96Å; W54-F70 HydrophobicContact CE3-CB 3.92Å; W54-F70 HydrophobicContact CZ3-CB 4.4Å; E55-F70 CarbonylContact O-C 3.48Å; E55-F70 WeakPolarHBondContact O-CA 3.47Å; E56-F70 HydrophobicContact CB-CD1 4.01Å; E56-F70 HydrophobicContact CB-CE1 3.63Å; E56-F70 HydrophobicContact CB-CZ 4.18Å; E56-F70 HydrophobicContact CG-CD1 4.46Å; E56-F70 HydrophobicContact CG-CE1 3.96Å; E56-F70 HydrophobicContact CG-CZ 3.99Å; F70-L84 HydrophobicContact CB-CD2 3.57Å; F70-L84 HydrophobicContact CD1-CD1 3.67Å; F70-L84 HydrophobicContact CD1-CD2 3.87Å; F70-L84 HydrophobicContact CD1-CG 4.43Å; F70-L84 HydrophobicContact CD2-CD2 3.92Å; F70-L84 HydrophobicContact CE1-CD1 3.7Å; F70-L84 HydrophobicContact CG-CD1 4.17Å; F70-L84 HydrophobicContact CG-CD2 3.52Å; F70-L84 HydrophobicContact CG-CG 4.49Å; F70-L84 HydrophobicContact CZ-CD1 4.23Å; F70-A193 CarbonylContact O-C 3.46Å; F70-A193 WeakPolarHBondContact O-CA 3.44Å; F70-L194 HydrophobicContact CB-CB 4.39Å; F70-L194 PolarHBondContact N-O 3.36Å; F70-L194 PolarHBondContact O-N 2.88Å
71	Q	93.3	Very high	83.9	Confident	78 Å²	78	75.8 Å²	75.8	36%	0.364	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	154.4	177.7	71.8	168.5	33.9	0	0	113	E55 I57 V192 A193	E55-Q71 PolarHBondContact N-O 3.22Å; E55-Q71 PolarHBondContact O-N 3.19Å; I57-Q71 HydrophobicContact CD1-CG 3.48Å; I57-Q71 VanDerWaalsContact CD1-CG 3.48Å; I57-Q71 HydrophobicContact CG1-CG 4.11Å; Q71-V192 WeakPolarHBondContact CA-O 3.28Å; Q71-A193 HydrophobicContact CB-CB 3.93Å
72	V	94.6	Very high	85	Confident	5 Å²	5	74.7 Å²	74.7	3%	0.03	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	138.9	170.4	60.4	0	0	0	0	108.8	G53 W54 N82 D187 C191 V192	G53-V72 VanDerWaalsContact O-CG2 3.25Å; G53-V72 WeakPolarHBondContact O-CG2 3.48Å; W54-V72 HydrophobicContact CD2-CB 4.02Å; W54-V72 HydrophobicContact CD2-CG1 3.78Å; W54-V72 HydrophobicContact CE3-CB 4.08Å; W54-V72 HydrophobicContact CE3-CG1 3.79Å; W54-V72 HydrophobicContact CG-CB 4.42Å; W54-V72 HydrophobicContact CH2-CG1 3.7Å; W54-V72 HydrophobicContact CZ2-CG1 3.65Å; W54-V72 HydrophobicContact CZ3-CB 4.48Å; W54-V72 HydrophobicContact CZ3-CG1 3.75Å; V72-N82 HydrophobicContact CG2-CB 4.34Å; V72-D187 HydrophobicContact CG1-CB 3.75Å; V72-D187 WeakPolarHBondContact CG2-OD2 3.43Å; V72-C191 WeakPolarHBondContact O-CA 3.32Å; V72-V192 HydrophobicContact CG1-CG1 3.58Å; V72-V192 PolarHBondContact N-O 3.22Å; V72-V192 PolarHBondContact O-N 2.97Å
73	C	92.2	Very high	86.1	Confident	56 Å²	56	68.8 Å²	68.8	38%	0.378	34%	0.339	S	S	.	.			trans	-150.6	49.2	-179.7	-166.3	0	0	0	0	111.9	V75 C191	C73-V75 PolarHBondContact O-N 3.02Å; C73-V75 VanDerWaalsContact O-N 3.1Å; C73-C191 HydrophobicContact CB-CB 3.96Å; C73-C191 WeakPolarHBondContact CB-SG 3.32Å; C73-C191 WeakPolarHBondContact SG-CB 3.25Å; C73-C191 CovalentContact SG-SG 2.05Å; C73-C191 PolarHBondContact SG-SG 3.19Å
74	N	90.1	Very high	87.2	Confident	53 Å²	53	61.7 Å²	61.7	28%	0.283	31%	0.306	S	S	.	.			trans	-88.3	47.3	-178.1	-65	-8.8	0	0	0	112.1	M76 E77 Q80	N74-M76 PolarHBondContact O-N 2.94Å; N74-E77 PolarHBondContact O-N 2.93Å; N74-Q80 HydrophobicContact CB-CG 4.28Å; N74-Q80 PolarHBondContact ND2-OE1 2.84Å
75	V	88.1	Confident	88.3	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.048	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.4	-170.3	-65.7	0	0	0	0	115.1	C73 I111 V114 T117 C118 C191	C73-V75 PolarHBondContact O-N 3.02Å; C73-V75 VanDerWaalsContact O-N 3.1Å; V75-I111 HydrophobicContact CG1-CD1 4.3Å; V75-I111 HydrophobicContact CG2-CD1 4.09Å; V75-I111 HydrophobicContact CG2-CG2 4.21Å; V75-V114 HydrophobicContact CB-CG1 4.08Å; V75-V114 HydrophobicContact CG2-CG1 3.69Å; V75-T117 WeakPolarHBondContact O-CB 3.49Å; V75-T117 PolarHBondContact O-OG1 2.84Å; V75-C118 HydrophobicContact CB-CB 4.23Å; V75-C118 HydrophobicContact CG1-CB 4.41Å; V75-C191 HydrophobicContact CG1-CB 3.85Å
76	M	85.3	Confident	89.1	Confident	116 Å²	116	50.1 Å²	50.1	57%	0.571	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-12.4	-177.9	-62.4	-65.2	-113.4	0	0	113.2	N74 L113 V114	N74-M76 PolarHBondContact O-N 2.94Å; M76-L113 HydrophobicContact CE-CB 4.33Å; M76-V114 HydrophobicContact CG-CG1 4.38Å; M76-V114 HydrophobicContact SD-CG1 3.3Å; M76-V114 WeakPolarHBondContact SD-CG1 3.45Å
77	E	84.6	Confident	89.7	Confident	107 Å²	107	49.1 Å²	49.1	50%	0.5	24%	0.244	S	C	.	.	S	Bend	trans	-92.8	139.7	-176.4	-66.3	-171.4	-161.1	0	0	111.7	N74 S79 Q80	N74-E77 PolarHBondContact O-N 2.93Å; E77-S79 VanDerWaalsContact C-N 3.34Å; E77-S79 PolarHBondContact O-N 2.85Å; E77-Q80 HydrophobicContact CB-CG 4.21Å; E77-Q80 PolarHBondContact OE2-NE2 2.98Å
78	Y	77.1	Confident	90.1	Very high	221 Å²	221	52.1 Å²	52.1	87%	0.867	26%	0.255	S	S	*	.	S	Bend	trans	-71.5	-22.8	-174.2	-72.9	-80.5	0	0	0	114.9	T117	Y78-T117 HydrophobicContact CD1-CG2 3.5Å; Y78-T117 VanDerWaalsContact CD1-CG2 3.5Å; Y78-T117 HydrophobicContact CE1-CG2 3.82Å; Y78-T117 HydrophobicContact CG-CG2 4.05Å
79	S	82.9	Confident	90.5	Very high	104 Å²	104	48.6 Å²	48.6	73%	0.727	24%	0.242	S	C	*	.			trans	-143.6	117.5	178.8	-177.2	0	0	0	0	108.7	E77	E77-S79 VanDerWaalsContact C-N 3.34Å; E77-S79 PolarHBondContact O-N 2.85Å
80	Q	88.4	Confident	90.7	Very high	20 Å²	20	50.6 Å²	50.6	9%	0.093	26%	0.255	C	S	.	.			trans	-119.5	147.3	176.7	-69.3	-61.5	-79	0	0	110.1	N74 E77 N82	N74-Q80 HydrophobicContact CB-CG 4.28Å; N74-Q80 PolarHBondContact ND2-OE1 2.84Å; E77-Q80 HydrophobicContact CB-CG 4.21Å; E77-Q80 PolarHBondContact OE2-NE2 2.98Å; Q80-N82 PolarHBondContact OE1-ND2 2.91Å
81	N	91.8	Very high	90.7	Very high	59 Å²	59	52.6 Å²	52.6	32%	0.316	26%	0.262	S	S	.	.			trans	-152	66.4	175.2	-172.2	34.4	0	0	0	108.6	W83 E139 Q186 D187	N81-W83 VanDerWaalsContact CG-NE1 3.26Å; N81-W83 PolarHBondContact ND2-NE1 3.25Å; N81-W83 PolarHBondContact OD1-NE1 3.36Å; N81-E139 PolarHBondContact ND2-OE2 2.74Å; N81-Q186 PolarHBondContact OD1-NE2 3.06Å; N81-D187 WeakPolarHBondContact CA-O 3.37Å
82	N	93.8	Very high	90.6	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.032	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.4	-174.4	-58.9	-50.1	0	0	0	109.8	G53 W54 V72 Q80 Q186 D187	G53-N82 WeakPolarHBondContact CA-OD1 3.45Å; W54-N82 PolarHBondContact NE1-O 3.04Å; V72-N82 HydrophobicContact CG2-CB 4.34Å; Q80-N82 PolarHBondContact OE1-ND2 2.91Å; N82-Q186 CarbonylContact O-C 3.56Å; N82-Q186 WeakPolarHBondContact O-CA 3.21Å; N82-D187 HydrophobicContact CB-CB 4.11Å; N82-D187 PolarHBondContact N-O 2.83Å; N82-D187 PolarHBondContact ND2-OD2 3.47Å; N82-D187 PolarHBondContact O-N 2.8Å
83	W	94.6	Very high	90.3	Very high	10 Å²	10	57 Å²	57	4%	0.038	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.5	-178.7	-66.2	76.7	0	0	0	111.5	S48 Y49 W54 N81 L125 F137 E139 F142 A184 F185 Q186	S48-W83 CarbonylContact C-O 3.59Å; S48-W83 VanDerWaalsContact CA-O 3.29Å; S48-W83 WeakPolarHBondContact CA-O 3.46Å; Y49-W83 PolarHBondContact N-O 2.94Å; Y49-W83 PolarHBondContact O-N 2.84Å; W54-W83 VanDerWaalsContact CD1-C 3.49Å; N81-W83 VanDerWaalsContact CG-NE1 3.26Å; N81-W83 PolarHBondContact ND2-NE1 3.25Å; N81-W83 PolarHBondContact OD1-NE1 3.36Å; W83-L125 HydrophobicContact CH2-CD1 4.34Å; W83-L125 HydrophobicContact CH2-CD2 3.86Å; W83-L125 HydrophobicContact CZ3-CD1 3.93Å; W83-L125 HydrophobicContact CZ3-CD2 3.97Å; W83-L125 HydrophobicContact CZ3-CG 4.42Å; W83-F137 HydrophobicContact CB-CE1 4.16Å; W83-F137 HydrophobicContact CB-CE2 4.39Å; W83-F137 HydrophobicContact CB-CZ 3.62Å; W83-F137 HydrophobicContact CD2-CE1 4.31Å; W83-F137 AromaticContact CD2-CZ 3.58Å; W83-F137 HydrophobicContact CD2-CZ 3.58Å; W83-F137 HydrophobicContact CE3-CE2 4.23Å; W83-F137 AromaticContact CE3-CZ 3.62Å; W83-F137 HydrophobicContact CE3-CZ 3.62Å; W83-F137 HydrophobicContact CG-CE1 4.07Å; W83-F137 AromaticContact CG-CZ 3.59Å; W83-F137 HydrophobicContact CG-CZ 3.59Å; W83-F137 HydrophobicContact CZ3-CZ 4.4Å; W83-E139 HydrophobicContact CH2-CB 4.37Å; W83-E139 HydrophobicContact CZ2-CB 3.95Å; W83-E139 HydrophobicContact CZ2-CG 3.98Å; W83-F142 HydrophobicContact CH2-CB 4.48Å; W83-F142 HydrophobicContact CZ3-CB 4.15Å; W83-F142 HydrophobicContact CZ3-CD2 4.4Å; W83-F142 HydrophobicContact CZ3-CG 4.23Å; W83-A184 HydrophobicContact CE3-CB 4.05Å; W83-A184 HydrophobicContact CZ3-CB 4.25Å; W83-F185 CarbonylContact C-O 3.57Å; W83-F185 VanDerWaalsContact CA-O 3.31Å; W83-F185 WeakPolarHBondContact CA-O 3.42Å; W83-Q186 HydrophobicContact CD2-CB 4.18Å; W83-Q186 HydrophobicContact CD2-CG 4.21Å; W83-Q186 HydrophobicContact CE3-CB 4.25Å; W83-Q186 HydrophobicContact CZ2-CG 4.14Å; W83-Q186 VanDerWaalsContact CZ2-NE2 3.31Å; W83-Q186 HydrophobicContact CZ3-CB 4.48Å
84	L	94.8	Very high	90.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	121.3	168.1	175.1	67.3	0	0	0	108.3	W46 I47 W54 F70 A184 F185 L194	W46-L84 HydrophobicContact CB-CD1 3.89Å; W46-L84 HydrophobicContact CE3-CD1 4.19Å; W46-L84 HydrophobicContact CE3-CD2 3.87Å; W46-L84 HydrophobicContact CE3-CG 3.95Å; W46-L84 HydrophobicContact CZ3-CD2 4.18Å; I47-L84 WeakPolarHBondContact O-CA 3.47Å; W54-L84 HydrophobicContact CB-CB 4.07Å; W54-L84 HydrophobicContact CB-CD1 4.24Å; W54-L84 HydrophobicContact CB-CD2 4.47Å; W54-L84 HydrophobicContact CD2-CB 3.97Å; W54-L84 HydrophobicContact CD2-CD2 4.11Å; W54-L84 HydrophobicContact CE3-CD2 4.11Å; W54-L84 HydrophobicContact CG-CB 3.63Å; W54-L84 HydrophobicContact CG-CD2 4.31Å; W54-L84 HydrophobicContact CG-CG 4.42Å; F70-L84 HydrophobicContact CB-CD2 3.57Å; F70-L84 HydrophobicContact CD1-CD1 3.67Å; F70-L84 HydrophobicContact CD1-CD2 3.87Å; F70-L84 HydrophobicContact CD1-CG 4.43Å; F70-L84 HydrophobicContact CD2-CD2 3.92Å; F70-L84 HydrophobicContact CE1-CD1 3.7Å; F70-L84 HydrophobicContact CG-CD1 4.17Å; F70-L84 HydrophobicContact CG-CD2 3.52Å; F70-L84 HydrophobicContact CG-CG 4.49Å; F70-L84 HydrophobicContact CZ-CD1 4.23Å; L84-A184 CarbonylContact O-C 3.57Å; L84-A184 WeakPolarHBondContact O-CA 3.48Å; L84-F185 HydrophobicContact CB-CB 4.29Å; L84-F185 HydrophobicContact CB-CD2 4.35Å; L84-F185 HydrophobicContact CD2-CD2 4.11Å; L84-F185 HydrophobicContact CG-CD2 4.23Å; L84-F185 PolarHBondContact N-O 2.99Å; L84-F185 WeakPolarHBondContact O-CD2 3.48Å; L84-F185 PolarHBondContact O-N 2.8Å; L84-L194 HydrophobicContact CD2-CD1 3.88Å
85	R	93.7	Very high	89.9	Confident	8 Å²	8	55 Å²	55	3%	0.03	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134	-178.5	-169.1	-155.2	71	-175.4	4.1	111	W46 I47 G134 H136 F137 F142 Y182 L183 A184	W46-R85 CarbonylContact C-O 3.45Å; W46-R85 WeakPolarHBondContact CA-O 3.27Å; W46-R85 VanDerWaalsContact CB-O 3.25Å; W46-R85 WeakPolarHBondContact CB-O 3.45Å; I47-R85 PolarHBondContact N-O 3.03Å; I47-R85 PolarHBondContact O-N 3.2Å; R85-G134 PolarHBondContact NH1-O 3.08Å; R85-G134 PolarHBondContact NH2-O 3.23Å; R85-H136 PolarHBondContact NH1-O 2.97Å; R85-F137 HydrophobicContact CB-CD2 4.45Å; R85-F137 HydrophobicContact CB-CE2 4.31Å; R85-F142 HydrophobicContact CG-CE1 4.23Å; R85-F142 HydrophobicContact CG-CZ 3.87Å; R85-Y182 HydrophobicContact CG-CD1 4.37Å; R85-L183 WeakPolarHBondContact CA-O 3.47Å; R85-L183 WeakPolarHBondContact CG-O 3.45Å; R85-A184 HydrophobicContact CB-CB 4.48Å; R85-A184 HydrophobicContact CG-CB 4.42Å
86	T	93.7	Very high	89.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.277	C	S	.	.			trans	-67.2	174	173.7	68.9	0	0	0	0	112.4	L35 W46 Y182 L183 F185	L35-T86 HydrophobicContact CD2-CG2 4.27Å; W46-T86 HydrophobicContact CD2-CG2 4Å; W46-T86 HydrophobicContact CE3-CG2 4.17Å; W46-T86 HydrophobicContact CH2-CG2 4.09Å; W46-T86 HydrophobicContact CZ2-CG2 3.87Å; W46-T86 HydrophobicContact CZ3-CG2 4.21Å; T86-Y182 WeakPolarHBondContact O-CD1 3.04Å; T86-L183 HydrophobicContact CG2-CB 3.82Å; T86-L183 PolarHBondContact N-O 3.33Å; T86-L183 PolarHBondContact OG1-N 2.96Å; T86-L183 PolarHBondContact OG1-O 2.8Å; T86-F185 HydrophobicContact CG2-CE2 4.09Å
87	N	92	Very high	90.3	Very high	73 Å²	73	50.3 Å²	50.3	39%	0.39	25%	0.249	S	C	.	.			trans	-70.3	170.5	162.8	-60.7	-25.7	0	0	0	110.8	L44 G45 I89	L44-N87 PolarHBondContact O-ND2 2.9Å; G45-N87 PolarHBondContact O-OD1 2.79Å; G45-N87 VanDerWaalsContact O-OD1 3.11Å; N87-I89 PolarHBondContact O-N 2.8Å
88	W	93.1	Very high	90.7	Very high	68 Å²	68	46.1 Å²	46.1	26%	0.258	23%	0.229	S	C	.	.			trans	-69.4	124.1	176.2	-173.2	76.5	0	0	0	110.3	P90 T129 D132 K179 Y182	W88-P90 HydrophobicContact CH2-CB 4.24Å; W88-P90 HydrophobicContact CZ3-CB 3.91Å; W88-T129 PolarHBondContact NE1-OG1 2.77Å; W88-D132 HydrophobicContact CB-CB 3.97Å; W88-D132 HydrophobicContact CD2-CB 4.32Å; W88-D132 HydrophobicContact CG-CB 4.03Å; W88-K179 HydrophobicContact CZ2-CB 4.23Å; W88-Y182 VanDerWaalsContact CA-CE1 3.45Å; W88-Y182 HydrophobicContact CB-CD1 4.37Å; W88-Y182 HydrophobicContact CB-CE1 3.6Å; W88-Y182 HydrophobicContact CB-CE2 4.48Å; W88-Y182 AromaticContact CD1-CE2 3.61Å; W88-Y182 AromaticContact CD1-CZ 3.63Å; W88-Y182 HydrophobicContact CG-CE1 4.37Å; W88-Y182 HydrophobicContact CG-CE2 4.44Å; W88-Y182 VanDerWaalsContact N-CE1 3.29Å
89	I	94.3	Very high	91.6	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.1	-176.9	-54.5	171.5	0	0	0	108.2	L34 L35 N87 R91 G180 F181 L183 V199	L34-I89 HydrophobicContact CB-CG2 3.67Å; L35-I89 HydrophobicContact CB-CD1 4.07Å; L35-I89 HydrophobicContact CB-CG1 4.47Å; L35-I89 HydrophobicContact CD2-CD1 3.6Å; L35-I89 HydrophobicContact CD2-CG1 4.31Å; L35-I89 HydrophobicContact CG-CD1 4.44Å; N87-I89 PolarHBondContact O-N 2.8Å; I89-R91 PolarHBondContact O-N 2.85Å; I89-G180 CarbonylContact O-C 3.56Å; I89-G180 WeakPolarHBondContact O-CA 3.47Å; I89-F181 HydrophobicContact CB-CD2 4.36Å; I89-F181 HydrophobicContact CB-CE1 4.25Å; I89-F181 HydrophobicContact CB-CE2 3.96Å; I89-F181 HydrophobicContact CB-CZ 3.88Å; I89-F181 HydrophobicContact CD1-CD2 4.36Å; I89-F181 HydrophobicContact CD1-CE2 3.74Å; I89-F181 HydrophobicContact CD1-CZ 4.28Å; I89-F181 HydrophobicContact CG1-CE2 4.41Å; I89-F181 HydrophobicContact CG2-CE1 4.06Å; I89-F181 HydrophobicContact CG2-CE2 4.14Å; I89-F181 HydrophobicContact CG2-CZ 3.61Å; I89-F181 PolarHBondContact N-O 3.01Å; I89-F181 PolarHBondContact O-N 2.94Å; I89-L183 HydrophobicContact CD1-CD1 4.41Å; I89-L183 HydrophobicContact CD1-CG 4.38Å; I89-V199 HydrophobicContact CD1-CG2 4.16Å
90	P	94.1	Very high	92.3	Very high	57 Å²	57	32.1 Å²	32.1	37%	0.37	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	131.1	175.8	27.6	-32.8	0	0	0	109.9	W88 Q92	W88-P90 HydrophobicContact CH2-CB 4.24Å; W88-P90 HydrophobicContact CZ3-CB 3.91Å; P90-Q92 VanDerWaalsContact C-N 3.31Å; P90-Q92 PolarHBondContact O-N 2.82Å
91	R	91.8	Very high	92.6	Very high	50 Å²	50	31.2 Å²	31.2	19%	0.189	16%	0.156	C	C	.	.			trans	-68.6	-28.8	-178.2	-176.3	-177.9	68.9	81.5	-3.3	113.1	I89 A94 L176 K178 K179	I89-R91 PolarHBondContact O-N 2.85Å; R91-A94 WeakPolarHBondContact CD-O 3.45Å; R91-A94 HydrophobicContact CG-CB 4.17Å; R91-A94 WeakPolarHBondContact CG-O 3.39Å; R91-A94 VanDerWaalsContact NH1-C 3.35Å; R91-A94 PolarHBondContact NH1-O 3.43Å; R91-A94 WeakPolarHBondContact O-CB 3.25Å; R91-A94 PolarHBondContact O-N 2.79Å; R91-A94 VanDerWaalsContact O-N 3.13Å; R91-L176 HydrophobicContact CG-CB 4.24Å; R91-L176 HydrophobicContact CG-CD1 4Å; R91-K178 VanDerWaalsContact CD-O 3.27Å; R91-K178 WeakPolarHBondContact CD-O 3.44Å; R91-K178 PolarHBondContact NE-O 3.24Å; R91-K179 WeakPolarHBondContact CB-O 3.48Å; R91-K179 PolarHBondContact N-O 2.83Å
92	Q	91.2	Very high	92.6	Very high	110 Å²	110	30.8 Å²	30.8	51%	0.514	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	-136	-168.3	-53	-175.5	20.7	0	0	111.3	L34 P90 A94	L34-Q92 HydrophobicContact CD2-CB 4.37Å; L34-Q92 HydrophobicContact CD2-CG 3.95Å; P90-Q92 VanDerWaalsContact C-N 3.31Å; P90-Q92 PolarHBondContact O-N 2.82Å; Q92-A94 VanDerWaalsContact C-N 3.28Å
93	S	88.1	Confident	92.6	Very high	66 Å²	66	30.5 Å²	30.5	46%	0.462	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.7	176.2	52.4	0	0	0	0	113.9	Q95 F201	S93-Q95 PolarHBondContact O-N 2.67Å; S93-F201 WeakPolarHBondContact OG-CZ 3.42Å
94	A	88.1	Confident	92.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.152	C	C	.	.			trans	-67.4	113.8	-174	0	0	0	0	0	111.4	L34 R91 Q92 I97 F201	L34-A94 HydrophobicContact CD1-CB 4.25Å; R91-A94 WeakPolarHBondContact CD-O 3.45Å; R91-A94 HydrophobicContact CG-CB 4.17Å; R91-A94 WeakPolarHBondContact CG-O 3.39Å; R91-A94 VanDerWaalsContact NH1-C 3.35Å; R91-A94 PolarHBondContact NH1-O 3.43Å; R91-A94 WeakPolarHBondContact O-CB 3.25Å; R91-A94 PolarHBondContact O-N 2.79Å; R91-A94 VanDerWaalsContact O-N 3.13Å; Q92-A94 VanDerWaalsContact C-N 3.28Å; A94-I97 HydrophobicContact CB-CG2 3.9Å; A94-F201 HydrophobicContact CB-CB 3.53Å; A94-F201 HydrophobicContact CB-CD1 3.54Å; A94-F201 HydrophobicContact CB-CD2 4.01Å; A94-F201 HydrophobicContact CB-CE1 4.16Å; A94-F201 HydrophobicContact CB-CG 3.43Å; A94-F201 VanDerWaalsContact CB-CG 3.43Å
95	Q	86.3	Confident	92.4	Very high	66 Å²	66	30.8 Å²	30.8	31%	0.308	15%	0.153	S	C	.	.	S	Bend	trans	-82.3	-24.4	167.3	-64.9	-167.5	5.9	0	0	111.4	S93 P175 L176 M220	S93-Q95 PolarHBondContact O-N 2.67Å; Q95-P175 CarbonylContact O-C 3.53Å; Q95-P175 VanDerWaalsContact O-CA 3.23Å; Q95-P175 WeakPolarHBondContact O-CA 3.39Å; Q95-L176 PolarHBondContact O-N 2.94Å; Q95-M220 VanDerWaalsContact OE1-CA 3.29Å; Q95-M220 PolarHBondContact OE1-O 2.04Å
96	K	89.1	Confident	92.2	Very high	27 Å²	27	33.1 Å²	33.1	12%	0.117	16%	0.161	C	C	.	.	S	Bend	trans	-136.8	139.8	-179.7	171	172.5	147.1	165	0	108.5	Y98 E172 V173 F201 S222	K96-Y98 VanDerWaalsContact CE-CZ 3.48Å; K96-Y98 WeakPolarHBondContact CE-OH 3.41Å; K96-E172 HydrophobicContact CD-CG 3.88Å; K96-E172 VanDerWaalsContact CD-OE1 3.22Å; K96-E172 WeakPolarHBondContact CD-OE1 3.36Å; K96-E172 VanDerWaalsContact CE-CG 3.49Å; K96-E172 WeakPolarHBondContact CE-OE1 3.29Å; K96-E172 WeakPolarHBondContact CE-OE2 3.44Å; K96-E172 HydrophobicContact CG-CG 3.94Å; K96-E172 IonicContact NZ-OE1 3.54Å; K96-E172 PolarHBondContact NZ-OE1 2.85Å; K96-E172 IonicContact NZ-OE2 2.66Å; K96-E172 PolarHBondContact NZ-OE2 3.26Å; K96-V173 WeakPolarHBondContact CA-O 3.26Å; K96-F201 VanDerWaalsContact O-CB 3.23Å; K96-F201 WeakPolarHBondContact O-CB 3.43Å; K96-S222 PolarHBondContact NZ-OG 3.34Å; K96-S222 VanDerWaalsContact NZ-OG 3.15Å
97	I	92.7	Very high	92	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	156.8	-179.9	63.3	170.7	0	0	0	110.2	L34 A94 V99 E172 V173 L176 F181 V199 Y200	L34-I97 HydrophobicContact CD1-CG2 3.7Å; A94-I97 HydrophobicContact CB-CG2 3.9Å; I97-V99 HydrophobicContact CD1-CG2 4.31Å; I97-E172 WeakPolarHBondContact O-CA 3.24Å; I97-V173 HydrophobicContact CD1-CB 4.07Å; I97-V173 HydrophobicContact CD1-CG2 4.49Å; I97-V173 HydrophobicContact CG1-CB 3.71Å; I97-V173 HydrophobicContact CG1-CG2 4.37Å; I97-V173 WeakPolarHBondContact CG1-O 3.4Å; I97-V173 PolarHBondContact N-O 2.78Å; I97-V173 PolarHBondContact O-N 2.96Å; I97-L176 HydrophobicContact CB-CD1 4.4Å; I97-L176 HydrophobicContact CD1-CD1 3.96Å; I97-L176 HydrophobicContact CG1-CD1 3.97Å; I97-L176 HydrophobicContact CG2-CD1 3.63Å; I97-F181 HydrophobicContact CD1-CD1 4.49Å; I97-F181 HydrophobicContact CD1-CD2 4.01Å; I97-F181 HydrophobicContact CD1-CE1 3.91Å; I97-F181 HydrophobicContact CD1-CE2 3.34Å; I97-F181 HydrophobicContact CD1-CZ 3.3Å; I97-F181 HydrophobicContact CG2-CE1 4.26Å; I97-F181 HydrophobicContact CG2-CZ 4.23Å; I97-V199 HydrophobicContact CB-CG1 4.25Å; I97-V199 HydrophobicContact CD1-CG1 4.04Å; I97-Y200 CarbonylContact C-O 3.56Å; I97-Y200 WeakPolarHBondContact CA-O 3.5Å
98	Y	94	Very high	91.8	Very high	18 Å²	18	32 Å²	32	7%	0.071	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.9	174.4	-62.3	-93.4	0	0	0	107.6	K96 V170 R171 V199 Y200 K202 T248	K96-Y98 VanDerWaalsContact CE-CZ 3.48Å; K96-Y98 WeakPolarHBondContact CE-OH 3.41Å; Y98-V170 HydrophobicContact CD1-CG1 4.32Å; Y98-R171 WeakPolarHBondContact CA-O 3.2Å; Y98-V199 WeakPolarHBondContact O-CA 3.09Å; Y98-Y200 HydrophobicContact CD2-CD2 4.39Å; Y98-Y200 HydrophobicContact CD2-CE2 4.14Å; Y98-Y200 HydrophobicContact CG-CE2 4.09Å; Y98-Y200 PolarHBondContact N-O 2.65Å; Y98-Y200 PolarHBondContact O-N 3.25Å; Y98-K202 HydrophobicContact CD2-CG 4.13Å; Y98-K202 HydrophobicContact CE2-CB 4.28Å; Y98-K202 HydrophobicContact CE2-CD 3.85Å; Y98-K202 HydrophobicContact CE2-CG 3.68Å; Y98-T248 PolarHBondContact OH-O 2.98Å
99	V	96.3	Very high	91.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	106.8	176.9	-176.3	0	0	0	0	107.1	I97 L101 L124 V170 R171 V173 L183 V199	I97-V99 HydrophobicContact CD1-CG2 4.31Å; V99-L101 HydrophobicContact CG1-CD2 3.82Å; V99-L101 HydrophobicContact CG1-CG 4.27Å; V99-L124 HydrophobicContact CB-CD2 4.39Å; V99-L124 HydrophobicContact CG1-CD1 4.44Å; V99-L124 HydrophobicContact CG1-CD2 4.11Å; V99-V170 CarbonylContact O-C 3.43Å; V99-V170 WeakPolarHBondContact O-CA 3.38Å; V99-R171 PolarHBondContact N-O 3.37Å; V99-R171 PolarHBondContact O-N 2.96Å; V99-V173 HydrophobicContact CG2-CG2 4.22Å; V99-L183 HydrophobicContact CG1-CD1 3.75Å; V99-L183 HydrophobicContact CG2-CD1 3.9Å; V99-L183 HydrophobicContact CG2-CD2 4.11Å; V99-V199 HydrophobicContact CG2-CG1 4.47Å; V99-V199 HydrophobicContact CG2-CG2 4.49Å
100	E	96	Very high	91.1	Very high	32 Å²	32	35.4 Å²	35.4	15%	0.15	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125	174.3	177.1	-171.8	110	0	0	109.3	T168 E169 V170 V197 R198 Y200	E100-T168 HydrophobicContact CG-CG2 4.11Å; E100-E169 CarbonylContact C-O 3.57Å; E100-E169 WeakPolarHBondContact CA-O 3.17Å; E100-V170 HydrophobicContact CB-CG2 4.12Å; E100-V170 HydrophobicContact CG-CG2 4.11Å; E100-V197 WeakPolarHBondContact O-CA 3.49Å; E100-R198 HydrophobicContact CB-CB 4.27Å; E100-R198 PolarHBondContact N-O 2.82Å; E100-R198 PolarHBondContact O-N 3.41Å; E100-Y200 HydrophobicContact CB-CE1 4.23Å
101	L	95.2	Very high	90.6	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.2	179.6	-55.7	-178.8	0	0	0	109	V99 F103 F122 L124 I148 T168 E169 F185 S196 V197	V99-L101 HydrophobicContact CG1-CD2 3.82Å; V99-L101 HydrophobicContact CG1-CG 4.27Å; L101-F103 HydrophobicContact CB-CD1 4.35Å; L101-F122 HydrophobicContact CD1-CE2 4.14Å; L101-F122 HydrophobicContact CD1-CZ 4.14Å; L101-L124 HydrophobicContact CD1-CD1 4.47Å; L101-L124 HydrophobicContact CD1-CD2 4.23Å; L101-I148 HydrophobicContact CD1-CD1 4.39Å; L101-I148 HydrophobicContact CD1-CG1 4.08Å; L101-T168 CarbonylContact O-C 3.45Å; L101-T168 VanDerWaalsContact O-CA 3.29Å; L101-T168 WeakPolarHBondContact O-CA 3.38Å; L101-E169 PolarHBondContact N-O 3.15Å; L101-E169 PolarHBondContact O-N 3.01Å; L101-F185 HydrophobicContact CD1-CE1 4.1Å; L101-F185 HydrophobicContact CD2-CE1 3.56Å; L101-F185 HydrophobicContact CD2-CZ 3.95Å; L101-S196 WeakPolarHBondContact CA-O 3.28Å; L101-V197 HydrophobicContact CD2-CB 4.33Å; L101-V197 HydrophobicContact CD2-CG1 3.95Å; L101-V197 HydrophobicContact CD2-CG2 3.93Å
102	K	92.8	Very high	90.1	Very high	49 Å²	49	35.8 Å²	35.8	21%	0.213	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126.1	165.4	-57.3	-169.4	173.3	-170.1	0	109.5	L166 N167 T168 V195 S196	K102-L166 HydrophobicContact CB-CD1 4.08Å; K102-L166 HydrophobicContact CB-CG 4.39Å; K102-L166 HydrophobicContact CD-CD2 4.3Å; K102-N167 CarbonylContact C-O 3.51Å; K102-N167 WeakPolarHBondContact CA-O 3.44Å; K102-T168 HydrophobicContact CG-CG2 4.21Å; K102-V195 HydrophobicContact CB-CB 4.49Å; K102-V195 WeakPolarHBondContact O-CA 3.31Å; K102-V195 WeakPolarHBondContact O-CB 2.95Å; K102-V195 PolarHBondContact O-N 2.92Å; K102-S196 PolarHBondContact N-O 3.18Å; K102-S196 PolarHBondContact O-N 3.47Å
103	F	93.4	Very high	89.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	159.5	-173.9	68.4	-82.4	0	0	0	112.8	L101 L105 F122 I148 A149 A150 N167 E169 V192 A193 L194	L101-F103 HydrophobicContact CB-CD1 4.35Å; F103-L105 HydrophobicContact CD2-CB 4.37Å; F103-L105 HydrophobicContact CE2-CB 4.23Å; F103-L105 HydrophobicContact CE2-CD1 4.38Å; F103-F122 HydrophobicContact CD1-CE1 4.33Å; F103-F122 HydrophobicContact CD1-CZ 4.29Å; F103-F122 AromaticContact CD2-CE1 3.85Å; F103-F122 HydrophobicContact CD2-CE1 3.85Å; F103-F122 HydrophobicContact CE1-CE1 4.33Å; F103-F122 HydrophobicContact CE1-CZ 4.43Å; F103-F122 AromaticContact CE2-CE1 3.84Å; F103-F122 HydrophobicContact CE2-CE1 3.84Å; F103-F122 HydrophobicContact CG-CE1 4.1Å; F103-F122 HydrophobicContact CG-CZ 4.35Å; F103-F122 HydrophobicContact CZ-CE1 4.1Å; F103-I148 HydrophobicContact CE1-CG2 3.65Å; F103-I148 HydrophobicContact CZ-CG2 3.63Å; F103-A149 WeakPolarHBondContact CZ-O 3.35Å; F103-A150 HydrophobicContact CE2-CB 3.97Å; F103-A150 HydrophobicContact CZ-CB 4.37Å; F103-N167 HydrophobicContact CD1-CB 4.18Å; F103-N167 HydrophobicContact CD2-CB 4.37Å; F103-N167 HydrophobicContact CE1-CB 3.8Å; F103-N167 HydrophobicContact CE2-CB 4.03Å; F103-N167 HydrophobicContact CG-CB 4.43Å; F103-N167 HydrophobicContact CZ-CB 3.72Å; F103-N167 PolarHBondContact N-O 3.39Å; F103-N167 WeakPolarHBondContact O-CB 3.4Å; F103-N167 PolarHBondContact O-N 2.81Å; F103-N167 PolarHBondContact O-ND2 3.15Å; F103-E169 HydrophobicContact CE1-CB 4.12Å; F103-E169 HydrophobicContact CE1-CG 3.76Å; F103-E169 HydrophobicContact CZ-CG 4.22Å; F103-V192 HydrophobicContact CB-CG2 4.37Å; F103-V192 HydrophobicContact CD2-CG2 3.97Å; F103-A193 CarbonylContact C-O 3.46Å; F103-A193 WeakPolarHBondContact CA-O 3.37Å; F103-A193 VanDerWaalsContact CB-O 3.27Å; F103-A193 WeakPolarHBondContact CB-O 3.32Å; F103-L194 HydrophobicContact CB-CD2 4.02Å
104	T	91.4	Very high	89.1	Confident	16 Å²	16	35.2 Å²	35.2	10%	0.098	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.9	172.2	63.6	0	0	0	0	109.3	L166 V192 A193 V195	T104-L166 HydrophobicContact CG2-CD1 4.19Å; T104-V192 WeakPolarHBondContact O-CA 3.36Å; T104-A193 PolarHBondContact N-O 3.28Å; T104-A193 PolarHBondContact O-N 2.82Å; T104-V195 HydrophobicContact CG2-CG2 4.27Å
105	L	93.2	Very high	88.2	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.6	179.7	-169.6	141.5	0	0	0	110.6	F103 E120 A150 S153 F154	F103-L105 HydrophobicContact CD2-CB 4.37Å; F103-L105 HydrophobicContact CE2-CB 4.23Å; F103-L105 HydrophobicContact CE2-CD1 4.38Å; L105-E120 VanDerWaalsContact CD1-C 3.5Å; L105-E120 VanDerWaalsContact CD1-O 3.24Å; L105-E120 WeakPolarHBondContact CD1-O 3.43Å; L105-E120 HydrophobicContact CD2-CB 3.82Å; L105-E120 HydrophobicContact CD2-CG 4.13Å; L105-A150 HydrophobicContact CB-CB 3.72Å; L105-A150 HydrophobicContact CD1-CB 4.27Å; L105-A150 HydrophobicContact CD2-CB 4.27Å; L105-A150 HydrophobicContact CG-CB 4.3Å; L105-S153 VanDerWaalsContact O-CA 3.31Å; L105-S153 WeakPolarHBondContact O-CA 3.41Å; L105-F154 WeakPolarHBondContact O-CD1 3.35Å; L105-F154 WeakPolarHBondContact O-CE1 3.23Å; L105-F154 PolarHBondContact O-N 2.82Å; L105-F154 VanDerWaalsContact O-N 3.08Å
106	R	90.5	Very high	87.7	Confident	57 Å²	57	43.9 Å²	43.9	22%	0.215	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-91.6	133.8	179.4	-171.2	172.7	174.7	178.2	-3.5	111.2	C108 S110 I111 F154 C191	R106-C108 PolarHBondContact O-N 2.77Å; R106-S110 WeakPolarHBondContact CG-OG 3.36Å; R106-S110 PolarHBondContact NE-OG 3.43Å; R106-S110 VanDerWaalsContact NE-OG 3.11Å; R106-S110 PolarHBondContact NH2-O 3.4Å; R106-I111 HydrophobicContact CG-CD1 4.27Å; R106-I111 HydrophobicContact CG-CG1 4.33Å; R106-F154 HydrophobicContact CB-CD2 4.39Å; R106-F154 HydrophobicContact CB-CE1 3.99Å; R106-F154 HydrophobicContact CB-CE2 3.75Å; R106-F154 HydrophobicContact CB-CZ 3.53Å; R106-F154 HydrophobicContact CG-CD2 4.16Å; R106-F154 HydrophobicContact CG-CE2 3.68Å; R106-F154 HydrophobicContact CG-CZ 4.02Å; R106-C191 HydrophobicContact CB-CB 4Å; R106-C191 PolarHBondContact N-O 3.23Å
107	D	88.4	Confident	87.5	Confident	27 Å²	27	43.5 Å²	43.5	14%	0.144	25%	0.248	C	C	.	.			trans	-61.9	127.9	175.9	-179.2	-11.8	0	0	0	110.4	N109 S110 E120 F154 T155	D107-N109 PolarHBondContact O-N 2.76Å; D107-N109 VanDerWaalsContact OD1-CB 3.28Å; D107-N109 WeakPolarHBondContact OD1-CB 3.06Å; D107-N109 PolarHBondContact OD1-N 2.93Å; D107-N109 PolarHBondContact OD1-ND2 2.61Å; D107-S110 WeakPolarHBondContact O-CB 3.17Å; D107-S110 PolarHBondContact O-N 3.49Å; D107-S110 PolarHBondContact O-OG 2.66Å; D107-E120 WeakPolarHBondContact CA-OE1 3.48Å; D107-F154 PolarHBondContact N-O 2.78Å; D107-T155 HydrophobicContact CB-CG2 4.07Å
108	C	88.8	Confident	87.4	Confident	21 Å²	21	44.2 Å²	44.2	14%	0.142	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-61.6	-30.7	178.6	-73.2	0	0	0	0	112.6	R106 S110 I111 C118 E120	R106-C108 PolarHBondContact O-N 2.77Å; C108-S110 PolarHBondContact O-N 2.83Å; C108-I111 PolarHBondContact O-N 2.81Å; C108-C118 VanDerWaalsContact CA-SG 3.52Å; C108-C118 HydrophobicContact CB-CB 3.76Å; C108-C118 WeakPolarHBondContact CB-SG 3.46Å; C108-C118 WeakPolarHBondContact SG-CB 3.15Å; C108-C118 CovalentContact SG-SG 2.04Å; C108-C118 PolarHBondContact SG-SG 2.93Å; C108-E120 HydrophobicContact CB-CG 4.28Å; C108-E120 PolarHBondContact N-OE1 2.78Å; C108-E120 VanDerWaalsContact SG-CG 3.53Å
109	N	86.4	Confident	87.2	Confident	133 Å²	133	48 Å²	48	71%	0.711	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-68	-21.4	176.5	-58.9	-60.6	0	0	0	112.4	D107 I111	D107-N109 PolarHBondContact O-N 2.76Å; D107-N109 VanDerWaalsContact OD1-CB 3.28Å; D107-N109 WeakPolarHBondContact OD1-CB 3.06Å; D107-N109 PolarHBondContact OD1-N 2.93Å; D107-N109 PolarHBondContact OD1-ND2 2.61Å; N109-I111 VanDerWaalsContact C-N 3.26Å; N109-I111 PolarHBondContact O-N 3.34Å
110	S	85	Confident	86.9	Confident	13 Å²	13	51.6 Å²	51.6	9%	0.091	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-82.6	-1.5	176.9	81.7	0	0	0	0	113.7	R106 D107 C108	R106-S110 WeakPolarHBondContact CG-OG 3.36Å; R106-S110 PolarHBondContact NE-OG 3.43Å; R106-S110 VanDerWaalsContact NE-OG 3.11Å; R106-S110 PolarHBondContact NH2-O 3.4Å; D107-S110 WeakPolarHBondContact O-CB 3.17Å; D107-S110 PolarHBondContact O-N 3.49Å; D107-S110 PolarHBondContact O-OG 2.66Å; C108-S110 PolarHBondContact O-N 2.83Å
111	I	84.5	Confident	86.8	Confident	22 Å²	22	52.1 Å²	52.1	11%	0.113	29%	0.292	C	S	.	.	S	Bend	trans	-112.2	120.2	-179.6	-52.7	175.8	0	0	0	108.1	V75 R106 C108 N109 V114 C191	V75-I111 HydrophobicContact CG1-CD1 4.3Å; V75-I111 HydrophobicContact CG2-CD1 4.09Å; V75-I111 HydrophobicContact CG2-CG2 4.21Å; R106-I111 HydrophobicContact CG-CD1 4.27Å; R106-I111 HydrophobicContact CG-CG1 4.33Å; C108-I111 PolarHBondContact O-N 2.81Å; N109-I111 VanDerWaalsContact C-N 3.26Å; N109-I111 PolarHBondContact O-N 3.34Å; I111-V114 HydrophobicContact CB-CG1 4.34Å; I111-V114 HydrophobicContact CB-CG2 3.7Å; I111-V114 HydrophobicContact CG2-CB 4.4Å; I111-V114 HydrophobicContact CG2-CG1 3.58Å; I111-V114 HydrophobicContact CG2-CG2 3.9Å; I111-V114 WeakPolarHBondContact O-CG2 3.29Å; I111-C191 HydrophobicContact CD1-CB 4.23Å
112	P	80.4	Confident	86.8	Confident	92 Å²	92	52.1 Å²	52.1	60%	0.597	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	144.5	177.6	28.1	-32.5	0	0	0	110.7	V114	P112-V114 PolarHBondContact O-N 3.17Å
113	L	77.5	Confident	87	Confident	160 Å²	160	50.6 Å²	50.6	84%	0.838	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	20.4	170.3	-55.4	163	0	0	0	117.2	M76	M76-L113 HydrophobicContact CE-CB 4.33Å
114	V	81.7	Confident	87.2	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.024	29%	0.286	C	S	.	.			trans	-112.1	14.9	-178.9	-61.4	0	0	0	0	115.5	V75 M76 I111 P112 G116 T117 C118	V75-V114 HydrophobicContact CB-CG1 4.08Å; V75-V114 HydrophobicContact CG2-CG1 3.69Å; M76-V114 HydrophobicContact CG-CG1 4.38Å; M76-V114 HydrophobicContact SD-CG1 3.3Å; M76-V114 WeakPolarHBondContact SD-CG1 3.45Å; I111-V114 HydrophobicContact CB-CG1 4.34Å; I111-V114 HydrophobicContact CB-CG2 3.7Å; I111-V114 HydrophobicContact CG2-CB 4.4Å; I111-V114 HydrophobicContact CG2-CG1 3.58Å; I111-V114 HydrophobicContact CG2-CG2 3.9Å; I111-V114 WeakPolarHBondContact O-CG2 3.29Å; P112-V114 PolarHBondContact O-N 3.17Å; V114-G116 PolarHBondContact O-N 2.9Å; V114-T117 PolarHBondContact O-N 2.81Å; V114-T117 PolarHBondContact O-OG1 3.06Å; V114-C118 HydrophobicContact CB-CB 3.84Å; V114-C118 HydrophobicContact CG2-CB 3.67Å; V114-C118 PolarHBondContact O-N 2.59Å
115	L	69.4	Low	87.4	Confident	175 Å²	175	50.2 Å²	50.2	92%	0.916	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	109.1	-177.5	-84	154.5	0	0	0	111
116	G	74.8	Confident	87.5	Confident	73 Å²	73	51.7 Å²	51.7	75%	0.753	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.1	-18.3	176.9	0	0	0	0	0	115.5	V114	V114-G116 PolarHBondContact O-N 2.9Å
117	T	85.8	Confident	87.7	Confident	19 Å²	19	50.2 Å²	50.2	12%	0.117	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-34.8	177.6	55	0	0	0	0	112.4	V75 Y78 V114	V75-T117 WeakPolarHBondContact O-CB 3.49Å; V75-T117 PolarHBondContact O-OG1 2.84Å; Y78-T117 HydrophobicContact CD1-CG2 3.5Å; Y78-T117 VanDerWaalsContact CD1-CG2 3.5Å; Y78-T117 HydrophobicContact CE1-CG2 3.82Å; Y78-T117 HydrophobicContact CG-CG2 4.05Å; V114-T117 PolarHBondContact O-N 2.81Å; V114-T117 PolarHBondContact O-OG1 3.06Å
118	C	89.4	Confident	87.9	Confident	15 Å²	15	50.3 Å²	50.3	10%	0.101	29%	0.285	C	S	.	.			trans	-71.8	141.4	-179.7	-174.7	0	0	0	0	113	V75 C108 V114 G189	V75-C118 HydrophobicContact CB-CB 4.23Å; V75-C118 HydrophobicContact CG1-CB 4.41Å; C108-C118 VanDerWaalsContact CA-SG 3.52Å; C108-C118 HydrophobicContact CB-CB 3.76Å; C108-C118 WeakPolarHBondContact CB-SG 3.46Å; C108-C118 WeakPolarHBondContact SG-CB 3.15Å; C108-C118 CovalentContact SG-SG 2.04Å; C108-C118 PolarHBondContact SG-SG 2.93Å; V114-C118 HydrophobicContact CB-CB 3.84Å; V114-C118 HydrophobicContact CG2-CB 3.67Å; V114-C118 PolarHBondContact O-N 2.59Å; C118-G189 CarbonylContact C-O 3.59Å; C118-G189 WeakPolarHBondContact CA-O 3.31Å
119	K	90.3	Very high	88.1	Confident	98 Å²	98	50 Å²	50	43%	0.426	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	-125.5	153.8	175.5	-59.3	-63.6	179.5	-170.9	0	110.6	V188 G189 A190	K119-V188 HydrophobicContact CG-CG2 4.3Å; K119-G189 PolarHBondContact N-O 2.8Å; K119-A190 WeakPolarHBondContact O-CA 3.43Å; K119-A190 VanDerWaalsContact O-CB 3.24Å; K119-A190 WeakPolarHBondContact O-CB 3.29Å
120	E	90.8	Very high	88.3	Confident	75 Å²	75	47 Å²	47	35%	0.35	27%	0.267	S	S	.	.	S	Bend	trans	-111.8	26.8	177.9	-60	-175.8	141.1	0	0	111.6	L105 D107 C108	L105-E120 VanDerWaalsContact CD1-C 3.5Å; L105-E120 VanDerWaalsContact CD1-O 3.24Å; L105-E120 WeakPolarHBondContact CD1-O 3.43Å; L105-E120 HydrophobicContact CD2-CB 3.82Å; L105-E120 HydrophobicContact CD2-CG 4.13Å; D107-E120 WeakPolarHBondContact CA-OE1 3.48Å; C108-E120 HydrophobicContact CB-CG 4.28Å; C108-E120 PolarHBondContact N-OE1 2.78Å; C108-E120 VanDerWaalsContact SG-CG 3.53Å
121	T	93.2	Very high	88.5	Confident	44 Å²	44	51.4 Å²	51.4	27%	0.27	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	148.9	-175.3	61.4	0	0	0	0	111.8	T147 I148 A149	T121-T147 HydrophobicContact CG2-CG2 4.19Å; T121-I148 CarbonylContact C-O 3.38Å; T121-I148 WeakPolarHBondContact CA-O 3.35Å; T121-I148 WeakPolarHBondContact CB-O 3.06Å; T121-A149 HydrophobicContact CG2-CB 3.93Å
122	F	95.6	Very high	88.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	161.6	168.5	66.4	-83.5	0	0	0	110.2	L101 F103 I148 F185 V192 L194	L101-F122 HydrophobicContact CD1-CE2 4.14Å; L101-F122 HydrophobicContact CD1-CZ 4.14Å; F103-F122 HydrophobicContact CD1-CE1 4.33Å; F103-F122 HydrophobicContact CD1-CZ 4.29Å; F103-F122 AromaticContact CD2-CE1 3.85Å; F103-F122 HydrophobicContact CD2-CE1 3.85Å; F103-F122 HydrophobicContact CE1-CE1 4.33Å; F103-F122 HydrophobicContact CE1-CZ 4.43Å; F103-F122 AromaticContact CE2-CE1 3.84Å; F103-F122 HydrophobicContact CE2-CE1 3.84Å; F103-F122 HydrophobicContact CG-CE1 4.1Å; F103-F122 HydrophobicContact CG-CZ 4.35Å; F103-F122 HydrophobicContact CZ-CE1 4.1Å; F122-I148 HydrophobicContact CD1-CB 4.16Å; F122-I148 HydrophobicContact CD1-CG2 4.48Å; F122-I148 HydrophobicContact CD2-CB 4.31Å; F122-I148 HydrophobicContact CD2-CG1 4.42Å; F122-I148 HydrophobicContact CE1-CB 3.72Å; F122-I148 HydrophobicContact CE1-CG2 3.63Å; F122-I148 HydrophobicContact CE2-CB 3.89Å; F122-I148 HydrophobicContact CE2-CG1 3.86Å; F122-I148 HydrophobicContact CE2-CG2 4.3Å; F122-I148 HydrophobicContact CG-CB 4.44Å; F122-I148 HydrophobicContact CZ-CB 3.59Å; F122-I148 HydrophobicContact CZ-CG1 3.97Å; F122-I148 HydrophobicContact CZ-CG2 3.53Å; F122-I148 PolarHBondContact N-O 2.83Å; F122-I148 PolarHBondContact O-N 2.85Å; F122-F185 HydrophobicContact CD2-CD1 4.43Å; F122-F185 AromaticContact CE2-CD1 3.97Å; F122-F185 HydrophobicContact CE2-CD1 3.97Å; F122-V192 HydrophobicContact CD1-CG2 4.05Å; F122-V192 HydrophobicContact CE1-CG2 4.06Å; F122-L194 HydrophobicContact CE2-CD2 4.16Å; F122-L194 HydrophobicContact CZ-CD2 3.94Å
123	N	96.4	Very high	88.5	Confident	17 Å²	17	55.2 Å²	55.2	9%	0.091	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.5	-179.6	-55.6	-52.4	0	0	0	111.2	L125 K144 F185 Q186	N123-L125 HydrophobicContact CB-CD1 3.92Å; N123-K144 VanDerWaalsContact OD1-CE 3.29Å; N123-K144 WeakPolarHBondContact OD1-CE 3.45Å; N123-K144 PolarHBondContact OD1-NZ 2.85Å; N123-F185 WeakPolarHBondContact O-CA 3.44Å; N123-Q186 HydrophobicContact CB-CB 4.2Å; N123-Q186 PolarHBondContact N-O 2.9Å; N123-Q186 PolarHBondContact ND2-OE1 3.21Å; N123-Q186 PolarHBondContact O-N 2.8Å
124	L	97.1	Very high	88.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130.1	168.5	176.7	65.6	0	0	0	109.1	V99 L101 I145 D146 I148 R171 F185	V99-L124 HydrophobicContact CB-CD2 4.39Å; V99-L124 HydrophobicContact CG1-CD1 4.44Å; V99-L124 HydrophobicContact CG1-CD2 4.11Å; L101-L124 HydrophobicContact CD1-CD1 4.47Å; L101-L124 HydrophobicContact CD1-CD2 4.23Å; L124-I145 HydrophobicContact CB-CB 4.47Å; L124-I145 HydrophobicContact CD1-CD1 4.45Å; L124-I145 HydrophobicContact CD2-CB 4.24Å; L124-I145 HydrophobicContact CD2-CD1 3.94Å; L124-I145 HydrophobicContact CD2-CG2 4.17Å; L124-I145 HydrophobicContact CG-CB 4.13Å; L124-I145 HydrophobicContact CG-CD1 3.74Å; L124-I145 HydrophobicContact CG-CG1 4.42Å; L124-I145 WeakPolarHBondContact O-CA 3.24Å; L124-I145 WeakPolarHBondContact O-CB 3.38Å; L124-I145 PolarHBondContact O-N 2.88Å; L124-D146 PolarHBondContact N-O 2.59Å; L124-D146 PolarHBondContact O-N 2.89Å; L124-I148 HydrophobicContact CB-CD1 4.21Å; L124-I148 HydrophobicContact CB-CG1 3.99Å; L124-R171 HydrophobicContact CD2-CB 4.09Å; L124-R171 HydrophobicContact CD2-CG 4.26Å; L124-F185 HydrophobicContact CD1-CD1 3.93Å; L124-F185 HydrophobicContact CD1-CE1 3.54Å; L124-F185 HydrophobicContact CD1-CZ 4.19Å
125	L	95.9	Very high	88.2	Confident	9 Å²	9	53.7 Å²	53.7	5%	0.047	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	161.5	-179	-54.6	96.8	0	0	0	111.5	W83 N123 F142 Q143 K144 L183 A184 Q186	W83-L125 HydrophobicContact CH2-CD1 4.34Å; W83-L125 HydrophobicContact CH2-CD2 3.86Å; W83-L125 HydrophobicContact CZ3-CD1 3.93Å; W83-L125 HydrophobicContact CZ3-CD2 3.97Å; W83-L125 HydrophobicContact CZ3-CG 4.42Å; N123-L125 HydrophobicContact CB-CD1 3.92Å; L125-F142 HydrophobicContact CB-CB 4.03Å; L125-F142 HydrophobicContact CB-CD1 4.32Å; L125-F142 HydrophobicContact CD2-CB 3.98Å; L125-Q143 CarbonylContact C-O 3.54Å; L125-Q143 WeakPolarHBondContact CA-O 3.49Å; L125-Q143 WeakPolarHBondContact CB-O 3.4Å; L125-K144 HydrophobicContact CD2-CB 4.12Å; L125-K144 HydrophobicContact CG-CB 4.3Å; L125-L183 CarbonylContact O-C 3.48Å; L125-L183 WeakPolarHBondContact O-CA 3.25Å; L125-A184 HydrophobicContact CB-CB 4.4Å; L125-A184 PolarHBondContact N-O 3.5Å; L125-A184 PolarHBondContact O-N 2.77Å; L125-Q186 HydrophobicContact CD1-CB 3.69Å
126	Y	95.8	Very high	88.4	Confident	31 Å²	31	51.9 Å²	51.9	12%	0.122	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	162.2	174.3	80.8	-64.1	0	0	0	113.4	E128 F142 Q143 I145 V173 L176 Y182	Y126-E128 HydrophobicContact CD2-CG 4.23Å; Y126-E128 HydrophobicContact CE2-CG 3.91Å; Y126-F142 WeakPolarHBondContact O-CA 3.38Å; Y126-Q143 HydrophobicContact CD1-CB 4.16Å; Y126-Q143 HydrophobicContact CE1-CB 3.87Å; Y126-Q143 HydrophobicContact CE1-CG 4.08Å; Y126-Q143 PolarHBondContact N-O 2.98Å; Y126-Q143 PolarHBondContact O-N 3.36Å; Y126-Q143 PolarHBondContact OH-OE1 2.88Å; Y126-I145 HydrophobicContact CD1-CD1 3.85Å; Y126-I145 HydrophobicContact CD1-CG1 3.45Å; Y126-I145 VanDerWaalsContact CD1-CG1 3.45Å; Y126-I145 HydrophobicContact CE1-CG1 4.13Å; Y126-I145 HydrophobicContact CG-CD1 4.09Å; Y126-I145 HydrophobicContact CG-CG1 4.2Å; Y126-V173 HydrophobicContact CD1-CG1 4.06Å; Y126-V173 HydrophobicContact CD2-CG1 3.79Å; Y126-V173 HydrophobicContact CE1-CG1 3.89Å; Y126-V173 HydrophobicContact CE2-CG1 3.64Å; Y126-V173 HydrophobicContact CG-CG1 4Å; Y126-L176 HydrophobicContact CD2-CD2 4.37Å; Y126-L176 HydrophobicContact CE2-CD2 3.95Å; Y126-Y182 CarbonylContact C-O 3.56Å; Y126-Y182 WeakPolarHBondContact CA-O 3.08Å; Y126-Y182 WeakPolarHBondContact CB-O 3.44Å
127	L	93.7	Very high	88.6	Confident	27 Å²	27	50.4 Å²	50.4	14%	0.141	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	120.1	175.6	168.2	61.2	0	0	0	110.1	T129 Q141 F142 F181 Y182	L127-T129 HydrophobicContact CD1-CG2 4.33Å; L127-T129 HydrophobicContact CD2-CG2 4.14Å; L127-T129 HydrophobicContact CG-CG2 3.88Å; L127-Q141 HydrophobicContact CD1-CB 4.05Å; L127-Q141 WeakPolarHBondContact CD1-O 3.31Å; L127-Q141 HydrophobicContact CD2-CB 4.09Å; L127-F142 HydrophobicContact CB-CD1 3.76Å; L127-F142 HydrophobicContact CB-CE1 3.67Å; L127-F142 HydrophobicContact CB-CG 4.24Å; L127-F142 HydrophobicContact CB-CZ 4.08Å; L127-F142 HydrophobicContact CD2-CE2 4.11Å; L127-F142 HydrophobicContact CD2-CZ 4.07Å; L127-F181 CarbonylContact O-C 3.52Å; L127-F181 WeakPolarHBondContact O-CA 3.28Å; L127-F181 WeakPolarHBondContact O-CB 3.32Å; L127-Y182 HydrophobicContact CD2-CD2 4.44Å; L127-Y182 PolarHBondContact N-O 3.45Å; L127-Y182 PolarHBondContact O-N 3.23Å
128	E	94	Very high	88.4	Confident	29 Å²	29	56.3 Å²	56.3	14%	0.136	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	129.2	173	-73.6	-177.3	-106.6	0	0	112.2	Y126 L176 S177 K178 F181	Y126-E128 HydrophobicContact CD2-CG 4.23Å; Y126-E128 HydrophobicContact CE2-CG 3.91Å; E128-L176 HydrophobicContact CG-CD2 3.81Å; E128-S177 PolarHBondContact OE2-N 2.03Å; E128-S177 PolarHBondContact OE2-OG 3.21Å; E128-K178 HydrophobicContact CB-CB 4.12Å; E128-K178 HydrophobicContact CB-CD 3.97Å; E128-K178 HydrophobicContact CB-CG 4.07Å; E128-K178 WeakPolarHBondContact O-CD 3.49Å; E128-K178 PolarHBondContact O-NZ 2.82Å; E128-K178 PolarHBondContact OE2-N 2.79Å; E128-K178 VanDerWaalsContact OE2-N 3.16Å; E128-F181 HydrophobicContact CG-CB 4.34Å
129	T	92.9	Very high	88.2	Confident	13 Å²	13	58.8 Å²	58.8	8%	0.08	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.2	174.7	70.2	0	0	0	0	111.6	W88 L127 D131 Q133 G180 Y182	W88-T129 PolarHBondContact NE1-OG1 2.77Å; L127-T129 HydrophobicContact CD1-CG2 4.33Å; L127-T129 HydrophobicContact CD2-CG2 4.14Å; L127-T129 HydrophobicContact CG-CG2 3.88Å; T129-D131 WeakPolarHBondContact CB-O 3.26Å; T129-D131 PolarHBondContact OG1-O 3.21Å; T129-Q133 HydrophobicContact CG2-CG 4.22Å; T129-G180 PolarHBondContact N-O 2.82Å; T129-G180 CarbonylContact O-C 3.57Å; T129-G180 PolarHBondContact O-N 2.84Å; T129-Y182 HydrophobicContact CG2-CD2 4.35Å; T129-Y182 HydrophobicContact CG2-CE2 4.15Å
130	D	91.1	Very high	87.9	Confident	72 Å²	72	61.2 Å²	61.2	39%	0.385	31%	0.312	S	S	.	.	S	Bend	trans	-81.2	-24.9	174.8	-68.7	-56.5	0	0	0	112.9	K178 K179	D130-K178 WeakPolarHBondContact OD1-CB 3.49Å; D130-K179 HydrophobicContact CB-CD 4.43Å; D130-K179 PolarHBondContact OD1-N 3.4Å; D130-K179 VanDerWaalsContact OD1-N 3.12Å
131	D	87.4	Confident	87.8	Confident	104 Å²	104	61.7 Å²	61.7	56%	0.556	31%	0.314	S	S	*	.	S	Bend	trans	-133.6	154.7	-178.2	-59.1	-64.2	0	0	0	111.4	T129 Q133	T129-D131 WeakPolarHBondContact CB-O 3.26Å; T129-D131 PolarHBondContact OG1-O 3.21Å; D131-Q133 PolarHBondContact O-N 2.96Å; D131-Q133 PolarHBondContact O-NE2 3.3Å
132	D	86.4	Confident	87.8	Confident	101 Å²	101	60.7 Å²	60.7	54%	0.54	31%	0.306	S	S	.	.			trans	-69.9	115.5	175.8	-173.6	2.5	0	0	0	110.7	W88 G134 Y182	W88-D132 HydrophobicContact CB-CB 3.97Å; W88-D132 HydrophobicContact CD2-CB 4.32Å; W88-D132 HydrophobicContact CG-CB 4.03Å; D132-G134 VanDerWaalsContact C-N 3.28Å; D132-G134 PolarHBondContact O-N 3.24Å; D132-G134 PolarHBondContact OD1-N 3.39Å; D132-Y182 WeakPolarHBondContact CA-OH 3.42Å; D132-Y182 PolarHBondContact OD1-OH 3.3Å
133	Q	79.7	Confident	87.7	Confident	93 Å²	93	66.3 Å²	66.3	44%	0.435	33%	0.332	S	S	.	.			trans	-83.1	3	-180	-57.1	-60.2	-52.8	0	0	113.4	T129 D131 S135 H136 Y182	T129-Q133 HydrophobicContact CG2-CG 4.22Å; D131-Q133 PolarHBondContact O-N 2.96Å; D131-Q133 PolarHBondContact O-NE2 3.3Å; Q133-S135 PolarHBondContact O-N 3.27Å; Q133-H136 PolarHBondContact O-N 3.29Å; Q133-Y182 HydrophobicContact CB-CE2 4.49Å; Q133-Y182 HydrophobicContact CG-CE2 4.44Å; Q133-Y182 PolarHBondContact N-OH 3.16Å
134	G	78.2	Confident	87.6	Confident	35 Å²	35	70.3 Å²	70.3	36%	0.361	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	-132.9	176	0	0	0	0	0	113	R85 D132 H136	R85-G134 PolarHBondContact NH1-O 3.08Å; R85-G134 PolarHBondContact NH2-O 3.23Å; D132-G134 VanDerWaalsContact C-N 3.28Å; D132-G134 PolarHBondContact O-N 3.24Å; D132-G134 PolarHBondContact OD1-N 3.39Å; G134-H136 VanDerWaalsContact C-N 3.3Å; G134-H136 PolarHBondContact O-N 2.71Å
135	S	73.8	Confident	87.5	Confident	97 Å²	97	72.3 Å²	72.3	68%	0.678	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-1.1	-177.3	63.2	0	0	0	0	115	Q133 F137	Q133-S135 PolarHBondContact O-N 3.27Å; S135-F137 PolarHBondContact O-N 3.27Å
136	H	74.3	Confident	87.5	Confident	137 Å²	137	74.8 Å²	74.8	63%	0.634	37%	0.373	S	S	*	.			trans	-72.3	118.2	178.6	-71.3	-67.7	0	0	0	110.6	R85 Q133 G134	R85-H136 PolarHBondContact NH1-O 2.97Å; Q133-H136 PolarHBondContact O-N 3.29Å; G134-H136 VanDerWaalsContact C-N 3.3Å; G134-H136 PolarHBondContact O-N 2.71Å
137	F	78.4	Confident	87.4	Confident	42 Å²	42	75.9 Å²	75.9	18%	0.184	38%	0.383	C	S	.	.			trans	-118.3	126.8	-179.4	-177.7	-104.1	0	0	0	110.6	Y49 W83 R85 S135 E139 F142	Y49-F137 HydrophobicContact CD1-CD1 4.05Å; Y49-F137 AromaticContact CD1-CE1 3.76Å; Y49-F137 HydrophobicContact CD1-CE1 3.76Å; Y49-F137 AromaticContact CG-CD1 3.96Å; Y49-F137 HydrophobicContact CG-CD1 3.96Å; Y49-F137 HydrophobicContact CG-CE1 4.03Å; W83-F137 HydrophobicContact CB-CE1 4.16Å; W83-F137 HydrophobicContact CB-CE2 4.39Å; W83-F137 HydrophobicContact CB-CZ 3.62Å; W83-F137 HydrophobicContact CD2-CE1 4.31Å; W83-F137 AromaticContact CD2-CZ 3.58Å; W83-F137 HydrophobicContact CD2-CZ 3.58Å; W83-F137 HydrophobicContact CE3-CE2 4.23Å; W83-F137 AromaticContact CE3-CZ 3.62Å; W83-F137 HydrophobicContact CE3-CZ 3.62Å; W83-F137 HydrophobicContact CG-CE1 4.07Å; W83-F137 AromaticContact CG-CZ 3.59Å; W83-F137 HydrophobicContact CG-CZ 3.59Å; W83-F137 HydrophobicContact CZ3-CZ 4.4Å; R85-F137 HydrophobicContact CB-CD2 4.45Å; R85-F137 HydrophobicContact CB-CE2 4.31Å; S135-F137 PolarHBondContact O-N 3.27Å; F137-E139 HydrophobicContact CD1-CG 4.41Å; F137-E139 HydrophobicContact CE1-CG 3.55Å; F137-E139 HydrophobicContact CZ-CG 4.07Å; F137-F142 HydrophobicContact CD2-CE2 4.17Å; F137-F142 HydrophobicContact CE2-CD2 4.47Å; F137-F142 AromaticContact CE2-CE2 3.81Å; F137-F142 HydrophobicContact CE2-CE2 3.81Å; F137-F142 HydrophobicContact CE2-CZ 4.25Å
138	R	82.4	Confident	87.6	Confident	143 Å²	143	74.6 Å²	74.6	54%	0.54	38%	0.376	S	S	.	.			trans	-137.2	109	178.7	-69	-178.1	-178.2	-175.5	4.6	110	H140 Q141 F142	R138-H140 VanDerWaalsContact C-N 3.34Å; R138-H140 PolarHBondContact O-N 2.76Å; R138-Q141 HydrophobicContact CB-CG 4.01Å; R138-Q141 PolarHBondContact O-N 2.75Å; R138-F142 WeakPolarHBondContact O-CD2 3.08Å
139	E	83.9	Confident	87.5	Confident	68 Å²	68	75.4 Å²	75.4	32%	0.318	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-56	-42.9	-174.1	-64.6	175.6	-137.7	0	0	113.3	Y49 N81 W83 F137 Q141 F142	Y49-E139 WeakPolarHBondContact CE1-OE1 3.27Å; N81-E139 PolarHBondContact ND2-OE2 2.74Å; W83-E139 HydrophobicContact CH2-CB 4.37Å; W83-E139 HydrophobicContact CZ2-CB 3.95Å; W83-E139 HydrophobicContact CZ2-CG 3.98Å; F137-E139 HydrophobicContact CD1-CG 4.41Å; F137-E139 HydrophobicContact CE1-CG 3.55Å; F137-E139 HydrophobicContact CZ-CG 4.07Å; E139-Q141 PolarHBondContact O-N 3.41Å; E139-Q141 VanDerWaalsContact O-N 3.11Å; E139-F142 PolarHBondContact O-N 3.04Å
140	H	85.1	Confident	87.3	Confident	149 Å²	149	76 Å²	76	69%	0.69	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-68	-11.1	-174.7	63.9	-90.5	0	0	0	115.3	R138	R138-H140 VanDerWaalsContact C-N 3.34Å; R138-H140 PolarHBondContact O-N 2.76Å
141	Q	89.3	Confident	87	Confident	85 Å²	85	78.9 Å²	78.9	40%	0.397	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-86.4	-19.9	-178.8	-62.9	-174.5	-29.3	0	0	112.3	L127 R138 E139	L127-Q141 HydrophobicContact CD1-CB 4.05Å; L127-Q141 WeakPolarHBondContact CD1-O 3.31Å; L127-Q141 HydrophobicContact CD2-CB 4.09Å; R138-Q141 HydrophobicContact CB-CG 4.01Å; R138-Q141 PolarHBondContact O-N 2.75Å; E139-Q141 PolarHBondContact O-N 3.41Å; E139-Q141 VanDerWaalsContact O-N 3.11Å
142	F	92.5	Very high	86.9	Confident	22 Å²	22	79.3 Å²	79.3	10%	0.096	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-78.5	132.7	-178	-75.5	-93.3	0	0	0	111.1	W83 R85 L125 Y126 L127 F137 R138 E139 A184	W83-F142 HydrophobicContact CH2-CB 4.48Å; W83-F142 HydrophobicContact CZ3-CB 4.15Å; W83-F142 HydrophobicContact CZ3-CD2 4.4Å; W83-F142 HydrophobicContact CZ3-CG 4.23Å; R85-F142 HydrophobicContact CG-CE1 4.23Å; R85-F142 HydrophobicContact CG-CZ 3.87Å; L125-F142 HydrophobicContact CB-CB 4.03Å; L125-F142 HydrophobicContact CB-CD1 4.32Å; L125-F142 HydrophobicContact CD2-CB 3.98Å; Y126-F142 WeakPolarHBondContact O-CA 3.38Å; L127-F142 HydrophobicContact CB-CD1 3.76Å; L127-F142 HydrophobicContact CB-CE1 3.67Å; L127-F142 HydrophobicContact CB-CG 4.24Å; L127-F142 HydrophobicContact CB-CZ 4.08Å; L127-F142 HydrophobicContact CD2-CE2 4.11Å; L127-F142 HydrophobicContact CD2-CZ 4.07Å; F137-F142 HydrophobicContact CD2-CE2 4.17Å; F137-F142 HydrophobicContact CE2-CD2 4.47Å; F137-F142 AromaticContact CE2-CE2 3.81Å; F137-F142 HydrophobicContact CE2-CE2 3.81Å; F137-F142 HydrophobicContact CE2-CZ 4.25Å; R138-F142 WeakPolarHBondContact O-CD2 3.08Å; E139-F142 PolarHBondContact O-N 3.04Å; F142-A184 HydrophobicContact CD1-CB 3.65Å; F142-A184 HydrophobicContact CE1-CB 3.57Å; F142-A184 HydrophobicContact CG-CB 4.39Å; F142-A184 HydrophobicContact CZ-CB 4.24Å
143	Q	93.3	Very high	86.9	Confident	118 Å²	118	76.1 Å²	76.1	55%	0.551	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	132	171.6	-172.8	169.1	36	0	0	109.4	L125 Y126 I145	L125-Q143 CarbonylContact C-O 3.54Å; L125-Q143 WeakPolarHBondContact CA-O 3.49Å; L125-Q143 WeakPolarHBondContact CB-O 3.4Å; Y126-Q143 HydrophobicContact CD1-CB 4.16Å; Y126-Q143 HydrophobicContact CE1-CB 3.87Å; Y126-Q143 HydrophobicContact CE1-CG 4.08Å; Y126-Q143 PolarHBondContact N-O 2.98Å; Y126-Q143 PolarHBondContact O-N 3.36Å; Y126-Q143 PolarHBondContact OH-OE1 2.88Å; Q143-I145 PolarHBondContact O-N 3.26Å
144	K	94.6	Very high	87	Confident	102 Å²	102	72.6 Å²	72.6	44%	0.443	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	127	176.4	-176.7	171.4	173.1	169.9	0	110.3	N123 L125 T147	N123-K144 VanDerWaalsContact OD1-CE 3.29Å; N123-K144 WeakPolarHBondContact OD1-CE 3.45Å; N123-K144 PolarHBondContact OD1-NZ 2.85Å; L125-K144 HydrophobicContact CD2-CB 4.12Å; L125-K144 HydrophobicContact CG-CB 4.3Å; K144-T147 VanDerWaalsContact CE-OG1 3.25Å; K144-T147 WeakPolarHBondContact CE-OG1 3.45Å; K144-T147 PolarHBondContact NZ-OG1 2.89Å
145	I	94.8	Very high	87.2	Confident	41 Å²	41	72.5 Å²	72.5	21%	0.21	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-61.8	172.6	-61	168.5	0	0	0	108.2	L124 Y126 Q143 R171 V173 L183	L124-I145 HydrophobicContact CB-CB 4.47Å; L124-I145 HydrophobicContact CD1-CD1 4.45Å; L124-I145 HydrophobicContact CD2-CB 4.24Å; L124-I145 HydrophobicContact CD2-CD1 3.94Å; L124-I145 HydrophobicContact CD2-CG2 4.17Å; L124-I145 HydrophobicContact CG-CB 4.13Å; L124-I145 HydrophobicContact CG-CD1 3.74Å; L124-I145 HydrophobicContact CG-CG1 4.42Å; L124-I145 WeakPolarHBondContact O-CA 3.24Å; L124-I145 WeakPolarHBondContact O-CB 3.38Å; L124-I145 PolarHBondContact O-N 2.88Å; Y126-I145 HydrophobicContact CD1-CD1 3.85Å; Y126-I145 HydrophobicContact CD1-CG1 3.45Å; Y126-I145 VanDerWaalsContact CD1-CG1 3.45Å; Y126-I145 HydrophobicContact CE1-CG1 4.13Å; Y126-I145 HydrophobicContact CG-CD1 4.09Å; Y126-I145 HydrophobicContact CG-CG1 4.2Å; Q143-I145 PolarHBondContact O-N 3.26Å; I145-R171 HydrophobicContact CG2-CB 4.07Å; I145-V173 HydrophobicContact CD1-CG2 3.45Å; I145-V173 VanDerWaalsContact CD1-CG2 3.45Å; I145-V173 HydrophobicContact CG1-CG2 4Å; I145-V173 HydrophobicContact CG2-CG2 4.06Å; I145-L183 HydrophobicContact CD1-CD2 4.16Å
146	D	95.4	Very high	87.3	Confident	61 Å²	61	74.4 Å²	74.4	33%	0.326	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	169.7	-178.6	-156.9	4.8	0	0	0	112.5	L124 I148 R171	L124-D146 PolarHBondContact N-O 2.59Å; L124-D146 PolarHBondContact O-N 2.89Å; D146-I148 HydrophobicContact CB-CD1 4.32Å; D146-R171 HydrophobicContact CB-CG 4.44Å; D146-R171 IonicContact OD2-CZ 3.51Å; D146-R171 IonicContact OD2-NE 2.71Å; D146-R171 PolarHBondContact OD2-NE 3.48Å; D146-R171 IonicContact OD2-NH2 2.79Å
147	T	95	Very high	87.1	Confident	55 Å²	55	72.7 Å²	72.7	34%	0.337	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.6	166.1	-42.5	0	0	0	0	108.2	T121 K144	T121-T147 HydrophobicContact CG2-CG2 4.19Å; K144-T147 VanDerWaalsContact CE-OG1 3.25Å; K144-T147 WeakPolarHBondContact CE-OG1 3.45Å; K144-T147 PolarHBondContact NZ-OG1 2.89Å
148	I	96.4	Very high	87	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.5	-178.3	-50	-56.5	0	0	0	109	L101 F103 T121 F122 L124 D146 E169 R171	L101-I148 HydrophobicContact CD1-CD1 4.39Å; L101-I148 HydrophobicContact CD1-CG1 4.08Å; F103-I148 HydrophobicContact CE1-CG2 3.65Å; F103-I148 HydrophobicContact CZ-CG2 3.63Å; T121-I148 CarbonylContact C-O 3.38Å; T121-I148 WeakPolarHBondContact CA-O 3.35Å; T121-I148 WeakPolarHBondContact CB-O 3.06Å; F122-I148 HydrophobicContact CD1-CB 4.16Å; F122-I148 HydrophobicContact CD1-CG2 4.48Å; F122-I148 HydrophobicContact CD2-CB 4.31Å; F122-I148 HydrophobicContact CD2-CG1 4.42Å; F122-I148 HydrophobicContact CE1-CB 3.72Å; F122-I148 HydrophobicContact CE1-CG2 3.63Å; F122-I148 HydrophobicContact CE2-CB 3.89Å; F122-I148 HydrophobicContact CE2-CG1 3.86Å; F122-I148 HydrophobicContact CE2-CG2 4.3Å; F122-I148 HydrophobicContact CG-CB 4.44Å; F122-I148 HydrophobicContact CZ-CB 3.59Å; F122-I148 HydrophobicContact CZ-CG1 3.97Å; F122-I148 HydrophobicContact CZ-CG2 3.53Å; F122-I148 PolarHBondContact N-O 2.83Å; F122-I148 PolarHBondContact O-N 2.85Å; L124-I148 HydrophobicContact CB-CD1 4.21Å; L124-I148 HydrophobicContact CB-CG1 3.99Å; D146-I148 HydrophobicContact CB-CD1 4.32Å; I148-E169 HydrophobicContact CG2-CB 4.18Å; I148-E169 HydrophobicContact CG2-CG 3.98Å; I148-R171 HydrophobicContact CD1-CG 4Å
149	A	92.2	Very high	86.4	Confident	45 Å²	45	68.9 Å²	68.9	37%	0.372	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	157.5	172.9	0	0	0	0	0	109.1	F103 T121	F103-A149 WeakPolarHBondContact CZ-O 3.35Å; T121-A149 HydrophobicContact CG2-CB 3.93Å
150	A	89.8	Confident	85.6	Confident	26 Å²	26	68.6 Å²	68.6	22%	0.215	37%	0.374	C	S	.	.			trans	-85.8	138.8	172.4	0	0	0	0	0	110.8	F103 L105	F103-A150 HydrophobicContact CE2-CB 3.97Å; F103-A150 HydrophobicContact CZ-CB 4.37Å; L105-A150 HydrophobicContact CB-CB 3.72Å; L105-A150 HydrophobicContact CD1-CB 4.27Å; L105-A150 HydrophobicContact CD2-CB 4.27Å; L105-A150 HydrophobicContact CG-CB 4.3Å
151	D	85.3	Confident	84.8	Confident	133 Å²	133	67.2 Å²	67.2	71%	0.711	37%	0.372	S	S	*	.	S	Bend	trans	-69	-40.3	166.5	-77.1	-27.3	0	0	0	110.5	N167	D151-N167 PolarHBondContact N-OD1 3.1Å
152	E	84.4	Confident	83.9	Confident	112 Å²	112	74.3 Å²	74.3	52%	0.523	40%	0.395	S	S	.	.	S	Bend	trans	-129.7	127.3	174.8	-54.3	-168.9	174.7	0	0	112	K165 N167	E152-K165 HydrophobicContact CB-CB 4.31Å; E152-K165 HydrophobicContact CB-CD 3.79Å; E152-K165 WeakPolarHBondContact OE2-CD 3.43Å; E152-K165 IonicContact OE2-NZ 3.53Å; E152-N167 PolarHBondContact N-OD1 3.39Å; E152-N167 PolarHBondContact O-ND2 3.42Å; E152-N167 PolarHBondContact O-OD1 2.73Å
153	S	86.3	Confident	82.8	Confident	34 Å²	34	77.3 Å²	77.3	24%	0.238	41%	0.411	C	S	.	.			trans	-100.7	148.9	170.2	58.1	0	0	0	0	111.1	L105 K165	L105-S153 VanDerWaalsContact O-CA 3.31Å; L105-S153 WeakPolarHBondContact O-CA 3.41Å; S153-K165 WeakPolarHBondContact O-CD 3.23Å; S153-K165 PolarHBondContact O-NZ 2.81Å
154	F	82.2	Confident	81.8	Confident	19 Å²	19	77.4 Å²	77.4	8%	0.083	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-97.1	146.6	175.7	68.3	-92.4	0	0	0	111.4	L105 R106 D107 D158 L159 K165	L105-F154 WeakPolarHBondContact O-CD1 3.35Å; L105-F154 WeakPolarHBondContact O-CE1 3.23Å; L105-F154 PolarHBondContact O-N 2.82Å; L105-F154 VanDerWaalsContact O-N 3.08Å; R106-F154 HydrophobicContact CB-CD2 4.39Å; R106-F154 HydrophobicContact CB-CE1 3.99Å; R106-F154 HydrophobicContact CB-CE2 3.75Å; R106-F154 HydrophobicContact CB-CZ 3.53Å; R106-F154 HydrophobicContact CG-CD2 4.16Å; R106-F154 HydrophobicContact CG-CE2 3.68Å; R106-F154 HydrophobicContact CG-CZ 4.02Å; D107-F154 PolarHBondContact N-O 2.78Å; F154-D158 HydrophobicContact CB-CB 4.19Å; F154-L159 HydrophobicContact CD2-CD1 4.09Å; F154-L159 HydrophobicContact CD2-CG 4.02Å; F154-L159 HydrophobicContact CE2-CD1 3.97Å; F154-L159 HydrophobicContact CE2-CD2 4.25Å; F154-L159 HydrophobicContact CE2-CG 4.1Å; F154-K165 HydrophobicContact CB-CD 4.49Å; F154-K165 HydrophobicContact CB-CG 4.33Å
155	T	82.4	Confident	81.2	Confident	33 Å²	33	75.2 Å²	75.2	20%	0.202	41%	0.405	C	S	.	.			trans	-115.3	178.7	-174.3	64.1	0	0	0	0	111.7	D107 T157 D158 L159	D107-T155 HydrophobicContact CB-CG2 4.07Å; T155-T157 VanDerWaalsContact C-N 3.26Å; T155-T157 PolarHBondContact O-N 2.84Å; T155-T157 PolarHBondContact OG1-OG1 3.02Å; T155-D158 PolarHBondContact N-OD2 2.64Å; T155-D158 PolarHBondContact O-N 2.63Å; T155-D158 PolarHBondContact OG1-OD2 2.89Å; T155-L159 PolarHBondContact O-N 2.93Å; T155-L159 VanDerWaalsContact O-N 3.16Å
156	Q	74.3	Confident	80.9	Confident	138 Å²	138	76.1 Å²	76.1	65%	0.645	41%	0.41	S	S	*	.	H	α-helix	trans	-65.5	-28.3	179.2	-169.8	168.7	15.2	0	0	113	G160	Q156-G160 PolarHBondContact O-N 2.82Å
157	T	72.1	Confident	80.7	Confident	101 Å²	101	73.6 Å²	73.6	62%	0.62	40%	0.396	S	S	*	.	H	α-helix	trans	-69.5	-41.9	173.3	40.8	0	0	0	0	111.4	T155 L159 G160 D161	T155-T157 VanDerWaalsContact C-N 3.26Å; T155-T157 PolarHBondContact O-N 2.84Å; T155-T157 PolarHBondContact OG1-OG1 3.02Å; T157-L159 VanDerWaalsContact C-N 3.31Å; T157-L159 PolarHBondContact O-N 2.9Å; T157-G160 WeakPolarHBondContact O-CA 3.31Å; T157-G160 PolarHBondContact O-N 2.76Å; T157-D161 PolarHBondContact O-N 3.04Å
158	D	74.8	Confident	80.6	Confident	27 Å²	27	74 Å²	74	14%	0.144	40%	0.399	C	S	.	.	H	α-helix	trans	-65.5	-35.4	179.5	-54.6	-44.2	0	0	0	112	F154 T155 G160 D161 R162 I163	F154-D158 HydrophobicContact CB-CB 4.19Å; T155-D158 PolarHBondContact N-OD2 2.64Å; T155-D158 PolarHBondContact O-N 2.63Å; T155-D158 PolarHBondContact OG1-OD2 2.89Å; D158-G160 VanDerWaalsContact C-N 3.3Å; D158-G160 PolarHBondContact O-N 3.31Å; D158-D161 CarbonylContact O-C 3.6Å; D158-D161 PolarHBondContact O-N 3.27Å; D158-R162 PolarHBondContact O-N 3.41Å; D158-R162 VanDerWaalsContact O-N 3.09Å; D158-I163 HydrophobicContact CB-CB 4.46Å; D158-I163 PolarHBondContact O-N 3.22Å
159	L	70.1	Confident	80.6	Confident	78 Å²	78	75.3 Å²	75.3	41%	0.408	41%	0.405	S	S	.	.	H	α-helix	trans	-62.7	-34.5	171.3	-82.1	155	0	0	0	112.7	F154 T155 T157 D161 R162	F154-L159 HydrophobicContact CD2-CD1 4.09Å; F154-L159 HydrophobicContact CD2-CG 4.02Å; F154-L159 HydrophobicContact CE2-CD1 3.97Å; F154-L159 HydrophobicContact CE2-CD2 4.25Å; F154-L159 HydrophobicContact CE2-CG 4.1Å; T155-L159 PolarHBondContact O-N 2.93Å; T155-L159 VanDerWaalsContact O-N 3.16Å; T157-L159 VanDerWaalsContact C-N 3.31Å; T157-L159 PolarHBondContact O-N 2.9Å; L159-D161 VanDerWaalsContact C-N 3.33Å; L159-R162 PolarHBondContact O-N 3.39Å
160	G	67.4	Low	80.7	Confident	62 Å²	62	76 Å²	76	64%	0.639	41%	0.405	S	S	*	.	H	α-helix	trans	-65.5	-36.3	175.6	0	0	0	0	0	112.7	Q156 T157 D158	Q156-G160 PolarHBondContact O-N 2.82Å; T157-G160 WeakPolarHBondContact O-CA 3.31Å; T157-G160 PolarHBondContact O-N 2.76Å; D158-G160 VanDerWaalsContact C-N 3.3Å; D158-G160 PolarHBondContact O-N 3.31Å
161	D	67.9	Low	80.9	Confident	120 Å²	120	77.5 Å²	77.5	64%	0.642	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	2.4	179.3	-65.2	-28	0	0	0	113.4	T157 D158 L159 I163	T157-D161 PolarHBondContact O-N 3.04Å; D158-D161 CarbonylContact O-C 3.6Å; D158-D161 PolarHBondContact O-N 3.27Å; L159-D161 VanDerWaalsContact C-N 3.33Å; D161-I163 HydrophobicContact CB-CD1 3.82Å; D161-I163 HydrophobicContact CB-CG1 3.94Å; D161-I163 PolarHBondContact O-N 2.88Å
162	R	70.8	Confident	81.2	Confident	233 Å²	233	75.6 Å²	75.6	88%	0.879	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	30.9	-175.3	-56.4	-177.7	176.2	-166.5	-1.6	114.1	D158 L159	D158-R162 PolarHBondContact O-N 3.41Å; D158-R162 VanDerWaalsContact O-N 3.09Å; L159-R162 PolarHBondContact O-N 3.39Å
163	I	69.6	Low	81.5	Confident	86 Å²	86	70.6 Å²	70.6	44%	0.441	37%	0.369	S	S	.	.			trans	-94.1	109.4	178.9	-57.8	174.3	0	0	0	108.2	D158 D161	D158-I163 HydrophobicContact CB-CB 4.46Å; D158-I163 PolarHBondContact O-N 3.22Å; D161-I163 HydrophobicContact CB-CD1 3.82Å; D161-I163 HydrophobicContact CB-CG1 3.94Å; D161-I163 PolarHBondContact O-N 2.88Å
164	L	72.3	Confident	81.5	Confident	119 Å²	119	70.7 Å²	70.7	62%	0.623	38%	0.375	S	S	*	.			trans	-95.8	129.6	169.5	-66.4	174.8	0	0	0	109
165	K	82.3	Confident	81.8	Confident	56 Å²	56	74.5 Å²	74.5	24%	0.243	40%	0.402	C	S	.	.			trans	-94.5	108	178.5	-62.5	-174.6	179.5	-178.1	0	110.1	E152 S153 F154 N167	E152-K165 HydrophobicContact CB-CB 4.31Å; E152-K165 HydrophobicContact CB-CD 3.79Å; E152-K165 WeakPolarHBondContact OE2-CD 3.43Å; E152-K165 IonicContact OE2-NZ 3.53Å; S153-K165 WeakPolarHBondContact O-CD 3.23Å; S153-K165 PolarHBondContact O-NZ 2.81Å; F154-K165 HydrophobicContact CB-CD 4.49Å; F154-K165 HydrophobicContact CB-CG 4.33Å; K165-N167 PolarHBondContact O-ND2 2.84Å
