A0A077Z4A8_TRITR Loading...

ER membrane protein complex subunit 1

AlphaFold DB , UniProt , Accession A0A077Z4A8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 993 aa.

						>A0A077Z4A8_TRITR|A0A077Z4A8
MFAYEPAHLHLWKSIFVITENNVIASINPRNGEISKIGAFFSKPTNGTPLTPYYCTKMACGSSSNKYCVMPPIVAGLLCVRGHGTVLENLNPSTGVLSWEAPLEVTRCDRIKLLNYQRTVYVVTCDQVRSFGASSGQLLWTTALHRQSEIVWQDAAIDSKSSLLYVATGSQDKLETVKQRNFKTSIRNADFSISDGNLEVLWLDLILFMWILKQTILWFTNAQVVNKRSCKSRCYSRKAEIDARIKTFEDEEFCSISSKQNATIVDVHRRGKGRLVSSVEEGGLLISLYDKDGTYISQAEVPLDSSALSLPLMAVTPFFANETFSVKRVFIVANDCTMAMLRPNGRPFWTRYESLASVVSTELIDLPLSEQETILEEEFSVPMGAVGLRISSSKLNCFFIDNVFRMFTNRVTKELLQLKSYLLRYLNDVFGLASFLGQYDWLALHLLPAWKPHRLERDHFGLRKMLVVTTAQGRVFGMDSATGQVLWHFNVAGTEPLGSGPKFFPLFVQRTTAYYSRAAQCATVLKRKSTGNGVVVTFNPITGDVVEVIDLEFPLCHASSTPLKDPQGLTALILWPLRGEKAYLFPPSLKTTKSALVDGRPIYFLHVDRTSGLAESYKLLEALHSDPSPAQVIPWSVSKQFTLNLTIEEGSEIVDFQMKHLDVFECLGCIEIFAAKVHSQGRVLGNRSVLYKYLNPNIAVALIRLKEEQVSTVLAGLLQLVPITNQRCTVDITVLAFDGITGRPVHAVKENRANPPYHLIVCENWIVYSFWNEKYRRTEVSVLEMYEGEVQANPTSFSSLYPLEPLVYHQSYIFPQKITSLAVTETEKAITPRFLLIAMPFGGIVELPKSFLDPRRTVNLTQELKWANLPPLIILIEIVLPSREEGIIPYAPDLPIATDHIINYNLSVHGVHSICTAPSGMESTSMVFAAGLVVNKLARTDLFFTRVSPAGAFDMLKDGFDHWFIATVLIGLSLAAMATKRLTRQKDTINAWR
					

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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	36	Very low	42.3	Very low	169 Å²	169	83.5 Å²	83.5	83%	0.833	44%	0.439	S	S	*	.				0	137	0	-66.3	-171.2	-60.8	0	0	107.8	F16 V17	M1-F16 CarbonylContact C-O 3.47Å; M1-F16 VanDerWaalsContact CA-O 3.3Å; M1-F16 WeakPolarHBondContact CA-O 3.35Å; M1-V17 HydrophobicContact CG-CG2 4.21Å
2	F	47.6	Very low	42.8	Very low	89 Å²	89	81 Å²	81	39%	0.39	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.6	174	-57.4	-79.8	0	0	0	109.1	F16 I18 V69	F2-F16 PolarHBondContact N-O 3.2Å; F2-F16 PolarHBondContact O-N 3.27Å; F2-I18 HydrophobicContact CD2-CD1 4.43Å; F2-I18 HydrophobicContact CE2-CD1 4.14Å; F2-V69 HydrophobicContact CE2-CB 4.23Å; F2-V69 WeakPolarHBondContact CZ-O 3.43Å
3	A	40.6	Very low	43.7	Very low	40 Å²	40	88.3 Å²	88.3	33%	0.331	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	134.2	171	0	0	0	0	0	109.6	W12	A3-W12 HydrophobicContact CB-CD2 4.28Å; A3-W12 HydrophobicContact CB-CE3 3.66Å; A3-W12 HydrophobicContact CB-CH2 3.21Å; A3-W12 HydrophobicContact CB-CZ2 3.86Å; A3-W12 HydrophobicContact CB-CZ3 3.1Å
4	Y	43.3	Very low	44.8	Very low	67 Å²	67	82.7 Å²	82.7	26%	0.263	42%	0.419	S	S	.	.			trans	-90.3	110.4	173.7	-175.8	-93.6	0	0	0	109.6	P71	Y4-P71 HydrophobicContact CD2-CB 3.92Å; Y4-P71 HydrophobicContact CE2-CB 4.47Å
5	E	43.4	Very low	46.2	Very low	119 Å²	119	79.4 Å²	79.4	56%	0.556	40%	0.402	S	S	*	.			trans	-83	147.7	172.4	-100	-174.2	160.2	0	0	111.5	W12	E5-W12 HydrophobicContact CG-CZ2 4.1Å
6	P	41.2	Very low	47.5	Very low	60 Å²	60	74.7 Å²	74.7	39%	0.39	38%	0.378	S	S	.	.	S	Bend		-103	161.1	97.8	30.9	-32.7	0	0	0	109.3	H8 L11	P6-H8 PolarHBondContact O-N 3.07Å; P6-L11 HydrophobicContact CG-CB 3.72Å; P6-L11 HydrophobicContact CG-CD1 3.78Å; P6-L11 HydrophobicContact CG-CG 4.37Å
7	A	43.4	Very low	48.6	Very low	68 Å²	68	72.6 Å²	72.6	56%	0.562	37%	0.37	S	S	*	.	S	Bend	trans	-44.9	2.5	-168.7	0	0	0	0	0	119.1
8	H	41.8	Very low	49.3	Very low	73 Å²	73	71 Å²	71	34%	0.338	36%	0.362	S	S	.	.			trans	-124.5	118.4	176.8	-58.2	-87	0	0	0	112.5	P6 H10 L11 N321	P6-H8 PolarHBondContact O-N 3.07Å; H8-H10 AromaticContact ND1-NE2 3.96Å; H8-H10 PolarHBondContact O-N 2.79Å; H8-L11 HydrophobicContact CB-CD1 4.12Å; H8-L11 WeakPolarHBondContact O-CB 3.3Å; H8-L11 PolarHBondContact O-N 2.86Å; H8-N321 VanDerWaalsContact CA-CG 3.4Å; H8-N321 WeakPolarHBondContact CA-ND2 3.29Å; H8-N321 VanDerWaalsContact CB-ND2 3.31Å; H8-N321 WeakPolarHBondContact CB-ND2 3.21Å
9	L	40.8	Very low	49.8	Very low	46 Å²	46	70.3 Å²	70.3	24%	0.241	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-43.1	-22.8	167.4	-92.1	113	0	0	0	115.9	L11 F319 N321	L9-L11 PolarHBondContact O-N 3.17Å; L9-F319 VanDerWaalsContact CD1-O 3.31Å; L9-F319 WeakPolarHBondContact CD1-O 3.41Å; L9-N321 WeakPolarHBondContact CB-OD1 3Å; L9-N321 WeakPolarHBondContact CD1-OD1 2.75Å; L9-N321 PolarHBondContact N-ND2 3.08Å; L9-N321 PolarHBondContact N-OD1 2.91Å
10	H	43	Very low	49.8	Very low	94 Å²	94	71 Å²	71	44%	0.435	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-70.9	-21.4	176.5	-19.6	-59.4	0	0	0	112.7	H8 R30 N321	H8-H10 AromaticContact ND1-NE2 3.96Å; H8-H10 PolarHBondContact O-N 2.79Å; H10-R30 PolarHBondContact O-NH2 2.79Å; H10-N321 PolarHBondContact CE1-ND2 2.9Å; H10-N321 PolarHBondContact ND1-ND2 3.46Å; H10-N321 PolarHBondContact NE2-ND2 3.24Å
11	L	43.9	Very low	49.8	Very low	93 Å²	93	72.9 Å²	72.9	49%	0.487	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-102.8	0.7	-173.1	-66.3	167.7	0	0	0	113.1	P6 H8 L9 K13	P6-L11 HydrophobicContact CG-CB 3.72Å; P6-L11 HydrophobicContact CG-CD1 3.78Å; P6-L11 HydrophobicContact CG-CG 4.37Å; H8-L11 HydrophobicContact CB-CD1 4.12Å; H8-L11 WeakPolarHBondContact O-CB 3.3Å; H8-L11 PolarHBondContact O-N 2.86Å; L9-L11 PolarHBondContact O-N 3.17Å; L11-K13 PolarHBondContact O-N 2.96Å
12	W	48.8	Very low	50.5	Low	54 Å²	54	66 Å²	66	21%	0.205	34%	0.34	C	S	.	.			trans	-66.2	108.2	177	-74.5	29.7	0	0	0	109.3	A3 E5 P29	A3-W12 HydrophobicContact CB-CD2 4.28Å; A3-W12 HydrophobicContact CB-CE3 3.66Å; A3-W12 HydrophobicContact CB-CH2 3.21Å; A3-W12 HydrophobicContact CB-CZ2 3.86Å; A3-W12 HydrophobicContact CB-CZ3 3.1Å; E5-W12 HydrophobicContact CG-CZ2 4.1Å; W12-P29 HydrophobicContact CB-CG 4.17Å
13	K	53.9	Low	51.1	Low	176 Å²	176	63.4 Å²	63.4	77%	0.765	33%	0.332	S	S	*	.			trans	-80.4	-31.6	-179	-69.3	-175.6	178.2	-178.8	0	112.3	L11	L11-K13 PolarHBondContact O-N 2.96Å
14	S	59.1	Low	52.1	Low	10 Å²	10	61.8 Å²	61.8	7%	0.07	32%	0.317	C	S	.	.			trans	-163.7	148.8	-175.9	47.1	0	0	0	0	113.2	F16 S26 I27	S14-F16 WeakPolarHBondContact OG-CE2 3.47Å; S14-F16 VanDerWaalsContact OG-CZ 3.26Å; S14-F16 WeakPolarHBondContact OG-CZ 3.09Å; S14-S26 WeakPolarHBondContact CB-OG 3.49Å; S14-I27 CarbonylContact C-O 3.59Å; S14-I27 WeakPolarHBondContact CA-O 3.04Å
15	I	66.7	Low	53.3	Low	33 Å²	33	59.3 Å²	59.3	17%	0.169	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.9	167.7	-63.1	170	0	0	0	107.6	V17 S26 I27 P29	I15-V17 HydrophobicContact CG2-CG2 4.48Å; I15-S26 CarbonylContact O-C 3.51Å; I15-S26 WeakPolarHBondContact O-CA 3.24Å; I15-I27 HydrophobicContact CB-CB 4.24Å; I15-I27 PolarHBondContact N-O 3.04Å; I15-I27 PolarHBondContact O-N 3.35Å; I15-P29 HydrophobicContact CD1-CB 3.99Å; I15-P29 HydrophobicContact CG1-CB 4.36Å
16	F	66.3	Low	54.5	Low	4 Å²	4	54.1 Å²	54.1	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.4	178.9	-63	-92.8	0	0	0	111.2	M1 F2 S14 I24 A25 I37 L77 P92	M1-F16 CarbonylContact C-O 3.47Å; M1-F16 VanDerWaalsContact CA-O 3.3Å; M1-F16 WeakPolarHBondContact CA-O 3.35Å; F2-F16 PolarHBondContact N-O 3.2Å; F2-F16 PolarHBondContact O-N 3.27Å; S14-F16 WeakPolarHBondContact OG-CE2 3.47Å; S14-F16 VanDerWaalsContact OG-CZ 3.26Å; S14-F16 WeakPolarHBondContact OG-CZ 3.09Å; F16-I24 HydrophobicContact CD1-CG2 4.02Å; F16-A25 CarbonylContact C-O 3.34Å; F16-A25 WeakPolarHBondContact CA-O 3.43Å; F16-I37 HydrophobicContact CD1-CD1 4.1Å; F16-I37 HydrophobicContact CE1-CD1 3.43Å; F16-I37 VanDerWaalsContact CE1-CD1 3.43Å; F16-I37 HydrophobicContact CZ-CD1 4.37Å; F16-L77 HydrophobicContact CD1-CD2 4.07Å; F16-L77 HydrophobicContact CE1-CD2 4.22Å; F16-L77 HydrophobicContact CG-CD1 4.45Å; F16-P92 HydrophobicContact CE1-CB 4.27Å; F16-P92 HydrophobicContact CE2-CB 4.25Å; F16-P92 HydrophobicContact CZ-CB 3.53Å; F16-P92 WeakPolarHBondContact CZ-O 3.23Å
17	V	66.2	Low	55.9	Low	39 Å²	39	53.5 Å²	53.5	24%	0.236	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.2	174.2	-175.5	0	0	0	0	108.5	M1 I15 I24 A25 I27	M1-V17 HydrophobicContact CG-CG2 4.21Å; I15-V17 HydrophobicContact CG2-CG2 4.48Å; V17-I24 WeakPolarHBondContact O-CA 3.32Å; V17-A25 PolarHBondContact N-O 3.35Å; V17-A25 PolarHBondContact O-N 2.98Å; V17-I27 HydrophobicContact CG2-CD1 3.48Å; V17-I27 VanDerWaalsContact CG2-CD1 3.48Å; V17-I27 HydrophobicContact CG2-CG1 4.12Å
18	I	61.5	Low	57.2	Low	44 Å²	44	52.5 Å²	52.5	23%	0.226	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.5	177	-53.4	171.4	0	0	0	106.4	F2 V23 I24 V69	F2-I18 HydrophobicContact CD2-CD1 4.43Å; F2-I18 HydrophobicContact CE2-CD1 4.14Å; I18-V23 WeakPolarHBondContact CA-O 3.24Å; I18-I24 HydrophobicContact CG1-CG1 4.28Å; I18-V69 HydrophobicContact CD1-CB 3.44Å; I18-V69 VanDerWaalsContact CD1-CB 3.44Å; I18-V69 HydrophobicContact CD1-CG1 4.05Å; I18-V69 HydrophobicContact CD1-CG2 3.22Å; I18-V69 HydrophobicContact CG1-CG2 4.49Å
19	T	59.5	Low	58.4	Low	57 Å²	57	51.4 Å²	51.4	35%	0.35	27%	0.265	S	S	.	.			trans	-85.4	164.4	178.8	68	0	0	0	0	111.2	N21 N22 V23	T19-N21 PolarHBondContact O-N 3.02Å; T19-N21 PolarHBondContact OG1-N 3.33Å; T19-N22 PolarHBondContact O-N 2.67Å; T19-V23 HydrophobicContact CG2-CB 4.22Å; T19-V23 PolarHBondContact N-O 2.83Å; T19-V23 WeakPolarHBondContact OG1-CB 3.4Å; T19-V23 PolarHBondContact OG1-N 2.64Å
20	E	48.7	Very low	59.7	Low	84 Å²	84	58.4 Å²	58.4	39%	0.393	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-22.1	171.6	-62.7	171.1	144.5	0	0	112.7	M58 K936	E20-M58 HydrophobicContact CG-CE 3.57Å; E20-M58 HydrophobicContact CG-SD 4.32Å; E20-M58 WeakPolarHBondContact OE1-CG 3.44Å; E20-K936 IonicContact OE2-NZ 3.19Å; E20-K936 PolarHBondContact OE2-NZ 3.42Å
21	N	49.7	Very low	61.2	Low	112 Å²	112	58.5 Å²	58.5	60%	0.599	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	20.2	178	-63.5	-5.8	0	0	0	112.7	T19 V23	T19-N21 PolarHBondContact O-N 3.02Å; T19-N21 PolarHBondContact OG1-N 3.33Å; N21-V23 PolarHBondContact O-N 2.84Å
22	N	51.2	Low	62.5	Low	24 Å²	24	56.3 Å²	56.3	13%	0.128	29%	0.292	C	S	.	.			trans	57.3	29.3	-179.8	-58.1	-31.6	0	0	0	114.6	T19 F40 Y67	T19-N22 PolarHBondContact O-N 2.67Å; N22-F40 HydrophobicContact CB-CB 4.28Å; N22-F40 WeakPolarHBondContact O-CD2 3.06Å; N22-Y67 VanDerWaalsContact CG-CE2 3.49Å; N22-Y67 WeakPolarHBondContact ND2-CE2 3.31Å; N22-Y67 PolarHBondContact ND2-OH 2.71Å; N22-Y67 WeakPolarHBondContact OD1-CD2 3.45Å; N22-Y67 WeakPolarHBondContact OD1-CE2 3.25Å
23	V	59.6	Low	63.6	Low	34 Å²	34	59.5 Å²	59.5	21%	0.206	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.2	171.3	-177.7	0	0	0	0	108	I18 T19 N21	I18-V23 WeakPolarHBondContact CA-O 3.24Å; T19-V23 HydrophobicContact CG2-CB 4.22Å; T19-V23 PolarHBondContact N-O 2.83Å; T19-V23 WeakPolarHBondContact OG1-CB 3.4Å; T19-V23 PolarHBondContact OG1-N 2.64Å; N21-V23 PolarHBondContact O-N 2.84Å
24	I	62.9	Low	64.4	Low	6 Å²	6	56.6 Å²	56.6	3%	0.031	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.2	172.4	-52.7	-175.5	0	0	0	107.9	F16 V17 I18 I37 F40 L77 C79 L90	F16-I24 HydrophobicContact CD1-CG2 4.02Å; V17-I24 WeakPolarHBondContact O-CA 3.32Å; I18-I24 HydrophobicContact CG1-CG1 4.28Å; I24-I37 PolarHBondContact O-N 2.85Å; I24-I37 VanDerWaalsContact O-N 3.15Å; I24-F40 HydrophobicContact CD1-CE2 3.95Å; I24-F40 HydrophobicContact CG1-CE2 4.32Å; I24-L77 HydrophobicContact CD1-CD2 4.02Å; I24-L77 HydrophobicContact CG2-CD2 3.96Å; I24-C79 HydrophobicContact CD1-CB 4.42Å; I24-L90 HydrophobicContact CD1-CD1 4.15Å
25	A	67.9	Low	64.6	Low	16 Å²	16	58.9 Å²	58.9	13%	0.132	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.7	173.3	0	0	0	0	0	109.6	F16 V17 I34	F16-A25 CarbonylContact C-O 3.34Å; F16-A25 WeakPolarHBondContact CA-O 3.43Å; V17-A25 PolarHBondContact N-O 3.35Å; V17-A25 PolarHBondContact O-N 2.98Å; A25-I34 HydrophobicContact CB-CG2 3.9Å
26	S	68.9	Low	64.3	Low	9 Å²	9	64.4 Å²	64.4	6%	0.063	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.5	170.7	131.2	0	0	0	0	107.6	S14 I15 I34 S35	S14-S26 WeakPolarHBondContact CB-OG 3.49Å; I15-S26 CarbonylContact O-C 3.51Å; I15-S26 WeakPolarHBondContact O-CA 3.24Å; S26-I34 CarbonylContact O-C 3.43Å; S26-I34 WeakPolarHBondContact O-CA 2.79Å; S26-S35 WeakPolarHBondContact CB-OG 3.49Å; S26-S35 PolarHBondContact N-O 2.63Å; S26-S35 PolarHBondContact O-N 2.65Å; S26-S35 PolarHBondContact O-OG 3.01Å; S26-S35 PolarHBondContact OG-OG 2.9Å
27	I	70.9	Confident	63.9	Low	47 Å²	47	65.4 Å²	65.4	24%	0.241	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.3	176.9	-53.2	179.9	0	0	0	107.1	S14 I15 V17 P29 E33 I34	S14-I27 CarbonylContact C-O 3.59Å; S14-I27 WeakPolarHBondContact CA-O 3.04Å; I15-I27 HydrophobicContact CB-CB 4.24Å; I15-I27 PolarHBondContact N-O 3.04Å; I15-I27 PolarHBondContact O-N 3.35Å; V17-I27 HydrophobicContact CG2-CD1 3.48Å; V17-I27 VanDerWaalsContact CG2-CD1 3.48Å; V17-I27 HydrophobicContact CG2-CG1 4.12Å; I27-P29 VanDerWaalsContact O-CD 3.28Å; I27-P29 WeakPolarHBondContact O-CD 3.48Å; I27-E33 WeakPolarHBondContact CA-O 3.25Å; I27-I34 HydrophobicContact CG1-CG1 4.31Å
28	N	69.8	Low	63.4	Low	48 Å²	48	65 Å²	65	26%	0.257	35%	0.348	S	S	.	.			trans	-73.4	115.6	173.4	178.3	-15.3	0	0	0	108.9	R30 N31 G32 E33	N28-R30 PolarHBondContact O-N 3.42Å; N28-R30 VanDerWaalsContact O-N 3.12Å; N28-R30 WeakPolarHBondContact OD1-CB 3.25Å; N28-R30 PolarHBondContact OD1-N 2.85Å; N28-N31 WeakPolarHBondContact CB-OD1 3.42Å; N28-N31 PolarHBondContact ND2-OD1 2.62Å; N28-G32 WeakPolarHBondContact O-CA 2.85Å; N28-G32 PolarHBondContact O-N 3.48Å; N28-E33 HydrophobicContact CB-CB 4.47Å; N28-E33 PolarHBondContact N-O 2.91Å
29	P	67.4	Low	62.7	Low	49 Å²	49	65.7 Å²	65.7	32%	0.318	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.9	-175.3	27.2	-34.5	0	0	0	113.9	W12 I15 I27	W12-P29 HydrophobicContact CB-CG 4.17Å; I15-P29 HydrophobicContact CD1-CB 3.99Å; I15-P29 HydrophobicContact CG1-CB 4.36Å; I27-P29 VanDerWaalsContact O-CD 3.28Å; I27-P29 WeakPolarHBondContact O-CD 3.48Å
30	R	67	Low	62.3	Low	194 Å²	194	65.4 Å²	65.4	73%	0.732	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-40.5	-179.1	-65.3	-174.8	179.3	-170.5	0.2	113.4	H10 N28	H10-R30 PolarHBondContact O-NH2 2.79Å; N28-R30 PolarHBondContact O-N 3.42Å; N28-R30 VanDerWaalsContact O-N 3.12Å; N28-R30 WeakPolarHBondContact OD1-CB 3.25Å; N28-R30 PolarHBondContact OD1-N 2.85Å
31	N	74.7	Confident	62	Low	95 Å²	95	69.5 Å²	69.5	51%	0.508	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-6.5	-175.1	64.5	-5.2	0	0	0	113.6	N28 E33	N28-N31 WeakPolarHBondContact CB-OD1 3.42Å; N28-N31 PolarHBondContact ND2-OD1 2.62Å; N31-E33 WeakPolarHBondContact ND2-CB 3.08Å; N31-E33 PolarHBondContact ND2-OE2 3.44Å; N31-E33 PolarHBondContact O-N 2.89Å; N31-E33 WeakPolarHBondContact OD1-CB 3.13Å; N31-E33 PolarHBondContact OD1-N 3.46Å
32	G	70.7	Confident	61.3	Low	47 Å²	47	69.2 Å²	69.2	49%	0.485	38%	0.378	S	S	.	.			trans	73.2	8.2	-175.8	0	0	0	0	0	113.9	N28 I34	N28-G32 WeakPolarHBondContact O-CA 2.85Å; N28-G32 PolarHBondContact O-N 3.48Å; G32-I34 PolarHBondContact O-N 3.49Å
33	E	72.7	Confident	60.4	Low	122 Å²	122	77.5 Å²	77.5	57%	0.57	41%	0.413	S	S	*	.			trans	-66.9	130.4	-179.9	-172.5	179.6	-176.7	0	0	110.3	I27 N28 N31	I27-E33 WeakPolarHBondContact CA-O 3.25Å; N28-E33 HydrophobicContact CB-CB 4.47Å; N28-E33 PolarHBondContact N-O 2.91Å; N31-E33 WeakPolarHBondContact ND2-CB 3.08Å; N31-E33 PolarHBondContact ND2-OE2 3.44Å; N31-E33 PolarHBondContact O-N 2.89Å; N31-E33 WeakPolarHBondContact OD1-CB 3.13Å; N31-E33 PolarHBondContact OD1-N 3.46Å
34	I	70.7	Confident	59.1	Low	115 Å²	115	80.4 Å²	80.4	59%	0.59	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	107.7	-178.7	-52.9	178.7	0	0	0	107.9	A25 S26 I27 G32	A25-I34 HydrophobicContact CB-CG2 3.9Å; S26-I34 CarbonylContact O-C 3.43Å; S26-I34 WeakPolarHBondContact O-CA 2.79Å; I27-I34 HydrophobicContact CG1-CG1 4.31Å; G32-I34 PolarHBondContact O-N 3.49Å
35	S	64.1	Low	57.8	Low	58 Å²	58	87 Å²	87	41%	0.406	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.1	166.6	55.9	0	0	0	0	109.7	S26 I37	S26-S35 WeakPolarHBondContact CB-OG 3.49Å; S26-S35 PolarHBondContact N-O 2.63Å; S26-S35 PolarHBondContact O-N 2.65Å; S26-S35 PolarHBondContact O-OG 3.01Å; S26-S35 PolarHBondContact OG-OG 2.9Å; S35-I37 PolarHBondContact O-N 3.09Å
36	K	59.7	Low	56.2	Low	148 Å²	148	92.5 Å²	92.5	64%	0.643	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	117.9	177.3	-170.3	177.2	-179.3	-178.5	0	108.6
37	I	57.8	Low	54.4	Low	25 Å²	25	96 Å²	96	13%	0.128	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-13.8	-176.1	-73	-175.6	0	0	0	112.1	F16 I24 S35 P92 G95	F16-I37 HydrophobicContact CD1-CD1 4.1Å; F16-I37 HydrophobicContact CE1-CD1 3.43Å; F16-I37 VanDerWaalsContact CE1-CD1 3.43Å; F16-I37 HydrophobicContact CZ-CD1 4.37Å; I24-I37 PolarHBondContact O-N 2.85Å; I24-I37 VanDerWaalsContact O-N 3.15Å; S35-I37 PolarHBondContact O-N 3.09Å; I37-P92 WeakPolarHBondContact CD1-O 3.44Å; I37-G95 VanDerWaalsContact CG2-CA 3.44Å
38	G	55.3	Low	52.4	Low	30 Å²	30	98.9 Å²	98.9	31%	0.309	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	155.8	159.6	169.9	0	0	0	0	0	112.4
39	A	48.5	Very low	50.5	Low	59 Å²	59	102.7 Å²	102.7	49%	0.488	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.6	124.3	169.4	0	0	0	0	0	108.8	F41	A39-F41 VanDerWaalsContact C-N 3.27Å; A39-F41 PolarHBondContact O-N 3.28Å
40	F	49.8	Very low	48.7	Very low	52 Å²	52	107.5 Å²	107.5	23%	0.228	61%	0.608	C	S	.	*			trans	-78.8	67.2	178	-80.7	-81.2	0	0	0	111.9	N22 I24 R81 E88 L90	N22-F40 HydrophobicContact CB-CB 4.28Å; N22-F40 WeakPolarHBondContact O-CD2 3.06Å; I24-F40 HydrophobicContact CD1-CE2 3.95Å; I24-F40 HydrophobicContact CG1-CE2 4.32Å; F40-R81 HydrophobicContact CD1-CB 4.26Å; F40-R81 HydrophobicContact CD1-CG 3.95Å; F40-R81 HydrophobicContact CE1-CB 4.08Å; F40-R81 HydrophobicContact CE1-CG 4.19Å; F40-E88 WeakPolarHBondContact CE1-OE2 3.37Å; F40-E88 WeakPolarHBondContact CZ-OE2 3.41Å; F40-L90 HydrophobicContact CE2-CD1 4.49Å; F40-L90 HydrophobicContact CZ-CD1 4.19Å
41	F	42.8	Very low	46.8	Very low	169 Å²	169	102.9 Å²	102.9	74%	0.741	60%	0.602	S	S	*	*			trans	-149.4	91.4	164.3	-72.7	-74.6	0	0	0	110.9	A39	A39-F41 VanDerWaalsContact C-N 3.27Å; A39-F41 PolarHBondContact O-N 3.28Å
42	S	34.7	Very low	44.6	Very low	106 Å²	106	103.9 Å²	103.9	74%	0.741	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-89.4	128.7	149.5	59.4	0	0	0	0	107.7
43	K	31.8	Very low	42.6	Very low	198 Å²	198	111.8 Å²	111.8	86%	0.861	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-55.2	133.4	174.1	-77.3	177.8	175	177.8	0	109	T45	K43-T45 PolarHBondContact O-N 3.24Å
44	P	32.8	Very low	40.4	Very low	96 Å²	96	116.6 Å²	116.6	62%	0.623	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-63.1	133.5	167.5	26.3	-30.1	0	0	0	108.4	N46	P44-N46 PolarHBondContact O-N 2.8Å
45	T	35.1	Very low	38.3	Very low	145 Å²	145	115.3 Å²	115.3	89%	0.89	65%	0.645	S	S	*	*	S	Bend	trans	-63.4	-0.5	177.7	31.8	0	0	0	0	114	K43	K43-T45 PolarHBondContact O-N 3.24Å
46	N	34.2	Very low	36.5	Very low	130 Å²	130	118.3 Å²	118.3	70%	0.695	66%	0.661	S	S	*	*	S	Bend	trans	-127.3	85.8	-179.5	-72.7	-14.5	0	0	0	112.2	P44 T48	P44-N46 PolarHBondContact O-N 2.8Å; N46-T48 VanDerWaalsContact C-N 3.25Å; N46-T48 PolarHBondContact O-N 2.72Å; N46-T48 PolarHBondContact O-OG1 2.95Å
47	G	31.6	Very low	34.8	Very low	84 Å²	84	120.3 Å²	120.3	87%	0.866	67%	0.67	S	S	*	*			trans	45.7	1.7	137.8	0	0	0	0	0	123.6
48	T	29.8	Very low	33.3	Very low	107 Å²	107	125.8 Å²	125.8	66%	0.656	70%	0.696	S	S	*	*			trans	-112.1	117.1	-174.8	47.9	0	0	0	0	111	N46 L50	N46-T48 VanDerWaalsContact C-N 3.25Å; N46-T48 PolarHBondContact O-N 2.72Å; N46-T48 PolarHBondContact O-OG1 2.95Å; T48-L50 PolarHBondContact O-N 3.27Å
49	P	29.4	Very low	31.8	Very low	127 Å²	127	127.9 Å²	127.9	83%	0.825	71%	0.71	S	S	*	*			trans	-80	112.2	177.9	30.2	-29	0	0	0	109.5
50	L	30.3	Very low	30.6	Very low	151 Å²	151	132 Å²	132	79%	0.791	73%	0.734	S	S	*	*			trans	-83.7	123.9	164.2	-81.6	161.3	0	0	0	109	T48	T48-L50 PolarHBondContact O-N 3.27Å
51	T	27.1	Very low	29.5	Very low	97 Å²	97	133.5 Å²	133.5	60%	0.595	76%	0.764	S	S	*	*			trans	-61.9	132.4	178.7	39.4	0	0	0	0	111.3	Y53	T51-Y53 PolarHBondContact O-N 3.24Å; T51-Y53 VanDerWaalsContact O-N 3.14Å
52	P	27.7	Very low	28.8	Very low	115 Å²	115	128.7 Å²	128.7	75%	0.747	75%	0.751	S	S	*	*			trans	-72.8	106.8	171.2	28.6	-29.9	0	0	0	108.8	Y54	P52-Y54 PolarHBondContact O-N 3.46Å
53	Y	29.4	Very low	28.4	Very low	213 Å²	213	127.7 Å²	127.7	84%	0.835	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-70.9	119.9	169.5	-79.2	-87.9	0	0	0	109.5	T51 C55	T51-Y53 PolarHBondContact O-N 3.24Å; T51-Y53 VanDerWaalsContact O-N 3.14Å; Y53-C55 PolarHBondContact O-N 3.17Å
54	Y	26	Very low	28.3	Very low	224 Å²	224	121.7 Å²	121.7	88%	0.878	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-59.8	121.8	176.2	-78.5	-98.1	0	0	0	111.3	P52	P52-Y54 PolarHBondContact O-N 3.46Å
55	C	27.3	Very low	28.3	Very low	88 Å²	88	123.7 Å²	123.7	60%	0.595	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-91.9	120.3	165.6	-126.8	0	0	0	0	108.8	Y53	Y53-C55 PolarHBondContact O-N 3.17Å
56	T	24.9	Very low	28.6	Very low	121 Å²	121	121.4 Å²	121.4	74%	0.742	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-103.6	135.9	174.6	45.6	0	0	0	0	110.8
57	K	25.1	Very low	29.1	Very low	190 Å²	190	118.2 Å²	118.2	83%	0.826	69%	0.689	S	S	*	*			trans	84	100.3	170.8	-69	-178.4	172.2	179.6	0	117.5
58	M	24.9	Very low	29.7	Very low	140 Å²	140	115.6 Å²	115.6	69%	0.69	66%	0.657	S	S	*	*			trans	-90.2	107.9	154.1	-97.9	179.2	167.4	0	0	109.6	E20	E20-M58 HydrophobicContact CG-CE 3.57Å; E20-M58 HydrophobicContact CG-SD 4.32Å; E20-M58 WeakPolarHBondContact OE1-CG 3.44Å
59	A	24.3	Very low	30.6	Very low	73 Å²	73	111 Å²	111	60%	0.603	63%	0.629	S	S	*	*			trans	-141.4	132.2	152.7	0	0	0	0	0	106.8	G61 S62	A59-G61 PolarHBondContact O-N 3.16Å; A59-S62 PolarHBondContact O-OG 2.96Å
60	C	23.9	Very low	31.7	Very low	147 Å²	147	107.2 Å²	107.2	99%	0.993	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-36.3	121.9	-174.7	-88	0	0	0	0	113.8
61	G	25.6	Very low	32.8	Very low	82 Å²	82	102 Å²	102	85%	0.845	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	104.7	-1.7	162.7	0	0	0	0	0	118.1	A59	A59-G61 PolarHBondContact O-N 3.16Å
62	S	28.1	Very low	33.9	Very low	69 Å²	69	97.4 Å²	97.4	48%	0.483	55%	0.548	S	S	.	.			trans	-108	116.4	-173.5	57.6	0	0	0	0	114.9	A59 S64	A59-S62 PolarHBondContact O-OG 2.96Å; S62-S64 PolarHBondContact O-N 3.08Å
63	S	28.1	Very low	35.1	Very low	85 Å²	85	98.9 Å²	98.9	59%	0.594	55%	0.548	S	S	*	.	S	Bend	trans	23.8	71.3	145.4	64.8	0	0	0	0	120.4
64	S	29.3	Very low	36.2	Very low	72 Å²	72	91.7 Å²	91.7	50%	0.503	53%	0.526	S	S	.	.			trans	-160.2	32.5	153.2	73.6	0	0	0	0	114.3	S62 K66	S62-S64 PolarHBondContact O-N 3.08Å; S64-K66 VanDerWaalsContact C-N 3.32Å; S64-K66 PolarHBondContact O-N 2.9Å
65	N	33.2	Very low	37.6	Very low	138 Å²	138	84.7 Å²	84.7	74%	0.738	52%	0.515	S	S	*	.			trans	-72.7	81.1	-178	-72.7	-16.3	0	0	0	111.6	Y67	N65-Y67 PolarHBondContact O-N 3.33Å
66	K	40.2	Very low	39.4	Very low	96 Å²	96	80.5 Å²	80.5	42%	0.417	49%	0.487	S	S	.	.			trans	-75.5	-4	170.1	-70.8	-163.1	175.3	-156	0	113.3	S64 D109	S64-K66 VanDerWaalsContact C-N 3.32Å; S64-K66 PolarHBondContact O-N 2.9Å; K66-D109 IonicContact NZ-OD1 2.95Å; K66-D109 PolarHBondContact NZ-OD1 3.27Å; K66-D109 IonicContact NZ-OD2 3.61Å; K66-D109 PolarHBondContact NZ-OD2 3.37Å
67	Y	44	Very low	41.5	Very low	63 Å²	63	75 Å²	75	25%	0.247	45%	0.452	C	S	.	.			trans	-141.2	108.6	-179.2	-58.8	-81.8	0	0	0	110.5	N22 N65 V80	N22-Y67 VanDerWaalsContact CG-CE2 3.49Å; N22-Y67 WeakPolarHBondContact ND2-CE2 3.31Å; N22-Y67 PolarHBondContact ND2-OH 2.71Å; N22-Y67 WeakPolarHBondContact OD1-CD2 3.45Å; N22-Y67 WeakPolarHBondContact OD1-CE2 3.25Å; N65-Y67 PolarHBondContact O-N 3.33Å; Y67-V80 WeakPolarHBondContact CD1-O 3.5Å; Y67-V80 VanDerWaalsContact CE1-O 3.26Å; Y67-V80 WeakPolarHBondContact CE1-O 3.45Å
68	C	45.6	Very low	43.6	Very low	29 Å²	29	66 Å²	66	20%	0.196	41%	0.414	C	S	.	.			trans	-84.4	128.4	167.1	-78.1	0	0	0	0	108.3	I111 L113	C68-I111 PolarHBondContact SG-O 3.19Å; C68-L113 HydrophobicContact CB-CB 3.91Å; C68-L113 HydrophobicContact CB-CD1 4.03Å; C68-L113 HydrophobicContact CB-CG 3.72Å; C68-L113 VanDerWaalsContact O-CD1 3.28Å; C68-L113 WeakPolarHBondContact O-CD1 3.05Å
69	V	48.9	Very low	45.7	Very low	11 Å²	11	59.6 Å²	59.6	7%	0.067	38%	0.382	C	S	.	.			trans	-118.8	127.2	165.2	170.9	0	0	0	0	108.4	F2 I18 L77 L78 C79	F2-V69 HydrophobicContact CE2-CB 4.23Å; F2-V69 WeakPolarHBondContact CZ-O 3.43Å; I18-V69 HydrophobicContact CD1-CB 3.44Å; I18-V69 VanDerWaalsContact CD1-CB 3.44Å; I18-V69 HydrophobicContact CD1-CG1 4.05Å; I18-V69 HydrophobicContact CD1-CG2 3.22Å; I18-V69 HydrophobicContact CG1-CG2 4.49Å; V69-L77 HydrophobicContact CG1-CD1 3.28Å; V69-L77 HydrophobicContact CG1-CD2 4.31Å; V69-L77 HydrophobicContact CG1-CG 3.69Å; V69-L78 WeakPolarHBondContact CA-O 3.25Å; V69-L78 WeakPolarHBondContact CG1-O 2.97Å; V69-C79 HydrophobicContact CG2-CB 3.83Å
70	M	52.5	Low	47.8	Very low	48 Å²	48	56.4 Å²	56.4	24%	0.236	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-125.2	129.8	178.8	-170	171.5	172.6	0	0	109.2	P72 L78 L114 N115	M70-P72 WeakPolarHBondContact O-CD 3.18Å; M70-L78 PolarHBondContact N-O 3.13Å; M70-L78 PolarHBondContact O-N 2.85Å; M70-L78 VanDerWaalsContact O-N 3.17Å; M70-L114 VanDerWaalsContact SD-C 3.51Å; M70-N115 HydrophobicContact CE-CB 3.46Å; M70-N115 VanDerWaalsContact CE-CB 3.46Å; M70-N115 VanDerWaalsContact CE-N 3.26Å; M70-N115 WeakPolarHBondContact CE-O 3.25Å; M70-N115 HydrophobicContact SD-CB 3.59Å; M70-N115 VanDerWaalsContact SD-CB 3.59Å; M70-N115 PolarHBondContact SD-N 3.43Å
71	P	52.5	Low	49.8	Very low	40 Å²	40	53.8 Å²	53.8	26%	0.26	33%	0.325	S	S	.	.			trans	-76.4	113.5	167.3	27.4	-28.5	0	0	0	109.6	Y4	Y4-P71 HydrophobicContact CD2-CB 3.92Å; Y4-P71 HydrophobicContact CE2-CB 4.47Å
72	P	51.4	Low	51.4	Low	2 Å²	2	51.5 Å²	51.5	1%	0.013	30%	0.301	C	S	.	.			trans	-70.2	141.7	165.9	25.1	-35.1	0	0	0	111.6	M70 V74 G76 L78 N115	M70-P72 WeakPolarHBondContact O-CD 3.18Å; P72-V74 PolarHBondContact O-N 3.09Å; P72-G76 WeakPolarHBondContact CD-O 3.36Å; P72-G76 WeakPolarHBondContact CG-O 3.2Å; P72-L78 HydrophobicContact CB-CD1 4.37Å; P72-L78 HydrophobicContact CG-CD1 4.04Å; P72-N115 VanDerWaalsContact CA-ND2 3.31Å; P72-N115 WeakPolarHBondContact CA-ND2 2.76Å
73	I	51	Low	53	Low	145 Å²	145	54.6 Å²	54.6	74%	0.744	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-12.7	169.3	-62.9	165.9	0	0	0	111.2
74	V	54.3	Low	54.6	Low	62 Å²	62	50.8 Å²	50.8	38%	0.376	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	92.5	179.2	-167.4	0	0	0	0	109.6	P72 G76	P72-V74 PolarHBondContact O-N 3.09Å; V74-G76 PolarHBondContact O-N 3.14Å
75	A	55.2	Low	56.5	Low	77 Å²	77	49.5 Å²	49.5	64%	0.636	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	41.7	152.4	0	0	0	0	0	119.9
76	G	64.5	Low	58.4	Low	1 Å²	1	44 Å²	44	1%	0.01	24%	0.242	C	C	.	.			trans	-169.7	177.5	178.2	0	0	0	0	0	116.6	P72 V74 N89 L90	P72-G76 WeakPolarHBondContact CD-O 3.36Å; P72-G76 WeakPolarHBondContact CG-O 3.2Å; V74-G76 PolarHBondContact O-N 3.14Å; G76-N89 WeakPolarHBondContact CA-OD1 3.43Å; G76-L90 CarbonylContact C-O 3.58Å; G76-L90 WeakPolarHBondContact CA-O 3.35Å
77	L	68.3	Low	60.2	Low	4 Å²	4	39.4 Å²	39.4	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	104	170.4	-178.1	78.5	0	0	0	106.9	F16 I24 V69 N89 L90	F16-L77 HydrophobicContact CD1-CD2 4.07Å; F16-L77 HydrophobicContact CE1-CD2 4.22Å; F16-L77 HydrophobicContact CG-CD1 4.45Å; I24-L77 HydrophobicContact CD1-CD2 4.02Å; I24-L77 HydrophobicContact CG2-CD2 3.96Å; V69-L77 HydrophobicContact CG1-CD1 3.28Å; V69-L77 HydrophobicContact CG1-CD2 4.31Å; V69-L77 HydrophobicContact CG1-CG 3.69Å; L77-N89 PolarHBondContact N-OD1 3.29Å; L77-L90 HydrophobicContact CB-CB 4.28Å; L77-L90 WeakPolarHBondContact CB-O 3.5Å; L77-L90 HydrophobicContact CD2-CD1 4.49Å; L77-L90 PolarHBondContact N-O 3.44Å; L77-L90 PolarHBondContact O-N 3.05Å
78	L	70.5	Confident	61.8	Low	2 Å²	2	37 Å²	37	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	131.4	-179.2	-81.2	144.6	0	0	0	110.5	V69 M70 P72 L87 E88 N89 W99 L113 V120	V69-L78 WeakPolarHBondContact CA-O 3.25Å; V69-L78 WeakPolarHBondContact CG1-O 2.97Å; M70-L78 PolarHBondContact N-O 3.13Å; M70-L78 PolarHBondContact O-N 2.85Å; M70-L78 VanDerWaalsContact O-N 3.17Å; P72-L78 HydrophobicContact CB-CD1 4.37Å; P72-L78 HydrophobicContact CG-CD1 4.04Å; L78-L87 HydrophobicContact CD2-CD1 3.89Å; L78-L87 HydrophobicContact CD2-CD2 4.06Å; L78-L87 HydrophobicContact CD2-CG 3.95Å; L78-E88 CarbonylContact C-O 3.56Å; L78-E88 VanDerWaalsContact CA-O 3.32Å; L78-E88 WeakPolarHBondContact CA-O 3.21Å; L78-N89 HydrophobicContact CD2-CB 4.42Å; L78-W99 HydrophobicContact CD2-CH2 3.59Å; L78-W99 HydrophobicContact CD2-CZ2 3.91Å; L78-L113 HydrophobicContact CB-CD1 4.11Å; L78-V120 HydrophobicContact CD1-CB 4.36Å; L78-V120 HydrophobicContact CD1-CG1 3.92Å; L78-V120 HydrophobicContact CD1-CG2 3.47Å; L78-V120 VanDerWaalsContact CD1-CG2 3.47Å; L78-V120 HydrophobicContact CD2-CG1 4.14Å; L78-V120 HydrophobicContact CD2-CG2 4.35Å
79	C	68.8	Low	63.3	Low	5 Å²	5	35.8 Å²	35.8	3%	0.034	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	166	174.6	64.3	0	0	0	0	110.6	I24 V69 E88	I24-C79 HydrophobicContact CD1-CB 4.42Å; V69-C79 HydrophobicContact CG2-CB 3.83Å; C79-E88 PolarHBondContact N-O 2.8Å; C79-E88 PolarHBondContact O-N 3.28Å
80	V	67.5	Low	64.4	Low	7 Å²	7	35.9 Å²	35.9	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118.7	-179.6	-172.5	0	0	0	0	109.7	Y67 G84 V86 L87 L103 I111 L113	Y67-V80 WeakPolarHBondContact CD1-O 3.5Å; Y67-V80 VanDerWaalsContact CE1-O 3.26Å; Y67-V80 WeakPolarHBondContact CE1-O 3.45Å; V80-G84 VanDerWaalsContact CG1-CA 3.48Å; V80-V86 CarbonylContact C-O 3.59Å; V80-V86 VanDerWaalsContact CA-O 3.27Å; V80-V86 WeakPolarHBondContact CA-O 3.27Å; V80-V86 WeakPolarHBondContact CG1-O 3.42Å; V80-L87 HydrophobicContact CG2-CD1 4.01Å; V80-L103 HydrophobicContact CG1-CD1 3.83Å; V80-L103 HydrophobicContact CG2-CD1 4.44Å; V80-I111 HydrophobicContact CG1-CD1 4.04Å; V80-I111 HydrophobicContact CG2-CG2 4.48Å; V80-L113 HydrophobicContact CG2-CD1 3.97Å; V80-L113 HydrophobicContact CG2-CD2 4.27Å; V80-L113 HydrophobicContact CG2-CG 4.34Å
81	R	66.2	Low	65.2	Low	92 Å²	92	36.5 Å²	36.5	35%	0.347	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	156.2	177.9	-178.8	174.6	61.5	97.5	-4.9	111.5	F40 T85 V86 E88 E100	F40-R81 HydrophobicContact CD1-CB 4.26Å; F40-R81 HydrophobicContact CD1-CG 3.95Å; F40-R81 HydrophobicContact CE1-CB 4.08Å; F40-R81 HydrophobicContact CE1-CG 4.19Å; R81-T85 PolarHBondContact O-N 2.78Å; R81-T85 VanDerWaalsContact O-N 3.12Å; R81-T85 PolarHBondContact O-OG1 3.49Å; R81-V86 HydrophobicContact CB-CB 4.31Å; R81-V86 PolarHBondContact N-O 3.08Å; R81-V86 PolarHBondContact O-N 3.47Å; R81-V86 VanDerWaalsContact O-N 3.1Å; R81-E88 HydrophobicContact CB-CG 4.47Å; R81-E88 WeakPolarHBondContact CB-OE1 3.33Å; R81-E88 WeakPolarHBondContact CD-OE1 3.42Å; R81-E88 IonicContact CZ-OE1 2.99Å; R81-E88 IonicContact NE-OE1 3.5Å; R81-E88 PolarHBondContact NE-OE1 3.37Å; R81-E88 IonicContact NH2-OE1 3.56Å; R81-E100 IonicContact NH2-OE2 3.51Å; R81-E100 PolarHBondContact NH2-OE2 3.3Å
82	G	59.6	Low	65.6	Low	34 Å²	34	35.7 Å²	35.7	35%	0.351	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	50.5	164.6	0	0	0	0	0	114.6	G84 T85	G82-G84 VanDerWaalsContact C-N 3.26Å; G82-G84 PolarHBondContact O-N 3.08Å; G82-T85 WeakPolarHBondContact CA-OG1 3.27Å; G82-T85 WeakPolarHBondContact O-CB 3.33Å; G82-T85 WeakPolarHBondContact O-CG2 3.37Å; G82-T85 PolarHBondContact O-N 3.42Å; G82-T85 PolarHBondContact O-OG1 2.85Å
83	H	60.8	Low	66	Low	134 Å²	134	40 Å²	40	62%	0.62	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	36.1	-178.5	-71.1	-88.3	0	0	0	114
84	G	62.8	Low	66.6	Low	4 Å²	4	37 Å²	37	4%	0.041	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	10.4	178.7	0	0	0	0	0	115.6	V80 G82 L103	V80-G84 VanDerWaalsContact CG1-CA 3.48Å; G82-G84 VanDerWaalsContact C-N 3.26Å; G82-G84 PolarHBondContact O-N 3.08Å; G84-L103 VanDerWaalsContact O-CB 3.23Å; G84-L103 WeakPolarHBondContact O-CB 2.91Å
85	T	68.1	Low	67	Low	45 Å²	45	34.9 Å²	34.9	28%	0.276	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-19.6	-171.5	54.1	0	0	0	0	115	R81 G82 L103 V105	R81-T85 PolarHBondContact O-N 2.78Å; R81-T85 VanDerWaalsContact O-N 3.12Å; R81-T85 PolarHBondContact O-OG1 3.49Å; G82-T85 WeakPolarHBondContact CA-OG1 3.27Å; G82-T85 WeakPolarHBondContact O-CB 3.33Å; G82-T85 WeakPolarHBondContact O-CG2 3.37Å; G82-T85 PolarHBondContact O-N 3.42Å; G82-T85 PolarHBondContact O-OG1 2.85Å; T85-L103 CarbonylContact C-O 3.58Å; T85-L103 WeakPolarHBondContact CA-O 3.46Å; T85-L103 CarbonylContact O-C 3.51Å; T85-L103 WeakPolarHBondContact O-CA 2.96Å; T85-L103 PolarHBondContact O-N 2.7Å; T85-V105 HydrophobicContact CG2-CG2 4.48Å
86	V	74.7	Confident	67.6	Low	22 Å²	22	35.6 Å²	35.6	13%	0.133	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	125	-178.5	-175.4	0	0	0	0	109.5	V80 R81 E88 E100	V80-V86 CarbonylContact C-O 3.59Å; V80-V86 VanDerWaalsContact CA-O 3.27Å; V80-V86 WeakPolarHBondContact CA-O 3.27Å; V80-V86 WeakPolarHBondContact CG1-O 3.42Å; R81-V86 HydrophobicContact CB-CB 4.31Å; R81-V86 PolarHBondContact N-O 3.08Å; R81-V86 PolarHBondContact O-N 3.47Å; R81-V86 VanDerWaalsContact O-N 3.1Å; V86-E88 HydrophobicContact CG1-CG 4.01Å; V86-E100 HydrophobicContact CG1-CB 3.93Å
87	L	78.1	Confident	68.1	Low	0 Å²	0	39 Å²	39	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.4	168.2	-176.1	68.5	0	0	0	108.5	L78 V80 W99 E100 A101 L103 L113 V122 F131	L78-L87 HydrophobicContact CD2-CD1 3.89Å; L78-L87 HydrophobicContact CD2-CD2 4.06Å; L78-L87 HydrophobicContact CD2-CG 3.95Å; V80-L87 HydrophobicContact CG2-CD1 4.01Å; L87-W99 HydrophobicContact CD2-CH2 3.75Å; L87-W99 HydrophobicContact CD2-CZ3 3.88Å; L87-W99 HydrophobicContact CG-CH2 4.15Å; L87-W99 HydrophobicContact CG-CZ3 4.02Å; L87-E100 CarbonylContact O-C 3.48Å; L87-E100 VanDerWaalsContact O-CA 3.26Å; L87-E100 WeakPolarHBondContact O-CA 3.45Å; L87-A101 HydrophobicContact CB-CB 4.42Å; L87-A101 PolarHBondContact N-O 2.83Å; L87-A101 PolarHBondContact O-N 3.48Å; L87-L103 HydrophobicContact CB-CD1 3.91Å; L87-L103 HydrophobicContact CB-CG 4.05Å; L87-L113 HydrophobicContact CD1-CD1 3.98Å; L87-L113 HydrophobicContact CD1-CD2 3.72Å; L87-V122 HydrophobicContact CD1-CG2 4.49Å; L87-V122 HydrophobicContact CD2-CG2 3.95Å; L87-F131 HydrophobicContact CD2-CD2 3.94Å; L87-F131 HydrophobicContact CD2-CE2 4.18Å; L87-F131 HydrophobicContact CD2-CG 4.12Å
88	E	76.3	Confident	68.4	Low	13 Å²	13	42 Å²	42	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.8	179.1	-68.4	-176.5	-176	0	0	110.5	F40 L78 C79 R81 V86 L97 E100	F40-E88 WeakPolarHBondContact CE1-OE2 3.37Å; F40-E88 WeakPolarHBondContact CZ-OE2 3.41Å; L78-E88 CarbonylContact C-O 3.56Å; L78-E88 VanDerWaalsContact CA-O 3.32Å; L78-E88 WeakPolarHBondContact CA-O 3.21Å; C79-E88 PolarHBondContact N-O 2.8Å; C79-E88 PolarHBondContact O-N 3.28Å; R81-E88 HydrophobicContact CB-CG 4.47Å; R81-E88 WeakPolarHBondContact CB-OE1 3.33Å; R81-E88 WeakPolarHBondContact CD-OE1 3.42Å; R81-E88 IonicContact CZ-OE1 2.99Å; R81-E88 IonicContact NE-OE1 3.5Å; R81-E88 PolarHBondContact NE-OE1 3.37Å; R81-E88 IonicContact NH2-OE1 3.56Å; V86-E88 HydrophobicContact CG1-CG 4.01Å; E88-L97 HydrophobicContact CB-CD1 3.67Å; E88-L97 HydrophobicContact CG-CD1 3.76Å; E88-E100 HydrophobicContact CG-CB 4.24Å
89	N	77.3	Confident	69.1	Low	4 Å²	4	43.2 Å²	43.2	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.2	167.7	-174.3	20.6	0	0	0	108.8	G76 L77 L78 S98 W99	G76-N89 WeakPolarHBondContact CA-OD1 3.43Å; L77-N89 PolarHBondContact N-OD1 3.29Å; L78-N89 HydrophobicContact CD2-CB 4.42Å; N89-S98 VanDerWaalsContact CB-OG 3.25Å; N89-S98 WeakPolarHBondContact CB-OG 3.29Å; N89-S98 PolarHBondContact ND2-OG 3.38Å; N89-S98 PolarHBondContact O-N 2.79Å; N89-S98 PolarHBondContact O-OG 2.82Å; N89-W99 HydrophobicContact CB-CD2 3.69Å; N89-W99 HydrophobicContact CB-CE3 4.24Å; N89-W99 HydrophobicContact CB-CG 4.1Å; N89-W99 HydrophobicContact CB-CH2 4.25Å; N89-W99 HydrophobicContact CB-CZ2 3.71Å; N89-W99 HydrophobicContact CB-CZ3 4.49Å; N89-W99 PolarHBondContact N-O 2.86Å; N89-W99 PolarHBondContact ND2-NE1 2.82Å
90	L	72	Confident	69.9	Low	13 Å²	13	48 Å²	48	7%	0.068	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143	-179.5	-59.3	171.6	0	0	0	110	I24 F40 G76 L77 P92 L97	I24-L90 HydrophobicContact CD1-CD1 4.15Å; F40-L90 HydrophobicContact CE2-CD1 4.49Å; F40-L90 HydrophobicContact CZ-CD1 4.19Å; G76-L90 CarbonylContact C-O 3.58Å; G76-L90 WeakPolarHBondContact CA-O 3.35Å; L77-L90 HydrophobicContact CB-CB 4.28Å; L77-L90 WeakPolarHBondContact CB-O 3.5Å; L77-L90 HydrophobicContact CD2-CD1 4.49Å; L77-L90 PolarHBondContact N-O 3.44Å; L77-L90 PolarHBondContact O-N 3.05Å; L90-P92 WeakPolarHBondContact O-CD 3.48Å; L90-L97 HydrophobicContact CD2-CB 4.31Å; L90-L97 HydrophobicContact CD2-CD1 4.08Å
91	N	68.6	Low	70.6	Confident	60 Å²	60	48 Å²	48	32%	0.321	27%	0.274	S	S	.	.			trans	-68.3	119.5	168.4	-176.8	-31.3	0	0	0	108.8	S93 T94 G95 V96	N91-S93 PolarHBondContact O-N 3.33Å; N91-S93 PolarHBondContact OD1-N 3.39Å; N91-S93 PolarHBondContact OD1-OG 2.92Å; N91-T94 WeakPolarHBondContact CB-OG1 3.47Å; N91-T94 PolarHBondContact O-N 2.7Å; N91-G95 WeakPolarHBondContact O-CA 3.16Å; N91-G95 PolarHBondContact O-N 3.22Å; N91-V96 WeakPolarHBondContact CB-O 3.24Å; N91-V96 PolarHBondContact N-O 3.49Å
92	P	61.7	Low	71.3	Confident	23 Å²	23	48.6 Å²	48.6	15%	0.149	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.3	-175.3	23.7	-33.2	0	0	0	113.7	F16 I37 L90	F16-P92 HydrophobicContact CE1-CB 4.27Å; F16-P92 HydrophobicContact CE2-CB 4.25Å; F16-P92 HydrophobicContact CZ-CB 3.53Å; F16-P92 WeakPolarHBondContact CZ-O 3.23Å; I37-P92 WeakPolarHBondContact CD1-O 3.44Å; L90-P92 WeakPolarHBondContact O-CD 3.48Å
93	S	59.3	Low	71.9	Confident	93 Å²	93	47.1 Å²	47.1	65%	0.65	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-34.3	-178.1	64.9	0	0	0	0	113.8	N91	N91-S93 PolarHBondContact O-N 3.33Å; N91-S93 PolarHBondContact OD1-N 3.39Å; N91-S93 PolarHBondContact OD1-OG 2.92Å
94	T	64.1	Low	72.2	Confident	83 Å²	83	47.8 Å²	47.8	51%	0.509	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-15.9	-175.3	59.7	0	0	0	0	113.7	N91 V96	N91-T94 WeakPolarHBondContact CB-OG1 3.47Å; N91-T94 PolarHBondContact O-N 2.7Å; T94-V96 PolarHBondContact O-N 2.91Å; T94-V96 WeakPolarHBondContact OG1-CB 3.22Å; T94-V96 WeakPolarHBondContact OG1-CG2 3.48Å; T94-V96 PolarHBondContact OG1-N 2.79Å
95	G	63.9	Low	71.9	Confident	16 Å²	16	53.5 Å²	53.5	17%	0.165	31%	0.312	C	S	.	.			trans	70	5.4	-169.4	0	0	0	0	0	114.9	I37 N91	I37-G95 VanDerWaalsContact CG2-CA 3.44Å; N91-G95 WeakPolarHBondContact O-CA 3.16Å; N91-G95 PolarHBondContact O-N 3.22Å
96	V	67.6	Low	71.3	Confident	92 Å²	92	52.2 Å²	52.2	56%	0.558	30%	0.304	S	S	*	.			trans	-73.9	132.3	179.4	177.3	0	0	0	0	109.5	N91 T94 S98	N91-V96 WeakPolarHBondContact CB-O 3.24Å; N91-V96 PolarHBondContact N-O 3.49Å; T94-V96 PolarHBondContact O-N 2.91Å; T94-V96 WeakPolarHBondContact OG1-CB 3.22Å; T94-V96 WeakPolarHBondContact OG1-CG2 3.48Å; T94-V96 PolarHBondContact OG1-N 2.79Å; V96-S98 PolarHBondContact O-N 3.44Å
97	L	74.2	Confident	70.3	Confident	74 Å²	74	62.4 Å²	62.4	39%	0.387	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	121	172.9	-175.5	73	0	0	0	110.4	E88 L90 W99 E100	E88-L97 HydrophobicContact CB-CD1 3.67Å; E88-L97 HydrophobicContact CG-CD1 3.76Å; L90-L97 HydrophobicContact CD2-CB 4.31Å; L90-L97 HydrophobicContact CD2-CD1 4.08Å; L97-W99 WeakPolarHBondContact CD1-O 2.92Å; L97-E100 HydrophobicContact CD1-CB 4.39Å; L97-E100 HydrophobicContact CD2-CB 4.25Å; L97-E100 HydrophobicContact CD2-CG 4.32Å
98	S	75.2	Confident	69.2	Low	66 Å²	66	64.4 Å²	64.4	46%	0.462	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-42.4	174.6	64.7	0	0	0	0	112	N89 V96	N89-S98 VanDerWaalsContact CB-OG 3.25Å; N89-S98 WeakPolarHBondContact CB-OG 3.29Å; N89-S98 PolarHBondContact ND2-OG 3.38Å; N89-S98 PolarHBondContact O-N 2.79Å; N89-S98 PolarHBondContact O-OG 2.82Å; V96-S98 PolarHBondContact O-N 3.44Å
99	W	84.6	Confident	68.1	Low	27 Å²	27	68.9 Å²	68.9	10%	0.102	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	153.9	174.4	56.3	-106	0	0	0	109.3	L78 L87 N89 L97 A101 A133 G136	L78-W99 HydrophobicContact CD2-CH2 3.59Å; L78-W99 HydrophobicContact CD2-CZ2 3.91Å; L87-W99 HydrophobicContact CD2-CH2 3.75Å; L87-W99 HydrophobicContact CD2-CZ3 3.88Å; L87-W99 HydrophobicContact CG-CH2 4.15Å; L87-W99 HydrophobicContact CG-CZ3 4.02Å; N89-W99 HydrophobicContact CB-CD2 3.69Å; N89-W99 HydrophobicContact CB-CE3 4.24Å; N89-W99 HydrophobicContact CB-CG 4.1Å; N89-W99 HydrophobicContact CB-CH2 4.25Å; N89-W99 HydrophobicContact CB-CZ2 3.71Å; N89-W99 HydrophobicContact CB-CZ3 4.49Å; N89-W99 PolarHBondContact N-O 2.86Å; N89-W99 PolarHBondContact ND2-NE1 2.82Å; L97-W99 WeakPolarHBondContact CD1-O 2.92Å; W99-A101 HydrophobicContact CE3-CB 4.22Å; W99-A101 HydrophobicContact CZ3-CB 3.87Å; W99-A133 PolarHBondContact NE1-O 3.26Å; W99-A133 VanDerWaalsContact NE1-O 3.08Å; W99-G136 VanDerWaalsContact CD2-CA 3.45Å; W99-G136 VanDerWaalsContact CE3-CA 3.41Å
100	E	85.1	Confident	67.2	Low	107 Å²	107	74.2 Å²	74.2	50%	0.5	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.7	168.8	61.9	177.3	179.5	0	0	109.8	R81 V86 L87 E88 L97	R81-E100 IonicContact NH2-OE2 3.51Å; R81-E100 PolarHBondContact NH2-OE2 3.3Å; V86-E100 HydrophobicContact CG1-CB 3.93Å; L87-E100 CarbonylContact O-C 3.48Å; L87-E100 VanDerWaalsContact O-CA 3.26Å; L87-E100 WeakPolarHBondContact O-CA 3.45Å; E88-E100 HydrophobicContact CG-CB 4.24Å; L97-E100 HydrophobicContact CD1-CB 4.39Å; L97-E100 HydrophobicContact CD2-CB 4.25Å; L97-E100 HydrophobicContact CD2-CG 4.32Å
101	A	82.4	Confident	67	Low	5 Å²	5	74.3 Å²	74.3	4%	0.041	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	128.9	176	0	0	0	0	0	109.2	L87 W99 L103 F131	L87-A101 HydrophobicContact CB-CB 4.42Å; L87-A101 PolarHBondContact N-O 2.83Å; L87-A101 PolarHBondContact O-N 3.48Å; W99-A101 HydrophobicContact CE3-CB 4.22Å; W99-A101 HydrophobicContact CZ3-CB 3.87Å; A101-L103 PolarHBondContact O-N 2.92Å; A101-F131 HydrophobicContact CB-CD1 4.01Å; A101-F131 HydrophobicContact CB-CE1 3.78Å
102	P	81.5	Confident	67.1	Low	106 Å²	106	73.4 Å²	73.4	69%	0.688	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	130.2	178.7	26.7	-32.8	0	0	0	110.7
103	L	72.1	Confident	67.7	Low	2 Å²	2	72.8 Å²	72.8	1%	0.01	39%	0.386	C	S	.	.			trans	-100.9	101	164	-68.9	169.4	0	0	0	106.1	V80 G84 T85 L87 A101 V105 I111 V122 F131	V80-L103 HydrophobicContact CG1-CD1 3.83Å; V80-L103 HydrophobicContact CG2-CD1 4.44Å; G84-L103 VanDerWaalsContact O-CB 3.23Å; G84-L103 WeakPolarHBondContact O-CB 2.91Å; T85-L103 CarbonylContact C-O 3.58Å; T85-L103 WeakPolarHBondContact CA-O 3.46Å; T85-L103 CarbonylContact O-C 3.51Å; T85-L103 WeakPolarHBondContact O-CA 2.96Å; T85-L103 PolarHBondContact O-N 2.7Å; L87-L103 HydrophobicContact CB-CD1 3.91Å; L87-L103 HydrophobicContact CB-CG 4.05Å; A101-L103 PolarHBondContact O-N 2.92Å; L103-V105 PolarHBondContact O-N 3.26Å; L103-I111 HydrophobicContact CD1-CD1 4.44Å; L103-V122 HydrophobicContact CD1-CG1 4.31Å; L103-V122 HydrophobicContact CD2-CB 4.35Å; L103-V122 HydrophobicContact CD2-CG1 3.86Å; L103-V122 HydrophobicContact CD2-CG2 4.33Å; L103-F131 HydrophobicContact CD2-CE2 4.01Å; L103-F131 HydrophobicContact CD2-CZ 3.84Å
104	E	67	Low	68.3	Low	148 Å²	148	69.5 Å²	69.5	69%	0.692	36%	0.361	S	S	*	.			trans	-47.9	141	175.6	-69.3	-179.6	162.4	0	0	111.1	T106 R129	E104-T106 PolarHBondContact O-N 2.85Å; E104-R129 IonicContact OE2-NH2 2.7Å
105	V	56.2	Low	68.8	Low	125 Å²	125	66.3 Å²	66.3	76%	0.758	34%	0.342	S	S	*	.			trans	-39.8	102.3	-169.6	-176	0	0	0	0	111.8	T85 L103 R107	T85-V105 HydrophobicContact CG2-CG2 4.48Å; L103-V105 PolarHBondContact O-N 3.26Å; V105-R107 PolarHBondContact O-N 3.28Å
106	T	54.7	Low	69.2	Low	18 Å²	18	67.8 Å²	67.8	11%	0.11	34%	0.342	C	S	.	.			trans	-72.3	124.2	177.1	52.5	0	0	0	0	108.8	E104 C108 I111 T124	E104-T106 PolarHBondContact O-N 2.85Å; T106-C108 PolarHBondContact O-N 3.23Å; T106-I111 HydrophobicContact CG2-CD1 4.33Å; T106-T124 HydrophobicContact CG2-CG2 3.6Å
107	R	54.9	Low	69.5	Low	236 Å²	236	69.5 Å²	69.5	89%	0.891	34%	0.344	S	S	*	.	S	Bend	trans	-67.3	-0.8	175.7	-70.7	-174.3	-177.4	-172.5	-0.3	114	V105	V105-R107 PolarHBondContact O-N 3.28Å
108	C	53.9	Low	69.7	Low	41 Å²	41	75.3 Å²	75.3	28%	0.277	36%	0.361	S	S	.	.	S	Bend	trans	-128.6	142.8	-172.4	-58.5	0	0	0	0	112	T106 R110 C125	T106-C108 PolarHBondContact O-N 3.23Å; C108-R110 PolarHBondContact O-N 3.25Å; C108-C125 HydrophobicContact CB-CB 3.54Å; C108-C125 WeakPolarHBondContact CB-SG 3.21Å; C108-C125 WeakPolarHBondContact SG-CB 3.05Å; C108-C125 CovalentContact SG-SG 2.01Å; C108-C125 PolarHBondContact SG-SG 2.81Å
109	D	54.4	Low	69.8	Low	107 Å²	107	73 Å²	73	57%	0.572	34%	0.344	S	S	*	.	S	Bend	trans	-70.8	-4.4	-178.6	-92.2	-25.4	0	0	0	114.9	K66	K66-D109 IonicContact NZ-OD1 2.95Å; K66-D109 PolarHBondContact NZ-OD1 3.27Å; K66-D109 IonicContact NZ-OD2 3.61Å; K66-D109 PolarHBondContact NZ-OD2 3.37Å
110	R	59.1	Low	69.5	Low	117 Å²	117	71.8 Å²	71.8	44%	0.442	34%	0.34	S	S	.	.			trans	-121.1	119.9	-170.6	-62.5	-172.2	-176.2	-167.6	2.9	111.9	C108 W152	C108-R110 PolarHBondContact O-N 3.25Å; R110-W152 HydrophobicContact CB-CZ2 3.83Å; R110-W152 PolarHBondContact O-NE1 3.07Å
111	I	67.1	Low	69.3	Low	14 Å²	14	67 Å²	67	7%	0.072	32%	0.317	C	S	.	.			trans	-125.1	127.4	174.6	-60.7	173.9	0	0	0	109.2	C68 V80 L103 T106 L113 V122 V123 T124 W152	C68-I111 PolarHBondContact SG-O 3.19Å; V80-I111 HydrophobicContact CG1-CD1 4.04Å; V80-I111 HydrophobicContact CG2-CG2 4.48Å; L103-I111 HydrophobicContact CD1-CD1 4.44Å; T106-I111 HydrophobicContact CG2-CD1 4.33Å; I111-L113 HydrophobicContact CG2-CD2 4.32Å; I111-V122 HydrophobicContact CG2-CG1 3.53Å; I111-V123 WeakPolarHBondContact CA-O 3.22Å; I111-T124 HydrophobicContact CG1-CG2 4.43Å; I111-W152 VanDerWaalsContact C-CZ2 3.48Å
112	K	70.8	Confident	69.3	Low	42 Å²	42	66.8 Å²	66.8	18%	0.183	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.6	168.9	-140.6	-174.8	173	-178.4	0	110.6	L114 V122 V123 W152 D154 A155	K112-L114 HydrophobicContact CD-CD1 4.45Å; K112-L114 HydrophobicContact CD-CD2 4.38Å; K112-L114 HydrophobicContact CD-CG 4.31Å; K112-V122 WeakPolarHBondContact O-CA 3.15Å; K112-V123 HydrophobicContact CB-CB 3.94Å; K112-V123 HydrophobicContact CB-CG2 4.49Å; K112-V123 PolarHBondContact N-O 2.95Å; K112-V123 PolarHBondContact O-N 2.86Å; K112-W152 HydrophobicContact CB-CE3 4.4Å; K112-W152 HydrophobicContact CB-CH2 3.25Å; K112-W152 HydrophobicContact CB-CZ2 3.73Å; K112-W152 HydrophobicContact CB-CZ3 3.62Å; K112-W152 HydrophobicContact CD-CH2 4.05Å; K112-W152 HydrophobicContact CD-CZ3 3.67Å; K112-W152 HydrophobicContact CG-CH2 3.54Å; K112-W152 HydrophobicContact CG-CZ2 4.46Å; K112-W152 HydrophobicContact CG-CZ3 3.72Å; K112-D154 IonicContact NZ-OD1 2.74Å; K112-D154 PolarHBondContact NZ-OD1 2.94Å; K112-A155 HydrophobicContact CD-CB 4.01Å; K112-A155 PolarHBondContact NZ-O 3.35Å