166	L	88.1	Confident	82.1	Confident	61 Å²	61	73.3 Å²	73.3	32%	0.319	39%	0.394	S	S	.	.			trans	-89.4	116.6	-178.7	-172.3	67.3	0	0	0	110.2	E62 K102 T104 V195	E62-L166 WeakPolarHBondContact OE1-CD2 3.48Å; K102-L166 HydrophobicContact CB-CD1 4.08Å; K102-L166 HydrophobicContact CB-CG 4.39Å; K102-L166 HydrophobicContact CD-CD2 4.3Å; T104-L166 HydrophobicContact CG2-CD1 4.19Å; L166-V195 HydrophobicContact CD1-CB 3.92Å; L166-V195 HydrophobicContact CD1-CG1 4.16Å; L166-V195 HydrophobicContact CD1-CG2 3.74Å
167	N	91.1	Very high	82.9	Confident	7 Å²	7	71.2 Å²	71.2	4%	0.037	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	145	176.3	-63.3	-89.8	0	0	0	109.8	K102 F103 D151 E152 K165	K102-N167 CarbonylContact C-O 3.51Å; K102-N167 WeakPolarHBondContact CA-O 3.44Å; F103-N167 HydrophobicContact CD1-CB 4.18Å; F103-N167 HydrophobicContact CD2-CB 4.37Å; F103-N167 HydrophobicContact CE1-CB 3.8Å; F103-N167 HydrophobicContact CE2-CB 4.03Å; F103-N167 HydrophobicContact CG-CB 4.43Å; F103-N167 HydrophobicContact CZ-CB 3.72Å; F103-N167 PolarHBondContact N-O 3.39Å; F103-N167 WeakPolarHBondContact O-CB 3.4Å; F103-N167 PolarHBondContact O-N 2.81Å; F103-N167 PolarHBondContact O-ND2 3.15Å; D151-N167 PolarHBondContact N-OD1 3.1Å; E152-N167 PolarHBondContact N-OD1 3.39Å; E152-N167 PolarHBondContact O-ND2 3.42Å; E152-N167 PolarHBondContact O-OD1 2.73Å; K165-N167 PolarHBondContact O-ND2 2.84Å
168	T	93.3	Very high	83.9	Confident	65 Å²	65	70.2 Å²	70.2	40%	0.399	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.2	174.7	-58.5	0	0	0	0	110	E100 L101 K102	E100-T168 HydrophobicContact CG-CG2 4.11Å; L101-T168 CarbonylContact O-C 3.45Å; L101-T168 VanDerWaalsContact O-CA 3.29Å; L101-T168 WeakPolarHBondContact O-CA 3.38Å; K102-T168 HydrophobicContact CG-CG2 4.21Å
169	E	94.9	Very high	84.8	Confident	26 Å²	26	75.2 Å²	75.2	12%	0.121	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.6	-178.4	-76.5	-68.9	159.3	0	0	110.5	E100 L101 F103 I148 R171	E100-E169 CarbonylContact C-O 3.57Å; E100-E169 WeakPolarHBondContact CA-O 3.17Å; L101-E169 PolarHBondContact N-O 3.15Å; L101-E169 PolarHBondContact O-N 3.01Å; F103-E169 HydrophobicContact CE1-CB 4.12Å; F103-E169 HydrophobicContact CE1-CG 3.76Å; F103-E169 HydrophobicContact CZ-CG 4.22Å; I148-E169 HydrophobicContact CG2-CB 4.18Å; I148-E169 HydrophobicContact CG2-CG 3.98Å; E169-R171 IonicContact OE2-CZ 3.96Å; E169-R171 IonicContact OE2-NH1 3.3Å; E169-R171 PolarHBondContact OE2-NH1 2.93Å; E169-R171 IonicContact OE2-NH2 3.6Å; E169-R171 PolarHBondContact OE2-NH2 2.9Å
170	V	95	Very high	85.9	Confident	60 Å²	60	71.6 Å²	71.6	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.2	178.3	-175.3	0	0	0	0	109.9	Y98 V99 E100	Y98-V170 HydrophobicContact CD1-CG1 4.32Å; V99-V170 CarbonylContact O-C 3.43Å; V99-V170 WeakPolarHBondContact O-CA 3.38Å; E100-V170 HydrophobicContact CB-CG2 4.12Å; E100-V170 HydrophobicContact CG-CG2 4.11Å
171	R	94.9	Very high	87.2	Confident	57 Å²	57	68.7 Å²	68.7	22%	0.215	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141	174.5	-66.6	-64	176.5	-76.6	-5.7	111.7	Y98 V99 L124 I145 D146 I148 E169	Y98-R171 WeakPolarHBondContact CA-O 3.2Å; V99-R171 PolarHBondContact N-O 3.37Å; V99-R171 PolarHBondContact O-N 2.96Å; L124-R171 HydrophobicContact CD2-CB 4.09Å; L124-R171 HydrophobicContact CD2-CG 4.26Å; I145-R171 HydrophobicContact CG2-CB 4.07Å; D146-R171 HydrophobicContact CB-CG 4.44Å; D146-R171 IonicContact OD2-CZ 3.51Å; D146-R171 IonicContact OD2-NE 2.71Å; D146-R171 PolarHBondContact OD2-NE 3.48Å; D146-R171 IonicContact OD2-NH2 2.79Å; I148-R171 HydrophobicContact CD1-CG 4Å; E169-R171 IonicContact OE2-CZ 3.96Å; E169-R171 IonicContact OE2-NH1 3.3Å; E169-R171 PolarHBondContact OE2-NH1 2.93Å; E169-R171 IonicContact OE2-NH2 3.6Å; E169-R171 PolarHBondContact OE2-NH2 2.9Å
172	E	91.6	Very high	88.5	Confident	93 Å²	93	63 Å²	63	44%	0.435	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	137.5	177.9	171.6	-179.8	155.5	0	0	110.4	K96 I97 S222	K96-E172 HydrophobicContact CD-CG 3.88Å; K96-E172 VanDerWaalsContact CD-OE1 3.22Å; K96-E172 WeakPolarHBondContact CD-OE1 3.36Å; K96-E172 VanDerWaalsContact CE-CG 3.49Å; K96-E172 WeakPolarHBondContact CE-OE1 3.29Å; K96-E172 WeakPolarHBondContact CE-OE2 3.44Å; K96-E172 HydrophobicContact CG-CG 3.94Å; K96-E172 IonicContact NZ-OE1 3.54Å; K96-E172 PolarHBondContact NZ-OE1 2.85Å; K96-E172 IonicContact NZ-OE2 2.66Å; K96-E172 PolarHBondContact NZ-OE2 3.26Å; I97-E172 WeakPolarHBondContact O-CA 3.24Å; E172-S222 PolarHBondContact OE1-OG 3.17Å
173	V	90.7	Very high	89.7	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	126.3	176.1	-169.5	0	0	0	0	109.6	K96 I97 V99 Y126 I145 L176	K96-V173 WeakPolarHBondContact CA-O 3.26Å; I97-V173 HydrophobicContact CD1-CB 4.07Å; I97-V173 HydrophobicContact CD1-CG2 4.49Å; I97-V173 HydrophobicContact CG1-CB 3.71Å; I97-V173 HydrophobicContact CG1-CG2 4.37Å; I97-V173 WeakPolarHBondContact CG1-O 3.4Å; I97-V173 PolarHBondContact N-O 2.78Å; I97-V173 PolarHBondContact O-N 2.96Å; V99-V173 HydrophobicContact CG2-CG2 4.22Å; Y126-V173 HydrophobicContact CD1-CG1 4.06Å; Y126-V173 HydrophobicContact CD2-CG1 3.79Å; Y126-V173 HydrophobicContact CE1-CG1 3.89Å; Y126-V173 HydrophobicContact CE2-CG1 3.64Å; Y126-V173 HydrophobicContact CG-CG1 4Å; I145-V173 HydrophobicContact CD1-CG2 3.45Å; I145-V173 VanDerWaalsContact CD1-CG2 3.45Å; I145-V173 HydrophobicContact CG1-CG2 4Å; I145-V173 HydrophobicContact CG2-CG2 4.06Å; V173-L176 HydrophobicContact CG1-CD2 4.2Å
174	G	85.4	Confident	90.9	Very high	36 Å²	36	47.8 Å²	47.8	37%	0.371	26%	0.26	S	S	.	.			trans	160.7	174.3	176.6	0	0	0	0	0	112.9
175	P	88.4	Confident	92.1	Very high	99 Å²	99	42.1 Å²	42.1	64%	0.643	23%	0.23	S	C	*	.			cis	-75.3	131.6	0.5	29.6	-33.9	0	0	0	112.8	Q95	Q95-P175 CarbonylContact O-C 3.53Å; Q95-P175 VanDerWaalsContact O-CA 3.23Å; Q95-P175 WeakPolarHBondContact O-CA 3.39Å
176	L	89.9	Confident	92.7	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.042	23%	0.225	C	C	.	.			trans	-84.8	135	176.3	-62.6	178.1	0	0	0	110.5	R91 Q95 I97 Y126 E128 V173 F181	R91-L176 HydrophobicContact CG-CB 4.24Å; R91-L176 HydrophobicContact CG-CD1 4Å; Q95-L176 PolarHBondContact O-N 2.94Å; I97-L176 HydrophobicContact CB-CD1 4.4Å; I97-L176 HydrophobicContact CD1-CD1 3.96Å; I97-L176 HydrophobicContact CG1-CD1 3.97Å; I97-L176 HydrophobicContact CG2-CD1 3.63Å; Y126-L176 HydrophobicContact CD2-CD2 4.37Å; Y126-L176 HydrophobicContact CE2-CD2 3.95Å; E128-L176 HydrophobicContact CG-CD2 3.81Å; V173-L176 HydrophobicContact CG1-CD2 4.2Å; L176-F181 HydrophobicContact CD1-CD1 3.88Å; L176-F181 HydrophobicContact CD1-CE1 3.91Å
177	S	90.1	Very high	93	Very high	95 Å²	95	38 Å²	38	66%	0.664	21%	0.21	S	C	*	.			trans	-115	-30.1	-172	61.5	0	0	0	0	113.7	E128	E128-S177 PolarHBondContact OE2-N 2.03Å; E128-S177 PolarHBondContact OE2-OG 3.21Å
178	K	93.4	Very high	93.1	Very high	80 Å²	80	40 Å²	40	35%	0.348	22%	0.223	S	C	.	.	S	Bend	trans	-87.3	174.5	-177.1	-59.9	-163.3	-166	167.4	0	113.1	R91 E128 D130 G180	R91-K178 VanDerWaalsContact CD-O 3.27Å; R91-K178 WeakPolarHBondContact CD-O 3.44Å; R91-K178 PolarHBondContact NE-O 3.24Å; E128-K178 HydrophobicContact CB-CB 4.12Å; E128-K178 HydrophobicContact CB-CD 3.97Å; E128-K178 HydrophobicContact CB-CG 4.07Å; E128-K178 WeakPolarHBondContact O-CD 3.49Å; E128-K178 PolarHBondContact O-NZ 2.82Å; E128-K178 PolarHBondContact OE2-N 2.79Å; E128-K178 VanDerWaalsContact OE2-N 3.16Å; D130-K178 WeakPolarHBondContact OD1-CB 3.49Å; K178-G180 VanDerWaalsContact C-N 3.32Å; K178-G180 PolarHBondContact O-N 3.45Å
179	K	93	Very high	92.9	Very high	132 Å²	132	37 Å²	37	57%	0.574	20%	0.204	S	C	*	.	S	Bend	trans	-68	-26	-177.9	-65.1	179.7	-176.5	169.4	0	114.5	W88 R91 D130	W88-K179 HydrophobicContact CZ2-CB 4.23Å; R91-K179 WeakPolarHBondContact CB-O 3.48Å; R91-K179 PolarHBondContact N-O 2.83Å; D130-K179 HydrophobicContact CB-CD 4.43Å; D130-K179 PolarHBondContact OD1-N 3.4Å; D130-K179 VanDerWaalsContact OD1-N 3.12Å
180	G	93.7	Very high	92.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	-175.4	178.4	0	0	0	0	0	113.1	I89 T129 K178	I89-G180 CarbonylContact O-C 3.56Å; I89-G180 WeakPolarHBondContact O-CA 3.47Å; T129-G180 PolarHBondContact N-O 2.82Å; T129-G180 CarbonylContact O-C 3.57Å; T129-G180 PolarHBondContact O-N 2.84Å; K178-G180 VanDerWaalsContact C-N 3.32Å; K178-G180 PolarHBondContact O-N 3.45Å
181	F	95	Very high	92.7	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	163.6	-175.9	59.2	-84.5	0	0	0	112.4	L34 I89 I97 L127 E128 L176 L183 V199	L34-F181 HydrophobicContact CD1-CE1 4.2Å; L34-F181 HydrophobicContact CD1-CZ 4.15Å; I89-F181 HydrophobicContact CB-CD2 4.36Å; I89-F181 HydrophobicContact CB-CE1 4.25Å; I89-F181 HydrophobicContact CB-CE2 3.96Å; I89-F181 HydrophobicContact CB-CZ 3.88Å; I89-F181 HydrophobicContact CD1-CD2 4.36Å; I89-F181 HydrophobicContact CD1-CE2 3.74Å; I89-F181 HydrophobicContact CD1-CZ 4.28Å; I89-F181 HydrophobicContact CG1-CE2 4.41Å; I89-F181 HydrophobicContact CG2-CE1 4.06Å; I89-F181 HydrophobicContact CG2-CE2 4.14Å; I89-F181 HydrophobicContact CG2-CZ 3.61Å; I89-F181 PolarHBondContact N-O 3.01Å; I89-F181 PolarHBondContact O-N 2.94Å; I97-F181 HydrophobicContact CD1-CD1 4.49Å; I97-F181 HydrophobicContact CD1-CD2 4.01Å; I97-F181 HydrophobicContact CD1-CE1 3.91Å; I97-F181 HydrophobicContact CD1-CE2 3.34Å; I97-F181 HydrophobicContact CD1-CZ 3.3Å; I97-F181 HydrophobicContact CG2-CE1 4.26Å; I97-F181 HydrophobicContact CG2-CZ 4.23Å; L127-F181 CarbonylContact O-C 3.52Å; L127-F181 WeakPolarHBondContact O-CA 3.28Å; L127-F181 WeakPolarHBondContact O-CB 3.32Å; E128-F181 HydrophobicContact CG-CB 4.34Å; L176-F181 HydrophobicContact CD1-CD1 3.88Å; L176-F181 HydrophobicContact CD1-CE1 3.91Å; F181-L183 HydrophobicContact CD2-CD2 4.35Å; F181-L183 HydrophobicContact CD2-CG 4.41Å; F181-L183 HydrophobicContact CE2-CD2 4.38Å; F181-L183 HydrophobicContact CE2-CG 4.28Å; F181-V199 HydrophobicContact CE2-CG1 4.1Å; F181-V199 HydrophobicContact CZ-CG1 3.83Å
182	Y	94.8	Very high	92.7	Very high	1 Å²	1	31.2 Å²	31.2	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	148.7	167.3	-62.4	-85.7	0	0	0	109.9	R85 T86 W88 Y126 L127 T129 D132 Q133	R85-Y182 HydrophobicContact CG-CD1 4.37Å; T86-Y182 WeakPolarHBondContact O-CD1 3.04Å; W88-Y182 VanDerWaalsContact CA-CE1 3.45Å; W88-Y182 HydrophobicContact CB-CD1 4.37Å; W88-Y182 HydrophobicContact CB-CE1 3.6Å; W88-Y182 HydrophobicContact CB-CE2 4.48Å; W88-Y182 AromaticContact CD1-CE2 3.61Å; W88-Y182 AromaticContact CD1-CZ 3.63Å; W88-Y182 HydrophobicContact CG-CE1 4.37Å; W88-Y182 HydrophobicContact CG-CE2 4.44Å; W88-Y182 VanDerWaalsContact N-CE1 3.29Å; Y126-Y182 CarbonylContact C-O 3.56Å; Y126-Y182 WeakPolarHBondContact CA-O 3.08Å; Y126-Y182 WeakPolarHBondContact CB-O 3.44Å; L127-Y182 HydrophobicContact CD2-CD2 4.44Å; L127-Y182 PolarHBondContact N-O 3.45Å; L127-Y182 PolarHBondContact O-N 3.23Å; T129-Y182 HydrophobicContact CG2-CD2 4.35Å; T129-Y182 HydrophobicContact CG2-CE2 4.15Å; D132-Y182 WeakPolarHBondContact CA-OH 3.42Å; D132-Y182 PolarHBondContact OD1-OH 3.3Å; Q133-Y182 HydrophobicContact CB-CE2 4.49Å; Q133-Y182 HydrophobicContact CG-CE2 4.44Å; Q133-Y182 PolarHBondContact N-OH 3.16Å
183	L	95.9	Very high	92.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	147.9	162.3	-63.9	178.2	0	0	0	109.6	R85 T86 I89 V99 L125 I145 F181 V197 V199	R85-L183 WeakPolarHBondContact CA-O 3.47Å; R85-L183 WeakPolarHBondContact CG-O 3.45Å; T86-L183 HydrophobicContact CG2-CB 3.82Å; T86-L183 PolarHBondContact N-O 3.33Å; T86-L183 PolarHBondContact OG1-N 2.96Å; T86-L183 PolarHBondContact OG1-O 2.8Å; I89-L183 HydrophobicContact CD1-CD1 4.41Å; I89-L183 HydrophobicContact CD1-CG 4.38Å; V99-L183 HydrophobicContact CG1-CD1 3.75Å; V99-L183 HydrophobicContact CG2-CD1 3.9Å; V99-L183 HydrophobicContact CG2-CD2 4.11Å; L125-L183 CarbonylContact O-C 3.48Å; L125-L183 WeakPolarHBondContact O-CA 3.25Å; I145-L183 HydrophobicContact CD1-CD2 4.16Å; F181-L183 HydrophobicContact CD2-CD2 4.35Å; F181-L183 HydrophobicContact CD2-CG 4.41Å; F181-L183 HydrophobicContact CE2-CD2 4.38Å; F181-L183 HydrophobicContact CE2-CG 4.28Å; L183-V197 HydrophobicContact CD1-CG1 4.4Å; L183-V199 HydrophobicContact CD1-CG2 3.46Å; L183-V199 VanDerWaalsContact CD1-CG2 3.46Å
184	A	95.4	Very high	92.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	145.2	172.9	0	0	0	0	0	111.7	W83 L84 R85 L125 F142	W83-A184 HydrophobicContact CE3-CB 4.05Å; W83-A184 HydrophobicContact CZ3-CB 4.25Å; L84-A184 CarbonylContact O-C 3.57Å; L84-A184 WeakPolarHBondContact O-CA 3.48Å; R85-A184 HydrophobicContact CB-CB 4.48Å; R85-A184 HydrophobicContact CG-CB 4.42Å; L125-A184 HydrophobicContact CB-CB 4.4Å; L125-A184 PolarHBondContact N-O 3.5Å; L125-A184 PolarHBondContact O-N 2.77Å; F142-A184 HydrophobicContact CD1-CB 3.65Å; F142-A184 HydrophobicContact CE1-CB 3.57Å; F142-A184 HydrophobicContact CG-CB 4.39Å; F142-A184 HydrophobicContact CZ-CB 4.24Å
185	F	96.6	Very high	93.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.7	178.5	-52.3	-85.7	0	0	0	107.9	W46 W54 W83 L84 T86 L101 F122 N123 L124 L194 V197	W46-F185 AromaticContact CZ3-CE2 3.97Å; W46-F185 HydrophobicContact CZ3-CE2 3.97Å; W54-F185 HydrophobicContact CZ2-CB 4.21Å; W83-F185 CarbonylContact C-O 3.57Å; W83-F185 VanDerWaalsContact CA-O 3.31Å; W83-F185 WeakPolarHBondContact CA-O 3.42Å; L84-F185 HydrophobicContact CB-CB 4.29Å; L84-F185 HydrophobicContact CB-CD2 4.35Å; L84-F185 HydrophobicContact CD2-CD2 4.11Å; L84-F185 HydrophobicContact CG-CD2 4.23Å; L84-F185 PolarHBondContact N-O 2.99Å; L84-F185 WeakPolarHBondContact O-CD2 3.48Å; L84-F185 PolarHBondContact O-N 2.8Å; T86-F185 HydrophobicContact CG2-CE2 4.09Å; L101-F185 HydrophobicContact CD1-CE1 4.1Å; L101-F185 HydrophobicContact CD2-CE1 3.56Å; L101-F185 HydrophobicContact CD2-CZ 3.95Å; F122-F185 HydrophobicContact CD2-CD1 4.43Å; F122-F185 AromaticContact CE2-CD1 3.97Å; F122-F185 HydrophobicContact CE2-CD1 3.97Å; N123-F185 WeakPolarHBondContact O-CA 3.44Å; L124-F185 HydrophobicContact CD1-CD1 3.93Å; L124-F185 HydrophobicContact CD1-CE1 3.54Å; L124-F185 HydrophobicContact CD1-CZ 4.19Å; F185-L194 HydrophobicContact CB-CD1 4.18Å; F185-L194 HydrophobicContact CD1-CD1 3.97Å; F185-L194 HydrophobicContact CD2-CD1 4.05Å; F185-L194 HydrophobicContact CE1-CD1 4.38Å; F185-L194 HydrophobicContact CE2-CD1 4.48Å; F185-L194 HydrophobicContact CG-CD1 3.78Å; F185-V197 HydrophobicContact CE1-CG2 4.35Å; F185-V197 HydrophobicContact CE2-CG2 4.18Å; F185-V197 HydrophobicContact CZ-CB 4.45Å; F185-V197 HydrophobicContact CZ-CG1 3.95Å; F185-V197 HydrophobicContact CZ-CG2 3.63Å
186	Q	95.6	Very high	93.2	Very high	30 Å²	30	22.3 Å²	22.3	14%	0.14	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	117.9	-179.1	179.7	-164.7	39.8	0	0	109.6	N81 N82 W83 N123 L125 V188	N81-Q186 PolarHBondContact OD1-NE2 3.06Å; N82-Q186 CarbonylContact O-C 3.56Å; N82-Q186 WeakPolarHBondContact O-CA 3.21Å; W83-Q186 HydrophobicContact CD2-CB 4.18Å; W83-Q186 HydrophobicContact CD2-CG 4.21Å; W83-Q186 HydrophobicContact CE3-CB 4.25Å; W83-Q186 HydrophobicContact CZ2-CG 4.14Å; W83-Q186 VanDerWaalsContact CZ2-NE2 3.31Å; W83-Q186 HydrophobicContact CZ3-CB 4.48Å; N123-Q186 HydrophobicContact CB-CB 4.2Å; N123-Q186 PolarHBondContact N-O 2.9Å; N123-Q186 PolarHBondContact ND2-OE1 3.21Å; N123-Q186 PolarHBondContact O-N 2.8Å; L125-Q186 HydrophobicContact CD1-CB 3.69Å; Q186-V188 HydrophobicContact CG-CG1 4.39Å
187	D	95	Very high	93.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.6	171.3	162.9	56.9	0	0	0	110.8	W54 V72 N81 N82 G189 A190	W54-D187 HydrophobicContact CZ2-CB 3.87Å; V72-D187 HydrophobicContact CG1-CB 3.75Å; V72-D187 WeakPolarHBondContact CG2-OD2 3.43Å; N81-D187 WeakPolarHBondContact CA-O 3.37Å; N82-D187 HydrophobicContact CB-CB 4.11Å; N82-D187 PolarHBondContact N-O 2.83Å; N82-D187 PolarHBondContact ND2-OD2 3.47Å; N82-D187 PolarHBondContact O-N 2.8Å; D187-G189 PolarHBondContact OD1-N 2.92Å; D187-A190 WeakPolarHBondContact OD1-CB 3.46Å; D187-A190 PolarHBondContact OD1-N 2.83Å
188	V	92.1	Very high	93.6	Very high	50 Å²	50	18.5 Å²	18.5	30%	0.303	9%	0.093	S	C	.	.	S	Bend	trans	-123.6	17.3	-178.5	-64.8	0	0	0	0	112.4	K119 Q186	K119-V188 HydrophobicContact CG-CG2 4.3Å; Q186-V188 HydrophobicContact CG-CG1 4.39Å
189	G	90.5	Very high	93.7	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.01	8%	0.077	C	C	.	.	S	Bend	trans	127.1	30.1	176.1	0	0	0	0	0	114.4	C118 K119 D187	C118-G189 CarbonylContact C-O 3.59Å; C118-G189 WeakPolarHBondContact CA-O 3.31Å; K119-G189 PolarHBondContact N-O 2.8Å; D187-G189 PolarHBondContact OD1-N 2.92Å
190	A	92.4	Very high	93.7	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.052	C	C	.	.	B	Isolated β-bridge	trans	-96	161.2	176.1	0	0	0	0	0	112.3	K119 D187 V192	K119-A190 WeakPolarHBondContact O-CA 3.43Å; K119-A190 VanDerWaalsContact O-CB 3.24Å; K119-A190 WeakPolarHBondContact O-CB 3.29Å; D187-A190 WeakPolarHBondContact OD1-CB 3.46Å; D187-A190 PolarHBondContact OD1-N 2.83Å; A190-V192 HydrophobicContact CB-CG1 4.45Å
191	C	92.6	Very high	93.7	Very high	18 Å²	18	9.2 Å²	9.2	12%	0.122	5%	0.052	C	C	.	.			trans	-109.2	93	169	-167.1	0	0	0	0	108.5	V72 C73 V75 R106 I111	V72-C191 WeakPolarHBondContact O-CA 3.32Å; C73-C191 HydrophobicContact CB-CB 3.96Å; C73-C191 WeakPolarHBondContact CB-SG 3.32Å; C73-C191 WeakPolarHBondContact SG-CB 3.25Å; C73-C191 CovalentContact SG-SG 2.05Å; C73-C191 PolarHBondContact SG-SG 3.19Å; V75-C191 HydrophobicContact CG1-CB 3.85Å; R106-C191 HydrophobicContact CB-CB 4Å; R106-C191 PolarHBondContact N-O 3.23Å; I111-C191 HydrophobicContact CD1-CB 4.23Å
192	V	94.4	Very high	93.5	Very high	4 Å²	4	10.6 Å²	10.6	2%	0.024	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	143.2	-168.7	60.7	0	0	0	0	111.1	W54 Q71 V72 F103 T104 F122 A190	W54-V192 HydrophobicContact CH2-CG1 3.48Å; W54-V192 VanDerWaalsContact CH2-CG1 3.48Å; W54-V192 HydrophobicContact CZ2-CG1 4.23Å; W54-V192 HydrophobicContact CZ3-CG1 4.02Å; Q71-V192 WeakPolarHBondContact CA-O 3.28Å; V72-V192 HydrophobicContact CG1-CG1 3.58Å; V72-V192 PolarHBondContact N-O 3.22Å; V72-V192 PolarHBondContact O-N 2.97Å; F103-V192 HydrophobicContact CB-CG2 4.37Å; F103-V192 HydrophobicContact CD2-CG2 3.97Å; T104-V192 WeakPolarHBondContact O-CA 3.36Å; F122-V192 HydrophobicContact CD1-CG2 4.05Å; F122-V192 HydrophobicContact CE1-CG2 4.06Å; A190-V192 HydrophobicContact CB-CG1 4.45Å
193	A	92.3	Very high	93.4	Very high	16 Å²	16	12.7 Å²	12.7	13%	0.132	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.9	167.5	0	0	0	0	0	110.2	F70 Q71 F103 T104 V195	F70-A193 CarbonylContact O-C 3.46Å; F70-A193 WeakPolarHBondContact O-CA 3.44Å; Q71-A193 HydrophobicContact CB-CB 3.93Å; F103-A193 CarbonylContact C-O 3.46Å; F103-A193 WeakPolarHBondContact CA-O 3.37Å; F103-A193 VanDerWaalsContact CB-O 3.27Å; F103-A193 WeakPolarHBondContact CB-O 3.32Å; T104-A193 PolarHBondContact N-O 3.28Å; T104-A193 PolarHBondContact O-N 2.82Å; A193-V195 PolarHBondContact O-N 3Å
194	L	93.1	Very high	93.2	Very high	4 Å²	4	12.7 Å²	12.7	2%	0.021	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	110.4	171.9	-69.5	173	0	0	0	109.1	W54 T69 F70 L84 F103 F122 F185	W54-L194 HydrophobicContact CE3-CD1 4.4Å; W54-L194 HydrophobicContact CH2-CD1 3.68Å; W54-L194 HydrophobicContact CH2-CG 3.91Å; W54-L194 HydrophobicContact CZ2-CD1 4.46Å; W54-L194 HydrophobicContact CZ3-CB 4.49Å; W54-L194 HydrophobicContact CZ3-CD1 3.66Å; W54-L194 HydrophobicContact CZ3-CG 3.8Å; T69-L194 VanDerWaalsContact CA-O 3.27Å; T69-L194 WeakPolarHBondContact CA-O 3.25Å; T69-L194 VanDerWaalsContact CB-O 3.31Å; T69-L194 WeakPolarHBondContact CB-O 3.07Å; F70-L194 HydrophobicContact CB-CB 4.39Å; F70-L194 PolarHBondContact N-O 3.36Å; F70-L194 PolarHBondContact O-N 2.88Å; L84-L194 HydrophobicContact CD2-CD1 3.88Å; F103-L194 HydrophobicContact CB-CD2 4.02Å; F122-L194 HydrophobicContact CE2-CD2 4.16Å; F122-L194 HydrophobicContact CZ-CD2 3.94Å; F185-L194 HydrophobicContact CB-CD1 4.18Å; F185-L194 HydrophobicContact CD1-CD1 3.97Å; F185-L194 HydrophobicContact CD2-CD1 4.05Å; F185-L194 HydrophobicContact CE1-CD1 4.38Å; F185-L194 HydrophobicContact CE2-CD1 4.48Å; F185-L194 HydrophobicContact CG-CD1 3.78Å
195	V	90.4	Very high	93.2	Very high	22 Å²	22	14.4 Å²	14.4	13%	0.133	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-35.4	-177.8	179.8	0	0	0	0	111.5	I67 T69 K102 T104 L166 A193	I67-V195 HydrophobicContact CD1-CG1 3.71Å; T69-V195 HydrophobicContact CG2-CG1 4.5Å; K102-V195 HydrophobicContact CB-CB 4.49Å; K102-V195 WeakPolarHBondContact O-CA 3.31Å; K102-V195 WeakPolarHBondContact O-CB 2.95Å; K102-V195 PolarHBondContact O-N 2.92Å; T104-V195 HydrophobicContact CG2-CG2 4.27Å; L166-V195 HydrophobicContact CD1-CB 3.92Å; L166-V195 HydrophobicContact CD1-CG1 4.16Å; L166-V195 HydrophobicContact CD1-CG2 3.74Å; A193-V195 PolarHBondContact O-N 3Å
196	S	91.2	Very high	93	Very high	5 Å²	5	20.7 Å²	20.7	4%	0.035	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	139.3	-178.3	-154.1	0	0	0	0	111.4	S37 K38 L101 K102	S37-S196 WeakPolarHBondContact OG-CA 3.4Å; K38-S196 WeakPolarHBondContact CD-OG 3.47Å; K38-S196 WeakPolarHBondContact CE-OG 2.71Å; K38-S196 WeakPolarHBondContact CG-OG 3.24Å; L101-S196 WeakPolarHBondContact CA-O 3.28Å; K102-S196 PolarHBondContact N-O 3.18Å; K102-S196 PolarHBondContact O-N 3.47Å
197	V	93.9	Very high	92.9	Very high	2 Å²	2	21 Å²	21	1%	0.012	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	118.6	164.9	-177.6	0	0	0	0	107.8	S37 W46 E100 L101 L183 F185 V199	S37-V197 PolarHBondContact N-O 2.98Å; S37-V197 PolarHBondContact OG-N 2.7Å; S37-V197 PolarHBondContact OG-O 3.29Å; W46-V197 HydrophobicContact CH2-CB 3.71Å; W46-V197 HydrophobicContact CH2-CG1 4.34Å; W46-V197 HydrophobicContact CH2-CG2 3.56Å; W46-V197 HydrophobicContact CZ3-CG2 3.96Å; E100-V197 WeakPolarHBondContact O-CA 3.49Å; L101-V197 HydrophobicContact CD2-CB 4.33Å; L101-V197 HydrophobicContact CD2-CG1 3.95Å; L101-V197 HydrophobicContact CD2-CG2 3.93Å; L183-V197 HydrophobicContact CD1-CG1 4.4Å; F185-V197 HydrophobicContact CE1-CG2 4.35Å; F185-V197 HydrophobicContact CE2-CG2 4.18Å; F185-V197 HydrophobicContact CZ-CB 4.45Å; F185-V197 HydrophobicContact CZ-CG1 3.95Å; F185-V197 HydrophobicContact CZ-CG2 3.63Å; V197-V199 HydrophobicContact CG1-CG2 4.35Å
198	R	94.3	Very high	92.8	Very high	22 Å²	22	23.1 Å²	23.1	8%	0.083	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.5	176.9	-177.1	-175	174	-140	-8.2	108.9	E31 N33 L35 E100 Y200	E31-R198 IonicContact OE2-CZ 3.13Å; E31-R198 IonicContact OE2-NH1 3.4Å; E31-R198 PolarHBondContact OE2-NH1 3.25Å; E31-R198 VanDerWaalsContact OE2-NH1 3.1Å; E31-R198 IonicContact OE2-NH2 3.97Å; E31-R198 PolarHBondContact OE2-NH2 2.71Å; N33-R198 VanDerWaalsContact OD1-CZ 3.24Å; N33-R198 PolarHBondContact OD1-NE 3.07Å; N33-R198 PolarHBondContact OD1-NH2 3.05Å; L35-R198 CarbonylContact O-C 3.54Å; L35-R198 WeakPolarHBondContact O-CA 3.32Å; E100-R198 HydrophobicContact CB-CB 4.27Å; E100-R198 PolarHBondContact N-O 2.82Å; E100-R198 PolarHBondContact O-N 3.41Å; R198-Y200 HydrophobicContact CG-CD1 4.18Å
199	V	95.2	Very high	92.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.1	177.5	-171.1	0	0	0	0	108.3	L34 L35 I89 I97 Y98 V99 F181 L183 V197	L34-V199 HydrophobicContact CB-CB 4.48Å; L34-V199 HydrophobicContact CB-CG1 4.37Å; L34-V199 HydrophobicContact CD1-CG1 4.44Å; L34-V199 PolarHBondContact N-O 3.34Å; L35-V199 HydrophobicContact CB-CB 3.98Å; L35-V199 HydrophobicContact CB-CG2 4.01Å; L35-V199 HydrophobicContact CD2-CG2 4.14Å; L35-V199 PolarHBondContact N-O 2.89Å; L35-V199 VanDerWaalsContact N-O 3.09Å; L35-V199 PolarHBondContact O-N 3.28Å; I89-V199 HydrophobicContact CD1-CG2 4.16Å; I97-V199 HydrophobicContact CB-CG1 4.25Å; I97-V199 HydrophobicContact CD1-CG1 4.04Å; Y98-V199 WeakPolarHBondContact O-CA 3.09Å; V99-V199 HydrophobicContact CG2-CG1 4.47Å; V99-V199 HydrophobicContact CG2-CG2 4.49Å; F181-V199 HydrophobicContact CE2-CG1 4.1Å; F181-V199 HydrophobicContact CZ-CG1 3.83Å; L183-V199 HydrophobicContact CD1-CG2 3.46Å; L183-V199 VanDerWaalsContact CD1-CG2 3.46Å; V197-V199 HydrophobicContact CG1-CG2 4.35Å
200	Y	94.1	Very high	92.8	Very high	14 Å²	14	29.1 Å²	29.1	6%	0.055	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	164.8	-177.9	65.3	-85	0	0	0	111.8	E31 V32 N33 I97 Y98 E100 R198 K202	E31-Y200 HydrophobicContact CB-CD2 4.04Å; E31-Y200 VanDerWaalsContact CD-CE2 3.48Å; E31-Y200 HydrophobicContact CG-CD2 3.8Å; E31-Y200 HydrophobicContact CG-CE2 3.87Å; E31-Y200 WeakPolarHBondContact OE1-CE2 3.38Å; V32-Y200 CarbonylContact O-C 3.56Å; V32-Y200 VanDerWaalsContact O-CA 3.23Å; V32-Y200 WeakPolarHBondContact O-CA 3.44Å; V32-Y200 WeakPolarHBondContact O-CB 3.34Å; N33-Y200 WeakPolarHBondContact OD1-CB 3.25Å; I97-Y200 CarbonylContact C-O 3.56Å; I97-Y200 WeakPolarHBondContact CA-O 3.5Å; Y98-Y200 HydrophobicContact CD2-CD2 4.39Å; Y98-Y200 HydrophobicContact CD2-CE2 4.14Å; Y98-Y200 HydrophobicContact CG-CE2 4.09Å; Y98-Y200 PolarHBondContact N-O 2.65Å; Y98-Y200 PolarHBondContact O-N 3.25Å; E100-Y200 HydrophobicContact CB-CE1 4.23Å; R198-Y200 HydrophobicContact CG-CD1 4.18Å; Y200-K202 HydrophobicContact CE2-CG 4.38Å
201	F	92.8	Very high	92.8	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.018	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	157.3	169.3	71.9	-85	0	0	0	110.6	V32 L34 S93 A94 K96 V218	V32-F201 HydrophobicContact CB-CD1 3.86Å; V32-F201 HydrophobicContact CB-CE1 3.41Å; V32-F201 VanDerWaalsContact CB-CE1 3.41Å; V32-F201 HydrophobicContact CB-CE2 4.13Å; V32-F201 HydrophobicContact CB-CG 4.42Å; V32-F201 HydrophobicContact CB-CZ 3.56Å; V32-F201 HydrophobicContact CG1-CD1 4.2Å; V32-F201 HydrophobicContact CG1-CE1 3.39Å; V32-F201 HydrophobicContact CG1-CZ 3.69Å; V32-F201 HydrophobicContact CG2-CE1 4.27Å; V32-F201 HydrophobicContact CG2-CE2 4.19Å; V32-F201 HydrophobicContact CG2-CZ 3.89Å; V32-F201 PolarHBondContact N-O 3.16Å; V32-F201 WeakPolarHBondContact O-CD1 3.42Å; V32-F201 PolarHBondContact O-N 3.2Å; L34-F201 HydrophobicContact CD1-CD1 4.19Å; L34-F201 HydrophobicContact CD2-CD1 3.81Å; L34-F201 HydrophobicContact CD2-CE1 3.78Å; L34-F201 HydrophobicContact CG-CD1 4Å; L34-F201 HydrophobicContact CG-CE1 4.46Å; S93-F201 WeakPolarHBondContact OG-CZ 3.42Å; A94-F201 HydrophobicContact CB-CB 3.53Å; A94-F201 HydrophobicContact CB-CD1 3.54Å; A94-F201 HydrophobicContact CB-CD2 4.01Å; A94-F201 HydrophobicContact CB-CE1 4.16Å; A94-F201 HydrophobicContact CB-CG 3.43Å; A94-F201 VanDerWaalsContact CB-CG 3.43Å; K96-F201 VanDerWaalsContact O-CB 3.23Å; K96-F201 WeakPolarHBondContact O-CB 3.43Å; F201-V218 HydrophobicContact CD2-CG1 4.2Å; F201-V218 HydrophobicContact CD2-CG2 4.41Å; F201-V218 HydrophobicContact CE2-CG1 4.38Å; F201-V218 HydrophobicContact CE2-CG2 3.83Å
202	K	91.5	Very high	92.9	Very high	30 Å²	30	28.3 Å²	28.3	13%	0.13	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	144.3	-179.1	-62.3	-174.2	-176.5	-167.7	0	111.3	N30 E31 Y98 Y200 P219 E249	N30-K202 CarbonylContact O-C 3.52Å; N30-K202 VanDerWaalsContact O-CA 3.23Å; N30-K202 WeakPolarHBondContact O-CA 3.3Å; E31-K202 HydrophobicContact CG-CG 4.49Å; Y98-K202 HydrophobicContact CD2-CG 4.13Å; Y98-K202 HydrophobicContact CE2-CB 4.28Å; Y98-K202 HydrophobicContact CE2-CD 3.85Å; Y98-K202 HydrophobicContact CE2-CG 3.68Å; Y200-K202 HydrophobicContact CE2-CG 4.38Å; K202-P219 WeakPolarHBondContact O-CD 3.44Å; K202-E249 IonicContact NZ-OE2 3.07Å; K202-E249 PolarHBondContact NZ-OE2 2.84Å
203	K	91.8	Very high	92.9	Very high	44 Å²	44	29.8 Å²	29.8	19%	0.191	16%	0.155	C	C	.	.			trans	-142.3	151.9	172.8	71.1	172.1	-177	173.3	0	110.3	N30 V32 P205 D216 T217 V218	N30-K203 VanDerWaalsContact CA-O 3.23Å; N30-K203 WeakPolarHBondContact CA-O 3.22Å; N30-K203 VanDerWaalsContact CB-O 3.3Å; N30-K203 WeakPolarHBondContact CB-O 3.36Å; N30-K203 PolarHBondContact O-N 3.16Å; V32-K203 HydrophobicContact CG2-CD 3.74Å; V32-K203 HydrophobicContact CG2-CG 4.09Å; K203-P205 WeakPolarHBondContact O-CD 3.33Å; K203-D216 IonicContact NZ-OD1 3.1Å; K203-D216 IonicContact NZ-OD2 3.16Å; K203-D216 PolarHBondContact NZ-OD2 3.31Å; K203-T217 CarbonylContact C-O 3.53Å; K203-T217 WeakPolarHBondContact CA-O 3.37Å; K203-V218 HydrophobicContact CB-CG2 4.09Å
204	C	92.8	Very high	93.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-81.6	118.5	166	-59	0	0	0	0	109.1	D216 T217 C246 W252	C204-D216 WeakPolarHBondContact O-CA 3.25Å; C204-T217 PolarHBondContact N-O 3.13Å; C204-T217 PolarHBondContact O-N 3.02Å; C204-C246 HydrophobicContact CB-CB 3.83Å; C204-C246 WeakPolarHBondContact CB-SG 3.39Å; C204-C246 WeakPolarHBondContact SG-CA 3.49Å; C204-C246 WeakPolarHBondContact SG-CB 3.2Å; C204-C246 CovalentContact SG-SG 2.03Å; C204-C246 PolarHBondContact SG-SG 2.89Å; C204-W252 HydrophobicContact CB-CD2 3.85Å; C204-W252 VanDerWaalsContact CB-CE2 3.48Å; C204-W252 HydrophobicContact CB-CE3 4.4Å; C204-W252 HydrophobicContact CB-CG 4.2Å; C204-W252 HydrophobicContact CB-CH2 4.34Å; C204-W252 HydrophobicContact CB-CZ2 3.76Å
205	P	93.9	Very high	93.1	Very high	36 Å²	36	32.1 Å²	32.1	23%	0.234	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-73	151.6	-174.4	29	-34.9	0	0	0	112.1	K203 T207 D216 W252	K203-P205 WeakPolarHBondContact O-CD 3.33Å; P205-T207 PolarHBondContact O-N 2.69Å; P205-D216 VanDerWaalsContact CA-OD1 3.3Å; P205-D216 WeakPolarHBondContact CA-OD1 3.16Å; P205-W252 PolarHBondContact O-NE1 3.37Å
206	Q	93.4	Very high	93.2	Very high	132 Å²	132	35 Å²	35	62%	0.617	18%	0.183	S	C	*	.	P	Polyproline II helix	trans	-54	129.3	178	-179	-179.6	-11.9	0	0	110.7	F214 D216	Q206-F214 VanDerWaalsContact CA-O 3.3Å; Q206-F214 WeakPolarHBondContact CA-O 3.25Å; Q206-F214 WeakPolarHBondContact CG-O 3.44Å; Q206-D216 PolarHBondContact N-OD1 2.87Å
207	T	93.4	Very high	93.2	Very high	38 Å²	38	35.7 Å²	35.7	23%	0.233	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	157.4	-176.8	-165	0	0	0	0	111.6	P205 K209 F214 W252	P205-T207 PolarHBondContact O-N 2.69Å; T207-K209 HydrophobicContact CG2-CG 4.28Å; T207-F214 HydrophobicContact CG2-CB 4.22Å; T207-F214 HydrophobicContact CG2-CD2 4.43Å; T207-F214 PolarHBondContact N-O 3.09Å; T207-F214 PolarHBondContact O-N 3.45Å; T207-W252 HydrophobicContact CG2-CD2 4.42Å; T207-W252 HydrophobicContact CG2-CG 4.18Å
208	V	92.9	Very high	93	Very high	43 Å²	43	37.4 Å²	37.4	26%	0.261	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119.2	171.6	-174.7	0	0	0	0	108.4	A212 V233	V208-A212 CarbonylContact C-O 3.41Å; V208-A212 VanDerWaalsContact CA-O 3.28Å; V208-A212 WeakPolarHBondContact CA-O 3.43Å; V208-A212 WeakPolarHBondContact CG1-O 3.43Å; V208-V233 HydrophobicContact CG1-CG1 3.81Å
209	K	91.1	Very high	92.6	Very high	107 Å²	107	37.1 Å²	37.1	47%	0.465	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.4	178.4	-71.5	-66.9	-174.5	175.5	0	109.4	T207 L211 A212 F214 M244	T207-K209 HydrophobicContact CG2-CG 4.28Å; K209-L211 PolarHBondContact O-N 3.06Å; K209-A212 PolarHBondContact N-O 3.43Å; K209-A212 PolarHBondContact O-N 2.03Å; K209-A212 VanDerWaalsContact O-O 3.12Å; K209-F214 HydrophobicContact CB-CE2 4.15Å; K209-M244 HydrophobicContact CB-SD 3.94Å; K209-M244 HydrophobicContact CG-CE 4.25Å; K209-M244 HydrophobicContact CG-SD 4.08Å
210	N	92.1	Very high	91.6	Very high	70 Å²	70	41.7 Å²	41.7	37%	0.374	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	40.7	-178	-59	-14.6	0	0	0	113.4	A212 G257 K258 C259	N210-A212 PolarHBondContact O-N 3.43Å; N210-G257 PolarHBondContact ND2-O 2.95Å; N210-G257 VanDerWaalsContact ND2-O 3.11Å; N210-K258 HydrophobicContact CB-CB 3.79Å; N210-C259 PolarHBondContact O-N 3Å
211	L	92.8	Very high	90.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	23.7	-175.6	-62.8	176.2	0	0	0	114.9	K209 V233 C259 C261 E267 N286	K209-L211 PolarHBondContact O-N 3.06Å; L211-V233 HydrophobicContact CB-CG2 3.98Å; L211-V233 HydrophobicContact CD2-CG2 4Å; L211-V233 WeakPolarHBondContact O-CG1 3.33Å; L211-V233 WeakPolarHBondContact O-CG2 3.31Å; L211-V233 PolarHBondContact O-N 2.69Å; L211-C259 HydrophobicContact CB-CB 3.92Å; L211-C261 WeakPolarHBondContact CD1-SG 3.45Å; L211-E267 HydrophobicContact CD1-CB 4.31Å; L211-E267 HydrophobicContact CD1-CG 4.47Å; L211-E267 HydrophobicContact CD2-CB 4.34Å; L211-E267 HydrophobicContact CD2-CG 3.84Å; L211-E267 HydrophobicContact CG-CG 4.36Å; L211-N286 VanDerWaalsContact CD1-CG 3.5Å; L211-N286 WeakPolarHBondContact CD1-OD1 3.49Å
212	A	94.3	Very high	88.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.2	170.3	0	0	0	0	0	110.2	V208 K209 N210 F214 L231 P242	V208-A212 CarbonylContact C-O 3.41Å; V208-A212 VanDerWaalsContact CA-O 3.28Å; V208-A212 WeakPolarHBondContact CA-O 3.43Å; V208-A212 WeakPolarHBondContact CG1-O 3.43Å; K209-A212 PolarHBondContact N-O 3.43Å; K209-A212 PolarHBondContact O-N 2.03Å; K209-A212 VanDerWaalsContact O-O 3.12Å; N210-A212 PolarHBondContact O-N 3.43Å; A212-F214 HydrophobicContact CB-CE2 3.78Å; A212-F214 HydrophobicContact CB-CZ 4.01Å; A212-F214 VanDerWaalsContact O-CD2 3.3Å; A212-F214 WeakPolarHBondContact O-CD2 3.4Å; A212-F214 VanDerWaalsContact O-CE2 3.31Å; A212-F214 WeakPolarHBondContact O-CE2 3.45Å; A212-L231 CarbonylContact C-O 3.59Å; A212-L231 WeakPolarHBondContact CA-O 3.26Å; A212-P242 HydrophobicContact CB-CB 3.32Å; A212-P242 HydrophobicContact CB-CG 3.58Å
213	S	94.8	Very high	87.5	Confident	35 Å²	35	56.1 Å²	56.1	25%	0.245	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.4	175.2	-175.7	0	0	0	0	110.1	G230 L231	S213-G230 WeakPolarHBondContact O-CA 3.33Å; S213-L231 PolarHBondContact N-O 3.32Å; S213-L231 PolarHBondContact O-N 2.88Å
214	F	94.9	Very high	86.2	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.009	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.9	177.1	-61.8	-90.5	0	0	0	108.8	Q206 T207 K209 A212 V228 P242 M244 W252	Q206-F214 VanDerWaalsContact CA-O 3.3Å; Q206-F214 WeakPolarHBondContact CA-O 3.25Å; Q206-F214 WeakPolarHBondContact CG-O 3.44Å; T207-F214 HydrophobicContact CG2-CB 4.22Å; T207-F214 HydrophobicContact CG2-CD2 4.43Å; T207-F214 PolarHBondContact N-O 3.09Å; T207-F214 PolarHBondContact O-N 3.45Å; K209-F214 HydrophobicContact CB-CE2 4.15Å; A212-F214 HydrophobicContact CB-CE2 3.78Å; A212-F214 HydrophobicContact CB-CZ 4.01Å; A212-F214 VanDerWaalsContact O-CD2 3.3Å; A212-F214 WeakPolarHBondContact O-CD2 3.4Å; A212-F214 VanDerWaalsContact O-CE2 3.31Å; A212-F214 WeakPolarHBondContact O-CE2 3.45Å; F214-V228 HydrophobicContact CD1-CG1 4.33Å; F214-P242 HydrophobicContact CZ-CB 4.12Å; F214-M244 HydrophobicContact CD1-CB 3.92Å; F214-M244 HydrophobicContact CD1-CG 4.04Å; F214-M244 HydrophobicContact CD1-SD 4.08Å; F214-M244 HydrophobicContact CD2-CG 4.37Å; F214-M244 HydrophobicContact CD2-SD 3.48Å; F214-M244 WeakPolarHBondContact CD2-SD 3.06Å; F214-M244 HydrophobicContact CE1-CB 3.74Å; F214-M244 HydrophobicContact CE1-CG 3.57Å; F214-M244 HydrophobicContact CE1-SD 3.98Å; F214-M244 HydrophobicContact CE2-CG 3.95Å; F214-M244 HydrophobicContact CE2-SD 3.37Å; F214-M244 WeakPolarHBondContact CE2-SD 3.38Å; F214-M244 HydrophobicContact CG-CG 4.41Å; F214-M244 HydrophobicContact CG-SD 3.84Å; F214-M244 HydrophobicContact CZ-CB 4.23Å; F214-M244 HydrophobicContact CZ-CG 3.52Å; F214-M244 HydrophobicContact CZ-SD 3.64Å; F214-W252 HydrophobicContact CB-CH2 3.96Å; F214-W252 HydrophobicContact CB-CZ2 3.83Å
215	P	94.3	Very high	85.7	Confident	67 Å²	67	60.4 Å²	60.4	44%	0.435	33%	0.327	S	S	.	.			trans	-75.7	163.9	-176.6	32.1	-36.3	0	0	0	112.9	T217 V228 W252	P215-T217 PolarHBondContact O-N 3.47Å; P215-T217 PolarHBondContact O-OG1 3.46Å; P215-V228 HydrophobicContact CG-CG1 4.33Å; P215-W252 WeakPolarHBondContact O-CZ2 3.33Å
216	D	92.4	Very high	85.4	Confident	82 Å²	82	59.8 Å²	59.8	44%	0.439	32%	0.322	S	S	.	.			trans	-50.6	123.4	168.6	-85.7	-9.1	0	0	0	110.5	K203 C204 P205 Q206	K203-D216 IonicContact NZ-OD1 3.1Å; K203-D216 IonicContact NZ-OD2 3.16Å; K203-D216 PolarHBondContact NZ-OD2 3.31Å; C204-D216 WeakPolarHBondContact O-CA 3.25Å; P205-D216 VanDerWaalsContact CA-OD1 3.3Å; P205-D216 WeakPolarHBondContact CA-OD1 3.16Å; Q206-D216 PolarHBondContact N-OD1 2.87Å
217	T	91.3	Very high	85.3	Confident	21 Å²	21	58.3 Å²	58.3	13%	0.129	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-131.5	131.6	-176	-56.5	0	0	0	0	111	K203 C204 P215 V226 V228 C246	K203-T217 CarbonylContact C-O 3.53Å; K203-T217 WeakPolarHBondContact CA-O 3.37Å; C204-T217 PolarHBondContact N-O 3.13Å; C204-T217 PolarHBondContact O-N 3.02Å; P215-T217 PolarHBondContact O-N 3.47Å; P215-T217 PolarHBondContact O-OG1 3.46Å; T217-V226 HydrophobicContact CG2-CG1 3.98Å; T217-V228 HydrophobicContact CG2-CG2 3.71Å; T217-C246 HydrophobicContact CG2-CB 4.18Å
218	V	89.6	Confident	85.3	Confident	38 Å²	38	57.2 Å²	57.2	23%	0.23	31%	0.308	C	S	.	.			trans	-101	128.2	176.6	-176.6	0	0	0	0	109.2	F201 K203	F201-V218 HydrophobicContact CD2-CG1 4.2Å; F201-V218 HydrophobicContact CD2-CG2 4.41Å; F201-V218 HydrophobicContact CE2-CG1 4.38Å; F201-V218 HydrophobicContact CE2-CG2 3.83Å; K203-V218 HydrophobicContact CB-CG2 4.09Å
219	P	84.7	Confident	85.3	Confident	15 Å²	15	61.6 Å²	61.6	10%	0.097	32%	0.324	C	S	.	.			trans	-66.9	139.9	176.1	27.3	-32.7	0	0	0	111	K202	K202-P219 WeakPolarHBondContact O-CD 3.44Å
220	M	73.8	Confident	85.4	Confident	96 Å²	96	56.6 Å²	56.6	47%	0.473	30%	0.303	S	S	.	.			trans	-88.4	-42.5	-175.5	-72.4	-171.9	-75.1	0	0	113.5	Q95	Q95-M220 VanDerWaalsContact OE1-CA 3.29Å; Q95-M220 PolarHBondContact OE1-O 2.04Å
221	D	69.4	Low	85.6	Confident	90 Å²	90	59.4 Å²	59.4	48%	0.481	32%	0.317	S	S	.	.	S	Bend	trans	-133.3	155.6	-175	-49.7	-62.5	0	0	0	113.3	Q223 S224 T248	D221-Q223 PolarHBondContact O-N 2.78Å; D221-S224 WeakPolarHBondContact CB-OG 3.29Å; D221-S224 PolarHBondContact N-OG 3.4Å; D221-S224 PolarHBondContact O-N 3.07Å; D221-S224 PolarHBondContact O-OG 2.88Å; D221-S224 PolarHBondContact OD2-OG 2.7Å; D221-T248 WeakPolarHBondContact O-CG2 3.29Å
222	S	62.6	Low	85.6	Confident	66 Å²	66	61.3 Å²	61.3	46%	0.462	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-4.6	-177.6	-54.2	0	0	0	0	115.5	K96 E172	K96-S222 PolarHBondContact NZ-OG 3.34Å; K96-S222 VanDerWaalsContact NZ-OG 3.15Å; E172-S222 PolarHBondContact OE1-OG 3.17Å
223	Q	60.8	Low	85.6	Confident	196 Å²	196	62.4 Å²	62.4	92%	0.916	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.5	-1	176.3	-65	-177.3	0.8	0	0	113.3	D221	D221-Q223 PolarHBondContact O-N 2.78Å
224	S	65.1	Low	85.5	Confident	32 Å²	32	67 Å²	67	22%	0.224	36%	0.359	C	S	.	.			trans	-103.1	130.7	-170.2	66.1	0	0	0	0	112.8	D221	D221-S224 WeakPolarHBondContact CB-OG 3.29Å; D221-S224 PolarHBondContact N-OG 3.4Å; D221-S224 PolarHBondContact O-N 3.07Å; D221-S224 PolarHBondContact O-OG 2.88Å; D221-S224 PolarHBondContact OD2-OG 2.7Å
225	L	82.9	Confident	85.5	Confident	101 Å²	101	73.1 Å²	73.1	53%	0.529	38%	0.383	S	S	.	.			trans	-86.4	119	163.8	-69.7	178.8	0	0	0	108.1	E227 Y245 L253	L225-E227 PolarHBondContact O-N 2.9Å; L225-Y245 HydrophobicContact CB-CD1 4.16Å; L225-L253 HydrophobicContact CD1-CD1 4.04Å; L225-L253 HydrophobicContact CD2-CD1 3.4Å; L225-L253 HydrophobicContact CG-CD1 4.37Å
226	V	87.8	Confident	85.4	Confident	24 Å²	24	70.9 Å²	70.9	15%	0.145	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	112.3	179.8	-178.7	0	0	0	0	109.1	T217 V228 Y245 C246	T217-V226 HydrophobicContact CG2-CG1 3.98Å; V226-V228 HydrophobicContact CG1-CG2 4.23Å; V226-V228 PolarHBondContact O-N 3.3Å; V226-Y245 CarbonylContact O-C 3.47Å; V226-Y245 WeakPolarHBondContact O-CA 3.29Å; V226-C246 HydrophobicContact CB-CB 4.35Å; V226-C246 PolarHBondContact N-O 2.83Å; V226-C246 PolarHBondContact O-N 3.42Å
227	E	90.7	Very high	85.4	Confident	100 Å²	100	73.2 Å²	73.2	47%	0.467	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	123.6	173.1	-173.5	172.6	155.1	0	0	110.3	L225 R243 Y245	L225-E227 PolarHBondContact O-N 2.9Å; E227-R243 WeakPolarHBondContact OE1-CD 3.27Å; E227-R243 IonicContact OE1-CZ 2.89Å; E227-R243 IonicContact OE1-NE 3.39Å; E227-R243 IonicContact OE1-NH1 3.9Å; E227-R243 PolarHBondContact OE1-NH1 3.33Å; E227-Y245 HydrophobicContact CB-CD1 3.97Å; E227-Y245 HydrophobicContact CB-CE1 3.65Å; E227-Y245 HydrophobicContact CG-CD1 4.41Å; E227-Y245 HydrophobicContact CG-CE1 3.82Å; E227-Y245 PolarHBondContact OE2-OH 3.14Å
228	V	93.1	Very high	85.5	Confident	15 Å²	15	76.4 Å²	76.4	9%	0.091	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.2	179	-174.3	0	0	0	0	109.3	F214 P215 T217 V226 R243 M244 W252	F214-V228 HydrophobicContact CD1-CG1 4.33Å; P215-V228 HydrophobicContact CG-CG1 4.33Å; T217-V228 HydrophobicContact CG2-CG2 3.71Å; V226-V228 HydrophobicContact CG1-CG2 4.23Å; V226-V228 PolarHBondContact O-N 3.3Å; V228-R243 WeakPolarHBondContact O-CA 3.4Å; V228-M244 PolarHBondContact N-O 3.3Å; V228-M244 PolarHBondContact O-N 2.96Å; V228-W252 HydrophobicContact CB-CH2 3.82Å; V228-W252 HydrophobicContact CB-CZ3 3.86Å; V228-W252 HydrophobicContact CG1-CH2 4Å; V228-W252 HydrophobicContact CG2-CH2 3.73Å; V228-W252 HydrophobicContact CG2-CZ3 3.82Å
229	K	93.4	Very high	85.5	Confident	135 Å²	135	79.3 Å²	79.3	59%	0.587	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.6	173.1	-172.2	177.4	179	179.1	0	109.8
230	G	93.7	Very high	85.8	Confident	2 Å²	2	83.7 Å²	83.7	2%	0.021	42%	0.418	C	S	.	.			trans	-79.9	157.7	175.2	0	0	0	0	0	112.3	S213 P242	S213-G230 WeakPolarHBondContact O-CA 3.33Å; G230-P242 PolarHBondContact N-O 2.99Å
231	L	94.8	Very high	86.6	Confident	130 Å²	130	82.1 Å²	82.1	68%	0.681	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	126	173	-68.4	170.2	0	0	0	109.6	A212 S213 V233	A212-L231 CarbonylContact C-O 3.59Å; A212-L231 WeakPolarHBondContact CA-O 3.26Å; S213-L231 PolarHBondContact N-O 3.32Å; S213-L231 PolarHBondContact O-N 2.88Å; L231-V233 PolarHBondContact O-N 2.97Å
232	C	94.4	Very high	87.8	Confident	40 Å²	40	77.9 Å²	77.9	27%	0.27	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	135.9	176.8	-70	0	0	0	0	111.4	S236 C259	C232-S236 WeakPolarHBondContact CB-OG 3.43Å; C232-C259 WeakPolarHBondContact CA-SG 3.16Å; C232-C259 HydrophobicContact CB-CB 3.75Å; C232-C259 WeakPolarHBondContact CB-SG 3.07Å; C232-C259 WeakPolarHBondContact SG-CB 3.37Å; C232-C259 CovalentContact SG-SG 2.03Å; C232-C259 PolarHBondContact SG-SG 3.21Å
233	V	93.9	Very high	89.3	Confident	24 Å²	24	78.7 Å²	78.7	15%	0.145	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-65.2	161.4	177	-60.4	0	0	0	0	111.2	V208 L211 L231 Y235 S236	V208-V233 HydrophobicContact CG1-CG1 3.81Å; L211-V233 HydrophobicContact CB-CG2 3.98Å; L211-V233 HydrophobicContact CD2-CG2 4Å; L211-V233 WeakPolarHBondContact O-CG1 3.33Å; L211-V233 WeakPolarHBondContact O-CG2 3.31Å; L211-V233 PolarHBondContact O-N 2.69Å; L231-V233 PolarHBondContact O-N 2.97Å; V233-Y235 PolarHBondContact O-N 2.99Å; V233-S236 PolarHBondContact N-OG 2.95Å; V233-S236 WeakPolarHBondContact O-CB 3.26Å; V233-S236 PolarHBondContact O-N 2.86Å; V233-S236 PolarHBondContact O-OG 3.48Å
234	N	93	Very high	90.9	Very high	132 Å²	132	69.5 Å²	69.5	71%	0.706	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	143.1	179.6	-71	-21.8	0	0	0	112.1	S236 C272	N234-S236 PolarHBondContact O-N 2.79Å; N234-C272 WeakPolarHBondContact O-CB 3.49Å
235	Y	93.3	Very high	92.1	Very high	130 Å²	130	70.7 Å²	70.7	51%	0.51	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	24.6	-177.9	-43.9	-74.8	0	0	0	114.7	V233 N262 Y265	V233-Y235 PolarHBondContact O-N 2.99Å; Y235-N262 WeakPolarHBondContact O-CB 3.39Å; Y235-N262 VanDerWaalsContact O-CG 3.27Å; Y235-N262 PolarHBondContact O-N 2.76Å; Y235-N262 PolarHBondContact O-ND2 3.48Å; Y235-Y265 AromaticContact CD1-CE1 3.8Å; Y235-Y265 HydrophobicContact CD1-CE1 3.8Å; Y235-Y265 HydrophobicContact CD1-CE2 4.39Å; Y235-Y265 AromaticContact CD1-CZ 3.68Å; Y235-Y265 HydrophobicContact CD2-CD1 4.28Å; Y235-Y265 AromaticContact CD2-CE1 3.8Å; Y235-Y265 HydrophobicContact CD2-CE1 3.8Å; Y235-Y265 HydrophobicContact CE1-CE1 4.39Å; Y235-Y265 HydrophobicContact CE2-CE1 4.39Å; Y235-Y265 AromaticContact CG-CD1 3.95Å; Y235-Y265 HydrophobicContact CG-CD1 3.95Å; Y235-Y265 AromaticContact CG-CE1 3.46Å; Y235-Y265 HydrophobicContact CG-CE1 3.46Å; Y235-Y265 VanDerWaalsContact CG-CE1 3.46Å; Y235-Y265 AromaticContact CG-CZ 3.83Å
236	S	93.8	Very high	92.6	Very high	19 Å²	19	65.9 Å²	65.9	13%	0.133	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	161.8	169.2	75.4	0	0	0	0	111.4	C232 V233 N234 L260	C232-S236 WeakPolarHBondContact CB-OG 3.43Å; V233-S236 PolarHBondContact N-OG 2.95Å; V233-S236 WeakPolarHBondContact O-CB 3.26Å; V233-S236 PolarHBondContact O-N 2.86Å; V233-S236 PolarHBondContact O-OG 3.48Å; N234-S236 PolarHBondContact O-N 2.79Å; S236-L260 CarbonylContact C-O 3.53Å; S236-L260 WeakPolarHBondContact CA-O 3.25Å; S236-L260 VanDerWaalsContact CB-O 3.32Å; S236-L260 WeakPolarHBondContact CB-O 3.1Å
237	K	92.6	Very high	92.6	Very high	131 Å²	131	65.3 Å²	65.3	57%	0.57	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.6	179.2	-173	176.2	179.7	-178.3	0	110.2	E239 C259 L260	K237-E239 PolarHBondContact O-N 2.99Å; K237-C259 CarbonylContact O-C 3.58Å; K237-C259 WeakPolarHBondContact O-CA 3.19Å; K237-L260 PolarHBondContact N-O 2.02Å; K237-L260 PolarHBondContact O-N 3.43Å
238	E	92.4	Very high	92.4	Very high	88 Å²	88	62 Å²	62	41%	0.411	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	125.2	175.2	-169.7	177.3	142.6	0	0	110.6	P241	E238-P241 WeakPolarHBondContact OE1-CA 3.39Å; E238-P241 WeakPolarHBondContact OE1-CB 3.37Å; E238-P241 WeakPolarHBondContact OE1-CD 3.46Å; E238-P241 WeakPolarHBondContact OE1-CG 3.48Å
239	E	89.4	Confident	92.1	Very high	99 Å²	99	65.7 Å²	65.7	46%	0.463	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-48.4	166.4	-179.3	-179.8	-168.3	0	0	109.3	K237 K258 L260	K237-E239 PolarHBondContact O-N 2.99Å; E239-K258 PolarHBondContact N-O 3.34Å; E239-K258 IonicContact OE1-NZ 2.83Å; E239-K258 PolarHBondContact OE1-NZ 3Å; E239-K258 WeakPolarHBondContact OE2-CE 3.36Å; E239-K258 IonicContact OE2-NZ 2.61Å; E239-K258 PolarHBondContact OE2-NZ 3.44Å; E239-L260 HydrophobicContact CB-CD1 4.08Å; E239-L260 HydrophobicContact CB-CG 4Å; E239-L260 HydrophobicContact CG-CD1 4.28Å; E239-L260 VanDerWaalsContact OE2-CD1 3.31Å; E239-L260 WeakPolarHBondContact OE2-CD1 3.38Å; E239-L260 WeakPolarHBondContact OE2-CD2 3.48Å; E239-L260 WeakPolarHBondContact OE2-CG 3.03Å
240	E	90.3	Very high	91.8	Very high	107 Å²	107	59.3 Å²	59.3	50%	0.5	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141	171.6	-73.5	-177.8	178.7	0	0	109.7	P242 K258	E240-P242 VanDerWaalsContact O-CD 3.27Å; E240-P242 WeakPolarHBondContact O-CD 2.99Å; E240-P242 VanDerWaalsContact O-N 3.08Å; E240-K258 PolarHBondContact N-O 3.1Å; E240-K258 PolarHBondContact O-N 3.41Å; E240-K258 VanDerWaalsContact O-N 3.12Å
241	P	91.6	Very high	91.6	Very high	63 Å²	63	64.3 Å²	64.3	41%	0.409	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	113	-176.1	-21	25.8	0	0	0	112.6	E238 R243	E238-P241 WeakPolarHBondContact OE1-CA 3.39Å; E238-P241 WeakPolarHBondContact OE1-CB 3.37Å; E238-P241 WeakPolarHBondContact OE1-CD 3.46Å; E238-P241 WeakPolarHBondContact OE1-CG 3.48Å; P241-R243 PolarHBondContact O-N 3.43Å
242	P	94.5	Very high	91.5	Very high	1 Å²	1	60 Å²	60	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	126.8	-176.5	28.8	-34.9	0	0	0	110.6	A212 F214 G230 E240 I256	A212-P242 HydrophobicContact CB-CB 3.32Å; A212-P242 HydrophobicContact CB-CG 3.58Å; F214-P242 HydrophobicContact CZ-CB 4.12Å; G230-P242 PolarHBondContact N-O 2.99Å; E240-P242 VanDerWaalsContact O-CD 3.27Å; E240-P242 WeakPolarHBondContact O-CD 2.99Å; E240-P242 VanDerWaalsContact O-N 3.08Å; P242-I256 CarbonylContact C-O 3.56Å; P242-I256 VanDerWaalsContact CA-O 3.27Å; P242-I256 WeakPolarHBondContact CA-O 3.08Å
243	R	94.3	Very high	91.3	Very high	83 Å²	83	61.5 Å²	61.5	31%	0.313	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.3	-177.3	-66.2	-175.9	-75.6	162	2.1	111.2	E227 V228 P241 I256	E227-R243 WeakPolarHBondContact OE1-CD 3.27Å; E227-R243 IonicContact OE1-CZ 2.89Å; E227-R243 IonicContact OE1-NE 3.39Å; E227-R243 IonicContact OE1-NH1 3.9Å; E227-R243 PolarHBondContact OE1-NH1 3.33Å; V228-R243 WeakPolarHBondContact O-CA 3.4Å; P241-R243 PolarHBondContact O-N 3.43Å; R243-I256 PolarHBondContact N-O 3.23Å; R243-I256 PolarHBondContact O-N 3.44Å
244	M	93.1	Very high	90.9	Very high	4 Å²	4	65.5 Å²	65.5	2%	0.02	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	159.5	176	-73.8	-177.4	75.7	0	0	110.2	K209 F214 V228 W252 L253 P255	K209-M244 HydrophobicContact CB-SD 3.94Å; K209-M244 HydrophobicContact CG-CE 4.25Å; K209-M244 HydrophobicContact CG-SD 4.08Å; F214-M244 HydrophobicContact CD1-CB 3.92Å; F214-M244 HydrophobicContact CD1-CG 4.04Å; F214-M244 HydrophobicContact CD1-SD 4.08Å; F214-M244 HydrophobicContact CD2-CG 4.37Å; F214-M244 HydrophobicContact CD2-SD 3.48Å; F214-M244 WeakPolarHBondContact CD2-SD 3.06Å; F214-M244 HydrophobicContact CE1-CB 3.74Å; F214-M244 HydrophobicContact CE1-CG 3.57Å; F214-M244 HydrophobicContact CE1-SD 3.98Å; F214-M244 HydrophobicContact CE2-CG 3.95Å; F214-M244 HydrophobicContact CE2-SD 3.37Å; F214-M244 WeakPolarHBondContact CE2-SD 3.38Å; F214-M244 HydrophobicContact CG-CG 4.41Å; F214-M244 HydrophobicContact CG-SD 3.84Å; F214-M244 HydrophobicContact CZ-CB 4.23Å; F214-M244 HydrophobicContact CZ-CG 3.52Å; F214-M244 HydrophobicContact CZ-SD 3.64Å; V228-M244 PolarHBondContact N-O 3.3Å; V228-M244 PolarHBondContact O-N 2.96Å; M244-W252 HydrophobicContact CB-CE3 3.59Å; M244-W252 HydrophobicContact CB-CZ3 3.73Å; M244-W252 HydrophobicContact CE-CB 3.52Å; M244-W252 HydrophobicContact CE-CD2 4.05Å; M244-W252 HydrophobicContact CE-CE3 4.09Å; M244-W252 HydrophobicContact CE-CG 3.86Å; M244-W252 HydrophobicContact SD-CE3 4.47Å; M244-L253 WeakPolarHBondContact CE-O 3.28Å; M244-P255 HydrophobicContact CE-CB 4.35Å; M244-P255 HydrophobicContact CG-CB 3.86Å; M244-P255 HydrophobicContact SD-CB 4.12Å
245	Y	91.9	Very high	90.7	Very high	57 Å²	57	61.8 Å²	61.8	22%	0.224	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.5	178.1	-61.9	-87.7	0	0	0	109.9	L225 V226 E227 L253 I256	L225-Y245 HydrophobicContact CB-CD1 4.16Å; V226-Y245 CarbonylContact O-C 3.47Å; V226-Y245 WeakPolarHBondContact O-CA 3.29Å; E227-Y245 HydrophobicContact CB-CD1 3.97Å; E227-Y245 HydrophobicContact CB-CE1 3.65Å; E227-Y245 HydrophobicContact CG-CD1 4.41Å; E227-Y245 HydrophobicContact CG-CE1 3.82Å; E227-Y245 PolarHBondContact OE2-OH 3.14Å; Y245-L253 PolarHBondContact O-N 3.13Å; Y245-I256 HydrophobicContact CE2-CD1 3.91Å
246	C	91.6	Very high	90.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.8	173.2	177.9	0	0	0	0	109.7	C204 T217 V226 W252	C204-C246 HydrophobicContact CB-CB 3.83Å; C204-C246 WeakPolarHBondContact CB-SG 3.39Å; C204-C246 WeakPolarHBondContact SG-CA 3.49Å; C204-C246 WeakPolarHBondContact SG-CB 3.2Å; C204-C246 CovalentContact SG-SG 2.03Å; C204-C246 PolarHBondContact SG-SG 2.89Å; T217-C246 HydrophobicContact CG2-CB 4.18Å; V226-C246 HydrophobicContact CB-CB 4.35Å; V226-C246 PolarHBondContact N-O 2.83Å; V226-C246 PolarHBondContact O-N 3.42Å; C246-W252 HydrophobicContact CB-CE3 4.28Å; C246-W252 HydrophobicContact CB-CH2 4.44Å; C246-W252 HydrophobicContact CB-CZ3 4Å
247	S	89.6	Confident	90.4	Very high	12 Å²	12	58.4 Å²	58.4	8%	0.084	29%	0.291	C	S	.	.			trans	-86.5	164.8	179.4	80.5	0	0	0	0	112.4	E249 G250 E251	S247-E249 PolarHBondContact O-N 3.39Å; S247-E249 PolarHBondContact OG-N 3.06Å; S247-G250 PolarHBondContact O-N 3.4Å; S247-E251 PolarHBondContact N-O 3.3Å; S247-E251 WeakPolarHBondContact OG-CB 3.01Å; S247-E251 PolarHBondContact OG-N 2.99Å; S247-E251 VanDerWaalsContact OG-N 3.14Å; S247-E251 PolarHBondContact OG-O 3.21Å
248	T	85.3	Confident	90.3	Very high	31 Å²	31	55.9 Å²	55.9	19%	0.19	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.7	173.8	52.3	0	0	0	0	113.4	Y98 D221 G250	Y98-T248 PolarHBondContact OH-O 2.98Å; D221-T248 WeakPolarHBondContact O-CG2 3.29Å; T248-G250 VanDerWaalsContact C-N 3.26Å; T248-G250 PolarHBondContact O-N 2.82Å
249	E	86.3	Confident	90.4	Very high	91 Å²	91	51.7 Å²	51.7	43%	0.425	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	2.4	176.8	-58.1	-50.8	134.6	0	0	113.2	N30 K202 S247 E251	N30-E249 PolarHBondContact ND2-O 3.36Å; K202-E249 IonicContact NZ-OE2 3.07Å; K202-E249 PolarHBondContact NZ-OE2 2.84Å; S247-E249 PolarHBondContact O-N 3.39Å; S247-E249 PolarHBondContact OG-N 3.06Å; E249-E251 VanDerWaalsContact C-N 3.31Å
250	G	87.8	Confident	90.6	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.01	25%	0.246	C	C	.	.	S	Bend	trans	76.4	20.1	-177	0	0	0	0	0	113.3	S247 T248	S247-G250 PolarHBondContact O-N 3.4Å; T248-G250 VanDerWaalsContact C-N 3.26Å; T248-G250 PolarHBondContact O-N 2.82Å
251	E	90.8	Very high	90.8	Very high	107 Å²	107	43.3 Å²	43.3	50%	0.5	22%	0.222	S	C	.	.			trans	-101.8	137.8	-179.9	-69.3	-64	154.2	0	0	111.7	S247 E249	S247-E251 PolarHBondContact N-O 3.3Å; S247-E251 WeakPolarHBondContact OG-CB 3.01Å; S247-E251 PolarHBondContact OG-N 2.99Å; S247-E251 VanDerWaalsContact OG-N 3.14Å; S247-E251 PolarHBondContact OG-O 3.21Å; E249-E251 VanDerWaalsContact C-N 3.31Å
252	W	91.8	Very high	90.9	Very high	40 Å²	40	42.5 Å²	42.5	15%	0.152	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-81.1	120	172.1	-83.5	119.3	0	0	0	110.6	C204 P205 T207 F214 P215 V228 M244 C246	C204-W252 HydrophobicContact CB-CD2 3.85Å; C204-W252 VanDerWaalsContact CB-CE2 3.48Å; C204-W252 HydrophobicContact CB-CE3 4.4Å; C204-W252 HydrophobicContact CB-CG 4.2Å; C204-W252 HydrophobicContact CB-CH2 4.34Å; C204-W252 HydrophobicContact CB-CZ2 3.76Å; P205-W252 PolarHBondContact O-NE1 3.37Å; T207-W252 HydrophobicContact CG2-CD2 4.42Å; T207-W252 HydrophobicContact CG2-CG 4.18Å; F214-W252 HydrophobicContact CB-CH2 3.96Å; F214-W252 HydrophobicContact CB-CZ2 3.83Å; P215-W252 WeakPolarHBondContact O-CZ2 3.33Å; V228-W252 HydrophobicContact CB-CH2 3.82Å; V228-W252 HydrophobicContact CB-CZ3 3.86Å; V228-W252 HydrophobicContact CG1-CH2 4Å; V228-W252 HydrophobicContact CG2-CH2 3.73Å; V228-W252 HydrophobicContact CG2-CZ3 3.82Å; M244-W252 HydrophobicContact CB-CE3 3.59Å; M244-W252 HydrophobicContact CB-CZ3 3.73Å; M244-W252 HydrophobicContact CE-CB 3.52Å; M244-W252 HydrophobicContact CE-CD2 4.05Å; M244-W252 HydrophobicContact CE-CE3 4.09Å; M244-W252 HydrophobicContact CE-CG 3.86Å; M244-W252 HydrophobicContact SD-CE3 4.47Å; C246-W252 HydrophobicContact CB-CE3 4.28Å; C246-W252 HydrophobicContact CB-CH2 4.44Å; C246-W252 HydrophobicContact CB-CZ3 4Å
253	L	90	Very high	90.9	Very high	71 Å²	71	44 Å²	44	37%	0.372	22%	0.224	S	C	.	.			trans	-90.4	-171.4	177.8	-53.8	-177.3	0	0	0	112.1	L225 M244 Y245	L225-L253 HydrophobicContact CD1-CD1 4.04Å; L225-L253 HydrophobicContact CD2-CD1 3.4Å; L225-L253 HydrophobicContact CG-CD1 4.37Å; M244-L253 WeakPolarHBondContact CE-O 3.28Å; Y245-L253 PolarHBondContact O-N 3.13Å
254	V	86.4	Confident	90.8	Very high	109 Å²	109	40.1 Å²	40.1	66%	0.661	21%	0.21	S	C	*	.			trans	-43.5	119.8	-170.2	-174.8	0	0	0	0	112.8
255	P	88	Confident	90.8	Very high	54 Å²	54	42.4 Å²	42.4	35%	0.351	22%	0.218	S	C	.	.			trans	-76	130	172.4	30.7	-32.9	0	0	0	111	M244	M244-P255 HydrophobicContact CE-CB 4.35Å; M244-P255 HydrophobicContact CG-CB 3.86Å; M244-P255 HydrophobicContact SD-CB 4.12Å
256	I	89.8	Confident	90.9	Very high	67 Å²	67	40.8 Å²	40.8	34%	0.344	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.6	176.1	-55.9	176.5	0	0	0	108	P242 R243 Y245	P242-I256 CarbonylContact C-O 3.56Å; P242-I256 VanDerWaalsContact CA-O 3.27Å; P242-I256 WeakPolarHBondContact CA-O 3.08Å; R243-I256 PolarHBondContact N-O 3.23Å; R243-I256 PolarHBondContact O-N 3.44Å; Y245-I256 HydrophobicContact CE2-CD1 3.91Å
257	G	90.3	Very high	90.9	Very high	11 Å²	11	43.8 Å²	43.8	11%	0.113	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.2	171.9	-177.8	0	0	0	0	0	113.7	N210	N210-G257 PolarHBondContact ND2-O 2.95Å; N210-G257 VanDerWaalsContact ND2-O 3.11Å
258	K	91.3	Very high	90.8	Very high	78 Å²	78	48.1 Å²	48.1	34%	0.339	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	155	-173.9	57	179	166.4	140.1	0	111.9	N210 E239 E240 L260	N210-K258 HydrophobicContact CB-CB 3.79Å; E239-K258 PolarHBondContact N-O 3.34Å; E239-K258 IonicContact OE1-NZ 2.83Å; E239-K258 PolarHBondContact OE1-NZ 3Å; E239-K258 WeakPolarHBondContact OE2-CE 3.36Å; E239-K258 IonicContact OE2-NZ 2.61Å; E239-K258 PolarHBondContact OE2-NZ 3.44Å; E240-K258 PolarHBondContact N-O 3.1Å; E240-K258 PolarHBondContact O-N 3.41Å; E240-K258 VanDerWaalsContact O-N 3.12Å; K258-L260 HydrophobicContact CD-CD2 4.44Å
259	C	93.8	Very high	90.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	149.2	168.2	-51.7	0	0	0	0	109.7	N210 L211 C232 K237 N286	N210-C259 PolarHBondContact O-N 3Å; L211-C259 HydrophobicContact CB-CB 3.92Å; C232-C259 WeakPolarHBondContact CA-SG 3.16Å; C232-C259 HydrophobicContact CB-CB 3.75Å; C232-C259 WeakPolarHBondContact CB-SG 3.07Å; C232-C259 WeakPolarHBondContact SG-CB 3.37Å; C232-C259 CovalentContact SG-SG 2.03Å; C232-C259 PolarHBondContact SG-SG 3.21Å; K237-C259 CarbonylContact O-C 3.58Å; K237-C259 WeakPolarHBondContact O-CA 3.19Å; C259-N286 PolarHBondContact O-ND2 3.37Å; C259-N286 PolarHBondContact O-OD1 3.29Å
260	L	94.4	Very high	90.6	Very high	29 Å²	29	51.7 Å²	51.7	15%	0.152	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134	177.7	-63.3	-175.1	0	0	0	111.1	S236 K237 E239 K258 H284 N286	S236-L260 CarbonylContact C-O 3.53Å; S236-L260 WeakPolarHBondContact CA-O 3.25Å; S236-L260 VanDerWaalsContact CB-O 3.32Å; S236-L260 WeakPolarHBondContact CB-O 3.1Å; K237-L260 PolarHBondContact N-O 2.02Å; K237-L260 PolarHBondContact O-N 3.43Å; E239-L260 HydrophobicContact CB-CD1 4.08Å; E239-L260 HydrophobicContact CB-CG 4Å; E239-L260 HydrophobicContact CG-CD1 4.28Å; E239-L260 VanDerWaalsContact OE2-CD1 3.31Å; E239-L260 WeakPolarHBondContact OE2-CD1 3.38Å; E239-L260 WeakPolarHBondContact OE2-CD2 3.48Å; E239-L260 WeakPolarHBondContact OE2-CG 3.03Å; K258-L260 HydrophobicContact CD-CD2 4.44Å; L260-H284 HydrophobicContact CD1-CB 4.41Å; L260-N286 VanDerWaalsContact CA-OD1 3.23Å; L260-N286 WeakPolarHBondContact CA-OD1 3.46Å
261	C	94.6	Very high	90.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	142.1	170.9	-65.4	0	0	0	0	111.3	L211 Y265 C272 H284 G285 N286	L211-C261 WeakPolarHBondContact CD1-SG 3.45Å; C261-Y265 WeakPolarHBondContact CB-O 3.45Å; C261-C272 WeakPolarHBondContact CA-SG 3.2Å; C261-C272 HydrophobicContact CB-CB 3.9Å; C261-C272 WeakPolarHBondContact CB-SG 3.42Å; C261-C272 VanDerWaalsContact SG-CA 3.55Å; C261-C272 WeakPolarHBondContact SG-CB 3.29Å; C261-C272 CovalentContact SG-SG 2.04Å; C261-C272 PolarHBondContact SG-SG 2.95Å; C261-H284 WeakPolarHBondContact O-CA 3.12Å; C261-G285 WeakPolarHBondContact CB-O 3.43Å; C261-G285 PolarHBondContact N-O 2.76Å; C261-G285 PolarHBondContact O-N 3.48Å; C261-G285 VanDerWaalsContact O-N 3.11Å; C261-N286 PolarHBondContact N-OD1 3.28Å
262	N	94.3	Very high	90.9	Very high	47 Å²	47	50.1 Å²	50.1	25%	0.251	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-64.7	159.4	176.4	-70.8	-20.1	0	0	0	111.5	Y235 G264 Y265	Y235-N262 WeakPolarHBondContact O-CB 3.39Å; Y235-N262 VanDerWaalsContact O-CG 3.27Å; Y235-N262 PolarHBondContact O-N 2.76Å; Y235-N262 PolarHBondContact O-ND2 3.48Å; N262-G264 PolarHBondContact O-N 3.32Å; N262-Y265 HydrophobicContact CB-CD2 4.15Å; N262-Y265 WeakPolarHBondContact O-CB 3.49Å; N262-Y265 PolarHBondContact O-N 2.8Å
263	P	92.9	Very high	91	Very high	33 Å²	33	51.6 Å²	51.6	21%	0.214	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	138.1	170.4	-25.1	35.6	0	0	0	110.9	Y265 L304	P263-Y265 VanDerWaalsContact C-N 3.3Å; P263-Y265 WeakPolarHBondContact O-CD2 3.41Å; P263-L304 HydrophobicContact CB-CD2 3.41Å; P263-L304 VanDerWaalsContact CB-CD2 3.41Å
264	G	92.3	Very high	91.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	0.6	-172.3	0	0	0	0	0	115.2	N262 M274 C275 K281 G302	N262-G264 PolarHBondContact O-N 3.32Å; G264-M274 CarbonylContact O-C 3.6Å; G264-M274 WeakPolarHBondContact O-CA 3.29Å; G264-C275 PolarHBondContact O-N 3.02Å; G264-C275 PolarHBondContact O-SG 2.85Å; G264-C275 VanDerWaalsContact O-SG 3.32Å; G264-K281 PolarHBondContact N-O 3.31Å; G264-G302 WeakPolarHBondContact O-CA 3.43Å
265	Y	94	Very high	91.5	Very high	52 Å²	52	47 Å²	47	20%	0.204	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.4	177.4	-65.3	-104.2	0	0	0	112	Y235 C261 N262 P263 Q273 M274 K281	Y235-Y265 AromaticContact CD1-CE1 3.8Å; Y235-Y265 HydrophobicContact CD1-CE1 3.8Å; Y235-Y265 HydrophobicContact CD1-CE2 4.39Å; Y235-Y265 AromaticContact CD1-CZ 3.68Å; Y235-Y265 HydrophobicContact CD2-CD1 4.28Å; Y235-Y265 AromaticContact CD2-CE1 3.8Å; Y235-Y265 HydrophobicContact CD2-CE1 3.8Å; Y235-Y265 HydrophobicContact CE1-CE1 4.39Å; Y235-Y265 HydrophobicContact CE2-CE1 4.39Å; Y235-Y265 AromaticContact CG-CD1 3.95Å; Y235-Y265 HydrophobicContact CG-CD1 3.95Å; Y235-Y265 AromaticContact CG-CE1 3.46Å; Y235-Y265 HydrophobicContact CG-CE1 3.46Å; Y235-Y265 VanDerWaalsContact CG-CE1 3.46Å; Y235-Y265 AromaticContact CG-CZ 3.83Å; C261-Y265 WeakPolarHBondContact CB-O 3.45Å; N262-Y265 HydrophobicContact CB-CD2 4.15Å; N262-Y265 WeakPolarHBondContact O-CB 3.49Å; N262-Y265 PolarHBondContact O-N 2.8Å; P263-Y265 VanDerWaalsContact C-N 3.3Å; P263-Y265 WeakPolarHBondContact O-CD2 3.41Å; Y265-Q273 CarbonylContact C-O 3.45Å; Y265-Q273 WeakPolarHBondContact CA-O 3.49Å; Y265-M274 HydrophobicContact CD1-CB 4.24Å; Y265-M274 HydrophobicContact CE1-CB 4.03Å; Y265-K281 WeakPolarHBondContact O-CD 3.4Å; Y265-K281 WeakPolarHBondContact O-CE 3.41Å; Y265-K281 PolarHBondContact O-NZ 2.97Å