113	L	73.5	Confident	69.1	Low	9 Å²	9	61.8 Å²	61.8	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.4	165.4	-59	-178	0	0	0	109.5	C68 L78 V80 L87 I111 Y121 V122	C68-L113 HydrophobicContact CB-CB 3.91Å; C68-L113 HydrophobicContact CB-CD1 4.03Å; C68-L113 HydrophobicContact CB-CG 3.72Å; C68-L113 VanDerWaalsContact O-CD1 3.28Å; C68-L113 WeakPolarHBondContact O-CD1 3.05Å; L78-L113 HydrophobicContact CB-CD1 4.11Å; V80-L113 HydrophobicContact CG2-CD1 3.97Å; V80-L113 HydrophobicContact CG2-CD2 4.27Å; V80-L113 HydrophobicContact CG2-CG 4.34Å; L87-L113 HydrophobicContact CD1-CD1 3.98Å; L87-L113 HydrophobicContact CD1-CD2 3.72Å; I111-L113 HydrophobicContact CG2-CD2 4.32Å; L113-Y121 WeakPolarHBondContact CA-O 3.41Å; L113-V122 HydrophobicContact CD2-CB 4.22Å; L113-V122 HydrophobicContact CD2-CG1 4.05Å; L113-V122 HydrophobicContact CD2-CG2 3.61Å
114	L	73.1	Confident	69.2	Low	24 Å²	24	61.7 Å²	61.7	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146.1	170.5	-64.2	159.2	0	0	0	107.5	M70 K112 V120 Y121 V123 A155 I157 L164	M70-L114 VanDerWaalsContact SD-C 3.51Å; K112-L114 HydrophobicContact CD-CD1 4.45Å; K112-L114 HydrophobicContact CD-CD2 4.38Å; K112-L114 HydrophobicContact CD-CG 4.31Å; L114-V120 CarbonylContact O-C 3.6Å; L114-V120 WeakPolarHBondContact O-CA 3.35Å; L114-Y121 PolarHBondContact N-O 2.86Å; L114-Y121 PolarHBondContact O-N 2.83Å; L114-V123 HydrophobicContact CD1-CG2 4.25Å; L114-A155 HydrophobicContact CD1-CB 3.71Å; L114-I157 HydrophobicContact CB-CD1 3.95Å; L114-I157 HydrophobicContact CD1-CD1 4.46Å; L114-I157 HydrophobicContact CD1-CG1 4.42Å; L114-L164 HydrophobicContact CD1-CD1 3.5Å
115	N	73.7	Confident	69.3	Low	17 Å²	17	55.2 Å²	55.2	9%	0.091	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.2	173.9	165.1	52.2	0	0	0	108.3	M70 P72 T119 V120	M70-N115 HydrophobicContact CE-CB 3.46Å; M70-N115 VanDerWaalsContact CE-CB 3.46Å; M70-N115 VanDerWaalsContact CE-N 3.26Å; M70-N115 WeakPolarHBondContact CE-O 3.25Å; M70-N115 HydrophobicContact SD-CB 3.59Å; M70-N115 VanDerWaalsContact SD-CB 3.59Å; M70-N115 PolarHBondContact SD-N 3.43Å; P72-N115 VanDerWaalsContact CA-ND2 3.31Å; P72-N115 WeakPolarHBondContact CA-ND2 2.76Å; N115-T119 WeakPolarHBondContact CA-O 3.42Å; N115-T119 PolarHBondContact OD1-O 3.26Å; N115-V120 HydrophobicContact CB-CG2 4.39Å
116	Y	73	Confident	70	Confident	46 Å²	46	52 Å²	52	18%	0.18	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	126	177	-178.1	-110.4	0	0	0	107.8	R118 T119 I157 S159	Y116-R118 PolarHBondContact O-N 2.94Å; Y116-R118 VanDerWaalsContact O-N 3.11Å; Y116-T119 PolarHBondContact N-O 2.83Å; Y116-T119 PolarHBondContact O-N 2.59Å; Y116-T119 VanDerWaalsContact O-O 3.12Å; Y116-T119 PolarHBondContact O-OG1 3.19Å; Y116-I157 HydrophobicContact CD1-CG2 4.28Å; Y116-I157 HydrophobicContact CD2-CG2 4.04Å; Y116-I157 HydrophobicContact CE2-CG2 4.43Å; Y116-I157 HydrophobicContact CG-CD1 4.48Å; Y116-I157 HydrophobicContact CG-CG2 3.97Å; Y116-S159 PolarHBondContact OH-O 3.06Å; Y116-S159 VanDerWaalsContact OH-O 3.13Å
117	Q	73.6	Confident	71.1	Confident	128 Å²	128	53.4 Å²	53.4	60%	0.598	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	-111.1	-177	-58	-179.4	-7.5	0	0	112.8
118	R	77.1	Confident	72.4	Confident	197 Å²	197	42.2 Å²	42.2	74%	0.743	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.6	16.2	-180	-65.4	-176	176.4	-179.2	-0.9	112.7	Y116 A133	Y116-R118 PolarHBondContact O-N 2.94Å; Y116-R118 VanDerWaalsContact O-N 3.11Å; R118-A133 WeakPolarHBondContact O-CB 3.36Å; R118-A133 PolarHBondContact O-N 3Å
119	T	77.1	Confident	73.9	Confident	18 Å²	18	41.1 Å²	41.1	11%	0.11	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.6	-173.4	53	0	0	0	0	112	N115 Y116 Y121 F131 L139	N115-T119 WeakPolarHBondContact CA-O 3.42Å; N115-T119 PolarHBondContact OD1-O 3.26Å; Y116-T119 PolarHBondContact N-O 2.83Å; Y116-T119 PolarHBondContact O-N 2.59Å; Y116-T119 VanDerWaalsContact O-O 3.12Å; Y116-T119 PolarHBondContact O-OG1 3.19Å; T119-Y121 PolarHBondContact OG1-OH 2.85Å; T119-F131 CarbonylContact C-O 3.55Å; T119-F131 WeakPolarHBondContact CA-O 3.22Å; T119-L139 HydrophobicContact CG2-CD1 3.56Å
120	V	79.9	Confident	75.4	Confident	0 Å²	0	36 Å²	36	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.6	174.4	179.2	0	0	0	0	108.3	L78 L114 N115 S130 F131 A133	L78-V120 HydrophobicContact CD1-CB 4.36Å; L78-V120 HydrophobicContact CD1-CG1 3.92Å; L78-V120 HydrophobicContact CD1-CG2 3.47Å; L78-V120 VanDerWaalsContact CD1-CG2 3.47Å; L78-V120 HydrophobicContact CD2-CG1 4.14Å; L78-V120 HydrophobicContact CD2-CG2 4.35Å; L114-V120 CarbonylContact O-C 3.6Å; L114-V120 WeakPolarHBondContact O-CA 3.35Å; N115-V120 HydrophobicContact CB-CG2 4.39Å; V120-S130 CarbonylContact O-C 3.58Å; V120-S130 WeakPolarHBondContact O-CA 3.2Å; V120-F131 HydrophobicContact CB-CB 4.33Å; V120-F131 PolarHBondContact N-O 2.7Å; V120-F131 PolarHBondContact O-N 3.04Å; V120-A133 HydrophobicContact CG2-CB 3.95Å
121	Y	80.7	Confident	76.7	Confident	8 Å²	8	30.7 Å²	30.7	3%	0.031	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.6	173.1	-54.7	-79.3	0	0	0	109.9	L113 L114 T119 R129 W140 I157 L164 Q179	L113-Y121 WeakPolarHBondContact CA-O 3.41Å; L114-Y121 PolarHBondContact N-O 2.86Å; L114-Y121 PolarHBondContact O-N 2.83Å; T119-Y121 PolarHBondContact OG1-OH 2.85Å; Y121-R129 CarbonylContact C-O 3.59Å; Y121-R129 WeakPolarHBondContact CA-O 3.34Å; Y121-W140 HydrophobicContact CD1-CH2 4.2Å; Y121-W140 AromaticContact CD1-CZ2 3.99Å; Y121-W140 HydrophobicContact CD1-CZ2 3.99Å; Y121-W140 HydrophobicContact CE1-CH2 4.19Å; Y121-W140 AromaticContact CE1-CZ2 3.55Å; Y121-W140 HydrophobicContact CE1-CZ2 3.55Å; Y121-I157 HydrophobicContact CD2-CD1 3.52Å; Y121-I157 HydrophobicContact CE2-CD1 3.7Å; Y121-L164 HydrophobicContact CD1-CD2 4.32Å; Y121-L164 HydrophobicContact CG-CD2 4.37Å; Y121-Q179 PolarHBondContact OH-OE1 2.91Å; Y121-Q179 VanDerWaalsContact OH-OE1 3.04Å
122	V	81.2	Confident	77.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	111.7	171.4	-173.7	0	0	0	0	107.3	L87 L103 I111 K112 L113 T124 V128 R129 F131	L87-V122 HydrophobicContact CD1-CG2 4.49Å; L87-V122 HydrophobicContact CD2-CG2 3.95Å; L103-V122 HydrophobicContact CD1-CG1 4.31Å; L103-V122 HydrophobicContact CD2-CB 4.35Å; L103-V122 HydrophobicContact CD2-CG1 3.86Å; L103-V122 HydrophobicContact CD2-CG2 4.33Å; I111-V122 HydrophobicContact CG2-CG1 3.53Å; K112-V122 WeakPolarHBondContact O-CA 3.15Å; L113-V122 HydrophobicContact CD2-CB 4.22Å; L113-V122 HydrophobicContact CD2-CG1 4.05Å; L113-V122 HydrophobicContact CD2-CG2 3.61Å; V122-T124 HydrophobicContact CG1-CG2 4.29Å; V122-V128 CarbonylContact O-C 3.5Å; V122-V128 WeakPolarHBondContact O-CA 3.43Å; V122-R129 HydrophobicContact CB-CB 4.37Å; V122-R129 PolarHBondContact N-O 2.98Å; V122-R129 PolarHBondContact O-N 2.75Å; V122-F131 HydrophobicContact CB-CD2 4.5Å; V122-F131 HydrophobicContact CB-CE2 4.05Å; V122-F131 HydrophobicContact CG2-CD2 3.61Å; V122-F131 HydrophobicContact CG2-CE2 3.44Å; V122-F131 VanDerWaalsContact CG2-CE2 3.44Å
123	V	77.5	Confident	77.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.6	177	-177.2	0	0	0	0	107.8	I111 K112 L114 V128 W152 A155 V166	I111-V123 WeakPolarHBondContact CA-O 3.22Å; K112-V123 HydrophobicContact CB-CB 3.94Å; K112-V123 HydrophobicContact CB-CG2 4.49Å; K112-V123 PolarHBondContact N-O 2.95Å; K112-V123 PolarHBondContact O-N 2.86Å; L114-V123 HydrophobicContact CD1-CG2 4.25Å; V123-V128 HydrophobicContact CG1-CG2 4.22Å; V123-V128 HydrophobicContact CG2-CG1 4.19Å; V123-V128 HydrophobicContact CG2-CG2 4.16Å; V123-W152 HydrophobicContact CG1-CD2 4.28Å; V123-W152 HydrophobicContact CG1-CG 4.42Å; V123-A155 HydrophobicContact CG1-CB 4.46Å; V123-A155 HydrophobicContact CG2-CB 3.98Å; V123-V166 HydrophobicContact CG1-CG1 3.87Å; V123-V166 HydrophobicContact CG1-CG2 4.38Å; V123-V166 HydrophobicContact CG2-CG2 4.47Å
124	T	74.2	Confident	78	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.			trans	-101.5	176.4	169.4	66.9	0	0	0	0	108.8	T106 I111 V122 D126 Q127 L144	T106-T124 HydrophobicContact CG2-CG2 3.6Å; I111-T124 HydrophobicContact CG1-CG2 4.43Å; V122-T124 HydrophobicContact CG1-CG2 4.29Å; T124-D126 WeakPolarHBondContact CB-OD1 3.16Å; T124-D126 PolarHBondContact O-N 3.21Å; T124-D126 PolarHBondContact OG1-OD1 3.46Å; T124-Q127 PolarHBondContact N-O 3.3Å; T124-Q127 PolarHBondContact OG1-N 2.91Å; T124-Q127 PolarHBondContact OG1-O 2.83Å; T124-L144 VanDerWaalsContact O-CD1 3.28Å; T124-L144 WeakPolarHBondContact O-CD1 3.48Å
125	C	68.9	Low	78.3	Confident	13 Å²	13	34.4 Å²	34.4	9%	0.088	17%	0.174	C	C	.	.	S	Bend	trans	-65.5	-22.4	177.8	61.2	0	0	0	0	114.6	C108	C108-C125 HydrophobicContact CB-CB 3.54Å; C108-C125 WeakPolarHBondContact CB-SG 3.21Å; C108-C125 WeakPolarHBondContact SG-CB 3.05Å; C108-C125 CovalentContact SG-SG 2.01Å; C108-C125 PolarHBondContact SG-SG 2.81Å
126	D	70.6	Confident	78.6	Confident	58 Å²	58	34.1 Å²	34.1	31%	0.31	18%	0.175	S	C	.	.	S	Bend	trans	-120.4	-16.7	-170.8	62.2	-29.7	0	0	0	112.9	T124 A143 L144	T124-D126 WeakPolarHBondContact CB-OD1 3.16Å; T124-D126 PolarHBondContact O-N 3.21Å; T124-D126 PolarHBondContact OG1-OD1 3.46Å; D126-A143 CarbonylContact O-C 3.56Å; D126-A143 WeakPolarHBondContact O-CA 3.45Å; D126-L144 PolarHBondContact O-N 2.85Å
127	Q	78.6	Confident	79.2	Confident	47 Å²	47	38.2 Å²	38.2	22%	0.22	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	152.6	-174.1	-58.6	-176.5	-2.3	0	0	112	T124 R129 T141 T142	T124-Q127 PolarHBondContact N-O 3.3Å; T124-Q127 PolarHBondContact OG1-N 2.91Å; T124-Q127 PolarHBondContact OG1-O 2.83Å; Q127-R129 VanDerWaalsContact OE1-NE 3.16Å; Q127-T141 HydrophobicContact CB-CG2 4.24Å; Q127-T141 HydrophobicContact CG-CG2 4.43Å; Q127-T142 CarbonylContact C-O 3.57Å; Q127-T142 WeakPolarHBondContact CA-O 3.48Å
128	V	82.6	Confident	79.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.5	160.2	-177.3	0	0	0	0	108.1	V122 V123 W140 T141 T142 L144 L164 V166	V122-V128 CarbonylContact O-C 3.5Å; V122-V128 WeakPolarHBondContact O-CA 3.43Å; V123-V128 HydrophobicContact CG1-CG2 4.22Å; V123-V128 HydrophobicContact CG2-CG1 4.19Å; V123-V128 HydrophobicContact CG2-CG2 4.16Å; V128-W140 HydrophobicContact CB-CZ3 4.23Å; V128-W140 HydrophobicContact CG1-CH2 3.98Å; V128-W140 HydrophobicContact CG1-CZ3 4.05Å; V128-T141 CarbonylContact O-C 3.43Å; V128-T141 WeakPolarHBondContact O-CA 3.48Å; V128-T142 HydrophobicContact CB-CG2 3.98Å; V128-T142 HydrophobicContact CG2-CG2 4.49Å; V128-T142 PolarHBondContact N-O 3.43Å; V128-T142 PolarHBondContact O-N 2.99Å; V128-L144 HydrophobicContact CG2-CD1 4.3Å; V128-L144 HydrophobicContact CG2-CD2 3.97Å; V128-L144 HydrophobicContact CG2-CG 4.2Å; V128-L164 HydrophobicContact CG1-CD2 3.62Å; V128-L164 HydrophobicContact CG2-CD2 4.48Å; V128-V166 HydrophobicContact CG2-CG2 4.05Å
129	R	85	Confident	80.2	Confident	18 Å²	18	30.5 Å²	30.5	7%	0.068	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.2	176.5	-63.7	-179.4	-178.2	154.6	-2.7	109.4	E104 Y121 V122 Q127 F131 L138 T141	E104-R129 IonicContact OE2-NH2 2.7Å; Y121-R129 CarbonylContact C-O 3.59Å; Y121-R129 WeakPolarHBondContact CA-O 3.34Å; V122-R129 HydrophobicContact CB-CB 4.37Å; V122-R129 PolarHBondContact N-O 2.98Å; V122-R129 PolarHBondContact O-N 2.75Å; Q127-R129 VanDerWaalsContact OE1-NE 3.16Å; R129-F131 HydrophobicContact CB-CD2 4.32Å; R129-F131 HydrophobicContact CB-CE2 3.56Å; R129-F131 HydrophobicContact CB-CZ 4.1Å; R129-L138 HydrophobicContact CB-CD1 3.96Å; R129-L138 HydrophobicContact CG-CD1 4.36Å; R129-T141 HydrophobicContact CG-CG2 3.82Å
130	S	86.6	Confident	80.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.8	174.3	178.7	0	0	0	0	109.3	V120 L139 W140	V120-S130 CarbonylContact O-C 3.58Å; V120-S130 WeakPolarHBondContact O-CA 3.2Å; S130-L139 WeakPolarHBondContact O-CB 3.44Å; S130-L139 PolarHBondContact O-N 2.01Å; S130-W140 PolarHBondContact N-O 3.41Å
131	F	86.1	Confident	80.8	Confident	5 Å²	5	35 Å²	35	2%	0.022	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.4	177.1	-62.6	-94	0	0	0	110.5	L87 A101 L103 T119 V120 V122 R129 A133 Q137 L138	L87-F131 HydrophobicContact CD2-CD2 3.94Å; L87-F131 HydrophobicContact CD2-CE2 4.18Å; L87-F131 HydrophobicContact CD2-CG 4.12Å; A101-F131 HydrophobicContact CB-CD1 4.01Å; A101-F131 HydrophobicContact CB-CE1 3.78Å; L103-F131 HydrophobicContact CD2-CE2 4.01Å; L103-F131 HydrophobicContact CD2-CZ 3.84Å; T119-F131 CarbonylContact C-O 3.55Å; T119-F131 WeakPolarHBondContact CA-O 3.22Å; V120-F131 HydrophobicContact CB-CB 4.33Å; V120-F131 PolarHBondContact N-O 2.7Å; V120-F131 PolarHBondContact O-N 3.04Å; V122-F131 HydrophobicContact CB-CD2 4.5Å; V122-F131 HydrophobicContact CB-CE2 4.05Å; V122-F131 HydrophobicContact CG2-CD2 3.61Å; V122-F131 HydrophobicContact CG2-CE2 3.44Å; V122-F131 VanDerWaalsContact CG2-CE2 3.44Å; R129-F131 HydrophobicContact CB-CD2 4.32Å; R129-F131 HydrophobicContact CB-CE2 3.56Å; R129-F131 HydrophobicContact CB-CZ 4.1Å; F131-A133 PolarHBondContact O-N 3.43Å; F131-Q137 CarbonylContact C-O 3.6Å; F131-Q137 VanDerWaalsContact CA-O 3.3Å; F131-Q137 WeakPolarHBondContact CA-O 3.39Å; F131-L138 HydrophobicContact CD1-CB 4.3Å; F131-L138 HydrophobicContact CD1-CD1 4.17Å; F131-L138 HydrophobicContact CE1-CB 4.18Å; F131-L138 HydrophobicContact CE1-CD1 3.74Å; F131-L138 HydrophobicContact CE2-CD1 4.21Å; F131-L138 HydrophobicContact CZ-CD1 3.77Å
132	G	83.5	Confident	80.7	Confident	7 Å²	7	35.2 Å²	35.2	7%	0.072	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	124.2	169	0	0	0	0	0	110.3	S134 S135 G136 Q137	G132-S134 VanDerWaalsContact C-N 3.27Å; G132-S134 PolarHBondContact O-N 2.81Å; G132-S135 PolarHBondContact O-N 3.42Å; G132-G136 PolarHBondContact O-N 3.16Å; G132-Q137 PolarHBondContact N-O 3.07Å
133	A	77.2	Confident	80.4	Confident	3 Å²	3	38.1 Å²	38.1	3%	0.025	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-34	-174	0	0	0	0	0	113.5	W99 R118 V120 F131	W99-A133 PolarHBondContact NE1-O 3.26Å; W99-A133 VanDerWaalsContact NE1-O 3.08Å; R118-A133 WeakPolarHBondContact O-CB 3.36Å; R118-A133 PolarHBondContact O-N 3Å; V120-A133 HydrophobicContact CG2-CB 3.95Å; F131-A133 PolarHBondContact O-N 3.43Å
134	S	76.9	Confident	80.1	Confident	94 Å²	94	38.4 Å²	38.4	66%	0.657	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-28.9	-179.4	55.1	0	0	0	0	114.2	G132	G132-S134 VanDerWaalsContact C-N 3.27Å; G132-S134 PolarHBondContact O-N 2.81Å
135	S	80.2	Confident	79.6	Confident	64 Å²	64	43.9 Å²	43.9	45%	0.448	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-17	-171.5	57.8	0	0	0	0	114.4	G132 Q137	G132-S135 PolarHBondContact O-N 3.42Å; S135-Q137 PolarHBondContact O-N 3.35Å; S135-Q137 VanDerWaalsContact O-N 3.13Å; S135-Q137 WeakPolarHBondContact OG-CB 3.46Å; S135-Q137 PolarHBondContact OG-N 3.04Å
136	G	79.6	Confident	78.8	Confident	10 Å²	10	54.6 Å²	54.6	10%	0.103	29%	0.286	C	S	.	.			trans	65.8	6.5	-169.2	0	0	0	0	0	113.8	W99 G132	W99-G136 VanDerWaalsContact CD2-CA 3.45Å; W99-G136 VanDerWaalsContact CE3-CA 3.41Å; G132-G136 PolarHBondContact O-N 3.16Å
137	Q	85.3	Confident	77.9	Confident	132 Å²	132	55.9 Å²	55.9	62%	0.617	29%	0.29	S	S	*	.			trans	-73.7	129.9	-178.3	-171.8	179.5	4	0	0	110.3	F131 G132 S135 L139	F131-Q137 CarbonylContact C-O 3.6Å; F131-Q137 VanDerWaalsContact CA-O 3.3Å; F131-Q137 WeakPolarHBondContact CA-O 3.39Å; G132-Q137 PolarHBondContact N-O 3.07Å; S135-Q137 PolarHBondContact O-N 3.35Å; S135-Q137 VanDerWaalsContact O-N 3.13Å; S135-Q137 WeakPolarHBondContact OG-CB 3.46Å; S135-Q137 PolarHBondContact OG-N 3.04Å; Q137-L139 PolarHBondContact O-N 2.87Å
138	L	86.6	Confident	76.6	Confident	87 Å²	87	59.8 Å²	59.8	46%	0.455	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	119.6	172.6	-175.6	71.5	0	0	0	109.9	R129 F131	R129-L138 HydrophobicContact CB-CD1 3.96Å; R129-L138 HydrophobicContact CG-CD1 4.36Å; F131-L138 HydrophobicContact CD1-CB 4.3Å; F131-L138 HydrophobicContact CD1-CD1 4.17Å; F131-L138 HydrophobicContact CE1-CB 4.18Å; F131-L138 HydrophobicContact CE1-CD1 3.74Å; F131-L138 HydrophobicContact CE2-CD1 4.21Å; F131-L138 HydrophobicContact CZ-CD1 3.77Å
139	L	84.9	Confident	75.2	Confident	76 Å²	76	67.6 Å²	67.6	40%	0.398	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-44.9	179.7	-64.2	173.4	0	0	0	111.9	T119 S130 Q137	T119-L139 HydrophobicContact CG2-CD1 3.56Å; S130-L139 WeakPolarHBondContact O-CB 3.44Å; S130-L139 PolarHBondContact O-N 2.01Å; Q137-L139 PolarHBondContact O-N 2.87Å
140	W	86.2	Confident	73.6	Confident	52 Å²	52	67.7 Å²	67.7	20%	0.197	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	158.6	175.8	54.3	-96.9	0	0	0	110.6	Y121 V128 S130 T142 V177 T184	Y121-W140 HydrophobicContact CD1-CH2 4.2Å; Y121-W140 AromaticContact CD1-CZ2 3.99Å; Y121-W140 HydrophobicContact CD1-CZ2 3.99Å; Y121-W140 HydrophobicContact CE1-CH2 4.19Å; Y121-W140 AromaticContact CE1-CZ2 3.55Å; Y121-W140 HydrophobicContact CE1-CZ2 3.55Å; V128-W140 HydrophobicContact CB-CZ3 4.23Å; V128-W140 HydrophobicContact CG1-CH2 3.98Å; V128-W140 HydrophobicContact CG1-CZ3 4.05Å; S130-W140 PolarHBondContact N-O 3.41Å; W140-T142 HydrophobicContact CZ3-CG2 3.79Å; W140-V177 HydrophobicContact CH2-CG1 3.91Å; W140-V177 HydrophobicContact CZ3-CG1 4.42Å; W140-T184 HydrophobicContact CE3-CG2 4.48Å
141	T	83.6	Confident	72	Confident	61 Å²	61	70.8 Å²	70.8	37%	0.374	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.8	172.8	-60.2	0	0	0	0	108.2	Q127 V128 R129	Q127-T141 HydrophobicContact CB-CG2 4.24Å; Q127-T141 HydrophobicContact CG-CG2 4.43Å; V128-T141 CarbonylContact O-C 3.43Å; V128-T141 WeakPolarHBondContact O-CA 3.48Å; R129-T141 HydrophobicContact CG-CG2 3.82Å
142	T	79.8	Confident	70.4	Confident	12 Å²	12	71.5 Å²	71.5	7%	0.074	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.4	172	-156	0	0	0	0	109	Q127 V128 W140 V177	Q127-T142 CarbonylContact C-O 3.57Å; Q127-T142 WeakPolarHBondContact CA-O 3.48Å; V128-T142 HydrophobicContact CB-CG2 3.98Å; V128-T142 HydrophobicContact CG2-CG2 4.49Å; V128-T142 PolarHBondContact N-O 3.43Å; V128-T142 PolarHBondContact O-N 2.99Å; W140-T142 HydrophobicContact CZ3-CG2 3.79Å; T142-V177 HydrophobicContact CG2-CG1 4.39Å; T142-V177 HydrophobicContact CG2-CG2 4.33Å
143	A	74.9	Confident	69.1	Low	61 Å²	61	75.9 Å²	75.9	50%	0.504	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	135.2	172.7	0	0	0	0	0	110.1	D126	D126-A143 CarbonylContact O-C 3.56Å; D126-A143 WeakPolarHBondContact O-CA 3.45Å
144	L	71.3	Confident	68.4	Low	6 Å²	6	79.3 Å²	79.3	3%	0.031	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-77.3	151.2	162.7	-62.1	168.9	0	0	0	107.9	T124 D126 V128 R146 V166 E175	T124-L144 VanDerWaalsContact O-CD1 3.28Å; T124-L144 WeakPolarHBondContact O-CD1 3.48Å; D126-L144 PolarHBondContact O-N 2.85Å; V128-L144 HydrophobicContact CG2-CD1 4.3Å; V128-L144 HydrophobicContact CG2-CD2 3.97Å; V128-L144 HydrophobicContact CG2-CG 4.2Å; L144-R146 PolarHBondContact O-N 3.05Å; L144-V166 HydrophobicContact CD1-CG1 4.19Å; L144-V166 HydrophobicContact CD2-CB 4.34Å; L144-V166 HydrophobicContact CD2-CG1 4.12Å; L144-E175 WeakPolarHBondContact CD2-OE2 3.22Å
145	H	64.3	Low	67.9	Low	116 Å²	116	75 Å²	75	54%	0.537	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-61.7	130.1	-173.5	-167.2	34.5	0	0	0	111.5	Q147 I150 E175	H145-Q147 PolarHBondContact O-N 2.73Å; H145-Q147 VanDerWaalsContact O-N 3.14Å; H145-I150 WeakPolarHBondContact O-CD1 3.48Å; H145-E175 WeakPolarHBondContact CB-OE1 3.44Å; H145-E175 PolarHBondContact N-OE1 2.73Å; H145-E175 VanDerWaalsContact N-OE1 3.07Å
146	R	51.1	Low	67.3	Low	238 Å²	238	74.5 Å²	74.5	90%	0.898	39%	0.388	S	S	*	.			trans	-63.3	111.6	-179.9	-90.2	-178.2	175.7	169.8	-0.2	110.9	L144	L144-R146 PolarHBondContact O-N 3.05Å
147	Q	50.7	Low	66.8	Low	85 Å²	85	76.1 Å²	76.1	40%	0.397	39%	0.394	S	S	.	.			trans	-132.4	149.7	157.6	-63.9	-172.7	-28.8	0	0	110.5	H145 E149 I150 S170	H145-Q147 PolarHBondContact O-N 2.73Å; H145-Q147 VanDerWaalsContact O-N 3.14Å; Q147-E149 PolarHBondContact O-N 3.01Å; Q147-E149 VanDerWaalsContact O-N 3.09Å; Q147-I150 HydrophobicContact CB-CD1 3.83Å; Q147-I150 HydrophobicContact CB-CG1 3.79Å; Q147-I150 HydrophobicContact CG-CD1 4.44Å; Q147-S170 PolarHBondContact OE1-OG 3.32Å
148	S	52.5	Low	66.3	Low	128 Å²	128	72.5 Å²	72.5	90%	0.895	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-15	-166.5	40.5	0	0	0	0	115.7
149	E	53	Low	65.5	Low	164 Å²	164	72.1 Å²	72.1	77%	0.766	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.9	51	-178	-69.3	-171.9	148.1	0	0	112.5	Q147 V151	Q147-E149 PolarHBondContact O-N 3.01Å; Q147-E149 VanDerWaalsContact O-N 3.09Å; E149-V151 PolarHBondContact O-N 3.13Å; E149-V151 VanDerWaalsContact O-N 3.13Å
150	I	51.6	Low	64.8	Low	21 Å²	21	77.8 Å²	77.8	11%	0.108	41%	0.405	C	S	.	.			trans	-79.2	102.6	176.4	-59.6	176.7	0	0	0	110.6	H145 Q147 T168	H145-I150 WeakPolarHBondContact O-CD1 3.48Å; Q147-I150 HydrophobicContact CB-CD1 3.83Å; Q147-I150 HydrophobicContact CB-CG1 3.79Å; Q147-I150 HydrophobicContact CG-CD1 4.44Å; I150-T168 HydrophobicContact CG2-CG2 3.84Å
151	V	51.8	Low	63.8	Low	64 Å²	64	77.5 Å²	77.5	39%	0.388	41%	0.411	S	S	.	.			trans	-87.1	95.9	157.8	-175.5	0	0	0	0	106.8	E149 Q153 G169	E149-V151 PolarHBondContact O-N 3.13Å; E149-V151 VanDerWaalsContact O-N 3.13Å; V151-Q153 PolarHBondContact O-N 3.45Å; V151-G169 VanDerWaalsContact O-CA 3.24Å; V151-G169 WeakPolarHBondContact O-CA 3.38Å; V151-G169 PolarHBondContact O-N 2.83Å
152	W	53.2	Low	63.1	Low	21 Å²	21	76.9 Å²	76.9	8%	0.08	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	131.3	165.6	70.4	-88.3	0	0	0	107.8	R110 I111 K112 V123 A167	R110-W152 HydrophobicContact CB-CZ2 3.83Å; R110-W152 PolarHBondContact O-NE1 3.07Å; I111-W152 VanDerWaalsContact C-CZ2 3.48Å; K112-W152 HydrophobicContact CB-CE3 4.4Å; K112-W152 HydrophobicContact CB-CH2 3.25Å; K112-W152 HydrophobicContact CB-CZ2 3.73Å; K112-W152 HydrophobicContact CB-CZ3 3.62Å; K112-W152 HydrophobicContact CD-CH2 4.05Å; K112-W152 HydrophobicContact CD-CZ3 3.67Å; K112-W152 HydrophobicContact CG-CH2 3.54Å; K112-W152 HydrophobicContact CG-CZ2 4.46Å; K112-W152 HydrophobicContact CG-CZ3 3.72Å; V123-W152 HydrophobicContact CG1-CD2 4.28Å; V123-W152 HydrophobicContact CG1-CG 4.42Å; W152-A167 WeakPolarHBondContact CA-O 3.44Å
153	Q	56.7	Low	62.8	Low	99 Å²	99	77.5 Å²	77.5	46%	0.463	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-42.8	-174.4	-72.3	-175.8	-2.9	0	0	110.9	V151 A167	V151-Q153 PolarHBondContact O-N 3.45Å; Q153-A167 PolarHBondContact N-O 2.86Å
154	D	61.2	Low	62.7	Low	75 Å²	75	75 Å²	75	40%	0.401	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	161.2	-177.2	-150.1	-5.6	0	0	0	111.3	K112 A167	K112-D154 IonicContact NZ-OD1 2.74Å; K112-D154 PolarHBondContact NZ-OD1 2.94Å; D154-A167 PolarHBondContact O-N 2.77Å
155	A	67.3	Low	62.8	Low	2 Å²	2	77.2 Å²	77.2	2%	0.017	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	136.8	169.9	0	0	0	0	0	110.2	K112 L114 V123 L164 Y165 V166	K112-A155 HydrophobicContact CD-CB 4.01Å; K112-A155 PolarHBondContact NZ-O 3.35Å; L114-A155 HydrophobicContact CD1-CB 3.71Å; V123-A155 HydrophobicContact CG1-CB 4.46Å; V123-A155 HydrophobicContact CG2-CB 3.98Å; A155-L164 HydrophobicContact CB-CD1 4.45Å; A155-Y165 CarbonylContact C-O 3.52Å; A155-Y165 WeakPolarHBondContact CA-O 3.42Å; A155-Y165 WeakPolarHBondContact CB-O 3.48Å; A155-V166 HydrophobicContact CB-CG2 4.07Å
156	A	67.5	Low	63.1	Low	55 Å²	55	71.7 Å²	71.7	46%	0.455	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	147.4	-174.9	0	0	0	0	0	110.7	Y165	A156-Y165 PolarHBondContact N-O 2.83Å; A156-Y165 PolarHBondContact O-N 2.82Å