266	E	92.9	Very high	91.8	Very high	24 Å²	24	50.6 Å²	50.6	11%	0.112	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	152.6	174.5	56.4	-177.1	-170.3	0	0	112.4	C272 Q273 C289	E266-C272 CarbonylContact O-C 3.58Å; E266-C272 WeakPolarHBondContact O-CA 3.48Å; E266-Q273 PolarHBondContact N-O 3.16Å; E266-Q273 PolarHBondContact O-N 3.4Å; E266-C289 VanDerWaalsContact CB-SG 3.53Å; E266-C289 VanDerWaalsContact OE2-CB 3.32Å; E266-C289 WeakPolarHBondContact OE2-CB 3.38Å; E266-C289 PolarHBondContact OE2-N 3.44Å; E266-C289 PolarHBondContact OE2-SG 3.22Å
267	E	92.3	Very high	91.9	Very high	62 Å²	62	50 Å²	50	29%	0.29	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	124.8	171.6	172.1	165.1	-160.7	0	0	109.9	L211 T271 N286	L211-E267 HydrophobicContact CD1-CB 4.31Å; L211-E267 HydrophobicContact CD1-CG 4.47Å; L211-E267 HydrophobicContact CD2-CB 4.34Å; L211-E267 HydrophobicContact CD2-CG 3.84Å; L211-E267 HydrophobicContact CG-CG 4.36Å; E267-T271 WeakPolarHBondContact CA-O 3.37Å; E267-N286 HydrophobicContact CB-CB 4.46Å; E267-N286 VanDerWaalsContact OE2-CB 3.3Å; E267-N286 WeakPolarHBondContact OE2-CB 3.34Å
268	R	87.6	Confident	91.9	Very high	104 Å²	104	50.7 Å²	50.7	39%	0.392	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	117.8	174.1	-163.7	164.8	178.8	-131.2	-1.9	110.5	S270 T271 Q273 R276	R268-S270 PolarHBondContact O-N 3.43Å; R268-S270 VanDerWaalsContact O-N 3.16Å; R268-T271 PolarHBondContact N-O 2.91Å; R268-T271 PolarHBondContact O-N 3.42Å; R268-T271 PolarHBondContact O-OG1 3.27Å; R268-Q273 HydrophobicContact CB-CG 4.33Å; R268-R276 VanDerWaalsContact CZ-NH2 3.31Å
269	I	81.9	Confident	92	Very high	151 Å²	151	50.6 Å²	50.6	77%	0.774	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	35.8	176.5	-45.1	160.2	0	0	0	111.2
270	S	85.9	Confident	92	Very high	46 Å²	46	51.3 Å²	51.3	32%	0.322	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	19.5	-177.6	-43.7	0	0	0	0	117	R268	R268-S270 PolarHBondContact O-N 3.43Å; R268-S270 VanDerWaalsContact O-N 3.16Å
271	T	91.6	Very high	92	Very high	64 Å²	64	50.2 Å²	50.2	39%	0.393	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.5	170.1	60.5	0	0	0	0	111.2	E267 R268 Q273	E267-T271 WeakPolarHBondContact CA-O 3.37Å; R268-T271 PolarHBondContact N-O 2.91Å; R268-T271 PolarHBondContact O-N 3.42Å; R268-T271 PolarHBondContact O-OG1 3.27Å; T271-Q273 PolarHBondContact OG1-NE2 2.99Å
272	C	93.8	Very high	91.7	Very high	10 Å²	10	52.4 Å²	52.4	7%	0.068	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	110.7	170.6	-66.8	0	0	0	0	110.1	N234 C261 E266	N234-C272 WeakPolarHBondContact O-CB 3.49Å; C261-C272 WeakPolarHBondContact CA-SG 3.2Å; C261-C272 HydrophobicContact CB-CB 3.9Å; C261-C272 WeakPolarHBondContact CB-SG 3.42Å; C261-C272 VanDerWaalsContact SG-CA 3.55Å; C261-C272 WeakPolarHBondContact SG-CB 3.29Å; C261-C272 CovalentContact SG-SG 2.04Å; C261-C272 PolarHBondContact SG-SG 2.95Å; E266-C272 CarbonylContact O-C 3.58Å; E266-C272 WeakPolarHBondContact O-CA 3.48Å
273	Q	92.9	Very high	91.5	Very high	72 Å²	72	53.8 Å²	53.8	34%	0.336	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.5	179.3	-62.4	-170.9	-3.4	0	0	110.3	Y265 E266 R268 T271	Y265-Q273 CarbonylContact C-O 3.45Å; Y265-Q273 WeakPolarHBondContact CA-O 3.49Å; E266-Q273 PolarHBondContact N-O 3.16Å; E266-Q273 PolarHBondContact O-N 3.4Å; R268-Q273 HydrophobicContact CB-CG 4.33Å; T271-Q273 PolarHBondContact OG1-NE2 2.99Å
274	M	94	Very high	91.2	Very high	84 Å²	84	56.9 Å²	56.9	41%	0.414	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	143.4	178.3	61.4	-172.3	78.7	0	0	111.8	G264 Y265 R276 E301	G264-M274 CarbonylContact O-C 3.6Å; G264-M274 WeakPolarHBondContact O-CA 3.29Å; Y265-M274 HydrophobicContact CD1-CB 4.24Å; Y265-M274 HydrophobicContact CE1-CB 4.03Å; M274-R276 PolarHBondContact O-N 2.83Å; M274-E301 HydrophobicContact CG-CB 4.08Å; M274-E301 HydrophobicContact SD-CB 3.73Å
275	C	93.8	Very high	91	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-58.1	134.6	173.9	-63.8	0	0	0	0	110.2	G264 F279 K281 C289 E301 G302	G264-C275 PolarHBondContact O-N 3.02Å; G264-C275 PolarHBondContact O-SG 2.85Å; G264-C275 VanDerWaalsContact O-SG 3.32Å; C275-F279 HydrophobicContact CB-CB 4.42Å; C275-K281 VanDerWaalsContact SG-CB 3.58Å; C275-C289 WeakPolarHBondContact CA-SG 3.3Å; C275-C289 HydrophobicContact CB-CB 3.68Å; C275-C289 WeakPolarHBondContact CB-SG 3Å; C275-C289 WeakPolarHBondContact SG-CB 3.35Å; C275-C289 CovalentContact SG-SG 2.02Å; C275-C289 PolarHBondContact SG-SG 2.98Å; C275-E301 CarbonylContact O-C 3.53Å; C275-E301 WeakPolarHBondContact O-CA 3.34Å; C275-E301 WeakPolarHBondContact O-CB 3.34Å; C275-G302 PolarHBondContact O-N 3.39Å
276	R	93.1	Very high	90.5	Very high	128 Å²	128	57.3 Å²	57.3	48%	0.483	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-67.6	158.9	176.3	-60	-177.7	-171.8	179.4	4.3	111.5	R268 M274 G278 F279	R268-R276 VanDerWaalsContact CZ-NH2 3.31Å; M274-R276 PolarHBondContact O-N 2.83Å; R276-G278 PolarHBondContact O-N 2.85Å; R276-F279 HydrophobicContact CB-CD2 4.29Å; R276-F279 WeakPolarHBondContact O-CA 3.04Å; R276-F279 WeakPolarHBondContact O-CB 3.45Å; R276-F279 PolarHBondContact O-N 3.11Å
277	A	92.1	Very high	90.1	Very high	55 Å²	55	61.6 Å²	61.6	46%	0.455	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	138	170.9	0	0	0	0	0	111.2	F279	A277-F279 VanDerWaalsContact C-N 3.27Å
278	G	90.5	Very high	90	Very high	26 Å²	26	65.9 Å²	65.9	27%	0.268	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	-2.1	-171.6	0	0	0	0	0	115	R276 C292 S298	R276-G278 PolarHBondContact O-N 2.85Å; G278-C292 PolarHBondContact O-N 2.68Å; G278-C292 PolarHBondContact O-SG 3.12Å; G278-S298 VanDerWaalsContact CA-OG 3.29Å; G278-S298 WeakPolarHBondContact CA-OG 3.46Å; G278-S298 PolarHBondContact N-O 2.71Å; G278-S298 PolarHBondContact N-OG 2.04Å
279	F	93.7	Very high	90.3	Very high	76 Å²	76	61.3 Å²	61.3	33%	0.333	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	160.4	173.4	-66.1	-105.9	0	0	0	110.4	C275 R276 A277 C289 S290 K291 S298	C275-F279 HydrophobicContact CB-CB 4.42Å; R276-F279 HydrophobicContact CB-CD2 4.29Å; R276-F279 WeakPolarHBondContact O-CA 3.04Å; R276-F279 WeakPolarHBondContact O-CB 3.45Å; R276-F279 PolarHBondContact O-N 3.11Å; A277-F279 VanDerWaalsContact C-N 3.27Å; F279-C289 HydrophobicContact CB-CB 3.91Å; F279-C289 WeakPolarHBondContact CD1-O 3.42Å; F279-S290 CarbonylContact C-O 3.54Å; F279-S290 WeakPolarHBondContact CA-O 3.32Å; F279-S290 WeakPolarHBondContact CB-O 3.16Å; F279-K291 HydrophobicContact CD1-CB 4.04Å; F279-K291 VanDerWaalsContact CD1-N 3.34Å; F279-K291 HydrophobicContact CE1-CB 3.75Å; F279-K291 HydrophobicContact CE1-CG 4.38Å; F279-K291 HydrophobicContact CZ-CB 4.22Å; F279-K291 HydrophobicContact CZ-CG 4.36Å; F279-S298 PolarHBondContact N-OG 3.5Å; F279-S298 PolarHBondContact O-OG 3.43Å
280	Y	93.7	Very high	90.8	Very high	14 Å²	14	56.8 Å²	56.8	6%	0.055	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	161.6	179.4	81.4	-74.3	0	0	0	112.2	S290 S303 L304 C306 A320 S321	Y280-S290 VanDerWaalsContact CD1-O 3.29Å; Y280-S290 WeakPolarHBondContact CD1-O 3.05Å; Y280-S290 PolarHBondContact N-O 3.46Å; Y280-S290 PolarHBondContact O-N 3.39Å; Y280-S303 CarbonylContact C-O 3.48Å; Y280-S303 WeakPolarHBondContact CA-O 3.37Å; Y280-S303 WeakPolarHBondContact CB-O 3.17Å; Y280-L304 WeakPolarHBondContact CD2-O 3.47Å; Y280-C306 WeakPolarHBondContact CD1-SG 3.48Å; Y280-C306 VanDerWaalsContact CG-SG 3.56Å; Y280-A320 HydrophobicContact CE2-CB 3.79Å; Y280-A320 PolarHBondContact OH-O 2.88Å; Y280-S321 WeakPolarHBondContact OH-CA 3.38Å; Y280-S321 WeakPolarHBondContact OH-CB 3.16Å; Y280-S321 PolarHBondContact OH-N 3.47Å
281	K	93.7	Very high	91.2	Very high	7 Å²	7	62.1 Å²	62.1	3%	0.03	33%	0.326	C	S	.	.			trans	-152.6	115.2	170.1	-176.7	176.8	178.6	171.7	0	111.8	G264 Y265 C275 T283 G285 M287 S303 L304	G264-K281 PolarHBondContact N-O 3.31Å; Y265-K281 WeakPolarHBondContact O-CD 3.4Å; Y265-K281 WeakPolarHBondContact O-CE 3.41Å; Y265-K281 PolarHBondContact O-NZ 2.97Å; C275-K281 VanDerWaalsContact SG-CB 3.58Å; K281-T283 VanDerWaalsContact CE-O 3.25Å; K281-T283 WeakPolarHBondContact CE-O 3.37Å; K281-T283 WeakPolarHBondContact CG-O 3.39Å; K281-G285 WeakPolarHBondContact CE-O 3.29Å; K281-G285 PolarHBondContact NZ-O 2.94Å; K281-M287 PolarHBondContact NZ-O 2.98Å; K281-S303 PolarHBondContact N-O 3.19Å; K281-L304 CarbonylContact C-O 3.54Å
282	S	89.4	Confident	91.3	Very high	45 Å²	45	59.9 Å²	59.9	32%	0.315	31%	0.313	S	S	.	.			trans	-90.4	-18	-174.4	51.7	0	0	0	0	114.8	L304 H305	S282-L304 VanDerWaalsContact CA-O 3.24Å; S282-L304 WeakPolarHBondContact CA-O 3.07Å; S282-L304 VanDerWaalsContact CB-O 3.29Å; S282-L304 WeakPolarHBondContact CB-O 3.47Å; S282-L304 PolarHBondContact N-O 3.43Å; S282-H305 VanDerWaalsContact CB-CE1 3.48Å; S282-H305 WeakPolarHBondContact CB-CE1 3.24Å
283	T	89	Confident	91.4	Very high	77 Å²	77	60 Å²	60	47%	0.472	31%	0.314	S	S	.	.	S	Bend	trans	-122.6	155	-172.1	53.3	0	0	0	0	112	K281	K281-T283 VanDerWaalsContact CE-O 3.25Å; K281-T283 WeakPolarHBondContact CE-O 3.37Å; K281-T283 WeakPolarHBondContact CG-O 3.39Å
284	H	87.6	Confident	91.4	Very high	98 Å²	98	60.7 Å²	60.7	45%	0.454	33%	0.325	S	S	.	.			trans	-63.2	145.7	167.5	-59	78.5	0	0	0	109.1	L260 C261	L260-H284 HydrophobicContact CD1-CB 4.41Å; C261-H284 WeakPolarHBondContact O-CA 3.12Å
285	G	86.8	Confident	91.4	Very high	11 Å²	11	60 Å²	60	11%	0.113	32%	0.321	C	S	.	.	S	Bend	trans	154.7	176.5	176.1	0	0	0	0	0	112.3	C261 K281	C261-G285 WeakPolarHBondContact CB-O 3.43Å; C261-G285 PolarHBondContact N-O 2.76Å; C261-G285 PolarHBondContact O-N 3.48Å; C261-G285 VanDerWaalsContact O-N 3.11Å; K281-G285 WeakPolarHBondContact CE-O 3.29Å; K281-G285 PolarHBondContact NZ-O 2.94Å
286	N	84.1	Confident	91.4	Very high	49 Å²	49	60.6 Å²	60.6	26%	0.262	32%	0.324	S	S	.	.	S	Bend	trans	-105	12.3	-179	-69.4	-2.6	0	0	0	113.2	L211 C259 L260 C261 E267	L211-N286 VanDerWaalsContact CD1-CG 3.5Å; L211-N286 WeakPolarHBondContact CD1-OD1 3.49Å; C259-N286 PolarHBondContact O-ND2 3.37Å; C259-N286 PolarHBondContact O-OD1 3.29Å; L260-N286 VanDerWaalsContact CA-OD1 3.23Å; L260-N286 WeakPolarHBondContact CA-OD1 3.46Å; C261-N286 PolarHBondContact N-OD1 3.28Å; E267-N286 HydrophobicContact CB-CB 4.46Å; E267-N286 VanDerWaalsContact OE2-CB 3.3Å; E267-N286 WeakPolarHBondContact OE2-CB 3.34Å
287	M	85.2	Confident	91.4	Very high	115 Å²	115	58.4 Å²	58.4	57%	0.567	32%	0.318	S	S	*	.	S	Bend	trans	-72.6	148.5	173.1	54.3	176.2	34.4	0	0	112.1	K281	K281-M287 PolarHBondContact NZ-O 2.98Å
288	E	89.9	Confident	91.5	Very high	151 Å²	151	56.2 Å²	56.2	71%	0.706	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-58.5	150.5	169.4	-63.6	-174.7	161.4	0	0	111	S290	E288-S290 PolarHBondContact O-N 3.13Å
289	C	93	Very high	91.2	Very high	9 Å²	9	61.6 Å²	61.6	6%	0.061	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-62.7	137.2	174.7	-63	0	0	0	0	109.4	E266 C275 F279	E266-C289 VanDerWaalsContact CB-SG 3.53Å; E266-C289 VanDerWaalsContact OE2-CB 3.32Å; E266-C289 WeakPolarHBondContact OE2-CB 3.38Å; E266-C289 PolarHBondContact OE2-N 3.44Å; E266-C289 PolarHBondContact OE2-SG 3.22Å; C275-C289 WeakPolarHBondContact CA-SG 3.3Å; C275-C289 HydrophobicContact CB-CB 3.68Å; C275-C289 WeakPolarHBondContact CB-SG 3Å; C275-C289 WeakPolarHBondContact SG-CB 3.35Å; C275-C289 CovalentContact SG-SG 2.02Å; C275-C289 PolarHBondContact SG-SG 2.98Å; F279-C289 HydrophobicContact CB-CB 3.91Å; F279-C289 WeakPolarHBondContact CD1-O 3.42Å
290	S	93.2	Very high	90.9	Very high	55 Å²	55	64.8 Å²	64.8	39%	0.385	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	140.5	179.6	-67.9	0	0	0	0	110.1	F279 Y280 E288	F279-S290 CarbonylContact C-O 3.54Å; F279-S290 WeakPolarHBondContact CA-O 3.32Å; F279-S290 WeakPolarHBondContact CB-O 3.16Å; Y280-S290 VanDerWaalsContact CD1-O 3.29Å; Y280-S290 WeakPolarHBondContact CD1-O 3.05Å; Y280-S290 PolarHBondContact N-O 3.46Å; Y280-S290 PolarHBondContact O-N 3.39Å; E288-S290 PolarHBondContact O-N 3.13Å
291	K	94.1	Very high	90.8	Very high	158 Å²	158	70 Å²	70	69%	0.687	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	142.7	171.2	-171.7	177.1	178.9	179.4	0	109.2	F279	F279-K291 HydrophobicContact CD1-CB 4.04Å; F279-K291 VanDerWaalsContact CD1-N 3.34Å; F279-K291 HydrophobicContact CE1-CB 3.75Å; F279-K291 HydrophobicContact CE1-CG 4.38Å; F279-K291 HydrophobicContact CZ-CB 4.22Å; F279-K291 HydrophobicContact CZ-CG 4.36Å
292	C	94.3	Very high	90.6	Very high	17 Å²	17	70.7 Å²	70.7	12%	0.115	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-54.1	130	174.6	-73.9	0	0	0	0	110.9	G278 F297 S298 C306	G278-C292 PolarHBondContact O-N 2.68Å; G278-C292 PolarHBondContact O-SG 3.12Å; C292-F297 VanDerWaalsContact SG-C 3.59Å; C292-S298 PolarHBondContact SG-N 3.07Å; C292-S298 VanDerWaalsContact SG-N 3.43Å; C292-S298 PolarHBondContact SG-OG 2.69Å; C292-S298 VanDerWaalsContact SG-OG 3.32Å; C292-C306 WeakPolarHBondContact CA-SG 3.49Å; C292-C306 HydrophobicContact CB-CB 3.75Å; C292-C306 WeakPolarHBondContact CB-SG 3.39Å; C292-C306 WeakPolarHBondContact SG-CB 3.4Å; C292-C306 CovalentContact SG-SG 2.03Å; C292-C306 PolarHBondContact SG-SG 2.8Å
293	P	94.4	Very high	90.8	Very high	14 Å²	14	69.5 Å²	69.5	9%	0.091	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-68	164.2	-179.9	29.9	-36.4	0	0	0	110.8	S296 M322 A323	P293-S296 WeakPolarHBondContact CD-OG 3.48Å; P293-S296 WeakPolarHBondContact CG-OG 3.48Å; P293-S296 PolarHBondContact O-N 3.41Å; P293-S296 PolarHBondContact O-OG 3.12Å; P293-M322 WeakPolarHBondContact CG-O 3.43Å; P293-A323 HydrophobicContact CB-CB 4.43Å
294	P	93.8	Very high	90.9	Very high	86 Å²	86	69.6 Å²	69.6	56%	0.558	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	144.8	-178.3	-28	33.9	0	0	0	113.6	S296 A323 C324	P294-S296 PolarHBondContact O-N 3.29Å; P294-A323 HydrophobicContact CB-CB 4.08Å; P294-A323 HydrophobicContact CG-CB 4.33Å; P294-A323 WeakPolarHBondContact O-CB 3.5Å; P294-C324 PolarHBondContact O-N 3.05Å; P294-C324 VanDerWaalsContact O-N 3.16Å
295	H	94.1	Very high	91	Very high	70 Å²	70	70.4 Å²	70.4	32%	0.324	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	27.2	-177	-52	-61	0	0	0	114.5	E309 Y312 C324	H295-E309 IonicContact ND1-OE2 3.87Å; H295-E309 PolarHBondContact ND1-OE2 3.42Å; H295-E309 PolarHBondContact O-N 2.79Å; H295-Y312 HydrophobicContact CB-CD1 3.57Å; H295-Y312 HydrophobicContact CB-CD2 4.07Å; H295-Y312 HydrophobicContact CB-CE1 3.94Å; H295-Y312 HydrophobicContact CB-CE2 4.41Å; H295-Y312 HydrophobicContact CB-CG 3.64Å; H295-Y312 AromaticContact CD2-CD1 3.71Å; H295-Y312 AromaticContact CD2-CE1 3.25Å; H295-Y312 WeakPolarHBondContact CD2-CE1 3.43Å; H295-Y312 AromaticContact CD2-CZ 3.77Å; H295-Y312 AromaticContact CE1-CE1 3.78Å; H295-Y312 AromaticContact CE1-CZ 3.46Å; H295-Y312 VanDerWaalsContact CE1-CZ 3.46Å; H295-Y312 PolarHBondContact CE1-OH 3Å; H295-Y312 VanDerWaalsContact CE1-OH 3.22Å; H295-Y312 AromaticContact CG-CD1 3.54Å; H295-Y312 AromaticContact CG-CE1 3.34Å; H295-Y312 AromaticContact CG-CG 3.94Å; H295-Y312 AromaticContact CG-CZ 3.59Å; H295-Y312 AromaticContact ND1-CE1 3.68Å; H295-Y312 AromaticContact ND1-CE2 3.7Å; H295-Y312 AromaticContact ND1-CZ 3.4Å; H295-Y312 AromaticContact NE2-CE1 3.54Å; H295-Y312 AromaticContact NE2-CZ 3.69Å; H295-C324 HydrophobicContact CB-CB 4.09Å; H295-C324 WeakPolarHBondContact O-CB 3.14Å; H295-C324 PolarHBondContact O-SG 3.15Å
296	S	94.6	Very high	91.3	Very high	11 Å²	11	70 Å²	70	8%	0.077	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.1	174.8	78.3	0	0	0	0	111.8	P293 P294 C306 G307 R314	P293-S296 WeakPolarHBondContact CD-OG 3.48Å; P293-S296 WeakPolarHBondContact CG-OG 3.48Å; P293-S296 PolarHBondContact O-N 3.41Å; P293-S296 PolarHBondContact O-OG 3.12Å; P294-S296 PolarHBondContact O-N 3.29Å; S296-C306 WeakPolarHBondContact OG-CB 3.25Å; S296-G307 CarbonylContact C-O 3.54Å; S296-G307 WeakPolarHBondContact CA-O 3.4Å; S296-G307 VanDerWaalsContact CB-O 3.25Å; S296-G307 WeakPolarHBondContact CB-O 3.49Å; S296-R314 PolarHBondContact OG-NH2 2.67Å
297	F	92.6	Very high	91.8	Very high	82 Å²	82	69.5 Å²	69.5	36%	0.36	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	158.6	-176.2	64.9	-89.2	0	0	0	112.4	C292 H299 C306 G307 E309	C292-F297 VanDerWaalsContact SG-C 3.59Å; F297-H299 AromaticContact CD2-CD2 3.57Å; F297-H299 AromaticContact CD2-CE1 3.66Å; F297-H299 AromaticContact CD2-NE2 3.26Å; F297-H299 VanDerWaalsContact CD2-NE2 3.26Å; F297-H299 WeakPolarHBondContact CD2-NE2 3.5Å; F297-H299 AromaticContact CE2-CD2 3.33Å; F297-H299 WeakPolarHBondContact CE2-CD2 3.5Å; F297-H299 AromaticContact CE2-CE1 3.93Å; F297-H299 AromaticContact CE2-NE2 3.07Å; F297-H299 WeakPolarHBondContact CE2-NE2 3.08Å; F297-C306 CarbonylContact O-C 3.59Å; F297-C306 WeakPolarHBondContact O-CA 3.28Å; F297-G307 PolarHBondContact N-O 2.8Å; F297-G307 PolarHBondContact O-N 2.78Å; F297-E309 HydrophobicContact CD1-CG 4.05Å; F297-E309 HydrophobicContact CE1-CG 4.43Å
298	S	93.1	Very high	92.2	Very high	10 Å²	10	66 Å²	66	7%	0.07	35%	0.348	C	S	.	.			trans	-134.4	123.4	169.7	63.6	0	0	0	0	109.8	G278 F279 C292 S303	G278-S298 VanDerWaalsContact CA-OG 3.29Å; G278-S298 WeakPolarHBondContact CA-OG 3.46Å; G278-S298 PolarHBondContact N-O 2.71Å; G278-S298 PolarHBondContact N-OG 2.04Å; F279-S298 PolarHBondContact N-OG 3.5Å; F279-S298 PolarHBondContact O-OG 3.43Å; C292-S298 PolarHBondContact SG-N 3.07Å; C292-S298 VanDerWaalsContact SG-N 3.43Å; C292-S298 PolarHBondContact SG-OG 2.69Å; C292-S298 VanDerWaalsContact SG-OG 3.32Å; S298-S303 WeakPolarHBondContact CB-OG 3.47Å
299	H	85.6	Confident	92.3	Very high	138 Å²	138	62.7 Å²	62.7	64%	0.639	33%	0.333	S	S	*	.			trans	-91.2	-21.5	-178.7	-69.3	-52.7	0	0	0	113.7	F297	F297-H299 AromaticContact CD2-CD2 3.57Å; F297-H299 AromaticContact CD2-CE1 3.66Å; F297-H299 AromaticContact CD2-NE2 3.26Å; F297-H299 VanDerWaalsContact CD2-NE2 3.26Å; F297-H299 WeakPolarHBondContact CD2-NE2 3.5Å; F297-H299 AromaticContact CE2-CD2 3.33Å; F297-H299 WeakPolarHBondContact CE2-CD2 3.5Å; F297-H299 AromaticContact CE2-CE1 3.93Å; F297-H299 AromaticContact CE2-NE2 3.07Å; F297-H299 WeakPolarHBondContact CE2-NE2 3.08Å
300	H	87.1	Confident	92.2	Very high	143 Å²	143	71 Å²	71	66%	0.662	37%	0.368	S	S	*	.	S	Bend	trans	-107.1	146.5	-174.2	-55.8	-72.6	0	0	0	110.8	S303	H300-S303 PolarHBondContact O-OG 3.05Å
301	E	91.1	Very high	92.1	Very high	124 Å²	124	72.3 Å²	72.3	58%	0.579	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	152	168.8	-60.9	-176.3	150.3	0	0	110.2	M274 C275 S303	M274-E301 HydrophobicContact CG-CB 4.08Å; M274-E301 HydrophobicContact SD-CB 3.73Å; C275-E301 CarbonylContact O-C 3.53Å; C275-E301 WeakPolarHBondContact O-CA 3.34Å; C275-E301 WeakPolarHBondContact O-CB 3.34Å; E301-S303 VanDerWaalsContact C-N 3.29Å; E301-S303 PolarHBondContact O-N 3.31Å
302	G	90.3	Very high	92	Very high	22 Å²	22	66.8 Å²	66.8	23%	0.227	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	19.5	-178.4	0	0	0	0	0	114.9	G264 C275 L304	G264-G302 WeakPolarHBondContact O-CA 3.43Å; C275-G302 PolarHBondContact O-N 3.39Å; G302-L304 PolarHBondContact O-N 2.61Å
303	S	92.8	Very high	92	Very high	19 Å²	19	68.5 Å²	68.5	13%	0.133	35%	0.352	C	S	.	.			trans	-63	130.8	-177.2	-73.5	0	0	0	0	112.6	Y280 K281 S298 H300 E301	Y280-S303 CarbonylContact C-O 3.48Å; Y280-S303 WeakPolarHBondContact CA-O 3.37Å; Y280-S303 WeakPolarHBondContact CB-O 3.17Å; K281-S303 PolarHBondContact N-O 3.19Å; S298-S303 WeakPolarHBondContact CB-OG 3.47Å; H300-S303 PolarHBondContact O-OG 3.05Å; E301-S303 VanDerWaalsContact C-N 3.29Å; E301-S303 PolarHBondContact O-N 3.31Å
304	L	91.1	Very high	91.9	Very high	79 Å²	79	70.3 Å²	70.3	41%	0.414	36%	0.357	S	S	.	.	S	Bend	trans	-81.4	-29.9	177.7	-58.4	-176.7	0	0	0	112.8	P263 Y280 K281 S282 G302	P263-L304 HydrophobicContact CB-CD2 3.41Å; P263-L304 VanDerWaalsContact CB-CD2 3.41Å; Y280-L304 WeakPolarHBondContact CD2-O 3.47Å; K281-L304 CarbonylContact C-O 3.54Å; S282-L304 VanDerWaalsContact CA-O 3.24Å; S282-L304 WeakPolarHBondContact CA-O 3.07Å; S282-L304 VanDerWaalsContact CB-O 3.29Å; S282-L304 WeakPolarHBondContact CB-O 3.47Å; S282-L304 PolarHBondContact N-O 3.43Å; G302-L304 PolarHBondContact O-N 2.61Å
305	H	90.8	Very high	91.8	Very high	115 Å²	115	67.1 Å²	67.1	53%	0.532	34%	0.337	S	S	.	.	S	Bend	trans	-147.1	155.6	-178.7	-51.6	-73.9	0	0	0	109.8	S282	S282-H305 VanDerWaalsContact CB-CE1 3.48Å; S282-H305 WeakPolarHBondContact CB-CE1 3.24Å
306	C	93.1	Very high	91.4	Very high	4 Å²	4	73.6 Å²	73.6	3%	0.027	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-94.9	130.9	172	-56.4	0	0	0	0	110.7	Y280 C292 S296 F297 R314	Y280-C306 WeakPolarHBondContact CD1-SG 3.48Å; Y280-C306 VanDerWaalsContact CG-SG 3.56Å; C292-C306 WeakPolarHBondContact CA-SG 3.49Å; C292-C306 HydrophobicContact CB-CB 3.75Å; C292-C306 WeakPolarHBondContact CB-SG 3.39Å; C292-C306 WeakPolarHBondContact SG-CB 3.4Å; C292-C306 CovalentContact SG-SG 2.03Å; C292-C306 PolarHBondContact SG-SG 2.8Å; S296-C306 WeakPolarHBondContact OG-CB 3.25Å; F297-C306 CarbonylContact O-C 3.59Å; F297-C306 WeakPolarHBondContact O-CA 3.28Å; C306-R314 PolarHBondContact O-NH1 2.92Å
307	G	92.8	Very high	90.8	Very high	38 Å²	38	76.8 Å²	76.8	39%	0.392	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	145.9	174.5	0	0	0	0	0	111.4	S296 F297	S296-G307 CarbonylContact C-O 3.54Å; S296-G307 WeakPolarHBondContact CA-O 3.4Å; S296-G307 VanDerWaalsContact CB-O 3.25Å; S296-G307 WeakPolarHBondContact CB-O 3.49Å; F297-G307 PolarHBondContact N-O 2.8Å; F297-G307 PolarHBondContact O-N 2.78Å
308	C	93.9	Very high	90.7	Very high	41 Å²	41	74.6 Å²	74.6	28%	0.277	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	146.3	178.2	-66.4	0	0	0	0	112.3	Y312 C324	C308-Y312 VanDerWaalsContact CB-O 3.31Å; C308-Y312 WeakPolarHBondContact CB-O 3.3Å; C308-C324 WeakPolarHBondContact CA-SG 3.23Å; C308-C324 HydrophobicContact CB-CB 3.69Å; C308-C324 WeakPolarHBondContact CB-SG 3.15Å; C308-C324 WeakPolarHBondContact SG-CB 3.3Å; C308-C324 CovalentContact SG-SG 2.04Å; C308-C324 PolarHBondContact SG-SG 2.99Å
309	E	93.6	Very high	90.5	Very high	81 Å²	81	77.6 Å²	77.6	38%	0.379	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-65.2	162.2	168.6	-71	173.8	-170	0	0	111.8	H295 F297 N311 Y312	H295-E309 IonicContact ND1-OE2 3.87Å; H295-E309 PolarHBondContact ND1-OE2 3.42Å; H295-E309 PolarHBondContact O-N 2.79Å; F297-E309 HydrophobicContact CD1-CG 4.05Å; F297-E309 HydrophobicContact CE1-CG 4.43Å; E309-N311 PolarHBondContact O-N 3.5Å; E309-Y312 HydrophobicContact CB-CD2 4.3Å; E309-Y312 PolarHBondContact O-N 2.91Å; E309-Y312 VanDerWaalsContact O-N 3.1Å
310	K	90.6	Very high	90.6	Very high	183 Å²	183	72.1 Å²	72.1	80%	0.796	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	133.8	179.1	-171.3	177.9	-179.8	179.5	0	110.9	Y312	K310-Y312 PolarHBondContact O-N 3.13Å
311	N	89.8	Confident	90.7	Very high	84 Å²	84	69 Å²	69	45%	0.449	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	12.1	-176.9	-49.7	-41.1	0	0	0	115.4	E309 F313 M432	E309-N311 PolarHBondContact O-N 3.5Å; N311-F313 VanDerWaalsContact O-CE2 3.31Å; N311-F313 WeakPolarHBondContact O-CE2 3.24Å; N311-M432 HydrophobicContact CB-CE 4.11Å; N311-M432 HydrophobicContact CB-SD 4.02Å
312	Y	93.3	Very high	90.7	Very high	42 Å²	42	66 Å²	66	17%	0.165	37%	0.373	C	S	.	.			trans	-116.9	147.9	169.6	-72.5	-95	0	0	0	110.2	H295 C308 E309 K310 C324 T325 R326	H295-Y312 HydrophobicContact CB-CD1 3.57Å; H295-Y312 HydrophobicContact CB-CD2 4.07Å; H295-Y312 HydrophobicContact CB-CE1 3.94Å; H295-Y312 HydrophobicContact CB-CE2 4.41Å; H295-Y312 HydrophobicContact CB-CG 3.64Å; H295-Y312 AromaticContact CD2-CD1 3.71Å; H295-Y312 AromaticContact CD2-CE1 3.25Å; H295-Y312 WeakPolarHBondContact CD2-CE1 3.43Å; H295-Y312 AromaticContact CD2-CZ 3.77Å; H295-Y312 AromaticContact CE1-CE1 3.78Å; H295-Y312 AromaticContact CE1-CZ 3.46Å; H295-Y312 VanDerWaalsContact CE1-CZ 3.46Å; H295-Y312 PolarHBondContact CE1-OH 3Å; H295-Y312 VanDerWaalsContact CE1-OH 3.22Å; H295-Y312 AromaticContact CG-CD1 3.54Å; H295-Y312 AromaticContact CG-CE1 3.34Å; H295-Y312 AromaticContact CG-CG 3.94Å; H295-Y312 AromaticContact CG-CZ 3.59Å; H295-Y312 AromaticContact ND1-CE1 3.68Å; H295-Y312 AromaticContact ND1-CE2 3.7Å; H295-Y312 AromaticContact ND1-CZ 3.4Å; H295-Y312 AromaticContact NE2-CE1 3.54Å; H295-Y312 AromaticContact NE2-CZ 3.69Å; C308-Y312 VanDerWaalsContact CB-O 3.31Å; C308-Y312 WeakPolarHBondContact CB-O 3.3Å; E309-Y312 HydrophobicContact CB-CD2 4.3Å; E309-Y312 PolarHBondContact O-N 2.91Å; E309-Y312 VanDerWaalsContact O-N 3.1Å; K310-Y312 PolarHBondContact O-N 3.13Å; Y312-C324 WeakPolarHBondContact CD1-O 3.37Å; Y312-T325 CarbonylContact C-O 3.51Å; Y312-T325 WeakPolarHBondContact CA-O 3.34Å; Y312-R326 HydrophobicContact CD1-CB 4.21Å; Y312-R326 HydrophobicContact CE1-CB 4.23Å; Y312-R326 HydrophobicContact CE1-CG 4.19Å
313	F	93.1	Very high	90.9	Very high	53 Å²	53	66.3 Å²	66.3	23%	0.232	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-144.7	161.9	-168.4	-49.7	-85.4	0	0	0	111.5	N311 C324 T325 V425 L428 A429	N311-F313 VanDerWaalsContact O-CE2 3.31Å; N311-F313 WeakPolarHBondContact O-CE2 3.24Å; F313-C324 WeakPolarHBondContact O-CA 3.46Å; F313-T325 PolarHBondContact N-O 2.88Å; F313-T325 PolarHBondContact O-N 3.39Å; F313-T325 PolarHBondContact O-OG1 3.46Å; F313-V425 HydrophobicContact CB-CB 4.12Å; F313-V425 HydrophobicContact CB-CG1 4.05Å; F313-L428 HydrophobicContact CB-CB 4.45Å; F313-L428 HydrophobicContact CB-CD1 3.72Å; F313-L428 HydrophobicContact CD1-CB 4.11Å; F313-L428 HydrophobicContact CD1-CD1 4.46Å; F313-L428 HydrophobicContact CG-CB 4.15Å; F313-L428 HydrophobicContact CG-CD1 4.29Å; F313-A429 HydrophobicContact CD2-CB 4.41Å; F313-A429 HydrophobicContact CE2-CB 3.65Å; F313-A429 HydrophobicContact CZ-CB 3.98Å
314	R	92.9	Very high	91	Very high	52 Å²	52	65.4 Å²	65.4	20%	0.196	37%	0.368	C	S	.	.			trans	-118.9	139.6	165.5	-70.8	-173.1	-175.5	103	-2	108.5	S296 C306 D318 M322 C324 L428	S296-R314 PolarHBondContact OG-NH2 2.67Å; C306-R314 PolarHBondContact O-NH1 2.92Å; R314-D318 HydrophobicContact CB-CB 4.22Å; R314-M322 PolarHBondContact NE-O 3.29Å; R314-M322 PolarHBondContact NH2-O 3.07Å; R314-M322 VanDerWaalsContact NH2-O 3.07Å; R314-C324 PolarHBondContact NH1-SG 3.21Å; R314-L428 WeakPolarHBondContact O-CD1 3.23Å
315	A	91.1	Very high	91.2	Very high	19 Å²	19	62 Å²	62	16%	0.157	35%	0.35	C	S	.	.			trans	-77.3	159.8	174.5	0	0	0	0	0	110.4	G317 D318 V425	A315-G317 PolarHBondContact O-N 3.44Å; A315-D318 PolarHBondContact N-OD2 2.71Å; A315-D318 WeakPolarHBondContact O-CB 3.45Å; A315-D318 PolarHBondContact O-N 3.39Å; A315-D318 VanDerWaalsContact O-N 3.13Å; A315-V425 HydrophobicContact CB-CG1 4.29Å
316	E	85.6	Confident	91.3	Very high	206 Å²	206	61 Å²	61	96%	0.963	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	117.9	174.6	-166	175.7	179.6	0	0	109.5
317	G	83.1	Confident	91.4	Very high	78 Å²	78	61.2 Å²	61.2	80%	0.804	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.1	-7.2	-174.4	0	0	0	0	0	115.4	A315	A315-G317 PolarHBondContact O-N 3.44Å
318	D	89.8	Confident	91.5	Very high	35 Å²	35	59.5 Å²	59.5	19%	0.187	33%	0.325	C	S	.	.			trans	-68.2	134.4	172.8	-72.3	-14.6	0	0	0	110.6	R314 A315 M322 R356	R314-D318 HydrophobicContact CB-CB 4.22Å; A315-D318 PolarHBondContact N-OD2 2.71Å; A315-D318 WeakPolarHBondContact O-CB 3.45Å; A315-D318 PolarHBondContact O-N 3.39Å; A315-D318 VanDerWaalsContact O-N 3.13Å; D318-M322 HydrophobicContact CB-SD 4.03Å; D318-R356 IonicContact OD1-CZ 3.06Å; D318-R356 IonicContact OD1-NH1 2.67Å; D318-R356 IonicContact OD1-NH2 2.91Å; D318-R356 PolarHBondContact OD1-NH2 2.79Å; D318-R356 IonicContact OD2-CZ 2.71Å; D318-R356 IonicContact OD2-NH1 2.9Å; D318-R356 PolarHBondContact OD2-NH1 3.46Å; D318-R356 IonicContact OD2-NH2 3.57Å; D318-R356 PolarHBondContact OD2-NH2 3.2Å
319	P	89.8	Confident	91.6	Very high	73 Å²	73	58.7 Å²	58.7	47%	0.474	32%	0.32	S	S	.	.			trans	-69.2	152.6	176.6	28.3	-32.9	0	0	0	111.2	S321 M322	P319-S321 PolarHBondContact O-N 3.2Å; P319-M322 HydrophobicContact CG-CB 4.11Å; P319-M322 VanDerWaalsContact O-CB 3.29Å; P319-M322 WeakPolarHBondContact O-CB 3.22Å; P319-M322 PolarHBondContact O-N 2.83Å
320	A	86.9	Confident	91.6	Very high	23 Å²	23	56 Å²	56	19%	0.19	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.7	179.9	0	0	0	0	0	113.8	Y280 M322	Y280-A320 HydrophobicContact CE2-CB 3.79Å; Y280-A320 PolarHBondContact OH-O 2.88Å; A320-M322 VanDerWaalsContact C-N 3.33Å
321	S	89.6	Confident	91.8	Very high	79 Å²	79	47.6 Å²	47.6	55%	0.552	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-15.5	173.8	54.5	0	0	0	0	114.4	Y280 P319	Y280-S321 WeakPolarHBondContact OH-CA 3.38Å; Y280-S321 WeakPolarHBondContact OH-CB 3.16Å; Y280-S321 PolarHBondContact OH-N 3.47Å; P319-S321 PolarHBondContact O-N 3.2Å
322	M	91.6	Very high	91.9	Very high	60 Å²	60	49 Å²	49	30%	0.296	27%	0.274	S	S	.	.	S	Bend	trans	-72.4	137.8	176.1	-162.2	169	-169.7	0	0	110.3	P293 R314 D318 P319 A320	P293-M322 WeakPolarHBondContact CG-O 3.43Å; R314-M322 PolarHBondContact NE-O 3.29Å; R314-M322 PolarHBondContact NH2-O 3.07Å; R314-M322 VanDerWaalsContact NH2-O 3.07Å; D318-M322 HydrophobicContact CB-SD 4.03Å; P319-M322 HydrophobicContact CG-CB 4.11Å; P319-M322 VanDerWaalsContact O-CB 3.29Å; P319-M322 WeakPolarHBondContact O-CB 3.22Å; P319-M322 PolarHBondContact O-N 2.83Å; A320-M322 VanDerWaalsContact C-N 3.33Å
323	A	93.5	Very high	91.7	Very high	28 Å²	28	52.7 Å²	52.7	23%	0.231	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-59.4	149.3	172.1	0	0	0	0	0	110.8	P293 P294	P293-A323 HydrophobicContact CB-CB 4.43Å; P294-A323 HydrophobicContact CB-CB 4.08Å; P294-A323 HydrophobicContact CG-CB 4.33Å; P294-A323 WeakPolarHBondContact O-CB 3.5Å
324	C	94.8	Very high	91.6	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.007	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-71.1	139.8	167.7	-56.7	0	0	0	0	108.5	P294 H295 C308 Y312 F313 R314	P294-C324 PolarHBondContact O-N 3.05Å; P294-C324 VanDerWaalsContact O-N 3.16Å; H295-C324 HydrophobicContact CB-CB 4.09Å; H295-C324 WeakPolarHBondContact O-CB 3.14Å; H295-C324 PolarHBondContact O-SG 3.15Å; C308-C324 WeakPolarHBondContact CA-SG 3.23Å; C308-C324 HydrophobicContact CB-CB 3.69Å; C308-C324 WeakPolarHBondContact CB-SG 3.15Å; C308-C324 WeakPolarHBondContact SG-CB 3.3Å; C308-C324 CovalentContact SG-SG 2.04Å; C308-C324 PolarHBondContact SG-SG 2.99Å; Y312-C324 WeakPolarHBondContact CD1-O 3.37Å; F313-C324 WeakPolarHBondContact O-CA 3.46Å; R314-C324 PolarHBondContact NH1-SG 3.21Å
325	T	95.1	Very high	91.4	Very high	6 Å²	6	54.5 Å²	54.5	4%	0.037	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-125.5	168.3	-170	49.8	0	0	0	0	110.6	Y312 F313 G354 R356	Y312-T325 CarbonylContact C-O 3.51Å; Y312-T325 WeakPolarHBondContact CA-O 3.34Å; F313-T325 PolarHBondContact N-O 2.88Å; F313-T325 PolarHBondContact O-N 3.39Å; F313-T325 PolarHBondContact O-OG1 3.46Å; T325-G354 WeakPolarHBondContact CB-O 3.34Å; T325-G354 WeakPolarHBondContact CG2-O 3.49Å; T325-R356 HydrophobicContact CG2-CG 3.62Å; T325-R356 WeakPolarHBondContact OG1-CD 3.38Å; T325-R356 PolarHBondContact OG1-NH1 2.98Å; T325-R356 VanDerWaalsContact OG1-NH1 3.17Å
326	R	94.1	Very high	91.3	Very high	94 Å²	94	55.5 Å²	55.5	36%	0.355	32%	0.319	S	S	.	.			trans	-129.1	165	-179.5	67	-180	-175.4	-173.5	4.4	111.4	Y312 D352 G354 N423 V425	Y312-R326 HydrophobicContact CD1-CB 4.21Å; Y312-R326 HydrophobicContact CE1-CB 4.23Å; Y312-R326 HydrophobicContact CE1-CG 4.19Å; R326-D352 IonicContact CZ-OD2 2.72Å; R326-D352 IonicContact NE-OD2 3.8Å; R326-D352 PolarHBondContact NE-OD2 2.91Å; R326-D352 IonicContact NH2-OD2 2.7Å; R326-D352 PolarHBondContact NH2-OD2 3.01Å; R326-G354 PolarHBondContact N-O 2.89Å; R326-G354 VanDerWaalsContact N-O 3.16Å; R326-G354 WeakPolarHBondContact O-CA 3.34Å; R326-N423 PolarHBondContact O-ND2 3.01Å; R326-V425 VanDerWaalsContact C-CG2 3.47Å
327	P	94.8	Very high	91.4	Very high	9 Å²	9	49 Å²	49	6%	0.058	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-59.3	148.8	172.3	-22.6	34.3	0	0	0	111.7	A429 M432	P327-A429 HydrophobicContact CG-CB 3.83Å; P327-M432 HydrophobicContact CG-CB 4.24Å
328	P	95.3	Very high	91.5	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.019	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-73.5	161.3	-179.1	33.8	-35.1	0	0	0	111.5	P350 D352 A421 S426	P328-P350 HydrophobicContact CB-CG 4.45Å; P328-D352 WeakPolarHBondContact CA-O 3.37Å; P328-A421 HydrophobicContact CB-CB 4.28Å; P328-A421 HydrophobicContact CG-CB 3.78Å; P328-A421 WeakPolarHBondContact CG-O 3.27Å; P328-S426 WeakPolarHBondContact CD-OG 3.31Å
329	S	94.6	Very high	91	Very high	24 Å²	24	50.6 Å²	50.6	17%	0.168	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-71.3	171	168.8	58.3	0	0	0	0	112.2	P350 E351 D352	S329-P350 VanDerWaalsContact O-CB 3.31Å; S329-P350 WeakPolarHBondContact O-CB 3.38Å; S329-P350 WeakPolarHBondContact O-CG 3.39Å; S329-P350 WeakPolarHBondContact OG-CB 3.46Å; S329-E351 PolarHBondContact OG-N 3.16Å; S329-D352 PolarHBondContact N-O 3.19Å; S329-D352 PolarHBondContact OG-N 2.73Å; S329-D352 PolarHBondContact OG-O 2.99Å
330	A	93.9	Very high	90.4	Very high	24 Å²	24	53.7 Å²	53.7	20%	0.198	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-63.1	147.8	176.2	0	0	0	0	0	112.4	Q434	A330-Q434 HydrophobicContact CB-CB 3.96Å
331	P	94.3	Very high	90.1	Very high	7 Å²	7	55.1 Å²	55.1	5%	0.045	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-57.2	151.8	169.4	-20.3	31	0	0	0	112.2	W347 F361 I419 A421 A436	P331-W347 HydrophobicContact CB-CB 4.4Å; P331-W347 HydrophobicContact CB-CG 4.24Å; P331-F361 HydrophobicContact CB-CE1 4.45Å; P331-F361 HydrophobicContact CG-CD1 3.99Å; P331-F361 HydrophobicContact CG-CE1 4.02Å; P331-I419 WeakPolarHBondContact CD-O 3.45Å; P331-I419 HydrophobicContact CG-CB 4.38Å; P331-I419 HydrophobicContact CG-CG2 3.88Å; P331-A421 HydrophobicContact CG-CB 4.17Å; P331-A436 WeakPolarHBondContact O-CB 3.48Å
332	R	92.5	Very high	89.9	Confident	113 Å²	113	52.7 Å²	52.7	43%	0.426	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	160.7	-177.7	-65.4	-173.6	-64.5	-179.6	5.7	111.5	V334 S348 W349	R332-V334 PolarHBondContact O-N 3.32Å; R332-S348 VanDerWaalsContact CB-OG 3.25Å; R332-S348 WeakPolarHBondContact CB-OG 3.43Å; R332-S348 PolarHBondContact N-O 3.46Å; R332-S348 WeakPolarHBondContact O-CA 3.32Å; R332-S348 PolarHBondContact O-N 3.38Å; R332-S348 PolarHBondContact O-OG 3.46Å; R332-W349 PolarHBondContact NE-O 3.28Å
333	N	90	Very high	89.9	Confident	120 Å²	120	49.8 Å²	49.8	64%	0.642	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.5	55.7	171.1	-54.8	-37	0	0	0	113.7	I335 S348	N333-I335 PolarHBondContact O-N 2.91Å; N333-S348 PolarHBondContact ND2-OG 3.05Å
334	V	90.4	Very high	89.8	Confident	34 Å²	34	52 Å²	52	21%	0.206	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	115.7	175.4	-174.8	0	0	0	0	109	R332 D346 W347 I419 A436 V438	R332-V334 PolarHBondContact O-N 3.32Å; V334-D346 CarbonylContact C-O 3.6Å; V334-D346 WeakPolarHBondContact CA-O 3.21Å; V334-W347 HydrophobicContact CG2-CB 4.1Å; V334-I419 HydrophobicContact CG1-CD1 3.72Å; V334-I419 HydrophobicContact CG2-CD1 4.22Å; V334-A436 HydrophobicContact CG2-CB 3.59Å; V334-V438 HydrophobicContact CG1-CB 3.95Å; V334-V438 HydrophobicContact CG1-CG1 3.69Å
335	I	89	Confident	89.7	Confident	108 Å²	108	52 Å²	52	55%	0.554	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	136	178.9	-58.7	169.4	0	0	0	108.3	N333 L345 D346	N333-I335 PolarHBondContact O-N 2.91Å; I335-L345 WeakPolarHBondContact O-CA 3.44Å; I335-D346 PolarHBondContact N-O 3.46Å; I335-D346 PolarHBondContact O-N 3.24Å
336	S	88.6	Confident	89.7	Confident	41 Å²	41	54.9 Å²	54.9	29%	0.287	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	126.6	177.6	60.2	0	0	0	0	111	I344 I440	S336-I344 WeakPolarHBondContact CA-O 3.31Å; S336-I440 VanDerWaalsContact OG-CG2 3.23Å; S336-I440 WeakPolarHBondContact OG-CG2 3.34Å
337	S	86.7	Confident	89.7	Confident	70 Å²	70	50.8 Å²	50.8	49%	0.49	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.1	172.1	178.9	0	0	0	0	110.1	V343 I344	S337-V343 CarbonylContact O-C 3.58Å; S337-V343 WeakPolarHBondContact O-CA 3.15Å; S337-I344 PolarHBondContact N-O 3.22Å; S337-I344 PolarHBondContact O-N 3.26Å
338	I	85.8	Confident	89.7	Confident	51 Å²	51	51.9 Å²	51.9	26%	0.262	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.6	-173.6	-50.9	179.6	0	0	0	109.1	V343 I440 T441	I338-V343 HydrophobicContact CG1-CG2 4.38Å; I338-V343 HydrophobicContact CG2-CG2 4.41Å; I338-I440 HydrophobicContact CD1-CB 4.05Å; I338-I440 HydrophobicContact CD1-CD1 4.3Å; I338-I440 HydrophobicContact CG1-CD1 4.35Å; I338-T441 WeakPolarHBondContact CD1-O 3.5Å
339	N	79.3	Confident	89.6	Confident	95 Å²	95	57.3 Å²	57.3	51%	0.508	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	99.8	175.1	-174.9	17.7	0	0	0	109.3	T341 S342	N339-T341 PolarHBondContact O-N 2.65Å; N339-S342 CarbonylContact C-O 3.59Å; N339-S342 PolarHBondContact N-O 3.11Å; N339-S342 WeakPolarHBondContact O-CA 3.36Å; N339-S342 PolarHBondContact O-N 3.2Å; N339-S342 VanDerWaalsContact O-O 3.12Å; N339-S342 PolarHBondContact O-OG 3.47Å
340	E	77	Confident	89.5	Confident	138 Å²	138	56.4 Å²	56.4	65%	0.645	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	-104.5	-174.6	-58.7	179.3	-177.8	0	0	113.1	N443	E340-N443 PolarHBondContact O-N 2.97Å
341	T	80.6	Confident	89.5	Confident	52 Å²	52	62.6 Å²	62.6	32%	0.319	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	7.5	178.8	55.2	0	0	0	0	113.2	N339 L409	N339-T341 PolarHBondContact O-N 2.65Å; T341-L409 VanDerWaalsContact CB-O 3.32Å; T341-L409 WeakPolarHBondContact CB-O 3.39Å; T341-L409 VanDerWaalsContact O-CB 3.25Å; T341-L409 WeakPolarHBondContact O-CB 3.44Å; T341-L409 PolarHBondContact O-N 2.96Å
342	S	86.7	Confident	89.4	Confident	28 Å²	28	64.7 Å²	64.7	20%	0.196	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	149.5	178.9	69.6	0	0	0	0	111.6	N339 V406	N339-S342 CarbonylContact C-O 3.59Å; N339-S342 PolarHBondContact N-O 3.11Å; N339-S342 WeakPolarHBondContact O-CA 3.36Å; N339-S342 PolarHBondContact O-N 3.2Å; N339-S342 VanDerWaalsContact O-O 3.12Å; N339-S342 PolarHBondContact O-OG 3.47Å; S342-V406 CarbonylContact C-O 3.55Å; S342-V406 VanDerWaalsContact CA-O 3.29Å; S342-V406 WeakPolarHBondContact CA-O 3.41Å
343	V	90.5	Very high	89.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127.1	-176.4	173.1	0	0	0	0	108.6	S337 I338 L345 T405 V406 L409 I440	S337-V343 CarbonylContact O-C 3.58Å; S337-V343 WeakPolarHBondContact O-CA 3.15Å; I338-V343 HydrophobicContact CG1-CG2 4.38Å; I338-V343 HydrophobicContact CG2-CG2 4.41Å; V343-L345 HydrophobicContact CG1-CD2 3.85Å; V343-L345 HydrophobicContact CG1-CG 4.08Å; V343-T405 CarbonylContact O-C 3.55Å; V343-T405 WeakPolarHBondContact O-CA 3.35Å; V343-V406 PolarHBondContact N-O 3.45Å; V343-V406 PolarHBondContact O-N 3.07Å; V343-L409 HydrophobicContact CB-CD1 3.97Å; V343-L409 HydrophobicContact CG2-CD1 3.4Å; V343-I440 HydrophobicContact CB-CD1 3.89Å; V343-I440 HydrophobicContact CG1-CD1 3.48Å; V343-I440 VanDerWaalsContact CG1-CD1 3.48Å; V343-I440 HydrophobicContact CG2-CD1 3.15Å
344	I	91.8	Very high	89.4	Confident	74 Å²	74	56 Å²	56	38%	0.379	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	117.9	171.8	-57	172.4	0	0	0	106.8	S336 S337 T405	S336-I344 WeakPolarHBondContact CA-O 3.31Å; S337-I344 PolarHBondContact N-O 3.22Å; S337-I344 PolarHBondContact O-N 3.26Å; I344-T405 HydrophobicContact CG1-CG2 4.18Å
345	L	93.6	Very high	89.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.4	172.5	-61.5	172.7	0	0	0	108.3	I335 V343 W347 V363 T403 V404 V406 F417 V438	I335-L345 WeakPolarHBondContact O-CA 3.44Å; V343-L345 HydrophobicContact CG1-CD2 3.85Å; V343-L345 HydrophobicContact CG1-CG 4.08Å; L345-W347 HydrophobicContact CB-CE3 4.31Å; L345-W347 HydrophobicContact CB-CZ3 4.01Å; L345-V363 HydrophobicContact CD1-CG1 4.18Å; L345-T403 CarbonylContact O-C 3.51Å; L345-T403 VanDerWaalsContact O-CA 3.25Å; L345-T403 WeakPolarHBondContact O-CA 3.5Å; L345-V404 HydrophobicContact CB-CG1 4.07Å; L345-V404 HydrophobicContact CD1-CG1 4.11Å; L345-V404 PolarHBondContact N-O 2.9Å; L345-V404 PolarHBondContact O-N 3.01Å; L345-V406 HydrophobicContact CD1-CG2 4.27Å; L345-F417 HydrophobicContact CD1-CB 3.68Å; L345-F417 HydrophobicContact CD1-CD1 3.76Å; L345-F417 HydrophobicContact CD1-CD2 4.14Å; L345-F417 HydrophobicContact CD1-CE1 4.43Å; L345-F417 HydrophobicContact CD1-CG 3.58Å; L345-F417 HydrophobicContact CD2-CD2 4.38Å; L345-V438 HydrophobicContact CD2-CG1 3.85Å
346	D	93.8	Very high	89.5	Confident	68 Å²	68	53 Å²	53	36%	0.364	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.8	172.8	-169.6	9.5	0	0	0	108.7	V334 I335 T402 T403	V334-D346 CarbonylContact C-O 3.6Å; V334-D346 WeakPolarHBondContact CA-O 3.21Å; I335-D346 PolarHBondContact N-O 3.46Å; I335-D346 PolarHBondContact O-N 3.24Å; D346-T402 WeakPolarHBondContact CA-O 3.31Å; D346-T403 HydrophobicContact CB-CG2 4.19Å; D346-T403 WeakPolarHBondContact OD1-CG2 3.4Å
347	W	94.8	Very high	89.6	Confident	8 Å²	8	62.8 Å²	62.8	3%	0.03	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	169.3	177.1	58.7	89.1	0	0	0	111	P331 V334 L345 F361 V363 L399 T402 V404 I419	P331-W347 HydrophobicContact CB-CB 4.4Å; P331-W347 HydrophobicContact CB-CG 4.24Å; V334-W347 HydrophobicContact CG2-CB 4.1Å; L345-W347 HydrophobicContact CB-CE3 4.31Å; L345-W347 HydrophobicContact CB-CZ3 4.01Å; W347-F361 AromaticContact CE2-CG 4Å; W347-F361 HydrophobicContact CZ2-CB 3.77Å; W347-F361 HydrophobicContact CZ2-CD2 4.25Å; W347-F361 AromaticContact CZ2-CG 3.99Å; W347-F361 HydrophobicContact CZ2-CG 3.99Å; W347-F361 AromaticContact NE1-CD1 3.42Å; W347-F361 AromaticContact NE1-CD2 3.66Å; W347-F361 AromaticContact NE1-CE1 3.6Å; W347-F361 AromaticContact NE1-CE2 3.84Å; W347-F361 AromaticContact NE1-CG 3.45Å; W347-F361 AromaticContact NE1-CZ 3.82Å; W347-V363 HydrophobicContact CH2-CG2 3.87Å; W347-V363 HydrophobicContact CZ3-CG2 4.3Å; W347-L399 HydrophobicContact CH2-CD1 4.16Å; W347-L399 HydrophobicContact CZ2-CD1 4.47Å; W347-T402 VanDerWaalsContact CE3-O 3.27Å; W347-T402 PolarHBondContact N-O 2.68Å; W347-T402 WeakPolarHBondContact O-CB 3.44Å; W347-T402 PolarHBondContact O-OG1 2.74Å; W347-V404 HydrophobicContact CH2-CB 4.17Å; W347-V404 HydrophobicContact CH2-CG1 4.05Å; W347-V404 HydrophobicContact CZ3-CB 4.39Å; W347-V404 HydrophobicContact CZ3-CG1 3.92Å; W347-I419 HydrophobicContact CD2-CG2 3.9Å; W347-I419 HydrophobicContact CE3-CG1 4.15Å; W347-I419 HydrophobicContact CE3-CG2 4.25Å; W347-I419 HydrophobicContact CG-CG2 4.38Å; W347-I419 HydrophobicContact CH2-CG2 4.38Å; W347-I419 HydrophobicContact CZ2-CG2 4.04Å; W347-I419 HydrophobicContact CZ3-CG1 4.33Å; W347-I419 HydrophobicContact CZ3-CG2 4.47Å
348	S	93.6	Very high	89.8	Confident	32 Å²	32	62.6 Å²	62.6	22%	0.224	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	158.9	173.3	62.8	0	0	0	0	111	R332 N333	R332-S348 VanDerWaalsContact CB-OG 3.25Å; R332-S348 WeakPolarHBondContact CB-OG 3.43Å; R332-S348 PolarHBondContact N-O 3.46Å; R332-S348 WeakPolarHBondContact O-CA 3.32Å; R332-S348 PolarHBondContact O-N 3.38Å; R332-S348 PolarHBondContact O-OG 3.46Å; N333-S348 PolarHBondContact ND2-OG 3.05Å
349	W	93.4	Very high	90.2	Very high	116 Å²	116	60.3 Å²	60.3	44%	0.439	31%	0.308	S	S	.	.			trans	-58.6	148.8	-178.4	-71.5	79.8	0	0	0	112.1	R332 I359 F361 T402	R332-W349 PolarHBondContact NE-O 3.28Å; W349-I359 HydrophobicContact CE3-CD1 4.01Å; W349-I359 HydrophobicContact CZ3-CB 3.91Å; W349-I359 HydrophobicContact CZ3-CD1 3.89Å; W349-I359 HydrophobicContact CZ3-CG1 4.42Å; W349-I359 HydrophobicContact CZ3-CG2 4.39Å; W349-F361 HydrophobicContact CD2-CZ 4.23Å; W349-F361 HydrophobicContact CE3-CZ 4.04Å; W349-F361 HydrophobicContact CH2-CE2 4.34Å; W349-F361 HydrophobicContact CZ2-CE2 4.45Å; W349-F361 HydrophobicContact CZ3-CE2 4.4Å; W349-F361 HydrophobicContact CZ3-CZ 4.29Å; W349-T402 HydrophobicContact CG-CG2 4.48Å
350	P	94.3	Very high	91	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.039	29%	0.292	C	S	.	.			trans	-51.9	150	172.6	-26.6	35.8	0	0	0	112.2	P328 S329 F361 A421	P328-P350 HydrophobicContact CB-CG 4.45Å; S329-P350 VanDerWaalsContact O-CB 3.31Å; S329-P350 WeakPolarHBondContact O-CB 3.38Å; S329-P350 WeakPolarHBondContact O-CG 3.39Å; S329-P350 WeakPolarHBondContact OG-CB 3.46Å; P350-F361 HydrophobicContact CG-CE1 4.25Å; P350-A421 HydrophobicContact CG-CB 3.63Å
351	E	92.5	Very high	91.8	Very high	153 Å²	153	50.7 Å²	50.7	72%	0.715	26%	0.262	S	S	*	.	S	Bend	trans	-66.8	-44.9	175.6	-178.2	166.7	-151.6	0	0	111.6	S329	S329-E351 PolarHBondContact OG-N 3.16Å
352	D	92.9	Very high	92.5	Very high	51 Å²	51	49.1 Å²	49.1	27%	0.273	25%	0.251	S	S	.	.			trans	-112.4	122.6	170.7	-177.7	15.3	0	0	0	110.2	R326 P328 S329 G354	R326-D352 IonicContact CZ-OD2 2.72Å; R326-D352 IonicContact NE-OD2 3.8Å; R326-D352 PolarHBondContact NE-OD2 2.91Å; R326-D352 IonicContact NH2-OD2 2.7Å; R326-D352 PolarHBondContact NH2-OD2 3.01Å; P328-D352 WeakPolarHBondContact CA-O 3.37Å; S329-D352 PolarHBondContact N-O 3.19Å; S329-D352 PolarHBondContact OG-N 2.73Å; S329-D352 PolarHBondContact OG-O 2.99Å; D352-G354 VanDerWaalsContact C-N 3.28Å; D352-G354 WeakPolarHBondContact OD1-CA 3.44Å; D352-G354 PolarHBondContact OD1-N 3.17Å
353	T	92.4	Very high	92.8	Very high	46 Å²	46	48.1 Å²	48.1	28%	0.282	24%	0.244	S	C	.	.			trans	-84.8	-4.9	175.7	66.1	0	0	0	0	113.1	G355 R356 I359 N423	T353-G355 PolarHBondContact O-N 3.19Å; T353-G355 PolarHBondContact OG1-N 2.76Å; T353-R356 WeakPolarHBondContact CB-O 3.48Å; T353-R356 PolarHBondContact OG1-O 2.92Å; T353-I359 HydrophobicContact CG2-CD1 3.33Å; T353-N423 PolarHBondContact O-ND2 3.5Å
354	G	89.6	Confident	92.9	Very high	5 Å²	5	52.1 Å²	52.1	5%	0.052	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	17.8	-172.7	0	0	0	0	0	113.4	T325 R326 D352	T325-G354 WeakPolarHBondContact CB-O 3.34Å; T325-G354 WeakPolarHBondContact CG2-O 3.49Å; R326-G354 PolarHBondContact N-O 2.89Å; R326-G354 VanDerWaalsContact N-O 3.16Å; R326-G354 WeakPolarHBondContact O-CA 3.34Å; D352-G354 VanDerWaalsContact C-N 3.28Å; D352-G354 WeakPolarHBondContact OD1-CA 3.44Å; D352-G354 PolarHBondContact OD1-N 3.17Å
355	G	90.1	Very high	93	Very high	61 Å²	61	49.2 Å²	49.2	63%	0.629	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	8	177.7	0	0	0	0	0	115.1	T353	T353-G355 PolarHBondContact O-N 3.19Å; T353-G355 PolarHBondContact OG1-N 2.76Å
356	R	91.7	Very high	92.8	Very high	18 Å²	18	52.2 Å²	52.2	7%	0.068	26%	0.264	C	S	.	.			trans	-114.5	165.4	177	-52.3	-178.5	77.8	99.7	0.4	112.4	D318 T325 T353 D358 N423	D318-R356 IonicContact OD1-CZ 3.06Å; D318-R356 IonicContact OD1-NH1 2.67Å; D318-R356 IonicContact OD1-NH2 2.91Å; D318-R356 PolarHBondContact OD1-NH2 2.79Å; D318-R356 IonicContact OD2-CZ 2.71Å; D318-R356 IonicContact OD2-NH1 2.9Å; D318-R356 PolarHBondContact OD2-NH1 3.46Å; D318-R356 IonicContact OD2-NH2 3.57Å; D318-R356 PolarHBondContact OD2-NH2 3.2Å; T325-R356 HydrophobicContact CG2-CG 3.62Å; T325-R356 WeakPolarHBondContact OG1-CD 3.38Å; T325-R356 PolarHBondContact OG1-NH1 2.98Å; T325-R356 VanDerWaalsContact OG1-NH1 3.17Å; T353-R356 WeakPolarHBondContact CB-O 3.48Å; T353-R356 PolarHBondContact OG1-O 2.92Å; R356-D358 WeakPolarHBondContact CB-OD1 3.28Å; R356-D358 WeakPolarHBondContact CD-OD1 3.31Å; R356-D358 IonicContact CZ-OD2 3.33Å; R356-D358 IonicContact NE-OD1 3.85Å; R356-D358 PolarHBondContact NE-OD1 3.18Å; R356-D358 VanDerWaalsContact NE-OD1 3.13Å; R356-D358 IonicContact NE-OD2 3.1Å; R356-D358 PolarHBondContact NE-OD2 2.98Å; R356-D358 IonicContact NH2-OD2 2.71Å; R356-D358 PolarHBondContact NH2-OD2 2.68Å; R356-N423 HydrophobicContact CB-CB 4.48Å
357	R	89.6	Confident	92.6	Very high	247 Å²	247	50.2 Å²	50.2	93%	0.932	25%	0.251	S	S	*	.	S	Bend	trans	-115	-8.3	177.7	-61.3	-177.7	-177.2	-175.9	0.3	113.2	I359	R357-I359 PolarHBondContact O-N 2.77Å
358	D	92.7	Very high	92	Very high	65 Å²	65	50 Å²	50	35%	0.348	25%	0.251	S	S	.	.			trans	-80.3	37.7	177.9	62	-15.7	0	0	0	111.8	R356 G424	R356-D358 WeakPolarHBondContact CB-OD1 3.28Å; R356-D358 WeakPolarHBondContact CD-OD1 3.31Å; R356-D358 IonicContact CZ-OD2 3.33Å; R356-D358 IonicContact NE-OD1 3.85Å; R356-D358 PolarHBondContact NE-OD1 3.18Å; R356-D358 VanDerWaalsContact NE-OD1 3.13Å; R356-D358 IonicContact NE-OD2 3.1Å; R356-D358 PolarHBondContact NE-OD2 2.98Å; R356-D358 IonicContact NH2-OD2 2.71Å; R356-D358 PolarHBondContact NH2-OD2 2.68Å; D358-G424 WeakPolarHBondContact OD2-CA 3.26Å; D358-G424 PolarHBondContact OD2-N 3.49Å; D358-G424 VanDerWaalsContact OD2-N 3.14Å
359	I	93.9	Very high	91.1	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.021	27%	0.272	C	S	.	.			trans	-77.5	136.7	-178.7	-52.2	168.2	0	0	0	109.1	W349 T353 R357 F361 A421 Q422	W349-I359 HydrophobicContact CE3-CD1 4.01Å; W349-I359 HydrophobicContact CZ3-CB 3.91Å; W349-I359 HydrophobicContact CZ3-CD1 3.89Å; W349-I359 HydrophobicContact CZ3-CG1 4.42Å; W349-I359 HydrophobicContact CZ3-CG2 4.39Å; T353-I359 HydrophobicContact CG2-CD1 3.33Å; R357-I359 PolarHBondContact O-N 2.77Å; I359-F361 HydrophobicContact CG2-CE1 4.29Å; I359-F361 HydrophobicContact CG2-CZ 4.18Å; I359-A421 HydrophobicContact CG2-CB 4.17Å; I359-Q422 CarbonylContact C-O 3.52Å; I359-Q422 VanDerWaalsContact CA-O 3.25Å; I359-Q422 WeakPolarHBondContact CA-O 3.23Å
360	T	95	Very high	89.6	Confident	30 Å²	30	54.1 Å²	54.1	18%	0.184	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.9	172.8	56.9	0	0	0	0	109.7	L399 Q422	T360-L399 CarbonylContact C-O 3.54Å; T360-L399 VanDerWaalsContact CA-O 3.27Å; T360-L399 WeakPolarHBondContact CA-O 3.37Å; T360-Q422 PolarHBondContact N-O 2.89Å; T360-Q422 PolarHBondContact O-N 3.02Å; T360-Q422 PolarHBondContact OG1-O 3.37Å
361	F	95.1	Very high	87.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.5	-179.7	-55.2	-80.2	0	0	0	111.1	P331 W347 W349 P350 I359 G398 L399 T402 I419 E420 A421	P331-F361 HydrophobicContact CB-CE1 4.45Å; P331-F361 HydrophobicContact CG-CD1 3.99Å; P331-F361 HydrophobicContact CG-CE1 4.02Å; W347-F361 AromaticContact CE2-CG 4Å; W347-F361 HydrophobicContact CZ2-CB 3.77Å; W347-F361 HydrophobicContact CZ2-CD2 4.25Å; W347-F361 AromaticContact CZ2-CG 3.99Å; W347-F361 HydrophobicContact CZ2-CG 3.99Å; W347-F361 AromaticContact NE1-CD1 3.42Å; W347-F361 AromaticContact NE1-CD2 3.66Å; W347-F361 AromaticContact NE1-CE1 3.6Å; W347-F361 AromaticContact NE1-CE2 3.84Å; W347-F361 AromaticContact NE1-CG 3.45Å; W347-F361 AromaticContact NE1-CZ 3.82Å; W349-F361 HydrophobicContact CD2-CZ 4.23Å; W349-F361 HydrophobicContact CE3-CZ 4.04Å; W349-F361 HydrophobicContact CH2-CE2 4.34Å; W349-F361 HydrophobicContact CZ2-CE2 4.45Å; W349-F361 HydrophobicContact CZ3-CE2 4.4Å; W349-F361 HydrophobicContact CZ3-CZ 4.29Å; P350-F361 HydrophobicContact CG-CE1 4.25Å; I359-F361 HydrophobicContact CG2-CE1 4.29Å; I359-F361 HydrophobicContact CG2-CZ 4.18Å; F361-G398 PolarHBondContact O-N 3.39Å; F361-L399 HydrophobicContact CB-CB 4.13Å; F361-L399 WeakPolarHBondContact CD2-O 2.89Å; F361-L399 PolarHBondContact N-O 2.03Å; F361-L399 WeakPolarHBondContact O-CB 3.3Å; F361-L399 PolarHBondContact O-N 3.18Å; F361-T402 HydrophobicContact CE2-CG2 4.04Å; F361-T402 HydrophobicContact CZ-CG2 4.33Å; F361-I419 HydrophobicContact CB-CG2 4.44Å; F361-I419 HydrophobicContact CD1-CG2 4.5Å; F361-E420 CarbonylContact C-O 3.55Å; F361-E420 VanDerWaalsContact CA-O 3.28Å; F361-E420 WeakPolarHBondContact CA-O 3.49Å; F361-A421 HydrophobicContact CD1-CB 3.96Å; F361-A421 HydrophobicContact CE1-CB 3.86Å
362	N	94.5	Very high	84.8	Confident	20 Å²	20	55.6 Å²	55.6	11%	0.107	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.1	173.6	-66.2	-24.1	0	0	0	109.1	T397 G398 I419 E420 Q422	N362-T397 HydrophobicContact CB-CG2 4.23Å; N362-T397 WeakPolarHBondContact OD1-CA 3.47Å; N362-T397 VanDerWaalsContact OD1-CB 3.26Å; N362-T397 WeakPolarHBondContact OD1-CB 3.42Å; N362-G398 PolarHBondContact OD1-N 3.39Å; N362-I419 WeakPolarHBondContact O-CA 3.26Å; N362-E420 PolarHBondContact N-O 2.81Å; N362-E420 PolarHBondContact O-N 2.7Å; N362-Q422 PolarHBondContact ND2-NE2 3.12Å; N362-Q422 PolarHBondContact ND2-OE1 3.35Å
363	V	94.1	Very high	82.3	Confident	6 Å²	6	57.7 Å²	57.7	4%	0.036	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.5	-178.9	-175.7	0	0	0	0	109.4	L345 W347 F392 A396 L399 V404 F417 E418 I419	L345-V363 HydrophobicContact CD1-CG1 4.18Å; W347-V363 HydrophobicContact CH2-CG2 3.87Å; W347-V363 HydrophobicContact CZ3-CG2 4.3Å; V363-F392 HydrophobicContact CB-CE1 4.35Å; V363-F392 HydrophobicContact CG1-CE1 4.02Å; V363-A396 PolarHBondContact N-O 3.36Å; V363-L399 HydrophobicContact CG2-CD1 3.92Å; V363-V404 HydrophobicContact CG1-CG1 4.5Å; V363-V404 HydrophobicContact CG2-CG1 4.11Å; V363-F417 HydrophobicContact CG1-CD1 4.16Å; V363-E418 CarbonylContact C-O 3.54Å; V363-E418 WeakPolarHBondContact CA-O 3.5Å; V363-I419 HydrophobicContact CG1-CG1 4.43Å; V363-I419 HydrophobicContact CG2-CG1 4.14Å; V363-I419 HydrophobicContact CG2-CG2 4.26Å
364	L	92.6	Very high	80	Confident	85 Å²	85	62.7 Å²	62.7	45%	0.445	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.9	173	-67.8	100.5	0	0	0	110.2	F417 E418	L364-F417 CarbonylContact O-C 3.56Å; L364-F417 WeakPolarHBondContact O-CA 3.28Å; L364-E418 HydrophobicContact CB-CB 4.32Å; L364-E418 PolarHBondContact N-O 2.91Å; L364-E418 PolarHBondContact O-N 3.07Å
365	C	92.2	Very high	77.5	Confident	13 Å²	13	69.1 Å²	69.1	9%	0.088	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.3	175.9	178.8	0	0	0	0	110.2	C386 F392 F417	C365-C386 HydrophobicContact CB-CB 3.61Å; C365-C386 WeakPolarHBondContact CB-SG 3.04Å; C365-C386 PolarHBondContact O-N 3.16Å; C365-C386 PolarHBondContact O-SG 3.01Å; C365-C386 WeakPolarHBondContact SG-CB 3.31Å; C365-C386 CovalentContact SG-SG 2.03Å; C365-C386 PolarHBondContact SG-SG 3.09Å; C365-F392 HydrophobicContact CB-CZ 3.76Å; C365-F417 HydrophobicContact CB-CD1 3.9Å; C365-F417 HydrophobicContact CB-CE1 3.63Å; C365-F417 WeakPolarHBondContact SG-CE1 3.33Å
366	K	90.6	Very high	75.3	Confident	63 Å²	63	71.3 Å²	71.3	27%	0.274	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136	173.1	-59.2	180	-177.1	169	0	110	C383 E384 C386 Y415 T416 E418	K366-C383 HydrophobicContact CB-CB 4.04Å; K366-C383 HydrophobicContact CD-CB 4.43Å; K366-E384 CarbonylContact C-O 3.58Å; K366-E384 VanDerWaalsContact CA-O 3.31Å; K366-E384 WeakPolarHBondContact CA-O 3.21Å; K366-C386 VanDerWaalsContact C-SG 3.59Å; K366-C386 PolarHBondContact N-SG 3.47Å; K366-C386 VanDerWaalsContact N-SG 3.39Å; K366-Y415 CarbonylContact O-C 3.59Å; K366-Y415 WeakPolarHBondContact O-CA 3.4Å; K366-T416 PolarHBondContact N-O 3.03Å; K366-T416 PolarHBondContact O-N 2.56Å; K366-E418 VanDerWaalsContact CE-OE2 3.23Å; K366-E418 WeakPolarHBondContact CE-OE2 3.07Å; K366-E418 IonicContact NZ-OE1 3.03Å; K366-E418 PolarHBondContact NZ-OE1 3.17Å; K366-E418 IonicContact NZ-OE2 3.49Å; K366-E418 PolarHBondContact NZ-OE2 3.46Å
367	R	88.5	Confident	72.9	Confident	25 Å²	25	76.5 Å²	76.5	9%	0.094	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.4	171.9	-178.3	175.3	69.8	174.5	0.7	108.9	C383 E384 L410 T413 Y415	R367-C383 CarbonylContact O-C 3.56Å; R367-C383 VanDerWaalsContact O-CA 3.25Å; R367-C383 WeakPolarHBondContact O-CA 3.49Å; R367-E384 HydrophobicContact CB-CG 4.23Å; R367-E384 IonicContact CZ-OE1 3.73Å; R367-E384 PolarHBondContact N-O 2.75Å; R367-E384 IonicContact NE-OE1 3.71Å; R367-E384 PolarHBondContact NE-OE1 3.17Å; R367-E384 IonicContact NH2-OE1 3.97Å; R367-E384 PolarHBondContact NH2-OE1 3.3Å; R367-E384 IonicContact NH2-OE2 3.42Å; R367-E384 PolarHBondContact O-N 3.15Å; R367-L410 VanDerWaalsContact NH1-CD1 3.34Å; R367-T413 HydrophobicContact CG-CG2 3.87Å; R367-Y415 HydrophobicContact CB-CD1 4.11Å; R367-Y415 HydrophobicContact CB-CE1 3.91Å; R367-Y415 HydrophobicContact CG-CD1 4.49Å; R367-Y415 HydrophobicContact CG-CE1 4.14Å
368	C	82.8	Confident	70.9	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.02	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134.9	-179.2	-49.5	0	0	0	0	109.9	L381 C383 N414 T416	C368-L381 HydrophobicContact CB-CB 4.35Å; C368-L381 HydrophobicContact CB-CD2 3.52Å; C368-L381 HydrophobicContact CB-CG 4.46Å; C368-C383 HydrophobicContact CB-CB 4.1Å; C368-C383 WeakPolarHBondContact CB-SG 3.25Å; C368-C383 WeakPolarHBondContact SG-CB 3.41Å; C368-C383 CovalentContact SG-SG 2.04Å; C368-C383 PolarHBondContact SG-SG 3.34Å; C368-N414 PolarHBondContact N-O 3.05Å; C368-N414 WeakPolarHBondContact O-CB 3.34Å; C368-T416 PolarHBondContact SG-OG1 3.09Å
369	R	75.4	Confident	68.4	Low	178 Å²	178	70.9 Å²	70.9	67%	0.672	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-92.6	131.2	173.1	-69.5	-177.2	179.4	-179	-0.7	109.5	A371	R369-A371 PolarHBondContact O-N 3Å
370	G	60.9	Low	66.3	Low	57 Å²	57	76.3 Å²	76.3	59%	0.588	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-64	125.1	172.9	0	0	0	0	0	110	A372	G370-A372 PolarHBondContact O-N 3.16Å
371	A	45.9	Very low	64.5	Low	99 Å²	99	79.7 Å²	79.7	82%	0.818	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-62.2	123.2	166.9	0	0	0	0	0	107.8	R369 A373	R369-A371 PolarHBondContact O-N 3Å; A371-A373 PolarHBondContact O-N 3.27Å
372	A	40.5	Very low	63.2	Low	92 Å²	92	86.5 Å²	86.5	76%	0.76	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-52.5	133.5	167.6	0	0	0	0	0	108.4	G370 N374	G370-A372 PolarHBondContact O-N 3.16Å; A372-N374 VanDerWaalsContact C-N 3.33Å; A372-N374 PolarHBondContact O-N 2.84Å
373	A	40.1	Very low	62.4	Low	94 Å²	94	87.9 Å²	87.9	78%	0.777	56%	0.558	S	S	*	*	S	Bend	trans	-59.1	96.7	175.3	0	0	0	0	0	109.1	A371	A371-A373 PolarHBondContact O-N 3.27Å
374	N	43.2	Very low	62.1	Low	152 Å²	152	91.4 Å²	91.4	81%	0.813	57%	0.573	S	S	*	*			trans	160.3	80.6	152	-80.2	-14.6	0	0	0	108.8	A372	A372-N374 VanDerWaalsContact C-N 3.33Å; A372-N374 PolarHBondContact O-N 2.84Å
375	V	39	Very low	61.8	Low	139 Å²	139	92.4 Å²	92.4	84%	0.842	59%	0.585	S	S	*	*			trans	-167	118.2	139	172.8	0	0	0	0	106.9
376	S	42.9	Very low	61.5	Low	108 Å²	108	93.1 Å²	93.1	76%	0.755	59%	0.59	S	S	*	*			trans	-71.5	116.7	167.3	48.8	0	0	0	0	110.7
377	T	40.7	Very low	60.9	Low	127 Å²	127	98.1 Å²	98.1	78%	0.779	61%	0.607	S	S	*	*	S	Bend	trans	159.9	118.7	137.5	42.3	0	0	0	0	109.3	G379	T377-G379 PolarHBondContact O-N 2.87Å
378	S	49.3	Very low	60	Low	120 Å²	120	102.6 Å²	102.6	84%	0.839	64%	0.642	S	S	*	*			trans	46.9	59.8	166.4	-175.9	0	0	0	0	116.2	T380	S378-T380 PolarHBondContact O-N 3.47Å
379	G	39.2	Very low	59.7	Low	73 Å²	73	108.3 Å²	108.3	75%	0.753	67%	0.672	S	S	*	*			trans	-77.4	86	179.2	0	0	0	0	0	113.3	T377 L381	T377-G379 PolarHBondContact O-N 2.87Å; G379-L381 PolarHBondContact O-N 3.39Å; G379-L381 VanDerWaalsContact O-N 3.16Å
380	T	49.1	Very low	60.3	Low	119 Å²	119	100.7 Å²	100.7	73%	0.73	65%	0.645	S	S	*	*			trans	-57.7	114.7	156.5	35.3	0	0	0	0	107.9	S378 N382	S378-T380 PolarHBondContact O-N 3.47Å; T380-N382 PolarHBondContact O-N 3.32Å
381	L	57.1	Low	61.6	Low	100 Å²	100	105.1 Å²	105.1	52%	0.524	64%	0.644	S	S	.	*			trans	-53.5	114.6	167.9	-93.9	84	0	0	0	107	C368 G379 C383	C368-L381 HydrophobicContact CB-CB 4.35Å; C368-L381 HydrophobicContact CB-CD2 3.52Å; C368-L381 HydrophobicContact CB-CG 4.46Å; G379-L381 PolarHBondContact O-N 3.39Å; G379-L381 VanDerWaalsContact O-N 3.16Å; L381-C383 VanDerWaalsContact C-N 3.3Å; L381-C383 PolarHBondContact O-N 3.08Å; L381-C383 PolarHBondContact O-SG 3.46Å
382	N	69.3	Low	63.8	Low	144 Å²	144	102.3 Å²	102.3	77%	0.77	61%	0.614	S	S	*	*			trans	-69.5	94.9	173.3	-112.3	-0.9	0	0	0	107.5	T380	T380-N382 PolarHBondContact O-N 3.32Å
383	C	78.1	Confident	66.2	Low	49 Å²	49	101.7 Å²	101.7	33%	0.331	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.6	120.3	179.6	-59.7	0	0	0	0	109.5	K366 R367 C368 L381	K366-C383 HydrophobicContact CB-CB 4.04Å; K366-C383 HydrophobicContact CD-CB 4.43Å; R367-C383 CarbonylContact O-C 3.56Å; R367-C383 VanDerWaalsContact O-CA 3.25Å; R367-C383 WeakPolarHBondContact O-CA 3.49Å; C368-C383 HydrophobicContact CB-CB 4.1Å; C368-C383 WeakPolarHBondContact CB-SG 3.25Å; C368-C383 WeakPolarHBondContact SG-CB 3.41Å; C368-C383 CovalentContact SG-SG 2.04Å; C368-C383 PolarHBondContact SG-SG 3.34Å; L381-C383 VanDerWaalsContact C-N 3.3Å; L381-C383 PolarHBondContact O-N 3.08Å; L381-C383 PolarHBondContact O-SG 3.46Å
384	E	86.3	Confident	68.5	Low	79 Å²	79	101.7 Å²	101.7	37%	0.369	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.4	150.7	174.5	67.5	-167.4	148	0	0	109.9	K366 R367 C386	K366-E384 CarbonylContact C-O 3.58Å; K366-E384 VanDerWaalsContact CA-O 3.31Å; K366-E384 WeakPolarHBondContact CA-O 3.21Å; R367-E384 HydrophobicContact CB-CG 4.23Å; R367-E384 IonicContact CZ-OE1 3.73Å; R367-E384 PolarHBondContact N-O 2.75Å; R367-E384 IonicContact NE-OE1 3.71Å; R367-E384 PolarHBondContact NE-OE1 3.17Å; R367-E384 IonicContact NH2-OE1 3.97Å; R367-E384 PolarHBondContact NH2-OE1 3.3Å; R367-E384 IonicContact NH2-OE2 3.42Å; R367-E384 PolarHBondContact O-N 3.15Å; E384-C386 PolarHBondContact O-N 2.89Å
385	P	87.2	Confident	70.8	Confident	107 Å²	107	100.4 Å²	100.4	70%	0.695	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-57.9	142.2	173.1	24.8	-33.2	0	0	0	110.5
386	C	86	Confident	73.2	Confident	27 Å²	27	95.1 Å²	95.1	18%	0.182	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-59.2	146.1	177.8	-65.7	0	0	0	0	111.4	C365 K366 E384 V390 Y415	C365-C386 HydrophobicContact CB-CB 3.61Å; C365-C386 WeakPolarHBondContact CB-SG 3.04Å; C365-C386 PolarHBondContact O-N 3.16Å; C365-C386 PolarHBondContact O-SG 3.01Å; C365-C386 WeakPolarHBondContact SG-CB 3.31Å; C365-C386 CovalentContact SG-SG 2.03Å; C365-C386 PolarHBondContact SG-SG 3.09Å; K366-C386 VanDerWaalsContact C-SG 3.59Å; K366-C386 PolarHBondContact N-SG 3.47Å; K366-C386 VanDerWaalsContact N-SG 3.39Å; E384-C386 PolarHBondContact O-N 2.89Å; C386-V390 HydrophobicContact CB-CG2 4.01Å; C386-Y415 VanDerWaalsContact SG-CD1 3.53Å
387	R	77.8	Confident	75.6	Confident	169 Å²	169	94.2 Å²	94.2	64%	0.638	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-65.7	155.6	178.7	-65.1	-174.4	175	-170.7	-2.5	110.8	N389 V390	R387-N389 PolarHBondContact O-N 3.25Å; R387-V390 PolarHBondContact O-N 2.91Å; R387-V390 VanDerWaalsContact O-N 3.15Å
388	S	70.2	Confident	78	Confident	118 Å²	118	89.1 Å²	89.1	83%	0.825	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-13.5	-180	52.9	0	0	0	0	115.6	V390	S388-V390 VanDerWaalsContact C-N 3.28Å
389	N	76.4	Confident	80	Confident	123 Å²	123	83.6 Å²	83.6	66%	0.658	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.3	-177.9	-56.9	-1.1	0	0	0	112.5	R387 D408	R387-N389 PolarHBondContact O-N 3.25Å; N389-D408 WeakPolarHBondContact O-CB 3.34Å
390	V	87.2	Confident	82.5	Confident	18 Å²	18	85.4 Å²	85.4	11%	0.109	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-76.8	125	175.1	177	0	0	0	0	109.5	C386 R387 S388 F392 V406 L409	C386-V390 HydrophobicContact CB-CG2 4.01Å; R387-V390 PolarHBondContact O-N 2.91Å; R387-V390 VanDerWaalsContact O-N 3.15Å; S388-V390 VanDerWaalsContact C-N 3.28Å; V390-F392 HydrophobicContact CG1-CE2 4.03Å; V390-F392 HydrophobicContact CG1-CZ 4.37Å; V390-V406 HydrophobicContact CG1-CG1 3.28Å; V390-L409 HydrophobicContact CG1-CD2 3.84Å; V390-L409 HydrophobicContact CG2-CD2 4Å
391	R	89.3	Confident	84.5	Confident	150 Å²	150	84.7 Å²	84.7	57%	0.566	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	124.6	-174.8	-171.1	177.6	-179.9	-177.5	-0.5	111.3	L393 V406 G407 D408	R391-L393 HydrophobicContact CG-CG 4.36Å; R391-V406 CarbonylContact O-C 3.59Å; R391-V406 WeakPolarHBondContact O-CA 3.31Å; R391-G407 PolarHBondContact N-O 3.42Å; R391-G407 VanDerWaalsContact N-O 3.15Å; R391-G407 PolarHBondContact O-N 3.15Å; R391-D408 WeakPolarHBondContact CB-OD2 3.35Å
392	F	91.9	Very high	86.2	Confident	41 Å²	41	81.4 Å²	81.4	18%	0.18	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.6	172.6	-64.9	-98.6	0	0	0	110.1	V363 C365 V390 P394 A396 V404 V406	V363-F392 HydrophobicContact CB-CE1 4.35Å; V363-F392 HydrophobicContact CG1-CE1 4.02Å; C365-F392 HydrophobicContact CB-CZ 3.76Å; V390-F392 HydrophobicContact CG1-CE2 4.03Å; V390-F392 HydrophobicContact CG1-CZ 4.37Å; F392-P394 CarbonylContact O-C 3.44Å; F392-A396 HydrophobicContact CB-CB 4.11Å; F392-A396 HydrophobicContact CD1-CB 3.99Å; F392-A396 HydrophobicContact CD2-CB 3.83Å; F392-A396 HydrophobicContact CE1-CB 4.34Å; F392-A396 HydrophobicContact CE2-CB 4.19Å; F392-A396 HydrophobicContact CG-CB 3.7Å; F392-A396 HydrophobicContact CZ-CB 4.42Å; F392-V404 HydrophobicContact CB-CG2 4.34Å; F392-V404 HydrophobicContact CD1-CG2 4.21Å; F392-V406 HydrophobicContact CD1-CG1 4.49Å; F392-V406 HydrophobicContact CD1-CG2 3.8Å; F392-V406 HydrophobicContact CE1-CG1 4.24Å; F392-V406 HydrophobicContact CE1-CG2 3.78Å; F392-V406 HydrophobicContact CZ-CG1 4.43Å
393	L	89.5	Confident	87.3	Confident	78 Å²	78	77.5 Å²	77.5	41%	0.408	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	116.5	177.3	-70.6	165.4	0	0	0	108.6	R391 V404 T405	R391-L393 HydrophobicContact CG-CG 4.36Å; L393-V404 WeakPolarHBondContact O-CG2 3.21Å; L393-T405 PolarHBondContact N-O 2.88Å; L393-T405 PolarHBondContact O-N 2.66Å
394	P	88.8	Confident	88.1	Confident	95 Å²	95	75.2 Å²	75.2	62%	0.617	40%	0.399	S	S	*	.	S	Bend	cis	-82.7	-30	5.8	31	-34.3	0	0	0	115.4	F392 L399	F392-P394 CarbonylContact O-C 3.44Å; P394-L399 HydrophobicContact CG-CD2 3.82Å
395	R	91.6	Very high	88.4	Confident	124 Å²	124	73.7 Å²	73.7	47%	0.468	40%	0.395	S	S	.	.			trans	-160.1	167.1	180	56.8	-175.5	178.1	-159.4	-2.4	111.2	T397 G398 L399	R395-T397 WeakPolarHBondContact CD-O 3.31Å; R395-T397 VanDerWaalsContact CG-O 3.29Å; R395-T397 WeakPolarHBondContact CG-O 3.33Å; R395-T397 PolarHBondContact NE-O 3.23Å; R395-G398 PolarHBondContact NE-O 3.21Å; R395-G398 VanDerWaalsContact NE-O 3.09Å; R395-G398 PolarHBondContact NH2-O 3.15Å; R395-L399 HydrophobicContact CG-CD2 3.75Å; R395-L399 HydrophobicContact CG-CG 4.17Å; R395-L399 WeakPolarHBondContact O-CD1 3.38Å; R395-L399 WeakPolarHBondContact O-CD2 3.25Å
396	A	89.8	Confident	88.7	Confident	29 Å²	29	68.6 Å²	68.6	24%	0.24	36%	0.362	C	S	.	.	S	Bend	trans	-89.2	-29.9	178.7	0	0	0	0	0	113.6	V363 F392	V363-A396 PolarHBondContact N-O 3.36Å; F392-A396 HydrophobicContact CB-CB 4.11Å; F392-A396 HydrophobicContact CD1-CB 3.99Å; F392-A396 HydrophobicContact CD2-CB 3.83Å; F392-A396 HydrophobicContact CE1-CB 4.34Å; F392-A396 HydrophobicContact CE2-CB 4.19Å; F392-A396 HydrophobicContact CG-CB 3.7Å; F392-A396 HydrophobicContact CZ-CB 4.42Å
397	T	92.4	Very high	88.8	Confident	88 Å²	88	67.9 Å²	67.9	54%	0.54	36%	0.359	S	S	.	.	S	Bend	trans	-125.8	156.3	-175.6	55.2	0	0	0	0	111.8	N362 R395 L399	N362-T397 HydrophobicContact CB-CG2 4.23Å; N362-T397 WeakPolarHBondContact OD1-CA 3.47Å; N362-T397 VanDerWaalsContact OD1-CB 3.26Å; N362-T397 WeakPolarHBondContact OD1-CB 3.42Å; R395-T397 WeakPolarHBondContact CD-O 3.31Å; R395-T397 VanDerWaalsContact CG-O 3.29Å; R395-T397 WeakPolarHBondContact CG-O 3.33Å; R395-T397 PolarHBondContact NE-O 3.23Å; T397-L399 VanDerWaalsContact C-N 3.28Å; T397-L399 PolarHBondContact O-N 3.2Å
398	G	91.1	Very high	89.3	Confident	21 Å²	21	64.7 Å²	64.7	22%	0.216	36%	0.355	C	S	.	.	S	Bend	trans	66	28.7	178.7	0	0	0	0	0	113.1	F361 N362 R395	F361-G398 PolarHBondContact O-N 3.39Å; N362-G398 PolarHBondContact OD1-N 3.39Å; R395-G398 PolarHBondContact NE-O 3.21Å; R395-G398 VanDerWaalsContact NE-O 3.09Å; R395-G398 PolarHBondContact NH2-O 3.15Å
399	L	92.6	Very high	90	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.016	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-71.4	131.6	179.9	-71.7	159.5	0	0	0	110.4	W347 T360 F361 V363 P394 R395 T397 V404	W347-L399 HydrophobicContact CH2-CD1 4.16Å; W347-L399 HydrophobicContact CZ2-CD1 4.47Å; T360-L399 CarbonylContact C-O 3.54Å; T360-L399 VanDerWaalsContact CA-O 3.27Å; T360-L399 WeakPolarHBondContact CA-O 3.37Å; F361-L399 HydrophobicContact CB-CB 4.13Å; F361-L399 WeakPolarHBondContact CD2-O 2.89Å; F361-L399 PolarHBondContact N-O 2.03Å; F361-L399 WeakPolarHBondContact O-CB 3.3Å; F361-L399 PolarHBondContact O-N 3.18Å; V363-L399 HydrophobicContact CG2-CD1 3.92Å; P394-L399 HydrophobicContact CG-CD2 3.82Å; R395-L399 HydrophobicContact CG-CD2 3.75Å; R395-L399 HydrophobicContact CG-CG 4.17Å; R395-L399 WeakPolarHBondContact O-CD1 3.38Å; R395-L399 WeakPolarHBondContact O-CD2 3.25Å; T397-L399 VanDerWaalsContact C-N 3.28Å; T397-L399 PolarHBondContact O-N 3.2Å; L399-V404 HydrophobicContact CD1-CB 4.22Å; L399-V404 HydrophobicContact CD1-CG2 4.28Å
400	H	90.8	Very high	90.4	Very high	111 Å²	111	57.3 Å²	57.3	51%	0.514	31%	0.305	S	S	.	.			trans	-93.7	-24.4	170.8	-61.5	-70.4	0	0	0	112.3
401	N	91.2	Very high	90	Very high	105 Å²	105	57.1 Å²	57.1	56%	0.561	31%	0.306	S	S	*	.	S	Bend	trans	-87	155.2	177.1	-62.7	-0.2	0	0	0	109.8	T403	N401-T403 VanDerWaalsContact C-N 3.28Å; N401-T403 PolarHBondContact O-N 3.34Å
402	T	93.1	Very high	89.6	Confident	31 Å²	31	54.9 Å²	54.9	19%	0.19	30%	0.301	C	S	.	.	S	Bend	trans	-92.5	17	-179.4	59.8	0	0	0	0	113.9	D346 W347 W349 F361	D346-T402 WeakPolarHBondContact CA-O 3.31Å; W347-T402 VanDerWaalsContact CE3-O 3.27Å; W347-T402 PolarHBondContact N-O 2.68Å; W347-T402 WeakPolarHBondContact O-CB 3.44Å; W347-T402 PolarHBondContact O-OG1 2.74Å; W349-T402 HydrophobicContact CG-CG2 4.48Å; F361-T402 HydrophobicContact CE2-CG2 4.04Å; F361-T402 HydrophobicContact CZ-CG2 4.33Å
403	T	93.3	Very high	89.2	Confident	61 Å²	61	54.3 Å²	54.3	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.5	-178.4	60.2	0	0	0	0	110.4	L345 D346 N401	L345-T403 CarbonylContact O-C 3.51Å; L345-T403 VanDerWaalsContact O-CA 3.25Å; L345-T403 WeakPolarHBondContact O-CA 3.5Å; D346-T403 HydrophobicContact CB-CG2 4.19Å; D346-T403 WeakPolarHBondContact OD1-CG2 3.4Å; N401-T403 VanDerWaalsContact C-N 3.28Å; N401-T403 PolarHBondContact O-N 3.34Å
404	V	94.6	Very high	89.1	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140	169	75.4	0	0	0	0	110.3	L345 W347 V363 F392 L393 L399 V406	L345-V404 HydrophobicContact CB-CG1 4.07Å; L345-V404 HydrophobicContact CD1-CG1 4.11Å; L345-V404 PolarHBondContact N-O 2.9Å; L345-V404 PolarHBondContact O-N 3.01Å; W347-V404 HydrophobicContact CH2-CB 4.17Å; W347-V404 HydrophobicContact CH2-CG1 4.05Å; W347-V404 HydrophobicContact CZ3-CB 4.39Å; W347-V404 HydrophobicContact CZ3-CG1 3.92Å; V363-V404 HydrophobicContact CG1-CG1 4.5Å; V363-V404 HydrophobicContact CG2-CG1 4.11Å; F392-V404 HydrophobicContact CB-CG2 4.34Å; F392-V404 HydrophobicContact CD1-CG2 4.21Å; L393-V404 WeakPolarHBondContact O-CG2 3.21Å; L399-V404 HydrophobicContact CD1-CB 4.22Å; L399-V404 HydrophobicContact CD1-CG2 4.28Å; V404-V406 HydrophobicContact CG1-CG2 4.18Å
405	T	92.8	Very high	89.1	Confident	48 Å²	48	49 Å²	49	29%	0.294	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.1	170.6	-55.9	0	0	0	0	109.2	V343 I344 L393	V343-T405 CarbonylContact O-C 3.55Å; V343-T405 WeakPolarHBondContact O-CA 3.35Å; I344-T405 HydrophobicContact CG1-CG2 4.18Å; L393-T405 PolarHBondContact N-O 2.88Å; L393-T405 PolarHBondContact O-N 2.66Å
406	V	92.8	Very high	89	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	109.9	177.4	-170.3	0	0	0	0	108.3	S342 V343 L345 V390 R391 F392 V404 L409 F417	S342-V406 CarbonylContact C-O 3.55Å; S342-V406 VanDerWaalsContact CA-O 3.29Å; S342-V406 WeakPolarHBondContact CA-O 3.41Å; V343-V406 PolarHBondContact N-O 3.45Å; V343-V406 PolarHBondContact O-N 3.07Å; L345-V406 HydrophobicContact CD1-CG2 4.27Å; V390-V406 HydrophobicContact CG1-CG1 3.28Å; R391-V406 CarbonylContact O-C 3.59Å; R391-V406 WeakPolarHBondContact O-CA 3.31Å; F392-V406 HydrophobicContact CD1-CG1 4.49Å; F392-V406 HydrophobicContact CD1-CG2 3.8Å; F392-V406 HydrophobicContact CE1-CG1 4.24Å; F392-V406 HydrophobicContact CE1-CG2 3.78Å; F392-V406 HydrophobicContact CZ-CG1 4.43Å; V404-V406 HydrophobicContact CG1-CG2 4.18Å; V406-L409 HydrophobicContact CG1-CD1 4.33Å; V406-L409 HydrophobicContact CG1-CD2 3.96Å; V406-L409 HydrophobicContact CG1-CG 4.29Å; V406-F417 HydrophobicContact CB-CE1 4.19Å; V406-F417 HydrophobicContact CB-CZ 4.31Å; V406-F417 HydrophobicContact CG1-CE1 3.85Å; V406-F417 HydrophobicContact CG1-CZ 4.04Å; V406-F417 HydrophobicContact CG2-CD1 4.42Å; V406-F417 HydrophobicContact CG2-CE1 3.83Å; V406-F417 HydrophobicContact CG2-CZ 4.34Å
407	G	88.5	Confident	89.2	Confident	11 Å²	11	42.3 Å²	42.3	11%	0.113	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	174.5	179	0	0	0	0	0	113.1	R391 L409	R391-G407 PolarHBondContact N-O 3.42Å; R391-G407 VanDerWaalsContact N-O 3.15Å; R391-G407 PolarHBondContact O-N 3.15Å; G407-L409 VanDerWaalsContact C-N 3.3Å; G407-L409 PolarHBondContact O-N 2.67Å
408	D	86.8	Confident	89.2	Confident	103 Å²	103	39.3 Å²	39.3	55%	0.551	22%	0.217	S	C	*	.	S	Bend	trans	62.3	32.9	174.8	-54.5	-47.7	0	0	0	113.9	N389 R391	N389-D408 WeakPolarHBondContact O-CB 3.34Å; R391-D408 WeakPolarHBondContact CB-OD2 3.35Å
409	L	86.4	Confident	89.4	Confident	7 Å²	7	38.3 Å²	38.3	4%	0.037	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-79.8	149.6	173.7	-56.6	169.7	0	0	0	110.6	T341 V343 V390 V406 G407 Y415 F417 T442	T341-L409 VanDerWaalsContact CB-O 3.32Å; T341-L409 WeakPolarHBondContact CB-O 3.39Å; T341-L409 VanDerWaalsContact O-CB 3.25Å; T341-L409 WeakPolarHBondContact O-CB 3.44Å; T341-L409 PolarHBondContact O-N 2.96Å; V343-L409 HydrophobicContact CB-CD1 3.97Å; V343-L409 HydrophobicContact CG2-CD1 3.4Å; V390-L409 HydrophobicContact CG1-CD2 3.84Å; V390-L409 HydrophobicContact CG2-CD2 4Å; V406-L409 HydrophobicContact CG1-CD1 4.33Å; V406-L409 HydrophobicContact CG1-CD2 3.96Å; V406-L409 HydrophobicContact CG1-CG 4.29Å; G407-L409 VanDerWaalsContact C-N 3.3Å; G407-L409 PolarHBondContact O-N 2.67Å; L409-Y415 HydrophobicContact CB-CD2 4.44Å; L409-Y415 HydrophobicContact CB-CE2 3.89Å; L409-Y415 HydrophobicContact CD2-CD1 4.11Å; L409-Y415 HydrophobicContact CD2-CD2 4.28Å; L409-Y415 HydrophobicContact CD2-CE1 3.86Å; L409-Y415 HydrophobicContact CD2-CE2 4.06Å; L409-Y415 HydrophobicContact CD2-CG 4.29Å; L409-Y415 HydrophobicContact CG-CE2 4.47Å; L409-F417 HydrophobicContact CD1-CZ 4.26Å; L409-F417 HydrophobicContact CD2-CZ 4.35Å; L409-T442 HydrophobicContact CB-CG2 3.84Å; L409-T442 HydrophobicContact CD1-CG2 4.03Å
410	L	83.6	Confident	89.5	Confident	79 Å²	79	39.6 Å²	39.6	41%	0.414	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-68.8	138.1	174.1	-65.2	171.9	0	0	0	109.8	R367 T413 Y415 T442	R367-L410 VanDerWaalsContact NH1-CD1 3.34Å; L410-T413 WeakPolarHBondContact CB-OG1 3.18Å; L410-Y415 PolarHBondContact N-OH 2.89Å; L410-T442 WeakPolarHBondContact O-CB 3.5Å; L410-T442 PolarHBondContact O-OG1 3.07Å
411	A	80.1	Confident	89.7	Confident	14 Å²	14	34.3 Å²	34.3	12%	0.116	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	149.4	173.9	0	0	0	0	0	111.2	T413 N443 A445 N474	A411-T413 VanDerWaalsContact C-N 3.28Å; A411-T413 PolarHBondContact O-N 3.11Å; A411-T413 PolarHBondContact O-OG1 3.36Å; A411-T413 VanDerWaalsContact O-OG1 3.08Å; A411-N443 WeakPolarHBondContact CB-O 2.93Å; A411-A445 HydrophobicContact CB-CB 3.88Å; A411-N474 HydrophobicContact CB-CB 4.1Å
412	H	80.8	Confident	89.8	Confident	102 Å²	102	31.1 Å²	31.1	47%	0.472	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	42	178.7	-161.1	58.7	0	0	0	115.1	T442 N443	H412-T442 WeakPolarHBondContact CA-O 3.17Å; H412-T442 PolarHBondContact N-O 3.25Å; H412-T442 PolarHBondContact N-OG1 2.94Å; H412-N443 PolarHBondContact N-O 2.91Å; H412-N443 VanDerWaalsContact N-O 3.17Å
413	T	83.1	Confident	89.9	Confident	30 Å²	30	30.2 Å²	30.2	18%	0.184	17%	0.165	C	C	.	.			trans	-126.7	141.9	-177	-59.3	0	0	0	0	111	R367 L410 A411 Y415 T442	R367-T413 HydrophobicContact CG-CG2 3.87Å; L410-T413 WeakPolarHBondContact CB-OG1 3.18Å; A411-T413 VanDerWaalsContact C-N 3.28Å; A411-T413 PolarHBondContact O-N 3.11Å; A411-T413 PolarHBondContact O-OG1 3.36Å; A411-T413 VanDerWaalsContact O-OG1 3.08Å; T413-Y415 HydrophobicContact CG2-CD2 4.19Å; T413-Y415 HydrophobicContact CG2-CE2 3.66Å; T413-Y415 WeakPolarHBondContact O-CD2 3.23Å; T413-T442 PolarHBondContact N-OG1 2.8Å; T413-T442 PolarHBondContact O-N 3.26Å; T413-T442 PolarHBondContact O-OG1 2.97Å
414	N	86.6	Confident	89.7	Confident	52 Å²	52	28.7 Å²	28.7	28%	0.278	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.6	178.8	-65	-8.3	0	0	0	111.4	C368 I440 T441	C368-N414 PolarHBondContact N-O 3.05Å; C368-N414 WeakPolarHBondContact O-CB 3.34Å; N414-I440 CarbonylContact C-O 3.5Å; N414-I440 VanDerWaalsContact CA-O 3.29Å; N414-I440 WeakPolarHBondContact CA-O 3.49Å; N414-T441 WeakPolarHBondContact OD1-CB 3.18Å; N414-T441 VanDerWaalsContact OD1-CG2 3.23Å; N414-T441 WeakPolarHBondContact OD1-CG2 3.5Å; N414-T441 PolarHBondContact OD1-OG1 2.81Å
415	Y	88.6	Confident	89.7	Confident	8 Å²	8	28.7 Å²	28.7	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.5	177	-73	-85.3	0	0	0	110.3	K366 R367 C386 L409 L410 T413 T439 I440 T442	K366-Y415 CarbonylContact O-C 3.59Å; K366-Y415 WeakPolarHBondContact O-CA 3.4Å; R367-Y415 HydrophobicContact CB-CD1 4.11Å; R367-Y415 HydrophobicContact CB-CE1 3.91Å; R367-Y415 HydrophobicContact CG-CD1 4.49Å; R367-Y415 HydrophobicContact CG-CE1 4.14Å; C386-Y415 VanDerWaalsContact SG-CD1 3.53Å; L409-Y415 HydrophobicContact CB-CD2 4.44Å; L409-Y415 HydrophobicContact CB-CE2 3.89Å; L409-Y415 HydrophobicContact CD2-CD1 4.11Å; L409-Y415 HydrophobicContact CD2-CD2 4.28Å; L409-Y415 HydrophobicContact CD2-CE1 3.86Å; L409-Y415 HydrophobicContact CD2-CE2 4.06Å; L409-Y415 HydrophobicContact CD2-CG 4.29Å; L409-Y415 HydrophobicContact CG-CE2 4.47Å; L410-Y415 PolarHBondContact N-OH 2.89Å; T413-Y415 HydrophobicContact CG2-CD2 4.19Å; T413-Y415 HydrophobicContact CG2-CE2 3.66Å; T413-Y415 WeakPolarHBondContact O-CD2 3.23Å; Y415-T439 CarbonylContact O-C 3.6Å; Y415-T439 WeakPolarHBondContact O-CA 3.12Å; Y415-I440 PolarHBondContact N-O 2.96Å; Y415-I440 PolarHBondContact O-N 3.12Å; Y415-T442 HydrophobicContact CD2-CG2 4.28Å; Y415-T442 HydrophobicContact CE2-CG2 4.45Å
416	T	90.6	Very high	89.7	Confident	14 Å²	14	26.4 Å²	26.4	9%	0.086	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.8	171.4	-58.9	0	0	0	0	109.3	K366 C368 A437 V438 T439	K366-T416 PolarHBondContact N-O 3.03Å; K366-T416 PolarHBondContact O-N 2.56Å; C368-T416 PolarHBondContact SG-OG1 3.09Å; T416-A437 HydrophobicContact CG2-CB 4.44Å; T416-V438 CarbonylContact C-O 3.54Å; T416-V438 VanDerWaalsContact CA-O 3.29Å; T416-V438 WeakPolarHBondContact CA-O 3.27Å; T416-T439 PolarHBondContact OG1-OG1 2.81Å
417	F	92.8	Very high	89.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.8	177.7	-65.1	-86.4	0	0	0	109.8	L345 V363 L364 C365 V406 L409 I419 A437 V438 I440	L345-F417 HydrophobicContact CD1-CB 3.68Å; L345-F417 HydrophobicContact CD1-CD1 3.76Å; L345-F417 HydrophobicContact CD1-CD2 4.14Å; L345-F417 HydrophobicContact CD1-CE1 4.43Å; L345-F417 HydrophobicContact CD1-CG 3.58Å; L345-F417 HydrophobicContact CD2-CD2 4.38Å; V363-F417 HydrophobicContact CG1-CD1 4.16Å; L364-F417 CarbonylContact O-C 3.56Å; L364-F417 WeakPolarHBondContact O-CA 3.28Å; C365-F417 HydrophobicContact CB-CD1 3.9Å; C365-F417 HydrophobicContact CB-CE1 3.63Å; C365-F417 WeakPolarHBondContact SG-CE1 3.33Å; V406-F417 HydrophobicContact CB-CE1 4.19Å; V406-F417 HydrophobicContact CB-CZ 4.31Å; V406-F417 HydrophobicContact CG1-CE1 3.85Å; V406-F417 HydrophobicContact CG1-CZ 4.04Å; V406-F417 HydrophobicContact CG2-CD1 4.42Å; V406-F417 HydrophobicContact CG2-CE1 3.83Å; V406-F417 HydrophobicContact CG2-CZ 4.34Å; L409-F417 HydrophobicContact CD1-CZ 4.26Å; L409-F417 HydrophobicContact CD2-CZ 4.35Å; F417-I419 HydrophobicContact CB-CD1 4.39Å; F417-A437 CarbonylContact O-C 3.54Å; F417-A437 VanDerWaalsContact O-CA 3.24Å; F417-A437 WeakPolarHBondContact O-CA 3.41Å; F417-V438 HydrophobicContact CB-CG1 4.12Å; F417-V438 PolarHBondContact N-O 2.73Å; F417-V438 PolarHBondContact O-N 3.03Å; F417-I440 HydrophobicContact CD2-CD1 4.42Å; F417-I440 HydrophobicContact CD2-CG1 4.23Å; F417-I440 HydrophobicContact CE2-CD1 3.81Å; F417-I440 HydrophobicContact CE2-CG1 3.91Å
418	E	93.8	Very high	89.7	Confident	24 Å²	24	33.9 Å²	33.9	11%	0.112	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.6	174	-67.6	173.4	175.7	0	0	108.9	V363 L364 K366 Y435 A436 A437	V363-E418 CarbonylContact C-O 3.54Å; V363-E418 WeakPolarHBondContact CA-O 3.5Å; L364-E418 HydrophobicContact CB-CB 4.32Å; L364-E418 PolarHBondContact N-O 2.91Å; L364-E418 PolarHBondContact O-N 3.07Å; K366-E418 VanDerWaalsContact CE-OE2 3.23Å; K366-E418 WeakPolarHBondContact CE-OE2 3.07Å; K366-E418 IonicContact NZ-OE1 3.03Å; K366-E418 PolarHBondContact NZ-OE1 3.17Å; K366-E418 IonicContact NZ-OE2 3.49Å; K366-E418 PolarHBondContact NZ-OE2 3.46Å; E418-Y435 HydrophobicContact CB-CD2 3.88Å; E418-Y435 HydrophobicContact CB-CE2 4.41Å; E418-Y435 HydrophobicContact CB-CG 4.41Å; E418-Y435 HydrophobicContact CG-CD2 3.71Å; E418-Y435 HydrophobicContact CG-CE2 3.77Å; E418-A436 CarbonylContact C-O 3.56Å; E418-A436 WeakPolarHBondContact CA-O 3.37Å; E418-A437 HydrophobicContact CG-CB 4.06Å
419	I	94.8	Very high	89.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	114.4	179.4	-53.1	83.9	0	0	0	107.8	P331 V334 W347 F361 N362 V363 F417 Y435 A436	P331-I419 WeakPolarHBondContact CD-O 3.45Å; P331-I419 HydrophobicContact CG-CB 4.38Å; P331-I419 HydrophobicContact CG-CG2 3.88Å; V334-I419 HydrophobicContact CG1-CD1 3.72Å; V334-I419 HydrophobicContact CG2-CD1 4.22Å; W347-I419 HydrophobicContact CD2-CG2 3.9Å; W347-I419 HydrophobicContact CE3-CG1 4.15Å; W347-I419 HydrophobicContact CE3-CG2 4.25Å; W347-I419 HydrophobicContact CG-CG2 4.38Å; W347-I419 HydrophobicContact CH2-CG2 4.38Å; W347-I419 HydrophobicContact CZ2-CG2 4.04Å; W347-I419 HydrophobicContact CZ3-CG1 4.33Å; W347-I419 HydrophobicContact CZ3-CG2 4.47Å; F361-I419 HydrophobicContact CB-CG2 4.44Å; F361-I419 HydrophobicContact CD1-CG2 4.5Å; N362-I419 WeakPolarHBondContact O-CA 3.26Å; V363-I419 HydrophobicContact CG1-CG1 4.43Å; V363-I419 HydrophobicContact CG2-CG1 4.14Å; V363-I419 HydrophobicContact CG2-CG2 4.26Å; F417-I419 HydrophobicContact CB-CD1 4.39Å; I419-Y435 CarbonylContact O-C 3.47Å; I419-Y435 VanDerWaalsContact O-CA 3.28Å; I419-Y435 WeakPolarHBondContact O-CA 3.35Å; I419-Y435 WeakPolarHBondContact O-CB 3.3Å; I419-A436 PolarHBondContact N-O 3.28Å; I419-A436 PolarHBondContact O-N 2.7Å
420	E	94.4	Very high	89.8	Confident	30 Å²	30	33.2 Å²	33.2	14%	0.14	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135	178.7	-173.6	-172.6	-157.5	0	0	109.9	F361 N362 Q422 R433	F361-E420 CarbonylContact C-O 3.55Å; F361-E420 VanDerWaalsContact CA-O 3.28Å; F361-E420 WeakPolarHBondContact CA-O 3.49Å; N362-E420 PolarHBondContact N-O 2.81Å; N362-E420 PolarHBondContact O-N 2.7Å; E420-Q422 VanDerWaalsContact CD-NE2 3.33Å; E420-Q422 HydrophobicContact CG-CG 4.15Å; E420-Q422 PolarHBondContact OE2-NE2 2.83Å; E420-R433 VanDerWaalsContact OE1-CB 3.28Å; E420-R433 WeakPolarHBondContact OE1-CB 3.14Å; E420-R433 WeakPolarHBondContact OE1-CD 3.3Å
421	A	94.9	Very high	89.8	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135	168.8	0	0	0	0	0	109.9	P328 P331 P350 I359 F361	P328-A421 HydrophobicContact CB-CB 4.28Å; P328-A421 HydrophobicContact CG-CB 3.78Å; P328-A421 WeakPolarHBondContact CG-O 3.27Å; P331-A421 HydrophobicContact CG-CB 4.17Å; P350-A421 HydrophobicContact CG-CB 3.63Å; I359-A421 HydrophobicContact CG2-CB 4.17Å; F361-A421 HydrophobicContact CD1-CB 3.96Å; F361-A421 HydrophobicContact CE1-CB 3.86Å
422	Q	94.5	Very high	90.1	Very high	38 Å²	38	42.2 Å²	42.2	18%	0.178	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	148.8	178.7	-63.4	-171.4	0.4	0	0	110.7	I359 T360 N362 E420	I359-Q422 CarbonylContact C-O 3.52Å; I359-Q422 VanDerWaalsContact CA-O 3.25Å; I359-Q422 WeakPolarHBondContact CA-O 3.23Å; T360-Q422 PolarHBondContact N-O 2.89Å; T360-Q422 PolarHBondContact O-N 3.02Å; T360-Q422 PolarHBondContact OG1-O 3.37Å; N362-Q422 PolarHBondContact ND2-NE2 3.12Å; N362-Q422 PolarHBondContact ND2-OE1 3.35Å; E420-Q422 VanDerWaalsContact CD-NE2 3.33Å; E420-Q422 HydrophobicContact CG-CG 4.15Å; E420-Q422 PolarHBondContact OE2-NE2 2.83Å
423	N	93.3	Very high	90.3	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.064	22%	0.22	C	C	.	.			trans	-132.9	179.6	173	70.3	6.7	0	0	0	110.7	R326 T353 R356 V425 S426	R326-N423 PolarHBondContact O-ND2 3.01Å; T353-N423 PolarHBondContact O-ND2 3.5Å; R356-N423 HydrophobicContact CB-CB 4.48Å; N423-V425 PolarHBondContact O-N 2.95Å; N423-V425 WeakPolarHBondContact OD1-CG2 3.3Å; N423-V425 PolarHBondContact OD1-N 2.79Å; N423-S426 PolarHBondContact N-OG 3Å; N423-S426 VanDerWaalsContact O-CB 3.29Å; N423-S426 WeakPolarHBondContact O-CB 3.42Å; N423-S426 PolarHBondContact O-N 2.92Å; N423-S426 PolarHBondContact O-OG 3.37Å; N423-S426 PolarHBondContact OD1-N 3.18Å; N423-S426 PolarHBondContact OD1-OG 3.21Å
424	G	90.9	Very high	90.5	Very high	29 Å²	29	44.8 Å²	44.8	30%	0.299	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-19.2	-175.7	0	0	0	0	0	116.2	D358	D358-G424 WeakPolarHBondContact OD2-CA 3.26Å; D358-G424 PolarHBondContact OD2-N 3.49Å; D358-G424 VanDerWaalsContact OD2-N 3.14Å
425	V	93.6	Very high	90.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-1.9	178	-62.2	0	0	0	0	113.7	F313 A315 R326 N423 S427 L428	F313-V425 HydrophobicContact CB-CB 4.12Å; F313-V425 HydrophobicContact CB-CG1 4.05Å; A315-V425 HydrophobicContact CB-CG1 4.29Å; R326-V425 VanDerWaalsContact C-CG2 3.47Å; N423-V425 PolarHBondContact O-N 2.95Å; N423-V425 WeakPolarHBondContact OD1-CG2 3.3Å; N423-V425 PolarHBondContact OD1-N 2.79Å; V425-S427 PolarHBondContact O-N 3.43Å; V425-L428 WeakPolarHBondContact O-CB 3.27Å; V425-L428 PolarHBondContact O-N 2.98Å; V425-L428 VanDerWaalsContact O-N 3.07Å
426	S	92.8	Very high	91	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.007	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.8	-177.6	-63.4	0	0	0	0	113.3	P328 N423 R433	P328-S426 WeakPolarHBondContact CD-OG 3.31Å; N423-S426 PolarHBondContact N-OG 3Å; N423-S426 VanDerWaalsContact O-CB 3.29Å; N423-S426 WeakPolarHBondContact O-CB 3.42Å; N423-S426 PolarHBondContact O-N 2.92Å; N423-S426 PolarHBondContact O-OG 3.37Å; N423-S426 PolarHBondContact OD1-N 3.18Å; N423-S426 PolarHBondContact OD1-OG 3.21Å; S426-R433 VanDerWaalsContact O-CZ 3.3Å; S426-R433 PolarHBondContact O-NE 3.38Å; S426-R433 PolarHBondContact O-NH2 3.11Å
427	S	90.4	Very high	91	Very high	80 Å²	80	51.1 Å²	51.1	56%	0.559	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-34.8	171.3	53.6	0	0	0	0	112.9	V425 A429	V425-S427 PolarHBondContact O-N 3.43Å; S427-A429 VanDerWaalsContact C-N 3.32Å; S427-A429 PolarHBondContact O-N 3.42Å
428	L	90.7	Very high	90.8	Very high	88 Å²	88	52.4 Å²	52.4	46%	0.461	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-19.5	-176.5	-57.9	174.9	0	0	0	112.8	F313 R314 V425	F313-L428 HydrophobicContact CB-CB 4.45Å; F313-L428 HydrophobicContact CB-CD1 3.72Å; F313-L428 HydrophobicContact CD1-CB 4.11Å; F313-L428 HydrophobicContact CD1-CD1 4.46Å; F313-L428 HydrophobicContact CG-CB 4.15Å; F313-L428 HydrophobicContact CG-CD1 4.29Å; R314-L428 WeakPolarHBondContact O-CD1 3.23Å; V425-L428 WeakPolarHBondContact O-CB 3.27Å; V425-L428 PolarHBondContact O-N 2.98Å; V425-L428 VanDerWaalsContact O-N 3.07Å
429	A	89.6	Confident	90.6	Very high	10 Å²	10	55.3 Å²	55.3	8%	0.083	30%	0.297	C	S	.	.			trans	-133.9	72.1	179.3	0	0	0	0	0	113.2	F313 P327 S427 K431 M432	F313-A429 HydrophobicContact CD2-CB 4.41Å; F313-A429 HydrophobicContact CE2-CB 3.65Å; F313-A429 HydrophobicContact CZ-CB 3.98Å; P327-A429 HydrophobicContact CG-CB 3.83Å; S427-A429 VanDerWaalsContact C-N 3.32Å; S427-A429 PolarHBondContact O-N 3.42Å; A429-K431 VanDerWaalsContact C-N 3.26Å; A429-K431 PolarHBondContact O-N 3.07Å; A429-M432 HydrophobicContact CB-CB 4.3Å; A429-M432 HydrophobicContact CB-CG 4.31Å; A429-M432 HydrophobicContact CB-SD 3.97Å; A429-M432 PolarHBondContact O-N 3.07Å
430	P	85.4	Confident	90.2	Very high	86 Å²	86	55.8 Å²	55.8	56%	0.558	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-61.6	-32.5	-177.8	-18.9	29.9	0	0	0	113.6	M432	P430-M432 PolarHBondContact O-N 3.07Å
431	K	84.4	Confident	89.7	Confident	212 Å²	212	57.3 Å²	57.3	92%	0.922	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-72.9	-11.6	-177.5	-64.2	-176	179.4	-179.4	0	113.9	A429	A429-K431 VanDerWaalsContact C-N 3.26Å; A429-K431 PolarHBondContact O-N 3.07Å
432	M	85.2	Confident	89.1	Confident	69 Å²	69	57.4 Å²	57.4	34%	0.34	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-100.9	-1.1	-177.8	-67.9	178.8	66.1	0	0	113.2	N311 P327 A429 P430	N311-M432 HydrophobicContact CB-CE 4.11Å; N311-M432 HydrophobicContact CB-SD 4.02Å; P327-M432 HydrophobicContact CG-CB 4.24Å; A429-M432 HydrophobicContact CB-CB 4.3Å; A429-M432 HydrophobicContact CB-CG 4.31Å; A429-M432 HydrophobicContact CB-SD 3.97Å; A429-M432 PolarHBondContact O-N 3.07Å; P430-M432 PolarHBondContact O-N 3.07Å
433	R	86.1	Confident	88.2	Confident	83 Å²	83	59.5 Å²	59.5	31%	0.313	33%	0.325	S	S	.	.			trans	-73.3	142.6	-176.6	-58.3	-170.4	-167.6	171.5	-0.7	111.7	E420 S426	E420-R433 VanDerWaalsContact OE1-CB 3.28Å; E420-R433 WeakPolarHBondContact OE1-CB 3.14Å; E420-R433 WeakPolarHBondContact OE1-CD 3.3Å; S426-R433 VanDerWaalsContact O-CZ 3.3Å; S426-R433 PolarHBondContact O-NE 3.38Å; S426-R433 PolarHBondContact O-NH2 3.11Å
434	Q	87.1	Confident	87.4	Confident	103 Å²	103	61.8 Å²	61.8	48%	0.481	34%	0.335	S	S	.	.			trans	-130.9	150.1	-177	-59.5	-179.6	3.2	0	0	110.3	A330	A330-Q434 HydrophobicContact CB-CB 3.96Å
435	Y	93.1	Very high	86.6	Confident	130 Å²	130	61.9 Å²	61.9	51%	0.51	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	153.9	-179.9	61.5	-92	0	0	0	111.2	E418 I419 A437	E418-Y435 HydrophobicContact CB-CD2 3.88Å; E418-Y435 HydrophobicContact CB-CE2 4.41Å; E418-Y435 HydrophobicContact CB-CG 4.41Å; E418-Y435 HydrophobicContact CG-CD2 3.71Å; E418-Y435 HydrophobicContact CG-CE2 3.77Å; I419-Y435 CarbonylContact O-C 3.47Å; I419-Y435 VanDerWaalsContact O-CA 3.28Å; I419-Y435 WeakPolarHBondContact O-CA 3.35Å; I419-Y435 WeakPolarHBondContact O-CB 3.3Å; Y435-A437 HydrophobicContact CD2-CB 4.43Å; Y435-A437 HydrophobicContact CE2-CB 4.39Å
436	A	92	Very high	85.9	Confident	17 Å²	17	63.8 Å²	63.8	14%	0.14	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	140.2	169.3	0	0	0	0	0	109.4	P331 V334 E418 I419	P331-A436 WeakPolarHBondContact O-CB 3.48Å; V334-A436 HydrophobicContact CG2-CB 3.59Å; E418-A436 CarbonylContact C-O 3.56Å; E418-A436 WeakPolarHBondContact CA-O 3.37Å; I419-A436 PolarHBondContact N-O 3.28Å; I419-A436 PolarHBondContact O-N 2.7Å
437	A	90.5	Very high	85.5	Confident	61 Å²	61	64 Å²	64	50%	0.504	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140.7	-177.3	0	0	0	0	0	112	T416 F417 E418 Y435	T416-A437 HydrophobicContact CG2-CB 4.44Å; F417-A437 CarbonylContact O-C 3.54Å; F417-A437 VanDerWaalsContact O-CA 3.24Å; F417-A437 WeakPolarHBondContact O-CA 3.41Å; E418-A437 HydrophobicContact CG-CB 4.06Å; Y435-A437 HydrophobicContact CD2-CB 4.43Å; Y435-A437 HydrophobicContact CE2-CB 4.39Å
438	V	90.3	Very high	85.1	Confident	26 Å²	26	61.4 Å²	61.4	16%	0.158	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.9	172.9	66.6	0	0	0	0	110.5	V334 L345 T416 F417 I440	V334-V438 HydrophobicContact CG1-CB 3.95Å; V334-V438 HydrophobicContact CG1-CG1 3.69Å; L345-V438 HydrophobicContact CD2-CG1 3.85Å; T416-V438 CarbonylContact C-O 3.54Å; T416-V438 VanDerWaalsContact CA-O 3.29Å; T416-V438 WeakPolarHBondContact CA-O 3.27Å; F417-V438 HydrophobicContact CB-CG1 4.12Å; F417-V438 PolarHBondContact N-O 2.73Å; F417-V438 PolarHBondContact O-N 3.03Å; V438-I440 HydrophobicContact CG2-CG2 4.19Å
439	T	88.8	Confident	84.9	Confident	85 Å²	85	59.5 Å²	59.5	52%	0.521	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.5	176.7	-56	0	0	0	0	110	Y415 T416	Y415-T439 CarbonylContact O-C 3.6Å; Y415-T439 WeakPolarHBondContact O-CA 3.12Å; T416-T439 PolarHBondContact OG1-OG1 2.81Å
440	I	85.9	Confident	84.8	Confident	10 Å²	10	59 Å²	59	5%	0.051	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	160	-175.9	60.1	152.5	0	0	0	112.1	S336 I338 V343 N414 Y415 F417 V438	S336-I440 VanDerWaalsContact OG-CG2 3.23Å; S336-I440 WeakPolarHBondContact OG-CG2 3.34Å; I338-I440 HydrophobicContact CD1-CB 4.05Å; I338-I440 HydrophobicContact CD1-CD1 4.3Å; I338-I440 HydrophobicContact CG1-CD1 4.35Å; V343-I440 HydrophobicContact CB-CD1 3.89Å; V343-I440 HydrophobicContact CG1-CD1 3.48Å; V343-I440 VanDerWaalsContact CG1-CD1 3.48Å; V343-I440 HydrophobicContact CG2-CD1 3.15Å; N414-I440 CarbonylContact C-O 3.5Å; N414-I440 VanDerWaalsContact CA-O 3.29Å; N414-I440 WeakPolarHBondContact CA-O 3.49Å; Y415-I440 PolarHBondContact N-O 2.96Å; Y415-I440 PolarHBondContact O-N 3.12Å; F417-I440 HydrophobicContact CD2-CD1 4.42Å; F417-I440 HydrophobicContact CD2-CG1 4.23Å; F417-I440 HydrophobicContact CE2-CD1 3.81Å; F417-I440 HydrophobicContact CE2-CG1 3.91Å; V438-I440 HydrophobicContact CG2-CG2 4.19Å
441	T	84.4	Confident	84.7	Confident	63 Å²	63	58.9 Å²	58.9	39%	0.387	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	121.2	174.9	-51.7	0	0	0	0	109.3	I338 N414	I338-T441 WeakPolarHBondContact CD1-O 3.5Å; N414-T441 WeakPolarHBondContact OD1-CB 3.18Å; N414-T441 VanDerWaalsContact OD1-CG2 3.23Å; N414-T441 WeakPolarHBondContact OD1-CG2 3.5Å; N414-T441 PolarHBondContact OD1-OG1 2.81Å
442	T	82.5	Confident	84.7	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.018	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-66.4	154.8	180	47.4	0	0	0	0	112.7	L409 L410 H412 T413 Y415	L409-T442 HydrophobicContact CB-CG2 3.84Å; L409-T442 HydrophobicContact CD1-CG2 4.03Å; L410-T442 WeakPolarHBondContact O-CB 3.5Å; L410-T442 PolarHBondContact O-OG1 3.07Å; H412-T442 WeakPolarHBondContact CA-O 3.17Å; H412-T442 PolarHBondContact N-O 3.25Å; H412-T442 PolarHBondContact N-OG1 2.94Å; T413-T442 PolarHBondContact N-OG1 2.8Å; T413-T442 PolarHBondContact O-N 3.26Å; T413-T442 PolarHBondContact O-OG1 2.97Å; Y415-T442 HydrophobicContact CD2-CG2 4.28Å; Y415-T442 HydrophobicContact CE2-CG2 4.45Å
443	N	76.3	Confident	84.9	Confident	82 Å²	82	49.1 Å²	49.1	44%	0.439	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-68.2	164.2	-178.8	-72.2	-28	0	0	0	112.3	E340 A411 H412	E340-N443 PolarHBondContact O-N 2.97Å; A411-N443 WeakPolarHBondContact CB-O 2.93Å; H412-N443 PolarHBondContact N-O 2.91Å; H412-N443 VanDerWaalsContact N-O 3.17Å
444	Q	76.1	Confident	84.9	Confident	60 Å²	60	53 Å²	53	28%	0.28	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-73.2	147.9	172.8	-59.2	-172	24.8	0	0	110.5	N474 G475	Q444-N474 CarbonylContact C-O 3.55Å; Q444-N474 WeakPolarHBondContact CA-O 3.42Å; Q444-N474 WeakPolarHBondContact CB-O 3.4Å; Q444-G475 VanDerWaalsContact OE1-CA 3.28Å
445	A	73.3	Confident	84.8	Confident	30 Å²	30	52.9 Å²	52.9	25%	0.248	29%	0.292	C	S	.	.			trans	-127.1	173.1	174.9	0	0	0	0	0	110.7	A411 N474 T523	A411-A445 HydrophobicContact CB-CB 3.88Å; A445-N474 HydrophobicContact CB-CB 4.09Å; A445-N474 PolarHBondContact N-O 3.42Å; A445-N474 WeakPolarHBondContact O-CB 3.41Å; A445-T523 PolarHBondContact O-OG1 3.02Å
446	A	78.6	Confident	84.4	Confident	41 Å²	41	52.1 Å²	52.1	34%	0.339	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-60.8	138	176.1	0	0	0	0	0	110.6	N474	A446-N474 PolarHBondContact O-ND2 3.04Å
447	P	85	Confident	83.9	Confident	6 Å²	6	58.8 Å²	58.8	4%	0.039	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-62.7	157.8	178	-22.5	32.8	0	0	0	112.8	P470 A521 T523 G528	P447-P470 HydrophobicContact CB-CB 4.15Å; P447-P470 HydrophobicContact CB-CG 3.94Å; P447-A521 HydrophobicContact CB-CB 4.04Å; P447-A521 HydrophobicContact CG-CB 3.96Å; P447-T523 HydrophobicContact CG-CG2 3.43Å; P447-T523 VanDerWaalsContact CG-CG2 3.43Å; P447-G528 VanDerWaalsContact O-CA 3.26Å; P447-G528 WeakPolarHBondContact O-CA 3.5Å
448	S	82.5	Confident	83.4	Confident	25 Å²	25	58.6 Å²	58.6	18%	0.175	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-63.2	161.1	163.9	62.1	0	0	0	0	111.5	P470 D471 R472	S448-P470 VanDerWaalsContact O-CB 3.24Å; S448-P470 WeakPolarHBondContact O-CB 3.46Å; S448-P470 WeakPolarHBondContact O-CG 2.87Å; S448-P470 WeakPolarHBondContact OG-CB 3.2Å; S448-D471 PolarHBondContact OG-N 3.47Å; S448-R472 PolarHBondContact N-O 3.4Å; S448-R472 PolarHBondContact OG-N 3.4Å; S448-R472 PolarHBondContact OG-O 3.28Å
449	P	86.3	Confident	82.9	Confident	48 Å²	48	59.6 Å²	59.6	31%	0.312	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-63.2	148.6	174.4	24.9	-33.3	0	0	0	111.4	T451 A529	P449-T451 PolarHBondContact O-N 3.25Å; P449-A529 WeakPolarHBondContact CA-O 3.41Å; P449-A529 HydrophobicContact CB-CB 4.17Å; P449-A529 WeakPolarHBondContact CB-O 3.45Å; P449-A529 HydrophobicContact CG-CB 4.41Å
450	V	87.3	Confident	82.3	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-72.5	123.1	169.8	174.7	0	0	0	0	108.1	I453 W467 Q468 P470 Y480 S531	V450-I453 HydrophobicContact CG1-CG1 4.33Å; V450-W467 HydrophobicContact CG1-CB 3.79Å; V450-W467 HydrophobicContact CG1-CG 4.09Å; V450-Q468 WeakPolarHBondContact CG1-O 3.32Å; V450-P470 HydrophobicContact CG2-CG 3.94Å; V450-Y480 HydrophobicContact CG2-CD1 4.35Å; V450-Y480 HydrophobicContact CG2-CE1 4.03Å; V450-S531 WeakPolarHBondContact O-CB 3.31Å
451	T	83.9	Confident	82.2	Confident	83 Å²	83	62.8 Å²	62.8	51%	0.509	33%	0.326	S	S	.	.			trans	-100	-24.6	-174.8	49.4	0	0	0	0	113.1	P449	P449-T451 PolarHBondContact O-N 3.25Å
452	V	84.6	Confident	82.3	Confident	50 Å²	50	60.8 Å²	60.8	30%	0.303	31%	0.314	S	S	.	.			trans	-117.1	112.4	-173.5	-176.3	0	0	0	0	110.7	W467 Q468	V452-W467 VanDerWaalsContact O-CA 3.24Å; V452-W467 WeakPolarHBondContact O-CA 3.47Å; V452-W467 WeakPolarHBondContact O-CB 3.46Å; V452-Q468 HydrophobicContact CB-CB 4.26Å; V452-Q468 PolarHBondContact O-N 3.48Å
453	I	88.2	Confident	82.7	Confident	25 Å²	25	60.6 Å²	60.6	13%	0.128	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.8	175.6	-55.9	172.9	0	0	0	109	V450 W467 L517 I519 S531 F534	V450-I453 HydrophobicContact CG1-CG1 4.33Å; I453-W467 HydrophobicContact CG1-CB 4.24Å; I453-L517 HydrophobicContact CD1-CD2 4.33Å; I453-I519 HydrophobicContact CD1-CB 4.47Å; I453-I519 HydrophobicContact CD1-CD1 3.75Å; I453-I519 HydrophobicContact CD1-CG1 3.92Å; I453-I519 HydrophobicContact CG1-CD1 4.02Å; I453-I519 HydrophobicContact CG2-CD1 4.29Å; I453-S531 WeakPolarHBondContact CD1-OG 3.29Å; I453-F534 HydrophobicContact CB-CD2 4.08Å; I453-F534 HydrophobicContact CB-CE2 4.44Å; I453-F534 HydrophobicContact CB-CG 4.33Å; I453-F534 HydrophobicContact CD1-CB 4.09Å; I453-F534 HydrophobicContact CG2-CD1 4.15Å; I453-F534 HydrophobicContact CG2-CD2 4.14Å; I453-F534 HydrophobicContact CG2-CE1 4.38Å; I453-F534 HydrophobicContact CG2-CE2 4.37Å; I453-F534 HydrophobicContact CG2-CG 4.03Å; I453-F534 HydrophobicContact CG2-CZ 4.49Å
454	R	87.2	Confident	83.3	Confident	166 Å²	166	57.6 Å²	57.6	63%	0.626	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.9	-177.2	-62.6	-178.3	179.1	175.1	0.7	110.2	L465 S466	R454-L465 CarbonylContact O-C 3.52Å; R454-L465 VanDerWaalsContact O-CA 3.3Å; R454-L465 WeakPolarHBondContact O-CA 3.31Å; R454-S466 WeakPolarHBondContact CA-O 3.41Å; R454-S466 PolarHBondContact N-O 3.31Å; R454-S466 PolarHBondContact O-N 2.87Å
455	K	84.1	Confident	83.9	Confident	100 Å²	100	54.8 Å²	54.8	44%	0.435	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123.5	175.2	-180	-176	176.9	-179.6	0	109.6	T458 V463 L465 F534	K455-T458 WeakPolarHBondContact CE-OG1 3.39Å; K455-T458 PolarHBondContact NZ-OG1 2.96Å; K455-V463 HydrophobicContact CG-CG2 4.24Å; K455-L465 HydrophobicContact CB-CD2 4.16Å; K455-L465 HydrophobicContact CG-CD2 4.39Å; K455-F534 HydrophobicContact CB-CE1 4.33Å; K455-F534 HydrophobicContact CB-CZ 4.08Å
456	E	84.8	Confident	84.8	Confident	114 Å²	114	54.3 Å²	54.3	53%	0.533	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-56.2	-175.7	-61.9	-171.6	170.1	0	0	112.6	S464 S466	E456-S464 PolarHBondContact N-O 3Å; E456-S466 WeakPolarHBondContact OE1-CB 3.21Å; E456-S466 PolarHBondContact OE1-OG 3.41Å
457	K	81	Confident	85.4	Confident	157 Å²	157	53.1 Å²	53.1	68%	0.683	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.8	-176.1	-66.3	-176.9	-178.7	176.5	0	111.4	V463 S464	K457-V463 CarbonylContact O-C 3.56Å; K457-V463 WeakPolarHBondContact O-CA 3.42Å; K457-V463 WeakPolarHBondContact O-CG2 3.49Å; K457-S464 PolarHBondContact N-O 3.39Å; K457-S464 PolarHBondContact O-N 2.75Å
458	T	79.9	Confident	85.6	Confident	56 Å²	56	58.3 Å²	58.3	34%	0.344	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	137.4	177.9	-56	0	0	0	0	110.6	K455 E537	K455-T458 WeakPolarHBondContact CE-OG1 3.39Å; K455-T458 PolarHBondContact NZ-OG1 2.96Å; T458-E537 VanDerWaalsContact CG2-O 3.27Å; T458-E537 WeakPolarHBondContact CG2-O 3.49Å
459	S	80	Confident	85.8	Confident	48 Å²	48	62.2 Å²	62.2	34%	0.336	31%	0.307	S	S	.	.			trans	-128.2	-177.7	179.5	-172.1	0	0	0	0	110.1	N461 S462 S539	S459-N461 PolarHBondContact O-N 3.37Å; S459-S462 VanDerWaalsContact CB-OG 3.24Å; S459-S462 WeakPolarHBondContact CB-OG 3.46Å; S459-S462 PolarHBondContact N-O 3.14Å; S459-S539 PolarHBondContact O-N 3.32Å; S459-S539 PolarHBondContact O-OG 2.91Å
460	R	77.4	Confident	85.8	Confident	94 Å²	94	60.1 Å²	60.1	36%	0.355	29%	0.293	S	S	.	.	S	Bend	trans	-58.7	-32.8	177.5	67	178.8	-62.7	158.9	-11.7	113	P511 S539 D541 S542	R460-P511 WeakPolarHBondContact O-CA 3.38Å; R460-P511 WeakPolarHBondContact O-CB 3.33Å; R460-S539 WeakPolarHBondContact CA-O 3.47Å; R460-S539 WeakPolarHBondContact CA-OG 3.31Å; R460-S539 PolarHBondContact N-OG 3.03Å; R460-D541 HydrophobicContact CB-CB 3.7Å; R460-D541 VanDerWaalsContact CB-OD2 3.22Å; R460-D541 WeakPolarHBondContact CB-OD2 3.37Å; R460-D541 WeakPolarHBondContact CD-OD2 3.44Å; R460-D541 HydrophobicContact CG-CB 4.45Å; R460-D541 IonicContact CZ-OD2 3.08Å; R460-D541 IonicContact NE-OD2 3.02Å; R460-D541 PolarHBondContact NE-OD2 3.02Å; R460-D541 IonicContact NH1-OD1 3.57Å; R460-D541 IonicContact NH1-OD2 2.79Å; R460-D541 PolarHBondContact NH1-OD2 3.05Å; R460-S542 PolarHBondContact NH2-O 3.23Å
461	N	83.9	Confident	85.6	Confident	68 Å²	68	65.8 Å²	65.8	36%	0.364	32%	0.323	S	S	.	.	S	Bend	trans	-137.8	11.8	-170.6	63.2	-3.3	0	0	0	112.1	S459 N507 G508 L509	S459-N461 PolarHBondContact O-N 3.37Å; N461-N507 CarbonylContact O-C 3.45Å; N461-N507 WeakPolarHBondContact O-CA 2.95Å; N461-G508 PolarHBondContact O-N 2.92Å; N461-L509 VanDerWaalsContact CA-O 3.3Å; N461-L509 WeakPolarHBondContact CA-O 3.49Å; N461-L509 WeakPolarHBondContact CB-O 3.45Å; N461-L509 PolarHBondContact O-N 3Å
462	S	86.6	Confident	85.3	Confident	20 Å²	20	69.7 Å²	69.7	14%	0.14	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	153.9	-178.9	68.8	0	0	0	0	114.7	S459 L506 N507	S459-S462 VanDerWaalsContact CB-OG 3.24Å; S459-S462 WeakPolarHBondContact CB-OG 3.46Å; S459-S462 PolarHBondContact N-O 3.14Å; S462-L506 CarbonylContact C-O 3.36Å; S462-L506 WeakPolarHBondContact CA-O 3Å; S462-L506 WeakPolarHBondContact CB-O 3.23Å; S462-N507 WeakPolarHBondContact CB-OD1 2.92Å
463	V	89.2	Confident	84.8	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.3	171	68.6	0	0	0	0	109.6	K455 K457 L465 T505 L506 L509 F536	K455-V463 HydrophobicContact CG-CG2 4.24Å; K457-V463 CarbonylContact O-C 3.56Å; K457-V463 WeakPolarHBondContact O-CA 3.42Å; K457-V463 WeakPolarHBondContact O-CG2 3.49Å; V463-L465 HydrophobicContact CG1-CD1 4.23Å; V463-L465 HydrophobicContact CG1-CG 4.33Å; V463-L465 HydrophobicContact CG2-CD2 4.06Å; V463-L465 HydrophobicContact CG2-CG 4.25Å; V463-T505 CarbonylContact O-C 3.55Å; V463-T505 WeakPolarHBondContact O-CA 3.29Å; V463-L506 HydrophobicContact CG1-CB 3.93Å; V463-L506 HydrophobicContact CG1-CD1 3.92Å; V463-L506 HydrophobicContact CG1-CG 4.14Å; V463-L506 PolarHBondContact N-O 3.44Å; V463-L506 PolarHBondContact O-N 3.26Å; V463-L509 HydrophobicContact CB-CD1 4.47Å; V463-L509 HydrophobicContact CG1-CD1 4.02Å; V463-F536 HydrophobicContact CB-CD2 3.98Å; V463-F536 HydrophobicContact CB-CE2 3.91Å; V463-F536 HydrophobicContact CG1-CD1 4.47Å; V463-F536 HydrophobicContact CG1-CD2 3.8Å; V463-F536 HydrophobicContact CG1-CE1 4.07Å; V463-F536 HydrophobicContact CG1-CE2 3.36Å; V463-F536 HydrophobicContact CG1-CG 4.34Å; V463-F536 HydrophobicContact CG1-CZ 3.51Å; V463-F536 HydrophobicContact CG2-CD2 4.04Å; V463-F536 HydrophobicContact CG2-CE2 4.44Å; V463-F536 HydrophobicContact CG2-CG 4.34Å
464	S	88.9	Confident	84.3	Confident	18 Å²	18	70.4 Å²	70.4	13%	0.126	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132	170.8	-58	0	0	0	0	110.3	E456 K457 V504 T505	E456-S464 PolarHBondContact N-O 3Å; K457-S464 PolarHBondContact N-O 3.39Å; K457-S464 PolarHBondContact O-N 2.75Å; S464-V504 CarbonylContact C-O 3.46Å; S464-V504 WeakPolarHBondContact CA-O 3.48Å; S464-T505 VanDerWaalsContact OG-CG2 3.31Å; S464-T505 WeakPolarHBondContact OG-CG2 3.3Å; S464-T505 PolarHBondContact OG-OG1 3.31Å
465	L	90.1	Very high	83.8	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	148.6	-173.9	-58.2	163.4	0	0	0	110	R454 K455 V463 N503 V504 L506 L517 F534	R454-L465 CarbonylContact O-C 3.52Å; R454-L465 VanDerWaalsContact O-CA 3.3Å; R454-L465 WeakPolarHBondContact O-CA 3.31Å; K455-L465 HydrophobicContact CB-CD2 4.16Å; K455-L465 HydrophobicContact CG-CD2 4.39Å; V463-L465 HydrophobicContact CG1-CD1 4.23Å; V463-L465 HydrophobicContact CG1-CG 4.33Å; V463-L465 HydrophobicContact CG2-CD2 4.06Å; V463-L465 HydrophobicContact CG2-CG 4.25Å; L465-N503 CarbonylContact O-C 3.56Å; L465-N503 VanDerWaalsContact O-CA 3.27Å; L465-N503 WeakPolarHBondContact O-CA 3.49Å; L465-V504 HydrophobicContact CB-CG1 4.34Å; L465-V504 PolarHBondContact N-O 2.74Å; L465-V504 PolarHBondContact O-N 3.47Å; L465-L506 HydrophobicContact CD1-CD1 4.22Å; L465-L517 HydrophobicContact CD1-CD1 3.3Å; L465-L517 HydrophobicContact CD1-CD2 4.29Å; L465-L517 HydrophobicContact CD1-CG 4.44Å; L465-F534 HydrophobicContact CD2-CD1 4.31Å; L465-F534 HydrophobicContact CD2-CE1 3.77Å
466	S	91.6	Very high	83.7	Confident	21 Å²	21	63.5 Å²	63.5	15%	0.147	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.3	168.8	53.6	0	0	0	0	111.5	R454 E456 C502	R454-S466 WeakPolarHBondContact CA-O 3.41Å; R454-S466 PolarHBondContact N-O 3.31Å; R454-S466 PolarHBondContact O-N 2.87Å; E456-S466 WeakPolarHBondContact OE1-CB 3.21Å; E456-S466 PolarHBondContact OE1-OG 3.41Å; S466-C502 CarbonylContact C-O 3.51Å; S466-C502 VanDerWaalsContact CA-O 3.22Å; S466-C502 WeakPolarHBondContact CA-O 3.48Å
467	W	91.3	Very high	83.6	Confident	15 Å²	15	59.7 Å²	59.7	6%	0.057	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	167.9	-179.2	56.7	91.3	0	0	0	111.8	V450 V452 I453 Y480 I482 A499 G501 C502 V504 I519	V450-W467 HydrophobicContact CG1-CB 3.79Å; V450-W467 HydrophobicContact CG1-CG 4.09Å; V452-W467 VanDerWaalsContact O-CA 3.24Å; V452-W467 WeakPolarHBondContact O-CA 3.47Å; V452-W467 WeakPolarHBondContact O-CB 3.46Å; I453-W467 HydrophobicContact CG1-CB 4.24Å; W467-Y480 AromaticContact CD1-CE1 3.83Å; W467-Y480 AromaticContact CE2-CD1 3.93Å; W467-Y480 AromaticContact CE2-CG 3.82Å; W467-Y480 HydrophobicContact CZ2-CD1 4.23Å; W467-Y480 AromaticContact CZ2-CD2 3.94Å; W467-Y480 HydrophobicContact CZ2-CD2 3.94Å; W467-Y480 AromaticContact CZ2-CG 3.67Å; W467-Y480 HydrophobicContact CZ2-CG 3.67Å; W467-Y480 AromaticContact NE1-CD1 3.14Å; W467-Y480 AromaticContact NE1-CD2 3.72Å; W467-Y480 AromaticContact NE1-CE1 3.22Å; W467-Y480 AromaticContact NE1-CE2 3.8Å; W467-Y480 AromaticContact NE1-CG 3.4Å; W467-Y480 AromaticContact NE1-CZ 3.57Å; W467-I482 HydrophobicContact CH2-CD1 3.91Å; W467-I482 HydrophobicContact CH2-CG1 4.06Å; W467-I482 HydrophobicContact CZ2-CD1 4.41Å; W467-I482 HydrophobicContact CZ3-CG1 4.49Å; W467-A499 HydrophobicContact CH2-CB 4.03Å; W467-A499 HydrophobicContact CZ2-CB 4.28Å; W467-G501 VanDerWaalsContact CZ2-O 3.28Å; W467-G501 WeakPolarHBondContact CZ2-O 3.34Å; W467-C502 HydrophobicContact CG-CB 4.48Å; W467-C502 PolarHBondContact N-O 2.97Å; W467-C502 WeakPolarHBondContact O-CB 3.5Å; W467-V504 HydrophobicContact CH2-CB 3.9Å; W467-V504 HydrophobicContact CH2-CG1 4.03Å; W467-V504 HydrophobicContact CZ3-CB 3.95Å; W467-V504 HydrophobicContact CZ3-CG1 3.69Å; W467-I519 HydrophobicContact CB-CD1 4.41Å; W467-I519 HydrophobicContact CD2-CD1 3.61Å; W467-I519 HydrophobicContact CD2-CG2 4.34Å; W467-I519 HydrophobicContact CE3-CD1 3.36Å; W467-I519 HydrophobicContact CG-CD1 4.1Å; W467-I519 HydrophobicContact CH2-CD1 4.46Å; W467-I519 HydrophobicContact CZ2-CG2 4.34Å; W467-I519 HydrophobicContact CZ3-CD1 3.82Å
468	Q	89.3	Confident	83.8	Confident	115 Å²	115	55.9 Å²	55.9	54%	0.537	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-93	151.4	172.9	-168.7	170.7	-2.1	0	0	110.7	V450 V452	V450-Q468 WeakPolarHBondContact CG1-O 3.32Å; V452-Q468 HydrophobicContact CB-CB 4.26Å; V452-Q468 PolarHBondContact O-N 3.48Å
469	E	86.8	Confident	84.1	Confident	108 Å²	108	54 Å²	54	51%	0.505	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-58.1	148.4	170.4	-60.3	-165.2	162.7	0	0	111.2	I477	E469-I477 HydrophobicContact CB-CD1 4.25Å; E469-I477 HydrophobicContact CG-CD1 4.41Å
470	P	86.3	Confident	84.7	Confident	4 Å²	4	52 Å²	52	3%	0.026	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-52.7	138.3	174.9	-26.9	34.6	0	0	0	113.7	P447 S448 V450 R472 P473 I477 A521	P447-P470 HydrophobicContact CB-CB 4.15Å; P447-P470 HydrophobicContact CB-CG 3.94Å; S448-P470 VanDerWaalsContact O-CB 3.24Å; S448-P470 WeakPolarHBondContact O-CB 3.46Å; S448-P470 WeakPolarHBondContact O-CG 2.87Å; S448-P470 WeakPolarHBondContact OG-CB 3.2Å; V450-P470 HydrophobicContact CG2-CG 3.94Å; P470-R472 PolarHBondContact O-N 3.02Å; P470-P473 WeakPolarHBondContact O-CD 3.48Å; P470-I477 HydrophobicContact CG-CD1 4.2Å; P470-A521 HydrophobicContact CG-CB 3.76Å
471	D	82.1	Confident	85.4	Confident	118 Å²	118	48 Å²	48	63%	0.631	24%	0.243	S	C	*	.	S	Bend	trans	-53.4	-30.9	177.8	-66.2	-37.7	0	0	0	113.5	S448	S448-D471 PolarHBondContact OG-N 3.47Å
472	R	77.3	Confident	85.7	Confident	166 Å²	166	44.7 Å²	44.7	63%	0.626	23%	0.226	S	C	*	.			trans	-125.7	92.1	172.4	-57	-176.4	-164.9	174.3	6.1	109	S448 P470 N474	S448-R472 PolarHBondContact N-O 3.4Å; S448-R472 PolarHBondContact OG-N 3.4Å; S448-R472 PolarHBondContact OG-O 3.28Å; P470-R472 PolarHBondContact O-N 3.02Å; R472-N474 PolarHBondContact O-N 3.33Å
473	P	75.3	Confident	85.9	Confident	45 Å²	45	45.7 Å²	45.7	29%	0.292	23%	0.228	S	C	.	.			trans	-61.3	-28.6	178.1	-23.3	33.8	0	0	0	112.4	P470 G475 I477 T523	P470-P473 WeakPolarHBondContact O-CD 3.48Å; P473-G475 WeakPolarHBondContact CB-O 3.42Å; P473-G475 PolarHBondContact O-N 3.24Å; P473-I477 HydrophobicContact CB-CD1 4.27Å; P473-I477 HydrophobicContact CB-CG1 4.35Å; P473-T523 WeakPolarHBondContact O-CG2 3.48Å
474	N	76.7	Confident	85.9	Confident	45 Å²	45	46.7 Å²	46.7	24%	0.241	23%	0.232	C	C	.	.			trans	52.9	18.6	-179.1	-64.6	-28.3	0	0	0	114.2	A411 Q444 A445 A446 R472	A411-N474 HydrophobicContact CB-CB 4.1Å; Q444-N474 CarbonylContact C-O 3.55Å; Q444-N474 WeakPolarHBondContact CA-O 3.42Å; Q444-N474 WeakPolarHBondContact CB-O 3.4Å; A445-N474 HydrophobicContact CB-CB 4.09Å; A445-N474 PolarHBondContact N-O 3.42Å; A445-N474 WeakPolarHBondContact O-CB 3.41Å; A446-N474 PolarHBondContact O-ND2 3.04Å; R472-N474 PolarHBondContact O-N 3.33Å
475	G	78.1	Confident	85.8	Confident	12 Å²	12	46.9 Å²	46.9	12%	0.124	23%	0.23	C	C	.	.	S	Bend	trans	155.7	-168	-173.5	0	0	0	0	0	111.5	Q444 P473	Q444-G475 VanDerWaalsContact OE1-CA 3.28Å; P473-G475 WeakPolarHBondContact CB-O 3.42Å; P473-G475 PolarHBondContact O-N 3.24Å
476	I	81.4	Confident	85.6	Confident	109 Å²	109	48.3 Å²	48.3	56%	0.559	24%	0.236	S	C	*	.			trans	-88.4	122.6	176.6	-57.1	172.4	0	0	0	108.2	L478 T523	I476-L478 PolarHBondContact O-N 3.43Å; I476-T523 WeakPolarHBondContact O-CG2 3.43Å
477	I	83.1	Confident	85	Confident	33 Å²	33	52.4 Å²	52.4	17%	0.169	25%	0.251	C	S	.	.			trans	-74.5	123.6	178.8	-57.7	174.6	0	0	0	109.1	E469 P470 P473 Y480 A521	E469-I477 HydrophobicContact CB-CD1 4.25Å; E469-I477 HydrophobicContact CG-CD1 4.41Å; P470-I477 HydrophobicContact CG-CD1 4.2Å; P473-I477 HydrophobicContact CB-CD1 4.27Å; P473-I477 HydrophobicContact CB-CG1 4.35Å; I477-Y480 WeakPolarHBondContact CD1-OH 3.47Å; I477-Y480 HydrophobicContact CG2-CD2 4.46Å; I477-Y480 HydrophobicContact CG2-CE1 4.34Å; I477-Y480 HydrophobicContact CG2-CE2 3.83Å; I477-A521 HydrophobicContact CG2-CB 4.25Å
478	L	85.3	Confident	84	Confident	77 Å²	77	60.8 Å²	60.8	40%	0.403	29%	0.291	S	S	.	.			trans	-90	-48.6	-176.9	-59.7	178	0	0	0	111.6	I476 R522	I476-L478 PolarHBondContact O-N 3.43Å; L478-R522 VanDerWaalsContact CD1-NH1 3.27Å; L478-R522 PolarHBondContact N-O 3.41Å
479	D	86.6	Confident	82.9	Confident	18 Å²	18	59.8 Å²	59.8	10%	0.096	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	172.8	174.7	58.8	27	0	0	0	111.5	A499 R522	D479-A499 CarbonylContact C-O 3.54Å; D479-A499 WeakPolarHBondContact CA-O 3.33Å; D479-A499 WeakPolarHBondContact CB-O 3.33Å; D479-R522 PolarHBondContact O-N 2.99Å; D479-R522 WeakPolarHBondContact OD1-CB 3.48Å; D479-R522 IonicContact OD1-CZ 3.97Å; D479-R522 IonicContact OD1-NE 3.45Å; D479-R522 PolarHBondContact OD1-NE 3.37Å; D479-R522 IonicContact OD1-NH2 3.29Å; D479-R522 PolarHBondContact OD1-NH2 3.45Å; D479-R522 IonicContact OD2-CZ 2.8Å; D479-R522 IonicContact OD2-NE 3.49Å; D479-R522 IonicContact OD2-NH2 2.7Å; D479-R522 PolarHBondContact OD2-NH2 3.4Å
480	Y	91.3	Very high	81.7	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	140.4	173.2	-63.3	-90.7	0	0	0	109.5	V450 W467 I477 R498 A499 G501 I519 R520 A521	V450-Y480 HydrophobicContact CG2-CD1 4.35Å; V450-Y480 HydrophobicContact CG2-CE1 4.03Å; W467-Y480 AromaticContact CD1-CE1 3.83Å; W467-Y480 AromaticContact CE2-CD1 3.93Å; W467-Y480 AromaticContact CE2-CG 3.82Å; W467-Y480 HydrophobicContact CZ2-CD1 4.23Å; W467-Y480 AromaticContact CZ2-CD2 3.94Å; W467-Y480 HydrophobicContact CZ2-CD2 3.94Å; W467-Y480 AromaticContact CZ2-CG 3.67Å; W467-Y480 HydrophobicContact CZ2-CG 3.67Å; W467-Y480 AromaticContact NE1-CD1 3.14Å; W467-Y480 AromaticContact NE1-CD2 3.72Å; W467-Y480 AromaticContact NE1-CE1 3.22Å; W467-Y480 AromaticContact NE1-CE2 3.8Å; W467-Y480 AromaticContact NE1-CG 3.4Å; W467-Y480 AromaticContact NE1-CZ 3.57Å; I477-Y480 WeakPolarHBondContact CD1-OH 3.47Å; I477-Y480 HydrophobicContact CG2-CD2 4.46Å; I477-Y480 HydrophobicContact CG2-CE1 4.34Å; I477-Y480 HydrophobicContact CG2-CE2 3.83Å; Y480-R498 CarbonylContact O-C 3.57Å; Y480-R498 VanDerWaalsContact O-CA 3.27Å; Y480-R498 WeakPolarHBondContact O-CA 3.22Å; Y480-A499 PolarHBondContact N-O 2.86Å; Y480-A499 PolarHBondContact O-N 3.39Å; Y480-G501 WeakPolarHBondContact CD2-O 3.47Å; Y480-I519 HydrophobicContact CD1-CG2 4.09Å; Y480-R520 CarbonylContact C-O 3.57Å; Y480-R520 WeakPolarHBondContact CA-O 3.15Å; Y480-A521 HydrophobicContact CD1-CB 3.74Å; Y480-A521 HydrophobicContact CE1-CB 3.56Å
481	E	91.9	Very high	80.5	Confident	10 Å²	10	67.7 Å²	67.7	5%	0.047	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.4	173.3	-171	174.6	78.4	0	0	109.8	I496 R498 I519 R520 Y527	E481-I496 HydrophobicContact CG-CG2 3.34Å; E481-R498 HydrophobicContact CG-CG 4.41Å; E481-R498 IonicContact OE2-CZ 3.58Å; E481-R498 IonicContact OE2-NE 2.78Å; E481-R498 PolarHBondContact OE2-NE 3.07Å; E481-R498 IonicContact OE2-NH2 3.55Å; E481-R498 PolarHBondContact OE2-NH2 3.24Å; E481-I519 WeakPolarHBondContact O-CA 3.45Å; E481-R520 HydrophobicContact CB-CG 4.04Å; E481-R520 PolarHBondContact N-O 3.12Å; E481-R520 PolarHBondContact O-N 2.8Å; E481-R520 IonicContact OE1-CZ 2.92Å; E481-R520 IonicContact OE1-NE 3.23Å; E481-R520 PolarHBondContact OE1-NE 2.98Å; E481-R520 IonicContact OE1-NH2 2.63Å; E481-R520 PolarHBondContact OE1-NH2 3.24Å; E481-Y527 HydrophobicContact CB-CD1 4.38Å; E481-Y527 HydrophobicContact CB-CE1 3.69Å; E481-Y527 PolarHBondContact OE2-OH 3.43Å
482	I	91.5	Very high	79.5	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	109.8	-175.6	-56.9	91.7	0	0	0	107.3	W467 I496 L497 A499 V504 L506 L517 Q518 I519	W467-I482 HydrophobicContact CH2-CD1 3.91Å; W467-I482 HydrophobicContact CH2-CG1 4.06Å; W467-I482 HydrophobicContact CZ2-CD1 4.41Å; W467-I482 HydrophobicContact CZ3-CG1 4.49Å; I482-I496 CarbonylContact O-C 3.56Å; I482-I496 WeakPolarHBondContact O-CA 3.47Å; I482-L497 HydrophobicContact CD1-CD2 4.32Å; I482-L497 WeakPolarHBondContact CD1-O 3.23Å; I482-L497 PolarHBondContact N-O 3.33Å; I482-L497 PolarHBondContact O-N 3.39Å; I482-A499 HydrophobicContact CD1-CB 3.78Å; I482-V504 HydrophobicContact CD1-CG2 4.48Å; I482-V504 HydrophobicContact CG1-CG1 4.4Å; I482-L506 HydrophobicContact CG2-CD2 4.4Å; I482-L517 HydrophobicContact CG2-CD1 3.47Å; I482-L517 VanDerWaalsContact CG2-CD1 3.47Å; I482-L517 HydrophobicContact CG2-CD2 4.18Å; I482-L517 HydrophobicContact CG2-CG 3.74Å; I482-Q518 WeakPolarHBondContact CA-O 3.05Å; I482-I519 HydrophobicContact CG1-CG1 4.25Å; I482-I519 HydrophobicContact CG1-CG2 4.4Å; I482-I519 HydrophobicContact CG2-CG1 4.49Å
483	K	89.2	Confident	79.3	Confident	40 Å²	40	62.6 Å²	62.6	17%	0.174	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.4	173.4	179.9	-173.4	178	-165.4	0	108.1	E491 Y494 T495 I496 L517 Q518	K483-E491 IonicContact NZ-OE1 2.74Å; K483-E491 PolarHBondContact NZ-OE1 2.75Å; K483-Y494 HydrophobicContact CD-CD2 4.17Å; K483-Y494 HydrophobicContact CD-CG 4.27Å; K483-Y494 HydrophobicContact CG-CD2 3.87Å; K483-Y494 HydrophobicContact CG-CG 4.12Å; K483-T495 WeakPolarHBondContact CA-O 3.33Å; K483-I496 HydrophobicContact CB-CG1 4.47Å; K483-L517 CarbonylContact O-C 3.57Å; K483-L517 VanDerWaalsContact O-CA 3.31Å; K483-L517 WeakPolarHBondContact O-CA 3.32Å; K483-Q518 PolarHBondContact N-O 3.48Å; K483-Q518 PolarHBondContact O-N 3.42Å
484	Y	89.7	Confident	79.6	Confident	22 Å²	22	66.1 Å²	66.1	9%	0.086	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	149.5	174.1	69.6	-85.3	0	0	0	112.4	T495 L506 L509 Y515 L516	Y484-T495 HydrophobicContact CE1-CG2 3.82Å; Y484-T495 PolarHBondContact N-O 2.99Å; Y484-T495 PolarHBondContact O-N 2.87Å; Y484-T495 WeakPolarHBondContact OH-CG2 3.25Å; Y484-L506 HydrophobicContact CD1-CD1 3.76Å; Y484-L506 HydrophobicContact CD1-CD2 4.06Å; Y484-L506 HydrophobicContact CD2-CD1 4.43Å; Y484-L506 HydrophobicContact CE1-CD1 4.09Å; Y484-L506 HydrophobicContact CE1-CD2 3.82Å; Y484-L506 HydrophobicContact CE1-CG 4.43Å; Y484-L506 HydrophobicContact CG-CD1 3.94Å; Y484-L509 HydrophobicContact CD2-CD2 3.95Å; Y484-L509 HydrophobicContact CE2-CD2 3.34Å; Y484-Y515 AromaticContact CD2-CD1 4Å; Y484-Y515 HydrophobicContact CD2-CD1 4Å; Y484-Y515 HydrophobicContact CD2-CE1 4.42Å; Y484-L516 CarbonylContact C-O 3.55Å; Y484-L516 WeakPolarHBondContact CA-O 3.45Å; Y484-L516 WeakPolarHBondContact CB-O 3.46Å
485	Y	87.2	Confident	80	Confident	22 Å²	22	67.3 Å²	67.3	9%	0.086	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	160.4	-177.2	55.6	-82.2	0	0	0	110.8	E491 Y515 L516	Y485-E491 HydrophobicContact CE1-CG 4.5Å; Y485-E491 HydrophobicContact CE2-CG 4.2Å; Y485-Y515 CarbonylContact O-C 3.49Å; Y485-Y515 VanDerWaalsContact O-CA 3.26Å; Y485-Y515 WeakPolarHBondContact O-CA 3.27Å; Y485-Y515 WeakPolarHBondContact O-CD1 3.38Å; Y485-L516 HydrophobicContact CD2-CB 4.43Å; Y485-L516 HydrophobicContact CE1-CB 4.09Å; Y485-L516 HydrophobicContact CE2-CB 3.95Å; Y485-L516 HydrophobicContact CE2-CD1 3.76Å; Y485-L516 HydrophobicContact CE2-CG 4.43Å; Y485-L516 PolarHBondContact N-O 2.87Å; Y485-L516 PolarHBondContact O-N 2.94Å
486	E	84.8	Confident	80.3	Confident	30 Å²	30	70.3 Å²	70.3	14%	0.14	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	141.2	178.9	-67.8	178	-164.5	0	0	110.1	E488 K510 T513 Y515	E486-E488 VanDerWaalsContact C-N 3.27Å; E486-E488 PolarHBondContact O-N 3.48Å; E486-K510 VanDerWaalsContact CD-NZ 3.28Å; E486-K510 WeakPolarHBondContact OE1-CD 3.23Å; E486-K510 WeakPolarHBondContact OE1-CE 3.46Å; E486-K510 IonicContact OE1-NZ 3.93Å; E486-K510 PolarHBondContact OE1-NZ 2.63Å; E486-K510 IonicContact OE2-NZ 3.42Å; E486-K510 PolarHBondContact OE2-NZ 3.09Å; E486-T513 HydrophobicContact CB-CG2 4.38Å; E486-T513 HydrophobicContact CG-CG2 3.88Å; E486-Y515 HydrophobicContact CB-CE1 4.35Å; E486-Y515 HydrophobicContact CG-CD1 3.81Å; E486-Y515 HydrophobicContact CG-CE1 3.19Å; E486-Y515 HydrophobicContact CG-CE2 4.48Å; E486-Y515 PolarHBondContact OE1-OH 3.17Å
487	K	80.7	Confident	80.7	Confident	107 Å²	107	68 Å²	68	47%	0.465	34%	0.335	S	S	.	.	S	Bend	trans	-68.5	-26.8	-175.3	-174.5	176	175.5	179.5	0	112.9	A514 L516	K487-A514 HydrophobicContact CB-CB 4.01Å; K487-A514 WeakPolarHBondContact CB-O 3.48Å; K487-A514 HydrophobicContact CD-CB 4.19Å; K487-A514 PolarHBondContact N-O 3.39Å; K487-L516 HydrophobicContact CB-CG 4.4Å; K487-L516 HydrophobicContact CG-CD1 4.3Å; K487-L516 HydrophobicContact CG-CG 4.36Å
488	E	70	Confident	80.9	Confident	191 Å²	191	73.8 Å²	73.8	89%	0.893	36%	0.355	S	S	*	.	S	Bend	trans	-88.1	-28.2	-176.3	-66.4	-175.6	174.8	0	0	113.4	E486	E486-E488 VanDerWaalsContact C-N 3.27Å; E486-E488 PolarHBondContact O-N 3.48Å
489	E	65.3	Low	81	Confident	95 Å²	95	70.7 Å²	70.7	44%	0.444	34%	0.34	S	S	.	.	S	Bend	trans	-84.7	123.3	168.9	-72.8	-176.4	173.5	0	0	108.5	S493	E489-S493 WeakPolarHBondContact OE2-CB 3.24Å; E489-S493 PolarHBondContact OE2-OG 3.21Å
490	Q	61.8	Low	80.9	Confident	170 Å²	170	80.9 Å²	80.9	79%	0.794	38%	0.377	S	S	*	.			trans	-56	163.7	172.4	-73.7	178.1	-7.3	0	0	110.6	T492	Q490-T492 PolarHBondContact O-N 2.93Å; Q490-T492 PolarHBondContact O-OG1 3.17Å
491	E	61.8	Low	80.7	Confident	108 Å²	108	82.1 Å²	82.1	51%	0.505	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	6.3	-170	-99.1	-164.1	130.2	0	0	119	K483 Y485 Y494	K483-E491 IonicContact NZ-OE1 2.74Å; K483-E491 PolarHBondContact NZ-OE1 2.75Å; Y485-E491 HydrophobicContact CE1-CG 4.5Å; Y485-E491 HydrophobicContact CE2-CG 4.2Å; E491-Y494 WeakPolarHBondContact O-CD1 3.47Å
492	T	59.8	Low	80.6	Confident	130 Å²	130	83.5 Å²	83.5	80%	0.798	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-19.2	-177.3	54	0	0	0	0	114.6	Q490	Q490-T492 PolarHBondContact O-N 2.93Å; Q490-T492 PolarHBondContact O-OG1 3.17Å
493	S	73.3	Confident	80.4	Confident	47 Å²	47	88.4 Å²	88.4	33%	0.329	43%	0.428	S	S	.	.	S	Bend	trans	-121.7	70.7	-179.7	57.9	0	0	0	0	113.3	E489	E489-S493 WeakPolarHBondContact OE2-CB 3.24Å; E489-S493 PolarHBondContact OE2-OG 3.21Å
494	Y	81.7	Confident	80.4	Confident	118 Å²	118	87.3 Å²	87.3	46%	0.463	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	152.3	178.6	64.9	-92.3	0	0	0	113.7	K483 E491 I496	K483-Y494 HydrophobicContact CD-CD2 4.17Å; K483-Y494 HydrophobicContact CD-CG 4.27Å; K483-Y494 HydrophobicContact CG-CD2 3.87Å; K483-Y494 HydrophobicContact CG-CG 4.12Å; E491-Y494 WeakPolarHBondContact O-CD1 3.47Å; Y494-I496 HydrophobicContact CD2-CD1 4.14Å; Y494-I496 HydrophobicContact CD2-CG1 3.83Å; Y494-I496 HydrophobicContact CE2-CD1 3.58Å; Y494-I496 HydrophobicContact CE2-CG1 3.8Å
495	T	84.8	Confident	80.4	Confident	70 Å²	70	89.4 Å²	89.4	43%	0.429	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	139.7	171.9	-55	0	0	0	0	110	K483 Y484	K483-T495 WeakPolarHBondContact CA-O 3.33Å; Y484-T495 HydrophobicContact CE1-CG2 3.82Å; Y484-T495 PolarHBondContact N-O 2.99Å; Y484-T495 PolarHBondContact O-N 2.87Å; Y484-T495 WeakPolarHBondContact OH-CG2 3.25Å
496	I	86.3	Confident	80.4	Confident	75 Å²	75	88.4 Å²	88.4	39%	0.385	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.3	175.8	-65.9	174.8	0	0	0	109.8	E481 I482 K483 Y494	E481-I496 HydrophobicContact CG-CG2 3.34Å; I482-I496 CarbonylContact O-C 3.56Å; I482-I496 WeakPolarHBondContact O-CA 3.47Å; K483-I496 HydrophobicContact CB-CG1 4.47Å; Y494-I496 HydrophobicContact CD2-CD1 4.14Å; Y494-I496 HydrophobicContact CD2-CG1 3.83Å; Y494-I496 HydrophobicContact CE2-CD1 3.58Å; Y494-I496 HydrophobicContact CE2-CG1 3.8Å
497	L	88.2	Confident	80.5	Confident	61 Å²	61	92 Å²	92	32%	0.319	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.2	173.3	-171	141.2	0	0	0	110.6	I482 V504 L506	I482-L497 HydrophobicContact CD1-CD2 4.32Å; I482-L497 WeakPolarHBondContact CD1-O 3.23Å; I482-L497 PolarHBondContact N-O 3.33Å; I482-L497 PolarHBondContact O-N 3.39Å; L497-V504 HydrophobicContact CD2-CG2 3.29Å; L497-L506 HydrophobicContact CD1-CD2 4.33Å; L497-L506 HydrophobicContact CD2-CD2 4.47Å