157	I	70	Confident	63.8	Low	44 Å²	44	61 Å²	61	23%	0.226	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.7	175.7	-61.3	169.9	0	0	0	107.4	L114 Y116 Y121 L163 L164	L114-I157 HydrophobicContact CB-CD1 3.95Å; L114-I157 HydrophobicContact CD1-CD1 4.46Å; L114-I157 HydrophobicContact CD1-CG1 4.42Å; Y116-I157 HydrophobicContact CD1-CG2 4.28Å; Y116-I157 HydrophobicContact CD2-CG2 4.04Å; Y116-I157 HydrophobicContact CE2-CG2 4.43Å; Y116-I157 HydrophobicContact CG-CD1 4.48Å; Y116-I157 HydrophobicContact CG-CG2 3.97Å; Y121-I157 HydrophobicContact CD2-CD1 3.52Å; Y121-I157 HydrophobicContact CE2-CD1 3.7Å; I157-L163 WeakPolarHBondContact CA-O 3.36Å; I157-L164 HydrophobicContact CD1-CD1 4.23Å; I157-L164 HydrophobicContact CG1-CD1 3.51Å
158	D	73.6	Confident	64.2	Low	55 Å²	55	57.6 Å²	57.6	29%	0.294	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.5	168	173	22.2	0	0	0	109.4	K160 S161 S162 L163 Y165	D158-K160 PolarHBondContact O-N 3.45Å; D158-K160 PolarHBondContact OD1-N 2.94Å; D158-S161 WeakPolarHBondContact CB-OG 3.26Å; D158-S161 VanDerWaalsContact CG-OG 3.26Å; D158-S161 WeakPolarHBondContact OD2-CB 3.43Å; D158-S161 PolarHBondContact OD2-N 3.09Å; D158-S161 PolarHBondContact OD2-OG 3.15Å; D158-S162 VanDerWaalsContact O-CA 3.32Å; D158-S162 WeakPolarHBondContact O-CA 3.43Å; D158-S162 PolarHBondContact O-N 3.42Å; D158-L163 PolarHBondContact N-O 2.72Å; D158-Y165 HydrophobicContact CB-CD2 4.5Å; D158-Y165 HydrophobicContact CB-CE2 3.8Å
159	S	69.5	Low	64.3	Low	80 Å²	80	53.2 Å²	53.2	56%	0.559	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.7	-180	59.2	0	0	0	0	113.1	Y116	Y116-S159 PolarHBondContact OH-O 3.06Å; Y116-S159 VanDerWaalsContact OH-O 3.13Å
160	K	70.2	Confident	64.3	Low	194 Å²	194	47 Å²	47	84%	0.843	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-50.2	178.8	-70	-175.5	178.4	-179.5	0	111.8	D158	D158-K160 PolarHBondContact O-N 3.45Å; D158-K160 PolarHBondContact OD1-N 2.94Å
161	S	66.7	Low	64.2	Low	47 Å²	47	54 Å²	54	33%	0.329	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.3	-178.2	64.6	0	0	0	0	114.4	D158 L163	D158-S161 WeakPolarHBondContact CB-OG 3.26Å; D158-S161 VanDerWaalsContact CG-OG 3.26Å; D158-S161 WeakPolarHBondContact OD2-CB 3.43Å; D158-S161 PolarHBondContact OD2-N 3.09Å; D158-S161 PolarHBondContact OD2-OG 3.15Å; S161-L163 PolarHBondContact O-N 2.87Å; S161-L163 WeakPolarHBondContact OG-CB 3.26Å; S161-L163 WeakPolarHBondContact OG-CG 3.42Å; S161-L163 PolarHBondContact OG-N 2.9Å
162	S	68.7	Low	64.2	Low	48 Å²	48	57 Å²	57	34%	0.336	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	31.2	-170.5	-57.4	0	0	0	0	112.5	D158	D158-S162 VanDerWaalsContact O-CA 3.32Å; D158-S162 WeakPolarHBondContact O-CA 3.43Å; D158-S162 PolarHBondContact O-N 3.42Å
163	L	72.9	Confident	64	Low	25 Å²	25	60.3 Å²	60.3	13%	0.131	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	134.7	176.6	-64.9	177	0	0	0	109.9	I157 D158 S161 Y165 K178	I157-L163 WeakPolarHBondContact CA-O 3.36Å; D158-L163 PolarHBondContact N-O 2.72Å; S161-L163 PolarHBondContact O-N 2.87Å; S161-L163 WeakPolarHBondContact OG-CB 3.26Å; S161-L163 WeakPolarHBondContact OG-CG 3.42Å; S161-L163 PolarHBondContact OG-N 2.9Å; L163-Y165 HydrophobicContact CB-CD2 4.38Å; L163-Y165 HydrophobicContact CB-CE2 3.75Å; L163-Y165 WeakPolarHBondContact CD1-OH 3.46Å; L163-K178 HydrophobicContact CD2-CB 3.47Å; L163-K178 VanDerWaalsContact CD2-CB 3.47Å; L163-K178 HydrophobicContact CD2-CD 3.79Å; L163-K178 HydrophobicContact CD2-CG 3.41Å; L163-K178 VanDerWaalsContact CD2-CG 3.41Å
164	L	73.8	Confident	63.8	Low	8 Å²	8	58.3 Å²	58.3	4%	0.042	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.6	166.7	176.2	70.4	0	0	0	107.9	L114 Y121 V128 A155 I157 V166 V177	L114-L164 HydrophobicContact CD1-CD1 3.5Å; Y121-L164 HydrophobicContact CD1-CD2 4.32Å; Y121-L164 HydrophobicContact CG-CD2 4.37Å; V128-L164 HydrophobicContact CG1-CD2 3.62Å; V128-L164 HydrophobicContact CG2-CD2 4.48Å; A155-L164 HydrophobicContact CB-CD1 4.45Å; I157-L164 HydrophobicContact CD1-CD1 4.23Å; I157-L164 HydrophobicContact CG1-CD1 3.51Å; L164-V166 HydrophobicContact CD2-CG2 4.16Å; L164-V166 HydrophobicContact CG-CG2 4.02Å; L164-V177 HydrophobicContact CB-CB 4.41Å; L164-V177 PolarHBondContact N-O 2.76Å; L164-V177 VanDerWaalsContact N-O 3.15Å; L164-V177 PolarHBondContact O-N 3.49Å
165	Y	73	Confident	63.7	Low	52 Å²	52	55.1 Å²	55.1	20%	0.204	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	126	172.9	-62.2	-85.5	0	0	0	108.6	A155 A156 D158 L163 L174 T176	A155-Y165 CarbonylContact C-O 3.52Å; A155-Y165 WeakPolarHBondContact CA-O 3.42Å; A155-Y165 WeakPolarHBondContact CB-O 3.48Å; A156-Y165 PolarHBondContact N-O 2.83Å; A156-Y165 PolarHBondContact O-N 2.82Å; D158-Y165 HydrophobicContact CB-CD2 4.5Å; D158-Y165 HydrophobicContact CB-CE2 3.8Å; L163-Y165 HydrophobicContact CB-CD2 4.38Å; L163-Y165 HydrophobicContact CB-CE2 3.75Å; L163-Y165 WeakPolarHBondContact CD1-OH 3.46Å; Y165-L174 HydrophobicContact CD1-CD2 3.84Å; Y165-L174 HydrophobicContact CE1-CD2 4.47Å; Y165-T176 HydrophobicContact CD1-CG2 3.62Å; Y165-T176 HydrophobicContact CE1-CG2 3.6Å
166	V	69.5	Low	63.1	Low	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	119.8	175	-177.3	0	0	0	0	108.2	V123 V128 L144 A155 L164 T168 E175	V123-V166 HydrophobicContact CG1-CG1 3.87Å; V123-V166 HydrophobicContact CG1-CG2 4.38Å; V123-V166 HydrophobicContact CG2-CG2 4.47Å; V128-V166 HydrophobicContact CG2-CG2 4.05Å; L144-V166 HydrophobicContact CD1-CG1 4.19Å; L144-V166 HydrophobicContact CD2-CB 4.34Å; L144-V166 HydrophobicContact CD2-CG1 4.12Å; A155-V166 HydrophobicContact CB-CG2 4.07Å; L164-V166 HydrophobicContact CD2-CG2 4.16Å; L164-V166 HydrophobicContact CG-CG2 4.02Å; V166-T168 HydrophobicContact CG1-CG2 4.46Å; V166-E175 PolarHBondContact N-O 2.81Å; V166-E175 VanDerWaalsContact N-O 3.1Å; V166-E175 PolarHBondContact O-N 2.85Å
167	A	65.8	Low	62.7	Low	15 Å²	15	54.2 Å²	54.2	12%	0.124	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	108.3	176.4	0	0	0	0	0	109.5	W152 Q153 D154 L174	W152-A167 WeakPolarHBondContact CA-O 3.44Å; Q153-A167 PolarHBondContact N-O 2.86Å; D154-A167 PolarHBondContact O-N 2.77Å; A167-L174 HydrophobicContact CB-CD1 4.5Å
168	T	60.7	Low	62	Low	13 Å²	13	56 Å²	56	8%	0.08	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	109.8	174.3	48.8	0	0	0	0	108.3	I150 V166 S170 K173	I150-T168 HydrophobicContact CG2-CG2 3.84Å; V166-T168 HydrophobicContact CG1-CG2 4.46Å; T168-S170 PolarHBondContact O-N 3.3Å; T168-K173 PolarHBondContact OG1-O 2.87Å
169	G	54.1	Low	61	Low	35 Å²	35	57.9 Å²	57.9	36%	0.361	31%	0.308	S	S	.	.	S	Bend	trans	-74.8	33.7	-165	0	0	0	0	0	117.1	V151	V151-G169 VanDerWaalsContact O-CA 3.24Å; V151-G169 WeakPolarHBondContact O-CA 3.38Å; V151-G169 PolarHBondContact O-N 2.83Å
170	S	53.3	Low	59.8	Low	33 Å²	33	62.4 Å²	62.4	23%	0.231	31%	0.313	C	S	.	.	S	Bend	trans	-129.2	99.6	179.9	159	0	0	0	0	109	Q147 T168	Q147-S170 PolarHBondContact OE1-OG 3.32Å; T168-S170 PolarHBondContact O-N 3.3Å
171	Q	49.4	Very low	58.4	Low	168 Å²	168	60.7 Å²	60.7	79%	0.785	31%	0.313	S	S	*	.	S	Bend	trans	55.9	103.2	177.4	-60.5	-173.6	-12.9	0	0	115.8	K173	Q171-K173 WeakPolarHBondContact O-CB 3.24Å; Q171-K173 WeakPolarHBondContact O-CG 3.2Å; Q171-K173 PolarHBondContact O-N 3.47Å
172	D	51.4	Low	57.2	Low	129 Å²	129	68.5 Å²	68.5	69%	0.69	34%	0.341	S	S	*	.	S	Bend	trans	38.4	22.4	158.5	-63.1	-18.6	0	0	0	119.8
173	K	49.6	Very low	55.7	Low	90 Å²	90	74.5 Å²	74.5	39%	0.391	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.4	-174.9	-74.4	179.1	179.5	-177.7	0	111.5	T168 Q171	T168-K173 PolarHBondContact OG1-O 2.87Å; Q171-K173 WeakPolarHBondContact O-CB 3.24Å; Q171-K173 WeakPolarHBondContact O-CG 3.2Å; Q171-K173 PolarHBondContact O-N 3.47Å
174	L	51.7	Low	54.2	Low	56 Å²	56	76.7 Å²	76.7	29%	0.293	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.1	172	-161.2	95.1	0	0	0	108.7	Y165 A167 T176	Y165-L174 HydrophobicContact CD1-CD2 3.84Å; Y165-L174 HydrophobicContact CE1-CD2 4.47Å; A167-L174 HydrophobicContact CB-CD1 4.5Å; L174-T176 HydrophobicContact CD2-CG2 4.26Å
175	E	58.4	Low	52.7	Low	9 Å²	9	79.4 Å²	79.4	4%	0.042	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.4	172.9	-71	-169	-172.2	0	0	110	L144 H145 V166 I186	L144-E175 WeakPolarHBondContact CD2-OE2 3.22Å; H145-E175 WeakPolarHBondContact CB-OE1 3.44Å; H145-E175 PolarHBondContact N-OE1 2.73Å; H145-E175 VanDerWaalsContact N-OE1 3.07Å; V166-E175 PolarHBondContact N-O 2.81Å; V166-E175 VanDerWaalsContact N-O 3.1Å; V166-E175 PolarHBondContact O-N 2.85Å; E175-I186 HydrophobicContact CG-CG2 4.41Å
176	T	55.3	Low	51.6	Low	33 Å²	33	80.2 Å²	80.2	20%	0.202	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.3	175.4	48.6	0	0	0	0	110.8	Y165 L174 R187	Y165-T176 HydrophobicContact CD1-CG2 3.62Å; Y165-T176 HydrophobicContact CE1-CG2 3.6Å; L174-T176 HydrophobicContact CD2-CG2 4.26Å; T176-R187 PolarHBondContact OG1-O 2.91Å
177	V	58.9	Low	50.4	Low	5 Å²	5	89.4 Å²	89.4	3%	0.03	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	110.2	175.4	-176	0	0	0	0	109	W140 T142 L164 T184	W140-V177 HydrophobicContact CH2-CG1 3.91Å; W140-V177 HydrophobicContact CZ3-CG1 4.42Å; T142-V177 HydrophobicContact CG2-CG1 4.39Å; T142-V177 HydrophobicContact CG2-CG2 4.33Å; L164-V177 HydrophobicContact CB-CB 4.41Å; L164-V177 PolarHBondContact N-O 2.76Å; L164-V177 VanDerWaalsContact N-O 3.15Å; L164-V177 PolarHBondContact O-N 3.49Å; V177-T184 HydrophobicContact CG1-CG2 4.28Å
178	K	54.9	Low	49.2	Very low	82 Å²	82	93.2 Å²	93.2	36%	0.357	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	120	178.2	-172.1	160.8	-165	167	0	111.5	L163 R180	L163-K178 HydrophobicContact CD2-CB 3.47Å; L163-K178 VanDerWaalsContact CD2-CB 3.47Å; L163-K178 HydrophobicContact CD2-CD 3.79Å; L163-K178 HydrophobicContact CD2-CG 3.41Å; L163-K178 VanDerWaalsContact CD2-CG 3.41Å; K178-R180 PolarHBondContact O-N 2.96Å; K178-R180 VanDerWaalsContact O-N 3.16Å
179	Q	52.9	Low	48.1	Very low	94 Å²	94	94.8 Å²	94.8	44%	0.439	47%	0.47	S	S	.	.			trans	-77.6	94.2	170.1	-165.6	176.9	13.6	0	0	109.4	Y121	Y121-Q179 PolarHBondContact OH-OE1 2.91Å; Y121-Q179 VanDerWaalsContact OH-OE1 3.04Å
180	R	44.3	Very low	47.1	Very low	175 Å²	175	99.4 Å²	99.4	66%	0.66	49%	0.486	S	S	*	.			trans	-131.5	118.2	167.4	-102.9	-173.5	177.4	-179.6	-2.4	109.8	K178 F182 K183	K178-R180 PolarHBondContact O-N 2.96Å; K178-R180 VanDerWaalsContact O-N 3.16Å; R180-F182 PolarHBondContact O-N 2.91Å; R180-K183 PolarHBondContact O-N 3.43Å; R180-K183 VanDerWaalsContact O-N 3.11Å
181	N	41.6	Very low	46.1	Very low	157 Å²	157	104.4 Å²	104.4	84%	0.84	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	35.9	64.7	165.3	-66.8	-5.3	0	0	0	115.9	K183	N181-K183 PolarHBondContact O-N 3.33Å
182	F	40.4	Very low	45.2	Very low	211 Å²	211	101.9 Å²	101.9	93%	0.925	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	13.6	174	-68.2	-84.7	0	0	0	116.4	R180	R180-F182 PolarHBondContact O-N 2.91Å
183	K	37.4	Very low	44.3	Very low	174 Å²	174	102.5 Å²	102.5	76%	0.757	51%	0.507	S	S	*	.			trans	-123.9	103.9	173.3	-77.1	-175.8	175.8	-179.2	0	109.4	R180 N181	R180-K183 PolarHBondContact O-N 3.43Å; R180-K183 VanDerWaalsContact O-N 3.11Å; N181-K183 PolarHBondContact O-N 3.33Å
184	T	42.3	Very low	43.5	Very low	71 Å²	71	103.2 Å²	103.2	44%	0.436	52%	0.523	S	S	.	.			trans	-69.8	124.6	168.6	33	0	0	0	0	109.2	W140 V177	W140-T184 HydrophobicContact CE3-CG2 4.48Å; V177-T184 HydrophobicContact CG1-CG2 4.28Å
185	S	43	Very low	42.5	Very low	65 Å²	65	108.6 Å²	108.6	46%	0.455	55%	0.552	S	S	.	*			trans	-117.3	120.5	163.9	83.2	0	0	0	0	108.7
186	I	49	Very low	41.1	Very low	70 Å²	70	111.2 Å²	111.2	36%	0.359	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.3	126	171.3	-58.7	170.6	0	0	0	107	E175	E175-I186 HydrophobicContact CG-CG2 4.41Å
187	R	45.3	Very low	39.8	Very low	192 Å²	192	117.2 Å²	117.2	73%	0.725	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.1	126.9	166.7	-74.9	-173.4	-177.9	-167.9	-2.5	108.8	T176	T176-R187 PolarHBondContact OG1-O 2.91Å
188	N	39.1	Very low	38.3	Very low	95 Å²	95	124.4 Å²	124.4	51%	0.508	65%	0.65	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90	133.7	169.7	-63.5	-13.5	0	0	0	108.2
189	A	39	Very low	36.9	Very low	46 Å²	46	129.3 Å²	129.3	38%	0.38	67%	0.674	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.7	116.8	168.2	0	0	0	0	0	108	F191	A189-F191 HydrophobicContact CB-CD2 4.19Å; A189-F191 HydrophobicContact CB-CE2 3.85Å
190	D	32.1	Very low	36.1	Very low	132 Å²	132	130.8 Å²	130.8	71%	0.706	69%	0.689	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.7	124.8	172.9	-65.8	-35.1	0	0	0	108.3
191	F	32.8	Very low	35.7	Very low	139 Å²	139	129 Å²	129	61%	0.61	69%	0.692	S	S	*	*			trans	-123.3	117.5	174.3	-80.9	-85.3	0	0	0	109.8	A189	A189-F191 HydrophobicContact CB-CD2 4.19Å; A189-F191 HydrophobicContact CB-CE2 3.85Å
192	S	30.9	Very low	35.2	Very low	114 Å²	114	132.3 Å²	132.3	80%	0.797	69%	0.693	S	S	*	*			trans	-111.6	119.3	169.2	64.8	0	0	0	0	109.8
193	I	32.4	Very low	35	Very low	143 Å²	143	129.5 Å²	129.5	73%	0.733	69%	0.687	S	S	*	*			trans	-94.8	105.7	178.8	-59.2	170.9	0	0	0	108.6	F208	I193-F208 HydrophobicContact CD1-CE1 4.18Å
194	S	31.2	Very low	35.1	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	69%	0.685	S	S	*	*			trans	-110.7	135.2	165.2	59.3	0	0	0	0	109.4
195	D	31.2	Very low	34.9	Very low	169 Å²	169	129.2 Å²	129.2	90%	0.904	69%	0.69	S	S	*	*	S	Bend	trans	-50.5	136.3	-177.8	-74.8	-36.8	0	0	0	114
196	G	29.1	Very low	34.8	Very low	64 Å²	64	131 Å²	131	66%	0.66	69%	0.694	S	S	*	*	S	Bend	trans	108.5	102.6	157.2	0	0	0	0	0	115.6
197	N	27.4	Very low	34.3	Very low	158 Å²	158	132.2 Å²	132.2	85%	0.845	70%	0.7	S	S	*	*			trans	82.6	150.8	161.1	-58.1	-28.5	0	0	0	118.4
198	L	27.2	Very low	33.9	Very low	157 Å²	157	126.5 Å²	126.5	82%	0.822	68%	0.681	S	S	*	*			trans	93.2	92.3	169.2	-71.8	106.6	0	0	0	117.1	V200	L198-V200 PolarHBondContact O-N 2.91Å
199	E	27	Very low	33.8	Very low	185 Å²	185	127 Å²	127	86%	0.864	68%	0.681	S	S	*	*				5	110.4	116.2	-62	-170.4	157.7	0	0	114.2
200	V	34.5	Very low	33.8	Very low	125 Å²	125	131.3 Å²	131.3	76%	0.758	69%	0.688	S	S	*	*			trans	179	123.4	144.4	160.6	0	0	0	0	109.2	L198	L198-V200 PolarHBondContact O-N 2.91Å
201	L	36	Very low	34.2	Very low	137 Å²	137	127.9 Å²	127.9	72%	0.717	67%	0.669	S	S	*	*			trans	57.2	89.1	161.4	-66.4	162.6	0	0	0	119.3	L203	L201-L203 PolarHBondContact O-N 2.74Å
202	W	32.1	Very low	34.5	Very low	226 Å²	226	124 Å²	124	86%	0.856	66%	0.655	S	S	*	*	H	α-helix	trans	-64.9	-10.8	-178.1	-104.2	64.3	0	0	0	118.5
203	L	36.2	Very low	34.8	Very low	152 Å²	152	125.7 Å²	125.7	80%	0.796	65%	0.647	S	S	*	*	H	α-helix	trans	-90.6	-27.6	-169.8	-91.4	153.1	0	0	0	114.9	L201	L201-L203 PolarHBondContact O-N 2.74Å
204	D	39.5	Very low	35.2	Very low	134 Å²	134	124.4 Å²	124.4	72%	0.717	64%	0.638	S	S	*	*	H	α-helix	trans	-84.9	-21.1	179.4	-67.3	-34.1	0	0	0	112.4
205	L	38.2	Very low	35.5	Very low	106 Å²	106	121.2 Å²	121.2	56%	0.555	62%	0.615	S	S	*	*	H	α-helix	trans	-73.8	-28.6	179.6	-123.8	105.8	0	0	0	113.6	F208 M209	L205-F208 PolarHBondContact O-N 3.05Å; L205-M209 WeakPolarHBondContact O-CB 3.09Å; L205-M209 WeakPolarHBondContact O-CG 3.22Å; L205-M209 PolarHBondContact O-N 3.49Å
206	I	40.2	Very low	35.8	Very low	102 Å²	102	118.9 Å²	118.9	52%	0.523	60%	0.601	S	S	.	*	H	α-helix	trans	-70.9	-37.7	-176	-63.7	170.8	0	0	0	111.2	W210	I206-W210 WeakPolarHBondContact O-CB 3.32Å; I206-W210 PolarHBondContact O-N 3.5Å; I206-W210 VanDerWaalsContact O-N 3.1Å
207	L	39.8	Very low	36	Very low	95 Å²	95	122.3 Å²	122.3	50%	0.497	60%	0.603	S	S	.	*	H	α-helix	trans	-71.8	-38.1	175.1	-160.4	76.9	0	0	0	110.9	W210 I211	L207-W210 PolarHBondContact O-N 3.39Å; L207-I211 WeakPolarHBondContact O-CG1 3.28Å; L207-I211 PolarHBondContact O-N 2.67Å; L207-I211 VanDerWaalsContact O-N 3.13Å
208	F	36.7	Very low	36.2	Very low	72 Å²	72	122.1 Å²	122.1	32%	0.316	59%	0.591	S	S	.	*	H	α-helix	trans	-64.2	-45.5	175.4	-166.7	-100.6	0	0	0	111.7	I193 L205 W210 I211 L212	I193-F208 HydrophobicContact CD1-CE1 4.18Å; L205-F208 PolarHBondContact O-N 3.05Å; F208-W210 VanDerWaalsContact C-N 3.3Å; F208-W210 PolarHBondContact O-N 2.98Å; F208-I211 PolarHBondContact O-N 2.85Å; F208-L212 HydrophobicContact CD1-CD1 4.42Å; F208-L212 HydrophobicContact CE1-CD1 3.81Å; F208-L212 HydrophobicContact CE2-CD1 4.49Å; F208-L212 HydrophobicContact CZ-CD1 3.86Å; F208-L212 WeakPolarHBondContact O-CB 3.18Å; F208-L212 PolarHBondContact O-N 2.77Å
209	M	35.6	Very low	36.4	Very low	105 Å²	105	123.6 Å²	123.6	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-63.4	-32.7	174.2	-78.9	-129.3	76.4	0	0	112.7	L205 K213	L205-M209 WeakPolarHBondContact O-CB 3.09Å; L205-M209 WeakPolarHBondContact O-CG 3.22Å; L205-M209 PolarHBondContact O-N 3.49Å; M209-K213 VanDerWaalsContact O-CB 3.26Å; M209-K213 WeakPolarHBondContact O-CB 3.3Å; M209-K213 PolarHBondContact O-N 2.86Å
210	W	38.9	Very low	36.8	Very low	137 Å²	137	120.2 Å²	120.2	52%	0.519	58%	0.583	S	S	.	*	H	α-helix	trans	-69.7	-37.4	176.9	-163.1	71.3	0	0	0	112.5	I206 L207 F208	I206-W210 WeakPolarHBondContact O-CB 3.32Å; I206-W210 PolarHBondContact O-N 3.5Å; I206-W210 VanDerWaalsContact O-N 3.1Å; L207-W210 PolarHBondContact O-N 3.39Å; F208-W210 VanDerWaalsContact C-N 3.3Å; F208-W210 PolarHBondContact O-N 2.98Å
211	I	41.2	Very low	36.7	Very low	60 Å²	60	121.6 Å²	121.6	31%	0.308	59%	0.586	S	S	.	*	H	α-helix	trans	-74.3	-39.2	175.8	-63.4	168.2	0	0	0	110.7	L207 F208 Q214 T215	L207-I211 WeakPolarHBondContact O-CG1 3.28Å; L207-I211 PolarHBondContact O-N 2.67Å; L207-I211 VanDerWaalsContact O-N 3.13Å; F208-I211 PolarHBondContact O-N 2.85Å; I211-Q214 PolarHBondContact O-N 2.95Å; I211-T215 PolarHBondContact O-N 3.3Å; I211-T215 PolarHBondContact O-OG1 3.29Å
212	L	38.6	Very low	36.5	Very low	59 Å²	59	119.2 Å²	119.2	31%	0.309	59%	0.586	S	S	.	*	H	α-helix	trans	-71.9	-35.7	177.6	-126.2	87.9	0	0	0	113.6	F208 Q214 T215 I216	F208-L212 HydrophobicContact CD1-CD1 4.42Å; F208-L212 HydrophobicContact CE1-CD1 3.81Å; F208-L212 HydrophobicContact CE2-CD1 4.49Å; F208-L212 HydrophobicContact CZ-CD1 3.86Å; F208-L212 WeakPolarHBondContact O-CB 3.18Å; F208-L212 PolarHBondContact O-N 2.77Å; L212-Q214 PolarHBondContact O-N 3.23Å; L212-T215 WeakPolarHBondContact CA-OG1 3.46Å; L212-T215 PolarHBondContact O-N 3.4Å; L212-T215 PolarHBondContact O-OG1 3.35Å; L212-I216 HydrophobicContact CD2-CD1 3.99Å; L212-I216 HydrophobicContact CG-CD1 4.45Å; L212-I216 PolarHBondContact O-N 2.82Å
213	K	37.1	Very low	36.4	Very low	148 Å²	148	117.5 Å²	117.5	64%	0.643	59%	0.587	S	S	*	*	H	α-helix	trans	-62.1	-33.4	174.9	-117.4	174.4	172	172.2	0	112.1	M209 T215	M209-K213 VanDerWaalsContact O-CB 3.26Å; M209-K213 WeakPolarHBondContact O-CB 3.3Å; M209-K213 PolarHBondContact O-N 2.86Å; K213-T215 VanDerWaalsContact C-N 3.34Å
214	Q	41.5	Very low	36.1	Very low	117 Å²	117	117 Å²	117	55%	0.547	59%	0.59	S	S	.	*	H	α-helix	trans	-71.6	-29.1	173.6	-74.1	-93.3	-16.4	0	0	111.6	I211 L212	I211-Q214 PolarHBondContact O-N 2.95Å; L212-Q214 PolarHBondContact O-N 3.23Å
215	T	38.4	Very low	35.7	Very low	38 Å²	38	117.4 Å²	117.4	23%	0.233	60%	0.597	C	S	.	*	H	α-helix	trans	-86.1	-31.4	-177.5	7.6	0	0	0	0	114.1	I211 L212 K213	I211-T215 PolarHBondContact O-N 3.3Å; I211-T215 PolarHBondContact O-OG1 3.29Å; L212-T215 WeakPolarHBondContact CA-OG1 3.46Å; L212-T215 PolarHBondContact O-N 3.4Å; L212-T215 PolarHBondContact O-OG1 3.35Å; K213-T215 VanDerWaalsContact C-N 3.34Å
216	I	36.2	Very low	35.2	Very low	119 Å²	119	119.4 Å²	119.4	61%	0.61	61%	0.609	S	S	*	*	H	α-helix	trans	-83.2	-28.8	-178	-64.2	172.9	0	0	0	112.6	L212 W218	L212-I216 HydrophobicContact CD2-CD1 3.99Å; L212-I216 HydrophobicContact CG-CD1 4.45Å; L212-I216 PolarHBondContact O-N 2.82Å; I216-W218 PolarHBondContact O-N 3Å
217	L	34.3	Very low	34.6	Very low	136 Å²	136	124.5 Å²	124.5	71%	0.712	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-10.4	171.7	-111.5	104.9	0	0	0	113.6
218	W	30.8	Very low	33.9	Very low	155 Å²	155	131.8 Å²	131.8	59%	0.587	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-20.8	-177.1	-93.1	57.7	0	0	0	114.4	I216 T220	I216-W218 PolarHBondContact O-N 3Å; W218-T220 PolarHBondContact O-N 3.01Å
219	F	32	Very low	33.5	Very low	188 Å²	188	133.4 Å²	133.4	83%	0.825	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-9.3	-172.4	-101.8	-85.4	0	0	0	115.2
220	T	34.9	Very low	33.1	Very low	113 Å²	113	134.3 Å²	134.3	69%	0.693	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-5.8	-170.4	45.8	0	0	0	0	116.2	W218	W218-T220 PolarHBondContact O-N 3.01Å
221	N	33.5	Very low	32.5	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	70%	0.701	S	S	*	*	S	Bend	trans	-123.6	16.3	-171.8	-84.4	-32.3	0	0	0	116.5
222	A	31.9	Very low	31.9	Very low	86 Å²	86	140.6 Å²	140.6	71%	0.711	73%	0.728	S	S	*	*			trans	-135.7	59	-172.6	0	0	0	0	0	115
223	Q	30.1	Very low	31.5	Very low	190 Å²	190	149 Å²	149	89%	0.888	76%	0.755	S	S	*	*			trans	-152.1	124.2	151.3	-82.5	-155.2	-26	0	0	109.7
224	V	28.9	Very low	31.2	Very low	142 Å²	142	147 Å²	147	86%	0.861	76%	0.759	S	S	*	*			trans	163.6	84.9	134.2	174.9	0	0	0	0	106.7
225	V	30.6	Very low	30.7	Very low	142 Å²	142	152 Å²	152	86%	0.861	77%	0.774	S	S	*	*	S	Bend	trans	-95.1	121.3	149.7	170.6	0	0	0	0	105.7
226	N	27.7	Very low	30.5	Very low	149 Å²	149	154.7 Å²	154.7	80%	0.797	80%	0.795	S	S	*	*			trans	23.2	97.1	157.6	-97.3	-23	0	0	0	117.3
227	K	29.1	Very low	30.3	Very low	208 Å²	208	157.8 Å²	157.8	90%	0.904	80%	0.799	S	S	*	*			trans	-150.8	127.7	137.5	-106.2	170.8	-172.5	-177.1	0	109.3
228	R	24.6	Very low	30.1	Very low	248 Å²	248	158.7 Å²	158.7	94%	0.936	80%	0.797	S	S	*	*			trans	-62.9	129.7	-177.8	-65.4	170.7	173.8	175.6	-3.5	110.7
229	S	26.9	Very low	30.3	Very low	107 Å²	107	154.9 Å²	154.9	75%	0.748	80%	0.799	S	S	*	*			trans	153.8	140.3	145.3	179.8	0	0	0	0	110.9
230	C	28.3	Very low	30.4	Very low	124 Å²	124	151.4 Å²	151.4	84%	0.838	79%	0.785	S	S	*	*			trans	76.2	78.5	169.8	-71	0	0	0	0	119.1
231	K	25.7	Very low	30.4	Very low	205 Å²	205	150.5 Å²	150.5	89%	0.891	78%	0.775	S	S	*	*			trans	-72.1	136.7	146.3	-75.8	178	174.9	179.5	0	109.4
232	S	30	Very low	30.4	Very low	123 Å²	123	148.3 Å²	148.3	86%	0.86	76%	0.763	S	S	*	*	S	Bend	trans	161.4	-7.2	131	55.5	0	0	0	0	117.5
233	R	29.1	Very low	30.5	Very low	235 Å²	235	147.4 Å²	147.4	89%	0.887	76%	0.756	S	S	*	*	S	Bend	trans	-114.4	-6	-170.7	-123.4	175.3	-176.3	178.4	0.6	119
234	C	30.3	Very low	30.5	Very low	107 Å²	107	147.2 Å²	147.2	72%	0.723	75%	0.747	S	S	*	*	S	Bend	trans	-105.7	2.1	-170.9	-73.1	0	0	0	0	116.4
235	Y	31.5	Very low	30.8	Very low	221 Å²	221	146.5 Å²	146.5	87%	0.867	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-15.4	-175.7	-92.2	-87	0	0	0	115.2
236	S	33.4	Very low	30.8	Very low	96 Å²	96	148.1 Å²	148.1	67%	0.671	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-25.8	178.5	83.2	0	0	0	0	114.8
237	R	31.9	Very low	31	Very low	184 Å²	184	146.1 Å²	146.1	69%	0.694	73%	0.725	S	S	*	*	H	α-helix	trans	-80.5	-17.9	-179.6	-96.4	-176.7	177.2	179.4	-0.9	114.7	E240 I241	R237-E240 PolarHBondContact O-N 3.36Å; R237-I241 WeakPolarHBondContact O-CG1 3.46Å; R237-I241 PolarHBondContact O-N 3.4Å
238	K	31.8	Very low	30.9	Very low	154 Å²	154	145.8 Å²	145.8	67%	0.67	72%	0.724	S	S	*	*	H	α-helix	trans	-73	-34.2	-179	-155.3	171.9	-177.3	179.4	0	112.2	D242	K238-D242 PolarHBondContact O-N 3.44Å
239	A	34.9	Very low	31.2	Very low	75 Å²	75	141.2 Å²	141.2	62%	0.62	71%	0.714	S	S	*	*	H	α-helix	trans	-73.6	-27	175.4	0	0	0	0	0	113.4
240	E	33.7	Very low	31.3	Very low	115 Å²	115	143.7 Å²	143.7	54%	0.537	72%	0.719	S	S	.	*	H	α-helix	trans	-83.4	-27.6	-180	-158.1	176	-173.2	0	0	112.5	R237 R244	R237-E240 PolarHBondContact O-N 3.36Å; E240-R244 PolarHBondContact O-N 3.16Å