498	R	88.9	Confident	80.5	Confident	155 Å²	155	90.1 Å²	90.1	59%	0.585	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.9	179.8	-66.2	-176	-179.1	165.7	0.8	111.7	Y480 E481 Y527	Y480-R498 CarbonylContact O-C 3.57Å; Y480-R498 VanDerWaalsContact O-CA 3.27Å; Y480-R498 WeakPolarHBondContact O-CA 3.22Å; E481-R498 HydrophobicContact CG-CG 4.41Å; E481-R498 IonicContact OE2-CZ 3.58Å; E481-R498 IonicContact OE2-NE 2.78Å; E481-R498 PolarHBondContact OE2-NE 3.07Å; E481-R498 IonicContact OE2-NH2 3.55Å; E481-R498 PolarHBondContact OE2-NH2 3.24Å; R498-Y527 PolarHBondContact NE-OH 3.32Å; R498-Y527 PolarHBondContact NH2-OH 2.94Å
499	A	86.8	Confident	81.2	Confident	11 Å²	11	81.4 Å²	81.4	9%	0.091	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136	178.2	0	0	0	0	0	110.5	W467 D479 Y480 I482 V504	W467-A499 HydrophobicContact CH2-CB 4.03Å; W467-A499 HydrophobicContact CZ2-CB 4.28Å; D479-A499 CarbonylContact C-O 3.54Å; D479-A499 WeakPolarHBondContact CA-O 3.33Å; D479-A499 WeakPolarHBondContact CB-O 3.33Å; Y480-A499 PolarHBondContact N-O 2.86Å; Y480-A499 PolarHBondContact O-N 3.39Å; I482-A499 HydrophobicContact CD1-CB 3.78Å; A499-V504 HydrophobicContact CB-CB 4.4Å; A499-V504 HydrophobicContact CB-CG2 4.21Å
500	R	84.9	Confident	81.9	Confident	232 Å²	232	81.6 Å²	81.6	88%	0.875	43%	0.427	S	S	*	.	S	Bend	trans	-85.5	-17.1	175.7	-68.4	-174.7	-176.5	174	1.5	113.5
501	G	86.5	Confident	82.8	Confident	31 Å²	31	76.2 Å²	76.2	32%	0.32	41%	0.406	S	S	.	.	S	Bend	trans	-111.9	178.3	176.2	0	0	0	0	0	111.8	W467 Y480 N503	W467-G501 VanDerWaalsContact CZ2-O 3.28Å; W467-G501 WeakPolarHBondContact CZ2-O 3.34Å; Y480-G501 WeakPolarHBondContact CD2-O 3.47Å; G501-N503 PolarHBondContact O-N 3.03Å
502	C	88.8	Confident	83.7	Confident	39 Å²	39	76.8 Å²	76.8	26%	0.264	41%	0.413	S	S	.	.	S	Bend	trans	-86.5	23.8	-179.8	-48.6	0	0	0	0	113.8	S466 W467	S466-C502 CarbonylContact C-O 3.51Å; S466-C502 VanDerWaalsContact CA-O 3.22Å; S466-C502 WeakPolarHBondContact CA-O 3.48Å; W467-C502 HydrophobicContact CG-CB 4.48Å; W467-C502 PolarHBondContact N-O 2.97Å; W467-C502 WeakPolarHBondContact O-CB 3.5Å
503	N	88.8	Confident	84.9	Confident	102 Å²	102	72 Å²	72	55%	0.545	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	153	176.8	63.8	3.6	0	0	0	111.4	L465 G501	L465-N503 CarbonylContact O-C 3.56Å; L465-N503 VanDerWaalsContact O-CA 3.27Å; L465-N503 WeakPolarHBondContact O-CA 3.49Å; G501-N503 PolarHBondContact O-N 3.03Å
504	V	89.6	Confident	85.5	Confident	18 Å²	18	70.9 Å²	70.9	11%	0.109	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	148.6	179.4	81.5	0	0	0	0	111.9	S464 L465 W467 I482 L497 A499 L506	S464-V504 CarbonylContact C-O 3.46Å; S464-V504 WeakPolarHBondContact CA-O 3.48Å; L465-V504 HydrophobicContact CB-CG1 4.34Å; L465-V504 PolarHBondContact N-O 2.74Å; L465-V504 PolarHBondContact O-N 3.47Å; W467-V504 HydrophobicContact CH2-CB 3.9Å; W467-V504 HydrophobicContact CH2-CG1 4.03Å; W467-V504 HydrophobicContact CZ3-CB 3.95Å; W467-V504 HydrophobicContact CZ3-CG1 3.69Å; I482-V504 HydrophobicContact CD1-CG2 4.48Å; I482-V504 HydrophobicContact CG1-CG1 4.4Å; L497-V504 HydrophobicContact CD2-CG2 3.29Å; A499-V504 HydrophobicContact CB-CB 4.4Å; A499-V504 HydrophobicContact CB-CG2 4.21Å; V504-L506 HydrophobicContact CG1-CD2 4.21Å; V504-L506 HydrophobicContact CG1-CG 4.44Å; V504-L506 HydrophobicContact CG2-CD2 4.44Å
505	T	88.8	Confident	85.8	Confident	66 Å²	66	65.8 Å²	65.8	41%	0.405	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115	169.5	-54.1	0	0	0	0	109.1	V463 S464	V463-T505 CarbonylContact O-C 3.55Å; V463-T505 WeakPolarHBondContact O-CA 3.29Å; S464-T505 VanDerWaalsContact OG-CG2 3.31Å; S464-T505 WeakPolarHBondContact OG-CG2 3.3Å; S464-T505 PolarHBondContact OG-OG1 3.31Å
506	L	88.1	Confident	86	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	126.1	174.9	-55.6	-178.8	0	0	0	108.6	S462 V463 L465 I482 Y484 L497 V504 L509 L517 F536	S462-L506 CarbonylContact C-O 3.36Å; S462-L506 WeakPolarHBondContact CA-O 3Å; S462-L506 WeakPolarHBondContact CB-O 3.23Å; V463-L506 HydrophobicContact CG1-CB 3.93Å; V463-L506 HydrophobicContact CG1-CD1 3.92Å; V463-L506 HydrophobicContact CG1-CG 4.14Å; V463-L506 PolarHBondContact N-O 3.44Å; V463-L506 PolarHBondContact O-N 3.26Å; L465-L506 HydrophobicContact CD1-CD1 4.22Å; I482-L506 HydrophobicContact CG2-CD2 4.4Å; Y484-L506 HydrophobicContact CD1-CD1 3.76Å; Y484-L506 HydrophobicContact CD1-CD2 4.06Å; Y484-L506 HydrophobicContact CD2-CD1 4.43Å; Y484-L506 HydrophobicContact CE1-CD1 4.09Å; Y484-L506 HydrophobicContact CE1-CD2 3.82Å; Y484-L506 HydrophobicContact CE1-CG 4.43Å; Y484-L506 HydrophobicContact CG-CD1 3.94Å; L497-L506 HydrophobicContact CD1-CD2 4.33Å; L497-L506 HydrophobicContact CD2-CD2 4.47Å; V504-L506 HydrophobicContact CG1-CD2 4.21Å; V504-L506 HydrophobicContact CG1-CG 4.44Å; V504-L506 HydrophobicContact CG2-CD2 4.44Å; L506-L509 HydrophobicContact CB-CD1 4.27Å; L506-L517 HydrophobicContact CD1-CD1 3.54Å; L506-F536 HydrophobicContact CD1-CE1 4.31Å; L506-F536 HydrophobicContact CD1-CZ 4.06Å
507	N	85.2	Confident	86.1	Confident	105 Å²	105	60.4 Å²	60.4	56%	0.561	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	161.3	-178.4	-63.3	-46.7	0	0	0	110.8	N461 S462	N461-N507 CarbonylContact O-C 3.45Å; N461-N507 WeakPolarHBondContact O-CA 2.95Å; S462-N507 WeakPolarHBondContact CB-OD1 2.92Å
508	G	80.8	Confident	86.2	Confident	69 Å²	69	59 Å²	59	71%	0.711	32%	0.318	S	S	*	.	S	Bend	trans	78.7	21.7	177	0	0	0	0	0	114.7	N461	N461-G508 PolarHBondContact O-N 2.92Å
509	L	84.9	Confident	86.4	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.037	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-77.6	150.8	178.4	-57.7	174.3	0	0	0	111.5	N461 V463 Y484 L506 Y515 F536 T538	N461-L509 VanDerWaalsContact CA-O 3.3Å; N461-L509 WeakPolarHBondContact CA-O 3.49Å; N461-L509 WeakPolarHBondContact CB-O 3.45Å; N461-L509 PolarHBondContact O-N 3Å; V463-L509 HydrophobicContact CB-CD1 4.47Å; V463-L509 HydrophobicContact CG1-CD1 4.02Å; Y484-L509 HydrophobicContact CD2-CD2 3.95Å; Y484-L509 HydrophobicContact CE2-CD2 3.34Å; L506-L509 HydrophobicContact CB-CD1 4.27Å; L509-Y515 HydrophobicContact CB-CE2 3.94Å; L509-Y515 HydrophobicContact CD2-CD1 4.29Å; L509-Y515 HydrophobicContact CD2-CD2 4.46Å; L509-Y515 HydrophobicContact CD2-CE1 3.95Å; L509-Y515 HydrophobicContact CD2-CE2 4.13Å; L509-Y515 HydrophobicContact CG-CE2 4.47Å; L509-F536 HydrophobicContact CD1-CE2 3.68Å; L509-F536 HydrophobicContact CD1-CZ 4.04Å; L509-T538 HydrophobicContact CB-CG2 3.65Å; L509-T538 HydrophobicContact CD1-CG2 3.72Å; L509-T538 HydrophobicContact CG-CG2 4.36Å
510	K	81.4	Confident	86.6	Confident	100 Å²	100	54.9 Å²	54.9	44%	0.435	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-66.5	136.7	172.6	-66.8	-176.8	-167.3	156.8	0	109.2	E486 T513 Y515 T538	E486-K510 VanDerWaalsContact CD-NZ 3.28Å; E486-K510 WeakPolarHBondContact OE1-CD 3.23Å; E486-K510 WeakPolarHBondContact OE1-CE 3.46Å; E486-K510 IonicContact OE1-NZ 3.93Å; E486-K510 PolarHBondContact OE1-NZ 2.63Å; E486-K510 IonicContact OE2-NZ 3.42Å; E486-K510 PolarHBondContact OE2-NZ 3.09Å; K510-T513 HydrophobicContact CB-CG2 4.49Å; K510-T513 VanDerWaalsContact CB-OG1 3.3Å; K510-T513 WeakPolarHBondContact CB-OG1 3.3Å; K510-Y515 WeakPolarHBondContact CB-OH 3.45Å; K510-Y515 PolarHBondContact N-OH 3.44Å; K510-T538 WeakPolarHBondContact O-CB 3.35Å; K510-T538 PolarHBondContact O-OG1 3.28Å
511	P	79.6	Confident	86.7	Confident	57 Å²	57	43.9 Å²	43.9	37%	0.37	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	151	174.7	27.1	-32.4	0	0	0	111.1	R460 T513 S539 D541	R460-P511 WeakPolarHBondContact O-CA 3.38Å; R460-P511 WeakPolarHBondContact O-CB 3.33Å; P511-T513 VanDerWaalsContact C-N 3.25Å; P511-T513 PolarHBondContact O-N 3.27Å; P511-T513 PolarHBondContact O-OG1 3.47Å; P511-S539 WeakPolarHBondContact CA-O 3.42Å; P511-S539 WeakPolarHBondContact CB-O 3.45Å; P511-D541 HydrophobicContact CB-CB 4.45Å
512	N	80.8	Confident	86.7	Confident	120 Å²	120	45.5 Å²	45.5	64%	0.642	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	36.8	179.5	-160.8	56.4	0	0	0	115	T538 S539 P540	N512-T538 VanDerWaalsContact CA-O 3.25Å; N512-T538 WeakPolarHBondContact CA-O 3.4Å; N512-T538 PolarHBondContact N-O 2.81Å; N512-T538 PolarHBondContact N-OG1 2.78Å; N512-T538 VanDerWaalsContact N-OG1 3.12Å; N512-S539 PolarHBondContact N-O 2.94Å; N512-P540 HydrophobicContact CB-CB 3.98Å
513	T	84	Confident	86.5	Confident	30 Å²	30	43.7 Å²	43.7	18%	0.184	24%	0.243	C	C	.	.			trans	-123.3	136	-176.1	-54.1	0	0	0	0	110.3	E486 K510 P511 Y515 E537 T538	E486-T513 HydrophobicContact CB-CG2 4.38Å; E486-T513 HydrophobicContact CG-CG2 3.88Å; K510-T513 HydrophobicContact CB-CG2 4.49Å; K510-T513 VanDerWaalsContact CB-OG1 3.3Å; K510-T513 WeakPolarHBondContact CB-OG1 3.3Å; P511-T513 VanDerWaalsContact C-N 3.25Å; P511-T513 PolarHBondContact O-N 3.27Å; P511-T513 PolarHBondContact O-OG1 3.47Å; T513-Y515 HydrophobicContact CG2-CD2 4.45Å; T513-Y515 HydrophobicContact CG2-CE2 3.9Å; T513-Y515 WeakPolarHBondContact O-CD2 3.05Å; T513-E537 WeakPolarHBondContact O-CA 3.02Å; T513-T538 PolarHBondContact N-OG1 3.14Å; T513-T538 PolarHBondContact O-N 3.11Å; T513-T538 PolarHBondContact O-OG1 3.36Å
514	A	86.3	Confident	85.9	Confident	23 Å²	23	42.7 Å²	42.7	19%	0.19	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	129.2	174.9	0	0	0	0	0	110.8	K487 F536 E537	K487-A514 HydrophobicContact CB-CB 4.01Å; K487-A514 WeakPolarHBondContact CB-O 3.48Å; K487-A514 HydrophobicContact CD-CB 4.19Å; K487-A514 PolarHBondContact N-O 3.39Å; A514-F536 CarbonylContact C-O 3.39Å; A514-F536 WeakPolarHBondContact CA-O 3.5Å; A514-E537 HydrophobicContact CB-CG 3.64Å
515	Y	87.9	Confident	85	Confident	10 Å²	10	44.6 Å²	44.6	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145.8	178	-72.1	-90.6	0	0	0	110.9	Y484 Y485 E486 L509 K510 T513 Q535 F536 T538	Y484-Y515 AromaticContact CD2-CD1 4Å; Y484-Y515 HydrophobicContact CD2-CD1 4Å; Y484-Y515 HydrophobicContact CD2-CE1 4.42Å; Y485-Y515 CarbonylContact O-C 3.49Å; Y485-Y515 VanDerWaalsContact O-CA 3.26Å; Y485-Y515 WeakPolarHBondContact O-CA 3.27Å; Y485-Y515 WeakPolarHBondContact O-CD1 3.38Å; E486-Y515 HydrophobicContact CB-CE1 4.35Å; E486-Y515 HydrophobicContact CG-CD1 3.81Å; E486-Y515 HydrophobicContact CG-CE1 3.19Å; E486-Y515 HydrophobicContact CG-CE2 4.48Å; E486-Y515 PolarHBondContact OE1-OH 3.17Å; L509-Y515 HydrophobicContact CB-CE2 3.94Å; L509-Y515 HydrophobicContact CD2-CD1 4.29Å; L509-Y515 HydrophobicContact CD2-CD2 4.46Å; L509-Y515 HydrophobicContact CD2-CE1 3.95Å; L509-Y515 HydrophobicContact CD2-CE2 4.13Å; L509-Y515 HydrophobicContact CG-CE2 4.47Å; K510-Y515 WeakPolarHBondContact CB-OH 3.45Å; K510-Y515 PolarHBondContact N-OH 3.44Å; T513-Y515 HydrophobicContact CG2-CD2 4.45Å; T513-Y515 HydrophobicContact CG2-CE2 3.9Å; T513-Y515 WeakPolarHBondContact O-CD2 3.05Å; Y515-Q535 WeakPolarHBondContact O-CA 3.35Å; Y515-F536 AromaticContact CD2-CE2 3.95Å; Y515-F536 HydrophobicContact CD2-CE2 3.95Å; Y515-F536 HydrophobicContact CD2-CZ 4.28Å; Y515-F536 HydrophobicContact CG-CE2 4.07Å; Y515-F536 AromaticContact CG-CZ 3.94Å; Y515-F536 HydrophobicContact CG-CZ 3.94Å; Y515-F536 PolarHBondContact N-O 3.15Å; Y515-F536 PolarHBondContact O-N 3.37Å; Y515-T538 HydrophobicContact CD2-CG2 4.33Å; Y515-T538 HydrophobicContact CE2-CG2 4.16Å
516	L	88.7	Confident	84.5	Confident	32 Å²	32	42.7 Å²	42.7	17%	0.168	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.4	168.2	-69.9	174.1	0	0	0	109.6	Y484 Y485 K487 Q535	Y484-L516 CarbonylContact C-O 3.55Å; Y484-L516 WeakPolarHBondContact CA-O 3.45Å; Y484-L516 WeakPolarHBondContact CB-O 3.46Å; Y485-L516 HydrophobicContact CD2-CB 4.43Å; Y485-L516 HydrophobicContact CE1-CB 4.09Å; Y485-L516 HydrophobicContact CE2-CB 3.95Å; Y485-L516 HydrophobicContact CE2-CD1 3.76Å; Y485-L516 HydrophobicContact CE2-CG 4.43Å; Y485-L516 PolarHBondContact N-O 2.87Å; Y485-L516 PolarHBondContact O-N 2.94Å; K487-L516 HydrophobicContact CB-CG 4.4Å; K487-L516 HydrophobicContact CG-CD1 4.3Å; K487-L516 HydrophobicContact CG-CG 4.36Å; L516-Q535 HydrophobicContact CD2-CB 3.89Å; L516-Q535 HydrophobicContact CD2-CG 4.24Å
517	L	89.8	Confident	84.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140	-174.8	178.5	147.1	0	0	0	112.7	I453 L465 I482 K483 L506 I519 S533 F534 F536	I453-L517 HydrophobicContact CD1-CD2 4.33Å; L465-L517 HydrophobicContact CD1-CD1 3.3Å; L465-L517 HydrophobicContact CD1-CD2 4.29Å; L465-L517 HydrophobicContact CD1-CG 4.44Å; I482-L517 HydrophobicContact CG2-CD1 3.47Å; I482-L517 VanDerWaalsContact CG2-CD1 3.47Å; I482-L517 HydrophobicContact CG2-CD2 4.18Å; I482-L517 HydrophobicContact CG2-CG 3.74Å; K483-L517 CarbonylContact O-C 3.57Å; K483-L517 VanDerWaalsContact O-CA 3.31Å; K483-L517 WeakPolarHBondContact O-CA 3.32Å; L506-L517 HydrophobicContact CD1-CD1 3.54Å; L517-I519 HydrophobicContact CD2-CD1 3.82Å; L517-I519 HydrophobicContact CD2-CG1 3.46Å; L517-I519 VanDerWaalsContact CD2-CG1 3.46Å; L517-S533 CarbonylContact O-C 3.58Å; L517-S533 WeakPolarHBondContact O-CA 3.49Å; L517-F534 HydrophobicContact CD2-CB 4.4Å; L517-F534 PolarHBondContact N-O 3.31Å; L517-F534 PolarHBondContact O-N 3.23Å; L517-F536 HydrophobicContact CB-CD1 4.41Å; L517-F536 HydrophobicContact CB-CE1 4.01Å; L517-F536 HydrophobicContact CD1-CE1 3.94Å
518	Q	90.8	Very high	84.1	Confident	33 Å²	33	41.1 Å²	41.1	15%	0.154	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	137.3	176.3	-69.1	179.3	-13.5	0	0	110	I482 K483 S533	I482-Q518 WeakPolarHBondContact CA-O 3.05Å; K483-Q518 PolarHBondContact N-O 3.48Å; K483-Q518 PolarHBondContact O-N 3.42Å; Q518-S533 PolarHBondContact NE2-OG 3.13Å
519	I	91.6	Very high	84.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.9	179.6	-50.5	-176.2	0	0	0	109.3	I453 W467 Y480 E481 I482 L517 S531	I453-I519 HydrophobicContact CD1-CB 4.47Å; I453-I519 HydrophobicContact CD1-CD1 3.75Å; I453-I519 HydrophobicContact CD1-CG1 3.92Å; I453-I519 HydrophobicContact CG1-CD1 4.02Å; I453-I519 HydrophobicContact CG2-CD1 4.29Å; W467-I519 HydrophobicContact CB-CD1 4.41Å; W467-I519 HydrophobicContact CD2-CD1 3.61Å; W467-I519 HydrophobicContact CD2-CG2 4.34Å; W467-I519 HydrophobicContact CE3-CD1 3.36Å; W467-I519 HydrophobicContact CG-CD1 4.1Å; W467-I519 HydrophobicContact CH2-CD1 4.46Å; W467-I519 HydrophobicContact CZ2-CG2 4.34Å; W467-I519 HydrophobicContact CZ3-CD1 3.82Å; Y480-I519 HydrophobicContact CD1-CG2 4.09Å; E481-I519 WeakPolarHBondContact O-CA 3.45Å; I482-I519 HydrophobicContact CG1-CG1 4.25Å; I482-I519 HydrophobicContact CG1-CG2 4.4Å; I482-I519 HydrophobicContact CG2-CG1 4.49Å; L517-I519 HydrophobicContact CD2-CD1 3.82Å; L517-I519 HydrophobicContact CD2-CG1 3.46Å; L517-I519 VanDerWaalsContact CD2-CG1 3.46Å; I519-S531 PolarHBondContact N-OG 2.84Å; I519-S531 WeakPolarHBondContact O-CB 3.41Å; I519-S531 PolarHBondContact O-N 3.25Å
520	R	91	Very high	84.4	Confident	79 Å²	79	42.8 Å²	42.8	30%	0.298	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140	169.4	59.2	-173.8	-171.7	169.3	-0.9	111.2	Y480 E481 Y527 G528	Y480-R520 CarbonylContact C-O 3.57Å; Y480-R520 WeakPolarHBondContact CA-O 3.15Å; E481-R520 HydrophobicContact CB-CG 4.04Å; E481-R520 PolarHBondContact N-O 3.12Å; E481-R520 PolarHBondContact O-N 2.8Å; E481-R520 IonicContact OE1-CZ 2.92Å; E481-R520 IonicContact OE1-NE 3.23Å; E481-R520 PolarHBondContact OE1-NE 2.98Å; E481-R520 IonicContact OE1-NH2 2.63Å; E481-R520 PolarHBondContact OE1-NH2 3.24Å; R520-Y527 HydrophobicContact CG-CD1 3.83Å; R520-Y527 HydrophobicContact CG-CG 4.46Å; R520-G528 WeakPolarHBondContact CB-O 3.32Å
521	A	88.6	Confident	84.8	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.008	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	152.6	175.8	0	0	0	0	0	110.8	P447 P470 I477 Y480 G528	P447-A521 HydrophobicContact CB-CB 4.04Å; P447-A521 HydrophobicContact CG-CB 3.96Å; P470-A521 HydrophobicContact CG-CB 3.76Å; I477-A521 HydrophobicContact CG2-CB 4.25Å; Y480-A521 HydrophobicContact CD1-CB 3.74Å; Y480-A521 HydrophobicContact CE1-CB 3.56Å; A521-G528 PolarHBondContact O-N 2.99Å
522	R	85.8	Confident	85	Confident	65 Å²	65	40.1 Å²	40.1	25%	0.245	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.3	177.5	-173.1	172.8	61.4	87.5	-0.9	111.8	L478 D479 G526 Y527	L478-R522 VanDerWaalsContact CD1-NH1 3.27Å; L478-R522 PolarHBondContact N-O 3.41Å; D479-R522 PolarHBondContact O-N 2.99Å; D479-R522 WeakPolarHBondContact OD1-CB 3.48Å; D479-R522 IonicContact OD1-CZ 3.97Å; D479-R522 IonicContact OD1-NE 3.45Å; D479-R522 PolarHBondContact OD1-NE 3.37Å; D479-R522 IonicContact OD1-NH2 3.29Å; D479-R522 PolarHBondContact OD1-NH2 3.45Å; D479-R522 IonicContact OD2-CZ 2.8Å; D479-R522 IonicContact OD2-NE 3.49Å; D479-R522 IonicContact OD2-NH2 2.7Å; D479-R522 PolarHBondContact OD2-NH2 3.4Å; R522-G526 WeakPolarHBondContact CA-O 3.46Å; R522-Y527 HydrophobicContact CB-CD1 3.69Å; R522-Y527 HydrophobicContact CB-CE1 3.71Å; R522-Y527 HydrophobicContact CB-CG 4.39Å; R522-Y527 HydrophobicContact CG-CD1 4.11Å; R522-Y527 HydrophobicContact CG-CE1 4.1Å; R522-Y527 HydrophobicContact CG-CG 4.38Å
523	T	84.3	Confident	85.2	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	-177.8	165.4	56.9	0	0	0	0	109.9	A445 P447 P473 I476 A525 G526	A445-T523 PolarHBondContact O-OG1 3.02Å; P447-T523 HydrophobicContact CG-CG2 3.43Å; P447-T523 VanDerWaalsContact CG-CG2 3.43Å; P473-T523 WeakPolarHBondContact O-CG2 3.48Å; I476-T523 WeakPolarHBondContact O-CG2 3.43Å; T523-A525 PolarHBondContact O-N 3.49Å; T523-A525 VanDerWaalsContact O-N 3.16Å; T523-A525 PolarHBondContact OG1-N 3.21Å; T523-G526 PolarHBondContact N-O 3.39Å; T523-G526 PolarHBondContact O-N 3.01Å
524	A	76.9	Confident	85.4	Confident	80 Å²	80	38.2 Å²	38.2	66%	0.661	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.9	171	0	0	0	0	0	113.2
525	A	70.3	Confident	85.5	Confident	58 Å²	58	41.1 Å²	41.1	48%	0.479	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.4	178.2	0	0	0	0	0	114.1	T523	T523-A525 PolarHBondContact O-N 3.49Å; T523-A525 VanDerWaalsContact O-N 3.16Å; T523-A525 PolarHBondContact OG1-N 3.21Å
526	G	78.1	Confident	85.4	Confident	27 Å²	27	41 Å²	41	28%	0.278	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	119.3	-167.8	178.4	0	0	0	0	0	114.2	R522 T523	R522-G526 WeakPolarHBondContact CA-O 3.46Å; T523-G526 PolarHBondContact N-O 3.39Å; T523-G526 PolarHBondContact O-N 3.01Å
527	Y	82.3	Confident	85.2	Confident	65 Å²	65	44.7 Å²	44.7	26%	0.255	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.9	-177.9	-72	-76.8	0	0	0	111.7	E481 R498 R520 R522	E481-Y527 HydrophobicContact CB-CD1 4.38Å; E481-Y527 HydrophobicContact CB-CE1 3.69Å; E481-Y527 PolarHBondContact OE2-OH 3.43Å; R498-Y527 PolarHBondContact NE-OH 3.32Å; R498-Y527 PolarHBondContact NH2-OH 2.94Å; R520-Y527 HydrophobicContact CG-CD1 3.83Å; R520-Y527 HydrophobicContact CG-CG 4.46Å; R522-Y527 HydrophobicContact CB-CD1 3.69Å; R522-Y527 HydrophobicContact CB-CE1 3.71Å; R522-Y527 HydrophobicContact CB-CG 4.39Å; R522-Y527 HydrophobicContact CG-CD1 4.11Å; R522-Y527 HydrophobicContact CG-CE1 4.1Å; R522-Y527 HydrophobicContact CG-CG 4.38Å
528	G	83.1	Confident	84.8	Confident	6 Å²	6	45 Å²	45	6%	0.062	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-70.3	173.9	166.2	0	0	0	0	0	112.4	P447 R520 A521	P447-G528 VanDerWaalsContact O-CA 3.26Å; P447-G528 WeakPolarHBondContact O-CA 3.5Å; R520-G528 WeakPolarHBondContact CB-O 3.32Å; A521-G528 PolarHBondContact O-N 2.99Å
529	A	85.1	Confident	84	Confident	61 Å²	61	45.6 Å²	45.6	50%	0.504	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-60.8	143.9	172.9	0	0	0	0	0	111	P449	P449-A529 WeakPolarHBondContact CA-O 3.41Å; P449-A529 HydrophobicContact CB-CB 4.17Å; P449-A529 WeakPolarHBondContact CB-O 3.45Å; P449-A529 HydrophobicContact CG-CB 4.41Å
530	S	86.3	Confident	82.4	Confident	50 Å²	50	49.9 Å²	49.9	35%	0.35	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-61.9	144.2	172.5	-65	0	0	0	0	111.2
531	S	89.6	Confident	80.3	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.028	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-58	159	168	71.6	0	0	0	0	110.8	V450 I453 I519	V450-S531 WeakPolarHBondContact O-CB 3.31Å; I453-S531 WeakPolarHBondContact CD1-OG 3.29Å; I519-S531 PolarHBondContact N-OG 2.84Å; I519-S531 WeakPolarHBondContact O-CB 3.41Å; I519-S531 PolarHBondContact O-N 3.25Å
532	P	84.8	Confident	78	Confident	97 Å²	97	53.6 Å²	53.6	63%	0.63	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-51.9	147	162.2	-23	33.9	0	0	0	111	F534	P532-F534 PolarHBondContact O-N 3.09Å
533	S	84.4	Confident	75.5	Confident	58 Å²	58	54.7 Å²	54.7	41%	0.406	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-64.2	119.1	-179.4	-59.6	0	0	0	0	110.9	L517 Q518	L517-S533 CarbonylContact O-C 3.58Å; L517-S533 WeakPolarHBondContact O-CA 3.49Å; Q518-S533 PolarHBondContact NE2-OG 3.13Å
534	F	87.7	Confident	72.8	Confident	53 Å²	53	63.5 Å²	63.5	23%	0.232	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122	176.9	-175.9	-97.1	0	0	0	110	I453 K455 L465 L517 P532 F536	I453-F534 HydrophobicContact CB-CD2 4.08Å; I453-F534 HydrophobicContact CB-CE2 4.44Å; I453-F534 HydrophobicContact CB-CG 4.33Å; I453-F534 HydrophobicContact CD1-CB 4.09Å; I453-F534 HydrophobicContact CG2-CD1 4.15Å; I453-F534 HydrophobicContact CG2-CD2 4.14Å; I453-F534 HydrophobicContact CG2-CE1 4.38Å; I453-F534 HydrophobicContact CG2-CE2 4.37Å; I453-F534 HydrophobicContact CG2-CG 4.03Å; I453-F534 HydrophobicContact CG2-CZ 4.49Å; K455-F534 HydrophobicContact CB-CE1 4.33Å; K455-F534 HydrophobicContact CB-CZ 4.08Å; L465-F534 HydrophobicContact CD2-CD1 4.31Å; L465-F534 HydrophobicContact CD2-CE1 3.77Å; L517-F534 HydrophobicContact CD2-CB 4.4Å; L517-F534 PolarHBondContact N-O 3.31Å; L517-F534 PolarHBondContact O-N 3.23Å; P532-F534 PolarHBondContact O-N 3.09Å; F534-F536 HydrophobicContact CD1-CD1 4.45Å; F534-F536 HydrophobicContact CE1-CB 4.36Å
535	Q	88.1	Confident	70.6	Confident	83 Å²	83	64.4 Å²	64.4	39%	0.388	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.9	-179.4	-174	-176.7	-31.1	0	0	111.5	Y515 L516 E537	Y515-Q535 WeakPolarHBondContact O-CA 3.35Å; L516-Q535 HydrophobicContact CD2-CB 3.89Å; L516-Q535 HydrophobicContact CD2-CG 4.24Å; Q535-E537 PolarHBondContact NE2-OE1 3.26Å
536	F	86.4	Confident	68.8	Low	7 Å²	7	68.7 Å²	68.7	3%	0.031	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	159.2	169.7	69.9	-92.3	0	0	0	112.1	V463 L506 L509 A514 Y515 L517 F534	V463-F536 HydrophobicContact CB-CD2 3.98Å; V463-F536 HydrophobicContact CB-CE2 3.91Å; V463-F536 HydrophobicContact CG1-CD1 4.47Å; V463-F536 HydrophobicContact CG1-CD2 3.8Å; V463-F536 HydrophobicContact CG1-CE1 4.07Å; V463-F536 HydrophobicContact CG1-CE2 3.36Å; V463-F536 HydrophobicContact CG1-CG 4.34Å; V463-F536 HydrophobicContact CG1-CZ 3.51Å; V463-F536 HydrophobicContact CG2-CD2 4.04Å; V463-F536 HydrophobicContact CG2-CE2 4.44Å; V463-F536 HydrophobicContact CG2-CG 4.34Å; L506-F536 HydrophobicContact CD1-CE1 4.31Å; L506-F536 HydrophobicContact CD1-CZ 4.06Å; L509-F536 HydrophobicContact CD1-CE2 3.68Å; L509-F536 HydrophobicContact CD1-CZ 4.04Å; A514-F536 CarbonylContact C-O 3.39Å; A514-F536 WeakPolarHBondContact CA-O 3.5Å; Y515-F536 AromaticContact CD2-CE2 3.95Å; Y515-F536 HydrophobicContact CD2-CE2 3.95Å; Y515-F536 HydrophobicContact CD2-CZ 4.28Å; Y515-F536 HydrophobicContact CG-CE2 4.07Å; Y515-F536 AromaticContact CG-CZ 3.94Å; Y515-F536 HydrophobicContact CG-CZ 3.94Å; Y515-F536 PolarHBondContact N-O 3.15Å; Y515-F536 PolarHBondContact O-N 3.37Å; L517-F536 HydrophobicContact CB-CD1 4.41Å; L517-F536 HydrophobicContact CB-CE1 4.01Å; L517-F536 HydrophobicContact CD1-CE1 3.94Å; F534-F536 HydrophobicContact CD1-CD1 4.45Å; F534-F536 HydrophobicContact CE1-CB 4.36Å
537	E	83.7	Confident	66.5	Low	111 Å²	111	72.2 Å²	72.2	52%	0.519	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.7	-179.8	-77	163.4	-156.6	0	0	111	T458 T513 A514 Q535	T458-E537 VanDerWaalsContact CG2-O 3.27Å; T458-E537 WeakPolarHBondContact CG2-O 3.49Å; T513-E537 WeakPolarHBondContact O-CA 3.02Å; A514-E537 HydrophobicContact CB-CG 3.64Å; Q535-E537 PolarHBondContact NE2-OE1 3.26Å
538	T	81.6	Confident	64	Low	6 Å²	6	74.3 Å²	74.3	4%	0.037	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-90.7	155.2	177.5	50.6	0	0	0	0	112.1	L509 K510 N512 T513 Y515	L509-T538 HydrophobicContact CB-CG2 3.65Å; L509-T538 HydrophobicContact CD1-CG2 3.72Å; L509-T538 HydrophobicContact CG-CG2 4.36Å; K510-T538 WeakPolarHBondContact O-CB 3.35Å; K510-T538 PolarHBondContact O-OG1 3.28Å; N512-T538 VanDerWaalsContact CA-O 3.25Å; N512-T538 WeakPolarHBondContact CA-O 3.4Å; N512-T538 PolarHBondContact N-O 2.81Å; N512-T538 PolarHBondContact N-OG1 2.78Å; N512-T538 VanDerWaalsContact N-OG1 3.12Å; T513-T538 PolarHBondContact N-OG1 3.14Å; T513-T538 PolarHBondContact O-N 3.11Å; T513-T538 PolarHBondContact O-OG1 3.36Å; Y515-T538 HydrophobicContact CD2-CG2 4.33Å; Y515-T538 HydrophobicContact CE2-CG2 4.16Å
539	S	74.3	Confident	61.6	Low	46 Å²	46	81.9 Å²	81.9	32%	0.322	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-78.5	150.1	-179.3	60.3	0	0	0	0	113	S459 R460 P511 N512	S459-S539 PolarHBondContact O-N 3.32Å; S459-S539 PolarHBondContact O-OG 2.91Å; R460-S539 WeakPolarHBondContact CA-O 3.47Å; R460-S539 WeakPolarHBondContact CA-OG 3.31Å; R460-S539 PolarHBondContact N-OG 3.03Å; P511-S539 WeakPolarHBondContact CA-O 3.42Å; P511-S539 WeakPolarHBondContact CB-O 3.45Å; N512-S539 PolarHBondContact N-O 2.94Å
540	P	58.4	Low	59.1	Low	90 Å²	90	85.7 Å²	85.7	58%	0.584	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-70.2	148.8	179.4	26.2	-33	0	0	0	112	N512	N512-P540 HydrophobicContact CB-CB 3.98Å
541	D	47.1	Very low	56.6	Low	76 Å²	76	88.4 Å²	88.4	41%	0.406	52%	0.519	S	S	.	.			trans	-153.8	147.8	174.7	-130.8	-22	0	0	0	119.3	R460 P511	R460-D541 HydrophobicContact CB-CB 3.7Å; R460-D541 VanDerWaalsContact CB-OD2 3.22Å; R460-D541 WeakPolarHBondContact CB-OD2 3.37Å; R460-D541 WeakPolarHBondContact CD-OD2 3.44Å; R460-D541 HydrophobicContact CG-CB 4.45Å; R460-D541 IonicContact CZ-OD2 3.08Å; R460-D541 IonicContact NE-OD2 3.02Å; R460-D541 PolarHBondContact NE-OD2 3.02Å; R460-D541 IonicContact NH1-OD1 3.57Å; R460-D541 IonicContact NH1-OD2 2.79Å; R460-D541 PolarHBondContact NH1-OD2 3.05Å; P511-D541 HydrophobicContact CB-CB 4.45Å
542	S	40.5	Very low	53.8	Low	81 Å²	81	96.2 Å²	96.2	57%	0.566	56%	0.555	S	S	*	*			trans	-66.8	139.5	-172.3	48.4	0	0	0	0	115.5	R460	R460-S542 PolarHBondContact NH2-O 3.23Å
543	A	32.3	Very low	51.6	Low	89 Å²	89	98.5 Å²	98.5	74%	0.736	57%	0.567	S	S	*	*			trans	45.1	120.2	149.2	0	0	0	0	0	122.1
544	F	27.9	Very low	49.3	Very low	185 Å²	185	100.4 Å²	100.4	81%	0.811	58%	0.576	S	S	*	*				93.5	141.7	125.9	-104.6	-93.1	0	0	0	124
545	S	30.9	Very low	46.9	Very low	100 Å²	100	104.1 Å²	104.1	70%	0.699	60%	0.597	S	S	*	*			trans	70.3	123.2	160.3	44.5	0	0	0	0	118.7
546	I	31.4	Very low	44.9	Very low	148 Å²	148	108.6 Å²	108.6	76%	0.759	62%	0.622	S	S	*	*			cis	116.7	144.1	26.9	-80.4	168.1	0	0	0	109.8
547	S	30.3	Very low	42.7	Very low	101 Å²	101	112.3 Å²	112.3	71%	0.706	65%	0.654	S	S	*	*			trans	88.2	106.6	163.8	68.5	0	0	0	0	115.9
548	S	29.3	Very low	41.2	Very low	108 Å²	108	114.2 Å²	114.2	76%	0.755	67%	0.666	S	S	*	*				95.2	118.9	51.9	70.4	0	0	0	0	111.6
549	E	34.4	Very low	39.9	Very low	166 Å²	166	119 Å²	119	78%	0.776	70%	0.7	S	S	*	*				-177.7	116.5	125	-94.2	-159	144.1	0	0	108.4
550	N	32.2	Very low	38.7	Very low	141 Å²	141	122.1 Å²	122.1	75%	0.754	72%	0.72	S	S	*	*				60.8	131.9	108.5	-67.3	-23	0	0	0	114.1
551	S	33.5	Very low	38.5	Very low	107 Å²	107	121.2 Å²	121.2	75%	0.748	72%	0.72	S	S	*	*			cis	-172.4	152.2	0.3	47.9	0	0	0	0	107.3
552	Q	31.5	Very low	38.8	Very low	167 Å²	167	122.5 Å²	122.5	78%	0.78	73%	0.73	S	S	*	*			trans	-34.9	140	159.4	-69	161.9	-59.3	0	0	114
553	V	37.6	Very low	39.5	Very low	146 Å²	146	122 Å²	122	89%	0.885	73%	0.731	S	S	*	*				-143.7	128.4	114.2	-177.8	0	0	0	0	109.7
554	V	36.6	Very low	40.8	Very low	98 Å²	98	124.2 Å²	124.2	59%	0.594	73%	0.73	S	S	*	*			trans	-86.7	145	-178.5	159.5	0	0	0	0	109.1
555	L	36.5	Very low	42.3	Very low	131 Å²	131	120.9 Å²	120.9	69%	0.686	72%	0.719	S	S	*	*			trans	41.6	103.2	159.3	-80.5	88.1	0	0	0	117.9	I558	L555-I558 HydrophobicContact CD2-CD1 4.46Å
556	I	45.5	Very low	43.6	Very low	177 Å²	177	121.4 Å²	121.4	91%	0.908	71%	0.713	S	S	*	*				-158	92.6	129	-75.6	121.7	0	0	0	106.2
557	A	41.6	Very low	44.9	Very low	84 Å²	84	120.8 Å²	120.8	69%	0.694	71%	0.711	S	S	*	*			trans	-170.8	11.1	160	0	0	0	0	0	113.9	S559	A557-S559 PolarHBondContact O-N 3.15Å
558	I	52.2	Low	46.3	Very low	151 Å²	151	120.2 Å²	120.2	77%	0.774	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	14.8	173	-64.8	173	0	0	0	111.4	L555	L555-I558 HydrophobicContact CD2-CD1 4.46Å
559	S	54.7	Low	47.8	Very low	107 Å²	107	119.1 Å²	119.1	75%	0.748	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	1.2	-174.8	-176.2	0	0	0	0	115.3	A557	A557-S559 PolarHBondContact O-N 3.15Å
560	C	48	Very low	49.1	Very low	112 Å²	112	117 Å²	117	76%	0.757	69%	0.685	S	S	*	*	S	Bend	trans	-112.3	18.3	-177.5	-70.9	0	0	0	0	114.6
561	A	53.7	Low	50.3	Low	70 Å²	70	116.3 Å²	116.3	58%	0.579	68%	0.681	S	S	*	*	S	Bend	trans	-80.8	-9.8	175.8	0	0	0	0	0	114.7
562	V	54	Low	51.3	Low	103 Å²	103	120.7 Å²	120.7	62%	0.624	68%	0.682	S	S	*	*	S	Bend	trans	-106.7	-21.8	-160.6	-174.3	0	0	0	0	114.3	L566	V562-L566 HydrophobicContact CG1-CD1 4.12Å; V562-L566 WeakPolarHBondContact O-CD1 3.32Å; V562-L566 WeakPolarHBondContact O-CG 3.39Å
563	A	56.3	Low	52.5	Low	71 Å²	71	116.3 Å²	116.3	59%	0.587	67%	0.667	S	S	*	*	H	α-helix	trans	-86.6	-29.3	-173.1	0	0	0	0	0	115.3
564	I	59.4	Low	53.3	Low	136 Å²	136	116.3 Å²	116.3	70%	0.697	66%	0.661	S	S	*	*	H	α-helix	trans	-87.5	-25.8	-173.6	-62.3	175	0	0	0	111.9
565	I	58.3	Low	54.1	Low	115 Å²	115	118.5 Å²	118.5	59%	0.59	67%	0.668	S	S	*	*	H	α-helix	trans	-79.1	-26	175.5	-62	176.1	0	0	0	111.4	T568 V569	I565-T568 PolarHBondContact O-OG1 2.7Å; I565-V569 WeakPolarHBondContact O-CG2 3.48Å
566	L	57.9	Low	54.8	Low	110 Å²	110	115.4 Å²	115.4	58%	0.576	67%	0.668	S	S	*	*	H	α-helix	trans	-74.4	-24.8	175.8	-80.4	168.8	0	0	0	113.6	V562	V562-L566 HydrophobicContact CG1-CD1 4.12Å; V562-L566 WeakPolarHBondContact O-CD1 3.32Å; V562-L566 WeakPolarHBondContact O-CG 3.39Å
567	L	59	Low	55.1	Low	135 Å²	135	116.9 Å²	116.9	71%	0.707	66%	0.662	S	S	*	*	H	α-helix	trans	-83.5	-26.6	-178.6	-108.4	151.4	0	0	0	113.6
568	T	59.7	Low	55.2	Low	90 Å²	90	122 Å²	122	55%	0.552	67%	0.669	S	S	*	*	H	α-helix	trans	-84	-26.7	177.9	52.7	0	0	0	0	112.9	I565	I565-T568 PolarHBondContact O-OG1 2.7Å
569	V	60.7	Low	54.4	Low	85 Å²	85	120 Å²	120	52%	0.515	67%	0.667	S	S	.	*	H	α-helix	trans	-75.8	-31.1	176.2	175.3	0	0	0	0	112	I565 Y572 V573	I565-V569 WeakPolarHBondContact O-CG2 3.48Å; V569-Y572 PolarHBondContact O-N 3.34Å; V569-V573 VanDerWaalsContact O-CG2 3.28Å; V569-V573 WeakPolarHBondContact O-CG2 3.35Å; V569-V573 PolarHBondContact O-N 2.95Å
570	L	61.2	Low	53.5	Low	121 Å²	121	121.2 Å²	121.2	63%	0.634	67%	0.674	S	S	*	*	H	α-helix	trans	-71.6	-27.9	177	-107.8	139.3	0	0	0	113.7
571	L	58.6	Low	52.8	Low	127 Å²	127	127.6 Å²	127.6	67%	0.665	68%	0.682	S	S	*	*	H	α-helix	trans	-75.1	-30.7	175	-162.5	71.6	0	0	0	112.2
572	Y	54.8	Low	51.9	Low	198 Å²	198	128.9 Å²	128.9	78%	0.776	69%	0.687	S	S	*	*	H	α-helix	trans	-78.1	-26.7	177.5	-120.9	-91.7	0	0	0	113.1	V569 G576	V569-Y572 PolarHBondContact O-N 3.34Å; Y572-G576 PolarHBondContact O-N 3.23Å
573	V	55.9	Low	50.8	Low	76 Å²	76	133 Å²	133	46%	0.461	70%	0.697	S	S	.	*	H	α-helix	trans	-76.4	-22.3	-179.8	170.6	0	0	0	0	113.1	V569	V569-V573 VanDerWaalsContact O-CG2 3.28Å; V569-V573 WeakPolarHBondContact O-CG2 3.35Å; V569-V573 PolarHBondContact O-N 2.95Å
574	L	54.3	Low	49.6	Very low	146 Å²	146	134.7 Å²	134.7	76%	0.764	70%	0.704	S	S	*	*	H	α-helix	trans	-83.4	-24.1	176.1	-74.8	170.7	0	0	0	113.9
575	I	54.1	Low	48	Very low	144 Å²	144	137.9 Å²	137.9	74%	0.738	71%	0.713	S	S	*	*	H	α-helix	trans	-91.6	-24	178.3	-60.4	172.8	0	0	0	111.2
576	G	51.8	Low	46.7	Very low	66 Å²	66	140.8 Å²	140.8	68%	0.68	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	2.5	-179.1	0	0	0	0	0	116.8	Y572	Y572-G576 PolarHBondContact O-N 3.23Å
577	R	50	Low	45.9	Very low	207 Å²	207	140.3 Å²	140.3	78%	0.781	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	16.5	-175.7	-121.3	-172.7	172.2	108.7	-0	115.7
578	F	43.8	Very low	44.4	Very low	193 Å²	193	140.8 Å²	140.8	85%	0.846	73%	0.73	S	S	*	*	S	Bend	trans	-121.7	92.3	162.3	-123	-98.8	0	0	0	110.2
579	C	35.6	Very low	42.9	Very low	108 Å²	108	145.4 Å²	145.4	73%	0.73	75%	0.746	S	S	*	*			trans	88.3	67.4	146.4	-58	0	0	0	0	119.5
580	C	35.8	Very low	41.3	Very low	133 Å²	133	149.9 Å²	149.9	90%	0.899	76%	0.758	S	S	*	*			trans	-107.9	114.3	136.6	-96.5	0	0	0	0	110.1
581	R	34.9	Very low	39.7	Very low	245 Å²	245	154.8 Å²	154.8	93%	0.925	77%	0.768	S	S	*	*			trans	-153	98.8	144.7	-105	-178.1	172.7	163.4	-2	105.9
582	S	33.4	Very low	38.3	Very low	98 Å²	98	156.3 Å²	156.3	69%	0.685	78%	0.776	S	S	*	*				99.1	131.6	74.9	171.9	0	0	0	0	109
583	K	31.1	Very low	36.9	Very low	190 Å²	190	154.9 Å²	154.9	83%	0.826	78%	0.776	S	S	*	*			cis	-171.2	142.2	8.6	-115.2	175.7	-179.3	179.5	0	110.4
584	S	30.4	Very low	35.7	Very low	105 Å²	105	161.1 Å²	161.1	73%	0.734	80%	0.798	S	S	*	*			trans	47.4	124.2	134	-168.9	0	0	0	0	123.7
585	K	27.6	Very low	34.4	Very low	204 Å²	204	157.5 Å²	157.5	89%	0.887	80%	0.795	S	S	*	*				-172.5	139.3	107.1	-98.8	179.3	179.5	-178.6	0	112.7
586	H	29.9	Very low	33.1	Very low	175 Å²	175	158.3 Å²	158.3	81%	0.81	80%	0.801	S	S	*	*			trans	-87.3	177.2	174.3	-121.2	-99.1	0	0	0	111
587	P	42.3	Very low	32	Very low	100 Å²	100	159 Å²	159	65%	0.649	81%	0.808	S	S	*	*			cis	-140.4	177.2	8	36.5	-13.7	0	0	0	118.5
588	D	27.5	Very low	31.3	Very low	145 Å²	145	157.1 Å²	157.1	78%	0.775	81%	0.808	S	S	*	*			trans	66.5	107.2	157.7	-66.6	-17.7	0	0	0	121.7
589	E	27.3	Very low	30.6	Very low	187 Å²	187	155.4 Å²	155.4	87%	0.874	81%	0.807	S	S	*	*				-172.5	167.7	112.6	-117	-172.1	155.6	0	0	114.4
590	K	27.4	Very low	30.4	Very low	180 Å²	180	161.1 Å²	161.1	78%	0.783	81%	0.813	S	S	*	*			trans	-80	160.6	-160.2	-69	156.6	174.2	162.1	0	115.4
591	R	26.6	Very low	30.3	Very low	224 Å²	224	161.3 Å²	161.3	85%	0.845	80%	0.804	S	S	*	*			trans	69.2	106.1	147	-83.3	177.4	171.7	163	-3.4	118.6
592	L	28.9	Very low	30.3	Very low	159 Å²	159	155.9 Å²	155.9	83%	0.832	80%	0.801	S	S	*	*			trans	-61.8	123.5	152	-86.6	102.2	0	0	0	110.8
593	H	26.4	Very low	30.9	Very low	168 Å²	168	155 Å²	155	78%	0.778	81%	0.807	S	S	*	*			trans	-116.4	122.6	149.1	-87.5	-87.5	0	0	0	107.7	G595	H593-G595 PolarHBondContact O-N 2.98Å
594	F	30.4	Very low	31.6	Very low	207 Å²	207	152.2 Å²	152.2	91%	0.908	80%	0.8	S	S	*	*			trans	-66.3	112	165.9	-102.7	-99.5	0	0	0	108.2
595	G	26.3	Very low	32.9	Very low	69 Å²	69	157.3 Å²	157.3	71%	0.711	80%	0.803	S	S	*	*			trans	-126.1	120.9	174.8	0	0	0	0	0	110.5	H593	H593-G595 PolarHBondContact O-N 2.98Å
596	N	27.8	Very low	35.1	Very low	162 Å²	162	151.7 Å²	151.7	87%	0.866	79%	0.786	S	S	*	*			trans	-17.6	119.5	175.8	-66.1	-15.3	0	0	0	117.2	H598	N596-H598 PolarHBondContact O-N 3.1Å
597	G	28.4	Very low	37.5	Very low	79 Å²	79	145.6 Å²	145.6	81%	0.814	76%	0.756	S	S	*	*			trans	-70.2	114.6	167.7	0	0	0	0	0	111.8
598	H	35	Very low	39.3	Very low	169 Å²	169	143.2 Å²	143.2	78%	0.782	74%	0.74	S	S	*	*			trans	-100.5	112.9	156.3	-118.3	79.7	0	0	0	107.8	N596 R600	N596-H598 PolarHBondContact O-N 3.1Å; H598-R600 PolarHBondContact O-N 3.41Å; H598-R600 VanDerWaalsContact O-N 3.15Å
599	L	30.3	Very low	41.6	Very low	157 Å²	157	139.4 Å²	139.4	82%	0.822	72%	0.719	S	S	*	*			trans	-61.7	111.9	168.9	-101.1	93.2	0	0	0	108.7	L601	L599-L601 PolarHBondContact O-N 3.49Å
600	R	30.5	Very low	43.7	Very low	228 Å²	228	130.7 Å²	130.7	86%	0.86	68%	0.679	S	S	*	*			trans	-81.4	101.2	164.5	-73.8	-152	173.1	-167.1	0.9	109.4	H598	H598-R600 PolarHBondContact O-N 3.41Å; H598-R600 VanDerWaalsContact O-N 3.15Å
601	L	33	Very low	45.6	Very low	136 Å²	136	128.1 Å²	128.1	71%	0.712	67%	0.669	S	S	*	*			trans	-72.8	136.8	160.4	-81.1	140.1	0	0	0	108.8	L599 G603	L599-L601 PolarHBondContact O-N 3.49Å; L601-G603 PolarHBondContact O-N 3.32Å
602	P	35.8	Very low	47.8	Very low	132 Å²	132	122.5 Å²	122.5	86%	0.857	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	118	178	3	11.1	0	0	0	109.7
603	G	46.3	Very low	49.6	Very low	79 Å²	79	117.3 Å²	117.3	81%	0.814	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.5	-9.7	162.8	0	0	0	0	0	117.7	L601	L601-G603 PolarHBondContact O-N 3.32Å
604	I	45	Very low	51.5	Low	132 Å²	132	119.1 Å²	119.1	68%	0.677	64%	0.638	S	S	*	*			trans	-117.8	101.8	175.1	-54.5	175.6	0	0	0	108.3	T606	I604-T606 HydrophobicContact CG2-CG2 3.84Å; I604-T606 PolarHBondContact O-N 2.51Å
605	R	58.1	Low	53.5	Low	211 Å²	211	112.8 Å²	112.8	80%	0.796	61%	0.614	S	S	*	*			trans	-74.5	114.7	164.7	-74.5	-176.8	171.8	-178.1	-3	106.5	M751	R605-M751 HydrophobicContact CB-CE 4.11Å; R605-M751 HydrophobicContact CB-SD 4.17Å
606	T	74.4	Confident	55.5	Low	86 Å²	86	110.3 Å²	110.3	53%	0.528	59%	0.585	S	S	.	*			trans	-102.6	146.3	171.1	40.9	0	0	0	0	108.6	I604	I604-T606 HydrophobicContact CG2-CG2 3.84Å; I604-T606 PolarHBondContact O-N 2.51Å
607	Y	79.5	Confident	57.8	Low	47 Å²	47	104.3 Å²	104.3	18%	0.184	56%	0.556	C	S	.	*			trans	-59.5	136.3	174.6	167.4	-102.9	0	0	0	110.9	D609 P610 I684 F688 M751 Y753	Y607-D609 HydrophobicContact CE1-CB 4.03Å; Y607-P610 WeakPolarHBondContact OH-CD 3.47Å; Y607-I684 HydrophobicContact CE2-CG1 4.29Å; Y607-I684 HydrophobicContact CE2-CG2 4.11Å; Y607-F688 HydrophobicContact CD2-CE1 4.07Å; Y607-F688 AromaticContact CD2-CZ 3.81Å; Y607-F688 HydrophobicContact CD2-CZ 3.81Å; Y607-F688 HydrophobicContact CE2-CZ 4.23Å; Y607-M751 VanDerWaalsContact CB-O 3.31Å; Y607-M751 WeakPolarHBondContact CB-O 3.44Å; Y607-M751 PolarHBondContact N-O 2.81Å; Y607-Y753 AromaticContact CD1-CD2 3.81Å; Y607-Y753 HydrophobicContact CD1-CD2 3.81Å; Y607-Y753 AromaticContact CD2-CD2 3.64Å; Y607-Y753 HydrophobicContact CD2-CD2 3.64Å; Y607-Y753 HydrophobicContact CD2-CE2 4.34Å; Y607-Y753 HydrophobicContact CD2-CG 4.47Å; Y607-Y753 AromaticContact CE1-CD2 3.69Å; Y607-Y753 HydrophobicContact CE1-CD2 3.69Å; Y607-Y753 HydrophobicContact CE1-CE2 4.13Å; Y607-Y753 AromaticContact CE2-CD2 3.52Å; Y607-Y753 HydrophobicContact CE2-CD2 3.52Å; Y607-Y753 AromaticContact CE2-CE2 3.76Å; Y607-Y753 HydrophobicContact CE2-CE2 3.76Å; Y607-Y753 AromaticContact CG-CD2 3.77Å; Y607-Y753 HydrophobicContact CG-CD2 3.77Å; Y607-Y753 HydrophobicContact CG-CG 4.46Å; Y607-Y753 AromaticContact CZ-CD2 3.53Å; Y607-Y753 AromaticContact CZ-CE2 3.62Å
608	V	80.9	Confident	60.2	Low	51 Å²	51	106.1 Å²	106.1	31%	0.309	54%	0.543	S	S	.	.			trans	-112.4	122.5	174.4	-177.7	0	0	0	0	108.2	P610 Y613 F623 Q687	V608-P610 WeakPolarHBondContact O-CD 3.25Å; V608-Y613 HydrophobicContact CG1-CE2 4.19Å; V608-F623 HydrophobicContact CB-CZ 4.14Å; V608-F623 HydrophobicContact CG1-CZ 4.38Å; V608-Q687 PolarHBondContact O-NE2 2.95Å; V608-Q687 PolarHBondContact O-OE1 3.09Å
609	D	75.1	Confident	62.3	Low	64 Å²	64	98 Å²	98	34%	0.342	51%	0.506	S	S	.	.			trans	-68.4	115.1	178.6	-173.1	-14.5	0	0	0	110.5	Y607 H611 T612	Y607-D609 HydrophobicContact CE1-CB 4.03Å; D609-H611 PolarHBondContact O-N 3.14Å; D609-H611 WeakPolarHBondContact OD1-CB 3.45Å; D609-H611 IonicContact OD1-CE1 2.66Å; D609-H611 IonicContact OD1-CG 2.67Å; D609-H611 PolarHBondContact OD1-N 2.72Å; D609-H611 IonicContact OD1-ND1 3.86Å; D609-H611 PolarHBondContact OD1-ND1 3.03Å; D609-T612 HydrophobicContact CB-CG2 4.33Å; D609-T612 PolarHBondContact O-N 2.81Å; D609-T612 PolarHBondContact O-OG1 2.86Å
610	P	70.9	Confident	64.8	Low	4 Å²	4	90.8 Å²	90.8	3%	0.026	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-60.1	-19.7	-179.9	-26.3	38.5	0	0	0	114	Y607 V608 T612 Y613 A619 I684	Y607-P610 WeakPolarHBondContact OH-CD 3.47Å; V608-P610 WeakPolarHBondContact O-CD 3.25Å; P610-T612 PolarHBondContact O-N 2.99Å; P610-Y613 WeakPolarHBondContact O-CB 3.24Å; P610-Y613 WeakPolarHBondContact O-CD2 3.43Å; P610-Y613 PolarHBondContact O-N 2.79Å; P610-Y613 VanDerWaalsContact O-N 3.16Å; P610-A619 HydrophobicContact CB-CB 4Å; P610-I684 HydrophobicContact CG-CG1 3.83Å
611	H	68.8	Low	67.3	Low	127 Å²	127	86.6 Å²	86.6	59%	0.588	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-70.4	-8.7	175.7	-59.3	90.9	0	0	0	113.5	D609 Y613	D609-H611 PolarHBondContact O-N 3.14Å; D609-H611 WeakPolarHBondContact OD1-CB 3.45Å; D609-H611 IonicContact OD1-CE1 2.66Å; D609-H611 IonicContact OD1-CG 2.67Å; D609-H611 PolarHBondContact OD1-N 2.72Å; D609-H611 IonicContact OD1-ND1 3.86Å; D609-H611 PolarHBondContact OD1-ND1 3.03Å; H611-Y613 PolarHBondContact O-N 2.99Å
612	T	72.2	Confident	69.7	Low	106 Å²	106	84.8 Å²	84.8	65%	0.65	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-75.5	-9.5	170.5	63.5	0	0	0	0	113.1	D609 P610	D609-T612 HydrophobicContact CB-CG2 4.33Å; D609-T612 PolarHBondContact O-N 2.81Å; D609-T612 PolarHBondContact O-OG1 2.86Å; P610-T612 PolarHBondContact O-N 2.99Å
613	Y	66.8	Low	72.1	Confident	50 Å²	50	80.4 Å²	80.4	20%	0.196	41%	0.413	C	S	.	.	S	Bend	trans	-90.4	136.9	175.6	-67.1	-107.4	0	0	0	110.1	V608 P610 H611 D615 Q618 A619 E622 F623	V608-Y613 HydrophobicContact CG1-CE2 4.19Å; P610-Y613 WeakPolarHBondContact O-CB 3.24Å; P610-Y613 WeakPolarHBondContact O-CD2 3.43Å; P610-Y613 PolarHBondContact O-N 2.79Å; P610-Y613 VanDerWaalsContact O-N 3.16Å; H611-Y613 PolarHBondContact O-N 2.99Å; Y613-D615 VanDerWaalsContact C-N 3.33Å; Y613-Q618 HydrophobicContact CD1-CB 4.26Å; Y613-Q618 HydrophobicContact CD1-CG 4.07Å; Y613-Q618 HydrophobicContact CE1-CG 4.38Å; Y613-A619 HydrophobicContact CD1-CB 4.35Å; Y613-A619 HydrophobicContact CD2-CB 3.98Å; Y613-A619 HydrophobicContact CE2-CB 4.43Å; Y613-A619 HydrophobicContact CG-CB 3.97Å; Y613-E622 WeakPolarHBondContact CE1-OE2 3.46Å; Y613-E622 VanDerWaalsContact CZ-OE2 3.31Å; Y613-E622 VanDerWaalsContact OH-CD 3.28Å; Y613-E622 PolarHBondContact OH-OE2 3.23Å; Y613-F623 HydrophobicContact CE2-CE2 4.16Å
614	E	66.6	Low	74.2	Confident	206 Å²	206	77.3 Å²	77.3	96%	0.963	38%	0.38	S	S	*	.	S	Bend	trans	-68.6	-32.2	175.9	-68.6	-175.4	169.9	0	0	112.2
615	D	72.4	Confident	76.4	Confident	74 Å²	74	76.5 Å²	76.5	40%	0.396	37%	0.372	S	S	.	.			trans	-119.2	115.8	174.2	-178.7	6.4	0	0	0	111.1	Y613 S617 Q618	Y613-D615 VanDerWaalsContact C-N 3.33Å; D615-S617 PolarHBondContact O-N 3.42Å; D615-S617 VanDerWaalsContact OD1-CB 3.27Å; D615-S617 WeakPolarHBondContact OD1-CB 3.33Å; D615-S617 PolarHBondContact OD1-N 3Å; D615-S617 PolarHBondContact OD1-OG 3.39Å; D615-Q618 VanDerWaalsContact O-CB 3.27Å; D615-Q618 WeakPolarHBondContact O-CB 3.34Å; D615-Q618 PolarHBondContact O-N 2.8Å
616	P	68.3	Low	78	Confident	16 Å²	16	68.8 Å²	68.8	10%	0.104	35%	0.345	C	S	.	.	H	α-helix	trans	-65.7	-17.8	178.1	15.5	-19.9	0	0	0	113.7	Q618 A619 V620 R676 L679	P616-Q618 PolarHBondContact O-N 3.39Å; P616-A619 PolarHBondContact O-N 3.18Å; P616-V620 WeakPolarHBondContact O-CG2 3.39Å; P616-V620 PolarHBondContact O-N 3Å; P616-R676 HydrophobicContact CG-CB 3.84Å; P616-R676 HydrophobicContact CG-CG 3.41Å; P616-R676 VanDerWaalsContact CG-CG 3.41Å; P616-L679 HydrophobicContact CB-CB 4.43Å
617	S	75.7	Confident	78.8	Confident	37 Å²	37	65.2 Å²	65.2	26%	0.259	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-30.2	171.9	-38.6	0	0	0	0	111.3	D615 H621 R675	D615-S617 PolarHBondContact O-N 3.42Å; D615-S617 VanDerWaalsContact OD1-CB 3.27Å; D615-S617 WeakPolarHBondContact OD1-CB 3.33Å; D615-S617 PolarHBondContact OD1-N 3Å; D615-S617 PolarHBondContact OD1-OG 3.39Å; S617-H621 WeakPolarHBondContact O-CB 3.29Å; S617-H621 PolarHBondContact O-N 3.02Å; S617-H621 VanDerWaalsContact O-N 3.11Å; S617-R675 PolarHBondContact OG-NH1 3.29Å; S617-R675 PolarHBondContact OG-NH2 3.19Å
618	Q	79	Confident	79.3	Confident	116 Å²	116	67.8 Å²	67.8	54%	0.542	34%	0.339	S	S	.	.	H	α-helix	trans	-72	-42.6	175.5	-170.6	178.5	-1.1	0	0	111.7	Y613 D615 P616 H621 E622	Y613-Q618 HydrophobicContact CD1-CB 4.26Å; Y613-Q618 HydrophobicContact CD1-CG 4.07Å; Y613-Q618 HydrophobicContact CE1-CG 4.38Å; D615-Q618 VanDerWaalsContact O-CB 3.27Å; D615-Q618 WeakPolarHBondContact O-CB 3.34Å; D615-Q618 PolarHBondContact O-N 2.8Å; P616-Q618 PolarHBondContact O-N 3.39Å; Q618-H621 PolarHBondContact O-N 3.42Å; Q618-E622 PolarHBondContact O-N 2.96Å; Q618-E622 VanDerWaalsContact O-N 3.09Å
619	A	79	Confident	79.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-42.6	176	0	0	0	0	0	111.8	P610 Y613 P616 H621 E622 F623	P610-A619 HydrophobicContact CB-CB 4Å; Y613-A619 HydrophobicContact CD1-CB 4.35Å; Y613-A619 HydrophobicContact CD2-CB 3.98Å; Y613-A619 HydrophobicContact CE2-CB 4.43Å; Y613-A619 HydrophobicContact CG-CB 3.97Å; P616-A619 PolarHBondContact O-N 3.18Å; A619-H621 VanDerWaalsContact C-N 3.32Å; A619-H621 PolarHBondContact O-N 3.47Å; A619-E622 PolarHBondContact O-N 2.92Å; A619-F623 HydrophobicContact CB-CD2 4.45Å; A619-F623 WeakPolarHBondContact O-CD2 3.41Å; A619-F623 PolarHBondContact O-N 3.06Å
620	V	83.6	Confident	80.3	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.024	36%	0.357	C	S	.	.	H	α-helix	trans	-60.7	-42.1	174.2	173.1	0	0	0	0	111.2	P616 E622 F623 A624 L679 S683 V699 T701	P616-V620 WeakPolarHBondContact O-CG2 3.39Å; P616-V620 PolarHBondContact O-N 3Å; V620-E622 VanDerWaalsContact C-N 3.26Å; V620-E622 PolarHBondContact O-N 3.19Å; V620-F623 PolarHBondContact O-N 3.04Å; V620-A624 HydrophobicContact CG1-CB 4.04Å; V620-A624 WeakPolarHBondContact O-CA 3.41Å; V620-A624 WeakPolarHBondContact O-CB 3.3Å; V620-A624 PolarHBondContact O-N 3.45Å; V620-L679 HydrophobicContact CG2-CB 3.7Å; V620-L679 HydrophobicContact CG2-CD2 4.12Å; V620-L679 HydrophobicContact CG2-CG 4.33Å; V620-L679 VanDerWaalsContact CG2-O 3.24Å; V620-L679 WeakPolarHBondContact CG2-O 3.41Å; V620-S683 WeakPolarHBondContact CA-OG 3.34Å; V620-S683 WeakPolarHBondContact CG2-OG 3.27Å; V620-S683 PolarHBondContact N-OG 3.02Å; V620-V699 HydrophobicContact CG1-CB 4.49Å; V620-V699 HydrophobicContact CG1-CG1 4.43Å; V620-V699 HydrophobicContact CG1-CG2 3.66Å; V620-T701 HydrophobicContact CG1-CG2 4.17Å
621	H	82.1	Confident	81.2	Confident	141 Å²	141	70.5 Å²	70.5	65%	0.653	37%	0.367	S	S	*	.	H	α-helix	trans	-65.7	-30	179	-169	57.6	0	0	0	113	S617 Q618 A619	S617-H621 WeakPolarHBondContact O-CB 3.29Å; S617-H621 PolarHBondContact O-N 3.02Å; S617-H621 VanDerWaalsContact O-N 3.11Å; Q618-H621 PolarHBondContact O-N 3.42Å; A619-H621 VanDerWaalsContact C-N 3.32Å; A619-H621 PolarHBondContact O-N 3.47Å
622	E	83.5	Confident	82.3	Confident	97 Å²	97	65.5 Å²	65.5	45%	0.453	35%	0.345	S	S	.	.	H	α-helix	trans	-78.1	-39.7	177.8	-171.9	171.3	170.8	0	0	112.7	Y613 Q618 A619 V620	Y613-E622 WeakPolarHBondContact CE1-OE2 3.46Å; Y613-E622 VanDerWaalsContact CZ-OE2 3.31Å; Y613-E622 VanDerWaalsContact OH-CD 3.28Å; Y613-E622 PolarHBondContact OH-OE2 3.23Å; Q618-E622 PolarHBondContact O-N 2.96Å; Q618-E622 VanDerWaalsContact O-N 3.09Å; A619-E622 PolarHBondContact O-N 2.92Å; V620-E622 VanDerWaalsContact C-N 3.26Å; V620-E622 PolarHBondContact O-N 3.19Å
623	F	86.4	Confident	83.1	Confident	40 Å²	40	62.3 Å²	62.3	18%	0.175	33%	0.329	C	S	.	.	H	α-helix	trans	-108	-17.9	-169.8	-56.3	-55.6	0	0	0	115.1	V608 Y613 A619 V620 G686 Q687	V608-F623 HydrophobicContact CB-CZ 4.14Å; V608-F623 HydrophobicContact CG1-CZ 4.38Å; Y613-F623 HydrophobicContact CE2-CE2 4.16Å; A619-F623 HydrophobicContact CB-CD2 4.45Å; A619-F623 WeakPolarHBondContact O-CD2 3.41Å; A619-F623 PolarHBondContact O-N 3.06Å; V620-F623 PolarHBondContact O-N 3.04Å; F623-G686 CarbonylContact O-C 3.58Å; F623-G686 VanDerWaalsContact O-CA 3.24Å; F623-G686 WeakPolarHBondContact O-CA 3.48Å; F623-Q687 HydrophobicContact CB-CG 3.97Å; F623-Q687 HydrophobicContact CD1-CG 3.57Å; F623-Q687 HydrophobicContact CD2-CG 4.16Å; F623-Q687 HydrophobicContact CE1-CG 4.08Å; F623-Q687 HydrophobicContact CG-CG 3.62Å
624	A	89.9	Confident	84.3	Confident	14 Å²	14	64.2 Å²	64.2	12%	0.116	34%	0.342	C	S	.	.	S	Bend	trans	-119.4	149.3	-177.8	0	0	0	0	0	112.5	V620 L696 V699	V620-A624 HydrophobicContact CG1-CB 4.04Å; V620-A624 WeakPolarHBondContact O-CA 3.41Å; V620-A624 WeakPolarHBondContact O-CB 3.3Å; V620-A624 PolarHBondContact O-N 3.45Å; A624-L696 HydrophobicContact CB-CD2 3.68Å; A624-V699 HydrophobicContact CB-CG1 4.05Å; A624-V699 HydrophobicContact CB-CG2 4.02Å
625	K	91	Very high	85.3	Confident	115 Å²	115	58.2 Å²	58.2	50%	0.5	32%	0.316	S	S	.	.			trans	-84.7	122	175.9	-177.7	-176.4	176	-173.3	0	110.4	L627 G698 V699	K625-L627 HydrophobicContact CD-CD2 4.25Å; K625-L627 HydrophobicContact CG-CD2 4.45Å; K625-G698 CarbonylContact O-C 3.55Å; K625-G698 WeakPolarHBondContact O-CA 3.47Å; K625-V699 PolarHBondContact O-N 2.91Å
626	E	92.4	Very high	86	Confident	49 Å²	49	60.6 Å²	60.6	23%	0.229	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-70.5	132.1	170.1	-171.9	71.6	-169.3	0	0	110.5	V699 T701 R702	E626-V699 CarbonylContact C-O 3.57Å; E626-V699 WeakPolarHBondContact CA-O 3.49Å; E626-T701 VanDerWaalsContact CD-OG1 3.28Å; E626-T701 PolarHBondContact OE1-N 3.06Å; E626-T701 PolarHBondContact OE1-OG1 3.42Å; E626-T701 PolarHBondContact OE2-N 3.24Å; E626-T701 PolarHBondContact OE2-OG1 2.89Å; E626-R702 HydrophobicContact CG-CG 4.38Å; E626-R702 VanDerWaalsContact OE1-CG 3.31Å; E626-R702 WeakPolarHBondContact OE1-CG 3.28Å; E626-R702 PolarHBondContact OE1-N 3.45Å
627	L	91.3	Very high	86.8	Confident	11 Å²	11	63.9 Å²	63.9	6%	0.058	34%	0.343	C	S	.	.			trans	-109.8	147.9	177.5	-61.1	176.4	0	0	0	110.3	K625 I632 L651 L653 V699 V700 V709	K625-L627 HydrophobicContact CD-CD2 4.25Å; K625-L627 HydrophobicContact CG-CD2 4.45Å; L627-I632 HydrophobicContact CB-CD1 4.36Å; L627-I632 HydrophobicContact CD1-CD1 4.32Å; L627-L651 HydrophobicContact CD1-CD1 4.15Å; L627-L651 HydrophobicContact CD1-CD2 3.97Å; L627-L653 HydrophobicContact CD2-CD2 4.12Å; L627-V699 PolarHBondContact N-O 3.1Å; L627-V700 HydrophobicContact CB-CG2 4.1Å; L627-V709 HydrophobicContact CD1-CB 4.04Å; L627-V709 HydrophobicContact CD1-CG1 4.47Å; L627-V709 HydrophobicContact CD1-CG2 3.98Å
628	D	89.4	Confident	87.1	Confident	101 Å²	101	65.6 Å²	65.6	54%	0.54	35%	0.352	S	S	.	.			trans	-78.9	131.2	169.2	-165.7	-61.1	0	0	0	109.4	S630 C631	D628-S630 VanDerWaalsContact CG-OG 3.31Å; D628-S630 PolarHBondContact O-N 3.08Å; D628-S630 VanDerWaalsContact OD1-CB 3.27Å; D628-S630 WeakPolarHBondContact OD1-CB 3.26Å; D628-S630 PolarHBondContact OD1-N 3.22Å; D628-S630 PolarHBondContact OD1-OG 3.4Å; D628-C631 WeakPolarHBondContact O-CB 3.28Å; D628-C631 PolarHBondContact O-N 2.86Å
629	A	88.8	Confident	86.7	Confident	38 Å²	38	61.6 Å²	61.6	31%	0.314	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-59	-29	180	0	0	0	0	0	112.8	C631 I632 V700 M707	A629-C631 PolarHBondContact O-N 3.44Å; A629-I632 PolarHBondContact O-N 3.47Å; A629-V700 HydrophobicContact CB-CG1 4.18Å; A629-M707 HydrophobicContact CB-CE 4.3Å
630	S	88.7	Confident	86.2	Confident	101 Å²	101	65.1 Å²	65.1	71%	0.706	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-67	-19.2	176.7	64.9	0	0	0	0	113.8	D628 I632	D628-S630 VanDerWaalsContact CG-OG 3.31Å; D628-S630 PolarHBondContact O-N 3.08Å; D628-S630 VanDerWaalsContact OD1-CB 3.27Å; D628-S630 WeakPolarHBondContact OD1-CB 3.26Å; D628-S630 PolarHBondContact OD1-N 3.22Å; D628-S630 PolarHBondContact OD1-OG 3.4Å; S630-I632 VanDerWaalsContact C-N 3.29Å
631	C	89.5	Confident	85.2	Confident	37 Å²	37	65.8 Å²	65.8	25%	0.25	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-82.5	-6.8	177.2	-66.5	0	0	0	0	113.2	D628 A629 L651 K652	D628-C631 WeakPolarHBondContact O-CB 3.28Å; D628-C631 PolarHBondContact O-N 2.86Å; A629-C631 PolarHBondContact O-N 3.44Å; C631-L651 HydrophobicContact CB-CD1 4.11Å; C631-L651 WeakPolarHBondContact O-CA 3.23Å; C631-K652 WeakPolarHBondContact CB-O 3.42Å; C631-K652 PolarHBondContact O-N 2.72Å
632	I	91.4	Very high	84.2	Confident	22 Å²	22	63.1 Å²	63.1	11%	0.113	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126	-174.8	-62.6	164	0	0	0	109.4	L627 A629 S630 I634 L651 I663 V700 M707 V709	L627-I632 HydrophobicContact CB-CD1 4.36Å; L627-I632 HydrophobicContact CD1-CD1 4.32Å; A629-I632 PolarHBondContact O-N 3.47Å; S630-I632 VanDerWaalsContact C-N 3.29Å; I632-I634 HydrophobicContact CG2-CG1 4.48Å; I632-L651 HydrophobicContact CG1-CD1 3.88Å; I632-I663 HydrophobicContact CG2-CD1 3.41Å; I632-I663 VanDerWaalsContact CG2-CD1 3.41Å; I632-I663 HydrophobicContact CG2-CG1 4.22Å; I632-V700 HydrophobicContact CD1-CG2 3.43Å; I632-V700 VanDerWaalsContact CD1-CG2 3.43Å; I632-M707 HydrophobicContact CD1-CE 4.25Å; I632-V709 HydrophobicContact CD1-CG2 3.78Å
633	A	90.4	Very high	83.3	Confident	39 Å²	39	59.2 Å²	59.2	32%	0.322	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122.8	168.9	0	0	0	0	0	109	G649 R650	A633-G649 CarbonylContact O-C 3.52Å; A633-G649 WeakPolarHBondContact O-CA 3.48Å; A633-R650 HydrophobicContact CB-CB 4.48Å; A633-R650 PolarHBondContact N-O 3.15Å; A633-R650 PolarHBondContact O-N 3.43Å
634	I	90.3	Very high	82.5	Confident	90 Å²	90	57.3 Å²	57.3	46%	0.462	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.9	175.2	-61	173.3	0	0	0	107.8	I632 C647 I663 M707	I632-I634 HydrophobicContact CG2-CG1 4.48Å; I634-C647 HydrophobicContact CG2-CB 3.54Å; I634-I663 HydrophobicContact CG1-CD1 3.84Å; I634-M707 HydrophobicContact CD1-SD 4.47Å
635	D	87.9	Confident	82.1	Confident	80 Å²	80	61 Å²	61	43%	0.428	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-64.9	-176.3	-66.9	-43.2	0	0	0	112.1	S648 R650	D635-S648 WeakPolarHBondContact CB-O 3.23Å; D635-S648 PolarHBondContact N-O 3.01Å; D635-R650 IonicContact OD1-CZ 3.5Å; D635-R650 IonicContact OD1-NE 2.73Å; D635-R650 PolarHBondContact OD1-NE 3.18Å; D635-R650 IonicContact OD1-NH2 3.96Å; D635-R650 PolarHBondContact OD1-NH2 2.84Å; D635-R650 IonicContact OD2-CZ 2.73Å; D635-R650 IonicContact OD2-NE 2.79Å; D635-R650 PolarHBondContact OD2-NE 2.93Å; D635-R650 IonicContact OD2-NH2 3.47Å
636	K	87.6	Confident	81.9	Confident	124 Å²	124	57.4 Å²	57.4	54%	0.539	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.2	-178.5	61.3	170.2	-177.5	179.9	0	111.8	V638 C647 S648	K636-V638 HydrophobicContact CG-CG2 4.48Å; K636-C647 CarbonylContact O-C 3.15Å; K636-C647 WeakPolarHBondContact O-CA 3.41Å; K636-C647 WeakPolarHBondContact O-CB 3.37Å; K636-S648 WeakPolarHBondContact CE-OG 3.45Å; K636-S648 WeakPolarHBondContact CG-OG 3.31Å; K636-S648 PolarHBondContact N-O 3.02Å; K636-S648 PolarHBondContact O-N 3.19Å
637	V	85.8	Confident	81.8	Confident	85 Å²	85	55.3 Å²	55.3	52%	0.515	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	127.5	169.1	-175.6	0	0	0	0	108.4	E645	V637-E645 HydrophobicContact CG1-CB 4.31Å; V637-E645 HydrophobicContact CG1-CG 4.43Å
638	V	80.3	Confident	81.8	Confident	74 Å²	74	55.3 Å²	55.3	45%	0.448	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-30.6	-178.4	-179.9	0	0	0	0	110.6	K636 V646 S648 Y712	K636-V638 HydrophobicContact CG-CG2 4.48Å; V638-V646 PolarHBondContact N-O 3.01Å; V638-S648 VanDerWaalsContact CG2-N 3.3Å; V638-Y712 HydrophobicContact CG2-CE2 4.12Å
639	G	71.8	Confident	82	Confident	31 Å²	31	50.6 Å²	50.6	32%	0.32	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	173.7	174.1	0	0	0	0	0	111.4	V646	G639-V646 PolarHBondContact N-O 3.31Å; G639-V646 VanDerWaalsContact N-O 3.1Å; G639-V646 PolarHBondContact O-N 3.2Å
640	A	68.5	Low	82.2	Confident	75 Å²	75	53.5 Å²	53.5	62%	0.62	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.6	166	0	0	0	0	0	107.7
641	G	61.5	Low	82.4	Confident	18 Å²	18	48.7 Å²	48.7	19%	0.186	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	-177.7	170.2	0	0	0	0	0	111.2	F643 G644	G641-F643 VanDerWaalsContact C-N 3.29Å; G641-F643 PolarHBondContact O-N 3.41Å; G641-F643 VanDerWaalsContact O-N 3.1Å; G641-G644 PolarHBondContact N-O 3.44Å; G641-G644 PolarHBondContact O-N 2.84Å
642	E	61.8	Low	82.4	Confident	84 Å²	84	52.8 Å²	52.8	39%	0.393	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-45.2	-173.5	-175.1	-179.2	-175.4	0	0	115	E783	E642-E783 PolarHBondContact N-OE1 2.97Å; E642-E783 VanDerWaalsContact N-OE1 3.15Å
643	F	63.7	Low	81.9	Confident	15 Å²	15	52.9 Å²	52.9	7%	0.066	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-14.7	-173.9	-60.7	-73.8	0	0	0	113.8	G641 T665 L666 K667 Q674 D677 F678	G641-F643 VanDerWaalsContact C-N 3.29Å; G641-F643 PolarHBondContact O-N 3.41Å; G641-F643 VanDerWaalsContact O-N 3.1Å; F643-T665 CarbonylContact C-O 3.23Å; F643-L666 HydrophobicContact CB-CD1 3.81Å; F643-L666 HydrophobicContact CD1-CD1 4.01Å; F643-L666 HydrophobicContact CG-CD1 4.33Å; F643-L666 WeakPolarHBondContact O-CA 3.43Å; F643-K667 PolarHBondContact O-N 3.39Å; F643-Q674 HydrophobicContact CD1-CB 4.45Å; F643-Q674 HydrophobicContact CE1-CB 4.42Å; F643-Q674 WeakPolarHBondContact CE1-O 3.39Å; F643-D677 HydrophobicContact CE1-CB 3.95Å; F643-D677 HydrophobicContact CZ-CB 3.85Å; F643-F678 HydrophobicContact CB-CD2 3.44Å; F643-F678 VanDerWaalsContact CB-CD2 3.44Å; F643-F678 HydrophobicContact CB-CE2 3.75Å; F643-F678 HydrophobicContact CB-CG 4.41Å; F643-F678 HydrophobicContact CD1-CB 3.85Å; F643-F678 AromaticContact CD1-CD2 3.98Å; F643-F678 HydrophobicContact CD1-CD2 3.98Å; F643-F678 HydrophobicContact CD1-CG 4.37Å; F643-F678 AromaticContact CD2-CD2 3.72Å; F643-F678 HydrophobicContact CD2-CD2 3.72Å; F643-F678 HydrophobicContact CD2-CE2 4.45Å; F643-F678 HydrophobicContact CE1-CB 4.04Å; F643-F678 HydrophobicContact CE2-CD2 4.46Å; F643-F678 HydrophobicContact CG-CB 4.18Å; F643-F678 AromaticContact CG-CD2 3.43Å; F643-F678 HydrophobicContact CG-CD2 3.43Å; F643-F678 VanDerWaalsContact CG-CD2 3.43Å; F643-F678 HydrophobicContact CG-CE2 4.2Å; F643-F678 HydrophobicContact CG-CG 4.25Å; F643-F678 HydrophobicContact CZ-CB 4.5Å
644	G	71.4	Confident	80.8	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.9	-155.1	-176.2	0	0	0	0	0	114.3	G641 T665	G641-G644 PolarHBondContact N-O 3.44Å; G641-G644 PolarHBondContact O-N 2.84Å; G644-T665 VanDerWaalsContact CA-O 3.3Å; G644-T665 WeakPolarHBondContact CA-O 3.42Å
645	E	81.5	Confident	79.6	Confident	92 Å²	92	58.3 Å²	58.3	43%	0.43	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	138.9	-178.3	-67	172.2	-179.3	0	0	110.1	V637 T665	V637-E645 HydrophobicContact CG1-CB 4.31Å; V637-E645 HydrophobicContact CG1-CG 4.43Å; E645-T665 PolarHBondContact O-N 3.4Å; E645-T665 PolarHBondContact O-OG1 2.96Å; E645-T665 VanDerWaalsContact O-OG1 3.06Å
646	V	86.4	Confident	78.6	Confident	39 Å²	39	60.9 Å²	60.9	24%	0.236	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.2	167.9	-178.1	0	0	0	0	107	V638 G639 I663 K664	V638-V646 PolarHBondContact N-O 3.01Å; G639-V646 PolarHBondContact N-O 3.31Å; G639-V646 VanDerWaalsContact N-O 3.1Å; G639-V646 PolarHBondContact O-N 3.2Å; V646-I663 WeakPolarHBondContact CA-O 3.36Å; V646-K664 HydrophobicContact CG2-CG 4.12Å
647	C	88.9	Confident	78	Confident	5 Å²	5	64 Å²	64	3%	0.034	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	144.9	-179.5	-54	0	0	0	0	110.5	I634 K636 A662 I663	I634-C647 HydrophobicContact CG2-CB 3.54Å; K636-C647 CarbonylContact O-C 3.15Å; K636-C647 WeakPolarHBondContact O-CA 3.41Å; K636-C647 WeakPolarHBondContact O-CB 3.37Å; C647-A662 CarbonylContact O-C 3.56Å; C647-A662 WeakPolarHBondContact O-CA 3.33Å; C647-I663 PolarHBondContact N-O 3.16Å; C647-I663 PolarHBondContact O-N 2.92Å
648	S	91.9	Very high	78	Confident	12 Å²	12	63.8 Å²	63.8	8%	0.084	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	145.9	161.9	64.6	0	0	0	0	108.9	D635 K636 V638 V661	D635-S648 WeakPolarHBondContact CB-O 3.23Å; D635-S648 PolarHBondContact N-O 3.01Å; K636-S648 WeakPolarHBondContact CE-OG 3.45Å; K636-S648 WeakPolarHBondContact CG-OG 3.31Å; K636-S648 PolarHBondContact N-O 3.02Å; K636-S648 PolarHBondContact O-N 3.19Å; V638-S648 VanDerWaalsContact CG2-N 3.3Å; S648-V661 CarbonylContact C-O 3.44Å; S648-V661 WeakPolarHBondContact CA-O 3.14Å
649	G	93.2	Very high	78.5	Confident	2 Å²	2	62.3 Å²	62.3	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	-168.6	176.7	0	0	0	0	0	112.8	A633 C660 V661	A633-G649 CarbonylContact O-C 3.52Å; A633-G649 WeakPolarHBondContact O-CA 3.48Å; G649-C660 WeakPolarHBondContact O-CA 3.35Å; G649-V661 PolarHBondContact N-O 3.27Å; G649-V661 WeakPolarHBondContact O-CG2 3.41Å; G649-V661 PolarHBondContact O-N 3.13Å
650	R	92.9	Very high	79.4	Confident	99 Å²	99	65 Å²	65	37%	0.374	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	132.9	-179	-73	172	-72.8	169.2	-3.5	110.3	A633 D635 E658 I659	A633-R650 HydrophobicContact CB-CB 4.48Å; A633-R650 PolarHBondContact N-O 3.15Å; A633-R650 PolarHBondContact O-N 3.43Å; D635-R650 IonicContact OD1-CZ 3.5Å; D635-R650 IonicContact OD1-NE 2.73Å; D635-R650 PolarHBondContact OD1-NE 3.18Å; D635-R650 IonicContact OD1-NH2 3.96Å; D635-R650 PolarHBondContact OD1-NH2 2.84Å; D635-R650 IonicContact OD2-CZ 2.73Å; D635-R650 IonicContact OD2-NE 2.79Å; D635-R650 PolarHBondContact OD2-NE 2.93Å; D635-R650 IonicContact OD2-NH2 3.47Å; R650-E658 HydrophobicContact CB-CG 3.77Å; R650-E658 WeakPolarHBondContact CB-OE1 3.23Å; R650-E658 WeakPolarHBondContact CD-OE1 3.46Å; R650-E658 HydrophobicContact CG-CG 4.07Å; R650-E658 IonicContact NE-OE1 2.68Å; R650-E658 IonicContact NH1-OE1 3.46Å; R650-I659 WeakPolarHBondContact CA-O 2.99Å
651	L	92.8	Very high	80.6	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.8	176.4	169.8	64.2	0	0	0	109.7	L627 C631 I632 L653 I659 V661 E697 V709	L627-L651 HydrophobicContact CD1-CD1 4.15Å; L627-L651 HydrophobicContact CD1-CD2 3.97Å; C631-L651 HydrophobicContact CB-CD1 4.11Å; C631-L651 WeakPolarHBondContact O-CA 3.23Å; I632-L651 HydrophobicContact CG1-CD1 3.88Å; L651-L653 HydrophobicContact CD1-CD2 4.36Å; L651-L653 HydrophobicContact CD2-CD1 4.41Å; L651-L653 HydrophobicContact CD2-CD2 4.39Å; L651-L653 HydrophobicContact CD2-CG 4.28Å; L651-L653 HydrophobicContact CG-CD2 4.41Å; L651-L653 HydrophobicContact CG-CG 4.12Å; L651-I659 HydrophobicContact CB-CD1 4.22Å; L651-I659 HydrophobicContact CB-CG1 3.95Å; L651-I659 HydrophobicContact CD2-CD1 3.84Å; L651-I659 HydrophobicContact CD2-CG1 4.47Å; L651-I659 HydrophobicContact CG-CD1 4.18Å; L651-I659 HydrophobicContact CG-CG1 4.29Å; L651-I659 PolarHBondContact N-O 3.15Å; L651-I659 WeakPolarHBondContact O-CG1 3.33Å; L651-I659 PolarHBondContact O-N 2.93Å; L651-I659 VanDerWaalsContact O-N 3.13Å; L651-V661 HydrophobicContact CB-CG1 3.72Å; L651-V661 HydrophobicContact CB-CG2 3.98Å; L651-V661 HydrophobicContact CD2-CG1 4.23Å; L651-E697 HydrophobicContact CD2-CB 3.83Å; L651-E697 HydrophobicContact CD2-CG 4.29Å; L651-V709 HydrophobicContact CD2-CG1 4.3Å
652	K	89.6	Confident	82.2	Confident	122 Å²	122	61.3 Å²	61.3	53%	0.53	32%	0.317	S	S	.	.			trans	-103	105.7	176.6	-68	-179.2	-177.2	175.6	0	109.8	C631 E658	C631-K652 WeakPolarHBondContact CB-O 3.42Å; C631-K652 PolarHBondContact O-N 2.72Å; K652-E658 WeakPolarHBondContact CE-OE1 3.43Å; K652-E658 HydrophobicContact CG-CG 4.14Å; K652-E658 IonicContact NZ-OE1 3.85Å
653	L	80.7	Confident	83.7	Confident	24 Å²	24	57.3 Å²	57.3	13%	0.126	30%	0.298	C	S	.	.			trans	-93	147.5	175.8	-69.9	168.3	0	0	0	110.7	L627 L651 S655 K656 I659	L627-L653 HydrophobicContact CD2-CD2 4.12Å; L651-L653 HydrophobicContact CD1-CD2 4.36Å; L651-L653 HydrophobicContact CD2-CD1 4.41Å; L651-L653 HydrophobicContact CD2-CD2 4.39Å; L651-L653 HydrophobicContact CD2-CG 4.28Å; L651-L653 HydrophobicContact CG-CD2 4.41Å; L651-L653 HydrophobicContact CG-CG 4.12Å; L653-S655 PolarHBondContact O-N 2.96Å; L653-K656 HydrophobicContact CB-CB 4.2Å; L653-K656 HydrophobicContact CD1-CD 4.05Å; L653-K656 PolarHBondContact O-N 3.25Å; L653-I659 HydrophobicContact CD1-CD1 4.29Å
654	P	68.5	Low	85	Confident	127 Å²	127	58.4 Å²	58.4	83%	0.825	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	7.8	-175.4	-24.2	33.4	0	0	0	117.2
655	S	64.9	Low	85.8	Confident	117 Å²	117	59.2 Å²	59.2	82%	0.818	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-161.9	11.2	-174.5	41.2	0	0	0	0	113.8	L653	L653-S655 PolarHBondContact O-N 2.96Å
656	K	68.1	Low	85.9	Confident	133 Å²	133	55.1 Å²	55.1	58%	0.578	29%	0.289	S	S	*	.	S	Bend	trans	-129.7	154.4	176.8	-69.4	-172.5	174.9	-178.3	0	111.1	L653	L653-K656 HydrophobicContact CB-CB 4.2Å; L653-K656 HydrophobicContact CD1-CD 4.05Å; L653-K656 PolarHBondContact O-N 3.25Å
657	K	73.9	Confident	85.5	Confident	191 Å²	191	58.7 Å²	58.7	83%	0.83	30%	0.301	S	S	*	.			trans	-57	148.9	167.1	-167.2	175	179.7	-178.1	0	109.2	I659	K657-I659 PolarHBondContact O-N 3.05Å
658	E	85.3	Confident	84.9	Confident	80 Å²	80	62.4 Å²	62.4	37%	0.374	34%	0.34	S	S	.	.			trans	-52.3	124.1	173.4	-170.3	168.8	-145	0	0	110.2	R650 K652	R650-E658 HydrophobicContact CB-CG 3.77Å; R650-E658 WeakPolarHBondContact CB-OE1 3.23Å; R650-E658 WeakPolarHBondContact CD-OE1 3.46Å; R650-E658 HydrophobicContact CG-CG 4.07Å; R650-E658 IonicContact NE-OE1 2.68Å; R650-E658 IonicContact NH1-OE1 3.46Å; K652-E658 WeakPolarHBondContact CE-OE1 3.43Å; K652-E658 HydrophobicContact CG-CG 4.14Å; K652-E658 IonicContact NZ-OE1 3.85Å
659	I	90.3	Very high	84.1	Confident	42 Å²	42	65.8 Å²	65.8	22%	0.215	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.7	-177.5	45.7	163.9	0	0	0	110.4	R650 L651 L653 K657 V661 E697	R650-I659 WeakPolarHBondContact CA-O 2.99Å; L651-I659 HydrophobicContact CB-CD1 4.22Å; L651-I659 HydrophobicContact CB-CG1 3.95Å; L651-I659 HydrophobicContact CD2-CD1 3.84Å; L651-I659 HydrophobicContact CD2-CG1 4.47Å; L651-I659 HydrophobicContact CG-CD1 4.18Å; L651-I659 HydrophobicContact CG-CG1 4.29Å; L651-I659 PolarHBondContact N-O 3.15Å; L651-I659 WeakPolarHBondContact O-CG1 3.33Å; L651-I659 PolarHBondContact O-N 2.93Å; L651-I659 VanDerWaalsContact O-N 3.13Å; L653-I659 HydrophobicContact CD1-CD1 4.29Å; K657-I659 PolarHBondContact O-N 3.05Å; I659-V661 HydrophobicContact CD1-CG1 4.11Å; I659-V661 HydrophobicContact CG1-CG1 4.28Å; I659-E697 VanDerWaalsContact CD1-CD 3.48Å; I659-E697 HydrophobicContact CD1-CG 4.21Å; I659-E697 VanDerWaalsContact CD1-OE1 3.25Å; I659-E697 WeakPolarHBondContact CD1-OE1 3.24Å
660	C	91.4	Very high	83.3	Confident	87 Å²	87	68.9 Å²	68.9	59%	0.588	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	130	173.2	-64.1	0	0	0	0	109.5	G649 Y712	G649-C660 WeakPolarHBondContact O-CA 3.35Å; C660-Y712 PolarHBondContact O-N 2.96Å
661	V	94.6	Very high	82.8	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	152.2	-174.6	-67.3	0	0	0	0	111.5	S648 G649 L651 I659 I663 E697 V709 T710	S648-V661 CarbonylContact C-O 3.44Å; S648-V661 WeakPolarHBondContact CA-O 3.14Å; G649-V661 PolarHBondContact N-O 3.27Å; G649-V661 WeakPolarHBondContact O-CG2 3.41Å; G649-V661 PolarHBondContact O-N 3.13Å; L651-V661 HydrophobicContact CB-CG1 3.72Å; L651-V661 HydrophobicContact CB-CG2 3.98Å; L651-V661 HydrophobicContact CD2-CG1 4.23Å; I659-V661 HydrophobicContact CD1-CG1 4.11Å; I659-V661 HydrophobicContact CG1-CG1 4.28Å; V661-I663 HydrophobicContact CG2-CD1 4.05Å; V661-I663 HydrophobicContact CG2-CG1 3.87Å; V661-E697 HydrophobicContact CG1-CG 4.05Å; V661-V709 HydrophobicContact CB-CG1 3.58Å; V661-V709 HydrophobicContact CG1-CG1 3.79Å; V661-V709 HydrophobicContact CG2-CG1 3.79Å; V661-T710 CarbonylContact C-O 3.56Å; V661-T710 VanDerWaalsContact CA-O 3.31Å; V661-T710 WeakPolarHBondContact CA-O 3.4Å; V661-T710 WeakPolarHBondContact CB-O 3.4Å
662	A	93.8	Very high	82.2	Confident	16 Å²	16	73.1 Å²	73.1	13%	0.132	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	132.4	164.1	0	0	0	0	0	108.5	C647 V709 T710 Y712	C647-A662 CarbonylContact O-C 3.56Å; C647-A662 WeakPolarHBondContact O-CA 3.33Å; A662-V709 WeakPolarHBondContact O-CA 3.37Å; A662-T710 PolarHBondContact N-O 3.18Å; A662-T710 PolarHBondContact O-N 3.39Å; A662-Y712 HydrophobicContact CB-CD2 4.21Å
663	I	92.9	Very high	81.6	Confident	0 Å²	0	72 Å²	72	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	105.7	-172.4	-56.1	162.3	0	0	0	106.8	I632 I634 V646 C647 V661 T665 M707 V709	I632-I663 HydrophobicContact CG2-CD1 3.41Å; I632-I663 VanDerWaalsContact CG2-CD1 3.41Å; I632-I663 HydrophobicContact CG2-CG1 4.22Å; I634-I663 HydrophobicContact CG1-CD1 3.84Å; V646-I663 WeakPolarHBondContact CA-O 3.36Å; C647-I663 PolarHBondContact N-O 3.16Å; C647-I663 PolarHBondContact O-N 2.92Å; V661-I663 HydrophobicContact CG2-CD1 4.05Å; V661-I663 HydrophobicContact CG2-CG1 3.87Å; I663-T665 HydrophobicContact CG2-CG2 4.06Å; I663-M707 HydrophobicContact CG2-CB 4.13Å; I663-M707 HydrophobicContact CG2-CG 4.12Å; I663-M707 HydrophobicContact CG2-SD 3.72Å; I663-V709 HydrophobicContact CG1-CG1 4.42Å
664	K	91.1	Very high	81.6	Confident	38 Å²	38	74.2 Å²	74.2	17%	0.165	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.3	172.1	-159.4	179.8	-170.8	179	0	107.6	V646 F678 E681 M707 I708	V646-K664 HydrophobicContact CG2-CG 4.12Å; K664-F678 HydrophobicContact CB-CE2 4.3Å; K664-F678 HydrophobicContact CB-CZ 4.47Å; K664-F678 HydrophobicContact CD-CE2 3.86Å; K664-F678 HydrophobicContact CG-CE2 3.85Å; K664-F678 HydrophobicContact CG-CZ 4.46Å; K664-E681 IonicContact NZ-OE1 2.65Å; K664-E681 PolarHBondContact NZ-OE1 2.82Å; K664-E681 IonicContact NZ-OE2 2.63Å; K664-E681 PolarHBondContact NZ-OE2 3.42Å; K664-M707 CarbonylContact O-C 3.6Å; K664-M707 VanDerWaalsContact O-CA 3.28Å; K664-M707 WeakPolarHBondContact O-CA 3.42Å; K664-I708 HydrophobicContact CB-CB 4.29Å; K664-I708 PolarHBondContact N-O 2.93Å; K664-I708 PolarHBondContact O-N 3.11Å
665	T	88.5	Confident	82.3	Confident	17 Å²	17	71.4 Å²	71.4	10%	0.104	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	142.7	-178.8	61.7	0	0	0	0	110.7	F643 G644 E645 I663 M707	F643-T665 CarbonylContact C-O 3.23Å; G644-T665 VanDerWaalsContact CA-O 3.3Å; G644-T665 WeakPolarHBondContact CA-O 3.42Å; E645-T665 PolarHBondContact O-N 3.4Å; E645-T665 PolarHBondContact O-OG1 2.96Å; E645-T665 VanDerWaalsContact O-OG1 3.06Å; I663-T665 HydrophobicContact CG2-CG2 4.06Å; T665-M707 HydrophobicContact CG2-CG 4.15Å
666	L	84.3	Confident	83.1	Confident	7 Å²	7	71.2 Å²	71.2	4%	0.037	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-91.8	116.3	175	-170.1	64.3	0	0	0	110.3	F643 Y670 R675 F678 V706	F643-L666 HydrophobicContact CB-CD1 3.81Å; F643-L666 HydrophobicContact CD1-CD1 4.01Å; F643-L666 HydrophobicContact CG-CD1 4.33Å; F643-L666 WeakPolarHBondContact O-CA 3.43Å; L666-Y670 HydrophobicContact CD1-CD1 4.39Å; L666-Y670 HydrophobicContact CD1-CG 4.47Å; L666-Y670 HydrophobicContact CD2-CD1 3.4Å; L666-Y670 VanDerWaalsContact CD2-CD1 3.4Å; L666-Y670 HydrophobicContact CD2-CD2 4.16Å; L666-Y670 HydrophobicContact CD2-CE1 3.44Å; L666-Y670 VanDerWaalsContact CD2-CE1 3.44Å; L666-Y670 HydrophobicContact CD2-CE2 4.23Å; L666-Y670 HydrophobicContact CD2-CG 3.77Å; L666-Y670 HydrophobicContact CG-CD1 3.47Å; L666-Y670 VanDerWaalsContact CG-CD1 3.47Å; L666-Y670 HydrophobicContact CG-CE1 3.9Å; L666-Y670 HydrophobicContact CG-CG 3.98Å; L666-R675 HydrophobicContact CD2-CB 4.37Å; L666-R675 HydrophobicContact CD2-CG 4.39Å; L666-F678 HydrophobicContact CB-CD1 4.1Å; L666-F678 HydrophobicContact CB-CE1 3.86Å; L666-F678 HydrophobicContact CB-CE2 4.49Å; L666-F678 HydrophobicContact CB-CZ 4.05Å; L666-F678 HydrophobicContact CD1-CB 4.11Å; L666-F678 HydrophobicContact CD1-CD1 4.29Å; L666-F678 HydrophobicContact CD1-CD2 4.15Å; L666-F678 HydrophobicContact CD1-CG 3.94Å; L666-F678 HydrophobicContact CD2-CD1 4.05Å; L666-F678 HydrophobicContact CD2-CG 4.41Å; L666-F678 HydrophobicContact CG-CD1 4.37Å; L666-V706 HydrophobicContact CB-CB 4.1Å; L666-V706 HydrophobicContact CD2-CB 4.33Å; L666-V706 PolarHBondContact N-O 3.04Å
667	K	77.6	Confident	83.6	Confident	114 Å²	114	67 Å²	67	50%	0.496	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-58.3	145.6	-177.8	-82.4	170.1	174.3	166.8	0	113	F643 Y670	F643-K667 PolarHBondContact O-N 3.39Å; K667-Y670 VanDerWaalsContact O-CD1 3.23Å; K667-Y670 WeakPolarHBondContact O-CD1 3.36Å
668	G	75.8	Confident	84.2	Confident	82 Å²	82	58 Å²	58	85%	0.845	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	142.5	173.9	0	0	0	0	0	112.6
669	G	76.1	Confident	84.3	Confident	83 Å²	83	54.2 Å²	54.2	86%	0.856	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	15.1	179.7	0	0	0	0	0	115.6
670	Y	77.2	Confident	84	Confident	68 Å²	68	52.7 Å²	52.7	27%	0.267	30%	0.301	S	S	.	.			trans	-62.5	152	177.1	61.1	-106.5	0	0	0	113.5	L666 K667 R675	L666-Y670 HydrophobicContact CD1-CD1 4.39Å; L666-Y670 HydrophobicContact CD1-CG 4.47Å; L666-Y670 HydrophobicContact CD2-CD1 3.4Å; L666-Y670 VanDerWaalsContact CD2-CD1 3.4Å; L666-Y670 HydrophobicContact CD2-CD2 4.16Å; L666-Y670 HydrophobicContact CD2-CE1 3.44Å; L666-Y670 VanDerWaalsContact CD2-CE1 3.44Å; L666-Y670 HydrophobicContact CD2-CE2 4.23Å; L666-Y670 HydrophobicContact CD2-CG 3.77Å; L666-Y670 HydrophobicContact CG-CD1 3.47Å; L666-Y670 VanDerWaalsContact CG-CD1 3.47Å; L666-Y670 HydrophobicContact CG-CE1 3.9Å; L666-Y670 HydrophobicContact CG-CG 3.98Å; K667-Y670 VanDerWaalsContact O-CD1 3.23Å; K667-Y670 WeakPolarHBondContact O-CD1 3.36Å; Y670-R675 HydrophobicContact CD2-CB 3.72Å; Y670-R675 HydrophobicContact CE2-CB 3.59Å; Y670-R675 HydrophobicContact CE2-CG 3.91Å
671	T	81.3	Confident	83.7	Confident	74 Å²	74	49.4 Å²	49.4	45%	0.454	28%	0.277	S	S	.	.			trans	-78.8	157.2	170.4	63	0	0	0	0	111.7	K673 Q674 R675	T671-K673 PolarHBondContact O-N 2.82Å; T671-Q674 PolarHBondContact O-N 2.67Å; T671-Q674 WeakPolarHBondContact OG1-CG 3.13Å; T671-Q674 PolarHBondContact OG1-N 2.71Å; T671-Q674 PolarHBondContact OG1-OE1 2.9Å; T671-R675 PolarHBondContact O-N 3.46Å
672	D	79.8	Confident	83.4	Confident	114 Å²	114	49.4 Å²	49.4	61%	0.61	28%	0.277	S	S	*	.	H	α-helix	trans	-56.8	-34.9	174	-71.8	-34.3	0	0	0	112.2	R675 R676	D672-R675 PolarHBondContact O-N 2.99Å; D672-R676 VanDerWaalsContact O-CG 3.26Å; D672-R676 WeakPolarHBondContact O-CG 3.49Å; D672-R676 PolarHBondContact O-N 3.05Å
673	K	78.3	Confident	83.2	Confident	99 Å²	99	48.6 Å²	48.6	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-61.6	-50.3	174.6	-177.5	-177.9	176.8	-64.3	0	111.1	T671 R675 R676 D677	T671-K673 PolarHBondContact O-N 2.82Å; K673-R675 VanDerWaalsContact C-N 3.3Å; K673-R675 PolarHBondContact O-N 3.46Å; K673-R676 PolarHBondContact O-N 2.95Å; K673-R676 VanDerWaalsContact O-N 3.12Å; K673-D677 WeakPolarHBondContact CG-OD2 3.18Å; K673-D677 IonicContact NZ-OD2 3.11Å; K673-D677 PolarHBondContact NZ-OD2 2.92Å; K673-D677 PolarHBondContact O-N 2.99Å
674	Q	79.1	Confident	82.9	Confident	70 Å²	70	49.1 Å²	49.1	33%	0.327	27%	0.273	S	S	.	.	H	α-helix	trans	-61	-38.4	178	-74.2	164.4	-49.6	0	0	112.2	F643 T671 F678	F643-Q674 HydrophobicContact CD1-CB 4.45Å; F643-Q674 HydrophobicContact CE1-CB 4.42Å; F643-Q674 WeakPolarHBondContact CE1-O 3.39Å; T671-Q674 PolarHBondContact O-N 2.67Å; T671-Q674 WeakPolarHBondContact OG1-CG 3.13Å; T671-Q674 PolarHBondContact OG1-N 2.71Å; T671-Q674 PolarHBondContact OG1-OE1 2.9Å; Q674-F678 VanDerWaalsContact O-CB 3.22Å; Q674-F678 WeakPolarHBondContact O-CB 3.46Å; Q674-F678 PolarHBondContact O-N 2.93Å
675	R	84.3	Confident	82.9	Confident	67 Å²	67	47.5 Å²	47.5	25%	0.253	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-45.8	173.1	-176.4	-180	175.6	-91.7	-4.1	111.9	S617 L666 Y670 T671 D672 K673 F678 L679	S617-R675 PolarHBondContact OG-NH1 3.29Å; S617-R675 PolarHBondContact OG-NH2 3.19Å; L666-R675 HydrophobicContact CD2-CB 4.37Å; L666-R675 HydrophobicContact CD2-CG 4.39Å; Y670-R675 HydrophobicContact CD2-CB 3.72Å; Y670-R675 HydrophobicContact CE2-CB 3.59Å; Y670-R675 HydrophobicContact CE2-CG 3.91Å; T671-R675 PolarHBondContact O-N 3.46Å; D672-R675 PolarHBondContact O-N 2.99Å; K673-R675 VanDerWaalsContact C-N 3.3Å; K673-R675 PolarHBondContact O-N 3.46Å; R675-F678 PolarHBondContact O-N 2.84Å; R675-L679 HydrophobicContact CG-CD1 4.08Å; R675-L679 HydrophobicContact CG-CG 4.48Å; R675-L679 WeakPolarHBondContact O-CB 3.5Å; R675-L679 VanDerWaalsContact O-CG 3.3Å; R675-L679 WeakPolarHBondContact O-CG 3.27Å; R675-L679 PolarHBondContact O-N 2.92Å
676	R	81.1	Confident	82.9	Confident	114 Å²	114	48 Å²	48	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-46.1	179.1	-70.6	-164	-73.7	-85.9	-6.4	111.3	P616 D672 K673 L679 A680	P616-R676 HydrophobicContact CG-CB 3.84Å; P616-R676 HydrophobicContact CG-CG 3.41Å; P616-R676 VanDerWaalsContact CG-CG 3.41Å; D672-R676 VanDerWaalsContact O-CG 3.26Å; D672-R676 WeakPolarHBondContact O-CG 3.49Å; D672-R676 PolarHBondContact O-N 3.05Å; K673-R676 PolarHBondContact O-N 2.95Å; K673-R676 VanDerWaalsContact O-N 3.12Å; R676-L679 PolarHBondContact O-N 2.82Å; R676-A680 VanDerWaalsContact O-CB 3.26Å; R676-A680 WeakPolarHBondContact O-CB 3.43Å; R676-A680 PolarHBondContact O-N 2.94Å
677	D	79.6	Confident	83.2	Confident	45 Å²	45	48.9 Å²	48.9	24%	0.241	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-43.9	179.7	-62.3	-13.9	0	0	0	110.5	F643 K673 A680 E681	F643-D677 HydrophobicContact CE1-CB 3.95Å; F643-D677 HydrophobicContact CZ-CB 3.85Å; K673-D677 WeakPolarHBondContact CG-OD2 3.18Å; K673-D677 IonicContact NZ-OD2 3.11Å; K673-D677 PolarHBondContact NZ-OD2 2.92Å; K673-D677 PolarHBondContact O-N 2.99Å; D677-A680 PolarHBondContact O-N 2.84Å; D677-E681 PolarHBondContact O-N 3.01Å; D677-E681 VanDerWaalsContact O-N 3.13Å
678	F	85.5	Confident	83.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-48.6	175.3	-172.5	-109.2	0	0	0	112.6	F643 K664 L666 Q674 R675 E681 A682 V706 I708	F643-F678 HydrophobicContact CB-CD2 3.44Å; F643-F678 VanDerWaalsContact CB-CD2 3.44Å; F643-F678 HydrophobicContact CB-CE2 3.75Å; F643-F678 HydrophobicContact CB-CG 4.41Å; F643-F678 HydrophobicContact CD1-CB 3.85Å; F643-F678 AromaticContact CD1-CD2 3.98Å; F643-F678 HydrophobicContact CD1-CD2 3.98Å; F643-F678 HydrophobicContact CD1-CG 4.37Å; F643-F678 AromaticContact CD2-CD2 3.72Å; F643-F678 HydrophobicContact CD2-CD2 3.72Å; F643-F678 HydrophobicContact CD2-CE2 4.45Å; F643-F678 HydrophobicContact CE1-CB 4.04Å; F643-F678 HydrophobicContact CE2-CD2 4.46Å; F643-F678 HydrophobicContact CG-CB 4.18Å; F643-F678 AromaticContact CG-CD2 3.43Å; F643-F678 HydrophobicContact CG-CD2 3.43Å; F643-F678 VanDerWaalsContact CG-CD2 3.43Å; F643-F678 HydrophobicContact CG-CE2 4.2Å; F643-F678 HydrophobicContact CG-CG 4.25Å; F643-F678 HydrophobicContact CZ-CB 4.5Å; K664-F678 HydrophobicContact CB-CE2 4.3Å; K664-F678 HydrophobicContact CB-CZ 4.47Å; K664-F678 HydrophobicContact CD-CE2 3.86Å; K664-F678 HydrophobicContact CG-CE2 3.85Å; K664-F678 HydrophobicContact CG-CZ 4.46Å; L666-F678 HydrophobicContact CB-CD1 4.1Å; L666-F678 HydrophobicContact CB-CE1 3.86Å; L666-F678 HydrophobicContact CB-CE2 4.49Å; L666-F678 HydrophobicContact CB-CZ 4.05Å; L666-F678 HydrophobicContact CD1-CB 4.11Å; L666-F678 HydrophobicContact CD1-CD1 4.29Å; L666-F678 HydrophobicContact CD1-CD2 4.15Å; L666-F678 HydrophobicContact CD1-CG 3.94Å; L666-F678 HydrophobicContact CD2-CD1 4.05Å; L666-F678 HydrophobicContact CD2-CG 4.41Å; L666-F678 HydrophobicContact CG-CD1 4.37Å; Q674-F678 VanDerWaalsContact O-CB 3.22Å; Q674-F678 WeakPolarHBondContact O-CB 3.46Å; Q674-F678 PolarHBondContact O-N 2.93Å; R675-F678 PolarHBondContact O-N 2.84Å; F678-E681 WeakPolarHBondContact O-CB 3.05Å; F678-E681 PolarHBondContact O-N 3.24Å; F678-A682 PolarHBondContact O-N 2.81Å; F678-V706 HydrophobicContact CD1-CG1 4.2Å; F678-V706 HydrophobicContact CE1-CB 4.4Å; F678-V706 HydrophobicContact CE1-CG1 3.87Å; F678-I708 HydrophobicContact CD1-CD1 3.93Å; F678-I708 HydrophobicContact CD1-CG1 4.23Å; F678-I708 HydrophobicContact CD2-CD1 3.8Å; F678-I708 HydrophobicContact CE1-CD1 3.72Å; F678-I708 HydrophobicContact CE1-CG1 3.61Å; F678-I708 HydrophobicContact CE2-CD1 3.63Å; F678-I708 HydrophobicContact CE2-CG1 4.15Å; F678-I708 HydrophobicContact CG-CD1 3.98Å; F678-I708 HydrophobicContact CZ-CB 4.29Å; F678-I708 HydrophobicContact CZ-CD1 3.6Å; F678-I708 HydrophobicContact CZ-CG1 3.59Å; F678-I708 VanDerWaalsContact O-CD1 3.23Å; F678-I708 WeakPolarHBondContact O-CD1 3.33Å
679	L	87.2	Confident	84.7	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-70.8	-31.4	179.5	-70.1	-177.1	0	0	0	112.8	P616 V620 R675 R676 A682 S683 T701 V706	P616-L679 HydrophobicContact CB-CB 4.43Å; V620-L679 HydrophobicContact CG2-CB 3.7Å; V620-L679 HydrophobicContact CG2-CD2 4.12Å; V620-L679 HydrophobicContact CG2-CG 4.33Å; V620-L679 VanDerWaalsContact CG2-O 3.24Å; V620-L679 WeakPolarHBondContact CG2-O 3.41Å; R675-L679 HydrophobicContact CG-CD1 4.08Å; R675-L679 HydrophobicContact CG-CG 4.48Å; R675-L679 WeakPolarHBondContact O-CB 3.5Å; R675-L679 VanDerWaalsContact O-CG 3.3Å; R675-L679 WeakPolarHBondContact O-CG 3.27Å; R675-L679 PolarHBondContact O-N 2.92Å; R676-L679 PolarHBondContact O-N 2.82Å; L679-A682 PolarHBondContact O-N 3.1Å; L679-S683 PolarHBondContact O-N 2.71Å; L679-S683 PolarHBondContact O-OG 2.8Å; L679-T701 HydrophobicContact CD2-CG2 3.9Å; L679-V706 HydrophobicContact CD2-CG1 4.13Å
680	A	83.5	Confident	85.6	Confident	9 Å²	9	43.7 Å²	43.7	7%	0.074	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-41.6	174.6	0	0	0	0	0	111.1	R676 D677 A682 S683 I684	R676-A680 VanDerWaalsContact O-CB 3.26Å; R676-A680 WeakPolarHBondContact O-CB 3.43Å; R676-A680 PolarHBondContact O-N 2.94Å; D677-A680 PolarHBondContact O-N 2.84Å; A680-A682 VanDerWaalsContact C-N 3.34Å; A680-A682 PolarHBondContact O-N 2.82Å; A680-S683 WeakPolarHBondContact O-CB 3.5Å; A680-S683 PolarHBondContact O-N 3.44Å; A680-S683 VanDerWaalsContact O-N 3.12Å; A680-I684 WeakPolarHBondContact O-CG1 3.43Å; A680-I684 PolarHBondContact O-N 2.83Å
681	E	86.3	Confident	86.5	Confident	18 Å²	18	44.6 Å²	44.6	8%	0.084	23%	0.23	C	C	.	.	H	α-helix	trans	-55.1	-48.7	174.9	-164.1	-172.5	152.1	0	0	111.2	K664 D677 F678 S683 I684 M685	K664-E681 IonicContact NZ-OE1 2.65Å; K664-E681 PolarHBondContact NZ-OE1 2.82Å; K664-E681 IonicContact NZ-OE2 2.63Å; K664-E681 PolarHBondContact NZ-OE2 3.42Å; D677-E681 PolarHBondContact O-N 3.01Å; D677-E681 VanDerWaalsContact O-N 3.13Å; F678-E681 WeakPolarHBondContact O-CB 3.05Å; F678-E681 PolarHBondContact O-N 3.24Å; E681-S683 PolarHBondContact O-N 3.34Å; E681-I684 PolarHBondContact O-N 3.35Å; E681-M685 HydrophobicContact CG-CE 3.97Å; E681-M685 WeakPolarHBondContact O-CG 3.41Å; E681-M685 PolarHBondContact O-N 3.14Å
682	A	89.2	Confident	87.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-40.1	176	0	0	0	0	0	112.9	F678 L679 A680 I684 M685 G686 L696 V699 I708	F678-A682 PolarHBondContact O-N 2.81Å; L679-A682 PolarHBondContact O-N 3.1Å; A680-A682 VanDerWaalsContact C-N 3.34Å; A680-A682 PolarHBondContact O-N 2.82Å; A682-I684 VanDerWaalsContact C-N 3.3Å; A682-I684 PolarHBondContact O-N 2.81Å; A682-M685 PolarHBondContact O-N 3.47Å; A682-G686 PolarHBondContact O-N 3.07Å; A682-L696 WeakPolarHBondContact O-CD2 3.46Å; A682-V699 HydrophobicContact CB-CG1 3.63Å; A682-I708 HydrophobicContact CB-CD1 3.91Å; A682-I708 HydrophobicContact CB-CG1 3.96Å; A682-I708 HydrophobicContact CB-CG2 4.31Å
683	S	87.8	Confident	88	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.1	-32.2	178.9	-56.3	0	0	0	0	112.7	V620 L679 A680 E681 Q687	V620-S683 WeakPolarHBondContact CA-OG 3.34Å; V620-S683 WeakPolarHBondContact CG2-OG 3.27Å; V620-S683 PolarHBondContact N-OG 3.02Å; L679-S683 PolarHBondContact O-N 2.71Å; L679-S683 PolarHBondContact O-OG 2.8Å; A680-S683 WeakPolarHBondContact O-CB 3.5Å; A680-S683 PolarHBondContact O-N 3.44Å; A680-S683 VanDerWaalsContact O-N 3.12Å; E681-S683 PolarHBondContact O-N 3.34Å; S683-Q687 WeakPolarHBondContact O-CG 3.5Å; S683-Q687 PolarHBondContact O-NE2 2.93Å
684	I	87.6	Confident	88.8	Confident	10 Å²	10	32 Å²	32	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-72	-51.2	174.3	-64.6	167.9	0	0	0	109.6	Y607 P610 A680 E681 A682 G686 Q687 F688 Y753 F776	Y607-I684 HydrophobicContact CE2-CG1 4.29Å; Y607-I684 HydrophobicContact CE2-CG2 4.11Å; P610-I684 HydrophobicContact CG-CG1 3.83Å; A680-I684 WeakPolarHBondContact O-CG1 3.43Å; A680-I684 PolarHBondContact O-N 2.83Å; E681-I684 PolarHBondContact O-N 3.35Å; A682-I684 VanDerWaalsContact C-N 3.3Å; A682-I684 PolarHBondContact O-N 2.81Å; I684-G686 VanDerWaalsContact C-N 3.26Å; I684-G686 PolarHBondContact O-N 3.29Å; I684-Q687 PolarHBondContact O-N 3.24Å; I684-Q687 VanDerWaalsContact O-N 3.13Å; I684-F688 HydrophobicContact CG2-CD2 4.41Å; I684-F688 HydrophobicContact CG2-CE2 3.5Å; I684-F688 VanDerWaalsContact CG2-CE2 3.5Å; I684-F688 HydrophobicContact CG2-CZ 4.04Å; I684-F688 WeakPolarHBondContact O-CD2 3.37Å; I684-Y753 HydrophobicContact CG2-CE2 3.75Å; I684-F776 HydrophobicContact CB-CB 4.25Å; I684-F776 WeakPolarHBondContact CD1-O 3.43Å; I684-F776 HydrophobicContact CG2-CB 3.66Å; I684-F776 HydrophobicContact CG2-CD1 4.31Å; I684-F776 HydrophobicContact CG2-CG 4.04Å
685	M	90.2	Very high	89.5	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.025	16%	0.163	C	C	.	.	H	α-helix	trans	-57.5	-38.9	179.2	-72.5	-175	-70.6	0	0	112.6	E681 A682 Q687 F688 I694 L696 I708 T710 F776	E681-M685 HydrophobicContact CG-CE 3.97Å; E681-M685 WeakPolarHBondContact O-CG 3.41Å; E681-M685 PolarHBondContact O-N 3.14Å; A682-M685 PolarHBondContact O-N 3.47Å; M685-Q687 PolarHBondContact O-N 2.84Å; M685-Q687 VanDerWaalsContact O-N 3.15Å; M685-F688 PolarHBondContact O-N 2.75Å; M685-F688 VanDerWaalsContact O-N 3.15Å; M685-I694 HydrophobicContact SD-CG2 4.24Å; M685-L696 HydrophobicContact CB-CB 4.05Å; M685-L696 HydrophobicContact CB-CD2 4.45Å; M685-L696 HydrophobicContact CE-CD1 4.37Å; M685-I708 HydrophobicContact CE-CG2 3.67Å; M685-T710 HydrophobicContact CE-CG2 4.39Å; M685-T710 HydrophobicContact SD-CG2 4.09Å; M685-F776 HydrophobicContact CG-CD2 3.48Å; M685-F776 VanDerWaalsContact CG-CD2 3.48Å; M685-F776 HydrophobicContact CG-CE2 4.04Å; M685-F776 HydrophobicContact CG-CG 4.44Å; M685-F776 HydrophobicContact SD-CD2 4.38Å
686	G	90.1	Very high	90	Very high	27 Å²	27	30.5 Å²	30.5	28%	0.278	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17	-179.8	0	0	0	0	0	115.1	F623 A682 I684	F623-G686 CarbonylContact O-C 3.58Å; F623-G686 VanDerWaalsContact O-CA 3.24Å; F623-G686 WeakPolarHBondContact O-CA 3.48Å; A682-G686 PolarHBondContact O-N 3.07Å; I684-G686 VanDerWaalsContact C-N 3.26Å; I684-G686 PolarHBondContact O-N 3.29Å
687	Q	90.4	Very high	90.6	Very high	25 Å²	25	25.9 Å²	25.9	12%	0.117	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-11.8	177.9	-66.9	178.7	63.3	0	0	113.6	V608 F623 S683 I684 M685	V608-Q687 PolarHBondContact O-NE2 2.95Å; V608-Q687 PolarHBondContact O-OE1 3.09Å; F623-Q687 HydrophobicContact CB-CG 3.97Å; F623-Q687 HydrophobicContact CD1-CG 3.57Å; F623-Q687 HydrophobicContact CD2-CG 4.16Å; F623-Q687 HydrophobicContact CE1-CG 4.08Å; F623-Q687 HydrophobicContact CG-CG 3.62Å; S683-Q687 WeakPolarHBondContact O-CG 3.5Å; S683-Q687 PolarHBondContact O-NE2 2.93Å; I684-Q687 PolarHBondContact O-N 3.24Å; I684-Q687 VanDerWaalsContact O-N 3.13Å; M685-Q687 PolarHBondContact O-N 2.84Å; M685-Q687 VanDerWaalsContact O-N 3.15Å
688	F	91.8	Very high	91.2	Very high	10 Å²	10	23.8 Å²	23.8	4%	0.044	13%	0.129	C	C	.	.			trans	-109.9	136.7	-172.1	-56.4	-40.6	0	0	0	112	Y607 I684 M685 I693 Y747 L748 M751 Y753 F776	Y607-F688 HydrophobicContact CD2-CE1 4.07Å; Y607-F688 AromaticContact CD2-CZ 3.81Å; Y607-F688 HydrophobicContact CD2-CZ 3.81Å; Y607-F688 HydrophobicContact CE2-CZ 4.23Å; I684-F688 HydrophobicContact CG2-CD2 4.41Å; I684-F688 HydrophobicContact CG2-CE2 3.5Å; I684-F688 VanDerWaalsContact CG2-CE2 3.5Å; I684-F688 HydrophobicContact CG2-CZ 4.04Å; I684-F688 WeakPolarHBondContact O-CD2 3.37Å; M685-F688 PolarHBondContact O-N 2.75Å; M685-F688 VanDerWaalsContact O-N 3.15Å; F688-I693 HydrophobicContact CB-CG2 3.95Å; F688-I693 HydrophobicContact CD2-CG2 4.48Å; F688-Y747 HydrophobicContact CB-CE1 3.96Å; F688-Y747 AromaticContact CD1-CE1 4Å; F688-Y747 HydrophobicContact CD1-CE1 4Å; F688-Y747 HydrophobicContact CG-CE1 4.28Å; F688-L748 HydrophobicContact CD1-CD2 4Å; F688-L748 HydrophobicContact CD2-CD2 3.82Å; F688-L748 HydrophobicContact CE1-CD2 3.91Å; F688-L748 HydrophobicContact CE2-CD2 3.7Å; F688-L748 HydrophobicContact CG-CD2 3.98Å; F688-L748 HydrophobicContact CZ-CD2 3.77Å; F688-M751 HydrophobicContact CD1-CE 4.44Å; F688-M751 HydrophobicContact CE1-CB 4.46Å; F688-M751 HydrophobicContact CE1-CE 4.5Å; F688-Y753 HydrophobicContact CE1-CG 4.41Å; F688-Y753 HydrophobicContact CE2-CD1 4.32Å; F688-Y753 HydrophobicContact CE2-CD2 4.41Å; F688-Y753 HydrophobicContact CE2-CE1 4.44Å; F688-Y753 HydrophobicContact CE2-CG 4.3Å; F688-Y753 HydrophobicContact CZ-CD1 4.01Å; F688-Y753 AromaticContact CZ-CD2 3.7Å; F688-Y753 HydrophobicContact CZ-CD2 3.7Å; F688-Y753 HydrophobicContact CZ-CE1 4.49Å; F688-Y753 HydrophobicContact CZ-CE2 4.21Å; F688-Y753 AromaticContact CZ-CG 3.58Å; F688-Y753 HydrophobicContact CZ-CG 3.58Å; F688-F776 HydrophobicContact CD2-CE1 4.18Å; F688-F776 HydrophobicContact CD2-CE2 4.46Å; F688-F776 HydrophobicContact CD2-CZ 4.14Å; F688-F776 HydrophobicContact CE2-CD1 4.05Å; F688-F776 AromaticContact CE2-CE1 3.98Å; F688-F776 HydrophobicContact CE2-CE1 3.98Å; F688-F776 HydrophobicContact CE2-CZ 4.39Å
689	D	91.9	Very high	91.6	Very high	122 Å²	122	23.8 Å²	23.8	65%	0.652	13%	0.13	S	C	*	.			trans	-142.5	97.6	175	-174.6	20	0	0	0	109.5	Y747	D689-Y747 PolarHBondContact N-OH 2.82Å
690	H	95.6	Very high	91.9	Very high	38 Å²	38	23.8 Å²	23.8	18%	0.176	13%	0.129	C	C	.	.			trans	-155.8	142.2	-178.7	-177.9	-87.9	0	0	0	110.3	N692 I693 S743 Y747	H690-N692 PolarHBondContact ND1-N 2.87Å; H690-N692 PolarHBondContact O-N 2.03Å; H690-N692 VanDerWaalsContact O-N 3.1Å; H690-I693 HydrophobicContact CB-CB 4.22Å; H690-I693 HydrophobicContact CB-CG1 3.88Å; H690-I693 PolarHBondContact O-N 2.89Å; H690-S743 PolarHBondContact CE1-O 2.84Å; H690-S743 PolarHBondContact CE1-OG 3.43Å; H690-S743 PolarHBondContact NE2-OG 3.41Å; H690-Y747 HydrophobicContact CB-CD1 3.69Å; H690-Y747 HydrophobicContact CB-CD2 4.08Å; H690-Y747 HydrophobicContact CB-CE1 3.95Å; H690-Y747 HydrophobicContact CB-CE2 4.3Å; H690-Y747 HydrophobicContact CB-CG 3.75Å; H690-Y747 AromaticContact CD2-CD2 3.92Å; H690-Y747 AromaticContact CD2-CG 3.83Å; H690-Y747 AromaticContact CG-CG 3.82Å
691	P	95.8	Very high	92.2	Very high	87 Å²	87	25.6 Å²	25.6	57%	0.565	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.8	-175.3	22	-35.8	0	0	0	115.2	K772	P691-K772 WeakPolarHBondContact O-CE 3.34Å; P691-K772 PolarHBondContact O-NZ 2.96Å
692	N	97.6	Very high	92.3	Very high	16 Å²	16	34.3 Å²	34.3	9%	0.086	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	18.4	177.3	-58.8	106.7	0	0	0	114.1	H690 G740 C771 K772 V773	H690-N692 PolarHBondContact ND1-N 2.87Å; H690-N692 PolarHBondContact O-N 2.03Å; H690-N692 VanDerWaalsContact O-N 3.1Å; N692-G740 WeakPolarHBondContact CB-O 3.3Å; N692-G740 VanDerWaalsContact ND2-CA 3.33Å; N692-G740 WeakPolarHBondContact ND2-CA 3.48Å; N692-C771 PolarHBondContact ND2-O 3.05Å; N692-K772 WeakPolarHBondContact O-CA 3.31Å; N692-V773 PolarHBondContact O-N 2.78Å
693	I	96.1	Very high	92	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.015	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-118.4	138.1	170.3	-61.8	-58.1	0	0	0	107.7	F688 H690 R695 Y747 L748 V773 F776	F688-I693 HydrophobicContact CB-CG2 3.95Å; F688-I693 HydrophobicContact CD2-CG2 4.48Å; H690-I693 HydrophobicContact CB-CB 4.22Å; H690-I693 HydrophobicContact CB-CG1 3.88Å; H690-I693 PolarHBondContact O-N 2.89Å; I693-R695 PolarHBondContact O-N 3.4Å; I693-Y747 HydrophobicContact CG1-CD1 4.05Å; I693-L748 HydrophobicContact CD1-CD1 3.79Å; I693-L748 HydrophobicContact CD1-CD2 4.13Å; I693-L748 HydrophobicContact CD1-CG 3.79Å; I693-V773 HydrophobicContact CD1-CB 3.73Å; I693-V773 HydrophobicContact CD1-CG2 4.07Å; I693-F776 HydrophobicContact CD1-CZ 4.49Å; I693-F776 HydrophobicContact CG2-CE2 4.06Å; I693-F776 HydrophobicContact CG2-CZ 3.68Å
694	I	95	Very high	91.8	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-61.5	127.4	178	-168	69.5	0	0	0	110	M685 E711 M713 L764 V773 F776	M685-I694 HydrophobicContact SD-CG2 4.24Å; I694-E711 HydrophobicContact CD1-CG 3.42Å; I694-E711 VanDerWaalsContact CD1-CG 3.42Å; I694-E711 HydrophobicContact CG1-CG 4.33Å; I694-M713 HydrophobicContact CD1-CG 3.66Å; I694-M713 HydrophobicContact CD1-SD 4.02Å; I694-L764 HydrophobicContact CD1-CD1 4.02Å; I694-L764 HydrophobicContact CG1-CD1 4.42Å; I694-V773 PolarHBondContact N-O 3.22Å; I694-F776 HydrophobicContact CG2-CE2 3.88Å
695	R	93.2	Very high	91.7	Very high	80 Å²	80	47.8 Å²	47.8	30%	0.302	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-92.6	130	-174.2	-171.4	172.9	54.2	74.8	9.6	111.6	I693 E697 T710 E711	I693-R695 PolarHBondContact O-N 3.4Å; R695-E697 IonicContact CZ-OE1 3.33Å; R695-E697 IonicContact CZ-OE2 2.9Å; R695-E697 IonicContact NH1-OE1 2.84Å; R695-E697 PolarHBondContact NH1-OE1 3.48Å; R695-E697 IonicContact NH1-OE2 3.64Å; R695-E697 PolarHBondContact NH1-OE2 3.41Å; R695-E697 IonicContact NH2-OE1 3.69Å; R695-E697 PolarHBondContact NH2-OE1 3.38Å; R695-T710 WeakPolarHBondContact O-CA 3.04Å; R695-T710 WeakPolarHBondContact O-CB 3.31Å; R695-E711 HydrophobicContact CB-CG 4.41Å; R695-E711 WeakPolarHBondContact CB-OE1 3.46Å; R695-E711 PolarHBondContact N-OE1 3.13Å; R695-E711 PolarHBondContact O-N 3.2Å
696	L	94.1	Very high	91.7	Very high	24 Å²	24	48 Å²	48	13%	0.126	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	123	168.8	-175.8	69.7	0	0	0	110.2	A624 A682 M685 V699 I708 V709 T710	A624-L696 HydrophobicContact CB-CD2 3.68Å; A682-L696 WeakPolarHBondContact O-CD2 3.46Å; M685-L696 HydrophobicContact CB-CB 4.05Å; M685-L696 HydrophobicContact CB-CD2 4.45Å; M685-L696 HydrophobicContact CE-CD1 4.37Å; L696-V699 HydrophobicContact CD1-CG1 4.47Å; L696-I708 HydrophobicContact CD1-CG2 3.59Å; L696-V709 WeakPolarHBondContact CD1-O 3.39Å; L696-T710 HydrophobicContact CD1-CG2 4.29Å
697	E	93.5	Very high	91.8	Very high	18 Å²	18	47.1 Å²	47.1	8%	0.084	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-34.8	171.3	-66.5	-71.4	-175.6	0	0	111.7	L651 I659 V661 R695 V709	L651-E697 HydrophobicContact CD2-CB 3.83Å; L651-E697 HydrophobicContact CD2-CG 4.29Å; I659-E697 VanDerWaalsContact CD1-CD 3.48Å; I659-E697 HydrophobicContact CD1-CG 4.21Å; I659-E697 VanDerWaalsContact CD1-OE1 3.25Å; I659-E697 WeakPolarHBondContact CD1-OE1 3.24Å; V661-E697 HydrophobicContact CG1-CG 4.05Å; R695-E697 IonicContact CZ-OE1 3.33Å; R695-E697 IonicContact CZ-OE2 2.9Å; R695-E697 IonicContact NH1-OE1 2.84Å; R695-E697 PolarHBondContact NH1-OE1 3.48Å; R695-E697 IonicContact NH1-OE2 3.64Å; R695-E697 PolarHBondContact NH1-OE2 3.41Å; R695-E697 IonicContact NH2-OE1 3.69Å; R695-E697 PolarHBondContact NH2-OE1 3.38Å; E697-V709 WeakPolarHBondContact CA-O 3.29Å; E697-V709 HydrophobicContact CB-CB 4.39Å; E697-V709 HydrophobicContact CB-CG1 4.11Å; E697-V709 WeakPolarHBondContact CB-O 3.43Å; E697-V709 PolarHBondContact N-O 3.3Å
698	G	92.8	Very high	91.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.2	-171.7	175.3	0	0	0	0	0	113	K625 V709	K625-G698 CarbonylContact O-C 3.55Å; K625-G698 WeakPolarHBondContact O-CA 3.47Å; G698-V709 PolarHBondContact N-O 3.02Å; G698-V709 PolarHBondContact O-N 3.12Å
699	V	94.3	Very high	92	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	154.3	-177.6	-65.6	0	0	0	0	110.4	V620 A624 K625 E626 L627 A682 L696 T701 M707 I708	V620-V699 HydrophobicContact CG1-CB 4.49Å; V620-V699 HydrophobicContact CG1-CG1 4.43Å; V620-V699 HydrophobicContact CG1-CG2 3.66Å; A624-V699 HydrophobicContact CB-CG1 4.05Å; A624-V699 HydrophobicContact CB-CG2 4.02Å; K625-V699 PolarHBondContact O-N 2.91Å; E626-V699 CarbonylContact C-O 3.57Å; E626-V699 WeakPolarHBondContact CA-O 3.49Å; L627-V699 PolarHBondContact N-O 3.1Å; A682-V699 HydrophobicContact CB-CG1 3.63Å; L696-V699 HydrophobicContact CD1-CG1 4.47Å; V699-T701 HydrophobicContact CB-CG2 4.11Å; V699-T701 HydrophobicContact CG2-CG2 3.92Å; V699-M707 CarbonylContact C-O 3.43Å; V699-M707 VanDerWaalsContact CA-O 3.29Å; V699-M707 WeakPolarHBondContact CA-O 3.34Å; V699-I708 HydrophobicContact CG1-CG1 4.45Å
700	V	92.6	Very high	92.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	107.6	167.1	-177.4	0	0	0	0	107.1	L627 A629 I632 S703 V706 M707	L627-V700 HydrophobicContact CB-CG2 4.1Å; A629-V700 HydrophobicContact CB-CG1 4.18Å; I632-V700 HydrophobicContact CD1-CG2 3.43Å; I632-V700 VanDerWaalsContact CD1-CG2 3.43Å; V700-S703 WeakPolarHBondContact CG1-OG 3.4Å; V700-V706 CarbonylContact O-C 3.59Å; V700-V706 VanDerWaalsContact O-CA 3.26Å; V700-V706 WeakPolarHBondContact O-CA 3.49Å; V700-V706 VanDerWaalsContact O-CG1 3.28Å; V700-V706 WeakPolarHBondContact O-CG1 3.41Å; V700-M707 HydrophobicContact CB-CB 4.01Å; V700-M707 HydrophobicContact CB-CE 3.82Å; V700-M707 HydrophobicContact CB-CG 4.46Å; V700-M707 HydrophobicContact CG1-CE 3.87Å; V700-M707 HydrophobicContact CG2-CB 4.22Å; V700-M707 HydrophobicContact CG2-CE 3.7Å; V700-M707 PolarHBondContact N-O 3.43Å; V700-M707 PolarHBondContact O-N 2.9Å
701	T	90.9	Very high	92	Very high	47 Å²	47	40.2 Å²	40.2	29%	0.288	20%	0.198	S	C	.	.			trans	-117	-19.3	-177.9	66.9	0	0	0	0	112.7	V620 E626 L679 V699 V706	V620-T701 HydrophobicContact CG1-CG2 4.17Å; E626-T701 VanDerWaalsContact CD-OG1 3.28Å; E626-T701 PolarHBondContact OE1-N 3.06Å; E626-T701 PolarHBondContact OE1-OG1 3.42Å; E626-T701 PolarHBondContact OE2-N 3.24Å; E626-T701 PolarHBondContact OE2-OG1 2.89Å; L679-T701 HydrophobicContact CD2-CG2 3.9Å; V699-T701 HydrophobicContact CB-CG2 4.11Å; V699-T701 HydrophobicContact CG2-CG2 3.92Å; T701-V706 HydrophobicContact CG2-CG1 4.42Å
702	R	87.1	Confident	91.9	Very high	202 Å²	202	38.5 Å²	38.5	76%	0.762	18%	0.181	S	C	*	.	S	Bend	trans	-82.3	-13.7	-177.8	-67.6	174.1	-178.3	-167.9	1.2	114.9	E626	E626-R702 HydrophobicContact CG-CG 4.38Å; E626-R702 VanDerWaalsContact OE1-CG 3.31Å; E626-R702 WeakPolarHBondContact OE1-CG 3.28Å; E626-R702 PolarHBondContact OE1-N 3.45Å
703	S	84.3	Confident	91.7	Very high	46 Å²	46	38.3 Å²	38.3	32%	0.322	18%	0.179	S	C	.	.	S	Bend	trans	-131.6	168.9	178	64.3	0	0	0	0	111.3	V700 P705	V700-S703 WeakPolarHBondContact CG1-OG 3.4Å; S703-P705 CarbonylContact O-C 3.5Å
704	K	82.1	Confident	91.6	Very high	183 Å²	183	42.5 Å²	42.5	80%	0.796	20%	0.199	S	C	*	.	S	Bend	trans	-106.5	138.9	174.2	-69.4	-174.6	179.3	-179	0	109.7
705	P	87.4	Confident	91.5	Very high	63 Å²	63	45 Å²	45	41%	0.409	21%	0.213	S	C	.	.	S	Bend	cis	-72.1	154.5	-2.3	31.5	-35.3	0	0	0	112.8	S703 M707	S703-P705 CarbonylContact O-C 3.5Å; P705-M707 HydrophobicContact CG-CG 4.4Å
706	V	89.9	Confident	91.4	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.055	21%	0.212	C	C	.	.			trans	-72.8	134.7	171.8	-176.9	0	0	0	0	107.7	L666 F678 L679 V700 T701	L666-V706 HydrophobicContact CB-CB 4.1Å; L666-V706 HydrophobicContact CD2-CB 4.33Å; L666-V706 PolarHBondContact N-O 3.04Å; F678-V706 HydrophobicContact CD1-CG1 4.2Å; F678-V706 HydrophobicContact CE1-CB 4.4Å; F678-V706 HydrophobicContact CE1-CG1 3.87Å; L679-V706 HydrophobicContact CD2-CG1 4.13Å; V700-V706 CarbonylContact O-C 3.59Å; V700-V706 VanDerWaalsContact O-CA 3.26Å; V700-V706 WeakPolarHBondContact O-CA 3.49Å; V700-V706 VanDerWaalsContact O-CG1 3.28Å; V700-V706 WeakPolarHBondContact O-CG1 3.41Å; T701-V706 HydrophobicContact CG2-CG1 4.42Å
707	M	92.2	Very high	91.4	Very high	10 Å²	10	43 Å²	43	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.3	-173.3	-57.3	-178.3	-92.4	0	0	112.7	A629 I632 I634 I663 K664 T665 V699 V700 P705	A629-M707 HydrophobicContact CB-CE 4.3Å; I632-M707 HydrophobicContact CD1-CE 4.25Å; I634-M707 HydrophobicContact CD1-SD 4.47Å; I663-M707 HydrophobicContact CG2-CB 4.13Å; I663-M707 HydrophobicContact CG2-CG 4.12Å; I663-M707 HydrophobicContact CG2-SD 3.72Å; K664-M707 CarbonylContact O-C 3.6Å; K664-M707 VanDerWaalsContact O-CA 3.28Å; K664-M707 WeakPolarHBondContact O-CA 3.42Å; T665-M707 HydrophobicContact CG2-CG 4.15Å; V699-M707 CarbonylContact C-O 3.43Å; V699-M707 VanDerWaalsContact CA-O 3.29Å; V699-M707 WeakPolarHBondContact CA-O 3.34Å; V700-M707 HydrophobicContact CB-CB 4.01Å; V700-M707 HydrophobicContact CB-CE 3.82Å; V700-M707 HydrophobicContact CB-CG 4.46Å; V700-M707 HydrophobicContact CG1-CE 3.87Å; V700-M707 HydrophobicContact CG2-CB 4.22Å; V700-M707 HydrophobicContact CG2-CE 3.7Å; V700-M707 PolarHBondContact N-O 3.43Å; V700-M707 PolarHBondContact O-N 2.9Å; P705-M707 HydrophobicContact CG-CG 4.4Å
708	I	92.5	Very high	91.6	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.015	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.3	165.3	-60.3	170.9	0	0	0	106.9	K664 F678 A682 M685 L696 V699 T710	K664-I708 HydrophobicContact CB-CB 4.29Å; K664-I708 PolarHBondContact N-O 2.93Å; K664-I708 PolarHBondContact O-N 3.11Å; F678-I708 HydrophobicContact CD1-CD1 3.93Å; F678-I708 HydrophobicContact CD1-CG1 4.23Å; F678-I708 HydrophobicContact CD2-CD1 3.8Å; F678-I708 HydrophobicContact CE1-CD1 3.72Å; F678-I708 HydrophobicContact CE1-CG1 3.61Å; F678-I708 HydrophobicContact CE2-CD1 3.63Å; F678-I708 HydrophobicContact CE2-CG1 4.15Å; F678-I708 HydrophobicContact CG-CD1 3.98Å; F678-I708 HydrophobicContact CZ-CB 4.29Å; F678-I708 HydrophobicContact CZ-CD1 3.6Å; F678-I708 HydrophobicContact CZ-CG1 3.59Å; F678-I708 VanDerWaalsContact O-CD1 3.23Å; F678-I708 WeakPolarHBondContact O-CD1 3.33Å; A682-I708 HydrophobicContact CB-CD1 3.91Å; A682-I708 HydrophobicContact CB-CG1 3.96Å; A682-I708 HydrophobicContact CB-CG2 4.31Å; M685-I708 HydrophobicContact CE-CG2 3.67Å; L696-I708 HydrophobicContact CD1-CG2 3.59Å; V699-I708 HydrophobicContact CG1-CG1 4.45Å; I708-T710 HydrophobicContact CG2-CG2 4.3Å
709	V	93.7	Very high	91.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114.6	-175.2	-171.2	0	0	0	0	108.7	L627 I632 L651 V661 A662 I663 L696 E697 G698	L627-V709 HydrophobicContact CD1-CB 4.04Å; L627-V709 HydrophobicContact CD1-CG1 4.47Å; L627-V709 HydrophobicContact CD1-CG2 3.98Å; I632-V709 HydrophobicContact CD1-CG2 3.78Å; L651-V709 HydrophobicContact CD2-CG1 4.3Å; V661-V709 HydrophobicContact CB-CG1 3.58Å; V661-V709 HydrophobicContact CG1-CG1 3.79Å; V661-V709 HydrophobicContact CG2-CG1 3.79Å; A662-V709 WeakPolarHBondContact O-CA 3.37Å; I663-V709 HydrophobicContact CG1-CG1 4.42Å; L696-V709 WeakPolarHBondContact CD1-O 3.39Å; E697-V709 WeakPolarHBondContact CA-O 3.29Å; E697-V709 HydrophobicContact CB-CB 4.39Å; E697-V709 HydrophobicContact CB-CG1 4.11Å; E697-V709 WeakPolarHBondContact CB-O 3.43Å; E697-V709 PolarHBondContact N-O 3.3Å; G698-V709 PolarHBondContact N-O 3.02Å; G698-V709 PolarHBondContact O-N 3.12Å
710	T	94.3	Very high	91.6	Very high	21 Å²	21	45.1 Å²	45.1	13%	0.129	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	168.4	176.1	63.2	0	0	0	0	110.6	V661 A662 M685 R695 L696 I708	V661-T710 CarbonylContact C-O 3.56Å; V661-T710 VanDerWaalsContact CA-O 3.31Å; V661-T710 WeakPolarHBondContact CA-O 3.4Å; V661-T710 WeakPolarHBondContact CB-O 3.4Å; A662-T710 PolarHBondContact N-O 3.18Å; A662-T710 PolarHBondContact O-N 3.39Å; M685-T710 HydrophobicContact CE-CG2 4.39Å; M685-T710 HydrophobicContact SD-CG2 4.09Å; R695-T710 WeakPolarHBondContact O-CA 3.04Å; R695-T710 WeakPolarHBondContact O-CB 3.31Å; L696-T710 HydrophobicContact CD1-CG2 4.29Å; I708-T710 HydrophobicContact CG2-CG2 4.3Å
711	E	93.1	Very high	91.7	Very high	25 Å²	25	45.9 Å²	45.9	12%	0.117	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	146.8	167.3	67.7	-172.4	133.4	0	0	111.4	I694 R695 M713 K772	I694-E711 HydrophobicContact CD1-CG 3.42Å; I694-E711 VanDerWaalsContact CD1-CG 3.42Å; I694-E711 HydrophobicContact CG1-CG 4.33Å; R695-E711 HydrophobicContact CB-CG 4.41Å; R695-E711 WeakPolarHBondContact CB-OE1 3.46Å; R695-E711 PolarHBondContact N-OE1 3.13Å; R695-E711 PolarHBondContact O-N 3.2Å; E711-M713 HydrophobicContact CG-SD 4.26Å; E711-K772 VanDerWaalsContact OE1-CD 3.3Å; E711-K772 WeakPolarHBondContact OE1-CD 3.25Å; E711-K772 WeakPolarHBondContact OE1-CE 3.48Å; E711-K772 IonicContact OE1-NZ 3.51Å; E711-K772 PolarHBondContact OE1-NZ 3.3Å; E711-K772 IonicContact OE2-NZ 2.7Å; E711-K772 PolarHBondContact OE2-NZ 3.38Å
712	Y	93.2	Very high	92	Very high	51 Å²	51	43.7 Å²	43.7	20%	0.2	22%	0.222	C	C	.	.			trans	-85.5	136	177.7	-173.8	-108.1	0	0	0	111.2	V638 C660 A662 E714	V638-Y712 HydrophobicContact CG2-CE2 4.12Å; C660-Y712 PolarHBondContact O-N 2.96Å; A662-Y712 HydrophobicContact CB-CD2 4.21Å; Y712-E714 HydrophobicContact CD1-CG 3.98Å; Y712-E714 HydrophobicContact CE1-CB 4.25Å; Y712-E714 HydrophobicContact CE1-CG 3.93Å
713	M	94.3	Very high	92.3	Very high	12 Å²	12	40 Å²	40	6%	0.059	21%	0.208	C	C	.	.			trans	-116.7	104.5	-178.6	-59.8	-65.7	-72	0	0	108.8	I694 E711 N715 G716 L764 V765 N766 K772	I694-M713 HydrophobicContact CD1-CG 3.66Å; I694-M713 HydrophobicContact CD1-SD 4.02Å; E711-M713 HydrophobicContact CG-SD 4.26Å; M713-N715 VanDerWaalsContact C-N 3.28Å; M713-N715 PolarHBondContact O-N 3.15Å; M713-G716 PolarHBondContact O-N 3.16Å; M713-L764 HydrophobicContact CB-CB 3.81Å; M713-L764 HydrophobicContact CB-CD1 4.35Å; M713-L764 VanDerWaalsContact CE-C 3.47Å; M713-L764 HydrophobicContact CE-CB 3.88Å; M713-L764 VanDerWaalsContact CE-O 3.24Å; M713-L764 WeakPolarHBondContact CE-O 3.24Å; M713-L764 HydrophobicContact CG-CB 3.64Å; M713-L764 HydrophobicContact CG-CD1 3.93Å; M713-L764 HydrophobicContact CG-CG 4.41Å; M713-V765 CarbonylContact C-O 3.49Å; M713-N766 HydrophobicContact CE-CB 3.88Å; M713-N766 HydrophobicContact SD-CB 4.06Å; M713-K772 HydrophobicContact CE-CB 3.95Å; M713-K772 HydrophobicContact CE-CD 3.88Å; M713-K772 HydrophobicContact CE-CG 3.67Å; M713-K772 HydrophobicContact SD-CD 3.97Å; M713-K772 HydrophobicContact SD-CG 4.43Å
714	E	92.5	Very high	92.7	Very high	92 Å²	92	45.8 Å²	45.8	43%	0.43	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-27.9	-163	-57.2	92.5	146.5	0	0	114.2	Y712 N766 S767	Y712-E714 HydrophobicContact CD1-CG 3.98Å; Y712-E714 HydrophobicContact CE1-CB 4.25Å; Y712-E714 HydrophobicContact CE1-CG 3.93Å; E714-N766 VanDerWaalsContact OE2-CA 3.26Å; E714-N766 WeakPolarHBondContact OE2-CA 3.3Å; E714-N766 WeakPolarHBondContact OE2-CB 3.2Å; E714-S767 PolarHBondContact OE1-OG 3.34Å; E714-S767 PolarHBondContact OE2-N 3.03Å
715	N	93.3	Very high	93.2	Very high	58 Å²	58	39 Å²	39	31%	0.31	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	0.2	-175.8	-70.7	-36.4	0	0	0	113.4	M713 F721 V765 N766	M713-N715 VanDerWaalsContact C-N 3.28Å; M713-N715 PolarHBondContact O-N 3.15Å; N715-F721 HydrophobicContact CB-CD2 3.56Å; N715-F721 HydrophobicContact CB-CE2 3.72Å; N715-F721 HydrophobicContact CB-CG 4.2Å; N715-F721 HydrophobicContact CB-CZ 4.47Å; N715-F721 VanDerWaalsContact CG-CE2 3.49Å; N715-V765 HydrophobicContact CB-CB 3.96Å; N715-V765 HydrophobicContact CB-CG1 4.19Å; N715-V765 WeakPolarHBondContact CB-O 3.48Å; N715-V765 PolarHBondContact N-O 3.12Å; N715-N766 PolarHBondContact ND2-O 3.38Å
716	G	92.2	Very high	93.2	Very high	29 Å²	29	41 Å²	41	30%	0.299	21%	0.207	S	C	.	.			trans	69.2	-148.9	178.9	0	0	0	0	0	113.4	M713 L764 V765	M713-G716 PolarHBondContact O-N 3.16Å; G716-L764 WeakPolarHBondContact O-CA 3.35Å; G716-V765 PolarHBondContact O-N 3.05Å
717	S	93.8	Very high	92.9	Very high	31 Å²	31	44.2 Å²	44.2	22%	0.217	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-74.6	144.8	-179.5	67.4	0	0	0	0	112.3	D719 S720 F721 R761 I763	S717-D719 VanDerWaalsContact CB-OD1 3.24Å; S717-D719 WeakPolarHBondContact CB-OD1 3.47Å; S717-D719 PolarHBondContact O-N 3.45Å; S717-D719 PolarHBondContact OG-OD1 3.15Å; S717-S720 PolarHBondContact O-N 3.32Å; S717-F721 VanDerWaalsContact O-CB 3.31Å; S717-F721 WeakPolarHBondContact O-CB 3.47Å; S717-F721 PolarHBondContact O-N 3.12Å; S717-R761 WeakPolarHBondContact CB-O 3.4Å; S717-I763 CarbonylContact C-O 3.56Å; S717-I763 WeakPolarHBondContact CA-O 3.31Å
718	L	96.6	Very high	92.7	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-38.7	-173.2	176.9	62.6	0	0	0	112.3	F721 L722 M737 I741 A760 I763 V765 V828	L718-F721 HydrophobicContact CD1-CD1 4.45Å; L718-F721 PolarHBondContact O-N 3.48Å; L718-L722 HydrophobicContact CD1-CD1 3.9Å; L718-L722 HydrophobicContact CD1-CD2 4.36Å; L718-L722 HydrophobicContact CD1-CG 3.86Å; L718-L722 HydrophobicContact CG-CD1 3.8Å; L718-L722 HydrophobicContact CG-CG 4.24Å; L718-L722 WeakPolarHBondContact O-CB 3.27Å; L718-L722 VanDerWaalsContact O-CG 3.22Å; L718-L722 WeakPolarHBondContact O-CG 3.48Å; L718-L722 PolarHBondContact O-N 2.97Å; L718-M737 HydrophobicContact CD1-SD 3.99Å; L718-I741 HydrophobicContact CD2-CD1 3.7Å; L718-A760 WeakPolarHBondContact CB-O 3.22Å; L718-A760 PolarHBondContact N-O 2.85Å; L718-I763 HydrophobicContact CB-CB 3.86Å; L718-I763 HydrophobicContact CB-CG2 4.07Å; L718-I763 WeakPolarHBondContact CB-O 3.21Å; L718-I763 HydrophobicContact CD2-CB 4.01Å; L718-I763 HydrophobicContact CD2-CG1 4.42Å; L718-I763 HydrophobicContact CD2-CG2 3.86Å; L718-I763 PolarHBondContact N-O 2.86Å; L718-V765 HydrophobicContact CB-CG2 3.8Å; L718-V765 HydrophobicContact CD1-CG2 3.61Å; L718-V765 HydrophobicContact CG-CG2 4.29Å; L718-V828 HydrophobicContact CD2-CG2 3.85Å
719	D	94.2	Very high	92.7	Very high	22 Å²	22	51.1 Å²	51.1	12%	0.118	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-48	178.9	72	-43.8	0	0	0	112.2	S717 F721 L722 R723 A760	S717-D719 VanDerWaalsContact CB-OD1 3.24Å; S717-D719 WeakPolarHBondContact CB-OD1 3.47Å; S717-D719 PolarHBondContact O-N 3.45Å; S717-D719 PolarHBondContact OG-OD1 3.15Å; D719-F721 VanDerWaalsContact C-N 3.35Å; D719-L722 PolarHBondContact O-N 3.15Å; D719-R723 PolarHBondContact O-N 3.03Å; D719-R723 VanDerWaalsContact O-N 3.15Å; D719-R723 IonicContact OD2-CZ 2.8Å; D719-R723 IonicContact OD2-NH1 3.51Å; D719-R723 IonicContact OD2-NH2 2.68Å; D719-R723 PolarHBondContact OD2-NH2 3.16Å; D719-A760 HydrophobicContact CB-CB 3.93Å
720	S	93.3	Very high	92.5	Very high	42 Å²	42	54.6 Å²	54.6	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-71.3	-33.2	178.3	-66.7	0	0	0	0	111.6	S717 R723 K724	S717-S720 PolarHBondContact O-N 3.32Å; S720-R723 PolarHBondContact OG-NH2 3.34Å; S720-K724 WeakPolarHBondContact O-CB 3.46Å; S720-K724 VanDerWaalsContact O-CG 3.25Å; S720-K724 WeakPolarHBondContact O-CG 3.32Å; S720-K724 PolarHBondContact O-N 3.08Å
721	F	96.1	Very high	92.2	Very high	18 Å²	18	55.2 Å²	55.2	8%	0.079	30%	0.298	C	S	.	.	H	α-helix	trans	-66.3	-42.7	174.4	179.9	-109	0	0	0	112.1	N715 S717 L718 D719 N725 F729 M737 V765 L769	N715-F721 HydrophobicContact CB-CD2 3.56Å; N715-F721 HydrophobicContact CB-CE2 3.72Å; N715-F721 HydrophobicContact CB-CG 4.2Å; N715-F721 HydrophobicContact CB-CZ 4.47Å; N715-F721 VanDerWaalsContact CG-CE2 3.49Å; S717-F721 VanDerWaalsContact O-CB 3.31Å; S717-F721 WeakPolarHBondContact O-CB 3.47Å; S717-F721 PolarHBondContact O-N 3.12Å; L718-F721 HydrophobicContact CD1-CD1 4.45Å; L718-F721 PolarHBondContact O-N 3.48Å; D719-F721 VanDerWaalsContact C-N 3.35Å; F721-N725 PolarHBondContact O-N 2.94Å; F721-N725 PolarHBondContact O-ND2 2.88Å; F721-F729 HydrophobicContact CD1-CE2 4.37Å; F721-F729 HydrophobicContact CD1-CZ 4.23Å; F721-F729 HydrophobicContact CE1-CE1 4.14Å; F721-F729 AromaticContact CE1-CE2 3.83Å; F721-F729 HydrophobicContact CE1-CE2 3.83Å; F721-F729 AromaticContact CE1-CZ 3.31Å; F721-F729 HydrophobicContact CE1-CZ 3.31Å; F721-F729 HydrophobicContact CE2-CZ 4.49Å; F721-F729 HydrophobicContact CZ-CE1 4.17Å; F721-F729 HydrophobicContact CZ-CE2 4.37Å; F721-F729 AromaticContact CZ-CZ 3.48Å; F721-F729 HydrophobicContact CZ-CZ 3.48Å; F721-F729 VanDerWaalsContact CZ-CZ 3.48Å; F721-M737 HydrophobicContact CE1-CE 3.91Å; F721-V765 HydrophobicContact CD1-CB 4.47Å; F721-V765 HydrophobicContact CD1-CG1 4.2Å; F721-V765 HydrophobicContact CD1-CG2 4.3Å; F721-V765 HydrophobicContact CE1-CG1 4.14Å; F721-L769 HydrophobicContact CE1-CD2 3.76Å; F721-L769 HydrophobicContact CZ-CD2 3.51Å
722	L	95.6	Very high	92.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.6	-48.4	178	-72.6	165.9	0	0	0	111.9	L718 D719 K724 N725 D726 F729 L734 V828 Y831	L718-L722 HydrophobicContact CD1-CD1 3.9Å; L718-L722 HydrophobicContact CD1-CD2 4.36Å; L718-L722 HydrophobicContact CD1-CG 3.86Å; L718-L722 HydrophobicContact CG-CD1 3.8Å; L718-L722 HydrophobicContact CG-CG 4.24Å; L718-L722 WeakPolarHBondContact O-CB 3.27Å; L718-L722 VanDerWaalsContact O-CG 3.22Å; L718-L722 WeakPolarHBondContact O-CG 3.48Å; L718-L722 PolarHBondContact O-N 2.97Å; D719-L722 PolarHBondContact O-N 3.15Å; L722-K724 VanDerWaalsContact C-N 3.26Å; L722-K724 PolarHBondContact O-N 2.76Å; L722-N725 CarbonylContact O-C 3.49Å; L722-N725 VanDerWaalsContact O-C 3.23Å; L722-N725 PolarHBondContact O-N 3.49Å; L722-D726 PolarHBondContact O-N 2.93Å; L722-F729 HydrophobicContact CD2-CD2 4.19Å; L722-F729 HydrophobicContact CD2-CE2 4.25Å; L722-L734 HydrophobicContact CD2-CD2 3.96Å; L722-V828 HydrophobicContact CD1-CB 4.32Å; L722-V828 HydrophobicContact CD1-CG1 4.49Å; L722-V828 HydrophobicContact CD1-CG2 4.09Å; L722-Y831 CarbonylContact C-O 3.58Å; L722-Y831 HydrophobicContact CD2-CD1 4.36Å
723	R	93.6	Very high	92.1	Very high	124 Å²	124	58.1 Å²	58.1	47%	0.468	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-34.4	178.5	-73.5	-172.2	-67.6	-98.5	-1.3	113.3	D719 S720 N725 Y831 G832	D719-R723 PolarHBondContact O-N 3.03Å; D719-R723 VanDerWaalsContact O-N 3.15Å; D719-R723 IonicContact OD2-CZ 2.8Å; D719-R723 IonicContact OD2-NH1 3.51Å; D719-R723 IonicContact OD2-NH2 2.68Å; D719-R723 PolarHBondContact OD2-NH2 3.16Å; S720-R723 PolarHBondContact OG-NH2 3.34Å; R723-N725 VanDerWaalsContact C-N 3.29Å; R723-N725 PolarHBondContact O-N 3.45Å; R723-Y831 VanDerWaalsContact CG-O 3.27Å; R723-Y831 WeakPolarHBondContact CG-O 3.43Å; R723-Y831 PolarHBondContact N-O 2.86Å; R723-G832 PolarHBondContact NH1-O 2.89Å
724	K	93.8	Very high	92.2	Very high	169 Å²	169	57.7 Å²	57.7	74%	0.735	31%	0.313	S	S	*	.	H	α-helix	trans	-72.5	-21.6	176.5	-75.2	174.8	-176.2	177.6	0	113.5	S720 L722	S720-K724 WeakPolarHBondContact O-CB 3.46Å; S720-K724 VanDerWaalsContact O-CG 3.25Å; S720-K724 WeakPolarHBondContact O-CG 3.32Å; S720-K724 PolarHBondContact O-N 3.08Å; L722-K724 VanDerWaalsContact C-N 3.26Å; L722-K724 PolarHBondContact O-N 2.76Å
725	N	91.9	Very high	92.3	Very high	39 Å²	39	53.3 Å²	53.3	21%	0.209	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	39.4	-176.1	-63.4	-84.2	0	0	0	110.3	F721 L722 R723 A727 Q728 F729 Y831	F721-N725 PolarHBondContact O-N 2.94Å; F721-N725 PolarHBondContact O-ND2 2.88Å; L722-N725 CarbonylContact O-C 3.49Å; L722-N725 VanDerWaalsContact O-C 3.23Å; L722-N725 PolarHBondContact O-N 3.49Å; R723-N725 VanDerWaalsContact C-N 3.29Å; R723-N725 PolarHBondContact O-N 3.45Å; N725-A727 PolarHBondContact O-N 2.94Å; N725-Q728 HydrophobicContact CB-CB 4.31Å; N725-Q728 WeakPolarHBondContact O-CB 3.46Å; N725-Q728 PolarHBondContact O-N 3.17Å; N725-F729 HydrophobicContact CB-CD2 4.43Å; N725-F729 HydrophobicContact CB-CE2 3.48Å; N725-F729 VanDerWaalsContact CB-CE2 3.48Å; N725-F729 HydrophobicContact CB-CZ 3.6Å; N725-Y831 WeakPolarHBondContact O-CE1 3.26Å
726	D	88.3	Confident	92.4	Very high	105 Å²	105	52.1 Å²	52.1	56%	0.561	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	129.8	-175.2	-173	31.1	0	0	0	111.6	L722 Q728 Y831	L722-D726 PolarHBondContact O-N 2.93Å; D726-Q728 WeakPolarHBondContact O-CG 3.1Å; D726-Q728 PolarHBondContact O-N 3.06Å; D726-Y831 VanDerWaalsContact OD1-CB 3.29Å; D726-Y831 WeakPolarHBondContact OD1-CB 3.46Å
727	A	83.2	Confident	92.6	Very high	77 Å²	77	50.9 Å²	50.9	64%	0.636	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	13.6	-174.5	0	0	0	0	0	117.2	N725 Y831	N725-A727 PolarHBondContact O-N 2.94Å; A727-Y831 VanDerWaalsContact CA-CZ 3.48Å; A727-Y831 VanDerWaalsContact N-CD1 3.34Å
728	Q	88.4	Confident	92.9	Very high	132 Å²	132	49.4 Å²	49.4	62%	0.617	27%	0.27	S	S	*	.			trans	-88.1	-16.7	-176	-61.4	-175	30.3	0	0	114.6	N725 D726	N725-Q728 HydrophobicContact CB-CB 4.31Å; N725-Q728 WeakPolarHBondContact O-CB 3.46Å; N725-Q728 PolarHBondContact O-N 3.17Å; D726-Q728 WeakPolarHBondContact O-CG 3.1Å; D726-Q728 PolarHBondContact O-N 3.06Å
729	F	90.9	Very high	92.9	Very high	27 Å²	27	53 Å²	53	12%	0.118	28%	0.283	C	S	.	.	S	Bend	trans	-92.9	141.4	-179.5	-58.5	-62.9	0	0	0	112.6	F721 L722 N725 Q733 L734 M737 L769 Y831	F721-F729 HydrophobicContact CD1-CE2 4.37Å; F721-F729 HydrophobicContact CD1-CZ 4.23Å; F721-F729 HydrophobicContact CE1-CE1 4.14Å; F721-F729 AromaticContact CE1-CE2 3.83Å; F721-F729 HydrophobicContact CE1-CE2 3.83Å; F721-F729 AromaticContact CE1-CZ 3.31Å; F721-F729 HydrophobicContact CE1-CZ 3.31Å; F721-F729 HydrophobicContact CE2-CZ 4.49Å; F721-F729 HydrophobicContact CZ-CE1 4.17Å; F721-F729 HydrophobicContact CZ-CE2 4.37Å; F721-F729 AromaticContact CZ-CZ 3.48Å; F721-F729 HydrophobicContact CZ-CZ 3.48Å; F721-F729 VanDerWaalsContact CZ-CZ 3.48Å; L722-F729 HydrophobicContact CD2-CD2 4.19Å; L722-F729 HydrophobicContact CD2-CE2 4.25Å; N725-F729 HydrophobicContact CB-CD2 4.43Å; N725-F729 HydrophobicContact CB-CE2 3.48Å; N725-F729 VanDerWaalsContact CB-CE2 3.48Å; N725-F729 HydrophobicContact CB-CZ 3.6Å; F729-Q733 HydrophobicContact CB-CB 4.32Å; F729-L734 HydrophobicContact CB-CD2 3.78Å; F729-L734 HydrophobicContact CB-CG 4.02Å; F729-L734 HydrophobicContact CD2-CD2 4.08Å; F729-L734 HydrophobicContact CG-CD2 4.25Å; F729-M737 HydrophobicContact CD1-CE 4.31Å; F729-M737 HydrophobicContact CD2-CE 4.48Å; F729-M737 HydrophobicContact CE1-CE 4.26Å; F729-M737 HydrophobicContact CE2-CE 4.42Å; F729-M737 HydrophobicContact CG-CE 4.45Å; F729-M737 HydrophobicContact CZ-CE 4.33Å; F729-L769 HydrophobicContact CE1-CD1 4.31Å; F729-L769 HydrophobicContact CE1-CD2 4.24Å; F729-Y831 HydrophobicContact CB-CE1 4.49Å; F729-Y831 AromaticContact CD2-CE1 3.88Å; F729-Y831 HydrophobicContact CD2-CE1 3.88Å; F729-Y831 PolarHBondContact O-OH 3.46Å
730	T	90.5	Very high	93	Very high	73 Å²	73	52.2 Å²	52.2	45%	0.448	28%	0.281	S	S	.	.			trans	-70	151.1	168.9	60.7	0	0	0	0	110.7	I732 Q733 L734	T730-I732 PolarHBondContact O-N 3.09Å; T730-I732 VanDerWaalsContact O-N 3.07Å; T730-I732 VanDerWaalsContact OG1-CG2 3.23Å; T730-I732 WeakPolarHBondContact OG1-CG2 3.37Å; T730-Q733 WeakPolarHBondContact O-CB 3.25Å; T730-Q733 PolarHBondContact O-N 3.41Å; T730-Q733 VanDerWaalsContact OG1-CG 3.31Å; T730-Q733 WeakPolarHBondContact OG1-CG 3.15Å; T730-Q733 PolarHBondContact OG1-N 3.25Å; T730-Q733 PolarHBondContact OG1-OE1 3.36Å; T730-L734 PolarHBondContact O-N 3.47Å; T730-L734 VanDerWaalsContact O-N 3.16Å
731	G	88.3	Confident	93.3	Very high	33 Å²	33	50.2 Å²	50.2	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-54.1	-32.8	177.3	0	0	0	0	0	113.5	L734 V735	G731-L734 PolarHBondContact O-N 3.36Å; G731-V735 VanDerWaalsContact O-CG2 3.23Å; G731-V735 WeakPolarHBondContact O-CG2 3.09Å; G731-V735 PolarHBondContact O-N 3.17Å
732	I	90.6	Very high	93.4	Very high	61 Å²	61	49.4 Å²	49.4	31%	0.313	26%	0.263	S	S	.	.	H	α-helix	trans	-68.7	-35.4	176.2	-170.7	63.5	0	0	0	112.9	T730 G736 I893 P896	T730-I732 PolarHBondContact O-N 3.09Å; T730-I732 VanDerWaalsContact O-N 3.07Å; T730-I732 VanDerWaalsContact OG1-CG2 3.23Å; T730-I732 WeakPolarHBondContact OG1-CG2 3.37Å; I732-G736 PolarHBondContact O-N 3.36Å; I732-I893 HydrophobicContact CD1-CB 4.15Å; I732-I893 HydrophobicContact CD1-CG1 4.04Å; I732-I893 HydrophobicContact CD1-CG2 4.17Å; I732-P896 HydrophobicContact CD1-CG 4.26Å
733	Q	93.6	Very high	93.5	Very high	76 Å²	76	50.1 Å²	50.1	36%	0.355	27%	0.268	S	S	.	.	H	α-helix	trans	-67.2	-43.2	175	-74.2	166.3	-55.3	0	0	110.7	F729 T730 G736 M737	F729-Q733 HydrophobicContact CB-CB 4.32Å; T730-Q733 WeakPolarHBondContact O-CB 3.25Å; T730-Q733 PolarHBondContact O-N 3.41Å; T730-Q733 VanDerWaalsContact OG1-CG 3.31Å; T730-Q733 WeakPolarHBondContact OG1-CG 3.15Å; T730-Q733 PolarHBondContact OG1-N 3.25Å; T730-Q733 PolarHBondContact OG1-OE1 3.36Å; Q733-G736 WeakPolarHBondContact O-CA 3.39Å; Q733-G736 PolarHBondContact O-N 2.77Å; Q733-G736 VanDerWaalsContact O-N 3.12Å; Q733-M737 WeakPolarHBondContact O-CG 3.43Å; Q733-M737 PolarHBondContact O-N 3.02Å
734	L	94.8	Very high	93.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-45.1	175	-62.7	179.1	0	0	0	111.6	L722 F729 T730 G731 G736 M737 L738 V828 M829 Y831	L722-L734 HydrophobicContact CD2-CD2 3.96Å; F729-L734 HydrophobicContact CB-CD2 3.78Å; F729-L734 HydrophobicContact CB-CG 4.02Å; F729-L734 HydrophobicContact CD2-CD2 4.08Å; F729-L734 HydrophobicContact CG-CD2 4.25Å; T730-L734 PolarHBondContact O-N 3.47Å; T730-L734 VanDerWaalsContact O-N 3.16Å; G731-L734 PolarHBondContact O-N 3.36Å; L734-G736 VanDerWaalsContact C-N 3.26Å; L734-G736 PolarHBondContact O-N 2.9Å; L734-M737 HydrophobicContact CD2-SD 4.42Å; L734-M737 WeakPolarHBondContact O-CB 3.11Å; L734-M737 PolarHBondContact O-N 3.05Å; L734-L738 WeakPolarHBondContact O-CG 3.33Å; L734-L738 PolarHBondContact O-N 2.86Å; L734-V828 HydrophobicContact CB-CG1 4.12Å; L734-V828 HydrophobicContact CD2-CG1 3.93Å; L734-M829 HydrophobicContact CB-SD 4.42Å; L734-M829 HydrophobicContact CD1-CE 4.39Å; L734-M829 HydrophobicContact CD1-SD 4.2Å; L734-Y831 HydrophobicContact CD1-CE2 4.08Å
735	V	94.8	Very high	93.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-36.7	173.8	174.8	0	0	0	0	111.3	G731 L738 R739 L864 L889 L892 I893 L899	G731-V735 VanDerWaalsContact O-CG2 3.23Å; G731-V735 WeakPolarHBondContact O-CG2 3.09Å; G731-V735 PolarHBondContact O-N 3.17Å; V735-L738 PolarHBondContact O-N 3.29Å; V735-R739 VanDerWaalsContact O-CB 3.23Å; V735-R739 WeakPolarHBondContact O-CB 2.97Å; V735-R739 PolarHBondContact O-N 3.12Å; V735-L864 HydrophobicContact CG2-CD1 3.82Å; V735-L864 HydrophobicContact CG2-CD2 4.35Å; V735-L889 HydrophobicContact CG1-CD2 4.22Å; V735-L892 HydrophobicContact CG1-CB 4.21Å; V735-I893 HydrophobicContact CG1-CD1 4.19Å; V735-I893 HydrophobicContact CG1-CG1 3.6Å; V735-L899 HydrophobicContact CG2-CD1 4.14Å; V735-L899 HydrophobicContact CG2-CD2 4.02Å
736	G	95.8	Very high	94.1	Very high	33 Å²	33	37.9 Å²	37.9	34%	0.34	22%	0.217	S	C	.	.	H	α-helix	trans	-60.6	-45.4	173.7	0	0	0	0	0	113	I732 Q733 L734 R739 G740	I732-G736 PolarHBondContact O-N 3.36Å; Q733-G736 WeakPolarHBondContact O-CA 3.39Å; Q733-G736 PolarHBondContact O-N 2.77Å; Q733-G736 VanDerWaalsContact O-N 3.12Å; L734-G736 VanDerWaalsContact C-N 3.26Å; L734-G736 PolarHBondContact O-N 2.9Å; G736-R739 PolarHBondContact O-N 3.27Å; G736-G740 PolarHBondContact O-N 3.47Å
737	M	97.8	Very high	94.5	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-50.2	174.1	-67.8	177.1	-174.4	0	0	111.1	L718 F721 F729 Q733 L734 R739 G740 I741 L769 C771	L718-M737 HydrophobicContact CD1-SD 3.99Å; F721-M737 HydrophobicContact CE1-CE 3.91Å; F729-M737 HydrophobicContact CD1-CE 4.31Å; F729-M737 HydrophobicContact CD2-CE 4.48Å; F729-M737 HydrophobicContact CE1-CE 4.26Å; F729-M737 HydrophobicContact CE2-CE 4.42Å; F729-M737 HydrophobicContact CG-CE 4.45Å; F729-M737 HydrophobicContact CZ-CE 4.33Å; Q733-M737 WeakPolarHBondContact O-CG 3.43Å; Q733-M737 PolarHBondContact O-N 3.02Å; L734-M737 HydrophobicContact CD2-SD 4.42Å; L734-M737 WeakPolarHBondContact O-CB 3.11Å; L734-M737 PolarHBondContact O-N 3.05Å; M737-R739 VanDerWaalsContact C-N 3.33Å; M737-R739 PolarHBondContact O-N 3.15Å; M737-G740 PolarHBondContact O-N 3.13Å; M737-G740 VanDerWaalsContact O-N 3.13Å; M737-I741 WeakPolarHBondContact O-CG1 3.33Å; M737-I741 PolarHBondContact O-N 3.41Å; M737-I741 VanDerWaalsContact O-N 3.08Å; M737-L769 HydrophobicContact CE-CB 3.99Å; M737-L769 HydrophobicContact CE-CD1 4.12Å; M737-L769 HydrophobicContact CE-CD2 3.95Å; M737-L769 HydrophobicContact CE-CG 4.24Å; M737-C771 VanDerWaalsContact CB-SG 3.53Å
738	L	98.1	Very high	95	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-42	178.5	-71.3	167.9	0	0	0	112.8	L734 V735 G740 I741 A742 Y821 L825 V828 M829 L889	L734-L738 WeakPolarHBondContact O-CG 3.33Å; L734-L738 PolarHBondContact O-N 2.86Å; V735-L738 PolarHBondContact O-N 3.29Å; L738-G740 VanDerWaalsContact C-N 3.34Å; L738-I741 PolarHBondContact O-N 2.85Å; L738-A742 WeakPolarHBondContact O-CB 3.39Å; L738-A742 PolarHBondContact O-N 3.31Å; L738-Y821 PolarHBondContact O-OH 2.92Å; L738-L825 HydrophobicContact CB-CD2 4.31Å; L738-L825 HydrophobicContact CD1-CD2 3.6Å; L738-L825 HydrophobicContact CD2-CD2 3.64Å; L738-L825 HydrophobicContact CD2-CG 4.23Å; L738-L825 HydrophobicContact CG-CD2 4.03Å; L738-V828 HydrophobicContact CD1-CB 4.5Å; L738-V828 HydrophobicContact CD1-CG1 4.21Å; L738-V828 HydrophobicContact CD2-CB 3.82Å; L738-V828 HydrophobicContact CD2-CG1 4.13Å; L738-V828 HydrophobicContact CD2-CG2 3.7Å; L738-V828 HydrophobicContact CG-CB 4.22Å; L738-V828 HydrophobicContact CG-CG1 3.98Å; L738-V828 HydrophobicContact CG-CG2 4.39Å; L738-M829 HydrophobicContact CD1-SD 4.48Å; L738-L889 HydrophobicContact CB-CD1 4.41Å