241	I	35.3	Very low	31.4	Very low	95 Å²	95	146.2 Å²	146.2	49%	0.487	72%	0.718	S	S	.	*	H	α-helix	trans	-80.8	-38.1	176.4	-66.1	169.1	0	0	0	111.2	R237 A243 R244 I245	R237-I241 WeakPolarHBondContact O-CG1 3.46Å; R237-I241 PolarHBondContact O-N 3.4Å; I241-A243 PolarHBondContact O-N 3.4Å; I241-R244 PolarHBondContact O-N 3.37Å; I241-I245 HydrophobicContact CG2-CD1 3.8Å; I241-I245 HydrophobicContact CG2-CG1 4.48Å; I241-I245 WeakPolarHBondContact O-CG1 3.31Å; I241-I245 PolarHBondContact O-N 3.42Å
242	D	33.1	Very low	31.5	Very low	109 Å²	109	145 Å²	145	58%	0.583	72%	0.716	S	S	*	*	H	α-helix	trans	-67.6	-19.7	174.6	-75.1	-19.8	0	0	0	112.7	K238	K238-D242 PolarHBondContact O-N 3.44Å
243	A	33.2	Very low	31.3	Very low	66 Å²	66	146.3 Å²	146.3	55%	0.545	71%	0.706	S	S	.	*	H	α-helix	trans	-86.4	-27.1	173.7	0	0	0	0	0	114	I241	I241-A243 PolarHBondContact O-N 3.4Å
244	R	31.1	Very low	31.2	Very low	186 Å²	186	140.3 Å²	140.3	70%	0.702	70%	0.699	S	S	*	*	H	α-helix	trans	-87.7	-15.5	-179.6	-93.7	-179.9	165.3	174.9	-3	114.8	E240 I241 K246 T247	E240-R244 PolarHBondContact O-N 3.16Å; I241-R244 PolarHBondContact O-N 3.37Å; R244-K246 PolarHBondContact O-N 2.87Å; R244-T247 PolarHBondContact O-OG1 3.14Å
245	I	33.8	Very low	30.9	Very low	127 Å²	127	138 Å²	138	65%	0.651	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-76.8	-4.4	176.5	-67.1	167.9	0	0	0	111.8	I241 T247	I241-I245 HydrophobicContact CG2-CD1 3.8Å; I241-I245 HydrophobicContact CG2-CG1 4.48Å; I241-I245 WeakPolarHBondContact O-CG1 3.31Å; I241-I245 PolarHBondContact O-N 3.42Å; I245-T247 PolarHBondContact O-N 2.8Å
246	K	32.3	Very low	30.7	Very low	177 Å²	177	133 Å²	133	77%	0.77	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-83.6	6.2	177.2	-87.1	-175.3	173	-177.9	0	116.1	R244	R244-K246 PolarHBondContact O-N 2.87Å
247	T	30.4	Very low	30.5	Very low	106 Å²	106	133.1 Å²	133.1	65%	0.65	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-135.3	28.3	-171.8	52.3	0	0	0	0	115.5	R244 I245	R244-T247 PolarHBondContact O-OG1 3.14Å; I245-T247 PolarHBondContact O-N 2.8Å
248	F	28.6	Very low	30.2	Very low	201 Å²	201	129.2 Å²	129.2	88%	0.882	67%	0.673	S	S	*	*			trans	-122.3	75	165.7	-86.6	-86.2	0	0	0	109.1
249	E	30.2	Very low	30.1	Very low	153 Å²	153	129.5 Å²	129.5	72%	0.715	67%	0.674	S	S	*	*			trans	-100.7	156.2	161.7	-68.9	-178.5	149.6	0	0	107.8
250	D	29.7	Very low	29.9	Very low	159 Å²	159	135.4 Å²	135.4	85%	0.85	69%	0.689	S	S	*	*			trans	99.8	112.2	-174.2	-54.9	-19.2	0	0	0	111.8
251	E	28.6	Very low	30.2	Very low	177 Å²	177	135 Å²	135	83%	0.827	69%	0.69	S	S	*	*	S	Bend	cis	-153.1	149.8	18.8	-70.8	180	150.7	0	0	111.1
252	E	28.5	Very low	30.6	Very low	179 Å²	179	132.2 Å²	132.2	84%	0.836	68%	0.682	S	S	*	*	S	Bend	trans	61.4	80	166.3	-56.3	-175.8	175.7	0	0	118.2
253	F	26.6	Very low	31.6	Very low	151 Å²	151	131.3 Å²	131.3	66%	0.662	68%	0.68	S	S	*	*	S	Bend	cis	-147.8	122.8	45.2	-94.7	-106.4	0	0	0	107.7	S255 D292	F253-S255 PolarHBondContact O-N 2.99Å; F253-D292 WeakPolarHBondContact CE1-O 3.35Å; F253-D292 WeakPolarHBondContact CZ-O 3.41Å
254	C	25.3	Very low	32.6	Very low	109 Å²	109	133.2 Å²	133.2	74%	0.736	68%	0.68	S	S	*	*			trans	-53.2	125	176.1	-73.4	0	0	0	0	112.4	I256	C254-I256 PolarHBondContact O-N 3.19Å; C254-I256 VanDerWaalsContact O-N 3.15Å
255	S	25.4	Very low	33.7	Very low	57 Å²	57	125.9 Å²	125.9	40%	0.399	66%	0.656	S	S	.	*				10.1	94.1	118.2	48	0	0	0	0	115.1	F253 S257	F253-S255 PolarHBondContact O-N 2.99Å; S255-S257 PolarHBondContact O-N 2.87Å
256	I	27.1	Very low	34.8	Very low	116 Å²	116	122.4 Å²	122.4	60%	0.595	64%	0.639	S	S	*	*	S	Bend	trans	-80.9	64.1	146.9	-59.2	168.7	0	0	0	106.4	C254 Y289	C254-I256 PolarHBondContact O-N 3.19Å; C254-I256 VanDerWaalsContact O-N 3.15Å; I256-Y289 HydrophobicContact CD1-CE1 3.58Å; I256-Y289 WeakPolarHBondContact CD1-OH 3.29Å
257	S	28.6	Very low	35.9	Very low	100 Å²	100	117.6 Å²	117.6	70%	0.699	62%	0.624	S	S	*	*			trans	-129.1	52.1	157.8	64.3	0	0	0	0	106.1	S255	S255-S257 PolarHBondContact O-N 2.87Å
258	S	26.7	Very low	37.2	Very low	102 Å²	102	117.6 Å²	117.6	71%	0.713	62%	0.616	S	S	*	*			trans	-141.2	45	177.2	174	0	0	0	0	109.9
259	K	29.2	Very low	38.3	Very low	160 Å²	160	116.1 Å²	116.1	70%	0.696	61%	0.605	S	S	*	*	S	Bend	trans	-134	126.7	141.7	-81.9	-171.6	179.1	177.9	0	105.1	N261	K259-N261 PolarHBondContact O-N 3.38Å
260	Q	31	Very low	39.3	Very low	198 Å²	198	111.1 Å²	111.1	93%	0.925	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	4.1	-154.9	-77.5	178.7	-30.5	0	0	117.6
261	N	38.6	Very low	40.6	Very low	107 Å²	107	106.8 Å²	106.8	57%	0.572	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.2	12	-173.9	-74.9	-19	0	0	0	116.5	K259 E281	K259-N261 PolarHBondContact O-N 3.38Å; N261-E281 PolarHBondContact ND2-OE1 2.72Å
262	A	44.6	Very low	41.4	Very low	37 Å²	37	105.8 Å²	105.8	31%	0.306	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-95.2	122.1	-174.7	0	0	0	0	0	114.4	V279 E280	A262-V279 WeakPolarHBondContact CA-O 3.19Å; A262-E280 HydrophobicContact CB-CG 3.77Å
263	T	54.1	Low	42.9	Very low	90 Å²	90	97.6 Å²	97.6	55%	0.552	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.9	171.2	54.2	0	0	0	0	111.2	V265 S278 V279	T263-V265 PolarHBondContact O-N 3.23Å; T263-S278 VanDerWaalsContact O-CA 3.29Å; T263-S278 WeakPolarHBondContact O-CA 3.25Å; T263-V279 PolarHBondContact N-O 3.1Å; T263-V279 PolarHBondContact O-N 3.09Å
264	I	54.6	Low	44.5	Very low	105 Å²	105	97.3 Å²	97.3	54%	0.538	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	123.6	172.8	-60.9	171.7	0	0	0	109.1	V267 V276 S277	I264-V267 HydrophobicContact CG2-CG2 4.01Å; I264-V276 HydrophobicContact CD1-CG1 4.36Å; I264-V276 HydrophobicContact CG1-CG1 4.14Å; I264-V276 HydrophobicContact CG2-CG1 3.78Å; I264-S277 CarbonylContact C-O 3.56Å
265	V	54.4	Low	46.4	Very low	33 Å²	33	92.3 Å²	92.3	20%	0.2	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-43.1	-175	-179.9	0	0	0	0	112.3	T263 S277 V279 L312 V315	T263-V265 PolarHBondContact O-N 3.23Å; V265-S277 PolarHBondContact N-O 2.95Å; V265-V279 HydrophobicContact CG2-CB 4.42Å; V265-V279 HydrophobicContact CG2-CG2 3.53Å; V265-L312 HydrophobicContact CG1-CB 3.85Å; V265-L312 HydrophobicContact CG2-CB 4.39Å; V265-L312 HydrophobicContact CG2-CD1 4.48Å; V265-V315 HydrophobicContact CG1-CB 4.34Å; V265-V315 HydrophobicContact CG1-CG2 3.79Å
266	D	55.4	Low	48.3	Very low	54 Å²	54	90.8 Å²	90.8	29%	0.289	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	151.2	179.1	-161.3	1.2	0	0	0	111.5	S277	D266-S277 WeakPolarHBondContact CA-OG 3.25Å; D266-S277 WeakPolarHBondContact CB-OG 3.27Å; D266-S277 PolarHBondContact N-OG 3.4Å; D266-S277 PolarHBondContact O-N 2.85Å; D266-S277 PolarHBondContact O-OG 3.14Å
267	V	55.3	Low	50.1	Low	75 Å²	75	85.5 Å²	85.5	46%	0.455	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	108.4	174.4	-175.8	0	0	0	0	109.8	I264 R274 L275 V276	I264-V267 HydrophobicContact CG2-CG2 4.01Å; V267-R274 HydrophobicContact CG1-CB 4.44Å; V267-L275 CarbonylContact C-O 3.59Å; V267-L275 WeakPolarHBondContact CA-O 3.47Å; V267-V276 HydrophobicContact CG1-CG2 4.31Å; V267-V276 HydrophobicContact CG2-CG1 4.43Å; V267-V276 HydrophobicContact CG2-CG2 4.22Å
268	H	58.3	Low	51.8	Low	107 Å²	107	81.3 Å²	81.3	50%	0.495	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.2	-178.9	-156.7	72.1	0	0	0	111.9	L275	H268-L275 HydrophobicContact CB-CB 4.33Å; H268-L275 PolarHBondContact N-O 2.64Å; H268-L275 PolarHBondContact O-N 3.06Å
269	R	51.8	Low	53.5	Low	169 Å²	169	77.3 Å²	77.3	64%	0.638	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	122.7	176.1	-166.7	178	-172.7	174.4	4.3	109.8
270	R	51.3	Low	55.1	Low	48 Å²	48	72.5 Å²	72.5	18%	0.181	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	111.5	176.1	-167.7	173.8	-178.8	-135.7	-0.7	111.3	K272 G273 L275 F319 A320	R270-K272 PolarHBondContact O-N 3.31Å; R270-G273 PolarHBondContact N-O 2.94Å; R270-G273 PolarHBondContact O-N 2.8Å; R270-L275 HydrophobicContact CB-CD1 3.9Å; R270-F319 VanDerWaalsContact CZ-CB 3.41Å; R270-A320 PolarHBondContact NH2-O 3.02Å
271	G	57.5	Low	56.5	Low	69 Å²	69	70.3 Å²	70.3	71%	0.711	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	-117.5	-179.4	0	0	0	0	0	112
272	K	45.4	Very low	57.2	Low	155 Å²	155	67.3 Å²	67.3	67%	0.674	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-16.9	176.6	-67.6	-162.4	-178.8	173.7	0	114.2	R270 K291	R270-K272 PolarHBondContact O-N 3.31Å; K272-K291 VanDerWaalsContact CB-CE 3.43Å; K272-K291 WeakPolarHBondContact O-CA 3.45Å; K272-K291 WeakPolarHBondContact O-CB 3.45Å; K272-K291 WeakPolarHBondContact O-CE 3.25Å; K272-K291 WeakPolarHBondContact O-CG 3.39Å; K272-K291 PolarHBondContact O-N 2.86Å
273	G	59.8	Low	58.2	Low	7 Å²	7	65.6 Å²	65.6	7%	0.072	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	176.8	-176.5	0	0	0	0	0	115.7	R270 Y289	R270-G273 PolarHBondContact N-O 2.94Å; R270-G273 PolarHBondContact O-N 2.8Å; G273-Y289 CarbonylContact C-O 3.56Å; G273-Y289 WeakPolarHBondContact CA-O 3.47Å
274	R	59.6	Low	58.9	Low	145 Å²	145	61.3 Å²	61.3	55%	0.547	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.8	171.9	-67.9	-176.9	-177	173.4	3.8	110	V267 Y289	V267-R274 HydrophobicContact CG1-CB 4.44Å; R274-Y289 PolarHBondContact N-O 2.77Å; R274-Y289 PolarHBondContact O-N 2.83Å
275	L	64.7	Low	59.6	Low	5 Å²	5	57.2 Å²	57.2	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.5	170.2	-77.5	153	0	0	0	108.6	V267 H268 R270 I286 S287 L288 F319	V267-L275 CarbonylContact C-O 3.59Å; V267-L275 WeakPolarHBondContact CA-O 3.47Å; H268-L275 HydrophobicContact CB-CB 4.33Å; H268-L275 PolarHBondContact N-O 2.64Å; H268-L275 PolarHBondContact O-N 3.06Å; R270-L275 HydrophobicContact CB-CD1 3.9Å; L275-I286 HydrophobicContact CD2-CG2 3.75Å; L275-S287 CarbonylContact C-O 3.49Å; L275-S287 WeakPolarHBondContact CA-O 3.25Å; L275-L288 HydrophobicContact CD2-CB 4.03Å; L275-L288 HydrophobicContact CD2-CD1 3.7Å; L275-L288 HydrophobicContact CD2-CG 4.47Å; L275-L288 HydrophobicContact CG-CD1 3.68Å; L275-F319 HydrophobicContact CD1-CD2 4.22Å; L275-F319 HydrophobicContact CD1-CE1 4.32Å; L275-F319 HydrophobicContact CD1-CE2 3.2Å; L275-F319 HydrophobicContact CD1-CZ 3.28Å; L275-F319 HydrophobicContact CD2-CE1 3.81Å; L275-F319 HydrophobicContact CD2-CE2 4.17Å; L275-F319 HydrophobicContact CD2-CZ 3.29Å; L275-F319 HydrophobicContact CG-CE2 4.28Å; L275-F319 HydrophobicContact CG-CZ 3.88Å
276	V	65.6	Low	60.3	Low	24 Å²	24	55.9 Å²	55.9	15%	0.145	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.1	173.7	-178.8	0	0	0	0	106.5	I264 V267 S287 Y289	I264-V276 HydrophobicContact CD1-CG1 4.36Å; I264-V276 HydrophobicContact CG1-CG1 4.14Å; I264-V276 HydrophobicContact CG2-CG1 3.78Å; V267-V276 HydrophobicContact CG1-CG2 4.31Å; V267-V276 HydrophobicContact CG2-CG1 4.43Å; V267-V276 HydrophobicContact CG2-CG2 4.22Å; V276-S287 PolarHBondContact N-O 2.93Å; V276-S287 PolarHBondContact O-N 3Å; V276-Y289 HydrophobicContact CB-CD2 4.29Å; V276-Y289 HydrophobicContact CB-CE2 3.97Å; V276-Y289 HydrophobicContact CG2-CD2 3.74Å; V276-Y289 HydrophobicContact CG2-CE2 3.81Å
277	S	65.3	Low	60.9	Low	5 Å²	5	53.5 Å²	53.5	4%	0.035	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.1	167.6	54.9	0	0	0	0	108.6	I264 V265 D266 L285	I264-S277 CarbonylContact C-O 3.56Å; V265-S277 PolarHBondContact N-O 2.95Å; D266-S277 WeakPolarHBondContact CA-OG 3.25Å; D266-S277 WeakPolarHBondContact CB-OG 3.27Å; D266-S277 PolarHBondContact N-OG 3.4Å; D266-S277 PolarHBondContact O-N 2.85Å; D266-S277 PolarHBondContact O-OG 3.14Å; S277-L285 CarbonylContact C-O 3.59Å; S277-L285 WeakPolarHBondContact CA-O 3.49Å
278	S	64.6	Low	61.4	Low	12 Å²	12	50.1 Å²	50.1	8%	0.084	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.2	172.8	54.2	0	0	0	0	109.7	T263 L285	T263-S278 VanDerWaalsContact O-CA 3.29Å; T263-S278 WeakPolarHBondContact O-CA 3.25Å; S278-L285 PolarHBondContact N-O 3.29Å; S278-L285 PolarHBondContact O-N 3.32Å
279	V	63	Low	61.7	Low	19 Å²	19	46.5 Å²	46.5	12%	0.115	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.2	173.5	176.4	0	0	0	0	107.8	A262 T263 V265 L284 L308 L312	A262-V279 WeakPolarHBondContact CA-O 3.19Å; T263-V279 PolarHBondContact N-O 3.1Å; T263-V279 PolarHBondContact O-N 3.09Å; V265-V279 HydrophobicContact CG2-CB 4.42Å; V265-V279 HydrophobicContact CG2-CG2 3.53Å; V279-L284 HydrophobicContact CG2-CD1 3.97Å; V279-L308 HydrophobicContact CG1-CD2 3.64Å; V279-L312 HydrophobicContact CG2-CD1 3.39Å; V279-L312 HydrophobicContact CG2-CG 4.35Å
280	E	63.1	Low	62.1	Low	59 Å²	59	41 Å²	41	28%	0.276	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	164.7	171.6	-63.8	-168.6	169.4	0	0	109	A262 G282 G283 L308	A262-E280 HydrophobicContact CB-CG 3.77Å; E280-G282 PolarHBondContact O-N 3.08Å; E280-G283 PolarHBondContact N-O 2.94Å; E280-G283 PolarHBondContact O-N 3.3Å; E280-L308 WeakPolarHBondContact O-CD2 3.45Å
281	E	59.6	Low	62.4	Low	151 Å²	151	44.3 Å²	44.3	71%	0.706	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-22.2	-178.9	-69.8	178.8	-178.9	0	0	114.3	N261 L308	N261-E281 PolarHBondContact ND2-OE1 2.72Å; E281-L308 WeakPolarHBondContact O-CD1 3.09Å
282	G	54.3	Low	62.1	Low	44 Å²	44	46.6 Å²	46.6	45%	0.454	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.5	177.1	0	0	0	0	0	115.7	E280	E280-G282 PolarHBondContact O-N 3.08Å
283	G	64.5	Low	62.6	Low	2 Å²	2	40.7 Å²	40.7	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.2	-163.4	-179.3	0	0	0	0	0	114.4	E280	E280-G283 PolarHBondContact N-O 2.94Å; E280-G283 PolarHBondContact O-N 3.3Å
284	L	68.7	Low	62.7	Low	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	112.2	177.1	177.5	78.1	0	0	0	109.3	V279 I286 V301 L303 L312 V315 V329 I331	V279-L284 HydrophobicContact CG2-CD1 3.97Å; L284-I286 HydrophobicContact CD2-CD1 4.11Å; L284-I286 HydrophobicContact CD2-CG1 4.19Å; L284-I286 HydrophobicContact CG-CG1 4.27Å; L284-V301 HydrophobicContact CB-CB 4.29Å; L284-V301 PolarHBondContact N-O 3Å; L284-V301 PolarHBondContact O-N 3.18Å; L284-L303 HydrophobicContact CB-CD1 3.74Å; L284-L303 HydrophobicContact CB-CG 4.27Å; L284-L312 HydrophobicContact CD1-CD1 4.2Å; L284-V315 HydrophobicContact CD1-CG1 4.02Å; L284-V315 HydrophobicContact CD1-CG2 3.97Å; L284-V315 HydrophobicContact CD2-CG1 3.4Å; L284-V315 VanDerWaalsContact CD2-CG1 3.4Å; L284-V315 HydrophobicContact CD2-CG2 4.36Å; L284-V315 HydrophobicContact CG-CG1 4.27Å; L284-V329 HydrophobicContact CD2-CG1 3.86Å; L284-I331 HydrophobicContact CD2-CD1 4.19Å
285	L	69.6	Low	63	Low	19 Å²	19	42.3 Å²	42.3	10%	0.099	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.9	174.3	-165.5	86	0	0	0	109.5	S277 S278 S287 Q298 E300	S277-L285 CarbonylContact C-O 3.59Å; S277-L285 WeakPolarHBondContact CA-O 3.49Å; S278-L285 PolarHBondContact N-O 3.29Å; S278-L285 PolarHBondContact O-N 3.32Å; L285-S287 WeakPolarHBondContact CD2-OG 3.39Å; L285-Q298 HydrophobicContact CD1-CB 4.4Å; L285-E300 HydrophobicContact CD1-CB 4.39Å
286	I	69.8	Low	63	Low	4 Å²	4	46 Å²	46	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	104.9	173.3	-60.9	159.9	0	0	0	107.7	L275 L284 Q298 A299 V301 P317 F319 V326 V329	L275-I286 HydrophobicContact CD2-CG2 3.75Å; L284-I286 HydrophobicContact CD2-CD1 4.11Å; L284-I286 HydrophobicContact CD2-CG1 4.19Å; L284-I286 HydrophobicContact CG-CG1 4.27Å; I286-Q298 CarbonylContact O-C 3.6Å; I286-Q298 VanDerWaalsContact O-CA 3.31Å; I286-Q298 WeakPolarHBondContact O-CA 3.25Å; I286-A299 PolarHBondContact N-O 3.46Å; I286-A299 PolarHBondContact O-N 2.94Å; I286-V301 HydrophobicContact CD1-CG2 4.14Å; I286-P317 HydrophobicContact CD1-CB 3.9Å; I286-P317 HydrophobicContact CG2-CB 4.45Å; I286-P317 HydrophobicContact CG2-CG 4.25Å; I286-F319 HydrophobicContact CG2-CZ 4.29Å; I286-V326 HydrophobicContact CD1-CG2 4.28Å; I286-V329 HydrophobicContact CD1-CG1 4.4Å; I286-V329 HydrophobicContact CD1-CG2 3.72Å
287	S	67.8	Low	62.9	Low	4 Å²	4	46.9 Å²	46.9	3%	0.028	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	131.2	179.3	-62	0	0	0	0	110.7	L275 V276 L285 Y289	L275-S287 CarbonylContact C-O 3.49Å; L275-S287 WeakPolarHBondContact CA-O 3.25Å; V276-S287 PolarHBondContact N-O 2.93Å; V276-S287 PolarHBondContact O-N 3Å; L285-S287 WeakPolarHBondContact CD2-OG 3.39Å; S287-Y289 VanDerWaalsContact CB-CE2 3.43Å
288	L	64.9	Low	63.2	Low	4 Å²	4	52 Å²	52	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.5	173.3	-178.6	71.4	0	0	0	108.9	L275 I296 S297 F324	L275-L288 HydrophobicContact CD2-CB 4.03Å; L275-L288 HydrophobicContact CD2-CD1 3.7Å; L275-L288 HydrophobicContact CD2-CG 4.47Å; L275-L288 HydrophobicContact CG-CD1 3.68Å; L288-I296 HydrophobicContact CB-CB 4.34Å; L288-I296 HydrophobicContact CD2-CB 3.92Å; L288-I296 HydrophobicContact CD2-CD1 3.99Å; L288-I296 HydrophobicContact CD2-CG2 3.78Å; L288-I296 HydrophobicContact CG-CB 4.04Å; L288-I296 HydrophobicContact CG-CD1 3.98Å; L288-I296 HydrophobicContact CG-CG1 4.5Å; L288-I296 HydrophobicContact CG-CG2 4.46Å; L288-I296 WeakPolarHBondContact O-CB 3.42Å; L288-I296 PolarHBondContact O-N 2.85Å; L288-S297 PolarHBondContact N-O 2.88Å; L288-S297 PolarHBondContact O-N 2.81Å; L288-F324 HydrophobicContact CD1-CD1 4.34Å; L288-F324 HydrophobicContact CD1-CE1 4.23Å; L288-F324 HydrophobicContact CD2-CB 4.25Å; L288-F324 HydrophobicContact CD2-CD1 3.41Å; L288-F324 VanDerWaalsContact CD2-CD1 3.41Å; L288-F324 HydrophobicContact CD2-CD2 4.4Å; L288-F324 HydrophobicContact CD2-CE1 3.74Å; L288-F324 HydrophobicContact CD2-CG 3.78Å; L288-F324 HydrophobicContact CD2-CZ 4.36Å
289	Y	64.9	Low	63	Low	32 Å²	32	52.9 Å²	52.9	13%	0.125	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.5	173.7	-63	-87.9	0	0	0	109.9	I256 G273 R274 V276 S287 G293 T294 Y295	I256-Y289 HydrophobicContact CD1-CE1 3.58Å; I256-Y289 WeakPolarHBondContact CD1-OH 3.29Å; G273-Y289 CarbonylContact C-O 3.56Å; G273-Y289 WeakPolarHBondContact CA-O 3.47Å; R274-Y289 PolarHBondContact N-O 2.77Å; R274-Y289 PolarHBondContact O-N 2.83Å; V276-Y289 HydrophobicContact CB-CD2 4.29Å; V276-Y289 HydrophobicContact CB-CE2 3.97Å; V276-Y289 HydrophobicContact CG2-CD2 3.74Å; V276-Y289 HydrophobicContact CG2-CE2 3.81Å; S287-Y289 VanDerWaalsContact CB-CE2 3.43Å; Y289-G293 WeakPolarHBondContact CD1-O 3.36Å; Y289-T294 CarbonylContact C-O 3.55Å; Y289-T294 VanDerWaalsContact CA-O 3.29Å; Y289-T294 WeakPolarHBondContact CA-O 3.48Å; Y289-Y295 HydrophobicContact CE1-CD2 4.29Å
290	D	59.3	Low	63.1	Low	53 Å²	53	57.7 Å²	57.7	28%	0.283	31%	0.306	S	S	.	.			trans	-71.2	172.7	169.4	-153.1	-5.4	0	0	0	110.5	D292 G293 T294 I296	D290-D292 PolarHBondContact O-N 2.71Å; D290-G293 PolarHBondContact O-N 2.78Å; D290-T294 WeakPolarHBondContact CB-OG1 3.35Å; D290-T294 PolarHBondContact N-O 2.91Å; D290-I296 HydrophobicContact CB-CD1 3.67Å; D290-I296 HydrophobicContact CB-CG1 3.94Å
291	K	57.6	Low	63.1	Low	118 Å²	118	55 Å²	55	51%	0.513	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-29.3	176.6	-137.7	173.6	-92.1	-168.2	0	113	K272 G293	K272-K291 VanDerWaalsContact CB-CE 3.43Å; K272-K291 WeakPolarHBondContact O-CA 3.45Å; K272-K291 WeakPolarHBondContact O-CB 3.45Å; K272-K291 WeakPolarHBondContact O-CE 3.25Å; K272-K291 WeakPolarHBondContact O-CG 3.39Å; K272-K291 PolarHBondContact O-N 2.86Å; K291-G293 VanDerWaalsContact C-N 3.32Å
292	D	51.3	Low	63	Low	116 Å²	116	51.1 Å²	51.1	62%	0.62	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	7.2	-178.7	-54.6	-28.8	0	0	0	112.3	F253 D290 T294	F253-D292 WeakPolarHBondContact CE1-O 3.35Å; F253-D292 WeakPolarHBondContact CZ-O 3.41Å; D290-D292 PolarHBondContact O-N 2.71Å; D292-T294 PolarHBondContact O-N 2.98Å
293	G	57.3	Low	63.3	Low	31 Å²	31	50.2 Å²	50.2	32%	0.32	27%	0.266	S	S	.	.	S	Bend	trans	78.5	2.3	-178.1	0	0	0	0	0	114.2	Y289 D290 K291	Y289-G293 WeakPolarHBondContact CD1-O 3.36Å; D290-G293 PolarHBondContact O-N 2.78Å; K291-G293 VanDerWaalsContact C-N 3.32Å
294	T	61.9	Low	62.8	Low	69 Å²	69	56.2 Å²	56.2	42%	0.423	30%	0.298	S	S	.	.			trans	-70.1	131.3	174.9	45.5	0	0	0	0	110.7	Y289 D290 D292 I296	Y289-T294 CarbonylContact C-O 3.55Å; Y289-T294 VanDerWaalsContact CA-O 3.29Å; Y289-T294 WeakPolarHBondContact CA-O 3.48Å; D290-T294 WeakPolarHBondContact CB-OG1 3.35Å; D290-T294 PolarHBondContact N-O 2.91Å; D292-T294 PolarHBondContact O-N 2.98Å; T294-I296 PolarHBondContact O-N 3.39Å
295	Y	66.1	Low	61.7	Low	117 Å²	117	61.3 Å²	61.3	46%	0.459	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	126.5	174.5	170	-92.8	0	0	0	110.4	Y289 Q298	Y289-Y295 HydrophobicContact CE1-CD2 4.29Å; Y295-Q298 HydrophobicContact CE2-CB 3.92Å; Y295-Q298 WeakPolarHBondContact OH-CB 3.35Å; Y295-Q298 WeakPolarHBondContact OH-CG 3.13Å; Y295-Q298 PolarHBondContact OH-N 3.4Å
296	I	63.7	Low	60.7	Low	82 Å²	82	63.9 Å²	63.9	42%	0.421	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-54.8	178.3	-60.7	172.5	0	0	0	110.1	L288 D290 T294	L288-I296 HydrophobicContact CB-CB 4.34Å; L288-I296 HydrophobicContact CD2-CB 3.92Å; L288-I296 HydrophobicContact CD2-CD1 3.99Å; L288-I296 HydrophobicContact CD2-CG2 3.78Å; L288-I296 HydrophobicContact CG-CB 4.04Å; L288-I296 HydrophobicContact CG-CD1 3.98Å; L288-I296 HydrophobicContact CG-CG1 4.5Å; L288-I296 HydrophobicContact CG-CG2 4.46Å; L288-I296 WeakPolarHBondContact O-CB 3.42Å; L288-I296 PolarHBondContact O-N 2.85Å; D290-I296 HydrophobicContact CB-CD1 3.67Å; D290-I296 HydrophobicContact CB-CG1 3.94Å; T294-I296 PolarHBondContact O-N 3.39Å
297	S	63.7	Low	59.6	Low	43 Å²	43	64.9 Å²	64.9	30%	0.301	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	158.8	-175.6	63.1	0	0	0	0	111.4	L288	L288-S297 PolarHBondContact N-O 2.88Å; L288-S297 PolarHBondContact O-N 2.81Å
298	Q	70.5	Confident	58.4	Low	114 Å²	114	67.3 Å²	67.3	53%	0.533	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.6	168.8	70.4	-162.2	-13.3	0	0	110	L285 I286 Y295	L285-Q298 HydrophobicContact CD1-CB 4.4Å; I286-Q298 CarbonylContact O-C 3.6Å; I286-Q298 VanDerWaalsContact O-CA 3.31Å; I286-Q298 WeakPolarHBondContact O-CA 3.25Å; Y295-Q298 HydrophobicContact CE2-CB 3.92Å; Y295-Q298 WeakPolarHBondContact OH-CB 3.35Å; Y295-Q298 WeakPolarHBondContact OH-CG 3.13Å; Y295-Q298 PolarHBondContact OH-N 3.4Å
299	A	62	Low	57.5	Low	30 Å²	30	71.4 Å²	71.4	25%	0.248	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	121.8	165.1	0	0	0	0	0	107.7	I286 V326	I286-A299 PolarHBondContact N-O 3.46Å; I286-A299 PolarHBondContact O-N 2.94Å; A299-V326 HydrophobicContact CB-CB 4.38Å; A299-V326 HydrophobicContact CB-CG2 3.63Å
300	E	63.5	Low	56.8	Low	120 Å²	120	71.2 Å²	71.2	56%	0.561	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	127.4	172.7	-169.1	175.7	-176.8	0	0	108.7	L285	L285-E300 HydrophobicContact CD1-CB 4.39Å
301	V	63.3	Low	56.4	Low	1 Å²	1	72.4 Å²	72.4	1%	0.006	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	105.8	174.5	-176.8	0	0	0	0	106.6	L284 I286 L303 V329 L341 G345	L284-V301 HydrophobicContact CB-CB 4.29Å; L284-V301 PolarHBondContact N-O 3Å; L284-V301 PolarHBondContact O-N 3.18Å; I286-V301 HydrophobicContact CD1-CG2 4.14Å; V301-L303 PolarHBondContact O-N 2.76Å; V301-V329 HydrophobicContact CG2-CG2 4.11Å; V301-L341 HydrophobicContact CG1-CB 4.5Å; V301-L341 HydrophobicContact CG1-CD1 3.73Å; V301-G345 VanDerWaalsContact CG1-CA 3.48Å
302	P	59	Low	56.4	Low	71 Å²	71	68.3 Å²	68.3	46%	0.461	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-62.5	123.6	-179.9	24.4	-31.5	0	0	0	108.7
303	L	60	Low	56.7	Low	24 Å²	24	67.8 Å²	67.8	13%	0.126	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-102.3	136.4	173.4	-77.6	166.6	0	0	0	108.2	L284 V301 A307 L308 L312 I331 L341	L284-L303 HydrophobicContact CB-CD1 3.74Å; L284-L303 HydrophobicContact CB-CG 4.27Å; V301-L303 PolarHBondContact O-N 2.76Å; L303-A307 HydrophobicContact CB-CB 4.3Å; L303-A307 HydrophobicContact CD2-CB 3.94Å; L303-L308 HydrophobicContact CB-CG 4.39Å; L303-L312 HydrophobicContact CD1-CD1 4.49Å; L303-I331 HydrophobicContact CD2-CD1 4.13Å; L303-L341 HydrophobicContact CD2-CD1 4.02Å