739	R	97.8	Very high	95.1	Very high	75 Å²	75	27 Å²	27	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-64.6	-39	176.9	-173.7	-89.4	-176.7	-141.5	-6.2	111.5	V735 G736 M737 A742 S743 L889 D890 I893	V735-R739 VanDerWaalsContact O-CB 3.23Å; V735-R739 WeakPolarHBondContact O-CB 2.97Å; V735-R739 PolarHBondContact O-N 3.12Å; G736-R739 PolarHBondContact O-N 3.27Å; M737-R739 VanDerWaalsContact C-N 3.33Å; M737-R739 PolarHBondContact O-N 3.15Å; R739-A742 PolarHBondContact O-N 2.77Å; R739-S743 WeakPolarHBondContact O-CB 3.27Å; R739-S743 PolarHBondContact O-N 3.46Å; R739-L889 HydrophobicContact CB-CB 4Å; R739-L889 HydrophobicContact CB-CD1 4.23Å; R739-L889 HydrophobicContact CG-CB 4.08Å; R739-D890 IonicContact CZ-OD1 3.91Å; R739-D890 IonicContact NE-OD1 3.54Å; R739-D890 PolarHBondContact NE-OD1 3.31Å; R739-D890 IonicContact NH2-OD1 2.9Å; R739-D890 PolarHBondContact NH2-OD1 2.8Å; R739-D890 IonicContact NH2-OD2 3.22Å; R739-D890 PolarHBondContact NH2-OD2 3.3Å; R739-I893 HydrophobicContact CB-CD1 3.9Å; R739-I893 HydrophobicContact CG-CD1 3.87Å
740	G	97.1	Very high	95	Very high	6 Å²	6	30.8 Å²	30.8	6%	0.062	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-50.9	172.9	0	0	0	0	0	111.9	N692 G736 M737 L738 A742 S743 G744	N692-G740 WeakPolarHBondContact CB-O 3.3Å; N692-G740 VanDerWaalsContact ND2-CA 3.33Å; N692-G740 WeakPolarHBondContact ND2-CA 3.48Å; G736-G740 PolarHBondContact O-N 3.47Å; M737-G740 PolarHBondContact O-N 3.13Å; M737-G740 VanDerWaalsContact O-N 3.13Å; L738-G740 VanDerWaalsContact C-N 3.34Å; G740-A742 PolarHBondContact O-N 2.89Å; G740-S743 WeakPolarHBondContact O-CB 3.4Å; G740-S743 PolarHBondContact O-N 2.91Å; G740-S743 VanDerWaalsContact O-N 3.17Å; G740-G744 PolarHBondContact O-N 2.6Å
741	I	98.4	Very high	94.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.4	-47.5	178.3	-59.5	162.4	0	0	0	110.7	L718 M737 L738 S743 G744 M745 L758 I763 C771 V773 Y821 V824	L718-I741 HydrophobicContact CD2-CD1 3.7Å; M737-I741 WeakPolarHBondContact O-CG1 3.33Å; M737-I741 PolarHBondContact O-N 3.41Å; M737-I741 VanDerWaalsContact O-N 3.08Å; L738-I741 PolarHBondContact O-N 2.85Å; I741-S743 VanDerWaalsContact C-N 3.3Å; I741-S743 PolarHBondContact O-N 3.3Å; I741-G744 PolarHBondContact O-N 2.95Å; I741-M745 WeakPolarHBondContact O-CG 3.34Å; I741-M745 PolarHBondContact O-N 2.8Å; I741-L758 HydrophobicContact CG2-CD1 4.43Å; I741-I763 HydrophobicContact CD1-CG1 4.09Å; I741-I763 HydrophobicContact CD1-CG2 4Å; I741-I763 HydrophobicContact CG1-CD1 4.26Å; I741-I763 HydrophobicContact CG1-CG1 4.24Å; I741-I763 HydrophobicContact CG1-CG2 3.87Å; I741-I763 HydrophobicContact CG2-CD1 3.94Å; I741-I763 HydrophobicContact CG2-CG1 4.48Å; I741-C771 HydrophobicContact CD1-CB 4.28Å; I741-C771 HydrophobicContact CG1-CB 3.72Å; I741-V773 HydrophobicContact CG2-CG2 4.32Å; I741-Y821 HydrophobicContact CB-CE2 4.07Å; I741-Y821 HydrophobicContact CG2-CD2 3.99Å; I741-Y821 HydrophobicContact CG2-CE2 3.78Å; I741-V824 HydrophobicContact CD1-CG1 3.99Å
742	A	98.4	Very high	94.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.3	-38.5	177.1	0	0	0	0	0	112.5	L738 R739 G740 M745 K746 Y821 I885 V886 L889	L738-A742 WeakPolarHBondContact O-CB 3.39Å; L738-A742 PolarHBondContact O-N 3.31Å; R739-A742 PolarHBondContact O-N 2.77Å; G740-A742 PolarHBondContact O-N 2.89Å; A742-M745 PolarHBondContact O-N 2.91Å; A742-K746 WeakPolarHBondContact O-CB 3.45Å; A742-K746 PolarHBondContact O-N 2.74Å; A742-Y821 HydrophobicContact CB-CE1 4.5Å; A742-Y821 HydrophobicContact CB-CE2 3.96Å; A742-I885 HydrophobicContact CB-CG2 3.85Å; A742-V886 HydrophobicContact CB-CG2 3.67Å; A742-L889 HydrophobicContact CB-CD1 3.92Å
743	S	98.3	Very high	94.5	Very high	16 Å²	16	26.7 Å²	26.7	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-64.1	-40.7	176.5	-164.5	0	0	0	0	111.8	H690 R739 G740 I741 Y747	H690-S743 PolarHBondContact CE1-O 2.84Å; H690-S743 PolarHBondContact CE1-OG 3.43Å; H690-S743 PolarHBondContact NE2-OG 3.41Å; R739-S743 WeakPolarHBondContact O-CB 3.27Å; R739-S743 PolarHBondContact O-N 3.46Å; G740-S743 WeakPolarHBondContact O-CB 3.4Å; G740-S743 PolarHBondContact O-N 2.91Å; G740-S743 VanDerWaalsContact O-N 3.17Å; I741-S743 VanDerWaalsContact C-N 3.3Å; I741-S743 PolarHBondContact O-N 3.3Å; S743-Y747 PolarHBondContact O-N 3.15Å
744	G	97.1	Very high	94.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.5	-47.4	173.9	0	0	0	0	0	112.1	G740 I741 K746 Y747 L748	G740-G744 PolarHBondContact O-N 2.6Å; I741-G744 PolarHBondContact O-N 2.95Å; G744-K746 VanDerWaalsContact C-N 3.35Å; G744-K746 PolarHBondContact O-N 2.87Å; G744-Y747 WeakPolarHBondContact O-CB 3.46Å; G744-Y747 PolarHBondContact O-N 3.07Å; G744-Y747 VanDerWaalsContact O-N 3.16Å; G744-L748 PolarHBondContact O-N 3.24Å
745	M	97.6	Very high	94.1	Very high	1 Å²	1	24 Å²	24	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-67.1	-33.5	179.4	-69.2	-55.3	-54.4	0	0	113.6	I741 A742 Y747 L748 S749 H755 L758 V773 D817 F882	I741-M745 WeakPolarHBondContact O-CG 3.34Å; I741-M745 PolarHBondContact O-N 2.8Å; A742-M745 PolarHBondContact O-N 2.91Å; M745-Y747 VanDerWaalsContact C-N 3.35Å; M745-L748 HydrophobicContact CE-CD1 4.43Å; M745-L748 PolarHBondContact O-N 2.87Å; M745-L748 HydrophobicContact SD-CD1 3.87Å; M745-S749 WeakPolarHBondContact O-CB 3.42Å; M745-S749 PolarHBondContact O-N 2.8Å; M745-H755 HydrophobicContact CE-CB 3.81Å; M745-H755 HydrophobicContact SD-CB 4.26Å; M745-L758 HydrophobicContact CE-CD2 4.04Å; M745-L758 HydrophobicContact CG-CD1 4.18Å; M745-L758 HydrophobicContact CG-CD2 3.8Å; M745-L758 HydrophobicContact SD-CD1 3.76Å; M745-L758 HydrophobicContact SD-CD2 3.9Å; M745-L758 HydrophobicContact SD-CG 4.37Å; M745-V773 HydrophobicContact CG-CG2 4.3Å; M745-V773 HydrophobicContact SD-CG1 4.06Å; M745-V773 HydrophobicContact SD-CG2 4.18Å; M745-D817 HydrophobicContact CE-CB 3.74Å; M745-F882 HydrophobicContact CB-CD1 3.53Å; M745-F882 HydrophobicContact CB-CD2 4.07Å; M745-F882 HydrophobicContact CB-CE1 3.31Å; M745-F882 HydrophobicContact CB-CE2 3.88Å; M745-F882 HydrophobicContact CB-CG 3.92Å; M745-F882 HydrophobicContact CB-CZ 3.51Å; M745-F882 HydrophobicContact CE-CE2 4.08Å; M745-F882 HydrophobicContact CE-CZ 3.94Å; M745-F882 HydrophobicContact CG-CE1 3.94Å; M745-F882 HydrophobicContact CG-CZ 4.02Å
746	K	97.2	Very high	93.8	Very high	74 Å²	74	29.4 Å²	29.4	32%	0.322	16%	0.162	S	C	.	.	H	α-helix	trans	-57.7	-50	169.5	-172.3	-161.7	168.9	-142.8	0	110.5	A742 G744 L748 S749 D750 F882 D883 V886	A742-K746 WeakPolarHBondContact O-CB 3.45Å; A742-K746 PolarHBondContact O-N 2.74Å; G744-K746 VanDerWaalsContact C-N 3.35Å; G744-K746 PolarHBondContact O-N 2.87Å; K746-L748 PolarHBondContact O-N 2.77Å; K746-S749 PolarHBondContact O-N 2.84Å; K746-D750 WeakPolarHBondContact CE-OD2 3.23Å; K746-D750 IonicContact NZ-OD2 2.77Å; K746-D750 WeakPolarHBondContact O-CB 3.23Å; K746-D750 VanDerWaalsContact O-CG 3.28Å; K746-D750 PolarHBondContact O-N 3.5Å; K746-F882 HydrophobicContact CB-CB 3.75Å; K746-F882 HydrophobicContact CG-CB 4.22Å; K746-D883 HydrophobicContact CD-CB 4.28Å; K746-D883 HydrophobicContact CG-CB 4.44Å; K746-V886 HydrophobicContact CB-CG2 4.48Å
747	Y	95.8	Very high	93.4	Very high	50 Å²	50	28.8 Å²	28.8	20%	0.196	15%	0.151	C	C	.	.	H	α-helix	trans	-58.9	-45.4	178.6	171.7	-95.5	0	0	0	112.2	F688 D689 H690 I693 S743 G744 M745 S749 D750 M751	F688-Y747 HydrophobicContact CB-CE1 3.96Å; F688-Y747 AromaticContact CD1-CE1 4Å; F688-Y747 HydrophobicContact CD1-CE1 4Å; F688-Y747 HydrophobicContact CG-CE1 4.28Å; D689-Y747 PolarHBondContact N-OH 2.82Å; H690-Y747 HydrophobicContact CB-CD1 3.69Å; H690-Y747 HydrophobicContact CB-CD2 4.08Å; H690-Y747 HydrophobicContact CB-CE1 3.95Å; H690-Y747 HydrophobicContact CB-CE2 4.3Å; H690-Y747 HydrophobicContact CB-CG 3.75Å; H690-Y747 AromaticContact CD2-CD2 3.92Å; H690-Y747 AromaticContact CD2-CG 3.83Å; H690-Y747 AromaticContact CG-CG 3.82Å; I693-Y747 HydrophobicContact CG1-CD1 4.05Å; S743-Y747 PolarHBondContact O-N 3.15Å; G744-Y747 WeakPolarHBondContact O-CB 3.46Å; G744-Y747 PolarHBondContact O-N 3.07Å; G744-Y747 VanDerWaalsContact O-N 3.16Å; M745-Y747 VanDerWaalsContact C-N 3.35Å; Y747-S749 PolarHBondContact O-N 3.06Å; Y747-D750 PolarHBondContact O-N 2.92Å; Y747-M751 HydrophobicContact CD1-CG 4.46Å; Y747-M751 HydrophobicContact CE1-CG 4.05Å; Y747-M751 HydrophobicContact CE2-CG 4.18Å; Y747-M751 VanDerWaalsContact O-CG 3.32Å; Y747-M751 WeakPolarHBondContact O-CG 3.34Å; Y747-M751 PolarHBondContact O-N 3Å
748	L	93	Very high	93.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-43.8	176.4	-66.8	175.7	0	0	0	112	F688 I693 G744 M745 K746 D750 M751 G752 Y753 V773 F776	F688-L748 HydrophobicContact CD1-CD2 4Å; F688-L748 HydrophobicContact CD2-CD2 3.82Å; F688-L748 HydrophobicContact CE1-CD2 3.91Å; F688-L748 HydrophobicContact CE2-CD2 3.7Å; F688-L748 HydrophobicContact CG-CD2 3.98Å; F688-L748 HydrophobicContact CZ-CD2 3.77Å; I693-L748 HydrophobicContact CD1-CD1 3.79Å; I693-L748 HydrophobicContact CD1-CD2 4.13Å; I693-L748 HydrophobicContact CD1-CG 3.79Å; G744-L748 PolarHBondContact O-N 3.24Å; M745-L748 HydrophobicContact CE-CD1 4.43Å; M745-L748 PolarHBondContact O-N 2.87Å; M745-L748 HydrophobicContact SD-CD1 3.87Å; K746-L748 PolarHBondContact O-N 2.77Å; L748-D750 PolarHBondContact O-N 2.88Å; L748-M751 CarbonylContact O-C 3.57Å; L748-M751 WeakPolarHBondContact O-CB 3.39Å; L748-M751 PolarHBondContact O-N 3.1Å; L748-G752 PolarHBondContact O-N 2.85Å; L748-G752 VanDerWaalsContact O-N 3.17Å; L748-Y753 CarbonylContact C-O 3.58Å; L748-Y753 HydrophobicContact CB-CD1 4.25Å; L748-Y753 HydrophobicContact CD1-CD1 4.22Å; L748-Y753 HydrophobicContact CD2-CD1 3.95Å; L748-Y753 HydrophobicContact CD2-CG 4.49Å; L748-Y753 HydrophobicContact CG-CD1 4.36Å; L748-Y753 PolarHBondContact O-N 2.65Å; L748-V773 HydrophobicContact CD1-CG1 4.39Å; L748-F776 HydrophobicContact CD1-CE1 3.82Å; L748-F776 HydrophobicContact CD1-CZ 4.44Å; L748-F776 HydrophobicContact CD2-CE1 4.05Å
749	S	90.8	Very high	93.1	Very high	36 Å²	36	28.7 Å²	28.7	25%	0.252	15%	0.15	S	C	.	.	H	α-helix	trans	-63.2	-40.4	176.9	-177.3	0	0	0	0	112.2	M745 K746 Y747 M751 G752 S814	M745-S749 WeakPolarHBondContact O-CB 3.42Å; M745-S749 PolarHBondContact O-N 2.8Å; K746-S749 PolarHBondContact O-N 2.84Å; Y747-S749 PolarHBondContact O-N 3.06Å; S749-M751 VanDerWaalsContact C-N 3.28Å; S749-M751 PolarHBondContact O-N 2.87Å; S749-G752 PolarHBondContact O-N 2.8Å; S749-S814 VanDerWaalsContact OG-CB 3.29Å; S749-S814 WeakPolarHBondContact OG-CB 3.38Å; S749-S814 PolarHBondContact OG-OG 2.99Å
750	D	90.4	Very high	93	Very high	105 Å²	105	25.1 Å²	25.1	56%	0.561	14%	0.137	S	C	*	.	H	α-helix	trans	-65.9	-32.7	176.7	-70.9	-15.4	0	0	0	111.3	K746 Y747 L748 G752	K746-D750 WeakPolarHBondContact CE-OD2 3.23Å; K746-D750 IonicContact NZ-OD2 2.77Å; K746-D750 WeakPolarHBondContact O-CB 3.23Å; K746-D750 VanDerWaalsContact O-CG 3.28Å; K746-D750 PolarHBondContact O-N 3.5Å; Y747-D750 PolarHBondContact O-N 2.92Å; L748-D750 PolarHBondContact O-N 2.88Å; D750-G752 PolarHBondContact O-N 2.89Å
751	M	86.6	Confident	92.7	Very high	17 Å²	17	27.8 Å²	27.8	8%	0.084	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.7	171.7	-70.6	-71.6	-65.1	0	0	113.3	R605 Y607 F688 Y747 L748 S749 Y753	R605-M751 HydrophobicContact CB-CE 4.11Å; R605-M751 HydrophobicContact CB-SD 4.17Å; Y607-M751 VanDerWaalsContact CB-O 3.31Å; Y607-M751 WeakPolarHBondContact CB-O 3.44Å; Y607-M751 PolarHBondContact N-O 2.81Å; F688-M751 HydrophobicContact CD1-CE 4.44Å; F688-M751 HydrophobicContact CE1-CB 4.46Å; F688-M751 HydrophobicContact CE1-CE 4.5Å; Y747-M751 HydrophobicContact CD1-CG 4.46Å; Y747-M751 HydrophobicContact CE1-CG 4.05Å; Y747-M751 HydrophobicContact CE2-CG 4.18Å; Y747-M751 VanDerWaalsContact O-CG 3.32Å; Y747-M751 WeakPolarHBondContact O-CG 3.34Å; Y747-M751 PolarHBondContact O-N 3Å; L748-M751 CarbonylContact O-C 3.57Å; L748-M751 WeakPolarHBondContact O-CB 3.39Å; L748-M751 PolarHBondContact O-N 3.1Å; S749-M751 VanDerWaalsContact C-N 3.28Å; S749-M751 PolarHBondContact O-N 2.87Å; M751-Y753 VanDerWaalsContact C-N 3.32Å
752	G	83.3	Confident	92.5	Very high	54 Å²	54	28.3 Å²	28.3	56%	0.557	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.1	16.3	-176.1	0	0	0	0	0	114.3	L748 S749 D750	L748-G752 PolarHBondContact O-N 2.85Å; L748-G752 VanDerWaalsContact O-N 3.17Å; S749-G752 PolarHBondContact O-N 2.8Å; D750-G752 PolarHBondContact O-N 2.89Å
753	Y	88.6	Confident	92.4	Very high	10 Å²	10	28.3 Å²	28.3	4%	0.039	15%	0.148	C	C	.	.			trans	-92.1	140.4	177.2	-175	-96.3	0	0	0	111.3	Y607 I684 F688 L748 M751 H755 F776	Y607-Y753 AromaticContact CD1-CD2 3.81Å; Y607-Y753 HydrophobicContact CD1-CD2 3.81Å; Y607-Y753 AromaticContact CD2-CD2 3.64Å; Y607-Y753 HydrophobicContact CD2-CD2 3.64Å; Y607-Y753 HydrophobicContact CD2-CE2 4.34Å; Y607-Y753 HydrophobicContact CD2-CG 4.47Å; Y607-Y753 AromaticContact CE1-CD2 3.69Å; Y607-Y753 HydrophobicContact CE1-CD2 3.69Å; Y607-Y753 HydrophobicContact CE1-CE2 4.13Å; Y607-Y753 AromaticContact CE2-CD2 3.52Å; Y607-Y753 HydrophobicContact CE2-CD2 3.52Å; Y607-Y753 AromaticContact CE2-CE2 3.76Å; Y607-Y753 HydrophobicContact CE2-CE2 3.76Å; Y607-Y753 AromaticContact CG-CD2 3.77Å; Y607-Y753 HydrophobicContact CG-CD2 3.77Å; Y607-Y753 HydrophobicContact CG-CG 4.46Å; Y607-Y753 AromaticContact CZ-CD2 3.53Å; Y607-Y753 AromaticContact CZ-CE2 3.62Å; I684-Y753 HydrophobicContact CG2-CE2 3.75Å; F688-Y753 HydrophobicContact CE1-CG 4.41Å; F688-Y753 HydrophobicContact CE2-CD1 4.32Å; F688-Y753 HydrophobicContact CE2-CD2 4.41Å; F688-Y753 HydrophobicContact CE2-CE1 4.44Å; F688-Y753 HydrophobicContact CE2-CG 4.3Å; F688-Y753 HydrophobicContact CZ-CD1 4.01Å; F688-Y753 AromaticContact CZ-CD2 3.7Å; F688-Y753 HydrophobicContact CZ-CD2 3.7Å; F688-Y753 HydrophobicContact CZ-CE1 4.49Å; F688-Y753 HydrophobicContact CZ-CE2 4.21Å; F688-Y753 AromaticContact CZ-CG 3.58Å; F688-Y753 HydrophobicContact CZ-CG 3.58Å; L748-Y753 CarbonylContact C-O 3.58Å; L748-Y753 HydrophobicContact CB-CD1 4.25Å; L748-Y753 HydrophobicContact CD1-CD1 4.22Å; L748-Y753 HydrophobicContact CD2-CD1 3.95Å; L748-Y753 HydrophobicContact CD2-CG 4.49Å; L748-Y753 HydrophobicContact CG-CD1 4.36Å; L748-Y753 PolarHBondContact O-N 2.65Å; M751-Y753 VanDerWaalsContact C-N 3.32Å; Y753-H755 HydrophobicContact CE1-CB 4.49Å; Y753-F776 AromaticContact CE1-CD1 3.56Å; Y753-F776 HydrophobicContact CE1-CD1 3.56Å; Y753-F776 HydrophobicContact CE1-CE1 4Å; Y753-F776 AromaticContact CZ-CD1 3.8Å; Y753-F776 PolarHBondContact OH-O 3.41Å
754	V	88.8	Confident	92.3	Very high	25 Å²	25	29.6 Å²	29.6	15%	0.152	15%	0.154	C	C	.	.			trans	-116.9	122.9	176.7	-176	0	0	0	0	108.4	R756 F812 D817	V754-R756 HydrophobicContact CB-CG 4.39Å; V754-R756 HydrophobicContact CG1-CG 3.84Å; V754-F812 HydrophobicContact CG1-CB 4.09Å; V754-D817 WeakPolarHBondContact CA-OD2 3.46Å; V754-D817 WeakPolarHBondContact CG1-OD2 3.33Å
755	H	90.4	Very high	92.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.			trans	-76.2	-34.1	-173.9	-166.4	-66.7	0	0	0	113.6	M745 Y753 D757 L758 V773 S774 D775 F776 L778 D817	M745-H755 HydrophobicContact CE-CB 3.81Å; M745-H755 HydrophobicContact SD-CB 4.26Å; Y753-H755 HydrophobicContact CE1-CB 4.49Å; H755-D757 PolarHBondContact CE1-O 3.35Å; H755-D757 VanDerWaalsContact CE1-O 3.27Å; H755-D757 VanDerWaalsContact ND1-C 3.29Å; H755-D757 PolarHBondContact ND1-O 3.46Å; H755-D757 PolarHBondContact O-N 2.91Å; H755-L758 PolarHBondContact ND1-N 2.78Å; H755-V773 WeakPolarHBondContact CD2-CG1 3.29Å; H755-V773 VanDerWaalsContact NE2-CG1 3.25Å; H755-V773 WeakPolarHBondContact NE2-CG1 3.46Å; H755-S774 PolarHBondContact CE1-O 3.23Å; H755-S774 PolarHBondContact NE2-O 2.91Å; H755-D775 PolarHBondContact CE1-O 3.41Å; H755-F776 AromaticContact CD2-CE1 3.93Å; H755-L778 WeakPolarHBondContact O-CD1 3.45Å; H755-L778 WeakPolarHBondContact O-CD2 3.48Å; H755-L778 WeakPolarHBondContact O-CG 3.41Å; H755-D817 PolarHBondContact N-OD2 2.72Å
756	R	88.1	Confident	92.1	Very high	112 Å²	112	30.8 Å²	30.8	42%	0.423	16%	0.16	S	C	.	.	S	Bend	trans	61.1	-18.8	174.3	-42.9	179.7	-176.2	174.3	-1.3	118	V754 L778 F812 D817	V754-R756 HydrophobicContact CB-CG 4.39Å; V754-R756 HydrophobicContact CG1-CG 3.84Å; R756-L778 HydrophobicContact CB-CD1 3.87Å; R756-L778 HydrophobicContact CB-CD2 3.92Å; R756-L778 HydrophobicContact CB-CG 4.41Å; R756-L778 HydrophobicContact CG-CD1 3.82Å; R756-F812 HydrophobicContact CB-CD1 3.74Å; R756-F812 HydrophobicContact CB-CE1 4.04Å; R756-F812 HydrophobicContact CB-CG 4.33Å; R756-F812 HydrophobicContact CG-CB 3.93Å; R756-F812 HydrophobicContact CG-CD1 3.78Å; R756-F812 HydrophobicContact CG-CE1 4.49Å; R756-F812 HydrophobicContact CG-CG 3.89Å; R756-D817 PolarHBondContact N-OD1 3.11Å
757	D	88.3	Confident	91.9	Very high	21 Å²	21	30.3 Å²	30.3	11%	0.112	17%	0.166	C	C	.	.			trans	-134.2	54.1	172.9	-166.7	19.2	0	0	0	112.3	H755 A759 R761 N762 L778 P798	H755-D757 PolarHBondContact CE1-O 3.35Å; H755-D757 VanDerWaalsContact CE1-O 3.27Å; H755-D757 VanDerWaalsContact ND1-C 3.29Å; H755-D757 PolarHBondContact ND1-O 3.46Å; H755-D757 PolarHBondContact O-N 2.91Å; D757-A759 PolarHBondContact O-N 2.9Å; D757-R761 IonicContact OD1-CZ 2.66Å; D757-R761 IonicContact OD1-NH2 3.06Å; D757-R761 PolarHBondContact OD1-NH2 2.92Å; D757-R761 IonicContact OD2-CZ 3.14Å; D757-R761 IonicContact OD2-NH2 2.81Å; D757-R761 PolarHBondContact OD2-NH2 2.72Å; D757-N762 VanDerWaalsContact CG-ND2 3.34Å; D757-N762 PolarHBondContact O-ND2 3Å; D757-N762 PolarHBondContact OD2-ND2 3.05Å; D757-N762 VanDerWaalsContact OD2-ND2 3.09Å; D757-L778 HydrophobicContact CB-CD2 3.86Å; D757-P798 HydrophobicContact CB-CG 4.44Å; D757-P798 VanDerWaalsContact OD1-CG 3.23Å; D757-P798 WeakPolarHBondContact OD1-CG 3.41Å
758	L	94	Very high	91.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.			trans	-80.4	115.4	176	-178	66.7	0	0	0	109.9	I741 M745 H755 I763 V773 S820 Y821 V824	I741-L758 HydrophobicContact CG2-CD1 4.43Å; M745-L758 HydrophobicContact CE-CD2 4.04Å; M745-L758 HydrophobicContact CG-CD1 4.18Å; M745-L758 HydrophobicContact CG-CD2 3.8Å; M745-L758 HydrophobicContact SD-CD1 3.76Å; M745-L758 HydrophobicContact SD-CD2 3.9Å; M745-L758 HydrophobicContact SD-CG 4.37Å; H755-L758 PolarHBondContact ND1-N 2.78Å; L758-I763 HydrophobicContact CD1-CD1 3.92Å; L758-V773 HydrophobicContact CD1-CG1 4.24Å; L758-S820 WeakPolarHBondContact O-CB 3.43Å; L758-Y821 HydrophobicContact CD2-CD2 4.26Å; L758-V824 HydrophobicContact CG-CG2 4.19Å
759	A	94.6	Very high	91.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.201	C	C	.	.			trans	-154	159.3	179	0	0	0	0	0	110	D757 R761 N762 W801	D757-A759 PolarHBondContact O-N 2.9Å; A759-R761 HydrophobicContact CB-CG 4.01Å; A759-R761 PolarHBondContact O-N 3.44Å; A759-N762 PolarHBondContact O-N 3.41Å; A759-W801 HydrophobicContact CB-CD2 4.14Å; A759-W801 HydrophobicContact CB-CG 3.97Å
760	A	95.8	Very high	92.1	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-57.8	-32.6	-179.8	0	0	0	0	0	113.4	L718 D719 N762 I763 E827	L718-A760 WeakPolarHBondContact CB-O 3.22Å; L718-A760 PolarHBondContact N-O 2.85Å; D719-A760 HydrophobicContact CB-CB 3.93Å; A760-N762 PolarHBondContact O-N 3.47Å; A760-I763 PolarHBondContact O-N 2.96Å; A760-I763 VanDerWaalsContact O-N 3.13Å; A760-E827 HydrophobicContact CB-CB 4.06Å; A760-E827 HydrophobicContact CB-CG 4.49Å; A760-E827 WeakPolarHBondContact CB-OE2 3.48Å; A760-E827 PolarHBondContact N-OE2 3.28Å
761	R	92.2	Very high	92.4	Very high	62 Å²	62	32.1 Å²	32.1	23%	0.234	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-61.7	-25	174.2	66.4	178.1	-171.2	-78	-7.6	114.3	S717 D757 A759	S717-R761 WeakPolarHBondContact CB-O 3.4Å; D757-R761 IonicContact OD1-CZ 2.66Å; D757-R761 IonicContact OD1-NH2 3.06Å; D757-R761 PolarHBondContact OD1-NH2 2.92Å; D757-R761 IonicContact OD2-CZ 3.14Å; D757-R761 IonicContact OD2-NH2 2.81Å; D757-R761 PolarHBondContact OD2-NH2 2.72Å; A759-R761 HydrophobicContact CB-CG 4.01Å; A759-R761 PolarHBondContact O-N 3.44Å
762	N	93.1	Very high	92.9	Very high	12 Å²	12	32.2 Å²	32.2	6%	0.064	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-98.3	8.6	179.7	-66.5	-10.1	0	0	0	112.2	D757 A759 A760 S774 D775	D757-N762 VanDerWaalsContact CG-ND2 3.34Å; D757-N762 PolarHBondContact O-ND2 3Å; D757-N762 PolarHBondContact OD2-ND2 3.05Å; D757-N762 VanDerWaalsContact OD2-ND2 3.09Å; A759-N762 PolarHBondContact O-N 3.41Å; A760-N762 PolarHBondContact O-N 3.47Å; N762-S774 PolarHBondContact O-N 3.23Å; N762-S774 PolarHBondContact O-OG 2.57Å; N762-D775 HydrophobicContact CB-CB 4.23Å
763	I	97.1	Very high	93.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.3	171.6	-54.1	-54.5	0	0	0	108.4	S717 L718 I741 L758 A760 C771 K772 V773	S717-I763 CarbonylContact C-O 3.56Å; S717-I763 WeakPolarHBondContact CA-O 3.31Å; L718-I763 HydrophobicContact CB-CB 3.86Å; L718-I763 HydrophobicContact CB-CG2 4.07Å; L718-I763 WeakPolarHBondContact CB-O 3.21Å; L718-I763 HydrophobicContact CD2-CB 4.01Å; L718-I763 HydrophobicContact CD2-CG1 4.42Å; L718-I763 HydrophobicContact CD2-CG2 3.86Å; L718-I763 PolarHBondContact N-O 2.86Å; I741-I763 HydrophobicContact CD1-CG1 4.09Å; I741-I763 HydrophobicContact CD1-CG2 4Å; I741-I763 HydrophobicContact CG1-CD1 4.26Å; I741-I763 HydrophobicContact CG1-CG1 4.24Å; I741-I763 HydrophobicContact CG1-CG2 3.87Å; I741-I763 HydrophobicContact CG2-CD1 3.94Å; I741-I763 HydrophobicContact CG2-CG1 4.48Å; L758-I763 HydrophobicContact CD1-CD1 3.92Å; A760-I763 PolarHBondContact O-N 2.96Å; A760-I763 VanDerWaalsContact O-N 3.13Å; I763-C771 HydrophobicContact CG2-CB 3.68Å; I763-K772 WeakPolarHBondContact CA-O 3.08Å; I763-V773 HydrophobicContact CD1-CB 4.19Å; I763-V773 HydrophobicContact CD1-CG1 4.24Å; I763-V773 HydrophobicContact CD1-CG2 3.91Å
764	L	95.8	Very high	93.7	Very high	43 Å²	43	29.8 Å²	29.8	23%	0.225	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.4	175.4	-62.5	174.8	0	0	0	111.2	I694 M713 G716 C771 K772	I694-L764 HydrophobicContact CD1-CD1 4.02Å; I694-L764 HydrophobicContact CG1-CD1 4.42Å; M713-L764 HydrophobicContact CB-CB 3.81Å; M713-L764 HydrophobicContact CB-CD1 4.35Å; M713-L764 VanDerWaalsContact CE-C 3.47Å; M713-L764 HydrophobicContact CE-CB 3.88Å; M713-L764 VanDerWaalsContact CE-O 3.24Å; M713-L764 WeakPolarHBondContact CE-O 3.24Å; M713-L764 HydrophobicContact CG-CB 3.64Å; M713-L764 HydrophobicContact CG-CD1 3.93Å; M713-L764 HydrophobicContact CG-CG 4.41Å; G716-L764 WeakPolarHBondContact O-CA 3.35Å; L764-C771 CarbonylContact O-C 3.58Å; L764-C771 WeakPolarHBondContact O-CA 3.35Å; L764-K772 PolarHBondContact N-O 3.42Å; L764-K772 PolarHBondContact O-N 3.48Å
765	V	96.6	Very high	93.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.4	-176.6	-169.7	0	0	0	0	110.2	M713 N715 G716 L718 F721	M713-V765 CarbonylContact C-O 3.49Å; N715-V765 HydrophobicContact CB-CB 3.96Å; N715-V765 HydrophobicContact CB-CG1 4.19Å; N715-V765 WeakPolarHBondContact CB-O 3.48Å; N715-V765 PolarHBondContact N-O 3.12Å; G716-V765 PolarHBondContact O-N 3.05Å; L718-V765 HydrophobicContact CB-CG2 3.8Å; L718-V765 HydrophobicContact CD1-CG2 3.61Å; L718-V765 HydrophobicContact CG-CG2 4.29Å; F721-V765 HydrophobicContact CD1-CB 4.47Å; F721-V765 HydrophobicContact CD1-CG1 4.2Å; F721-V765 HydrophobicContact CD1-CG2 4.3Å; F721-V765 HydrophobicContact CE1-CG1 4.14Å
766	N	94.2	Very high	92.8	Very high	25 Å²	25	31.6 Å²	31.6	13%	0.134	16%	0.163	C	C	.	.			trans	-95.3	174.9	174.5	77.1	3	0	0	0	112	M713 E714 N715 N768 L769 V770	M713-N766 HydrophobicContact CE-CB 3.88Å; M713-N766 HydrophobicContact SD-CB 4.06Å; E714-N766 VanDerWaalsContact OE2-CA 3.26Å; E714-N766 WeakPolarHBondContact OE2-CA 3.3Å; E714-N766 WeakPolarHBondContact OE2-CB 3.2Å; N715-N766 PolarHBondContact ND2-O 3.38Å; N766-N768 PolarHBondContact O-N 2.8Å; N766-N768 VanDerWaalsContact O-N 3.08Å; N766-N768 WeakPolarHBondContact OD1-CA 3.25Å; N766-N768 PolarHBondContact OD1-N 3.11Å; N766-L769 PolarHBondContact O-N 3.47Å; N766-L769 PolarHBondContact OD1-N 2.67Å; N766-V770 PolarHBondContact N-O 3.1Å; N766-V770 WeakPolarHBondContact OD1-CB 3.48Å; N766-V770 PolarHBondContact OD1-N 3.41Å
767	S	92	Very high	91.6	Very high	65 Å²	65	28.1 Å²	28.1	46%	0.455	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-23.8	178.2	49.1	0	0	0	0	114.9	E714	E714-S767 PolarHBondContact OE1-OG 3.34Å; E714-S767 PolarHBondContact OE2-N 3.03Å
768	N	93.6	Very high	89.7	Confident	128 Å²	128	29.5 Å²	29.5	68%	0.684	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	16	177.8	-62.8	-54.2	0	0	0	113.5	N766 V770	N766-N768 PolarHBondContact O-N 2.8Å; N766-N768 VanDerWaalsContact O-N 3.08Å; N766-N768 WeakPolarHBondContact OD1-CA 3.25Å; N766-N768 PolarHBondContact OD1-N 3.11Å; N768-V770 HydrophobicContact CB-CG2 4.28Å; N768-V770 PolarHBondContact O-N 3.11Å
769	L	93.9	Very high	87.2	Confident	48 Å²	48	32.7 Å²	32.7	25%	0.251	19%	0.191	S	C	.	.			trans	61.9	17.7	-176.7	-50.5	179.4	0	0	0	114.4	F721 F729 M737 N766 C771	F721-L769 HydrophobicContact CE1-CD2 3.76Å; F721-L769 HydrophobicContact CZ-CD2 3.51Å; F729-L769 HydrophobicContact CE1-CD1 4.31Å; F729-L769 HydrophobicContact CE1-CD2 4.24Å; M737-L769 HydrophobicContact CE-CB 3.99Å; M737-L769 HydrophobicContact CE-CD1 4.12Å; M737-L769 HydrophobicContact CE-CD2 3.95Å; M737-L769 HydrophobicContact CE-CG 4.24Å; N766-L769 PolarHBondContact O-N 3.47Å; N766-L769 PolarHBondContact OD1-N 2.67Å; L769-C771 PolarHBondContact O-N 3.12Å
770	V	96.3	Very high	84.7	Confident	51 Å²	51	38.4 Å²	38.4	31%	0.309	21%	0.212	S	C	.	.			trans	-75.9	119.3	174.7	-178.1	0	0	0	0	108.6	N766 N768 K772	N766-V770 PolarHBondContact N-O 3.1Å; N766-V770 WeakPolarHBondContact OD1-CB 3.48Å; N766-V770 PolarHBondContact OD1-N 3.41Å; N768-V770 HydrophobicContact CB-CG2 4.28Å; N768-V770 PolarHBondContact O-N 3.11Å; V770-K772 HydrophobicContact CG1-CG 4.49Å
771	C	97.7	Very high	81.8	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.007	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.6	175.1	-67.9	0	0	0	0	110.8	N692 M737 I741 I763 L764 L769	N692-C771 PolarHBondContact ND2-O 3.05Å; M737-C771 VanDerWaalsContact CB-SG 3.53Å; I741-C771 HydrophobicContact CD1-CB 4.28Å; I741-C771 HydrophobicContact CG1-CB 3.72Å; I763-C771 HydrophobicContact CG2-CB 3.68Å; L764-C771 CarbonylContact O-C 3.58Å; L764-C771 WeakPolarHBondContact O-CA 3.35Å; L769-C771 PolarHBondContact O-N 3.12Å
772	K	97.3	Very high	79	Confident	19 Å²	19	40.9 Å²	40.9	8%	0.083	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131	175.9	-58.2	-164.9	179.4	-153.8	0	111.1	P691 N692 E711 M713 I763 L764 V770	P691-K772 WeakPolarHBondContact O-CE 3.34Å; P691-K772 PolarHBondContact O-NZ 2.96Å; N692-K772 WeakPolarHBondContact O-CA 3.31Å; E711-K772 VanDerWaalsContact OE1-CD 3.3Å; E711-K772 WeakPolarHBondContact OE1-CD 3.25Å; E711-K772 WeakPolarHBondContact OE1-CE 3.48Å; E711-K772 IonicContact OE1-NZ 3.51Å; E711-K772 PolarHBondContact OE1-NZ 3.3Å; E711-K772 IonicContact OE2-NZ 2.7Å; E711-K772 PolarHBondContact OE2-NZ 3.38Å; M713-K772 HydrophobicContact CE-CB 3.95Å; M713-K772 HydrophobicContact CE-CD 3.88Å; M713-K772 HydrophobicContact CE-CG 3.67Å; M713-K772 HydrophobicContact SD-CD 3.97Å; M713-K772 HydrophobicContact SD-CG 4.43Å; I763-K772 WeakPolarHBondContact CA-O 3.08Å; L764-K772 PolarHBondContact N-O 3.42Å; L764-K772 PolarHBondContact O-N 3.48Å; V770-K772 HydrophobicContact CG1-CG 4.49Å
773	V	96.3	Very high	76.2	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.8	173.6	-172.3	0	0	0	0	108.9	N692 I693 I694 I741 M745 L748 H755 L758 I763	N692-V773 PolarHBondContact O-N 2.78Å; I693-V773 HydrophobicContact CD1-CB 3.73Å; I693-V773 HydrophobicContact CD1-CG2 4.07Å; I694-V773 PolarHBondContact N-O 3.22Å; I741-V773 HydrophobicContact CG2-CG2 4.32Å; M745-V773 HydrophobicContact CG-CG2 4.3Å; M745-V773 HydrophobicContact SD-CG1 4.06Å; M745-V773 HydrophobicContact SD-CG2 4.18Å; L748-V773 HydrophobicContact CD1-CG1 4.39Å; H755-V773 WeakPolarHBondContact CD2-CG1 3.29Å; H755-V773 VanDerWaalsContact NE2-CG1 3.25Å; H755-V773 WeakPolarHBondContact NE2-CG1 3.46Å; L758-V773 HydrophobicContact CD1-CG1 4.24Å; I763-V773 HydrophobicContact CD1-CB 4.19Å; I763-V773 HydrophobicContact CD1-CG1 4.24Å; I763-V773 HydrophobicContact CD1-CG2 3.91Å
774	S	91.7	Very high	73.3	Confident	13 Å²	13	54 Å²	54	9%	0.091	30%	0.299	C	S	.	.			trans	-139.1	179.3	-177.6	70.6	0	0	0	0	110.9	H755 N762	H755-S774 PolarHBondContact CE1-O 3.23Å; H755-S774 PolarHBondContact NE2-O 2.91Å; N762-S774 PolarHBondContact O-N 3.23Å; N762-S774 PolarHBondContact O-OG 2.57Å
775	D	82.3	Confident	70.6	Confident	64 Å²	64	54.5 Å²	54.5	34%	0.342	30%	0.302	S	S	.	.			trans	64.3	76.9	178.8	-161.4	6	0	0	0	114.6	H755 N762 G777	H755-D775 PolarHBondContact CE1-O 3.41Å; N762-D775 HydrophobicContact CB-CB 4.23Å; D775-G777 VanDerWaalsContact C-N 3.33Å
776	F	77.2	Confident	67.9	Low	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.337	C	S	.	.			trans	-92.1	10.9	-179.9	-61.4	-75.8	0	0	0	113.6	I684 M685 F688 I693 I694 L748 Y753 H755 L778	I684-F776 HydrophobicContact CB-CB 4.25Å; I684-F776 WeakPolarHBondContact CD1-O 3.43Å; I684-F776 HydrophobicContact CG2-CB 3.66Å; I684-F776 HydrophobicContact CG2-CD1 4.31Å; I684-F776 HydrophobicContact CG2-CG 4.04Å; M685-F776 HydrophobicContact CG-CD2 3.48Å; M685-F776 VanDerWaalsContact CG-CD2 3.48Å; M685-F776 HydrophobicContact CG-CE2 4.04Å; M685-F776 HydrophobicContact CG-CG 4.44Å; M685-F776 HydrophobicContact SD-CD2 4.38Å; F688-F776 HydrophobicContact CD2-CE1 4.18Å; F688-F776 HydrophobicContact CD2-CE2 4.46Å; F688-F776 HydrophobicContact CD2-CZ 4.14Å; F688-F776 HydrophobicContact CE2-CD1 4.05Å; F688-F776 AromaticContact CE2-CE1 3.98Å; F688-F776 HydrophobicContact CE2-CE1 3.98Å; F688-F776 HydrophobicContact CE2-CZ 4.39Å; I693-F776 HydrophobicContact CD1-CZ 4.49Å; I693-F776 HydrophobicContact CG2-CE2 4.06Å; I693-F776 HydrophobicContact CG2-CZ 3.68Å; I694-F776 HydrophobicContact CG2-CE2 3.88Å; L748-F776 HydrophobicContact CD1-CE1 3.82Å; L748-F776 HydrophobicContact CD1-CZ 4.44Å; L748-F776 HydrophobicContact CD2-CE1 4.05Å; Y753-F776 AromaticContact CE1-CD1 3.56Å; Y753-F776 HydrophobicContact CE1-CD1 3.56Å; Y753-F776 HydrophobicContact CE1-CE1 4Å; Y753-F776 AromaticContact CZ-CD1 3.8Å; Y753-F776 PolarHBondContact OH-O 3.41Å; H755-F776 AromaticContact CD2-CE1 3.93Å; F776-L778 PolarHBondContact O-N 2.85Å; F776-L778 VanDerWaalsContact O-N 3.15Å
777	G	63.5	Low	65.5	Low	38 Å²	38	63.5 Å²	63.5	39%	0.392	35%	0.353	S	S	.	.			trans	-84.1	74.9	-172.8	0	0	0	0	0	113.5	D775 S779	D775-G777 VanDerWaalsContact C-N 3.33Å; G777-S779 PolarHBondContact O-N 2.98Å
778	L	49.2	Very low	62.9	Low	51 Å²	51	61.2 Å²	61.2	27%	0.267	34%	0.338	S	S	.	.			trans	-94	80.8	-169.7	-63.1	161.1	0	0	0	114.3	H755 R756 D757 F776	H755-L778 WeakPolarHBondContact O-CD1 3.45Å; H755-L778 WeakPolarHBondContact O-CD2 3.48Å; H755-L778 WeakPolarHBondContact O-CG 3.41Å; R756-L778 HydrophobicContact CB-CD1 3.87Å; R756-L778 HydrophobicContact CB-CD2 3.92Å; R756-L778 HydrophobicContact CB-CG 4.41Å; R756-L778 HydrophobicContact CG-CD1 3.82Å; D757-L778 HydrophobicContact CB-CD2 3.86Å; F776-L778 PolarHBondContact O-N 2.85Å; F776-L778 VanDerWaalsContact O-N 3.15Å
779	S	40.6	Very low	60.7	Low	67 Å²	67	55.7 Å²	55.7	47%	0.469	31%	0.31	S	S	.	.	S	Bend	trans	177.3	100.4	139.5	157.8	0	0	0	0	111.9	G777	G777-S779 PolarHBondContact O-N 2.98Å
780	R	42.2	Very low	58.4	Low	119 Å²	119	58.5 Å²	58.5	45%	0.449	32%	0.318	S	S	.	.	S	Bend	trans	73.5	120.5	160.8	-44.3	155.9	-166.2	-175.6	2.4	111.6	G794 G795	R780-G794 PolarHBondContact NH2-O 3.2Å; R780-G795 VanDerWaalsContact NE-CA 3.31Å
781	V	35.8	Very low	56.2	Low	79 Å²	79	60.8 Å²	60.8	48%	0.479	33%	0.332	S	S	.	.			cis	-150	117.9	48.3	168	0	0	0	0	107.2	E783 K796	V781-E783 PolarHBondContact O-N 3.2Å; V781-K796 HydrophobicContact CG1-CD 4.38Å
782	L	32.6	Very low	53.7	Low	36 Å²	36	62.9 Å²	62.9	19%	0.188	35%	0.345	C	S	.	.			trans	-53.5	116.5	164.3	-78	157.5	0	0	0	107.5	A789 K796 P798	L782-A789 HydrophobicContact CB-CB 3.71Å; L782-A789 HydrophobicContact CD1-CB 3.19Å; L782-A789 HydrophobicContact CG-CB 4.02Å; L782-K796 HydrophobicContact CB-CD 4.19Å; L782-K796 PolarHBondContact O-NZ 3.1Å; L782-P798 HydrophobicContact CD1-CB 4.22Å
783	E	34.4	Very low	51.1	Low	119 Å²	119	74.9 Å²	74.9	56%	0.556	39%	0.39	S	S	*	.			trans	-58.4	131.6	178.3	-70.9	179.6	166.5	0	0	109.4	E642 V781 D785	E642-E783 PolarHBondContact N-OE1 2.97Å; E642-E783 VanDerWaalsContact N-OE1 3.15Å; V781-E783 PolarHBondContact O-N 3.2Å; E783-D785 PolarHBondContact O-N 3.36Å
784	D	35.9	Very low	48.6	Very low	167 Å²	167	76.1 Å²	76.1	89%	0.893	40%	0.403	S	S	*	.	S	Bend	trans	38.9	0.2	158.2	-60.8	-21.4	0	0	0	123.1	P786	D784-P786 VanDerWaalsContact O-CD 3.23Å; D784-P786 WeakPolarHBondContact O-CD 3.35Å
785	D	40	Very low	47	Very low	54 Å²	54	76.1 Å²	76.1	29%	0.289	41%	0.405	S	S	.	.			trans	-104.9	95.7	168.2	-171.8	0.8	0	0	0	110.6	E783 E787 A788 R834	E783-D785 PolarHBondContact O-N 3.36Å; D785-E787 PolarHBondContact O-N 3.12Å; D785-E787 VanDerWaalsContact O-N 3.07Å; D785-E787 WeakPolarHBondContact OD1-CA 3.27Å; D785-E787 VanDerWaalsContact OD1-CB 3.28Å; D785-E787 WeakPolarHBondContact OD1-CB 3.15Å; D785-E787 PolarHBondContact OD1-N 3.13Å; D785-A788 HydrophobicContact CB-CB 4.08Å; D785-A788 PolarHBondContact O-N 3.38Å; D785-A788 VanDerWaalsContact O-N 3.09Å; D785-R834 IonicContact OD2-NH1 2.64Å; D785-R834 PolarHBondContact OD2-NH1 3.16Å
786	P	39.3	Very low	46.1	Very low	113 Å²	113	76.3 Å²	76.3	73%	0.734	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-12.6	174.7	23.1	-30.7	0	0	0	113.5	D784	D784-P786 VanDerWaalsContact O-CD 3.23Å; D784-P786 WeakPolarHBondContact O-CD 3.35Å
787	E	43.3	Very low	45.8	Very low	101 Å²	101	76.8 Å²	76.8	47%	0.472	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-13.5	174.4	-61.4	-162.1	136.5	0	0	114.7	D785 R834 N841	D785-E787 PolarHBondContact O-N 3.12Å; D785-E787 VanDerWaalsContact O-N 3.07Å; D785-E787 WeakPolarHBondContact OD1-CA 3.27Å; D785-E787 VanDerWaalsContact OD1-CB 3.28Å; D785-E787 WeakPolarHBondContact OD1-CB 3.15Å; D785-E787 PolarHBondContact OD1-N 3.13Å; E787-R834 IonicContact OE2-NH2 3.82Å; E787-R834 PolarHBondContact OE2-NH2 3.04Å; E787-N841 PolarHBondContact O-ND2 2.9Å; E787-N841 PolarHBondContact O-OD1 2.92Å; E787-N841 VanDerWaalsContact O-OD1 3.11Å
788	A	38.8	Very low	46.8	Very low	18 Å²	18	75.5 Å²	75.5	15%	0.149	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-12.9	-179	0	0	0	0	0	113.5	D785	D785-A788 HydrophobicContact CB-CB 4.08Å; D785-A788 PolarHBondContact O-N 3.38Å; D785-A788 VanDerWaalsContact O-N 3.09Å
789	A	47.3	Very low	48.6	Very low	11 Å²	11	73.3 Å²	73.3	9%	0.091	38%	0.378	C	S	.	.			trans	-139.8	137	-167.2	0	0	0	0	0	113.1	L782 K796 N841	L782-A789 HydrophobicContact CB-CB 3.71Å; L782-A789 HydrophobicContact CD1-CB 3.19Å; L782-A789 HydrophobicContact CG-CB 4.02Å; A789-K796 HydrophobicContact CB-CB 4.33Å; A789-K796 HydrophobicContact CB-CD 4.01Å; A789-K796 HydrophobicContact CB-CG 4.45Å; A789-N841 PolarHBondContact N-ND2 3.16Å
790	Y	45.5	Very low	51.1	Low	108 Å²	108	70.3 Å²	70.3	42%	0.424	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.8	168.6	-171.3	-103.1	0	0	0	112	T792 K796 I797	Y790-T792 HydrophobicContact CD1-CG2 3.62Å; Y790-T792 HydrophobicContact CE1-CG2 3.71Å; Y790-K796 WeakPolarHBondContact O-CA 3.21Å; Y790-I797 PolarHBondContact N-O 3.39Å; Y790-I797 PolarHBondContact O-N 3.4Å
791	T	48.5	Very low	53.5	Low	99 Å²	99	65.7 Å²	65.7	61%	0.607	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.4	179.6	-57.7	0	0	0	0	110.3
792	T	46.9	Very low	56.1	Low	45 Å²	45	62.1 Å²	62.1	28%	0.276	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	169	171.6	51	0	0	0	0	109.9	Y790 G794 G795 R810	Y790-T792 HydrophobicContact CD1-CG2 3.62Å; Y790-T792 HydrophobicContact CE1-CG2 3.71Å; T792-G794 PolarHBondContact O-N 3.34Å; T792-G795 PolarHBondContact N-O 3.43Å; T792-G795 PolarHBondContact O-N 2.85Å; T792-G795 VanDerWaalsContact O-N 3.15Å; T792-G795 PolarHBondContact OG1-O 2.92Å; T792-G795 VanDerWaalsContact OG1-O 3.12Å; T792-R810 PolarHBondContact OG1-NE 2.9Å; T792-R810 PolarHBondContact OG1-NH2 2.79Å
793	R	42.4	Very low	59	Low	270 Å²	270	60.5 Å²	60.5	100%	1.019	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	11.2	-177	-67	-173	-175.1	-170.3	2.1	116.2
794	G	42.3	Very low	61.7	Low	27 Å²	27	55.9 Å²	55.9	28%	0.278	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.2	22.5	178.6	0	0	0	0	0	115.2	R780 T792 R810	R780-G794 PolarHBondContact NH2-O 3.2Å; T792-G794 PolarHBondContact O-N 3.34Å; G794-R810 VanDerWaalsContact CA-NH2 3.34Å
795	G	58.3	Low	64.2	Low	12 Å²	12	49.1 Å²	49.1	12%	0.124	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.2	170.6	168.3	0	0	0	0	0	115.3	R780 T792	R780-G795 VanDerWaalsContact NE-CA 3.31Å; T792-G795 PolarHBondContact N-O 3.43Å; T792-G795 PolarHBondContact O-N 2.85Å; T792-G795 VanDerWaalsContact O-N 3.15Å; T792-G795 PolarHBondContact OG1-O 2.92Å; T792-G795 VanDerWaalsContact OG1-O 3.12Å
796	K	63	Low	66.5	Low	68 Å²	68	46.6 Å²	46.6	30%	0.296	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	137.4	168	-69.9	-167.7	-178.5	-170.3	0	109	V781 L782 A789 Y790	V781-K796 HydrophobicContact CG1-CD 4.38Å; L782-K796 HydrophobicContact CB-CD 4.19Å; L782-K796 PolarHBondContact O-NZ 3.1Å; A789-K796 HydrophobicContact CB-CB 4.33Å; A789-K796 HydrophobicContact CB-CD 4.01Å; A789-K796 HydrophobicContact CB-CG 4.45Å; Y790-K796 WeakPolarHBondContact O-CA 3.21Å
797	I	71.1	Confident	68.7	Low	11 Å²	11	42.9 Å²	42.9	6%	0.056	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136	176.8	-61.5	175.8	0	0	0	109.3	Y790 I799 T802 F812	Y790-I797 PolarHBondContact N-O 3.39Å; Y790-I797 PolarHBondContact O-N 3.4Å; I797-I799 HydrophobicContact CB-CD1 4.36Å; I797-I799 HydrophobicContact CG2-CD1 4.24Å; I797-I799 PolarHBondContact O-N 3.09Å; I797-I799 VanDerWaalsContact O-N 3.07Å; I797-T802 HydrophobicContact CG2-CG2 3.8Å; I797-T802 WeakPolarHBondContact CG2-OG1 3.41Å; I797-F812 HydrophobicContact CD1-CZ 4.5Å
798	P	84.9	Confident	70.6	Confident	11 Å²	11	41.2 Å²	41.2	7%	0.071	22%	0.216	C	C	.	.			trans	-77.9	84.5	176.8	32.8	-35.3	0	0	0	110.5	D757 L782 R800 W801 T802	D757-P798 HydrophobicContact CB-CG 4.44Å; D757-P798 VanDerWaalsContact OD1-CG 3.23Å; D757-P798 WeakPolarHBondContact OD1-CG 3.41Å; L782-P798 HydrophobicContact CD1-CB 4.22Å; P798-R800 VanDerWaalsContact C-N 3.31Å; P798-R800 PolarHBondContact O-N 3.28Å; P798-R800 VanDerWaalsContact O-N 3.15Å; P798-W801 HydrophobicContact CB-CE3 4.04Å; P798-W801 PolarHBondContact O-N 2.89Å; P798-T802 PolarHBondContact O-N 3.2Å; P798-T802 PolarHBondContact O-OG1 2.8Å
799	I	87.9	Confident	72.4	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-52.6	-43.8	-165.9	-66.7	-57.4	0	0	0	113.5	I797 W801 T802 I807 N841 V844 I845	I797-I799 HydrophobicContact CB-CD1 4.36Å; I797-I799 HydrophobicContact CG2-CD1 4.24Å; I797-I799 PolarHBondContact O-N 3.09Å; I797-I799 VanDerWaalsContact O-N 3.07Å; I799-W801 VanDerWaalsContact C-N 3.26Å; I799-W801 PolarHBondContact O-N 3.45Å; I799-T802 PolarHBondContact O-N 3.26Å; I799-I807 HydrophobicContact CD1-CG1 4.38Å; I799-I807 HydrophobicContact CD1-CG2 4.5Å; I799-I807 HydrophobicContact CG2-CD1 4.43Å; I799-N841 HydrophobicContact CB-CB 4.42Å; I799-N841 HydrophobicContact CG1-CB 4.35Å; I799-N841 HydrophobicContact CG2-CB 4.37Å; I799-V844 HydrophobicContact CG2-CB 4.29Å; I799-V844 HydrophobicContact CG2-CG1 4.05Å; I799-I845 HydrophobicContact CD1-CD1 4.12Å; I799-I845 HydrophobicContact CD1-CG1 4.4Å; I799-I845 HydrophobicContact CG1-CD1 4.45Å; I799-I845 HydrophobicContact CG2-CD1 4.22Å; I799-I845 HydrophobicContact CG2-CG1 3.66Å
800	R	91.9	Very high	73.8	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.015	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-67.1	-22.2	-172.6	-60.6	169	-175.8	-86.9	-1.3	114.6	P798 P835 Y836 W837 M839 V844	P798-R800 VanDerWaalsContact C-N 3.31Å; P798-R800 PolarHBondContact O-N 3.28Å; P798-R800 VanDerWaalsContact O-N 3.15Å; R800-P835 HydrophobicContact CB-CB 4.31Å; R800-P835 WeakPolarHBondContact CD-O 3.4Å; R800-P835 PolarHBondContact NH1-O 3.35Å; R800-Y836 HydrophobicContact CB-CD2 4.36Å; R800-W837 PolarHBondContact NH1-O 3.38Å; R800-M839 PolarHBondContact NH1-O 3.46Å; R800-M839 PolarHBondContact NH2-O 3.28Å; R800-V844 HydrophobicContact CG-CG1 4.44Å; R800-V844 HydrophobicContact CG-CG2 4.46Å
801	W	93.5	Very high	75.3	Confident	22 Å²	22	53.1 Å²	53.1	8%	0.083	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-104.3	-7.2	178.8	-61.2	-98.4	0	0	0	113.1	A759 P798 I799 S820 I823 E827 P835	A759-W801 HydrophobicContact CB-CD2 4.14Å; A759-W801 HydrophobicContact CB-CG 3.97Å; P798-W801 HydrophobicContact CB-CE3 4.04Å; P798-W801 PolarHBondContact O-N 2.89Å; I799-W801 VanDerWaalsContact C-N 3.26Å; I799-W801 PolarHBondContact O-N 3.45Å; W801-S820 WeakPolarHBondContact O-CA 3.4Å; W801-S820 WeakPolarHBondContact O-CB 3.29Å; W801-S820 PolarHBondContact O-OG 3.5Å; W801-I823 HydrophobicContact CG-CG2 4.04Å; W801-E827 WeakPolarHBondContact CZ2-OE1 3.46Å; W801-E827 PolarHBondContact NE1-OE1 2.98Å; W801-E827 PolarHBondContact NE1-OE2 3.26Å; W801-P835 HydrophobicContact CZ2-CG 3.98Å
802	T	91.2	Very high	77	Confident	4 Å²	4	51 Å²	51	3%	0.025	24%	0.241	C	C	.	.	S	Bend	trans	-92.6	136.8	-169	-57.7	0	0	0	0	111.8	I797 P798 I799 A806 I807 F812 W819	I797-T802 HydrophobicContact CG2-CG2 3.8Å; I797-T802 WeakPolarHBondContact CG2-OG1 3.41Å; P798-T802 PolarHBondContact O-N 3.2Å; P798-T802 PolarHBondContact O-OG1 2.8Å; I799-T802 PolarHBondContact O-N 3.26Å; T802-A806 HydrophobicContact CG2-CB 3.49Å; T802-A806 VanDerWaalsContact CG2-CB 3.49Å; T802-I807 HydrophobicContact CG2-CG1 3.69Å; T802-I807 WeakPolarHBondContact O-CD1 3.34Å; T802-F812 HydrophobicContact CG2-CE1 4.42Å; T802-W819 PolarHBondContact O-NE1 2.85Å
803	A	92.6	Very high	78.9	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.008	24%	0.24	C	C	.	.			trans	-64.2	150.2	176.4	0	0	0	0	0	113.1	E805 A806 I807 W819	A803-E805 VanDerWaalsContact C-N 3.29Å; A803-E805 WeakPolarHBondContact CB-OE1 3.34Å; A803-E805 WeakPolarHBondContact CB-OE2 3.33Å; A803-E805 PolarHBondContact O-N 2.63Å; A803-A806 HydrophobicContact CB-CB 4.46Å; A803-A806 PolarHBondContact O-N 3.34Å; A803-I807 WeakPolarHBondContact O-CG1 3.19Å; A803-I807 PolarHBondContact O-N 3.06Å; A803-W819 HydrophobicContact CB-CB 3.76Å; A803-W819 HydrophobicContact CB-CD2 4.11Å; A803-W819 HydrophobicContact CB-CG 3.7Å
804	P	91.8	Very high	81.2	Confident	22 Å²	22	39.7 Å²	39.7	14%	0.143	20%	0.203	C	C	.	.	H	α-helix	trans	-55.3	-40	-177.8	18.3	-31	0	0	0	113.4	A806 I807 A808 W819 V848	P804-A806 VanDerWaalsContact C-N 3.33Å; P804-A806 PolarHBondContact O-N 2.91Å; P804-I807 PolarHBondContact O-N 2.67Å; P804-A808 VanDerWaalsContact O-CB 3.3Å; P804-A808 WeakPolarHBondContact O-CB 3.27Å; P804-A808 PolarHBondContact O-N 2.66Å; P804-W819 HydrophobicContact CG-CH2 4.21Å; P804-W819 HydrophobicContact CG-CZ3 4.08Å; P804-V848 HydrophobicContact CB-CG1 3.99Å; P804-V848 HydrophobicContact CG-CG1 4.35Å
805	E	88.4	Confident	83.6	Confident	25 Å²	25	39.6 Å²	39.6	12%	0.117	20%	0.2	C	C	.	.	H	α-helix	trans	-70.6	-27.6	178.9	72.4	-78.8	-172.3	0	0	113.7	A803 Y809 R810 K811 R879	A803-E805 VanDerWaalsContact C-N 3.29Å; A803-E805 WeakPolarHBondContact CB-OE1 3.34Å; A803-E805 WeakPolarHBondContact CB-OE2 3.33Å; A803-E805 PolarHBondContact O-N 2.63Å; E805-Y809 HydrophobicContact CB-CD2 4.43Å; E805-Y809 CarbonylContact O-C 3.55Å; E805-Y809 WeakPolarHBondContact O-CA 3.49Å; E805-Y809 WeakPolarHBondContact O-CB 3.48Å; E805-Y809 PolarHBondContact O-N 3.23Å; E805-R810 PolarHBondContact O-N 2.77Å; E805-K811 PolarHBondContact O-N 3.4Å; E805-R879 IonicContact OE1-CZ 2.78Å; E805-R879 IonicContact OE1-NH1 3.38Å; E805-R879 PolarHBondContact OE1-NH1 2.8Å; E805-R879 IonicContact OE1-NH2 3.41Å; E805-R879 PolarHBondContact OE1-NH2 3.26Å; E805-R879 IonicContact OE2-CZ 3.59Å; E805-R879 IonicContact OE2-NH1 3.53Å; E805-R879 IonicContact OE2-NH2 2.65Å; E805-R879 PolarHBondContact OE2-NH2 3.26Å
806	A	87.6	Confident	85.3	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-78.9	-35.3	175.4	0	0	0	0	0	111	T802 A803 P804 R810 F812	T802-A806 HydrophobicContact CG2-CB 3.49Å; T802-A806 VanDerWaalsContact CG2-CB 3.49Å; A803-A806 HydrophobicContact CB-CB 4.46Å; A803-A806 PolarHBondContact O-N 3.34Å; P804-A806 VanDerWaalsContact C-N 3.33Å; P804-A806 PolarHBondContact O-N 2.91Å; A806-R810 VanDerWaalsContact O-CA 3.22Å; A806-R810 WeakPolarHBondContact O-CA 3.5Å; A806-R810 PolarHBondContact O-N 3.42Å; A806-R810 VanDerWaalsContact O-N 3.12Å; A806-F812 HydrophobicContact CB-CD1 3.92Å; A806-F812 HydrophobicContact CB-CE1 3.79Å; A806-F812 HydrophobicContact CB-CG 4.48Å; A806-F812 HydrophobicContact CB-CZ 4.23Å
807	I	85.5	Confident	86.8	Confident	35 Å²	35	36 Å²	36	18%	0.179	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-53.1	171.1	-64.1	173.4	0	0	0	110.6	I799 T802 A803 P804 I845	I799-I807 HydrophobicContact CD1-CG1 4.38Å; I799-I807 HydrophobicContact CD1-CG2 4.5Å; I799-I807 HydrophobicContact CG2-CD1 4.43Å; T802-I807 HydrophobicContact CG2-CG1 3.69Å; T802-I807 WeakPolarHBondContact O-CD1 3.34Å; A803-I807 WeakPolarHBondContact O-CG1 3.19Å; A803-I807 PolarHBondContact O-N 3.06Å; P804-I807 PolarHBondContact O-N 2.67Å; I807-I845 HydrophobicContact CG2-CD1 4.46Å; I807-I845 HydrophobicContact CG2-CG1 4.13Å; I807-I845 HydrophobicContact CG2-CG2 4.35Å
808	A	82.3	Confident	88.1	Confident	66 Å²	66	35.6 Å²	35.6	55%	0.545	18%	0.18	S	C	.	.	H	α-helix	trans	-76.1	-42.6	-171.8	0	0	0	0	0	113.3	P804	P804-A808 VanDerWaalsContact O-CB 3.3Å; P804-A808 WeakPolarHBondContact O-CB 3.27Å; P804-A808 PolarHBondContact O-N 2.66Å
809	Y	77.9	Confident	88.6	Confident	165 Å²	165	35.9 Å²	35.9	65%	0.647	18%	0.18	S	C	*	.	H	α-helix	trans	-122.2	2.8	-168.7	-50.2	-67.7	0	0	0	114.1	E805 K811	E805-Y809 HydrophobicContact CB-CD2 4.43Å; E805-Y809 CarbonylContact O-C 3.55Å; E805-Y809 WeakPolarHBondContact O-CA 3.49Å; E805-Y809 WeakPolarHBondContact O-CB 3.48Å; E805-Y809 PolarHBondContact O-N 3.23Å; Y809-K811 PolarHBondContact O-N 2.86Å
810	R	76.5	Confident	89.1	Confident	102 Å²	102	35.9 Å²	35.9	39%	0.385	18%	0.18	S	C	.	.			trans	56.1	30.6	-176.4	-63.4	-112.9	-162.8	102.5	8.1	113.9	T792 G794 E805 A806 F812	T792-R810 PolarHBondContact OG1-NE 2.9Å; T792-R810 PolarHBondContact OG1-NH2 2.79Å; G794-R810 VanDerWaalsContact CA-NH2 3.34Å; E805-R810 PolarHBondContact O-N 2.77Å; A806-R810 VanDerWaalsContact O-CA 3.22Å; A806-R810 WeakPolarHBondContact O-CA 3.5Å; A806-R810 PolarHBondContact O-N 3.42Å; A806-R810 VanDerWaalsContact O-N 3.12Å; R810-F812 WeakPolarHBondContact O-CD2 3.14Å; R810-F812 PolarHBondContact O-N 3.45Å
811	K	76	Confident	89.4	Confident	121 Å²	121	35.7 Å²	35.7	53%	0.526	18%	0.179	S	C	.	.			trans	-93.4	95.5	178.5	-70	-177.1	-179.8	175.8	0	110.3	E805 Y809	E805-K811 PolarHBondContact O-N 3.4Å; Y809-K811 PolarHBondContact O-N 2.86Å
812	F	84.3	Confident	89.6	Confident	55 Å²	55	34.6 Å²	34.6	24%	0.241	18%	0.175	C	C	.	.			trans	-90.4	131.8	175.4	-62	-86.4	0	0	0	111	V754 R756 I797 T802 A806 R810	V754-F812 HydrophobicContact CG1-CB 4.09Å; R756-F812 HydrophobicContact CB-CD1 3.74Å; R756-F812 HydrophobicContact CB-CE1 4.04Å; R756-F812 HydrophobicContact CB-CG 4.33Å; R756-F812 HydrophobicContact CG-CB 3.93Å; R756-F812 HydrophobicContact CG-CD1 3.78Å; R756-F812 HydrophobicContact CG-CE1 4.49Å; R756-F812 HydrophobicContact CG-CG 3.89Å; I797-F812 HydrophobicContact CD1-CZ 4.5Å; T802-F812 HydrophobicContact CG2-CE1 4.42Å; A806-F812 HydrophobicContact CB-CD1 3.92Å; A806-F812 HydrophobicContact CB-CE1 3.79Å; A806-F812 HydrophobicContact CB-CG 4.48Å; A806-F812 HydrophobicContact CB-CZ 4.23Å; R810-F812 WeakPolarHBondContact O-CD2 3.14Å; R810-F812 PolarHBondContact O-N 3.45Å
813	T	87.6	Confident	89.9	Confident	40 Å²	40	34.4 Å²	34.4	25%	0.245	17%	0.174	C	C	.	.			trans	-149.2	169	-179.1	61.9	0	0	0	0	110.2	A815 S816 D817	T813-A815 PolarHBondContact O-N 2.88Å; T813-A815 VanDerWaalsContact O-N 3.08Å; T813-A815 PolarHBondContact OG1-N 3.26Å; T813-S816 PolarHBondContact N-OG 3.19Å; T813-S816 PolarHBondContact O-N 2.81Å; T813-S816 PolarHBondContact O-OG 2.9Å; T813-S816 PolarHBondContact OG1-N 2.78Å; T813-D817 PolarHBondContact O-N 2.88Å; T813-D817 VanDerWaalsContact O-N 3.15Å
814	S	90.8	Very high	90.1	Very high	36 Å²	36	34.4 Å²	34.4	25%	0.252	17%	0.174	S	C	.	.	H	α-helix	trans	-55.7	-28.2	171.6	-46.5	0	0	0	0	112.9	S749 D817 A818	S749-S814 VanDerWaalsContact OG-CB 3.29Å; S749-S814 WeakPolarHBondContact OG-CB 3.38Å; S749-S814 PolarHBondContact OG-OG 2.99Å; S814-D817 PolarHBondContact O-N 2.89Å; S814-A818 PolarHBondContact O-N 2.98Å
815	A	93.3	Very high	90.4	Very high	26 Å²	26	33.3 Å²	33.3	22%	0.215	17%	0.167	C	C	.	.	H	α-helix	trans	-74.5	-26.8	175.4	0	0	0	0	0	113.3	T813 W819 R876 R879	T813-A815 PolarHBondContact O-N 2.88Å; T813-A815 VanDerWaalsContact O-N 3.08Å; T813-A815 PolarHBondContact OG1-N 3.26Å; A815-W819 PolarHBondContact O-N 2.88Å; A815-R876 HydrophobicContact CB-CB 4.08Å; A815-R879 WeakPolarHBondContact O-CD 3.05Å; A815-R879 PolarHBondContact O-NH1 3.26Å
816	S	92.7	Very high	90.8	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-74	-33.8	170.3	64.5	0	0	0	0	111	T813 A818 W819 S820	T813-S816 PolarHBondContact N-OG 3.19Å; T813-S816 PolarHBondContact O-N 2.81Å; T813-S816 PolarHBondContact O-OG 2.9Å; T813-S816 PolarHBondContact OG1-N 2.78Å; S816-A818 VanDerWaalsContact C-N 3.32Å; S816-W819 WeakPolarHBondContact O-CB 3.02Å; S816-W819 PolarHBondContact O-N 3.2Å; S816-S820 PolarHBondContact O-N 3.01Å; S816-S820 PolarHBondContact O-OG 3.28Å
817	D	94.8	Very high	91.3	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.011	16%	0.163	C	C	.	.	H	α-helix	trans	-68.2	-32.1	171.7	-70	-15.3	0	0	0	111.9	M745 V754 H755 R756 T813 S814 W819 S820 Y821 F882	M745-D817 HydrophobicContact CE-CB 3.74Å; V754-D817 WeakPolarHBondContact CA-OD2 3.46Å; V754-D817 WeakPolarHBondContact CG1-OD2 3.33Å; H755-D817 PolarHBondContact N-OD2 2.72Å; R756-D817 PolarHBondContact N-OD1 3.11Å; T813-D817 PolarHBondContact O-N 2.88Å; T813-D817 VanDerWaalsContact O-N 3.15Å; S814-D817 PolarHBondContact O-N 2.89Å; D817-W819 VanDerWaalsContact C-N 3.31Å; D817-W819 PolarHBondContact O-N 2.59Å; D817-S820 WeakPolarHBondContact O-CB 3.45Å; D817-S820 PolarHBondContact O-N 3.33Å; D817-Y821 WeakPolarHBondContact O-CB 3.44Å; D817-Y821 PolarHBondContact O-N 2.81Å; D817-F882 HydrophobicContact CB-CE2 4.04Å; D817-F882 HydrophobicContact CB-CZ 4.1Å
818	A	97.8	Very high	91.8	Very high	2 Å²	2	31 Å²	31	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-63	-36.6	172.9	0	0	0	0	0	112.2	S814 S816 Y821 G822 C871 F882	S814-A818 PolarHBondContact O-N 2.98Å; S816-A818 VanDerWaalsContact C-N 3.32Å; A818-Y821 WeakPolarHBondContact O-CB 3.48Å; A818-Y821 PolarHBondContact O-N 3.01Å; A818-G822 PolarHBondContact O-N 2.79Å; A818-C871 WeakPolarHBondContact O-CB 3.23Å; A818-F882 HydrophobicContact CB-CE2 4.48Å; A818-F882 HydrophobicContact CB-CZ 4.4Å
819	W	97.3	Very high	92.4	Very high	16 Å²	16	28.6 Å²	28.6	6%	0.061	13%	0.132	C	C	.	.	H	α-helix	trans	-62.3	-48.2	170.8	176	-74.1	0	0	0	111.2	T802 A803 P804 A815 S816 D817 Y821 G822 I823 V848 W872	T802-W819 PolarHBondContact O-NE1 2.85Å; A803-W819 HydrophobicContact CB-CB 3.76Å; A803-W819 HydrophobicContact CB-CD2 4.11Å; A803-W819 HydrophobicContact CB-CG 3.7Å; P804-W819 HydrophobicContact CG-CH2 4.21Å; P804-W819 HydrophobicContact CG-CZ3 4.08Å; A815-W819 PolarHBondContact O-N 2.88Å; S816-W819 WeakPolarHBondContact O-CB 3.02Å; S816-W819 PolarHBondContact O-N 3.2Å; D817-W819 VanDerWaalsContact C-N 3.31Å; D817-W819 PolarHBondContact O-N 2.59Å; W819-Y821 VanDerWaalsContact C-N 3.26Å; W819-Y821 PolarHBondContact O-N 2.68Å; W819-G822 WeakPolarHBondContact O-CA 3.22Å; W819-G822 PolarHBondContact O-N 2.85Å; W819-I823 PolarHBondContact O-N 3.05Å; W819-V848 HydrophobicContact CH2-CG1 4.12Å; W819-V848 HydrophobicContact CZ2-CG1 3.81Å; W819-W872 AromaticContact CD2-CD1 3.87Å; W819-W872 AromaticContact CE2-CD1 3.9Å; W819-W872 HydrophobicContact CE3-CB 4.32Å; W819-W872 HydrophobicContact CH2-CB 4.2Å; W819-W872 VanDerWaalsContact CZ3-C 3.48Å; W819-W872 HydrophobicContact CZ3-CB 4.02Å; W819-W872 WeakPolarHBondContact CZ3-O 3.45Å
820	S	96.8	Very high	93.1	Very high	5 Å²	5	21.4 Å²	21.4	4%	0.035	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-37.9	176.7	-55.4	0	0	0	0	111.7	L758 W801 S816 D817 G822 I823 V824	L758-S820 WeakPolarHBondContact O-CB 3.43Å; W801-S820 WeakPolarHBondContact O-CA 3.4Å; W801-S820 WeakPolarHBondContact O-CB 3.29Å; W801-S820 PolarHBondContact O-OG 3.5Å; S816-S820 PolarHBondContact O-N 3.01Å; S816-S820 PolarHBondContact O-OG 3.28Å; D817-S820 WeakPolarHBondContact O-CB 3.45Å; D817-S820 PolarHBondContact O-N 3.33Å; S820-G822 VanDerWaalsContact C-N 3.29Å; S820-G822 PolarHBondContact O-N 3.41Å; S820-I823 WeakPolarHBondContact O-CA 3.19Å; S820-I823 WeakPolarHBondContact O-CB 3.38Å; S820-I823 PolarHBondContact O-N 2.93Å; S820-V824 PolarHBondContact O-N 2.88Å
821	Y	98.3	Very high	94	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.2	-35.2	172.7	-176.6	-97.1	0	0	0	112.4	L738 I741 A742 L758 D817 A818 W819 I823 V824 L825 F882 I885 L889	L738-Y821 PolarHBondContact O-OH 2.92Å; I741-Y821 HydrophobicContact CB-CE2 4.07Å; I741-Y821 HydrophobicContact CG2-CD2 3.99Å; I741-Y821 HydrophobicContact CG2-CE2 3.78Å; A742-Y821 HydrophobicContact CB-CE1 4.5Å; A742-Y821 HydrophobicContact CB-CE2 3.96Å; L758-Y821 HydrophobicContact CD2-CD2 4.26Å; D817-Y821 WeakPolarHBondContact O-CB 3.44Å; D817-Y821 PolarHBondContact O-N 2.81Å; A818-Y821 WeakPolarHBondContact O-CB 3.48Å; A818-Y821 PolarHBondContact O-N 3.01Å; W819-Y821 VanDerWaalsContact C-N 3.26Å; W819-Y821 PolarHBondContact O-N 2.68Å; Y821-I823 VanDerWaalsContact C-N 3.29Å; Y821-I823 PolarHBondContact O-N 2.81Å; Y821-V824 PolarHBondContact O-N 3.04Å; Y821-L825 HydrophobicContact CD1-CD1 3.82Å; Y821-L825 HydrophobicContact CD1-CG 4.06Å; Y821-L825 HydrophobicContact CE1-CD1 3.56Å; Y821-L825 HydrophobicContact CE1-CD2 3.98Å; Y821-L825 HydrophobicContact CE1-CG 3.62Å; Y821-L825 WeakPolarHBondContact O-CG 3.4Å; Y821-L825 PolarHBondContact O-N 2.77Å; Y821-F882 HydrophobicContact CD1-CE1 4.44Å; Y821-F882 HydrophobicContact CD2-CE1 4.12Å; Y821-F882 AromaticContact CG-CE1 3.87Å; Y821-F882 HydrophobicContact CG-CE1 3.87Å; Y821-I885 HydrophobicContact CD1-CD1 3.95Å; Y821-I885 HydrophobicContact CD1-CG2 4.04Å; Y821-I885 HydrophobicContact CE1-CD1 4.35Å; Y821-I885 HydrophobicContact CE1-CG2 3.37Å; Y821-L889 WeakPolarHBondContact OH-CD1 3.32Å
822	G	97.7	Very high	94.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-57.3	-40.1	169.4	0	0	0	0	0	113.1	A818 W819 S820 L825 W826 W872	A818-G822 PolarHBondContact O-N 2.79Å; W819-G822 WeakPolarHBondContact O-CA 3.22Å; W819-G822 PolarHBondContact O-N 2.85Å; S820-G822 VanDerWaalsContact C-N 3.29Å; S820-G822 PolarHBondContact O-N 3.41Å; G822-L825 WeakPolarHBondContact O-CB 3.46Å; G822-L825 PolarHBondContact O-N 2.9Å; G822-W826 PolarHBondContact O-N 3.25Å; G822-W872 WeakPolarHBondContact O-CZ2 3.39Å
823	I	97.4	Very high	95.1	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-70	-39.9	174.7	-55.5	-68.6	0	0	0	110.9	W801 W819 S820 Y821 L825 W826 E827 P835 Y836 L854 W872	W801-I823 HydrophobicContact CG-CG2 4.04Å; W819-I823 PolarHBondContact O-N 3.05Å; S820-I823 WeakPolarHBondContact O-CA 3.19Å; S820-I823 WeakPolarHBondContact O-CB 3.38Å; S820-I823 PolarHBondContact O-N 2.93Å; Y821-I823 VanDerWaalsContact C-N 3.29Å; Y821-I823 PolarHBondContact O-N 2.81Å; I823-L825 VanDerWaalsContact C-N 3.33Å; I823-L825 PolarHBondContact O-N 3.15Å; I823-W826 WeakPolarHBondContact O-CA 3.4Å; I823-W826 WeakPolarHBondContact O-CB 3.48Å; I823-W826 PolarHBondContact O-N 3Å; I823-W826 VanDerWaalsContact O-N 3.08Å; I823-E827 HydrophobicContact CG2-CG 4.44Å; I823-E827 WeakPolarHBondContact O-CG 3.13Å; I823-E827 PolarHBondContact O-N 2.65Å; I823-P835 HydrophobicContact CG2-CB 3.87Å; I823-P835 HydrophobicContact CG2-CG 3.58Å; I823-Y836 HydrophobicContact CD1-CE2 4.39Å; I823-L854 HydrophobicContact CD1-CD1 3.83Å; I823-W872 HydrophobicContact CD1-CZ2 3.78Å
824	V	97.9	Very high	95.2	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.4	-39	174.4	175.1	0	0	0	0	111.9	I741 L758 S820 Y821 W826 E827 V828	I741-V824 HydrophobicContact CD1-CG1 3.99Å; L758-V824 HydrophobicContact CG-CG2 4.19Å; S820-V824 PolarHBondContact O-N 2.88Å; Y821-V824 PolarHBondContact O-N 3.04Å; V824-W826 VanDerWaalsContact C-N 3.26Å; V824-W826 PolarHBondContact O-N 2.98Å; V824-E827 PolarHBondContact O-N 3.39Å; V824-V828 HydrophobicContact CG1-CG2 4.27Å; V824-V828 VanDerWaalsContact O-CG2 3.31Å; V824-V828 WeakPolarHBondContact O-CG2 3.23Å; V824-V828 PolarHBondContact O-N 3.18Å
825	L	97.7	Very high	95.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-54.9	-46.2	171.6	-78.5	165.8	0	0	0	110.7	L738 Y821 G822 I823 M829 L867 M868	L738-L825 HydrophobicContact CB-CD2 4.31Å; L738-L825 HydrophobicContact CD1-CD2 3.6Å; L738-L825 HydrophobicContact CD2-CD2 3.64Å; L738-L825 HydrophobicContact CD2-CG 4.23Å; L738-L825 HydrophobicContact CG-CD2 4.03Å; Y821-L825 HydrophobicContact CD1-CD1 3.82Å; Y821-L825 HydrophobicContact CD1-CG 4.06Å; Y821-L825 HydrophobicContact CE1-CD1 3.56Å; Y821-L825 HydrophobicContact CE1-CD2 3.98Å; Y821-L825 HydrophobicContact CE1-CG 3.62Å; Y821-L825 WeakPolarHBondContact O-CG 3.4Å; Y821-L825 PolarHBondContact O-N 2.77Å; G822-L825 WeakPolarHBondContact O-CB 3.46Å; G822-L825 PolarHBondContact O-N 2.9Å; I823-L825 VanDerWaalsContact C-N 3.33Å; I823-L825 PolarHBondContact O-N 3.15Å; L825-M829 WeakPolarHBondContact O-CB 3.4Å; L825-M829 VanDerWaalsContact O-CG 3.27Å; L825-M829 WeakPolarHBondContact O-CG 3.34Å; L825-M829 PolarHBondContact O-N 3.41Å; L825-M829 VanDerWaalsContact O-N 3.16Å; L825-L867 HydrophobicContact CD1-CD2 3.97Å; L825-L867 HydrophobicContact CD1-CG 3.87Å; L825-L867 HydrophobicContact CD2-CD2 4.41Å; L825-M868 HydrophobicContact CB-CE 4Å; L825-M868 HydrophobicContact CB-CG 3.68Å; L825-M868 HydrophobicContact CB-SD 4.41Å; L825-M868 HydrophobicContact CD1-CG 4.14Å; L825-M868 WeakPolarHBondContact O-CE 3.5Å
826	W	97.1	Very high	95.1	Very high	3 Å²	3	13.1 Å²	13.1	1%	0.011	6%	0.06	C	C	.	.	H	α-helix	trans	-64	-49.3	177.1	-172.2	93.2	0	0	0	111.8	G822 I823 V824 V828 M829 S830 E833 P835 W837 L854 P855 P857 M868 W872	G822-W826 PolarHBondContact O-N 3.25Å; I823-W826 WeakPolarHBondContact O-CA 3.4Å; I823-W826 WeakPolarHBondContact O-CB 3.48Å; I823-W826 PolarHBondContact O-N 3Å; I823-W826 VanDerWaalsContact O-N 3.08Å; V824-W826 VanDerWaalsContact C-N 3.26Å; V824-W826 PolarHBondContact O-N 2.98Å; W826-V828 VanDerWaalsContact C-N 3.31Å; W826-V828 PolarHBondContact O-N 2.85Å; W826-M829 PolarHBondContact O-N 3.3Å; W826-M829 VanDerWaalsContact O-N 3.15Å; W826-S830 WeakPolarHBondContact CZ3-OG 3.44Å; W826-S830 WeakPolarHBondContact O-CB 3.34Å; W826-S830 PolarHBondContact O-N 2.74Å; W826-S830 PolarHBondContact O-OG 3.2Å; W826-E833 HydrophobicContact CH2-CB 3.71Å; W826-E833 HydrophobicContact CZ3-CB 3.85Å; W826-P835 HydrophobicContact CE3-CG 4.38Å; W826-P835 HydrophobicContact CZ3-CG 4.36Å; W826-W837 HydrophobicContact CZ2-CZ2 4.32Å; W826-L854 HydrophobicContact CD2-CD1 3.91Å; W826-L854 HydrophobicContact CE3-CD1 4.28Å; W826-L854 HydrophobicContact CG-CB 4.39Å; W826-L854 HydrophobicContact CG-CD1 4Å; W826-P855 PolarHBondContact NE1-O 3.25Å; W826-P857 HydrophobicContact CD2-CG 4.48Å; W826-P857 HydrophobicContact CG-CG 4.19Å; W826-M868 HydrophobicContact CB-SD 4.04Å; W826-W872 HydrophobicContact CB-CH2 4.13Å; W826-W872 HydrophobicContact CB-CZ2 4.16Å; W826-W872 HydrophobicContact CG-CH2 4.39Å
827	E	97	Very high	95.1	Very high	9 Å²	9	17.9 Å²	17.9	4%	0.042	8%	0.077	C	C	.	.	H	α-helix	trans	-55.9	-42.2	178	-70.9	178.8	119.7	0	0	112.3	A760 W801 I823 V824 S830 Y831 G832 P835	A760-E827 HydrophobicContact CB-CB 4.06Å; A760-E827 HydrophobicContact CB-CG 4.49Å; A760-E827 WeakPolarHBondContact CB-OE2 3.48Å; A760-E827 PolarHBondContact N-OE2 3.28Å; W801-E827 WeakPolarHBondContact CZ2-OE1 3.46Å; W801-E827 PolarHBondContact NE1-OE1 2.98Å; W801-E827 PolarHBondContact NE1-OE2 3.26Å; I823-E827 HydrophobicContact CG2-CG 4.44Å; I823-E827 WeakPolarHBondContact O-CG 3.13Å; I823-E827 PolarHBondContact O-N 2.65Å; V824-E827 PolarHBondContact O-N 3.39Å; E827-S830 PolarHBondContact O-OG 2.76Å; E827-Y831 PolarHBondContact O-N 3.35Å; E827-G832 WeakPolarHBondContact O-CA 3.31Å; E827-G832 PolarHBondContact O-N 2.97Å; E827-P835 HydrophobicContact CG-CG 3.82Å
828	V	96.4	Very high	94.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.5	-40.7	179.1	174.7	0	0	0	0	111.5	L718 L722 L734 L738 V824 W826 S830 Y831	L718-V828 HydrophobicContact CD2-CG2 3.85Å; L722-V828 HydrophobicContact CD1-CB 4.32Å; L722-V828 HydrophobicContact CD1-CG1 4.49Å; L722-V828 HydrophobicContact CD1-CG2 4.09Å; L734-V828 HydrophobicContact CB-CG1 4.12Å; L734-V828 HydrophobicContact CD2-CG1 3.93Å; L738-V828 HydrophobicContact CD1-CB 4.5Å; L738-V828 HydrophobicContact CD1-CG1 4.21Å; L738-V828 HydrophobicContact CD2-CB 3.82Å; L738-V828 HydrophobicContact CD2-CG1 4.13Å; L738-V828 HydrophobicContact CD2-CG2 3.7Å; L738-V828 HydrophobicContact CG-CB 4.22Å; L738-V828 HydrophobicContact CG-CG1 3.98Å; L738-V828 HydrophobicContact CG-CG2 4.39Å; V824-V828 HydrophobicContact CG1-CG2 4.27Å; V824-V828 VanDerWaalsContact O-CG2 3.31Å; V824-V828 WeakPolarHBondContact O-CG2 3.23Å; V824-V828 PolarHBondContact O-N 3.18Å; W826-V828 VanDerWaalsContact C-N 3.31Å; W826-V828 PolarHBondContact O-N 2.85Å; V828-S830 VanDerWaalsContact C-N 3.33Å; V828-Y831 PolarHBondContact O-N 3.22Å