304	D	53.4	Low	56.9	Low	129 Å²	129	67.9 Å²	67.9	69%	0.69	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-60.3	147.2	169	-76.5	-27.9	0	0	0	109.9	S306 A307 L308	D304-S306 PolarHBondContact O-N 2.81Å; D304-A307 WeakPolarHBondContact O-CA 3.47Å; D304-A307 WeakPolarHBondContact O-CB 3.5Å; D304-A307 PolarHBondContact O-N 3.4Å; D304-L308 PolarHBondContact O-N 2.83Å
305	S	46	Very low	57.3	Low	107 Å²	107	64.6 Å²	64.6	75%	0.748	37%	0.371	S	S	*	.	H	α-helix	trans	-54.2	-27.4	-177	53.7	0	0	0	0	114	A307	S305-A307 VanDerWaalsContact C-N 3.35Å
306	S	47.8	Very low	57.6	Low	73 Å²	73	61.2 Å²	61.2	51%	0.51	36%	0.363	S	S	.	.	H	α-helix	trans	-66.7	-34.7	174.2	59.2	0	0	0	0	112.6	D304 S309	D304-S306 PolarHBondContact O-N 2.81Å; S306-S309 PolarHBondContact O-OG 2.91Å
307	A	47.2	Very low	57.8	Low	24 Å²	24	58.4 Å²	58.4	20%	0.198	35%	0.35	C	S	.	.	H	α-helix	trans	-77.8	-26.6	179.5	0	0	0	0	0	113.1	L303 D304 S305 S309 L310	L303-A307 HydrophobicContact CB-CB 4.3Å; L303-A307 HydrophobicContact CD2-CB 3.94Å; D304-A307 WeakPolarHBondContact O-CA 3.47Å; D304-A307 WeakPolarHBondContact O-CB 3.5Å; D304-A307 PolarHBondContact O-N 3.4Å; S305-A307 VanDerWaalsContact C-N 3.35Å; A307-S309 VanDerWaalsContact C-N 3.27Å; A307-S309 PolarHBondContact O-N 2.78Å; A307-L310 WeakPolarHBondContact O-CB 3.1Å; A307-L310 PolarHBondContact O-N 3.17Å
308	L	43.9	Very low	58.1	Low	56 Å²	56	59.4 Å²	59.4	29%	0.293	35%	0.349	S	S	.	.	H	α-helix	trans	-66.7	-24.9	175.9	-85.5	149	0	0	0	113.5	V279 E280 E281 L303 D304 L310	V279-L308 HydrophobicContact CG1-CD2 3.64Å; E280-L308 WeakPolarHBondContact O-CD2 3.45Å; E281-L308 WeakPolarHBondContact O-CD1 3.09Å; L303-L308 HydrophobicContact CB-CG 4.39Å; D304-L308 PolarHBondContact O-N 2.83Å; L308-L310 VanDerWaalsContact C-N 3.26Å; L308-L310 PolarHBondContact O-N 2.82Å
309	S	45.7	Very low	58	Low	89 Å²	89	54.5 Å²	54.5	62%	0.622	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-11.3	174.9	73.8	0	0	0	0	113.8	S306 A307 P311	S306-S309 PolarHBondContact O-OG 2.91Å; A307-S309 VanDerWaalsContact C-N 3.27Å; A307-S309 PolarHBondContact O-N 2.78Å; S309-P311 WeakPolarHBondContact O-CD 3.43Å
310	L	50.2	Low	58.1	Low	28 Å²	28	53.6 Å²	53.6	15%	0.147	32%	0.318	C	S	.	.	S	Bend	trans	-91.1	121.3	-174.3	-56.2	179.3	0	0	0	109	A307 L308 L312 A333 D335	A307-L310 WeakPolarHBondContact O-CB 3.1Å; A307-L310 PolarHBondContact O-N 3.17Å; L308-L310 VanDerWaalsContact C-N 3.26Å; L308-L310 PolarHBondContact O-N 2.82Å; L310-L312 PolarHBondContact O-N 2.89Å; L310-A333 HydrophobicContact CB-CB 4.28Å; L310-A333 HydrophobicContact CD1-CB 4.25Å; L310-D335 WeakPolarHBondContact CD1-OD2 3.26Å; L310-D335 WeakPolarHBondContact CD2-OD2 3.49Å
311	P	50.6	Low	57.8	Low	78 Å²	78	49.2 Å²	49.2	51%	0.506	30%	0.299	S	S	.	.			trans	-64.4	106.1	173	18.9	-20.6	0	0	0	107.8	S309 M313 N334	S309-P311 WeakPolarHBondContact O-CD 3.43Å; P311-M313 PolarHBondContact O-N 2.84Å; P311-N334 HydrophobicContact CB-CB 4.38Å; P311-N334 VanDerWaalsContact CB-ND2 3.28Å; P311-N334 WeakPolarHBondContact CB-ND2 3.39Å; P311-N334 HydrophobicContact CG-CB 3.83Å; P311-N334 VanDerWaalsContact CG-ND2 3.28Å; P311-N334 WeakPolarHBondContact CG-ND2 3.37Å; P311-N334 WeakPolarHBondContact O-CB 3.36Å; P311-N334 PolarHBondContact O-N 2.9Å; P311-N334 PolarHBondContact O-ND2 2.85Å; P311-N334 PolarHBondContact O-OD1 2.88Å
312	L	58	Low	57.5	Low	32 Å²	32	56.7 Å²	56.7	17%	0.168	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	124.8	-179	-64.6	-176.8	0	0	0	108.4	V265 V279 L284 L303 L310 V315 I331	V265-L312 HydrophobicContact CG1-CB 3.85Å; V265-L312 HydrophobicContact CG2-CB 4.39Å; V265-L312 HydrophobicContact CG2-CD1 4.48Å; V279-L312 HydrophobicContact CG2-CD1 3.39Å; V279-L312 HydrophobicContact CG2-CG 4.35Å; L284-L312 HydrophobicContact CD1-CD1 4.2Å; L303-L312 HydrophobicContact CD1-CD1 4.49Å; L310-L312 PolarHBondContact O-N 2.89Å; L312-V315 HydrophobicContact CB-CG2 4.39Å; L312-V315 HydrophobicContact CD1-CG2 3.9Å; L312-I331 HydrophobicContact CD2-CG2 3.57Å
313	M	56.7	Low	57.3	Low	105 Å²	105	58 Å²	58	52%	0.517	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-42.5	-179.4	-166.9	-172.8	-63.1	0	0	110.9	P311 V332 N334	P311-M313 PolarHBondContact O-N 2.84Å; M313-V332 WeakPolarHBondContact CA-O 3.31Å; M313-V332 VanDerWaalsContact CB-O 3.31Å; M313-V332 WeakPolarHBondContact CB-O 3.39Å; M313-V332 PolarHBondContact N-O 3.46Å; M313-N334 WeakPolarHBondContact CB-OD1 2.92Å
314	A	62.5	Low	57.3	Low	34 Å²	34	60.9 Å²	60.9	28%	0.281	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	140.3	-178.9	0	0	0	0	0	110.8	V332	A314-V332 HydrophobicContact CB-CB 4.46Å; A314-V332 PolarHBondContact N-O 2.84Å; A314-V332 VanDerWaalsContact N-O 3.12Å; A314-V332 PolarHBondContact O-N 3.39Å
315	V	69.1	Low	57.7	Low	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	113	176.8	173	0	0	0	0	107.8	V265 L284 L312 P317 V329 I331	V265-V315 HydrophobicContact CG1-CB 4.34Å; V265-V315 HydrophobicContact CG1-CG2 3.79Å; L284-V315 HydrophobicContact CD1-CG1 4.02Å; L284-V315 HydrophobicContact CD1-CG2 3.97Å; L284-V315 HydrophobicContact CD2-CG1 3.4Å; L284-V315 VanDerWaalsContact CD2-CG1 3.4Å; L284-V315 HydrophobicContact CD2-CG2 4.36Å; L284-V315 HydrophobicContact CG-CG1 4.27Å; L312-V315 HydrophobicContact CB-CG2 4.39Å; L312-V315 HydrophobicContact CD1-CG2 3.9Å; V315-P317 WeakPolarHBondContact O-CD 3.34Å; V315-V329 HydrophobicContact CG1-CG1 3.7Å; V315-I331 HydrophobicContact CG2-CG1 4.38Å; V315-I331 HydrophobicContact CG2-CG2 4.41Å
316	T	72	Confident	58.7	Low	45 Å²	45	53 Å²	53	28%	0.276	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	101.8	-178.6	51.6	0	0	0	0	110.3	F330	T316-F330 PolarHBondContact N-O 2.91Å; T316-F330 PolarHBondContact O-N 2.91Å; T316-F330 WeakPolarHBondContact OG1-CB 3.25Å; T316-F330 WeakPolarHBondContact OG1-CD1 3.23Å; T316-F330 PolarHBondContact OG1-O 2.93Å
317	P	68.3	Low	59.9	Low	23 Å²	23	54.8 Å²	54.8	15%	0.149	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	135.2	178.2	29.1	-31.7	0	0	0	112.2	I286 V315 F319 V329	I286-P317 HydrophobicContact CD1-CB 3.9Å; I286-P317 HydrophobicContact CG2-CB 4.45Å; I286-P317 HydrophobicContact CG2-CG 4.25Å; V315-P317 WeakPolarHBondContact O-CD 3.34Å; P317-F319 HydrophobicContact CB-CE1 4.36Å; P317-F319 HydrophobicContact CB-CE2 3.67Å; P317-F319 HydrophobicContact CB-CZ 3.51Å; P317-F319 HydrophobicContact CG-CE2 3.62Å; P317-F319 HydrophobicContact CG-CZ 3.54Å; P317-F319 VanDerWaalsContact O-CE2 3.3Å; P317-F319 WeakPolarHBondContact O-CE2 3.49Å; P317-V329 HydrophobicContact CB-CG2 4.42Å
318	F	71.2	Confident	61.3	Low	64 Å²	64	58.8 Å²	58.8	28%	0.281	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.8	171.3	-61.7	-85.2	0	0	0	109.7	K327 R328 F330 M340	F318-K327 PolarHBondContact O-N 2.96Å; F318-R328 WeakPolarHBondContact CA-O 3.39Å; F318-R328 HydrophobicContact CB-CB 4.24Å; F318-R328 WeakPolarHBondContact CB-O 3.38Å; F318-R328 HydrophobicContact CD2-CB 4.14Å; F318-R328 PolarHBondContact N-O 2.81Å; F318-R328 PolarHBondContact O-N 2.82Å; F318-R328 VanDerWaalsContact O-N 3.13Å; F318-R328 VanDerWaalsContact O-O 3.13Å; F318-F330 HydrophobicContact CE2-CB 3.67Å; F318-M340 HydrophobicContact CD2-CE 4.46Å; F318-M340 HydrophobicContact CD2-SD 4.17Å; F318-M340 HydrophobicContact CE2-CE 3.84Å; F318-M340 HydrophobicContact CE2-SD 4.05Å
319	F	67	Low	62.8	Low	12 Å²	12	56.1 Å²	56.1	5%	0.053	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	162.3	-173.2	-59	-90.9	0	0	0	112.8	L9 R270 L275 I286 P317 F324 S325 V326	L9-F319 VanDerWaalsContact CD1-O 3.31Å; L9-F319 WeakPolarHBondContact CD1-O 3.41Å; R270-F319 VanDerWaalsContact CZ-CB 3.41Å; L275-F319 HydrophobicContact CD1-CD2 4.22Å; L275-F319 HydrophobicContact CD1-CE1 4.32Å; L275-F319 HydrophobicContact CD1-CE2 3.2Å; L275-F319 HydrophobicContact CD1-CZ 3.28Å; L275-F319 HydrophobicContact CD2-CE1 3.81Å; L275-F319 HydrophobicContact CD2-CE2 4.17Å; L275-F319 HydrophobicContact CD2-CZ 3.29Å; L275-F319 HydrophobicContact CG-CE2 4.28Å; L275-F319 HydrophobicContact CG-CZ 3.88Å; I286-F319 HydrophobicContact CG2-CZ 4.29Å; P317-F319 HydrophobicContact CB-CE1 4.36Å; P317-F319 HydrophobicContact CB-CE2 3.67Å; P317-F319 HydrophobicContact CB-CZ 3.51Å; P317-F319 HydrophobicContact CG-CE2 3.62Å; P317-F319 HydrophobicContact CG-CZ 3.54Å; P317-F319 VanDerWaalsContact O-CE2 3.3Å; P317-F319 WeakPolarHBondContact O-CE2 3.49Å; F319-F324 WeakPolarHBondContact CD1-O 3.28Å; F319-S325 CarbonylContact C-O 3.53Å; F319-S325 WeakPolarHBondContact CA-O 3.45Å; F319-V326 HydrophobicContact CD1-CG2 3.86Å; F319-V326 HydrophobicContact CE1-CG2 3.51Å; F319-V326 HydrophobicContact CZ-CG2 4.35Å
320	A	64.3	Low	64.5	Low	10 Å²	10	54 Å²	54	8%	0.083	28%	0.281	C	S	.	.			trans	-72.9	151.2	157	0	0	0	0	0	109.9	R270 S325 K327	R270-A320 PolarHBondContact NH2-O 3.02Å; A320-S325 VanDerWaalsContact CB-OG 3.26Å; A320-S325 WeakPolarHBondContact CB-OG 3.35Å; A320-S325 PolarHBondContact N-O 3.02Å; A320-K327 HydrophobicContact CB-CD 4.14Å; A320-K327 HydrophobicContact CB-CG 4.08Å
321	N	57.7	Low	65.7	Low	29 Å²	29	53.2 Å²	53.2	16%	0.155	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-26.5	-174.6	-64.7	-43.6	0	0	0	114.3	H8 L9 H10	H8-N321 VanDerWaalsContact CA-CG 3.4Å; H8-N321 WeakPolarHBondContact CA-ND2 3.29Å; H8-N321 VanDerWaalsContact CB-ND2 3.31Å; H8-N321 WeakPolarHBondContact CB-ND2 3.21Å; L9-N321 WeakPolarHBondContact CB-OD1 3Å; L9-N321 WeakPolarHBondContact CD1-OD1 2.75Å; L9-N321 PolarHBondContact N-ND2 3.08Å; L9-N321 PolarHBondContact N-OD1 2.91Å; H10-N321 PolarHBondContact CE1-ND2 2.9Å; H10-N321 PolarHBondContact ND1-ND2 3.46Å; H10-N321 PolarHBondContact NE2-ND2 3.24Å
322	E	56	Low	66.9	Low	157 Å²	157	50.8 Å²	50.8	73%	0.734	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-31.9	-165.4	-64.7	-179.8	-176.8	0	0	113.3
323	T	56.2	Low	67.5	Low	100 Å²	100	49.4 Å²	49.4	61%	0.613	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	1.1	-171.8	52	0	0	0	0	113.8	S325	T323-S325 PolarHBondContact O-N 2.73Å; T323-S325 WeakPolarHBondContact OG1-CB 3.21Å; T323-S325 PolarHBondContact OG1-N 2.91Å; T323-S325 PolarHBondContact OG1-OG 2.99Å
324	F	59.4	Low	68.1	Low	84 Å²	84	48.1 Å²	48.1	37%	0.368	25%	0.248	S	C	.	.			trans	51.1	16.4	-166.7	-76.2	-90	0	0	0	114.2	L288 F319 V326	L288-F324 HydrophobicContact CD1-CD1 4.34Å; L288-F324 HydrophobicContact CD1-CE1 4.23Å; L288-F324 HydrophobicContact CD2-CB 4.25Å; L288-F324 HydrophobicContact CD2-CD1 3.41Å; L288-F324 VanDerWaalsContact CD2-CD1 3.41Å; L288-F324 HydrophobicContact CD2-CD2 4.4Å; L288-F324 HydrophobicContact CD2-CE1 3.74Å; L288-F324 HydrophobicContact CD2-CG 3.78Å; L288-F324 HydrophobicContact CD2-CZ 4.36Å; F319-F324 WeakPolarHBondContact CD1-O 3.28Å; F324-V326 PolarHBondContact O-N 2.82Å
325	S	62.4	Low	68.3	Low	56 Å²	56	46.9 Å²	46.9	39%	0.392	24%	0.237	S	C	.	.			trans	-68.1	122.9	175.5	65.5	0	0	0	0	109	F319 A320 T323 K327	F319-S325 CarbonylContact C-O 3.53Å; F319-S325 WeakPolarHBondContact CA-O 3.45Å; A320-S325 VanDerWaalsContact CB-OG 3.26Å; A320-S325 WeakPolarHBondContact CB-OG 3.35Å; A320-S325 PolarHBondContact N-O 3.02Å; T323-S325 PolarHBondContact O-N 2.73Å; T323-S325 WeakPolarHBondContact OG1-CB 3.21Å; T323-S325 PolarHBondContact OG1-N 2.91Å; T323-S325 PolarHBondContact OG1-OG 2.99Å; S325-K327 PolarHBondContact O-N 2.79Å
326	V	66.2	Low	68.6	Low	13 Å²	13	48.8 Å²	48.8	8%	0.079	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	122	170.7	178	0	0	0	0	107.9	I286 A299 F319 F324 V329 P343	I286-V326 HydrophobicContact CD1-CG2 4.28Å; A299-V326 HydrophobicContact CB-CB 4.38Å; A299-V326 HydrophobicContact CB-CG2 3.63Å; F319-V326 HydrophobicContact CD1-CG2 3.86Å; F319-V326 HydrophobicContact CE1-CG2 3.51Å; F319-V326 HydrophobicContact CZ-CG2 4.35Å; F324-V326 PolarHBondContact O-N 2.82Å; V326-V329 HydrophobicContact CG1-CG2 3.42Å; V326-V329 VanDerWaalsContact CG1-CG2 3.42Å; V326-P343 WeakPolarHBondContact O-CB 3.47Å; V326-P343 WeakPolarHBondContact O-CG 3.27Å
327	K	73.5	Confident	68.8	Low	111 Å²	111	47.4 Å²	47.4	48%	0.483	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-39.7	175.4	-83.9	-168.3	173.2	-169.6	0	111.8	F318 A320 S325 P343	F318-K327 PolarHBondContact O-N 2.96Å; A320-K327 HydrophobicContact CB-CD 4.14Å; A320-K327 HydrophobicContact CB-CG 4.08Å; S325-K327 PolarHBondContact O-N 2.79Å; K327-P343 WeakPolarHBondContact O-CD 3.26Å; K327-P343 WeakPolarHBondContact O-CG 3.35Å
328	R	77	Confident	69.5	Low	108 Å²	108	49.1 Å²	49.1	41%	0.408	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	157.9	177.9	-61.7	-176.1	178.7	151.8	-2.8	109.7	F318 M340 L341	F318-R328 WeakPolarHBondContact CA-O 3.39Å; F318-R328 HydrophobicContact CB-CB 4.24Å; F318-R328 WeakPolarHBondContact CB-O 3.38Å; F318-R328 HydrophobicContact CD2-CB 4.14Å; F318-R328 PolarHBondContact N-O 2.81Å; F318-R328 PolarHBondContact O-N 2.82Å; F318-R328 VanDerWaalsContact O-N 3.13Å; F318-R328 VanDerWaalsContact O-O 3.13Å; R328-M340 HydrophobicContact CB-CG 4.38Å; R328-M340 HydrophobicContact CB-SD 3.68Å; R328-M340 HydrophobicContact CG-SD 4.4Å; R328-L341 CarbonylContact C-O 3.54Å; R328-L341 WeakPolarHBondContact CA-O 3.42Å
329	V	74.9	Confident	69.9	Low	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	123.4	172.7	-176	0	0	0	0	108.4	L284 I286 V301 V315 P317 V326 I331 M340 L341	L284-V329 HydrophobicContact CD2-CG1 3.86Å; I286-V329 HydrophobicContact CD1-CG1 4.4Å; I286-V329 HydrophobicContact CD1-CG2 3.72Å; V301-V329 HydrophobicContact CG2-CG2 4.11Å; V315-V329 HydrophobicContact CG1-CG1 3.7Å; P317-V329 HydrophobicContact CB-CG2 4.42Å; V326-V329 HydrophobicContact CG1-CG2 3.42Å; V326-V329 VanDerWaalsContact CG1-CG2 3.42Å; V329-I331 HydrophobicContact CG1-CD1 4.34Å; V329-I331 HydrophobicContact CG1-CG1 3.89Å; V329-M340 CarbonylContact O-C 3.58Å; V329-M340 WeakPolarHBondContact O-CA 3.26Å; V329-L341 HydrophobicContact CB-CB 4.34Å; V329-L341 PolarHBondContact N-O 2.95Å; V329-L341 PolarHBondContact O-N 2.56Å
330	F	80.6	Confident	70.6	Confident	46 Å²	46	47.5 Å²	47.5	20%	0.202	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123	173.1	176.6	-111.1	0	0	0	110.1	T316 F318 V332 M338 A339 M340 W349	T316-F330 PolarHBondContact N-O 2.91Å; T316-F330 PolarHBondContact O-N 2.91Å; T316-F330 WeakPolarHBondContact OG1-CB 3.25Å; T316-F330 WeakPolarHBondContact OG1-CD1 3.23Å; T316-F330 PolarHBondContact OG1-O 2.93Å; F318-F330 HydrophobicContact CE2-CB 3.67Å; F330-V332 HydrophobicContact CD1-CG2 4.21Å; F330-V332 HydrophobicContact CE1-CG2 3.39Å; F330-V332 HydrophobicContact CZ-CG2 3.62Å; F330-M338 HydrophobicContact CE2-CB 3.94Å; F330-M338 HydrophobicContact CZ-CB 4.13Å; F330-M338 HydrophobicContact CZ-CG 4.19Å; F330-M338 HydrophobicContact CZ-SD 4.21Å; F330-A339 WeakPolarHBondContact CA-O 3.33Å; F330-A339 WeakPolarHBondContact CD2-O 3.23Å; F330-M340 HydrophobicContact CB-CE 3.89Å; F330-M340 HydrophobicContact CB-SD 3.97Å; F330-M340 HydrophobicContact CD2-CE 4.08Å; F330-M340 HydrophobicContact CG-CE 4.31Å; F330-W349 HydrophobicContact CD2-CH2 4.1Å; F330-W349 HydrophobicContact CD2-CZ2 4.45Å; F330-W349 AromaticContact CE2-CH2 3.61Å; F330-W349 HydrophobicContact CE2-CH2 3.61Å; F330-W349 HydrophobicContact CE2-CZ2 4.34Å; F330-W349 HydrophobicContact CE2-CZ3 4.35Å
331	I	75.3	Confident	71.3	Confident	11 Å²	11	47.5 Å²	47.5	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.7	-176.5	-56.9	-174.8	0	0	0	108.6	L284 L303 L312 V315 V329 M338 A339 L341	L284-I331 HydrophobicContact CD2-CD1 4.19Å; L303-I331 HydrophobicContact CD2-CD1 4.13Å; L312-I331 HydrophobicContact CD2-CG2 3.57Å; V315-I331 HydrophobicContact CG2-CG1 4.38Å; V315-I331 HydrophobicContact CG2-CG2 4.41Å; V329-I331 HydrophobicContact CG1-CD1 4.34Å; V329-I331 HydrophobicContact CG1-CG1 3.89Å; I331-M338 WeakPolarHBondContact O-CA 3.48Å; I331-A339 PolarHBondContact N-O 2.96Å; I331-A339 PolarHBondContact O-N 3.24Å; I331-L341 HydrophobicContact CD1-CD1 3.4Å; I331-L341 VanDerWaalsContact CD1-CD1 3.4Å; I331-L341 HydrophobicContact CD1-CG 4.04Å; I331-L341 HydrophobicContact CG1-CD1 4.36Å
332	V	77.3	Confident	72.2	Confident	26 Å²	26	51.4 Å²	51.4	16%	0.158	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.5	167.1	-175.5	0	0	0	0	107.7	M313 A314 F330 T337 M338	M313-V332 WeakPolarHBondContact CA-O 3.31Å; M313-V332 VanDerWaalsContact CB-O 3.31Å; M313-V332 WeakPolarHBondContact CB-O 3.39Å; M313-V332 PolarHBondContact N-O 3.46Å; A314-V332 HydrophobicContact CB-CB 4.46Å; A314-V332 PolarHBondContact N-O 2.84Å; A314-V332 VanDerWaalsContact N-O 3.12Å; A314-V332 PolarHBondContact O-N 3.39Å; F330-V332 HydrophobicContact CD1-CG2 4.21Å; F330-V332 HydrophobicContact CE1-CG2 3.39Å; F330-V332 HydrophobicContact CZ-CG2 3.62Å; V332-T337 WeakPolarHBondContact CA-O 3.49Å; V332-M338 HydrophobicContact CG2-CG 4.41Å
333	A	70.7	Confident	72.9	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	161.6	174.7	0	0	0	0	0	111.3	L310 D335 C336 T337	L310-A333 HydrophobicContact CB-CB 4.28Å; L310-A333 HydrophobicContact CD1-CB 4.25Å; A333-D335 WeakPolarHBondContact CB-OD1 3.01Å; A333-D335 PolarHBondContact O-N 3.48Å; A333-D335 VanDerWaalsContact O-N 3.17Å; A333-C336 PolarHBondContact O-N 3.5Å; A333-T337 WeakPolarHBondContact CB-OG1 3.46Å; A333-T337 PolarHBondContact N-O 3.3Å
334	N	68.5	Low	73.6	Confident	79 Å²	79	46.4 Å²	46.4	42%	0.422	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.5	179.1	-88	-0.1	0	0	0	115	P311 M313 C336	P311-N334 HydrophobicContact CB-CB 4.38Å; P311-N334 VanDerWaalsContact CB-ND2 3.28Å; P311-N334 WeakPolarHBondContact CB-ND2 3.39Å; P311-N334 HydrophobicContact CG-CB 3.83Å; P311-N334 VanDerWaalsContact CG-ND2 3.28Å; P311-N334 WeakPolarHBondContact CG-ND2 3.37Å; P311-N334 WeakPolarHBondContact O-CB 3.36Å; P311-N334 PolarHBondContact O-N 2.9Å; P311-N334 PolarHBondContact O-ND2 2.85Å; P311-N334 PolarHBondContact O-OD1 2.88Å; M313-N334 WeakPolarHBondContact CB-OD1 2.92Å; N334-C336 PolarHBondContact O-N 2.85Å
335	D	66.7	Low	73.9	Confident	8 Å²	8	42.9 Å²	42.9	4%	0.043	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	21	175	53.3	48.4	0	0	0	113.2	L310 A333 T337 S354 Q472 R474	L310-D335 WeakPolarHBondContact CD1-OD2 3.26Å; L310-D335 WeakPolarHBondContact CD2-OD2 3.49Å; A333-D335 WeakPolarHBondContact CB-OD1 3.01Å; A333-D335 PolarHBondContact O-N 3.48Å; A333-D335 VanDerWaalsContact O-N 3.17Å; D335-T337 PolarHBondContact O-N 3.38Å; D335-T337 WeakPolarHBondContact OD1-CB 3.21Å; D335-T337 PolarHBondContact OD1-N 3.18Å; D335-T337 PolarHBondContact OD1-OG1 2.82Å; D335-S354 WeakPolarHBondContact O-CB 3.37Å; D335-Q472 PolarHBondContact O-OE1 2.96Å; D335-R474 HydrophobicContact CB-CG 4.46Å; D335-R474 VanDerWaalsContact CB-NE 3.32Å; D335-R474 IonicContact OD1-CZ 3.73Å; D335-R474 VanDerWaalsContact OD1-CZ 3.23Å; D335-R474 IonicContact OD1-NH1 2.81Å; D335-R474 PolarHBondContact OD1-NH1 3.38Å; D335-R474 IonicContact OD1-NH2 2.85Å; D335-R474 PolarHBondContact OD1-NH2 2.64Å; D335-R474 IonicContact OD2-CZ 3.46Å; D335-R474 IonicContact OD2-NE 3.27Å; D335-R474 PolarHBondContact OD2-NE 3.28Å; D335-R474 IonicContact OD2-NH1 2.93Å; D335-R474 IonicContact OD2-NH2 3.3Å; D335-R474 PolarHBondContact OD2-NH2 3.02Å
336	C	75.8	Confident	74.2	Confident	39 Å²	39	48.3 Å²	48.3	26%	0.264	23%	0.234	S	C	.	.			trans	57.4	19.3	-179.6	-60.2	0	0	0	0	114.6	A333 N334 M338 E353 Q472	A333-C336 PolarHBondContact O-N 3.5Å; N334-C336 PolarHBondContact O-N 2.85Å; C336-M338 PolarHBondContact O-N 3.13Å; C336-E353 HydrophobicContact CB-CB 4.06Å; C336-E353 VanDerWaalsContact O-CB 3.3Å; C336-E353 WeakPolarHBondContact O-CB 3.15Å; C336-E353 PolarHBondContact O-N 3.1Å; C336-Q472 PolarHBondContact SG-NE2 3.18Å
337	T	75.9	Confident	74.5	Confident	16 Å²	16	51 Å²	51	10%	0.098	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	132.6	162	41.8	0	0	0	0	111	V332 A333 D335 Y352	V332-T337 WeakPolarHBondContact CA-O 3.49Å; A333-T337 WeakPolarHBondContact CB-OG1 3.46Å; A333-T337 PolarHBondContact N-O 3.3Å; D335-T337 PolarHBondContact O-N 3.38Å; D335-T337 WeakPolarHBondContact OD1-CB 3.21Å; D335-T337 PolarHBondContact OD1-N 3.18Å; D335-T337 PolarHBondContact OD1-OG1 2.82Å; T337-Y352 HydrophobicContact CG2-CD1 3.24Å; T337-Y352 HydrophobicContact CG2-CE1 3.71Å; T337-Y352 HydrophobicContact CG2-CG 4.18Å
338	M	83	Confident	74.8	Confident	59 Å²	59	50.2 Å²	50.2	29%	0.291	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124	175	-62.5	-176.8	-168.5	0	0	107.6	F330 I331 V332 C336 W349 T350 R351 E353	F330-M338 HydrophobicContact CE2-CB 3.94Å; F330-M338 HydrophobicContact CZ-CB 4.13Å; F330-M338 HydrophobicContact CZ-CG 4.19Å; F330-M338 HydrophobicContact CZ-SD 4.21Å; I331-M338 WeakPolarHBondContact O-CA 3.48Å; V332-M338 HydrophobicContact CG2-CG 4.41Å; C336-M338 PolarHBondContact O-N 3.13Å; M338-W349 HydrophobicContact CB-CH2 4.46Å; M338-W349 HydrophobicContact CB-CZ3 4.03Å; M338-W349 WeakPolarHBondContact O-CZ3 3.39Å; M338-T350 CarbonylContact O-C 3.44Å; M338-R351 HydrophobicContact CB-CB 4.47Å; M338-R351 PolarHBondContact N-O 3.1Å; M338-R351 PolarHBondContact O-N 2.83Å; M338-E353 HydrophobicContact CE-CB 4.39Å; M338-E353 HydrophobicContact CE-CG 3.72Å; M338-E353 HydrophobicContact CG-CG 4.45Å; M338-E353 HydrophobicContact SD-CG 4.03Å
339	A	79.2	Confident	75.2	Confident	18 Å²	18	49.9 Å²	49.9	15%	0.149	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.5	177.5	0	0	0	0	0	109.8	F330 I331 L341	F330-A339 WeakPolarHBondContact CA-O 3.33Å; F330-A339 WeakPolarHBondContact CD2-O 3.23Å; I331-A339 PolarHBondContact N-O 2.96Å; I331-A339 PolarHBondContact O-N 3.24Å; A339-L341 HydrophobicContact CB-CD2 4.19Å
340	M	82.6	Confident	75.5	Confident	24 Å²	24	52.7 Å²	52.7	12%	0.118	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	111.2	167.6	-177.4	69.9	72.6	0	0	107.4	F318 R328 V329 F330 F348 W349	F318-M340 HydrophobicContact CD2-CE 4.46Å; F318-M340 HydrophobicContact CD2-SD 4.17Å; F318-M340 HydrophobicContact CE2-CE 3.84Å; F318-M340 HydrophobicContact CE2-SD 4.05Å; R328-M340 HydrophobicContact CB-CG 4.38Å; R328-M340 HydrophobicContact CB-SD 3.68Å; R328-M340 HydrophobicContact CG-SD 4.4Å; V329-M340 CarbonylContact O-C 3.58Å; V329-M340 WeakPolarHBondContact O-CA 3.26Å; F330-M340 HydrophobicContact CB-CE 3.89Å; F330-M340 HydrophobicContact CB-SD 3.97Å; F330-M340 HydrophobicContact CD2-CE 4.08Å; F330-M340 HydrophobicContact CG-CE 4.31Å; M340-F348 HydrophobicContact CB-CB 4.44Å; M340-F348 HydrophobicContact CG-CB 4.31Å; M340-F348 HydrophobicContact CG-CD1 4.33Å; M340-F348 WeakPolarHBondContact O-CA 3.21Å; M340-F348 VanDerWaalsContact O-CB 3.25Å; M340-F348 WeakPolarHBondContact O-CB 3.36Å; M340-F348 PolarHBondContact O-N 2.95Å; M340-W349 HydrophobicContact CB-CD2 3.88Å; M340-W349 VanDerWaalsContact CB-CE2 3.42Å; M340-W349 HydrophobicContact CB-CG 4.28Å; M340-W349 HydrophobicContact CB-CH2 4.43Å; M340-W349 HydrophobicContact CB-CZ2 3.73Å; M340-W349 HydrophobicContact CE-CZ2 4.27Å; M340-W349 PolarHBondContact N-O 2.85Å
341	L	78.2	Confident	75.8	Confident	11 Å²	11	57.6 Å²	57.6	6%	0.058	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	145.9	178.9	-53.6	-172.9	0	0	0	111.2	V301 L303 R328 V329 I331 A339 P347	V301-L341 HydrophobicContact CG1-CB 4.5Å; V301-L341 HydrophobicContact CG1-CD1 3.73Å; L303-L341 HydrophobicContact CD2-CD1 4.02Å; R328-L341 CarbonylContact C-O 3.54Å; R328-L341 WeakPolarHBondContact CA-O 3.42Å; V329-L341 HydrophobicContact CB-CB 4.34Å; V329-L341 PolarHBondContact N-O 2.95Å; V329-L341 PolarHBondContact O-N 2.56Å; I331-L341 HydrophobicContact CD1-CD1 3.4Å; I331-L341 VanDerWaalsContact CD1-CD1 3.4Å; I331-L341 HydrophobicContact CD1-CG 4.04Å; I331-L341 HydrophobicContact CG1-CD1 4.36Å; A339-L341 HydrophobicContact CB-CD2 4.19Å; L341-P347 HydrophobicContact CD2-CB 4.01Å