829	M	94.6	Very high	94	Very high	15 Å²	15	27.9 Å²	27.9	7%	0.074	12%	0.124	C	C	.	.	H	α-helix	trans	-75.9	-21.5	-179.6	-67.1	-54.6	-51.1	0	0	113.1	L734 L738 L825 W826 P857 L864 M868	L734-M829 HydrophobicContact CB-SD 4.42Å; L734-M829 HydrophobicContact CD1-CE 4.39Å; L734-M829 HydrophobicContact CD1-SD 4.2Å; L738-M829 HydrophobicContact CD1-SD 4.48Å; L825-M829 WeakPolarHBondContact O-CB 3.4Å; L825-M829 VanDerWaalsContact O-CG 3.27Å; L825-M829 WeakPolarHBondContact O-CG 3.34Å; L825-M829 PolarHBondContact O-N 3.41Å; L825-M829 VanDerWaalsContact O-N 3.16Å; W826-M829 PolarHBondContact O-N 3.3Å; W826-M829 VanDerWaalsContact O-N 3.15Å; M829-P857 HydrophobicContact CB-CB 4.28Å; M829-P857 HydrophobicContact CB-CG 3.95Å; M829-L864 HydrophobicContact CE-CD1 4.26Å; M829-L864 HydrophobicContact CG-CD1 4.48Å; M829-L864 HydrophobicContact SD-CD1 3.72Å; M829-M868 HydrophobicContact CB-CE 4.1Å; M829-M868 HydrophobicContact CG-CE 3.76Å
830	S	93.8	Very high	93.4	Very high	14 Å²	14	29.3 Å²	29.3	10%	0.098	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	15.7	172.3	63.9	0	0	0	0	113.2	W826 E827 V828 G832 E833	W826-S830 WeakPolarHBondContact CZ3-OG 3.44Å; W826-S830 WeakPolarHBondContact O-CB 3.34Å; W826-S830 PolarHBondContact O-N 2.74Å; W826-S830 PolarHBondContact O-OG 3.2Å; E827-S830 PolarHBondContact O-OG 2.76Å; V828-S830 VanDerWaalsContact C-N 3.33Å; S830-G832 PolarHBondContact O-N 3.45Å; S830-G832 VanDerWaalsContact O-N 3.12Å; S830-E833 WeakPolarHBondContact O-CG 3.33Å; S830-E833 PolarHBondContact O-N 3.49Å
831	Y	94.3	Very high	92.9	Very high	33 Å²	33	29.8 Å²	29.8	13%	0.129	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	34.4	179.8	-74.8	-98.9	0	0	0	114.9	L722 R723 N725 D726 A727 F729 L734 E827 V828	L722-Y831 CarbonylContact C-O 3.58Å; L722-Y831 HydrophobicContact CD2-CD1 4.36Å; R723-Y831 VanDerWaalsContact CG-O 3.27Å; R723-Y831 WeakPolarHBondContact CG-O 3.43Å; R723-Y831 PolarHBondContact N-O 2.86Å; N725-Y831 WeakPolarHBondContact O-CE1 3.26Å; D726-Y831 VanDerWaalsContact OD1-CB 3.29Å; D726-Y831 WeakPolarHBondContact OD1-CB 3.46Å; A727-Y831 VanDerWaalsContact CA-CZ 3.48Å; A727-Y831 VanDerWaalsContact N-CD1 3.34Å; F729-Y831 HydrophobicContact CB-CE1 4.49Å; F729-Y831 AromaticContact CD2-CE1 3.88Å; F729-Y831 HydrophobicContact CD2-CE1 3.88Å; F729-Y831 PolarHBondContact O-OH 3.46Å; L734-Y831 HydrophobicContact CD1-CE2 4.08Å; E827-Y831 PolarHBondContact O-N 3.35Å; V828-Y831 PolarHBondContact O-N 3.22Å
832	G	91.5	Very high	92.3	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.021	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	24.8	174.2	0	0	0	0	0	114.6	R723 E827 S830	R723-G832 PolarHBondContact NH1-O 2.89Å; E827-G832 WeakPolarHBondContact O-CA 3.31Å; E827-G832 PolarHBondContact O-N 2.97Å; S830-G832 PolarHBondContact O-N 3.45Å; S830-G832 VanDerWaalsContact O-N 3.12Å
833	E	91.9	Very high	91.8	Very high	96 Å²	96	38.6 Å²	38.6	45%	0.449	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-58	154.6	165.7	-77	-169.9	-170.3	0	0	112.1	W826 S830 P835 W837	W826-E833 HydrophobicContact CH2-CB 3.71Å; W826-E833 HydrophobicContact CZ3-CB 3.85Å; S830-E833 WeakPolarHBondContact O-CG 3.33Å; S830-E833 PolarHBondContact O-N 3.49Å; E833-P835 WeakPolarHBondContact O-CD 3.39Å; E833-W837 PolarHBondContact OE2-NE1 3.05Å
834	R	89.5	Confident	91.3	Very high	73 Å²	73	38.6 Å²	38.6	28%	0.275	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-75.4	122.1	178	-178.5	170.1	167.3	128.6	-18.9	110.3	D785 E787 Y836 W837	D785-R834 IonicContact OD2-NH1 2.64Å; D785-R834 PolarHBondContact OD2-NH1 3.16Å; E787-R834 IonicContact OE2-NH2 3.82Å; E787-R834 PolarHBondContact OE2-NH2 3.04Å; R834-Y836 PolarHBondContact O-N 2.78Å; R834-W837 PolarHBondContact NE-O 2.96Å; R834-W837 WeakPolarHBondContact O-CA 3.37Å; R834-W837 PolarHBondContact O-N 3.23Å
835	P	93.1	Very high	90.8	Very high	1 Å²	1	41 Å²	41	1%	0.006	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	133	177.6	-25.1	34.7	0	0	0	112.2	R800 W801 I823 W826 E827 E833 W837 L854	R800-P835 HydrophobicContact CB-CB 4.31Å; R800-P835 WeakPolarHBondContact CD-O 3.4Å; R800-P835 PolarHBondContact NH1-O 3.35Å; W801-P835 HydrophobicContact CZ2-CG 3.98Å; I823-P835 HydrophobicContact CG2-CB 3.87Å; I823-P835 HydrophobicContact CG2-CG 3.58Å; W826-P835 HydrophobicContact CE3-CG 4.38Å; W826-P835 HydrophobicContact CZ3-CG 4.36Å; E827-P835 HydrophobicContact CG-CG 3.82Å; E833-P835 WeakPolarHBondContact O-CD 3.39Å; P835-W837 PolarHBondContact O-N 3.13Å; P835-L854 HydrophobicContact CB-CD1 4.16Å
836	Y	90.6	Very high	90.3	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.008	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	16.7	-173.1	-54.7	-89.8	0	0	0	114.5	R800 I823 R834 E838 M839 V844 V848 Y852 L854	R800-Y836 HydrophobicContact CB-CD2 4.36Å; I823-Y836 HydrophobicContact CD1-CE2 4.39Å; R834-Y836 PolarHBondContact O-N 2.78Å; Y836-E838 PolarHBondContact O-N 3.24Å; Y836-M839 HydrophobicContact CD1-SD 4.15Å; Y836-M839 VanDerWaalsContact O-CB 3.31Å; Y836-M839 WeakPolarHBondContact O-CB 3.31Å; Y836-M839 VanDerWaalsContact O-CG 3.31Å; Y836-M839 WeakPolarHBondContact O-CG 3.48Å; Y836-M839 PolarHBondContact O-N 3.25Å; Y836-M839 VanDerWaalsContact O-N 3.07Å; Y836-V844 HydrophobicContact CD1-CG1 4.45Å; Y836-V844 HydrophobicContact CD1-CG2 4.47Å; Y836-V844 HydrophobicContact CD2-CG1 3.78Å; Y836-V844 HydrophobicContact CD2-CG2 4.28Å; Y836-V844 HydrophobicContact CE2-CG1 3.95Å; Y836-V844 HydrophobicContact CG-CG1 4.06Å; Y836-V844 HydrophobicContact CG-CG2 3.91Å; Y836-V848 HydrophobicContact CE1-CG2 4.48Å; Y836-V848 WeakPolarHBondContact OH-CG2 3.06Å; Y836-Y852 HydrophobicContact CE1-CD1 4.29Å; Y836-L854 HydrophobicContact CD1-CD2 3.71Å; Y836-L854 HydrophobicContact CD1-CG 4.36Å; Y836-L854 HydrophobicContact CD2-CD1 4.44Å; Y836-L854 HydrophobicContact CD2-CD2 4.14Å; Y836-L854 HydrophobicContact CD2-CG 4.49Å; Y836-L854 HydrophobicContact CE1-CD2 3.92Å; Y836-L854 HydrophobicContact CE1-CG 4.08Å; Y836-L854 HydrophobicContact CE2-CD1 4.17Å; Y836-L854 HydrophobicContact CE2-CD2 4.33Å; Y836-L854 HydrophobicContact CE2-CG 4.21Å; Y836-L854 HydrophobicContact CG-CD2 3.82Å
837	W	91.3	Very high	89.9	Confident	103 Å²	103	46.8 Å²	46.8	39%	0.39	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.1	-126.9	175.8	-50	-73.8	0	0	0	112.8	R800 W826 E833 R834 P835 M839 P855	R800-W837 PolarHBondContact NH1-O 3.38Å; W826-W837 HydrophobicContact CZ2-CZ2 4.32Å; E833-W837 PolarHBondContact OE2-NE1 3.05Å; R834-W837 PolarHBondContact NE-O 2.96Å; R834-W837 WeakPolarHBondContact O-CA 3.37Å; R834-W837 PolarHBondContact O-N 3.23Å; P835-W837 PolarHBondContact O-N 3.13Å; W837-M839 VanDerWaalsContact C-N 3.32Å; W837-M839 PolarHBondContact O-N 3.1Å; W837-P855 HydrophobicContact CH2-CG 3.51Å; W837-P855 HydrophobicContact CZ2-CG 4.25Å; W837-P855 HydrophobicContact CZ3-CG 4.41Å
838	E	86	Confident	89.5	Confident	153 Å²	153	46.7 Å²	46.7	72%	0.715	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	8.5	-176.6	-54.2	-49.1	131.9	0	0	114.1	Y836 S840	Y836-E838 PolarHBondContact O-N 3.24Å; E838-S840 PolarHBondContact O-N 3.07Å
839	M	84.7	Confident	89	Confident	60 Å²	60	51.6 Å²	51.6	30%	0.296	25%	0.249	S	C	.	.			trans	-61.6	137.7	174.4	-68.3	-179.2	65.6	0	0	110.7	R800 Y836 W837 D843 V844 A847	R800-M839 PolarHBondContact NH1-O 3.46Å; R800-M839 PolarHBondContact NH2-O 3.28Å; Y836-M839 HydrophobicContact CD1-SD 4.15Å; Y836-M839 VanDerWaalsContact O-CB 3.31Å; Y836-M839 WeakPolarHBondContact O-CB 3.31Å; Y836-M839 VanDerWaalsContact O-CG 3.31Å; Y836-M839 WeakPolarHBondContact O-CG 3.48Å; Y836-M839 PolarHBondContact O-N 3.25Å; Y836-M839 VanDerWaalsContact O-N 3.07Å; W837-M839 VanDerWaalsContact C-N 3.32Å; W837-M839 PolarHBondContact O-N 3.1Å; M839-D843 HydrophobicContact CE-CB 3.88Å; M839-V844 HydrophobicContact CB-CG2 3.81Å; M839-A847 HydrophobicContact CE-CB 3.89Å
840	S	85	Confident	88.6	Confident	46 Å²	46	59.4 Å²	59.4	32%	0.322	28%	0.282	S	S	.	.			trans	-65.4	154.3	173.9	81.4	0	0	0	0	111.1	E838 Q842 D843 V844	E838-S840 PolarHBondContact O-N 3.07Å; S840-Q842 PolarHBondContact O-N 2.93Å; S840-Q842 VanDerWaalsContact O-N 3.11Å; S840-Q842 PolarHBondContact OG-N 3.44Å; S840-D843 PolarHBondContact O-N 3.03Å; S840-D843 PolarHBondContact OG-N 2.95Å; S840-D843 PolarHBondContact OG-OD2 3.35Å; S840-V844 WeakPolarHBondContact O-CG2 3.33Å; S840-V844 PolarHBondContact O-N 3.19Å
841	N	84.8	Confident	88.2	Confident	16 Å²	16	61.1 Å²	61.1	9%	0.086	30%	0.302	C	S	.	.	H	α-helix	trans	-55	-32.7	175.5	-79.8	-23.9	0	0	0	112.9	E787 A789 I799 I845	E787-N841 PolarHBondContact O-ND2 2.9Å; E787-N841 PolarHBondContact O-OD1 2.92Å; E787-N841 VanDerWaalsContact O-OD1 3.11Å; A789-N841 PolarHBondContact N-ND2 3.16Å; I799-N841 HydrophobicContact CB-CB 4.42Å; I799-N841 HydrophobicContact CG1-CB 4.35Å; I799-N841 HydrophobicContact CG2-CB 4.37Å; N841-I845 WeakPolarHBondContact O-CD1 3.38Å; N841-I845 WeakPolarHBondContact O-CG1 3.49Å; N841-I845 PolarHBondContact O-N 2.89Å
842	Q	85.4	Confident	87.8	Confident	118 Å²	118	64.3 Å²	64.3	55%	0.551	32%	0.315	S	S	*	.	H	α-helix	trans	-68.9	-38.1	176.8	-65.7	-174.3	8.3	0	0	111.9	S840 I845 K846	S840-Q842 PolarHBondContact O-N 2.93Å; S840-Q842 VanDerWaalsContact O-N 3.11Å; S840-Q842 PolarHBondContact OG-N 3.44Å; Q842-I845 PolarHBondContact O-N 3.46Å; Q842-K846 WeakPolarHBondContact O-CG 3.35Å; Q842-K846 PolarHBondContact O-N 3.03Å; Q842-K846 VanDerWaalsContact O-N 3.13Å
843	D	87.6	Confident	87.5	Confident	67 Å²	67	66.7 Å²	66.7	36%	0.358	33%	0.33	S	S	.	.	H	α-helix	trans	-74.4	-34.9	178.5	-59.6	-41.7	0	0	0	111.4	M839 S840 K846 A847	M839-D843 HydrophobicContact CE-CB 3.88Å; S840-D843 PolarHBondContact O-N 3.03Å; S840-D843 PolarHBondContact OG-N 2.95Å; S840-D843 PolarHBondContact OG-OD2 3.35Å; D843-K846 PolarHBondContact O-N 2.96Å; D843-K846 IonicContact OD1-NZ 2.77Å; D843-A847 VanDerWaalsContact O-CB 3.31Å; D843-A847 WeakPolarHBondContact O-CB 3.32Å; D843-A847 PolarHBondContact O-N 3.36Å
844	V	87.2	Confident	87.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-45.9	170.3	176.9	0	0	0	0	110.8	I799 R800 Y836 M839 S840 K846 A847 V848	I799-V844 HydrophobicContact CG2-CB 4.29Å; I799-V844 HydrophobicContact CG2-CG1 4.05Å; R800-V844 HydrophobicContact CG-CG1 4.44Å; R800-V844 HydrophobicContact CG-CG2 4.46Å; Y836-V844 HydrophobicContact CD1-CG1 4.45Å; Y836-V844 HydrophobicContact CD1-CG2 4.47Å; Y836-V844 HydrophobicContact CD2-CG1 3.78Å; Y836-V844 HydrophobicContact CD2-CG2 4.28Å; Y836-V844 HydrophobicContact CE2-CG1 3.95Å; Y836-V844 HydrophobicContact CG-CG1 4.06Å; Y836-V844 HydrophobicContact CG-CG2 3.91Å; M839-V844 HydrophobicContact CB-CG2 3.81Å; S840-V844 WeakPolarHBondContact O-CG2 3.33Å; S840-V844 PolarHBondContact O-N 3.19Å; V844-K846 VanDerWaalsContact C-N 3.32Å; V844-K846 PolarHBondContact O-N 3.01Å; V844-A847 PolarHBondContact O-N 3.39Å; V844-V848 HydrophobicContact CG1-CG2 4.19Å; V844-V848 WeakPolarHBondContact O-CB 3.4Å; V844-V848 VanDerWaalsContact O-CG2 3.31Å; V844-V848 WeakPolarHBondContact O-CG2 3.47Å; V844-V848 PolarHBondContact O-N 3.36Å
845	I	87.3	Confident	87.5	Confident	50 Å²	50	60.7 Å²	60.7	26%	0.256	31%	0.309	S	S	.	.	H	α-helix	trans	-57.4	-46.1	176	-69.4	163.4	0	0	0	110.8	I799 I807 N841 Q842 D849	I799-I845 HydrophobicContact CD1-CD1 4.12Å; I799-I845 HydrophobicContact CD1-CG1 4.4Å; I799-I845 HydrophobicContact CG1-CD1 4.45Å; I799-I845 HydrophobicContact CG2-CD1 4.22Å; I799-I845 HydrophobicContact CG2-CG1 3.66Å; I807-I845 HydrophobicContact CG2-CD1 4.46Å; I807-I845 HydrophobicContact CG2-CG1 4.13Å; I807-I845 HydrophobicContact CG2-CG2 4.35Å; N841-I845 WeakPolarHBondContact O-CD1 3.38Å; N841-I845 WeakPolarHBondContact O-CG1 3.49Å; N841-I845 PolarHBondContact O-N 2.89Å; Q842-I845 PolarHBondContact O-N 3.46Å; I845-D849 WeakPolarHBondContact O-CB 3.43Å; I845-D849 PolarHBondContact O-N 3.32Å
846	K	87.8	Confident	87.3	Confident	111 Å²	111	62.6 Å²	62.6	48%	0.483	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-40.4	177.9	-69.2	170.6	-169.1	161.8	0	112.2	Q842 D843 V844 K850	Q842-K846 WeakPolarHBondContact O-CG 3.35Å; Q842-K846 PolarHBondContact O-N 3.03Å; Q842-K846 VanDerWaalsContact O-N 3.13Å; D843-K846 PolarHBondContact O-N 2.96Å; D843-K846 IonicContact OD1-NZ 2.77Å; V844-K846 VanDerWaalsContact C-N 3.32Å; V844-K846 PolarHBondContact O-N 3.01Å; K846-K850 WeakPolarHBondContact O-CB 3Å; K846-K850 VanDerWaalsContact O-CG 3.24Å; K846-K850 WeakPolarHBondContact O-CG 3.44Å; K846-K850 PolarHBondContact O-N 3.24Å; K846-K850 VanDerWaalsContact O-N 3.07Å
847	A	87.5	Confident	87.2	Confident	13 Å²	13	63.2 Å²	63.2	11%	0.107	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-47.8	179.7	0	0	0	0	0	111.1	M839 D843 V844 D849 K850 G851 Y852	M839-A847 HydrophobicContact CE-CB 3.89Å; D843-A847 VanDerWaalsContact O-CB 3.31Å; D843-A847 WeakPolarHBondContact O-CB 3.32Å; D843-A847 PolarHBondContact O-N 3.36Å; V844-A847 PolarHBondContact O-N 3.39Å; A847-D849 PolarHBondContact O-N 3.16Å; A847-K850 CarbonylContact O-C 3.53Å; A847-K850 PolarHBondContact O-N 2.86Å; A847-G851 PolarHBondContact O-N 3Å; A847-G851 VanDerWaalsContact O-N 3.13Å; A847-Y852 HydrophobicContact CB-CD1 4.2Å; A847-Y852 HydrophobicContact CB-CG 4.45Å; A847-Y852 WeakPolarHBondContact O-CB 3.42Å; A847-Y852 PolarHBondContact O-N 3.08Å
848	V	88.9	Confident	86.7	Confident	8 Å²	8	66 Å²	66	5%	0.048	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-43.5	176.8	171.5	0	0	0	0	111.2	P804 W819 Y836 V844 K850 G851	P804-V848 HydrophobicContact CB-CG1 3.99Å; P804-V848 HydrophobicContact CG-CG1 4.35Å; W819-V848 HydrophobicContact CH2-CG1 4.12Å; W819-V848 HydrophobicContact CZ2-CG1 3.81Å; Y836-V848 HydrophobicContact CE1-CG2 4.48Å; Y836-V848 WeakPolarHBondContact OH-CG2 3.06Å; V844-V848 HydrophobicContact CG1-CG2 4.19Å; V844-V848 WeakPolarHBondContact O-CB 3.4Å; V844-V848 VanDerWaalsContact O-CG2 3.31Å; V844-V848 WeakPolarHBondContact O-CG2 3.47Å; V844-V848 PolarHBondContact O-N 3.36Å; V848-K850 VanDerWaalsContact C-N 3.33Å; V848-K850 PolarHBondContact O-N 2.87Å; V848-G851 PolarHBondContact O-N 3.08Å
849	D	86.4	Confident	86.4	Confident	103 Å²	103	64.9 Å²	64.9	55%	0.551	34%	0.344	S	S	*	.	H	α-helix	trans	-63.6	-38.9	178.5	-174.2	49.6	0	0	0	112.6	I845 A847 G851 K874	I845-D849 WeakPolarHBondContact O-CB 3.43Å; I845-D849 PolarHBondContact O-N 3.32Å; A847-D849 PolarHBondContact O-N 3.16Å; D849-G851 PolarHBondContact O-N 2.75Å; D849-K874 PolarHBondContact O-NZ 2.81Å
850	K	86.3	Confident	86.6	Confident	178 Å²	178	62 Å²	62	77%	0.774	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-4.4	172.6	-71.8	178.5	179.7	-175.3	0	113.9	K846 A847 V848	K846-K850 WeakPolarHBondContact O-CB 3Å; K846-K850 VanDerWaalsContact O-CG 3.24Å; K846-K850 WeakPolarHBondContact O-CG 3.44Å; K846-K850 PolarHBondContact O-N 3.24Å; K846-K850 VanDerWaalsContact O-N 3.07Å; A847-K850 CarbonylContact O-C 3.53Å; A847-K850 PolarHBondContact O-N 2.86Å; V848-K850 VanDerWaalsContact C-N 3.33Å; V848-K850 PolarHBondContact O-N 2.87Å
851	G	85.4	Confident	86.8	Confident	51 Å²	51	60.1 Å²	60.1	53%	0.526	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	30.2	178.4	0	0	0	0	0	113.9	A847 V848 D849 P853	A847-G851 PolarHBondContact O-N 3Å; A847-G851 VanDerWaalsContact O-N 3.13Å; V848-G851 PolarHBondContact O-N 3.08Å; D849-G851 PolarHBondContact O-N 2.75Å; G851-P853 WeakPolarHBondContact O-CD 3.04Å
852	Y	86.5	Confident	86.9	Confident	99 Å²	99	61.1 Å²	61.1	39%	0.388	33%	0.327	S	S	.	.			trans	-80.1	111	173.5	179.1	-94.7	0	0	0	110.5	Y836 A847	Y836-Y852 HydrophobicContact CE1-CD1 4.29Å; A847-Y852 HydrophobicContact CB-CD1 4.2Å; A847-Y852 HydrophobicContact CB-CG 4.45Å; A847-Y852 WeakPolarHBondContact O-CB 3.42Å; A847-Y852 PolarHBondContact O-N 3.08Å
853	P	85.2	Confident	87.1	Confident	52 Å²	52	58.2 Å²	58.2	34%	0.338	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-82.2	160.6	174	35.2	-34.6	0	0	0	111.5	G851 L869 W872	G851-P853 WeakPolarHBondContact O-CD 3.04Å; P853-L869 HydrophobicContact CB-CD2 4.07Å; P853-L869 HydrophobicContact CG-CD2 4.28Å; P853-W872 HydrophobicContact CB-CE3 3.95Å; P853-W872 HydrophobicContact CB-CZ3 4.37Å
854	L	90.6	Very high	87.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-67.8	141.4	169.6	-72.1	166.6	0	0	0	110.5	I823 W826 P835 Y836 Y865 W872	I823-L854 HydrophobicContact CD1-CD1 3.83Å; W826-L854 HydrophobicContact CD2-CD1 3.91Å; W826-L854 HydrophobicContact CE3-CD1 4.28Å; W826-L854 HydrophobicContact CG-CB 4.39Å; W826-L854 HydrophobicContact CG-CD1 4Å; P835-L854 HydrophobicContact CB-CD1 4.16Å; Y836-L854 HydrophobicContact CD1-CD2 3.71Å; Y836-L854 HydrophobicContact CD1-CG 4.36Å; Y836-L854 HydrophobicContact CD2-CD1 4.44Å; Y836-L854 HydrophobicContact CD2-CD2 4.14Å; Y836-L854 HydrophobicContact CD2-CG 4.49Å; Y836-L854 HydrophobicContact CE1-CD2 3.92Å; Y836-L854 HydrophobicContact CE1-CG 4.08Å; Y836-L854 HydrophobicContact CE2-CD1 4.17Å; Y836-L854 HydrophobicContact CE2-CD2 4.33Å; Y836-L854 HydrophobicContact CE2-CG 4.21Å; Y836-L854 HydrophobicContact CG-CD2 3.82Å; L854-Y865 WeakPolarHBondContact O-CE2 3.25Å; L854-Y865 PolarHBondContact O-OH 2.96Å; L854-W872 HydrophobicContact CB-CH2 3.86Å; L854-W872 HydrophobicContact CB-CZ3 4.21Å; L854-W872 HydrophobicContact CD1-CH2 4.42Å; L854-W872 HydrophobicContact CD1-CZ2 4.36Å
855	P	90.2	Very high	87.7	Confident	44 Å²	44	56.8 Å²	56.8	29%	0.286	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-69.5	158.8	175.5	27.8	-31.2	0	0	0	111.6	W826 W837	W826-P855 PolarHBondContact NE1-O 3.25Å; W837-P855 HydrophobicContact CH2-CG 3.51Å; W837-P855 HydrophobicContact CZ2-CG 4.25Å; W837-P855 HydrophobicContact CZ3-CG 4.41Å
856	P	88.1	Confident	88.1	Confident	41 Å²	41	59.1 Å²	59.1	27%	0.266	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-62.7	134.9	178.2	25.9	-32	0	0	0	110.4	Y865 A903	P856-Y865 VanDerWaalsContact CA-CE2 3.49Å; P856-Y865 HydrophobicContact CB-CD1 4.02Å; P856-Y865 HydrophobicContact CB-CD2 3.65Å; P856-Y865 HydrophobicContact CB-CE1 4.16Å; P856-Y865 HydrophobicContact CB-CE2 3.82Å; P856-Y865 HydrophobicContact CB-CG 3.77Å; P856-Y865 VanDerWaalsContact CD-CZ 3.5Å; P856-Y865 HydrophobicContact CG-CD1 4.43Å; P856-Y865 HydrophobicContact CG-CE1 4.2Å; P856-Y865 HydrophobicContact CG-CE2 4.42Å; P856-A903 HydrophobicContact CB-CB 4.16Å; P856-A903 HydrophobicContact CG-CB 4.39Å
857	P	89.3	Confident	88.4	Confident	14 Å²	14	54 Å²	54	9%	0.091	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-59.5	158.6	169.7	-24.6	35.4	0	0	0	112.2	W826 M829 D859 C860	W826-P857 HydrophobicContact CD2-CG 4.48Å; W826-P857 HydrophobicContact CG-CG 4.19Å; M829-P857 HydrophobicContact CB-CB 4.28Å; M829-P857 HydrophobicContact CB-CG 3.95Å; P857-D859 PolarHBondContact O-N 3.04Å; P857-C860 HydrophobicContact CB-CB 4.26Å; P857-C860 WeakPolarHBondContact O-CB 3.49Å; P857-C860 PolarHBondContact O-N 3.21Å; P857-C860 VanDerWaalsContact O-N 3.15Å
858	M	81.3	Confident	88.9	Confident	163 Å²	163	53.3 Å²	53.3	80%	0.803	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	136.8	175	-71.2	-66.7	-71.3	0	0	110.5	C860	M858-C860 PolarHBondContact O-N 2.92Å
859	D	79.6	Confident	89.3	Confident	128 Å²	128	55.1 Å²	55.1	68%	0.684	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	21.3	-178.7	-57.3	-42.7	0	0	0	115.3	P857 P861	P857-D859 PolarHBondContact O-N 3.04Å; D859-P861 WeakPolarHBondContact O-CD 3.48Å
860	C	87.8	Confident	89.8	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.007	29%	0.286	C	S	.	.			trans	-69.4	127.5	177.7	-171	0	0	0	0	111.3	P857 M858 A862 A903	P857-C860 HydrophobicContact CB-CB 4.26Å; P857-C860 WeakPolarHBondContact O-CB 3.49Å; P857-C860 PolarHBondContact O-N 3.21Å; P857-C860 VanDerWaalsContact O-N 3.15Å; M858-C860 PolarHBondContact O-N 2.92Å; C860-A862 PolarHBondContact O-N 2.88Å; C860-A903 PolarHBondContact O-N 2.72Å
861	P	89.8	Confident	90.3	Very high	6 Å²	6	44.2 Å²	44.2	4%	0.039	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-60.4	132.7	173.4	-25	34.9	0	0	0	112.2	D859 T863 L864 Y865 L899 I901	D859-P861 WeakPolarHBondContact O-CD 3.48Å; P861-T863 PolarHBondContact O-N 2.98Å; P861-T863 VanDerWaalsContact O-N 3.12Å; P861-L864 HydrophobicContact CB-CD1 4.32Å; P861-L864 HydrophobicContact CB-CG 4.44Å; P861-L864 HydrophobicContact CG-CD1 4.03Å; P861-L864 PolarHBondContact O-N 2.86Å; P861-Y865 PolarHBondContact O-N 3.43Å; P861-Y865 VanDerWaalsContact O-N 3.11Å; P861-L899 HydrophobicContact CB-CB 4.45Å; P861-L899 HydrophobicContact CB-CD2 4.04Å; P861-L899 HydrophobicContact CG-CB 4.13Å; P861-L899 HydrophobicContact CG-CD2 3.98Å; P861-L899 WeakPolarHBondContact CG-O 3.39Å; P861-I901 WeakPolarHBondContact CA-O 3.25Å
862	A	87.7	Confident	90.8	Very high	37 Å²	37	42.8 Å²	42.8	31%	0.306	23%	0.227	S	C	.	.	H	α-helix	trans	-56.1	-35.4	-176.3	0	0	0	0	0	113.1	C860 L864 Y865 Q866 I901 A903	C860-A862 PolarHBondContact O-N 2.88Å; A862-L864 VanDerWaalsContact C-N 3.34Å; A862-L864 PolarHBondContact O-N 2.9Å; A862-Y865 PolarHBondContact O-N 3.13Å; A862-Q866 WeakPolarHBondContact O-CB 3.2Å; A862-Q866 PolarHBondContact O-N 2.82Å; A862-I901 HydrophobicContact CB-CG2 4.4Å; A862-I901 PolarHBondContact N-O 2.93Å; A862-A903 HydrophobicContact CB-CB 4.42Å
863	T	88.6	Confident	91.3	Very high	57 Å²	57	41.5 Å²	41.5	35%	0.35	23%	0.225	S	C	.	.	H	α-helix	trans	-66.1	-33.1	177.1	52.9	0	0	0	0	113.4	P861 L867 L892	P861-T863 PolarHBondContact O-N 2.98Å; P861-T863 VanDerWaalsContact O-N 3.12Å; T863-L867 PolarHBondContact O-N 2.73Å; T863-L892 HydrophobicContact CG2-CD2 4.35Å; T863-L892 WeakPolarHBondContact OG1-CD2 3.31Å
864	L	92.9	Very high	91.5	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-76.9	-40.4	176.7	-73.4	174.9	0	0	0	110.8	V735 M829 P861 A862 Q866 L867 M868 L889 L892 L899	V735-L864 HydrophobicContact CG2-CD1 3.82Å; V735-L864 HydrophobicContact CG2-CD2 4.35Å; M829-L864 HydrophobicContact CE-CD1 4.26Å; M829-L864 HydrophobicContact CG-CD1 4.48Å; M829-L864 HydrophobicContact SD-CD1 3.72Å; P861-L864 HydrophobicContact CB-CD1 4.32Å; P861-L864 HydrophobicContact CB-CG 4.44Å; P861-L864 HydrophobicContact CG-CD1 4.03Å; P861-L864 PolarHBondContact O-N 2.86Å; A862-L864 VanDerWaalsContact C-N 3.34Å; A862-L864 PolarHBondContact O-N 2.9Å; L864-Q866 VanDerWaalsContact C-N 3.32Å; L864-Q866 PolarHBondContact O-N 3.07Å; L864-L867 WeakPolarHBondContact O-CB 3.36Å; L864-L867 PolarHBondContact O-N 2.79Å; L864-M868 WeakPolarHBondContact O-CG 3.42Å; L864-M868 PolarHBondContact O-N 3.05Å; L864-L889 HydrophobicContact CD2-CD2 3.9Å; L864-L892 HydrophobicContact CD2-CD1 3.53Å; L864-L892 HydrophobicContact CG-CD1 4.03Å; L864-L899 HydrophobicContact CD1-CD2 4.26Å
865	Y	95.1	Very high	91.5	Very high	36 Å²	36	50.6 Å²	50.6	14%	0.141	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-39	175	-171.5	-117.6	0	0	0	112	L854 P856 P861 A862 L867 M868 L869 W872	L854-Y865 WeakPolarHBondContact O-CE2 3.25Å; L854-Y865 PolarHBondContact O-OH 2.96Å; P856-Y865 VanDerWaalsContact CA-CE2 3.49Å; P856-Y865 HydrophobicContact CB-CD1 4.02Å; P856-Y865 HydrophobicContact CB-CD2 3.65Å; P856-Y865 HydrophobicContact CB-CE1 4.16Å; P856-Y865 HydrophobicContact CB-CE2 3.82Å; P856-Y865 HydrophobicContact CB-CG 3.77Å; P856-Y865 VanDerWaalsContact CD-CZ 3.5Å; P856-Y865 HydrophobicContact CG-CD1 4.43Å; P856-Y865 HydrophobicContact CG-CE1 4.2Å; P856-Y865 HydrophobicContact CG-CE2 4.42Å; P861-Y865 PolarHBondContact O-N 3.43Å; P861-Y865 VanDerWaalsContact O-N 3.11Å; A862-Y865 PolarHBondContact O-N 3.13Å; Y865-L867 VanDerWaalsContact C-N 3.3Å; Y865-L867 PolarHBondContact O-N 3Å; Y865-M868 HydrophobicContact CD2-CB 4.48Å; Y865-M868 HydrophobicContact CD2-SD 3.82Å; Y865-M868 HydrophobicContact CE2-SD 4.48Å; Y865-M868 WeakPolarHBondContact O-CA 3.4Å; Y865-M868 WeakPolarHBondContact O-CB 3.29Å; Y865-M868 PolarHBondContact O-N 2.98Å; Y865-L869 HydrophobicContact CD1-CD1 4.06Å; Y865-L869 HydrophobicContact CD1-CG 4.39Å; Y865-L869 HydrophobicContact CE1-CD1 3.8Å; Y865-L869 HydrophobicContact CE1-CD2 4.23Å; Y865-L869 HydrophobicContact CE1-CG 4.08Å; Y865-L869 WeakPolarHBondContact O-CG 3.46Å; Y865-L869 PolarHBondContact O-N 2.94Å; Y865-W872 HydrophobicContact CE2-CZ3 4.24Å
866	Q	94.4	Very high	91.6	Very high	98 Å²	98	53.9 Å²	53.9	46%	0.458	27%	0.268	S	S	.	.	H	α-helix	trans	-59.4	-41.9	173	-173.2	58.8	53.5	0	0	112	A862 L864 M868 L869 D870	A862-Q866 WeakPolarHBondContact O-CB 3.2Å; A862-Q866 PolarHBondContact O-N 2.82Å; L864-Q866 VanDerWaalsContact C-N 3.32Å; L864-Q866 PolarHBondContact O-N 3.07Å; Q866-M868 VanDerWaalsContact C-N 3.29Å; Q866-M868 PolarHBondContact O-N 2.88Å; Q866-L869 WeakPolarHBondContact O-CB 3.48Å; Q866-L869 PolarHBondContact O-N 2.9Å; Q866-D870 PolarHBondContact NE2-OD1 2.66Å; Q866-D870 PolarHBondContact O-N 2.78Å
867	L	95.9	Very high	91.7	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-61.7	-36.6	174.4	-179.9	61.5	0	0	0	112.1	L825 T863 L864 Y865 D870 C871 P880 I885 I888 L889	L825-L867 HydrophobicContact CD1-CD2 3.97Å; L825-L867 HydrophobicContact CD1-CG 3.87Å; L825-L867 HydrophobicContact CD2-CD2 4.41Å; T863-L867 PolarHBondContact O-N 2.73Å; L864-L867 WeakPolarHBondContact O-CB 3.36Å; L864-L867 PolarHBondContact O-N 2.79Å; Y865-L867 VanDerWaalsContact C-N 3.3Å; Y865-L867 PolarHBondContact O-N 3Å; L867-D870 PolarHBondContact O-N 2.84Å; L867-C871 PolarHBondContact O-N 2.83Å; L867-C871 PolarHBondContact O-SG 2.88Å; L867-C871 VanDerWaalsContact O-SG 3.32Å; L867-P880 HydrophobicContact CD1-CG 4.41Å; L867-I885 HydrophobicContact CD1-CG1 4.35Å; L867-I885 HydrophobicContact CD2-CG2 4.39Å; L867-I888 HydrophobicContact CD1-CD1 3.85Å; L867-I888 HydrophobicContact CD2-CG2 4.2Å; L867-L889 HydrophobicContact CD2-CD2 4.1Å; L867-L889 HydrophobicContact CD2-CG 4.39Å
868	M	97.6	Very high	92	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-46.1	173.2	-60.5	173.5	-161	0	0	111.2	L825 W826 M829 L864 Y865 Q866 D870 C871 W872	L825-M868 HydrophobicContact CB-CE 4Å; L825-M868 HydrophobicContact CB-CG 3.68Å; L825-M868 HydrophobicContact CB-SD 4.41Å; L825-M868 HydrophobicContact CD1-CG 4.14Å; L825-M868 WeakPolarHBondContact O-CE 3.5Å; W826-M868 HydrophobicContact CB-SD 4.04Å; M829-M868 HydrophobicContact CB-CE 4.1Å; M829-M868 HydrophobicContact CG-CE 3.76Å; L864-M868 WeakPolarHBondContact O-CG 3.42Å; L864-M868 PolarHBondContact O-N 3.05Å; Y865-M868 HydrophobicContact CD2-CB 4.48Å; Y865-M868 HydrophobicContact CD2-SD 3.82Å; Y865-M868 HydrophobicContact CE2-SD 4.48Å; Y865-M868 WeakPolarHBondContact O-CA 3.4Å; Y865-M868 WeakPolarHBondContact O-CB 3.29Å; Y865-M868 PolarHBondContact O-N 2.98Å; Q866-M868 VanDerWaalsContact C-N 3.29Å; Q866-M868 PolarHBondContact O-N 2.88Å; M868-D870 VanDerWaalsContact C-N 3.32Å; M868-D870 PolarHBondContact O-N 2.81Å; M868-C871 WeakPolarHBondContact O-CB 3.21Å; M868-C871 PolarHBondContact O-N 2.98Å; M868-C871 VanDerWaalsContact O-N 3.14Å; M868-W872 HydrophobicContact CB-CD2 4.45Å; M868-W872 HydrophobicContact CB-CE3 4.06Å; M868-W872 HydrophobicContact CB-CH2 3.68Å; M868-W872 HydrophobicContact CB-CZ2 4.08Å; M868-W872 HydrophobicContact CB-CZ3 3.66Å; M868-W872 HydrophobicContact CG-CH2 4.26Å; M868-W872 VanDerWaalsContact O-CD2 3.26Å; M868-W872 VanDerWaalsContact O-CG 3.31Å; M868-W872 PolarHBondContact O-N 2.84Å; M868-W872 HydrophobicContact SD-CH2 4.07Å
869	L	95.9	Very high	92.7	Very high	45 Å²	45	55.4 Å²	55.4	24%	0.236	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-36.7	176.9	-65	175.4	0	0	0	112.6	P853 Y865 Q866 C871 W872 Q873	P853-L869 HydrophobicContact CB-CD2 4.07Å; P853-L869 HydrophobicContact CG-CD2 4.28Å; Y865-L869 HydrophobicContact CD1-CD1 4.06Å; Y865-L869 HydrophobicContact CD1-CG 4.39Å; Y865-L869 HydrophobicContact CE1-CD1 3.8Å; Y865-L869 HydrophobicContact CE1-CD2 4.23Å; Y865-L869 HydrophobicContact CE1-CG 4.08Å; Y865-L869 WeakPolarHBondContact O-CG 3.46Å; Y865-L869 PolarHBondContact O-N 2.94Å; Q866-L869 WeakPolarHBondContact O-CB 3.48Å; Q866-L869 PolarHBondContact O-N 2.9Å; L869-C871 VanDerWaalsContact C-N 3.34Å; L869-W872 HydrophobicContact CD2-CE3 4.26Å; L869-W872 CarbonylContact O-C 3.54Å; L869-W872 PolarHBondContact O-N 2.85Å; L869-Q873 PolarHBondContact O-N 3Å; L869-Q873 PolarHBondContact O-NE2 3.01Å; L869-Q873 VanDerWaalsContact O-NE2 3.16Å
870	D	96.9	Very high	93.5	Very high	53 Å²	53	50 Å²	50	28%	0.283	25%	0.247	S	C	.	.	H	α-helix	trans	-66.8	-36.8	174.8	-63.6	-14.2	0	0	0	111.1	Q866 L867 M868 W872 Q873 P880	Q866-D870 PolarHBondContact NE2-OD1 2.66Å; Q866-D870 PolarHBondContact O-N 2.78Å; L867-D870 PolarHBondContact O-N 2.84Å; M868-D870 VanDerWaalsContact C-N 3.32Å; M868-D870 PolarHBondContact O-N 2.81Å; D870-W872 VanDerWaalsContact C-N 3.34Å; D870-Q873 VanDerWaalsContact O-CG 3.25Å; D870-Q873 WeakPolarHBondContact O-CG 3.35Å; D870-P880 HydrophobicContact CB-CG 4.27Å; D870-P880 WeakPolarHBondContact O-CD 3.48Å
871	C	97.6	Very high	93.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68.2	-30.8	172.2	-71.5	0	0	0	0	113	A818 L867 M868 L869 Q873 R879	A818-C871 WeakPolarHBondContact O-CB 3.23Å; L867-C871 PolarHBondContact O-N 2.83Å; L867-C871 PolarHBondContact O-SG 2.88Å; L867-C871 VanDerWaalsContact O-SG 3.32Å; M868-C871 WeakPolarHBondContact O-CB 3.21Å; M868-C871 PolarHBondContact O-N 2.98Å; M868-C871 VanDerWaalsContact O-N 3.14Å; L869-C871 VanDerWaalsContact C-N 3.34Å; C871-Q873 VanDerWaalsContact C-N 3.33Å; C871-Q873 PolarHBondContact O-N 2.85Å; C871-R879 VanDerWaalsContact O-CD 3.25Å; C871-R879 WeakPolarHBondContact O-CD 3.24Å; C871-R879 WeakPolarHBondContact O-CG 3.38Å
872	W	96.8	Very high	94.3	Very high	20 Å²	20	57 Å²	57	8%	0.076	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	19.7	-179.2	-59.5	-35.3	0	0	0	114.6	W819 G822 I823 W826 P853 L854 Y865 M868 L869 D870 K874	W819-W872 AromaticContact CD2-CD1 3.87Å; W819-W872 AromaticContact CE2-CD1 3.9Å; W819-W872 HydrophobicContact CE3-CB 4.32Å; W819-W872 HydrophobicContact CH2-CB 4.2Å; W819-W872 VanDerWaalsContact CZ3-C 3.48Å; W819-W872 HydrophobicContact CZ3-CB 4.02Å; W819-W872 WeakPolarHBondContact CZ3-O 3.45Å; G822-W872 WeakPolarHBondContact O-CZ2 3.39Å; I823-W872 HydrophobicContact CD1-CZ2 3.78Å; W826-W872 HydrophobicContact CB-CH2 4.13Å; W826-W872 HydrophobicContact CB-CZ2 4.16Å; W826-W872 HydrophobicContact CG-CH2 4.39Å; P853-W872 HydrophobicContact CB-CE3 3.95Å; P853-W872 HydrophobicContact CB-CZ3 4.37Å; L854-W872 HydrophobicContact CB-CH2 3.86Å; L854-W872 HydrophobicContact CB-CZ3 4.21Å; L854-W872 HydrophobicContact CD1-CH2 4.42Å; L854-W872 HydrophobicContact CD1-CZ2 4.36Å; Y865-W872 HydrophobicContact CE2-CZ3 4.24Å; M868-W872 HydrophobicContact CB-CD2 4.45Å; M868-W872 HydrophobicContact CB-CE3 4.06Å; M868-W872 HydrophobicContact CB-CH2 3.68Å; M868-W872 HydrophobicContact CB-CZ2 4.08Å; M868-W872 HydrophobicContact CB-CZ3 3.66Å; M868-W872 HydrophobicContact CG-CH2 4.26Å; M868-W872 VanDerWaalsContact O-CD2 3.26Å; M868-W872 VanDerWaalsContact O-CG 3.31Å; M868-W872 PolarHBondContact O-N 2.84Å; M868-W872 HydrophobicContact SD-CH2 4.07Å; L869-W872 HydrophobicContact CD2-CE3 4.26Å; L869-W872 CarbonylContact O-C 3.54Å; L869-W872 PolarHBondContact O-N 2.85Å; D870-W872 VanDerWaalsContact C-N 3.34Å; W872-K874 PolarHBondContact O-N 2.8Å
873	Q	95.8	Very high	94.7	Very high	73 Å²	73	59.1 Å²	59.1	34%	0.341	28%	0.283	S	S	.	.			trans	-60.3	131.9	170.8	-66.5	-62.2	-44.8	0	0	110.7	L869 D870 C871 E875 N878 R879	L869-Q873 PolarHBondContact O-N 3Å; L869-Q873 PolarHBondContact O-NE2 3.01Å; L869-Q873 VanDerWaalsContact O-NE2 3.16Å; D870-Q873 VanDerWaalsContact O-CG 3.25Å; D870-Q873 WeakPolarHBondContact O-CG 3.35Å; C871-Q873 VanDerWaalsContact C-N 3.33Å; C871-Q873 PolarHBondContact O-N 2.85Å; Q873-E875 VanDerWaalsContact C-N 3.33Å; Q873-E875 PolarHBondContact O-N 2.93Å; Q873-N878 HydrophobicContact CB-CB 4Å; Q873-N878 HydrophobicContact CG-CB 4.21Å; Q873-R879 HydrophobicContact CB-CG 3.99Å; Q873-R879 PolarHBondContact O-NE 3.3Å; Q873-R879 PolarHBondContact O-NH2 2.05Å
874	K	89.6	Confident	95.1	Very high	120 Å²	120	61 Å²	61	52%	0.522	29%	0.288	S	S	.	.	S	Bend	trans	-59.1	-45.7	-179.5	-173.6	165.1	-176.9	159	0	111.2	D849 W872 R876 R879	D849-K874 PolarHBondContact O-NZ 2.81Å; W872-K874 PolarHBondContact O-N 2.8Å; K874-R876 PolarHBondContact O-N 3.04Å; K874-R879 PolarHBondContact O-NH2 2.88Å
875	E	91.5	Very high	95.3	Very high	122 Å²	122	61 Å²	61	57%	0.57	29%	0.287	S	S	*	.	S	Bend	trans	-78	119.2	175.6	-67.8	-56.3	144.9	0	0	111.6	Q873 N877 N878	Q873-E875 VanDerWaalsContact C-N 3.33Å; Q873-E875 PolarHBondContact O-N 2.93Å; E875-N877 PolarHBondContact O-N 3.11Å; E875-N877 VanDerWaalsContact O-N 3.09Å; E875-N878 HydrophobicContact CB-CB 4.44Å; E875-N878 WeakPolarHBondContact O-CB 3.11Å; E875-N878 PolarHBondContact O-N 2.63Å
876	R	91.5	Very high	95.5	Very high	114 Å²	114	59.9 Å²	59.9	43%	0.43	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-56.1	-31.8	-175.7	74	-178.3	-174.8	-179.4	-1.6	114.2	A815 K874 N878 R879	A815-R876 HydrophobicContact CB-CB 4.08Å; K874-R876 PolarHBondContact O-N 3.04Å; R876-N878 VanDerWaalsContact C-N 3.26Å; R876-N878 PolarHBondContact O-N 3.01Å; R876-R879 PolarHBondContact O-N 3.03Å
877	N	90.2	Very high	95.6	Very high	130 Å²	130	57.7 Å²	57.7	70%	0.695	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-76.8	-16.7	-176.5	-67	-14.9	0	0	0	112.3	E875	E875-N877 PolarHBondContact O-N 3.11Å; E875-N877 VanDerWaalsContact O-N 3.09Å
878	N	95.1	Very high	95.6	Very high	108 Å²	108	60.1 Å²	60.1	58%	0.578	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-88.8	-9.8	179	-65.1	-7	0	0	0	112.2	Q873 E875 R876	Q873-N878 HydrophobicContact CB-CB 4Å; Q873-N878 HydrophobicContact CG-CB 4.21Å; E875-N878 HydrophobicContact CB-CB 4.44Å; E875-N878 WeakPolarHBondContact O-CB 3.11Å; E875-N878 PolarHBondContact O-N 2.63Å; R876-N878 VanDerWaalsContact C-N 3.26Å; R876-N878 PolarHBondContact O-N 3.01Å
879	R	96.7	Very high	95.5	Very high	12 Å²	12	60.1 Å²	60.1	5%	0.045	29%	0.292	C	S	.	.	S	Bend	trans	-74.4	143.6	176.9	-60.5	178.3	-165.7	153.1	8.1	110.1	E805 A815 C871 Q873 K874 R876	E805-R879 IonicContact OE1-CZ 2.78Å; E805-R879 IonicContact OE1-NH1 3.38Å; E805-R879 PolarHBondContact OE1-NH1 2.8Å; E805-R879 IonicContact OE1-NH2 3.41Å; E805-R879 PolarHBondContact OE1-NH2 3.26Å; E805-R879 IonicContact OE2-CZ 3.59Å; E805-R879 IonicContact OE2-NH1 3.53Å; E805-R879 IonicContact OE2-NH2 2.65Å; E805-R879 PolarHBondContact OE2-NH2 3.26Å; A815-R879 WeakPolarHBondContact O-CD 3.05Å; A815-R879 PolarHBondContact O-NH1 3.26Å; C871-R879 VanDerWaalsContact O-CD 3.25Å; C871-R879 WeakPolarHBondContact O-CD 3.24Å; C871-R879 WeakPolarHBondContact O-CG 3.38Å; Q873-R879 HydrophobicContact CB-CG 3.99Å; Q873-R879 PolarHBondContact O-NE 3.3Å; Q873-R879 PolarHBondContact O-NH2 2.05Å; K874-R879 PolarHBondContact O-NH2 2.88Å; R876-R879 PolarHBondContact O-N 3.03Å
880	P	97.1	Very high	95.4	Very high	14 Å²	14	59.9 Å²	59.9	9%	0.091	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-65.9	143.6	177.7	28.4	-34.5	0	0	0	110.7	L867 D870 Q884 I885	L867-P880 HydrophobicContact CD1-CG 4.41Å; D870-P880 HydrophobicContact CB-CG 4.27Å; D870-P880 WeakPolarHBondContact O-CD 3.48Å; P880-Q884 VanDerWaalsContact CA-OE1 3.31Å; P880-Q884 HydrophobicContact CB-CB 4.37Å; P880-I885 HydrophobicContact CB-CG1 3.96Å; P880-I885 HydrophobicContact CG-CD1 4.13Å; P880-I885 HydrophobicContact CG-CG1 3.89Å
881	K	95.6	Very high	95.2	Very high	150 Å²	150	63.3 Å²	63.3	65%	0.652	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-76.5	155.4	169.7	-68.2	-177.8	-178.3	-178.7	0	110.1	D883 Q884 I885	K881-D883 WeakPolarHBondContact CB-OD1 3.17Å; K881-D883 PolarHBondContact O-N 3.42Å; K881-Q884 WeakPolarHBondContact O-CA 2.97Å; K881-Q884 WeakPolarHBondContact O-CB 3.39Å; K881-Q884 PolarHBondContact O-N 3.26Å; K881-I885 WeakPolarHBondContact O-CG1 3.24Å; K881-I885 PolarHBondContact O-N 2.74Å
882	F	97.5	Very high	94.9	Very high	5 Å²	5	63.9 Å²	63.9	2%	0.022	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-28	-176.1	-79	-70.4	0	0	0	114.4	M745 K746 D817 A818 Y821 Q884 I885 V886	M745-F882 HydrophobicContact CB-CD1 3.53Å; M745-F882 HydrophobicContact CB-CD2 4.07Å; M745-F882 HydrophobicContact CB-CE1 3.31Å; M745-F882 HydrophobicContact CB-CE2 3.88Å; M745-F882 HydrophobicContact CB-CG 3.92Å; M745-F882 HydrophobicContact CB-CZ 3.51Å; M745-F882 HydrophobicContact CE-CE2 4.08Å; M745-F882 HydrophobicContact CE-CZ 3.94Å; M745-F882 HydrophobicContact CG-CE1 3.94Å; M745-F882 HydrophobicContact CG-CZ 4.02Å; K746-F882 HydrophobicContact CB-CB 3.75Å; K746-F882 HydrophobicContact CG-CB 4.22Å; D817-F882 HydrophobicContact CB-CE2 4.04Å; D817-F882 HydrophobicContact CB-CZ 4.1Å; A818-F882 HydrophobicContact CB-CE2 4.48Å; A818-F882 HydrophobicContact CB-CZ 4.4Å; Y821-F882 HydrophobicContact CD1-CE1 4.44Å; Y821-F882 HydrophobicContact CD2-CE1 4.12Å; Y821-F882 AromaticContact CG-CE1 3.87Å; Y821-F882 HydrophobicContact CG-CE1 3.87Å; F882-Q884 VanDerWaalsContact C-N 3.35Å; F882-I885 HydrophobicContact CD1-CD1 3.92Å; F882-I885 HydrophobicContact CE1-CD1 4.19Å; F882-I885 PolarHBondContact O-N 3.1Å; F882-V886 VanDerWaalsContact O-CG2 3.31Å; F882-V886 WeakPolarHBondContact O-CG2 3.43Å; F882-V886 PolarHBondContact O-N 3.3Å
883	D	96.4	Very high	94.7	Very high	80 Å²	80	65.7 Å²	65.7	43%	0.428	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-40.1	171.3	64.3	-38.4	0	0	0	112.3	K746 K881 S887	K746-D883 HydrophobicContact CD-CB 4.28Å; K746-D883 HydrophobicContact CG-CB 4.44Å; K881-D883 WeakPolarHBondContact CB-OD1 3.17Å; K881-D883 PolarHBondContact O-N 3.42Å; D883-S887 PolarHBondContact O-N 2.91Å; D883-S887 VanDerWaalsContact O-N 3.12Å
884	Q	97.4	Very high	94.4	Very high	97 Å²	97	71 Å²	71	45%	0.453	33%	0.334	S	S	.	.	H	α-helix	trans	-68	-44.1	174.6	-60.3	172.1	-29	0	0	111	P880 K881 F882 V886 S887 I888	P880-Q884 VanDerWaalsContact CA-OE1 3.31Å; P880-Q884 HydrophobicContact CB-CB 4.37Å; K881-Q884 WeakPolarHBondContact O-CA 2.97Å; K881-Q884 WeakPolarHBondContact O-CB 3.39Å; K881-Q884 PolarHBondContact O-N 3.26Å; F882-Q884 VanDerWaalsContact C-N 3.35Å; Q884-V886 PolarHBondContact O-N 3.28Å; Q884-S887 WeakPolarHBondContact O-CB 3.4Å; Q884-S887 PolarHBondContact O-N 2.93Å; Q884-S887 VanDerWaalsContact O-N 3.16Å; Q884-I888 WeakPolarHBondContact O-CG1 3.36Å; Q884-I888 PolarHBondContact O-N 2.75Å
885	I	97.9	Very high	94.3	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-57.4	-49.6	176.8	-63.8	176.1	0	0	0	110.8	A742 Y821 L867 P880 K881 F882 S887 I888 L889	A742-I885 HydrophobicContact CB-CG2 3.85Å; Y821-I885 HydrophobicContact CD1-CD1 3.95Å; Y821-I885 HydrophobicContact CD1-CG2 4.04Å; Y821-I885 HydrophobicContact CE1-CD1 4.35Å; Y821-I885 HydrophobicContact CE1-CG2 3.37Å; L867-I885 HydrophobicContact CD1-CG1 4.35Å; L867-I885 HydrophobicContact CD2-CG2 4.39Å; P880-I885 HydrophobicContact CB-CG1 3.96Å; P880-I885 HydrophobicContact CG-CD1 4.13Å; P880-I885 HydrophobicContact CG-CG1 3.89Å; K881-I885 WeakPolarHBondContact O-CG1 3.24Å; K881-I885 PolarHBondContact O-N 2.74Å; F882-I885 HydrophobicContact CD1-CD1 3.92Å; F882-I885 HydrophobicContact CE1-CD1 4.19Å; F882-I885 PolarHBondContact O-N 3.1Å; I885-S887 VanDerWaalsContact C-N 3.3Å; I885-S887 PolarHBondContact O-N 2.87Å; I885-I888 PolarHBondContact O-N 2.92Å; I885-L889 HydrophobicContact CG2-CD1 3.96Å; I885-L889 WeakPolarHBondContact O-CG 3.16Å; I885-L889 PolarHBondContact O-N 2.83Å
886	V	98	Very high	93.9	Very high	13 Å²	13	66.7 Å²	66.7	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-59.5	-42.4	176.8	173.3	0	0	0	0	111	A742 K746 F882 Q884 I888 L889 D890	A742-V886 HydrophobicContact CB-CG2 3.67Å; K746-V886 HydrophobicContact CB-CG2 4.48Å; F882-V886 VanDerWaalsContact O-CG2 3.31Å; F882-V886 WeakPolarHBondContact O-CG2 3.43Å; F882-V886 PolarHBondContact O-N 3.3Å; Q884-V886 PolarHBondContact O-N 3.28Å; V886-I888 VanDerWaalsContact C-N 3.31Å; V886-I888 PolarHBondContact O-N 2.78Å; V886-L889 PolarHBondContact O-N 2.89Å; V886-D890 WeakPolarHBondContact O-CB 3.49Å; V886-D890 PolarHBondContact O-N 2.73Å
887	S	96.6	Very high	93.2	Very high	52 Å²	52	65.2 Å²	65.2	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-60.5	-39.7	177.3	-168.1	0	0	0	0	112.7	D883 Q884 I885 K891	D883-S887 PolarHBondContact O-N 2.91Å; D883-S887 VanDerWaalsContact O-N 3.12Å; Q884-S887 WeakPolarHBondContact O-CB 3.4Å; Q884-S887 PolarHBondContact O-N 2.93Å; Q884-S887 VanDerWaalsContact O-N 3.16Å; I885-S887 VanDerWaalsContact C-N 3.3Å; I885-S887 PolarHBondContact O-N 2.87Å; S887-K891 VanDerWaalsContact O-CG 3.3Å; S887-K891 WeakPolarHBondContact O-CG 3.28Å; S887-K891 PolarHBondContact O-N 3.05Å; S887-K891 VanDerWaalsContact O-N 3.15Å
888	I	95.3	Very high	92.5	Very high	54 Å²	54	60.4 Å²	60.4	28%	0.277	31%	0.307	S	S	.	.	H	α-helix	trans	-64.9	-49	176.7	-67.8	165.2	0	0	0	110.1	L867 Q884 I885 V886 D890 K891 L892	L867-I888 HydrophobicContact CD1-CD1 3.85Å; L867-I888 HydrophobicContact CD2-CG2 4.2Å; Q884-I888 WeakPolarHBondContact O-CG1 3.36Å; Q884-I888 PolarHBondContact O-N 2.75Å; I885-I888 PolarHBondContact O-N 2.92Å; V886-I888 VanDerWaalsContact C-N 3.31Å; V886-I888 PolarHBondContact O-N 2.78Å; I888-D890 PolarHBondContact O-N 2.81Å; I888-K891 WeakPolarHBondContact O-CB 3.42Å; I888-K891 PolarHBondContact O-N 2.87Å; I888-K891 VanDerWaalsContact O-N 3.12Å; I888-L892 PolarHBondContact O-N 3.11Å; I888-L892 VanDerWaalsContact O-N 3.11Å
889	L	96.1	Very high	91.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-39.9	180	-63.3	167.8	0	0	0	112.1	V735 L738 R739 A742 Y821 L864 L867 I885 V886 K891 L892 I893	V735-L889 HydrophobicContact CG1-CD2 4.22Å; L738-L889 HydrophobicContact CB-CD1 4.41Å; R739-L889 HydrophobicContact CB-CB 4Å; R739-L889 HydrophobicContact CB-CD1 4.23Å; R739-L889 HydrophobicContact CG-CB 4.08Å; A742-L889 HydrophobicContact CB-CD1 3.92Å; Y821-L889 WeakPolarHBondContact OH-CD1 3.32Å; L864-L889 HydrophobicContact CD2-CD2 3.9Å; L867-L889 HydrophobicContact CD2-CD2 4.1Å; L867-L889 HydrophobicContact CD2-CG 4.39Å; I885-L889 HydrophobicContact CG2-CD1 3.96Å; I885-L889 WeakPolarHBondContact O-CG 3.16Å; I885-L889 PolarHBondContact O-N 2.83Å; V886-L889 PolarHBondContact O-N 2.89Å; L889-K891 PolarHBondContact O-N 3.47Å; L889-L892 HydrophobicContact CD2-CD1 4.39Å; L889-L892 PolarHBondContact O-N 3.3Å; L889-L892 VanDerWaalsContact O-N 3.1Å; L889-I893 WeakPolarHBondContact O-CG1 3.29Å; L889-I893 PolarHBondContact O-N 2.92Å
890	D	94.5	Very high	90.7	Very high	41 Å²	41	64 Å²	64	22%	0.219	32%	0.319	C	S	.	.	H	α-helix	trans	-62.7	-29.3	174.5	-77.9	-17.5	0	0	0	112.2	R739 V886 I888 R894	R739-D890 IonicContact CZ-OD1 3.91Å; R739-D890 IonicContact NE-OD1 3.54Å; R739-D890 PolarHBondContact NE-OD1 3.31Å; R739-D890 IonicContact NH2-OD1 2.9Å; R739-D890 PolarHBondContact NH2-OD1 2.8Å; R739-D890 IonicContact NH2-OD2 3.22Å; R739-D890 PolarHBondContact NH2-OD2 3.3Å; V886-D890 WeakPolarHBondContact O-CB 3.49Å; V886-D890 PolarHBondContact O-N 2.73Å; I888-D890 PolarHBondContact O-N 2.81Å; D890-R894 WeakPolarHBondContact O-CB 3.3Å; D890-R894 WeakPolarHBondContact O-CG 3.5Å; D890-R894 PolarHBondContact O-N 2.74Å; D890-R894 PolarHBondContact O-NE 3.27Å
891	K	92.9	Very high	89.5	Confident	125 Å²	125	69 Å²	69	54%	0.543	34%	0.344	S	S	.	.	H	α-helix	trans	-71.5	-41	172	-72.2	169.4	-174.3	176.6	0	111.5	S887 I888 L889 R894 N895	S887-K891 VanDerWaalsContact O-CG 3.3Å; S887-K891 WeakPolarHBondContact O-CG 3.28Å; S887-K891 PolarHBondContact O-N 3.05Å; S887-K891 VanDerWaalsContact O-N 3.15Å; I888-K891 WeakPolarHBondContact O-CB 3.42Å; I888-K891 PolarHBondContact O-N 2.87Å; I888-K891 VanDerWaalsContact O-N 3.12Å; L889-K891 PolarHBondContact O-N 3.47Å; K891-R894 PolarHBondContact O-N 2.8Å; K891-N895 PolarHBondContact O-N 3.29Å
892	L	91.4	Very high	88.4	Confident	11 Å²	11	64.5 Å²	64.5	6%	0.058	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-39.2	176.4	-65	177.7	0	0	0	111.8	V735 T863 L864 I888 L889 N895 S898 L899	V735-L892 HydrophobicContact CG1-CB 4.21Å; T863-L892 HydrophobicContact CG2-CD2 4.35Å; T863-L892 WeakPolarHBondContact OG1-CD2 3.31Å; L864-L892 HydrophobicContact CD2-CD1 3.53Å; L864-L892 HydrophobicContact CG-CD1 4.03Å; I888-L892 PolarHBondContact O-N 3.11Å; I888-L892 VanDerWaalsContact O-N 3.11Å; L889-L892 HydrophobicContact CD2-CD1 4.39Å; L889-L892 PolarHBondContact O-N 3.3Å; L889-L892 VanDerWaalsContact O-N 3.1Å; L892-N895 CarbonylContact O-C 3.46Å; L892-N895 PolarHBondContact O-N 3.48Å; L892-S898 WeakPolarHBondContact CD2-OG 3.04Å; L892-L899 HydrophobicContact CB-CD2 4.41Å; L892-L899 HydrophobicContact CD1-CD2 4.39Å; L892-L899 HydrophobicContact CD2-CD2 4.37Å
893	I	91.8	Very high	86.9	Confident	59 Å²	59	65.8 Å²	65.8	30%	0.303	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-41.4	175.8	-67	171.6	0	0	0	111.4	I732 V735 R739 L889 N895	I732-I893 HydrophobicContact CD1-CB 4.15Å; I732-I893 HydrophobicContact CD1-CG1 4.04Å; I732-I893 HydrophobicContact CD1-CG2 4.17Å; V735-I893 HydrophobicContact CG1-CD1 4.19Å; V735-I893 HydrophobicContact CG1-CG1 3.6Å; R739-I893 HydrophobicContact CB-CD1 3.9Å; R739-I893 HydrophobicContact CG-CD1 3.87Å; L889-I893 WeakPolarHBondContact O-CG1 3.29Å; L889-I893 PolarHBondContact O-N 2.92Å; I893-N895 VanDerWaalsContact C-N 3.29Å; I893-N895 PolarHBondContact O-N 3.2Å
894	R	90.4	Very high	84.5	Confident	183 Å²	183	68.2 Å²	68.2	69%	0.691	35%	0.353	S	S	*	.	H	α-helix	trans	-71.5	-22.2	177.7	-75.8	179.6	-71.4	-162.5	-1	113.5	D890 K891	D890-R894 WeakPolarHBondContact O-CB 3.3Å; D890-R894 WeakPolarHBondContact O-CG 3.5Å; D890-R894 PolarHBondContact O-N 2.74Å; D890-R894 PolarHBondContact O-NE 3.27Å; K891-R894 PolarHBondContact O-N 2.8Å
895	N	87.4	Confident	81.6	Confident	89 Å²	89	69.2 Å²	69.2	48%	0.476	37%	0.366	S	S	.	.			trans	-130.9	75.2	177.2	-173.7	9.8	0	0	0	112.1	K891 L892 I893 C897 S898	K891-N895 PolarHBondContact O-N 3.29Å; L892-N895 CarbonylContact O-C 3.46Å; L892-N895 PolarHBondContact O-N 3.48Å; I893-N895 VanDerWaalsContact C-N 3.29Å; I893-N895 PolarHBondContact O-N 3.2Å; N895-C897 PolarHBondContact O-N 3.32Å; N895-C897 VanDerWaalsContact O-N 3.1Å; N895-S898 WeakPolarHBondContact O-CB 3.06Å; N895-S898 PolarHBondContact O-N 3.49Å; N895-S898 VanDerWaalsContact O-N 3.13Å; N895-S898 PolarHBondContact O-OG 3.44Å
896	P	83	Confident	78.4	Confident	64 Å²	64	75.5 Å²	75.5	42%	0.416	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-62.3	-20.7	-176.9	-22.3	33.6	0	0	0	114	I732 S898 L899	I732-P896 HydrophobicContact CD1-CG 4.26Å; P896-S898 PolarHBondContact O-N 2.04Å; P896-L899 WeakPolarHBondContact O-CB 3.37Å; P896-L899 PolarHBondContact O-N 3.23Å
897	C	76.2	Confident	75.2	Confident	83 Å²	83	80.3 Å²	80.3	56%	0.561	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-60.6	-28.2	176.8	-66.4	0	0	0	0	112.8	N895 L899 K900	N895-C897 PolarHBondContact O-N 3.32Å; N895-C897 VanDerWaalsContact O-N 3.1Å; C897-L899 PolarHBondContact O-N 2.94Å; C897-K900 PolarHBondContact O-N 2.78Å
898	S	76.1	Confident	72	Confident	28 Å²	28	88.5 Å²	88.5	20%	0.196	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-64.3	-19.5	175.8	62	0	0	0	0	113.5	L892 N895 P896 K900	L892-S898 WeakPolarHBondContact CD2-OG 3.04Å; N895-S898 WeakPolarHBondContact O-CB 3.06Å; N895-S898 PolarHBondContact O-N 3.49Å; N895-S898 VanDerWaalsContact O-N 3.13Å; N895-S898 PolarHBondContact O-OG 3.44Å; P896-S898 PolarHBondContact O-N 2.04Å; S898-K900 VanDerWaalsContact C-N 3.27Å; S898-K900 PolarHBondContact O-N 2.99Å
899	L	78.8	Confident	68.9	Low	23 Å²	23	91 Å²	91	12%	0.12	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-79	-6.3	178.7	-58.4	172.2	0	0	0	113.4	V735 P861 L864 L892 P896 C897	V735-L899 HydrophobicContact CG2-CD1 4.14Å; V735-L899 HydrophobicContact CG2-CD2 4.02Å; P861-L899 HydrophobicContact CB-CB 4.45Å; P861-L899 HydrophobicContact CB-CD2 4.04Å; P861-L899 HydrophobicContact CG-CB 4.13Å; P861-L899 HydrophobicContact CG-CD2 3.98Å; P861-L899 WeakPolarHBondContact CG-O 3.39Å; L864-L899 HydrophobicContact CD1-CD2 4.26Å; L892-L899 HydrophobicContact CB-CD2 4.41Å; L892-L899 HydrophobicContact CD1-CD2 4.39Å; L892-L899 HydrophobicContact CD2-CD2 4.37Å; P896-L899 WeakPolarHBondContact O-CB 3.37Å; P896-L899 PolarHBondContact O-N 3.23Å; C897-L899 PolarHBondContact O-N 2.94Å
900	K	74	Confident	65.6	Low	173 Å²	173	95.2 Å²	95.2	75%	0.752	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-81.5	-13.9	-178.7	-65.9	-174	176.2	-175.8	0	114.2	C897 S898 T902	C897-K900 PolarHBondContact O-N 2.78Å; S898-K900 VanDerWaalsContact C-N 3.27Å; S898-K900 PolarHBondContact O-N 2.99Å; K900-T902 PolarHBondContact O-N 2.83Å
901	I	72.3	Confident	62.6	Low	119 Å²	119	101 Å²	101	61%	0.61	55%	0.547	S	S	*	.			trans	-89.1	105.4	-179.4	-58	172.9	0	0	0	107.9	P861 A862	P861-I901 WeakPolarHBondContact CA-O 3.25Å; A862-I901 HydrophobicContact CB-CG2 4.4Å; A862-I901 PolarHBondContact N-O 2.93Å
902	T	72.6	Confident	59.6	Low	56 Å²	56	103.3 Å²	103.3	34%	0.344	57%	0.565	S	S	.	*	B	Isolated β-bridge	trans	-82.6	146.2	179.7	50.8	0	0	0	0	111.6	K900 N904	K900-T902 PolarHBondContact O-N 2.83Å; T902-N904 PolarHBondContact O-N 2.66Å; T902-N904 VanDerWaalsContact O-N 3.1Å
903	A	66	Low	57	Low	31 Å²	31	110.2 Å²	110.2	26%	0.256	60%	0.601	S	S	.	*			trans	-75.9	91.5	172	0	0	0	0	0	109.8	P856 C860 A862	P856-A903 HydrophobicContact CB-CB 4.16Å; P856-A903 HydrophobicContact CG-CB 4.39Å; C860-A903 PolarHBondContact O-N 2.72Å; A862-A903 HydrophobicContact CB-CB 4.42Å
904	N	45.1	Very low	54.2	Low	132 Å²	132	115.8 Å²	115.8	71%	0.706	63%	0.631	S	S	*	*			trans	-69.1	142.1	176.3	-86.5	-0.9	0	0	0	112.5	T902 T906	T902-N904 PolarHBondContact O-N 2.66Å; T902-N904 VanDerWaalsContact O-N 3.1Å; N904-T906 PolarHBondContact O-N 2.78Å
905	T	36.7	Very low	51.1	Low	118 Å²	118	114.4 Å²	114.4	72%	0.724	64%	0.637	S	S	*	*			trans	-64.5	82.7	-178.6	14	0	0	0	0	113.2
906	T	31.9	Very low	48.3	Very low	132 Å²	132	121.8 Å²	121.8	81%	0.81	66%	0.658	S	S	*	*			trans	-123.4	72.1	157.9	49.5	0	0	0	0	109.9	N904	N904-T906 PolarHBondContact O-N 2.78Å
907	S	31	Very low	45.6	Very low	113 Å²	113	123.2 Å²	123.2	79%	0.79	67%	0.669	S	S	*	*			trans	169.6	68	154.9	43.5	0	0	0	0	110.6
908	R	29	Very low	43.3	Very low	224 Å²	224	124.8 Å²	124.8	85%	0.845	68%	0.681	S	S	*	*			trans	-80.9	121.4	152.7	-91.3	-177.1	168.9	-179.8	-2.8	107	A910	R908-A910 PolarHBondContact O-N 2.79Å; R908-A910 VanDerWaalsContact O-N 3.16Å
909	P	28.9	Very low	41	Very low	108 Å²	108	128 Å²	128	70%	0.701	71%	0.71	S	S	*	*			trans	-67.5	108.7	154.5	6	8.2	0	0	0	106.2
910	A	28.1	Very low	38.5	Very low	88 Å²	88	136.2 Å²	136.2	73%	0.727	75%	0.747	S	S	*	*			trans	-60.7	139.7	168.5	0	0	0	0	0	109.2	R908 L912	R908-A910 PolarHBondContact O-N 2.79Å; R908-A910 VanDerWaalsContact O-N 3.16Å; A910-L912 PolarHBondContact O-N 2.92Å
911	N	31	Very low	36.4	Very low	162 Å²	162	134.5 Å²	134.5	87%	0.866	75%	0.751	S	S	*	*			trans	-46.9	106.5	172.7	-71.8	-43.6	0	0	0	111.2	L913	N911-L913 VanDerWaalsContact C-N 3.33Å; N911-L913 PolarHBondContact O-N 3.03Å
912	L	30.6	Very low	34.4	Very low	173 Å²	173	134.5 Å²	134.5	91%	0.906	76%	0.759	S	S	*	*			trans	-74.9	93.1	153.4	-88.2	160.7	0	0	0	106.7	A910	A910-L912 PolarHBondContact O-N 2.92Å
913	L	36.6	Very low	33	Very low	157 Å²	157	137.1 Å²	137.1	82%	0.822	78%	0.777	S	S	*	*	S	Bend	trans	176.3	117.4	145.2	-91.5	167.5	0	0	0	106.9	N911	N911-L913 VanDerWaalsContact C-N 3.33Å; N911-L913 PolarHBondContact O-N 3.03Å
914	L	32.6	Very low	31.6	Very low	176 Å²	176	142.6 Å²	142.6	92%	0.921	81%	0.807	S	S	*	*	S	Bend	trans	85.2	84.4	-176.1	-53	162.1	0	0	0	114.7
915	D	24.6	Very low	30.9	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	81%	0.806	S	S	*	*				-178.8	141.2	100.4	-157.2	-0.3	0	0	0	109.7
916	R	29.6	Very low	31.2	Very low	244 Å²	244	138.9 Å²	138.9	92%	0.921	80%	0.802	S	S	*	*			trans	-117.5	94.6	-177.3	178	-178.2	170.8	171.6	-2.5	107.8
917	S	27	Very low	31.1	Very low	93 Å²	93	140.3 Å²	140.3	65%	0.65	80%	0.802	S	S	*	*			trans	-163.6	130.9	157.2	38.3	0	0	0	0	113.7
918	S	26.3	Very low	31.5	Very low	117 Å²	117	137 Å²	137	82%	0.818	79%	0.785	S	S	*	*			trans	62.5	108.8	155	54.4	0	0	0	0	121.1
919	A	28.5	Very low	32	Very low	95 Å²	95	132.3 Å²	132.3	79%	0.785	78%	0.777	S	S	*	*			trans	-20.4	136.9	150	0	0	0	0	0	118.6
920	E	26.9	Very low	32.5	Very low	195 Å²	195	135.6 Å²	135.6	91%	0.911	78%	0.775	S	S	*	*				-176.1	135.4	110.8	-96.5	176.7	-172.1	0	0	110.2
921	V	28.8	Very low	32.7	Very low	138 Å²	138	138.3 Å²	138.3	84%	0.836	78%	0.775	S	S	*	*			trans	-123.9	141.9	178.2	175.3	0	0	0	0	108.7
922	P	30.9	Very low	32.8	Very low	119 Å²	119	138 Å²	138	77%	0.773	77%	0.773	S	S	*	*			trans	-125.9	166.5	145.3	23.5	-4	0	0	0	113.8
923	P	42.7	Very low	32.8	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	76%	0.761	S	S	*	*			trans	-110.8	152.9	-135.2	39.2	-32.9	0	0	0	117.5
924	V	36.9	Very low	32.4	Very low	145 Å²	145	131.9 Å²	131.9	88%	0.879	75%	0.751	S	S	*	*			trans	36.2	128.3	140.6	-171.8	0	0	0	0	120.9
925	G	31.1	Very low	32.1	Very low	67 Å²	67	134.5 Å²	134.5	69%	0.691	75%	0.748	S	S	*	*			trans	-137.9	103.9	157.1	0	0	0	0	0	112.8
926	T	41.6	Very low	32.3	Very low	106 Å²	106	133.1 Å²	133.1	65%	0.65	75%	0.745	S	S	*	*			trans	17.3	136.9	159.4	46.2	0	0	0	0	124.7	G928	T926-G928 PolarHBondContact O-N 3.23Å
927	M	31.2	Very low	32.2	Very low	162 Å²	162	129 Å²	129	80%	0.798	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	0.6	178.5	-162.4	131.5	87	0	0	116.6
928	G	38.7	Very low	32.7	Very low	42 Å²	42	130.2 Å²	130.2	43%	0.433	75%	0.747	S	S	.	*	H	α-helix	trans	-75.1	-39.5	176.2	0	0	0	0	0	112.5	T926 W930 M931	T926-G928 PolarHBondContact O-N 3.23Å; G928-W930 PolarHBondContact O-N 3.25Å; G928-M931 PolarHBondContact O-N 3.24Å
929	D	38.7	Very low	32.5	Very low	127 Å²	127	130 Å²	130	68%	0.679	74%	0.744	S	S	*	*	H	α-helix	trans	-73.1	-15.4	-177.9	-63.6	-24.4	0	0	0	112.7
930	W	39.5	Very low	32.2	Very low	177 Å²	177	134.9 Å²	134.9	67%	0.67	75%	0.748	S	S	*	*	H	α-helix	trans	-83.1	-25.3	176.3	-154.4	79.3	0	0	0	112.9	G928 M934	G928-W930 PolarHBondContact O-N 3.25Å; W930-M934 HydrophobicContact CH2-CE 4.08Å; W930-M934 HydrophobicContact CZ2-CE 4.26Å
931	M	32	Very low	32.2	Very low	145 Å²	145	134.4 Å²	134.4	71%	0.714	75%	0.745	S	S	*	*	H	α-helix	trans	-82.9	-24.1	-178.9	-76.3	-154.4	-64.8	0	0	113.8	G928 A933	G928-M931 PolarHBondContact O-N 3.24Å; M931-A933 VanDerWaalsContact C-N 3.3Å
932	D	33.1	Very low	32	Very low	154 Å²	154	132.6 Å²	132.6	82%	0.824	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-15.2	174.6	-82.3	-15.9	0	0	0	113.2
933	A	31	Very low	31.7	Very low	80 Å²	80	136.1 Å²	136.1	66%	0.661	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-8.9	-178.6	0	0	0	0	0	114.7	M931	M931-A933 VanDerWaalsContact C-N 3.3Å
934	M	28.2	Very low	30.8	Very low	123 Å²	123	136.6 Å²	136.6	61%	0.606	75%	0.754	S	S	*	*	S	Bend	trans	-129.2	56.4	-164.5	-81	-87.7	-119	0	0	114.2	W930	W930-M934 HydrophobicContact CH2-CE 4.08Å; W930-M934 HydrophobicContact CZ2-CE 4.26Å
935	R	27.7	Very low	30.2	Very low	231 Å²	231	133.2 Å²	133.2	87%	0.872	75%	0.749	S	S	*	*			trans	-166	99.9	150.5	-107.5	162	-149.4	-146.1	7.2	115.3
936	T	28.9	Very low	30	Very low	124 Å²	124	136.4 Å²	136.4	76%	0.761	75%	0.754	S	S	*	*				33.9	129.4	129.4	60.1	0	0	0	0	121.2
937	L	26.3	Very low	29.1	Very low	159 Å²	159	136.7 Å²	136.7	83%	0.832	76%	0.761	S	S	*	*			trans	-144.6	146.5	140.2	-104.6	113.5	0	0	0	111
938	P	38	Very low	28.9	Very low	118 Å²	118	139 Å²	139	77%	0.766	76%	0.762	S	S	*	*				-146.8	131.8	109.6	35.1	-18.5	0	0	0	114.5
939	C	22.4	Very low	28.5	Very low	113 Å²	113	142.2 Å²	142.2	76%	0.764	78%	0.778	S	S	*	*				168.5	113.4	119.4	-101.1	0	0	0	0	112.2
940	K	22.6	Very low	27.8	Very low	197 Å²	197	142.1 Å²	142.1	86%	0.857	79%	0.787	S	S	*	*			trans	58.8	103.4	135	-148	172.6	-174.8	179.6	0	118.5	A942	K940-A942 PolarHBondContact O-N 3.4Å; K940-A942 VanDerWaalsContact O-N 3.11Å
941	E	26	Very low	27.2	Very low	184 Å²	184	138.9 Å²	138.9	86%	0.86	79%	0.79	S	S	*	*			trans	-39.3	110.5	150.4	-64.9	175.3	149.5	0	0	111.3
942	A	24.3	Very low	26.8	Very low	100 Å²	100	138.9 Å²	138.9	83%	0.826	79%	0.793	S	S	*	*			trans	-86.2	112	146.2	0	0	0	0	0	106.4	K940	K940-A942 PolarHBondContact O-N 3.4Å; K940-A942 VanDerWaalsContact O-N 3.11Å
943	F	24.1	Very low	26.4	Very low	193 Å²	193	137.4 Å²	137.4	85%	0.846	79%	0.79	S	S	*	*			trans	-13.2	129.9	169.4	-78.8	-94.6	0	0	0	119.2
944	S	25.1	Very low	26	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	80%	0.804	S	S	*	*			trans	69.2	140.6	140.9	66.9	0	0	0	0	118.5
945	G	24.5	Very low	25.8	Very low	74 Å²	74	140.1 Å²	140.1	76%	0.763	81%	0.806	S	S	*	*			cis	-173.1	173.9	14	0	0	0	0	0	112.3
946	V	26.9	Very low	25.6	Very low	134 Å²	134	138.4 Å²	138.4	81%	0.812	80%	0.804	S	S	*	*			trans	-62.7	137.9	-175.4	178.9	0	0	0	0	112.5
947	S	22.6	Very low	25.3	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	80%	0.804	S	S	*	*				166	158.9	112.2	55.8	0	0	0	0	114
948	Y	26.9	Very low	25.2	Very low	211 Å²	211	135.5 Å²	135.5	83%	0.827	80%	0.798	S	S	*	*			trans	-80	161.6	-160.8	-80.9	-105.9	0	0	0	115.8
949	S	29.1	Very low	24.5	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	80%	0.797	S	S	*	*			trans	37.4	118.2	141.4	66.1	0	0	0	0	120.6
950	S	25.6	Very low	24.7	Very low	124 Å²	124	136.6 Å²	136.6	87%	0.867	79%	0.794	S	S	*	*				169	162.4	127.4	-177.1	0	0	0	0	112
951	C	25.4	Very low	24.9	Very low	109 Å²	109	137.9 Å²	137.9	74%	0.736	79%	0.793	S	S	*	*			trans	-59.1	166.3	-170.8	-76.2	0	0	0	0	118.7
952	D	24.9	Very low	24.8	Very low	146 Å²	146	135.1 Å²	135.1	78%	0.781	79%	0.789	S	S	*	*			trans	96	108.1	152.3	-66	-26.2	0	0	0	120.6
953	T	25	Very low	24.8	Very low	123 Å²	123	136.3 Å²	136.3	76%	0.755	79%	0.786	S	S	*	*			trans	25.4	122.2	134.9	-3.7	0	0	0	0	120.4
954	L	22	Very low	25.2	Very low	182 Å²	182	134.8 Å²	134.8	95%	0.953	79%	0.785	S	S	*	*				-165.4	142.4	121	-103.1	163.1	0	0	0	111.5
955	A	23.6	Very low	25.2	Very low	78 Å²	78	135.4 Å²	135.4	65%	0.645	78%	0.784	S	S	*	*			trans	-105.7	164.5	-169.8	0	0	0	0	0	113
956	K	23.9	Very low	25.3	Very low	194 Å²	194	140.1 Å²	140.1	84%	0.843	79%	0.786	S	S	*	*			trans	79	139.4	159.6	-63	176.6	179	176.9	0	115.7
957	T	23	Very low	25.2	Very low	124 Å²	124	138.7 Å²	138.7	76%	0.761	78%	0.778	S	S	*	*			cis	-165.9	150.4	26.5	-11.1	0	0	0	0	111.2
958	S	23.1	Very low	25.3	Very low	99 Å²	99	141 Å²	141	69%	0.692	78%	0.776	S	S	*	*			trans	53.7	132.8	153.9	74	0	0	0	0	119
959	T	24.1	Very low	25.1	Very low	123 Å²	123	137 Å²	137	76%	0.755	77%	0.768	S	S	*	*				-154.9	124	51.6	-7.1	0	0	0	0	111
960	D	25.3	Very low	24.9	Very low	130 Å²	130	137.8 Å²	137.8	70%	0.695	77%	0.768	S	S	*	*			trans	27.5	112	148.9	-69.2	-36.9	0	0	0	120.4
961	R	27.3	Very low	26.1	Very low	224 Å²	224	137.7 Å²	137.7	85%	0.845	76%	0.764	S	S	*	*				81.6	130.9	75.4	-91.4	-172.1	160.9	-177.2	-3.8	110.9
962	V	24.7	Very low	26.1	Very low	127 Å²	127	136.7 Å²	136.7	77%	0.77	76%	0.764	S	S	*	*			cis	-161.5	121.1	42	173.6	0	0	0	0	105.5
963	V	24.3	Very low	26.2	Very low	125 Å²	125	136.6 Å²	136.6	76%	0.758	77%	0.769	S	S	*	*				59.9	102.5	61.5	-173.5	0	0	0	0	116.3
964	L	31.8	Very low	26.1	Very low	160 Å²	160	136.5 Å²	136.5	84%	0.838	77%	0.772	S	S	*	*			trans	-48.9	156.1	157.9	-77.8	128.8	0	0	0	113.3
965	T	25.4	Very low	26.7	Very low	134 Å²	134	133.4 Å²	133.4	82%	0.822	76%	0.763	S	S	*	*			trans	-164.5	151.2	131.9	9.1	0	0	0	0	113.7
966	E	26.8	Very low	26.8	Very low	173 Å²	173	137.7 Å²	137.7	81%	0.808	77%	0.769	S	S	*	*			trans	-69.6	-178.6	-173.8	-58.5	163.6	127	0	0	114.7
967	V	24.9	Very low	26.9	Very low	105 Å²	105	140.1 Å²	140.1	64%	0.636	77%	0.773	S	S	*	*				160.5	148.6	106.7	175.8	0	0	0	0	111.8
968	H	23.4	Very low	27	Very low	162 Å²	162	142.9 Å²	142.9	75%	0.75	78%	0.778	S	S	*	*			trans	103.6	148.4	154.9	-72.6	-42.1	0	0	0	118.9
969	I	23.7	Very low	27.9	Very low	126 Å²	126	143.1 Å²	143.1	65%	0.646	78%	0.777	S	S	*	*			cis	-177.5	128	-35.3	-110.2	-176	0	0	0	107.1
970	T	25.7	Very low	28	Very low	125 Å²	125	142.1 Å²	142.1	77%	0.767	78%	0.775	S	S	*	*			trans	71.9	176.3	146.9	74.1	0	0	0	0	122.5
971	P	49.1	Very low	28.1	Very low	122 Å²	122	145.2 Å²	145.2	79%	0.792	79%	0.787	S	S	*	*				-138.3	-158.2	-107.4	37	-9.4	0	0	0	115.5
972	A	26.9	Very low	28.2	Very low	89 Å²	89	137.7 Å²	137.7	74%	0.736	78%	0.78	S	S	*	*			trans	101.6	142.7	170.8	0	0	0	0	0	115.4
973	T	27.2	Very low	28.3	Very low	143 Å²	143	139.2 Å²	139.2	88%	0.877	78%	0.782	S	S	*	*			cis	-171.2	159.1	29.4	8.1	0	0	0	0	111.5
974	C	21.7	Very low	28.6	Very low	122 Å²	122	138.8 Å²	138.8	82%	0.824	78%	0.78	S	S	*	*			trans	-72.2	169.5	164.9	-91.1	0	0	0	0	112.9
975	P	35	Very low	28.8	Very low	116 Å²	116	137 Å²	137	75%	0.753	78%	0.776	S	S	*	*				-155.4	163.5	62.1	39	-14.9	0	0	0	121.3
976	E	26.2	Very low	29.2	Very low	169 Å²	169	142.4 Å²	142.4	79%	0.79	80%	0.798	S	S	*	*			trans	14.6	145	145	-60.6	175.9	156.2	0	0	124.1
977	W	24.5	Very low	29.3	Very low	244 Å²	244	140.9 Å²	140.9	92%	0.924	80%	0.798	S	S	*	*				178.1	125.3	115.3	-98.3	43.2	0	0	0	112.6
978	E	26.6	Very low	29.6	Very low	183 Å²	183	142.7 Å²	142.7	86%	0.855	81%	0.806	S	S	*	*			trans	-116.9	167.3	150.9	-97.3	-167.4	178.5	0	0	105.9
979	P	41.5	Very low	29.9	Very low	104 Å²	104	141.7 Å²	141.7	68%	0.675	81%	0.809	S	S	*	*			cis	-152.1	-178.5	31.4	38.4	-14.3	0	0	0	118
980	S	27.1	Very low	30.3	Very low	102 Å²	102	142.6 Å²	142.6	71%	0.713	82%	0.819	S	S	*	*			trans	107.3	137.4	132	78.3	0	0	0	0	122.9
981	M	27	Very low	30.6	Very low	194 Å²	194	143.7 Å²	143.7	96%	0.956	82%	0.822	S	S	*	*			trans	68.9	136.4	160.7	-62.5	-173.2	-178.3	0	0	117.8
982	G	27.8	Very low	29.3	Very low	67 Å²	67	145.1 Å²	145.1	69%	0.691	82%	0.824	S	S	*	*			cis	149.2	128.9	8.2	0	0	0	0	0	109.9
983	I	28.8	Very low	29.5	Very low	159 Å²	159	149.1 Å²	149.1	82%	0.815	83%	0.831	S	S	*	*			trans	75.6	128.2	147.6	-32	-177.4	0	0	0	120.8
984	T	30	Very low	29.7	Very low	115 Å²	115	149.6 Å²	149.6	71%	0.706	83%	0.827	S	S	*	*			trans	92.8	103.9	140	23.3	0	0	0	0	122.2
985	T	36.1	Very low	30.4	Very low	123 Å²	123	151.9 Å²	151.9	76%	0.755	83%	0.827	S	S	*	*				51.4	115	127.3	52.9	0	0	0	0	120.8
986	L	33.7	Very low	29.9	Very low	247 Å²	247	155.2 Å²	155.2	100%	1.293	83%	0.834	S	S	*	*				-158.9	0	100.1	-109.4	160.3	0	0	0	110.3

Retrieved 986 of 986 residues in 1108.5 ms (Link to these results)

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