342	R	77.8	Confident	76.3	Confident	110 Å²	110	60.1 Å²	60.1	42%	0.415	29%	0.291	S	S	.	.			trans	-77.1	168.3	164	-69	-179.9	-173	149.5	5.8	109.5	N344 G345 R346 F348	R342-N344 WeakPolarHBondContact CB-OD1 3.36Å; R342-N344 PolarHBondContact O-N 3.42Å; R342-N344 VanDerWaalsContact O-N 3.13Å; R342-G345 PolarHBondContact O-N 2.89Å; R342-R346 WeakPolarHBondContact CB-O 3.34Å; R342-R346 PolarHBondContact N-O 3.26Å; R342-F348 HydrophobicContact CG-CB 4.12Å
343	P	70.2	Confident	76.7	Confident	69 Å²	69	61.2 Å²	61.2	45%	0.448	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.1	179.7	-21.6	35.1	0	0	0	113.2	V326 K327 G345	V326-P343 WeakPolarHBondContact O-CB 3.47Å; V326-P343 WeakPolarHBondContact O-CG 3.27Å; K327-P343 WeakPolarHBondContact O-CD 3.26Å; K327-P343 WeakPolarHBondContact O-CG 3.35Å; P343-G345 PolarHBondContact O-N 2.82Å
344	N	71.4	Confident	77.2	Confident	83 Å²	83	61.1 Å²	61.1	44%	0.444	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	12.7	177.1	67.4	-9.6	0	0	0	113.8	R342 R346	R342-N344 WeakPolarHBondContact CB-OD1 3.36Å; R342-N344 PolarHBondContact O-N 3.42Å; R342-N344 VanDerWaalsContact O-N 3.13Å; N344-R346 PolarHBondContact O-N 3.07Å; N344-R346 VanDerWaalsContact O-N 3.09Å; N344-R346 WeakPolarHBondContact OD1-CB 3.34Å; N344-R346 PolarHBondContact OD1-N 2.87Å
345	G	65.1	Low	78.1	Confident	11 Å²	11	58.4 Å²	58.4	11%	0.113	28%	0.279	C	S	.	.	S	Bend	trans	75.6	-14.2	-177.1	0	0	0	0	0	115.6	V301 R342 P343	V301-G345 VanDerWaalsContact CG1-CA 3.48Å; R342-G345 PolarHBondContact O-N 2.89Å; P343-G345 PolarHBondContact O-N 2.82Å
346	R	68.2	Low	79	Confident	169 Å²	169	58.8 Å²	58.8	64%	0.638	28%	0.283	S	S	*	.			trans	-69.2	134.3	178.6	-62.8	-171.5	-179	-179.9	-0.1	110.7	R342 N344 F348	R342-R346 WeakPolarHBondContact CB-O 3.34Å; R342-R346 PolarHBondContact N-O 3.26Å; N344-R346 PolarHBondContact O-N 3.07Å; N344-R346 VanDerWaalsContact O-N 3.09Å; N344-R346 WeakPolarHBondContact OD1-CB 3.34Å; N344-R346 PolarHBondContact OD1-N 2.87Å; R346-F348 PolarHBondContact O-N 3.15Å
347	P	72.4	Confident	79.3	Confident	69 Å²	69	58.2 Å²	58.2	45%	0.448	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	129.2	174.8	26	-32.8	0	0	0	110.4	L341	L341-P347 HydrophobicContact CD2-CB 4.01Å
348	F	80.1	Confident	79.8	Confident	96 Å²	96	57.6 Å²	57.6	42%	0.421	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-42.3	165.9	179.3	-111.9	0	0	0	110.3	M340 R342 R346	M340-F348 HydrophobicContact CB-CB 4.44Å; M340-F348 HydrophobicContact CG-CB 4.31Å; M340-F348 HydrophobicContact CG-CD1 4.33Å; M340-F348 WeakPolarHBondContact O-CA 3.21Å; M340-F348 VanDerWaalsContact O-CB 3.25Å; M340-F348 WeakPolarHBondContact O-CB 3.36Å; M340-F348 PolarHBondContact O-N 2.95Å; R342-F348 HydrophobicContact CG-CB 4.12Å; R346-F348 PolarHBondContact O-N 3.15Å
349	W	84.9	Confident	79.8	Confident	101 Å²	101	56.9 Å²	56.9	38%	0.383	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	155.8	165.5	54.3	-107.4	0	0	0	109.2	F330 M338 M340 R351	F330-W349 HydrophobicContact CD2-CH2 4.1Å; F330-W349 HydrophobicContact CD2-CZ2 4.45Å; F330-W349 AromaticContact CE2-CH2 3.61Å; F330-W349 HydrophobicContact CE2-CH2 3.61Å; F330-W349 HydrophobicContact CE2-CZ2 4.34Å; F330-W349 HydrophobicContact CE2-CZ3 4.35Å; M338-W349 HydrophobicContact CB-CH2 4.46Å; M338-W349 HydrophobicContact CB-CZ3 4.03Å; M338-W349 WeakPolarHBondContact O-CZ3 3.39Å; M340-W349 HydrophobicContact CB-CD2 3.88Å; M340-W349 VanDerWaalsContact CB-CE2 3.42Å; M340-W349 HydrophobicContact CB-CG 4.28Å; M340-W349 HydrophobicContact CB-CH2 4.43Å; M340-W349 HydrophobicContact CB-CZ2 3.73Å; M340-W349 HydrophobicContact CE-CZ2 4.27Å; M340-W349 PolarHBondContact N-O 2.85Å; W349-R351 HydrophobicContact CE3-CB 4.1Å; W349-R351 HydrophobicContact CZ3-CB 3.92Å
350	T	82.4	Confident	80.1	Confident	59 Å²	59	57.2 Å²	57.2	36%	0.362	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138.1	173.3	-55.2	0	0	0	0	108	M338 Y352	M338-T350 CarbonylContact O-C 3.44Å; T350-Y352 HydrophobicContact CG2-CE1 4.13Å; T350-Y352 HydrophobicContact CG2-CE2 4.26Å
351	R	86	Confident	80.4	Confident	148 Å²	148	56.8 Å²	56.8	56%	0.558	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	124.3	-179.6	-173.6	164.4	170.2	160.6	-9.1	109.8	M338 W349 E353	M338-R351 HydrophobicContact CB-CB 4.47Å; M338-R351 PolarHBondContact N-O 3.1Å; M338-R351 PolarHBondContact O-N 2.83Å; W349-R351 HydrophobicContact CE3-CB 4.1Å; W349-R351 HydrophobicContact CZ3-CB 3.92Å; R351-E353 WeakPolarHBondContact CD-OE1 3.5Å; R351-E353 HydrophobicContact CG-CG 4.41Å; R351-E353 IonicContact CZ-OE1 2.7Å; R351-E353 IonicContact NE-OE1 3.86Å; R351-E353 PolarHBondContact NE-OE1 3.12Å; R351-E353 IonicContact NH2-OE1 3.69Å; R351-E353 PolarHBondContact NH2-OE1 2.63Å; R351-E353 PolarHBondContact O-N 3.29Å
352	Y	85.9	Confident	81	Confident	65 Å²	65	59.5 Å²	59.5	26%	0.255	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	82.1	-176.5	-58.9	-80.2	0	0	0	110.5	T337 T350 S354 L355 F476 V485 H488	T337-Y352 HydrophobicContact CG2-CD1 3.24Å; T337-Y352 HydrophobicContact CG2-CE1 3.71Å; T337-Y352 HydrophobicContact CG2-CG 4.18Å; T350-Y352 HydrophobicContact CG2-CE1 4.13Å; T350-Y352 HydrophobicContact CG2-CE2 4.26Å; Y352-S354 PolarHBondContact O-N 3.41Å; Y352-L355 PolarHBondContact O-N 3.4Å; Y352-F476 AromaticContact CD1-CE1 3.71Å; Y352-F476 HydrophobicContact CD1-CE1 3.71Å; Y352-F476 HydrophobicContact CD1-CZ 4.18Å; Y352-F476 HydrophobicContact CE1-CE1 4.33Å; Y352-F476 AromaticContact CG-CE1 3.99Å; Y352-F476 HydrophobicContact CG-CE1 3.99Å; Y352-V485 HydrophobicContact CD2-CG2 4.28Å; Y352-V485 HydrophobicContact CE2-CB 4.5Å; Y352-V485 HydrophobicContact CE2-CG2 4.43Å; Y352-H488 AromaticContact CE1-CD2 3.69Å; Y352-H488 AromaticContact CE1-NE2 3.64Å; Y352-H488 AromaticContact CZ-CD2 3.88Å; Y352-H488 AromaticContact CZ-NE2 3.89Å; Y352-H488 PolarHBondContact OH-NE2 3.12Å
353	E	85.8	Confident	81.6	Confident	49 Å²	49	55.2 Å²	55.2	23%	0.229	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-71.9	-8.5	178.4	-64.5	-70.9	173.1	0	0	113.1	C336 M338 R351 L355 A356	C336-E353 HydrophobicContact CB-CB 4.06Å; C336-E353 VanDerWaalsContact O-CB 3.3Å; C336-E353 WeakPolarHBondContact O-CB 3.15Å; C336-E353 PolarHBondContact O-N 3.1Å; M338-E353 HydrophobicContact CE-CB 4.39Å; M338-E353 HydrophobicContact CE-CG 3.72Å; M338-E353 HydrophobicContact CG-CG 4.45Å; M338-E353 HydrophobicContact SD-CG 4.03Å; R351-E353 WeakPolarHBondContact CD-OE1 3.5Å; R351-E353 HydrophobicContact CG-CG 4.41Å; R351-E353 IonicContact CZ-OE1 2.7Å; R351-E353 IonicContact NE-OE1 3.86Å; R351-E353 PolarHBondContact NE-OE1 3.12Å; R351-E353 IonicContact NH2-OE1 3.69Å; R351-E353 PolarHBondContact NH2-OE1 2.63Å; R351-E353 PolarHBondContact O-N 3.29Å; E353-L355 PolarHBondContact O-N 3.16Å; E353-A356 WeakPolarHBondContact O-CB 3.39Å; E353-A356 PolarHBondContact O-N 2.85Å; E353-A356 VanDerWaalsContact O-N 3.13Å
354	S	82.1	Confident	82.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-60.3	-29.9	169.7	50.4	0	0	0	0	112.7	D335 Y352 A356 S357 T470 F476	D335-S354 WeakPolarHBondContact O-CB 3.37Å; Y352-S354 PolarHBondContact O-N 3.41Å; S354-A356 PolarHBondContact O-N 2.8Å; S354-S357 PolarHBondContact O-N 3.39Å; S354-S357 VanDerWaalsContact O-N 3.07Å; S354-S357 PolarHBondContact O-OG 3.31Å; S354-T470 VanDerWaalsContact O-CG2 3.24Å; S354-T470 WeakPolarHBondContact O-CG2 3.37Å; S354-F476 VanDerWaalsContact OG-CE2 3.29Å; S354-F476 WeakPolarHBondContact OG-CE2 3.3Å; S354-F476 WeakPolarHBondContact OG-CZ 3.32Å
355	L	87.5	Confident	83.6	Confident	23 Å²	23	50.3 Å²	50.3	12%	0.12	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-66.2	-11.4	177	-70.9	175.2	0	0	0	113.1	Y352 E353 S357 V358 V468 T470 F476 M478 V485 L942	Y352-L355 PolarHBondContact O-N 3.4Å; E353-L355 PolarHBondContact O-N 3.16Å; L355-S357 PolarHBondContact O-N 2.88Å; L355-V358 VanDerWaalsContact O-CG2 3.27Å; L355-V358 WeakPolarHBondContact O-CG2 2.94Å; L355-V468 HydrophobicContact CD2-CG1 4.22Å; L355-T470 HydrophobicContact CD2-CG2 4.38Å; L355-F476 HydrophobicContact CD2-CB 4.16Å; L355-F476 HydrophobicContact CD2-CD1 4.31Å; L355-F476 HydrophobicContact CD2-CD2 3.52Å; L355-F476 HydrophobicContact CD2-CE2 3.97Å; L355-F476 HydrophobicContact CD2-CG 3.72Å; L355-F476 HydrophobicContact CG-CD2 4.27Å; L355-F476 HydrophobicContact CG-CE2 4.28Å; L355-F476 HydrophobicContact CG-CG 4.44Å; L355-F476 HydrophobicContact CG-CZ 4.47Å; L355-M478 HydrophobicContact CD1-SD 4.22Å; L355-M478 HydrophobicContact CD2-SD 4.32Å; L355-V485 HydrophobicContact CD1-CG2 4.39Å; L355-L942 HydrophobicContact CB-CD1 4.3Å
356	A	84.4	Confident	84.8	Confident	16 Å²	16	49.8 Å²	49.8	13%	0.132	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-67.3	-14.1	169.7	0	0	0	0	0	113.4	E353 S354 V933 T940	E353-A356 WeakPolarHBondContact O-CB 3.39Å; E353-A356 PolarHBondContact O-N 2.85Å; E353-A356 VanDerWaalsContact O-N 3.13Å; S354-A356 PolarHBondContact O-N 2.8Å; A356-V933 HydrophobicContact CB-CG2 4.21Å; A356-T940 HydrophobicContact CB-CG2 3.9Å; A356-T940 WeakPolarHBondContact CB-OG1 3.48Å; A356-T940 VanDerWaalsContact O-CG2 3.3Å; A356-T940 WeakPolarHBondContact O-CG2 3.41Å
357	S	82.9	Confident	85.9	Confident	27 Å²	27	43.8 Å²	43.8	19%	0.189	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-124.6	50.7	-173.8	62.2	0	0	0	0	111.1	S354 L355 T470 A471	S354-S357 PolarHBondContact O-N 3.39Å; S354-S357 VanDerWaalsContact O-N 3.07Å; S354-S357 PolarHBondContact O-OG 3.31Å; L355-S357 PolarHBondContact O-N 2.88Å; S357-T470 CarbonylContact O-C 3.58Å; S357-T470 VanDerWaalsContact O-CA 3.26Å; S357-T470 WeakPolarHBondContact O-CA 3.44Å; S357-A471 PolarHBondContact O-N 2.9Å
358	V	85.5	Confident	86.5	Confident	3 Å²	3	42 Å²	42	2%	0.018	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	136.7	175	178.2	0	0	0	0	109.9	L355 T361 V468 T469 H912 A930 L942	L355-V358 VanDerWaalsContact O-CG2 3.27Å; L355-V358 WeakPolarHBondContact O-CG2 2.94Å; V358-T361 HydrophobicContact CG1-CG2 3.38Å; V358-V468 HydrophobicContact CB-CG1 4.12Å; V358-V468 HydrophobicContact CG1-CG1 3.58Å; V358-V468 HydrophobicContact CG2-CG1 3.53Å; V358-T469 WeakPolarHBondContact CA-O 3.28Å; V358-H912 PolarHBondContact O-CE1 2.99Å; V358-H912 PolarHBondContact O-NE2 3.12Å; V358-A930 HydrophobicContact CB-CB 4.03Å; V358-A930 HydrophobicContact CG1-CB 4.13Å; V358-A930 HydrophobicContact CG2-CB 4.4Å; V358-L942 HydrophobicContact CG2-CD2 3.88Å
359	V	83.6	Confident	86.7	Confident	44 Å²	44	38.4 Å²	38.4	27%	0.267	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	-51.5	178.3	172.7	0	0	0	0	110.7	T469 A471 K502 F504	V359-T469 PolarHBondContact N-O 3.2Å; V359-A471 HydrophobicContact CG2-CB 3.77Å; V359-K502 WeakPolarHBondContact CG1-O 3.21Å; V359-F504 HydrophobicContact CB-CB 4.06Å; V359-F504 HydrophobicContact CG1-CB 3.67Å
360	S	85	Confident	86.5	Confident	25 Å²	25	38.8 Å²	38.8	18%	0.175	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	152.3	175.9	65.4	0	0	0	0	111	T469 F504	S360-T469 PolarHBondContact N-OG1 2.96Å; S360-T469 PolarHBondContact O-N 3.18Å; S360-T469 PolarHBondContact O-OG1 2.95Å; S360-T469 WeakPolarHBondContact OG-CG2 3.26Å; S360-T469 PolarHBondContact OG-OG1 2.83Å; S360-F504 VanDerWaalsContact CB-O 3.31Å; S360-F504 WeakPolarHBondContact CB-O 3Å; S360-F504 PolarHBondContact OG-O 3.37Å
361	T	88.9	Confident	86.4	Confident	14 Å²	14	41.7 Å²	41.7	9%	0.086	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	133.4	-174.5	54.2	0	0	0	0	108.5	V358 V467 V468 C915 F928	V358-T361 HydrophobicContact CG1-CG2 3.38Å; T361-V467 CarbonylContact C-O 3.48Å; T361-V467 WeakPolarHBondContact CA-O 3.28Å; T361-V468 HydrophobicContact CG2-CG1 4.19Å; T361-V468 HydrophobicContact CG2-CG2 4.27Å; T361-C915 VanDerWaalsContact OG1-CB 3.29Å; T361-C915 WeakPolarHBondContact OG1-CB 3.2Å; T361-F928 HydrophobicContact CG2-CD1 3.78Å; T361-F928 HydrophobicContact CG2-CE1 3.46Å; T361-F928 VanDerWaalsContact CG2-CE1 3.46Å
362	E	90	Very high	86.2	Confident	69 Å²	69	36.9 Å²	36.9	32%	0.322	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142.4	174	-72.7	-63.4	158.4	0	0	110	V467 L506	E362-V467 PolarHBondContact N-O 3.26Å; E362-V467 PolarHBondContact O-N 3.38Å; E362-L506 HydrophobicContact CB-CD2 3.67Å; E362-L506 HydrophobicContact CB-CG 4.34Å; E362-L506 HydrophobicContact CG-CB 4.24Å; E362-L506 HydrophobicContact CG-CD2 3.52Å; E362-L506 HydrophobicContact CG-CG 3.77Å
363	L	91.2	Very high	86	Confident	19 Å²	19	34.4 Å²	34.4	10%	0.099	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	110.3	175.9	-78.3	89.7	0	0	0	109.9	K464 L466 A917 M926 F944	L363-K464 HydrophobicContact CB-CD 4.13Å; L363-K464 HydrophobicContact CD2-CD 4.49Å; L363-L466 HydrophobicContact CD1-CD2 3.77Å; L363-L466 HydrophobicContact CD2-CD2 3.93Å; L363-L466 HydrophobicContact CG-CD2 3.55Å; L363-L466 HydrophobicContact CG-CG 4.46Å; L363-A917 HydrophobicContact CB-CB 3.77Å; L363-A917 HydrophobicContact CD1-CB 4.08Å; L363-A917 HydrophobicContact CD2-CB 3.98Å; L363-A917 HydrophobicContact CG-CB 4.13Å; L363-M926 HydrophobicContact CD2-CB 4.1Å; L363-M926 HydrophobicContact CD2-CE 4.45Å; L363-M926 HydrophobicContact CD2-SD 4.24Å; L363-F944 HydrophobicContact CD2-CE2 3.85Å; L363-F944 HydrophobicContact CD2-CZ 4.48Å
364	I	91.4	Very high	85.7	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.3	-174.6	-61.1	171.7	0	0	0	109.4	K464 M465 V467 V508 C521 P540 I541	I364-K464 WeakPolarHBondContact O-CB 3.34Å; I364-M465 HydrophobicContact CB-CB 4.32Å; I364-M465 PolarHBondContact N-O 3.33Å; I364-M465 WeakPolarHBondContact O-CB 3.49Å; I364-M465 PolarHBondContact O-N 2.98Å; I364-V467 HydrophobicContact CD1-CB 4.34Å; I364-V467 HydrophobicContact CD1-CG2 3.67Å; I364-V508 HydrophobicContact CD1-CG2 4.17Å; I364-V508 HydrophobicContact CG1-CG2 4.15Å; I364-C521 WeakPolarHBondContact CD1-SG 3.32Å; I364-P540 HydrophobicContact CD1-CB 3.32Å; I364-P540 HydrophobicContact CD1-CG 3.83Å; I364-P540 HydrophobicContact CG2-CG 4.26Å; I364-I541 HydrophobicContact CG2-CD1 4.4Å
365	D	91.7	Very high	85.6	Confident	43 Å²	43	38.1 Å²	38.1	23%	0.23	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	141.7	175.7	-69.1	-10.5	0	0	0	110.7	R457 K464 T512	D365-R457 IonicContact OD2-NH1 2.85Å; D365-R457 PolarHBondContact OD2-NH1 3.05Å; D365-K464 WeakPolarHBondContact OD1-CE 3.35Å; D365-K464 IonicContact OD1-NZ 3.44Å; D365-K464 PolarHBondContact OD1-NZ 2.95Å; D365-T512 WeakPolarHBondContact O-CG2 3.12Å; D365-T512 PolarHBondContact O-OG1 2.7Å
366	L	91.9	Very high	85.1	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-68.2	160.5	171.4	-72.2	176.3	0	0	0	110.8	L455 E456 R457 R463 M465 T512	L366-L455 HydrophobicContact CD2-CB 4.42Å; L366-L455 HydrophobicContact CD2-CD2 4.35Å; L366-E456 VanDerWaalsContact CD1-O 3.29Å; L366-E456 WeakPolarHBondContact CD1-O 3.34Å; L366-R457 HydrophobicContact CB-CB 4.15Å; L366-R463 HydrophobicContact CD1-CB 4.17Å; L366-R463 HydrophobicContact CD1-CG 3.61Å; L366-M465 HydrophobicContact CD2-CB 4.14Å; L366-T512 PolarHBondContact O-OG1 3.3Å; L366-T512 VanDerWaalsContact O-OG1 3.07Å
367	P	90.3	Very high	84.8	Confident	43 Å²	43	44.2 Å²	44.2	28%	0.279	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-64.1	152.5	176.1	28.4	-36	0	0	0	111.7	L455 R457 I541	P367-L455 WeakPolarHBondContact CD-O 3.48Å; P367-L455 WeakPolarHBondContact CG-O 3.48Å; P367-R457 WeakPolarHBondContact O-CB 3.45Å; P367-R457 PolarHBondContact O-N 2.92Å; P367-I541 HydrophobicContact CG-CG2 4.44Å
368	L	86	Confident	84.3	Confident	32 Å²	32	44.3 Å²	44.3	17%	0.168	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-58	145.9	177.7	-65.8	173.9	0	0	0	111.3	E372 T373 E376	L368-E372 HydrophobicContact CB-CB 4.12Å; L368-E372 HydrophobicContact CD2-CB 4.3Å; L368-T373 HydrophobicContact CB-CG2 3.77Å; L368-E376 HydrophobicContact CD1-CG 4.11Å
369	S	83.9	Confident	83.7	Confident	20 Å²	20	51.3 Å²	51.3	14%	0.14	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-66.8	153.2	174.1	63.6	0	0	0	0	111.1	Q371 E372 T373	S369-Q371 PolarHBondContact O-N 2.75Å; S369-E372 PolarHBondContact N-OE2 3.32Å; S369-E372 PolarHBondContact O-N 2.73Å; S369-E372 VanDerWaalsContact OG-CD 3.27Å; S369-E372 VanDerWaalsContact OG-CG 3.29Å; S369-E372 WeakPolarHBondContact OG-CG 3.36Å; S369-E372 PolarHBondContact OG-N 2.95Å; S369-E372 PolarHBondContact OG-OE2 3.12Å; S369-T373 WeakPolarHBondContact O-CG2 3.45Å; S369-T373 PolarHBondContact O-N 3.5Å
370	E	80.8	Confident	82.9	Confident	109 Å²	109	52.8 Å²	52.8	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-51.1	-35.4	178.9	-72	179.1	-174.2	0	0	112.3	T373 I374 R454	E370-T373 VanDerWaalsContact C-OG1 3.3Å; E370-T373 WeakPolarHBondContact CA-OG1 3.37Å; E370-T373 PolarHBondContact O-N 2.81Å; E370-T373 PolarHBondContact O-OG1 2.7Å; E370-I374 WeakPolarHBondContact O-CD1 3.44Å; E370-I374 VanDerWaalsContact O-CG1 3.27Å; E370-I374 WeakPolarHBondContact O-CG1 3.44Å; E370-I374 PolarHBondContact O-N 2.62Å; E370-I374 VanDerWaalsContact O-N 3.09Å; E370-R454 VanDerWaalsContact CD-NH1 3.32Å; E370-R454 IonicContact OE1-CZ 3.78Å; E370-R454 IonicContact OE1-NH1 3.15Å; E370-R454 PolarHBondContact OE1-NH1 2.77Å; E370-R454 IonicContact OE1-NH2 3.46Å; E370-R454 IonicContact OE2-NH1 3.93Å
371	Q	78.9	Confident	81.7	Confident	119 Å²	119	53.8 Å²	53.8	56%	0.556	27%	0.274	S	S	*	.	H	α-helix	trans	-66.8	-46.5	177.5	-64	-176.8	-24.2	0	0	112.6	S369 T373 I374 L375	S369-Q371 PolarHBondContact O-N 2.75Å; Q371-T373 VanDerWaalsContact C-N 3.3Å; Q371-T373 PolarHBondContact O-N 2.79Å; Q371-I374 PolarHBondContact O-N 3.45Å; Q371-L375 WeakPolarHBondContact O-CG 3.49Å; Q371-L375 PolarHBondContact O-N 3.49Å
372	E	83.1	Confident	80.2	Confident	48 Å²	48	57 Å²	57	22%	0.224	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-36.2	175.8	-70.9	165	156.2	0	0	111.5	L368 S369 I374 L375 E376	L368-E372 HydrophobicContact CB-CB 4.12Å; L368-E372 HydrophobicContact CD2-CB 4.3Å; S369-E372 PolarHBondContact N-OE2 3.32Å; S369-E372 PolarHBondContact O-N 2.73Å; S369-E372 VanDerWaalsContact OG-CD 3.27Å; S369-E372 VanDerWaalsContact OG-CG 3.29Å; S369-E372 WeakPolarHBondContact OG-CG 3.36Å; S369-E372 PolarHBondContact OG-N 2.95Å; S369-E372 PolarHBondContact OG-OE2 3.12Å; E372-I374 VanDerWaalsContact C-N 3.32Å; E372-I374 PolarHBondContact O-N 2.81Å; E372-L375 WeakPolarHBondContact O-CB 3.44Å; E372-L375 PolarHBondContact O-N 2.75Å; E372-L375 VanDerWaalsContact O-N 3.15Å; E372-E376 PolarHBondContact O-N 2.8Å
373	T	81.4	Confident	78.2	Confident	13 Å²	13	59.6 Å²	59.6	8%	0.08	31%	0.309	C	S	.	.	H	α-helix	trans	-63.8	-39.3	176	65.7	0	0	0	0	112.2	L368 S369 E370 Q371 L375 E376 E377 Y515	L368-T373 HydrophobicContact CB-CG2 3.77Å; S369-T373 WeakPolarHBondContact O-CG2 3.45Å; S369-T373 PolarHBondContact O-N 3.5Å; E370-T373 VanDerWaalsContact C-OG1 3.3Å; E370-T373 WeakPolarHBondContact CA-OG1 3.37Å; E370-T373 PolarHBondContact O-N 2.81Å; E370-T373 PolarHBondContact O-OG1 2.7Å; Q371-T373 VanDerWaalsContact C-N 3.3Å; Q371-T373 PolarHBondContact O-N 2.79Å; T373-L375 VanDerWaalsContact C-N 3.27Å; T373-L375 PolarHBondContact O-N 2.91Å; T373-E376 PolarHBondContact O-N 2.83Å; T373-E377 WeakPolarHBondContact O-CG 3.38Å; T373-E377 PolarHBondContact O-N 3.12Å; T373-Y515 HydrophobicContact CG2-CD2 3.18Å; T373-Y515 HydrophobicContact CG2-CE2 3.23Å; T373-Y515 HydrophobicContact CG2-CG 4.04Å
374	I	79.1	Confident	76	Confident	53 Å²	53	61.6 Å²	61.6	27%	0.272	33%	0.334	S	S	.	.	H	α-helix	trans	-64	-35.7	175.2	-69.7	164.2	0	0	0	111	E370 Q371 E372 E378 K413	E370-I374 WeakPolarHBondContact O-CD1 3.44Å; E370-I374 VanDerWaalsContact O-CG1 3.27Å; E370-I374 WeakPolarHBondContact O-CG1 3.44Å; E370-I374 PolarHBondContact O-N 2.62Å; E370-I374 VanDerWaalsContact O-N 3.09Å; Q371-I374 PolarHBondContact O-N 3.45Å; E372-I374 VanDerWaalsContact C-N 3.32Å; E372-I374 PolarHBondContact O-N 2.81Å; I374-E378 PolarHBondContact O-N 3.02Å; I374-E378 VanDerWaalsContact O-N 3.13Å; I374-K413 HydrophobicContact CG2-CB 4.5Å; I374-K413 HydrophobicContact CG2-CD 3.97Å
375	L	79.3	Confident	73.8	Confident	73 Å²	73	65 Å²	65	38%	0.382	36%	0.363	S	S	.	.	H	α-helix	trans	-67.8	-45.9	175.5	-66.8	170.8	0	0	0	111.3	Q371 E372 T373 E377 E378 F379	Q371-L375 WeakPolarHBondContact O-CG 3.49Å; Q371-L375 PolarHBondContact O-N 3.49Å; E372-L375 WeakPolarHBondContact O-CB 3.44Å; E372-L375 PolarHBondContact O-N 2.75Å; E372-L375 VanDerWaalsContact O-N 3.15Å; T373-L375 VanDerWaalsContact C-N 3.27Å; T373-L375 PolarHBondContact O-N 2.91Å; L375-E377 VanDerWaalsContact C-N 3.3Å; L375-E377 PolarHBondContact O-N 2.92Å; L375-E378 WeakPolarHBondContact O-CB 3.48Å; L375-E378 PolarHBondContact O-N 2.85Å; L375-F379 WeakPolarHBondContact O-CD2 3.48Å; L375-F379 PolarHBondContact O-N 2.92Å
376	E	78.4	Confident	71.3	Confident	98 Å²	98	66.1 Å²	66.1	46%	0.458	37%	0.372	S	S	.	.	H	α-helix	trans	-61.6	-37.6	175.4	-75.2	-69.4	169.7	0	0	112.2	L368 E372 T373 E378 F379 S380	L368-E376 HydrophobicContact CD1-CG 4.11Å; E372-E376 PolarHBondContact O-N 2.8Å; T373-E376 PolarHBondContact O-N 2.83Å; E376-E378 VanDerWaalsContact C-N 3.29Å; E376-E378 PolarHBondContact O-N 3.29Å; E376-F379 PolarHBondContact O-N 2.85Å; E376-S380 WeakPolarHBondContact O-CB 3.49Å; E376-S380 PolarHBondContact O-N 2.82Å; E376-S380 PolarHBondContact O-OG 3.35Å
377	E	76.7	Confident	68.7	Low	70 Å²	70	70 Å²	70	33%	0.327	41%	0.412	S	S	.	.	H	α-helix	trans	-62.5	-33.2	172.2	-77.9	-174.6	175.5	0	0	113.3	T373 L375 F379 S380 K413 Y515	T373-E377 WeakPolarHBondContact O-CG 3.38Å; T373-E377 PolarHBondContact O-N 3.12Å; L375-E377 VanDerWaalsContact C-N 3.3Å; L375-E377 PolarHBondContact O-N 2.92Å; E377-F379 VanDerWaalsContact C-N 3.31Å; E377-F379 PolarHBondContact O-N 3.21Å; E377-S380 WeakPolarHBondContact CA-OG 3.44Å; E377-K413 IonicContact OE2-NZ 3.45Å; E377-K413 PolarHBondContact OE2-NZ 2.71Å; E377-Y515 HydrophobicContact CG-CD1 4.37Å; E377-Y515 HydrophobicContact CG-CE1 3.91Å
378	E	73.1	Confident	66.3	Low	29 Å²	29	74 Å²	74	14%	0.136	43%	0.431	C	S	.	.	H	α-helix	trans	-62.7	-40.6	178.4	-168	-172.8	148.2	0	0	111.4	I374 L375 E376 R410	I374-E378 PolarHBondContact O-N 3.02Å; I374-E378 VanDerWaalsContact O-N 3.13Å; L375-E378 WeakPolarHBondContact O-CB 3.48Å; L375-E378 PolarHBondContact O-N 2.85Å; E376-E378 VanDerWaalsContact C-N 3.29Å; E376-E378 PolarHBondContact O-N 3.29Å; E378-R410 HydrophobicContact CG-CB 4.41Å; E378-R410 WeakPolarHBondContact OE1-CB 3.42Å; E378-R410 WeakPolarHBondContact OE1-CD 3.31Å; E378-R410 WeakPolarHBondContact OE1-CG 3.15Å; E378-R410 IonicContact OE1-NE 2.81Å
379	F	72.4	Confident	63.9	Low	149 Å²	149	84.8 Å²	84.8	65%	0.654	47%	0.469	S	S	*	.	H	α-helix	trans	-95.3	-20.4	-174.8	-62.5	-69.6	0	0	0	114.4	L375 E376 E377 V381	L375-F379 WeakPolarHBondContact O-CD2 3.48Å; L375-F379 PolarHBondContact O-N 2.92Å; E376-F379 PolarHBondContact O-N 2.85Å; E377-F379 VanDerWaalsContact C-N 3.31Å; E377-F379 PolarHBondContact O-N 3.21Å; F379-V381 VanDerWaalsContact C-N 3.26Å; F379-V381 PolarHBondContact O-N 2.68Å
380	S	67.1	Low	61.9	Low	76 Å²	76	87.9 Å²	87.9	53%	0.531	48%	0.483	S	S	.	.			trans	-77.9	-2	-175.2	54.7	0	0	0	0	115	E376 E377 P382	E376-S380 WeakPolarHBondContact O-CB 3.49Å; E376-S380 PolarHBondContact O-N 2.82Å; E376-S380 PolarHBondContact O-OG 3.35Å; E377-S380 WeakPolarHBondContact CA-OG 3.44Å; S380-P382 WeakPolarHBondContact O-CD 3.48Å; S380-P382 VanDerWaalsContact O-N 3.11Å
381	V	61.2	Low	60.1	Low	45 Å²	45	86.6 Å²	86.6	27%	0.273	49%	0.486	S	S	.	.	S	Bend	trans	-66.9	109	176.5	-176.1	0	0	0	0	109.5	F379 M383 R405	F379-V381 VanDerWaalsContact C-N 3.26Å; F379-V381 PolarHBondContact O-N 2.68Å; V381-M383 PolarHBondContact O-N 2.68Å; V381-R405 VanDerWaalsContact CG1-NH2 3.28Å
382	P	56.2	Low	58.9	Low	83 Å²	83	86 Å²	86	54%	0.539	50%	0.495	S	S	.	.			trans	-66	130.7	-174.7	-13	26.8	0	0	0	109.7	S380 G384	S380-P382 WeakPolarHBondContact O-CD 3.48Å; S380-P382 VanDerWaalsContact O-N 3.11Å; P382-G384 PolarHBondContact O-N 3.2Å
383	M	47.4	Very low	57.5	Low	123 Å²	123	88.8 Å²	88.8	61%	0.606	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-5.4	176	-129.1	-174.3	-173.9	0	0	114.2	V381 M406	V381-M383 PolarHBondContact O-N 2.68Å; M383-M406 HydrophobicContact CE-CE 4.5Å; M383-M406 HydrophobicContact CG-CE 3.77Å
384	G	46.3	Very low	56.1	Low	60 Å²	60	94.9 Å²	94.9	62%	0.619	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	10	-170.4	0	0	0	0	0	117	P382 V386	P382-G384 PolarHBondContact O-N 3.2Å; G384-V386 PolarHBondContact O-N 2.89Å; G384-V386 VanDerWaalsContact O-N 3.1Å
385	A	45.1	Very low	54.7	Low	77 Å²	77	96.8 Å²	96.8	64%	0.636	56%	0.555	S	S	*	*			trans	-77.3	11.3	-173.8	0	0	0	0	0	115.8
386	V	38.6	Very low	53.2	Low	68 Å²	68	99.9 Å²	99.9	41%	0.412	57%	0.572	S	S	.	*			trans	-120.6	75.6	167.2	-173.1	0	0	0	0	108.5	G384 L388 F398	G384-V386 PolarHBondContact O-N 2.89Å; G384-V386 VanDerWaalsContact O-N 3.1Å; V386-L388 HydrophobicContact CG1-CB 4.28Å; V386-L388 HydrophobicContact CG1-CD1 3.95Å; V386-L388 HydrophobicContact CG1-CG 4.4Å; V386-L388 PolarHBondContact O-N 3.47Å; V386-F398 HydrophobicContact CB-CZ 4.28Å
387	G	37.2	Very low	51.8	Low	83 Å²	83	98.9 Å²	98.9	86%	0.856	58%	0.575	S	S	*	*			trans	-71.7	62.5	168.3	0	0	0	0	0	111.7
388	L	40.6	Very low	50.5	Low	127 Å²	127	98.9 Å²	98.9	67%	0.665	57%	0.574	S	S	*	*			trans	-95.7	121	163.1	-89.3	158.5	0	0	0	107.6	V386 I390	V386-L388 HydrophobicContact CG1-CB 4.28Å; V386-L388 HydrophobicContact CG1-CD1 3.95Å; V386-L388 HydrophobicContact CG1-CG 4.4Å; V386-L388 PolarHBondContact O-N 3.47Å; L388-I390 VanDerWaalsContact C-N 3.33Å; L388-I390 HydrophobicContact CB-CD1 4.35Å; L388-I390 HydrophobicContact CB-CG1 4.24Å; L388-I390 WeakPolarHBondContact O-CG1 3.48Å; L388-I390 PolarHBondContact O-N 2.88Å
389	R	34.8	Very low	49.4	Very low	257 Å²	257	103.6 Å²	103.6	97%	0.97	59%	0.594	S	S	*	*			trans	-52.4	95	168.1	-83.7	176.7	166.4	169.8	-4.3	108.9
390	I	42.5	Very low	48.6	Very low	86 Å²	86	102 Å²	102	44%	0.441	59%	0.591	S	S	.	*			trans	-110.1	122	175	-63.6	170.8	0	0	0	107.9	L388 K394 F398	L388-I390 VanDerWaalsContact C-N 3.33Å; L388-I390 HydrophobicContact CB-CD1 4.35Å; L388-I390 HydrophobicContact CB-CG1 4.24Å; L388-I390 WeakPolarHBondContact O-CG1 3.48Å; L388-I390 PolarHBondContact O-N 2.88Å; I390-K394 HydrophobicContact CG2-CB 3.58Å; I390-K394 HydrophobicContact CG2-CD 4.18Å; I390-K394 HydrophobicContact CG2-CG 4.45Å; I390-F398 HydrophobicContact CD1-CD2 4.27Å; I390-F398 HydrophobicContact CD1-CE2 4.35Å
391	S	43.7	Very low	48.2	Very low	82 Å²	82	103 Å²	103	57%	0.573	59%	0.591	S	S	*	*			trans	-47.7	143.9	174.8	-175.9	0	0	0	0	112.3	S393 K394	S391-S393 PolarHBondContact O-N 3.02Å; S391-K394 PolarHBondContact O-N 2.94Å; S391-K394 VanDerWaalsContact O-N 3.11Å
392	S	53.5	Low	48.6	Very low	106 Å²	106	102 Å²	102	74%	0.741	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-54.5	-14.1	-173.5	40.5	0	0	0	0	115.5
393	S	53.9	Low	49.8	Very low	106 Å²	106	102.1 Å²	102.1	74%	0.741	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-81.2	-4	177	57.3	0	0	0	0	115.4	S391	S391-S393 PolarHBondContact O-N 3.02Å
394	K	50.5	Low	51.4	Low	142 Å²	142	102.4 Å²	102.4	62%	0.617	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-115.9	8.6	179.4	-80.6	-174	178.6	-176.2	0	115.4	I390 S391 N396 C397 F398	I390-K394 HydrophobicContact CG2-CB 3.58Å; I390-K394 HydrophobicContact CG2-CD 4.18Å; I390-K394 HydrophobicContact CG2-CG 4.45Å; S391-K394 PolarHBondContact O-N 2.94Å; S391-K394 VanDerWaalsContact O-N 3.11Å; K394-N396 VanDerWaalsContact C-N 3.28Å; K394-N396 PolarHBondContact O-N 3.29Å; K394-C397 PolarHBondContact O-N 3.45Å; K394-F398 PolarHBondContact O-N 3.38Å
395	L	49.6	Very low	53	Low	92 Å²	92	104.1 Å²	104.1	48%	0.482	57%	0.569	S	S	.	*	H	α-helix	trans	-55.4	-40.1	-179.4	-100	90	0	0	0	113.1	C397 F398 F399	L395-C397 VanDerWaalsContact C-N 3.31Å; L395-C397 PolarHBondContact O-N 2.64Å; L395-F398 PolarHBondContact O-N 2.66Å; L395-F399 HydrophobicContact CD2-CE2 4.25Å; L395-F399 WeakPolarHBondContact O-CD2 3.07Å; L395-F399 PolarHBondContact O-N 2.81Å
396	N	47.9	Very low	54.7	Low	138 Å²	138	103.8 Å²	103.8	74%	0.738	56%	0.555	S	S	*	*	H	α-helix	trans	-67.4	-26.8	-175.7	-73.2	-5.9	0	0	0	114	K394 I400	K394-N396 VanDerWaalsContact C-N 3.28Å; K394-N396 PolarHBondContact O-N 3.29Å; N396-I400 WeakPolarHBondContact O-CG1 3.08Å
397	C	49.5	Very low	57	Low	77 Å²	77	106.4 Å²	106.4	52%	0.52	56%	0.561	S	S	.	*	H	α-helix	trans	-81.1	-31.6	177.4	-145.7	0	0	0	0	111.6	K394 L395 I400 D401	K394-C397 PolarHBondContact O-N 3.45Å; L395-C397 VanDerWaalsContact C-N 3.31Å; L395-C397 PolarHBondContact O-N 2.64Å; C397-I400 PolarHBondContact O-N 2.56Å; C397-D401 PolarHBondContact O-N 2.75Å
398	F	49.3	Very low	59.3	Low	71 Å²	71	104.6 Å²	104.6	31%	0.311	53%	0.533	S	S	.	.	H	α-helix	trans	-71.2	-32.7	-179.7	-161.4	-99.9	0	0	0	113	V386 I390 K394 L395 N402	V386-F398 HydrophobicContact CB-CZ 4.28Å; I390-F398 HydrophobicContact CD1-CD2 4.27Å; I390-F398 HydrophobicContact CD1-CE2 4.35Å; K394-F398 PolarHBondContact O-N 3.38Å; L395-F398 PolarHBondContact O-N 2.66Å; F398-N402 VanDerWaalsContact CD1-ND2 3.3Å; F398-N402 WeakPolarHBondContact CD1-ND2 3.21Å; F398-N402 WeakPolarHBondContact CE1-ND2 3.45Å; F398-N402 WeakPolarHBondContact O-CB 3.35Å; F398-N402 PolarHBondContact O-N 3Å; F398-N402 VanDerWaalsContact O-N 3.17Å; F398-N402 PolarHBondContact O-ND2 2.89Å
399	F	50	Low	61.3	Low	127 Å²	127	101.3 Å²	101.3	56%	0.557	52%	0.517	S	S	*	.	H	α-helix	trans	-67.6	-39.8	172.3	-82.8	-77.3	0	0	0	112.2	L395 V403	L395-F399 HydrophobicContact CD2-CE2 4.25Å; L395-F399 WeakPolarHBondContact O-CD2 3.07Å; L395-F399 PolarHBondContact O-N 2.81Å; F399-V403 WeakPolarHBondContact O-CB 3.21Å; F399-V403 VanDerWaalsContact O-CG2 3.29Å; F399-V403 WeakPolarHBondContact O-CG2 3.49Å; F399-V403 PolarHBondContact O-N 2.62Å; F399-V403 VanDerWaalsContact O-N 3.09Å
400	I	55	Low	63.8	Low	115 Å²	115	95 Å²	95	59%	0.59	49%	0.493	S	S	*	.	H	α-helix	trans	-69.6	-42.5	179.1	-61	170.1	0	0	0	110.3	N396 C397 N402 V403 F404	N396-I400 WeakPolarHBondContact O-CG1 3.08Å; C397-I400 PolarHBondContact O-N 2.56Å; I400-N402 PolarHBondContact O-N 3.47Å; I400-V403 PolarHBondContact O-N 2.78Å; I400-F404 WeakPolarHBondContact O-CB 3.44Å; I400-F404 PolarHBondContact O-N 2.76Å
401	D	59.3	Low	65.9	Low	97 Å²	97	93.2 Å²	93.2	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-39.5	178.7	-77.9	-13.9	0	0	0	112.4	C397 R405	C397-D401 PolarHBondContact O-N 2.75Å; D401-R405 WeakPolarHBondContact O-CB 3.48Å; D401-R405 PolarHBondContact O-N 3.21Å
402	N	70.7	Confident	68	Low	26 Å²	26	92.8 Å²	92.8	14%	0.139	48%	0.48	C	S	.	.	H	α-helix	trans	-71.3	-43	178.4	-76.2	-31.3	0	0	0	112.7	F398 I400 R405 M406	F398-N402 VanDerWaalsContact CD1-ND2 3.3Å; F398-N402 WeakPolarHBondContact CD1-ND2 3.21Å; F398-N402 WeakPolarHBondContact CE1-ND2 3.45Å; F398-N402 WeakPolarHBondContact O-CB 3.35Å; F398-N402 PolarHBondContact O-N 3Å; F398-N402 VanDerWaalsContact O-N 3.17Å; F398-N402 PolarHBondContact O-ND2 2.89Å; I400-N402 PolarHBondContact O-N 3.47Å; N402-R405 PolarHBondContact O-N 3.1Å; N402-M406 WeakPolarHBondContact O-CB 3.47Å; N402-M406 VanDerWaalsContact O-CG 3.26Å; N402-M406 WeakPolarHBondContact O-CG 3.45Å; N402-M406 PolarHBondContact O-N 3Å
403	V	80.1	Confident	69.4	Low	85 Å²	85	90.3 Å²	90.3	52%	0.515	46%	0.456	S	S	.	.	H	α-helix	trans	-68.8	-41.5	177.3	175	0	0	0	0	110.7	F399 I400 M406 F407	F399-V403 WeakPolarHBondContact O-CB 3.21Å; F399-V403 VanDerWaalsContact O-CG2 3.29Å; F399-V403 WeakPolarHBondContact O-CG2 3.49Å; F399-V403 PolarHBondContact O-N 2.62Å; F399-V403 VanDerWaalsContact O-N 3.09Å; I400-V403 PolarHBondContact O-N 2.78Å; V403-M406 PolarHBondContact O-N 3.14Å; V403-F407 WeakPolarHBondContact O-CB 3.47Å; V403-F407 PolarHBondContact O-N 3.27Å
404	F	82.1	Confident	71	Confident	128 Å²	128	89.1 Å²	89.1	56%	0.561	44%	0.439	S	S	*	.	H	α-helix	trans	-64.1	-42.5	175.5	-173	-100.9	0	0	0	111	I400 M406 F407 T408	I400-F404 WeakPolarHBondContact O-CB 3.44Å; I400-F404 PolarHBondContact O-N 2.76Å; F404-M406 PolarHBondContact O-N 2.8Å; F404-F407 WeakPolarHBondContact O-CB 3.37Å; F404-F407 PolarHBondContact O-N 3.01Å; F404-T408 HydrophobicContact CD1-CG2 3.92Å; F404-T408 HydrophobicContact CE1-CG2 3.52Å; F404-T408 HydrophobicContact CE2-CG2 4.28Å; F404-T408 HydrophobicContact CG-CG2 4.45Å; F404-T408 HydrophobicContact CZ-CG2 3.73Å; F404-T408 WeakPolarHBondContact O-CG2 3.41Å; F404-T408 PolarHBondContact O-N 3.3Å; F404-T408 PolarHBondContact O-OG1 3.38Å
405	R	79.5	Confident	72.8	Confident	97 Å²	97	87.3 Å²	87.3	37%	0.366	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-43.4	174.2	-170.2	-179.8	79.3	162.8	3.5	112.2	V381 D401 N402 T408 N409	V381-R405 VanDerWaalsContact CG1-NH2 3.28Å; D401-R405 WeakPolarHBondContact O-CB 3.48Å; D401-R405 PolarHBondContact O-N 3.21Å; N402-R405 PolarHBondContact O-N 3.1Å; R405-T408 WeakPolarHBondContact CA-OG1 3.28Å; R405-T408 PolarHBondContact O-N 2.83Å; R405-T408 PolarHBondContact O-OG1 3.32Å; R405-N409 VanDerWaalsContact O-CB 3.28Å; R405-N409 WeakPolarHBondContact O-CB 3.4Å; R405-N409 PolarHBondContact O-N 3.47Å; R405-N409 PolarHBondContact O-OD1 3.32Å
406	M	81.5	Confident	74.4	Confident	69 Å²	69	87.9 Å²	87.9	34%	0.34	44%	0.438	S	S	.	.	H	α-helix	trans	-60.5	-45.3	174	-76	177.8	169.8	0	0	111.2	M383 N402 V403 F404 N409 R410	M383-M406 HydrophobicContact CE-CE 4.5Å; M383-M406 HydrophobicContact CG-CE 3.77Å; N402-M406 WeakPolarHBondContact O-CB 3.47Å; N402-M406 VanDerWaalsContact O-CG 3.26Å; N402-M406 WeakPolarHBondContact O-CG 3.45Å; N402-M406 PolarHBondContact O-N 3Å; V403-M406 PolarHBondContact O-N 3.14Å; F404-M406 PolarHBondContact O-N 2.8Å; M406-N409 PolarHBondContact O-N 3.16Å; M406-R410 WeakPolarHBondContact O-CB 3.34Å; M406-R410 PolarHBondContact O-N 3.31Å
407	F	85.7	Confident	76.1	Confident	123 Å²	123	84.1 Å²	84.1	54%	0.539	42%	0.416	S	S	.	.	H	α-helix	trans	-62.2	-47	176.7	176.8	-100	0	0	0	112.2	V403 F404 N409 R410 V411	V403-F407 WeakPolarHBondContact O-CB 3.47Å; V403-F407 PolarHBondContact O-N 3.27Å; F404-F407 WeakPolarHBondContact O-CB 3.37Å; F404-F407 PolarHBondContact O-N 3.01Å; F407-N409 VanDerWaalsContact C-N 3.33Å; F407-N409 PolarHBondContact O-N 2.96Å; F407-R410 PolarHBondContact O-N 3.13Å; F407-V411 HydrophobicContact CD1-CG2 4.26Å; F407-V411 HydrophobicContact CD2-CG2 4.16Å; F407-V411 HydrophobicContact CE1-CG2 3.85Å; F407-V411 HydrophobicContact CE2-CG2 3.74Å; F407-V411 HydrophobicContact CG-CG2 4.41Å; F407-V411 HydrophobicContact CZ-CG2 3.57Å; F407-V411 WeakPolarHBondContact O-CB 3.47Å; F407-V411 WeakPolarHBondContact O-CG2 3.15Å; F407-V411 PolarHBondContact O-N 2.93Å
408	T	85.8	Confident	77.9	Confident	45 Å²	45	85.2 Å²	85.2	28%	0.276	42%	0.417	S	S	.	.	H	α-helix	trans	-64.7	-38.6	177.4	54.6	0	0	0	0	111.7	F404 R405 T412	F404-T408 HydrophobicContact CD1-CG2 3.92Å; F404-T408 HydrophobicContact CE1-CG2 3.52Å; F404-T408 HydrophobicContact CE2-CG2 4.28Å; F404-T408 HydrophobicContact CG-CG2 4.45Å; F404-T408 HydrophobicContact CZ-CG2 3.73Å; F404-T408 WeakPolarHBondContact O-CG2 3.41Å; F404-T408 PolarHBondContact O-N 3.3Å; F404-T408 PolarHBondContact O-OG1 3.38Å; R405-T408 WeakPolarHBondContact CA-OG1 3.28Å; R405-T408 PolarHBondContact O-N 2.83Å; R405-T408 PolarHBondContact O-OG1 3.32Å; T408-T412 WeakPolarHBondContact O-CB 3.37Å; T408-T412 WeakPolarHBondContact O-CG2 3.33Å; T408-T412 PolarHBondContact O-N 3.06Å; T408-T412 PolarHBondContact O-OG1 3.43Å
409	N	83.5	Confident	79.6	Confident	59 Å²	59	87.9 Å²	87.9	32%	0.316	43%	0.428	S	S	.	.	H	α-helix	trans	-62.6	-47	175	-77	-4.7	0	0	0	110.7	R405 M406 F407 T412 K413	R405-N409 VanDerWaalsContact O-CB 3.28Å; R405-N409 WeakPolarHBondContact O-CB 3.4Å; R405-N409 PolarHBondContact O-N 3.47Å; R405-N409 PolarHBondContact O-OD1 3.32Å; M406-N409 PolarHBondContact O-N 3.16Å; F407-N409 VanDerWaalsContact C-N 3.33Å; F407-N409 PolarHBondContact O-N 2.96Å; N409-T412 WeakPolarHBondContact CA-OG1 3.48Å; N409-T412 PolarHBondContact O-N 3.04Å; N409-T412 PolarHBondContact O-OG1 2.8Å; N409-K413 WeakPolarHBondContact O-CB 3.28Å; N409-K413 WeakPolarHBondContact O-CG 3.45Å; N409-K413 PolarHBondContact O-N 2.94Å
410	R	85.8	Confident	81	Confident	123 Å²	123	84.6 Å²	84.6	46%	0.464	42%	0.421	S	S	.	.	H	α-helix	trans	-59.2	-53.6	175.6	173	165.9	-179.5	171.8	6.1	112.3	E378 M406 F407 T412 K413 E414	E378-R410 HydrophobicContact CG-CB 4.41Å; E378-R410 WeakPolarHBondContact OE1-CB 3.42Å; E378-R410 WeakPolarHBondContact OE1-CD 3.31Å; E378-R410 WeakPolarHBondContact OE1-CG 3.15Å; E378-R410 IonicContact OE1-NE 2.81Å; M406-R410 WeakPolarHBondContact O-CB 3.34Å; M406-R410 PolarHBondContact O-N 3.31Å; F407-R410 PolarHBondContact O-N 3.13Å; R410-T412 VanDerWaalsContact C-N 3.32Å; R410-T412 PolarHBondContact O-N 2.8Å; R410-K413 PolarHBondContact O-N 2.81Å; R410-K413 VanDerWaalsContact O-N 3.17Å; R410-E414 HydrophobicContact CG-CG 4.29Å; R410-E414 IonicContact CZ-OE1 3.49Å; R410-E414 IonicContact NE-OE1 2.62Å; R410-E414 PolarHBondContact NE-OE1 3.08Å; R410-E414 IonicContact NH2-OE1 3.89Å; R410-E414 PolarHBondContact NH2-OE1 3.3Å; R410-E414 VanDerWaalsContact NH2-OE1 3.15Å; R410-E414 WeakPolarHBondContact O-CB 3.27Å; R410-E414 WeakPolarHBondContact O-CG 3.32Å; R410-E414 PolarHBondContact O-N 2.81Å
411	V	87.6	Confident	82.3	Confident	50 Å²	50	86.4 Å²	86.4	30%	0.303	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-40.3	-178.2	171.3	0	0	0	0	111.7	F407 L415	F407-V411 HydrophobicContact CD1-CG2 4.26Å; F407-V411 HydrophobicContact CD2-CG2 4.16Å; F407-V411 HydrophobicContact CE1-CG2 3.85Å; F407-V411 HydrophobicContact CE2-CG2 3.74Å; F407-V411 HydrophobicContact CG-CG2 4.41Å; F407-V411 HydrophobicContact CZ-CG2 3.57Å; F407-V411 WeakPolarHBondContact O-CB 3.47Å; F407-V411 WeakPolarHBondContact O-CG2 3.15Å; F407-V411 PolarHBondContact O-N 2.93Å; V411-L415 HydrophobicContact CG1-CD1 4Å; V411-L415 WeakPolarHBondContact O-CB 3.3Å; V411-L415 PolarHBondContact O-N 2.87Å
412	T	86.4	Confident	83.5	Confident	73 Å²	73	86.1 Å²	86.1	45%	0.448	42%	0.419	S	S	.	.	H	α-helix	trans	-66.8	-41.1	176.9	52.5	0	0	0	0	112.1	T408 N409 R410 L415 L416	T408-T412 WeakPolarHBondContact O-CB 3.37Å; T408-T412 WeakPolarHBondContact O-CG2 3.33Å; T408-T412 PolarHBondContact O-N 3.06Å; T408-T412 PolarHBondContact O-OG1 3.43Å; N409-T412 WeakPolarHBondContact CA-OG1 3.48Å; N409-T412 PolarHBondContact O-N 3.04Å; N409-T412 PolarHBondContact O-OG1 2.8Å; R410-T412 VanDerWaalsContact C-N 3.32Å; R410-T412 PolarHBondContact O-N 2.8Å; T412-L415 PolarHBondContact O-N 3.01Å; T412-L416 VanDerWaalsContact O-CG 3.29Å; T412-L416 WeakPolarHBondContact O-CG 3.37Å; T412-L416 PolarHBondContact O-N 3.49Å
413	K	84.5	Confident	83.9	Confident	54 Å²	54	87 Å²	87	24%	0.235	42%	0.424	C	S	.	.	H	α-helix	trans	-66.8	-43.8	176	-68.4	-69.6	-160.2	159.2	0	111.9	I374 E377 N409 R410 L415 L416 Q417	I374-K413 HydrophobicContact CG2-CB 4.5Å; I374-K413 HydrophobicContact CG2-CD 3.97Å; E377-K413 IonicContact OE2-NZ 3.45Å; E377-K413 PolarHBondContact OE2-NZ 2.71Å; N409-K413 WeakPolarHBondContact O-CB 3.28Å; N409-K413 WeakPolarHBondContact O-CG 3.45Å; N409-K413 PolarHBondContact O-N 2.94Å; R410-K413 PolarHBondContact O-N 2.81Å; R410-K413 VanDerWaalsContact O-N 3.17Å; K413-L415 PolarHBondContact O-N 2.74Å; K413-L416 WeakPolarHBondContact O-CB 3.35Å; K413-L416 PolarHBondContact O-N 2.95Å; K413-Q417 WeakPolarHBondContact O-CG 3.26Å; K413-Q417 PolarHBondContact O-N 3.26Å
414	E	87	Confident	83.6	Confident	81 Å²	81	89.7 Å²	89.7	38%	0.379	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-40.5	174.7	-73.5	179.5	173.6	0	0	111.6	R410 Q417 L418	R410-E414 HydrophobicContact CG-CG 4.29Å; R410-E414 IonicContact CZ-OE1 3.49Å; R410-E414 IonicContact NE-OE1 2.62Å; R410-E414 PolarHBondContact NE-OE1 3.08Å; R410-E414 IonicContact NH2-OE1 3.89Å; R410-E414 PolarHBondContact NH2-OE1 3.3Å; R410-E414 VanDerWaalsContact NH2-OE1 3.15Å; R410-E414 WeakPolarHBondContact O-CB 3.27Å; R410-E414 WeakPolarHBondContact O-CG 3.32Å; R410-E414 PolarHBondContact O-N 2.81Å; E414-Q417 PolarHBondContact O-N 2.95Å; E414-L418 WeakPolarHBondContact O-CB 3.12Å; E414-L418 PolarHBondContact O-N 3.32Å
415	L	87.1	Confident	83.4	Confident	104 Å²	104	89.5 Å²	89.5	55%	0.545	42%	0.421	S	S	.	.	H	α-helix	trans	-63.3	-40.3	173.8	-93.9	159.5	0	0	0	112.7	V411 T412 K413 L418 K419	V411-L415 HydrophobicContact CG1-CD1 4Å; V411-L415 WeakPolarHBondContact O-CB 3.3Å; V411-L415 PolarHBondContact O-N 2.87Å; T412-L415 PolarHBondContact O-N 3.01Å; K413-L415 PolarHBondContact O-N 2.74Å; L415-L418 PolarHBondContact O-N 2.75Å; L415-K419 WeakPolarHBondContact O-CB 3.45Å; L415-K419 PolarHBondContact O-N 2.75Å
416	L	84.2	Confident	83.2	Confident	104 Å²	104	87.2 Å²	87.2	55%	0.545	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-42	175.2	-73.2	168.8	0	0	0	111.4	T412 K413 K419 S420	T412-L416 VanDerWaalsContact O-CG 3.29Å; T412-L416 WeakPolarHBondContact O-CG 3.37Å; T412-L416 PolarHBondContact O-N 3.49Å; K413-L416 WeakPolarHBondContact O-CB 3.35Å; K413-L416 PolarHBondContact O-N 2.95Å; L416-K419 WeakPolarHBondContact O-CB 3.12Å; L416-K419 PolarHBondContact O-N 3.21Å; L416-S420 PolarHBondContact O-N 3.08Å
417	Q	83.4	Confident	82.7	Confident	58 Å²	58	86 Å²	86	27%	0.271	41%	0.411	S	S	.	.	H	α-helix	trans	-61.6	-46.7	173.9	-73.7	-180	-4.3	0	0	111.1	K413 E414 K419 S420 Y421	K413-Q417 WeakPolarHBondContact O-CG 3.26Å; K413-Q417 PolarHBondContact O-N 3.26Å; E414-Q417 PolarHBondContact O-N 2.95Å; Q417-K419 VanDerWaalsContact C-N 3.33Å; Q417-K419 PolarHBondContact O-N 3.06Å; Q417-S420 PolarHBondContact O-N 3.2Å; Q417-S420 VanDerWaalsContact O-N 3.12Å; Q417-S420 PolarHBondContact O-OG 2.87Å; Q417-Y421 WeakPolarHBondContact O-CB 3.39Å; Q417-Y421 PolarHBondContact O-N 2.86Å
418	L	87	Confident	82	Confident	101 Å²	101	85.5 Å²	85.5	53%	0.529	41%	0.414	S	S	.	.	H	α-helix	trans	-58.6	-43.2	176.1	-179.3	65.3	0	0	0	111.9	E414 L415 S420 Y421 L422	E414-L418 WeakPolarHBondContact O-CB 3.12Å; E414-L418 PolarHBondContact O-N 3.32Å; L415-L418 PolarHBondContact O-N 2.75Å; L418-S420 VanDerWaalsContact C-N 3.35Å; L418-S420 PolarHBondContact O-N 2.99Å; L418-Y421 PolarHBondContact O-N 2.75Å; L418-L422 VanDerWaalsContact O-CB 3.31Å; L418-L422 WeakPolarHBondContact O-CB 3.35Å; L418-L422 PolarHBondContact O-N 2.97Å
419	K	84.8	Confident	81.4	Confident	127 Å²	127	87.1 Å²	87.1	55%	0.552	42%	0.423	S	S	*	.	H	α-helix	trans	-57.7	-47.3	174.5	179.5	-174.9	174.8	-174.6	0	111.1	L415 L416 Q417 L422 L423	L415-K419 WeakPolarHBondContact O-CB 3.45Å; L415-K419 PolarHBondContact O-N 2.75Å; L416-K419 WeakPolarHBondContact O-CB 3.12Å; L416-K419 PolarHBondContact O-N 3.21Å; Q417-K419 VanDerWaalsContact C-N 3.33Å; Q417-K419 PolarHBondContact O-N 3.06Å; K419-L422 PolarHBondContact O-N 3.4Å; K419-L423 HydrophobicContact CG-CD1 4.1Å; K419-L423 WeakPolarHBondContact O-CB 3.14Å; K419-L423 VanDerWaalsContact O-CG 3.31Å; K419-L423 WeakPolarHBondContact O-CG 3.22Å; K419-L423 PolarHBondContact O-N 2.71Å
420	S	80.9	Confident	80.7	Confident	58 Å²	58	91 Å²	91	41%	0.406	44%	0.438	S	S	.	.	H	α-helix	trans	-64.7	-40.8	179.2	74.9	0	0	0	0	112.5	L416 Q417 L418 R424	L416-S420 PolarHBondContact O-N 3.08Å; Q417-S420 PolarHBondContact O-N 3.2Å; Q417-S420 VanDerWaalsContact O-N 3.12Å; Q417-S420 PolarHBondContact O-OG 2.87Å; L418-S420 VanDerWaalsContact C-N 3.35Å; L418-S420 PolarHBondContact O-N 2.99Å; S420-R424 WeakPolarHBondContact O-CB 3.33Å; S420-R424 PolarHBondContact O-N 2.72Å
421	Y	81.3	Confident	79.6	Confident	152 Å²	152	86.6 Å²	86.6	60%	0.596	43%	0.43	S	S	*	.	H	α-helix	trans	-63.3	-46.9	176.7	176.1	-95.3	0	0	0	111.5	Q417 L418 R424 Y425	Q417-Y421 WeakPolarHBondContact O-CB 3.39Å; Q417-Y421 PolarHBondContact O-N 2.86Å; L418-Y421 PolarHBondContact O-N 2.75Å; Y421-R424 PolarHBondContact O-N 2.8Å; Y421-Y425 WeakPolarHBondContact O-CB 3.34Å; Y421-Y425 PolarHBondContact O-N 3.29Å
422	L	83.8	Confident	78.3	Confident	92 Å²	92	86.3 Å²	86.3	48%	0.482	43%	0.427	S	S	.	.	H	α-helix	trans	-65.5	-41.8	-179.3	-171.6	139.1	0	0	0	111.5	L418 K419 R424 Y425 L426	L418-L422 VanDerWaalsContact O-CB 3.31Å; L418-L422 WeakPolarHBondContact O-CB 3.35Å; L418-L422 PolarHBondContact O-N 2.97Å; K419-L422 PolarHBondContact O-N 3.4Å; L422-R424 VanDerWaalsContact C-N 3.34Å; L422-R424 PolarHBondContact O-N 2.78Å; L422-Y425 PolarHBondContact O-N 3.48Å; L422-L426 HydrophobicContact CD2-CD1 3.5Å; L422-L426 HydrophobicContact CD2-CG 4.23Å; L422-L426 HydrophobicContact CG-CD1 4.29Å; L422-L426 VanDerWaalsContact O-CB 3.3Å; L422-L426 WeakPolarHBondContact O-CB 3.32Å; L422-L426 WeakPolarHBondContact O-CG 3.43Å; L422-L426 PolarHBondContact O-N 3.23Å
423	L	79.6	Confident	77	Confident	45 Å²	45	85.1 Å²	85.1	24%	0.236	42%	0.424	C	S	.	.	H	α-helix	trans	-60.7	-42.1	173.3	-73.7	170.2	0	0	0	111.9	K419 N427 L446	K419-L423 HydrophobicContact CG-CD1 4.1Å; K419-L423 WeakPolarHBondContact O-CB 3.14Å; K419-L423 VanDerWaalsContact O-CG 3.31Å; K419-L423 WeakPolarHBondContact O-CG 3.22Å; K419-L423 PolarHBondContact O-N 2.71Å; L423-N427 WeakPolarHBondContact O-CB 3.35Å; L423-N427 PolarHBondContact O-N 2.76Å; L423-L446 HydrophobicContact CD1-CD2 4.48Å
424	R	74.1	Confident	76	Confident	140 Å²	140	87.5 Å²	87.5	53%	0.528	45%	0.448	S	S	.	.	H	α-helix	trans	-65.4	-49.6	176.2	-178	178.5	175	-179.9	-0.9	112.2	S420 Y421 L422 L426 N427 D428	S420-R424 WeakPolarHBondContact O-CB 3.33Å; S420-R424 PolarHBondContact O-N 2.72Å; Y421-R424 PolarHBondContact O-N 2.8Å; L422-R424 VanDerWaalsContact C-N 3.34Å; L422-R424 PolarHBondContact O-N 2.78Å; R424-L426 VanDerWaalsContact C-N 3.32Å; R424-L426 PolarHBondContact O-N 2.75Å; R424-N427 WeakPolarHBondContact O-CB 3.34Å; R424-N427 PolarHBondContact O-N 2.81Å; R424-N427 VanDerWaalsContact O-N 3.12Å; R424-D428 IonicContact NE-OD2 2.75Å; R424-D428 PolarHBondContact O-N 2.62Å
425	Y	77.4	Confident	74.7	Confident	124 Å²	124	91.3 Å²	91.3	49%	0.486	46%	0.463	S	S	.	.	H	α-helix	trans	-58.1	-45.2	178.3	176.2	-97	0	0	0	111.5	Y421 L422 N427 D428 V429	Y421-Y425 WeakPolarHBondContact O-CB 3.34Å; Y421-Y425 PolarHBondContact O-N 3.29Å; L422-Y425 PolarHBondContact O-N 3.48Å; Y425-N427 VanDerWaalsContact C-N 3.32Å; Y425-N427 PolarHBondContact O-N 2.73Å; Y425-D428 PolarHBondContact O-N 3.21Å; Y425-V429 HydrophobicContact CD1-CG2 4.45Å; Y425-V429 HydrophobicContact CD2-CG2 3.98Å; Y425-V429 HydrophobicContact CE1-CG2 4.11Å; Y425-V429 HydrophobicContact CE2-CG2 3.6Å; Y425-V429 HydrophobicContact CG-CG2 4.39Å; Y425-V429 WeakPolarHBondContact O-CB 3.29Å; Y425-V429 WeakPolarHBondContact O-CG2 3.37Å; Y425-V429 PolarHBondContact O-N 3.11Å
426	L	76.6	Confident	73.4	Confident	50 Å²	50	87.3 Å²	87.3	26%	0.262	44%	0.442	S	S	.	.	H	α-helix	trans	-64.8	-36.9	177	-72	177.8	0	0	0	112.1	L422 R424 F430 L432	L422-L426 HydrophobicContact CD2-CD1 3.5Å; L422-L426 HydrophobicContact CD2-CG 4.23Å; L422-L426 HydrophobicContact CG-CD1 4.29Å; L422-L426 VanDerWaalsContact O-CB 3.3Å; L422-L426 WeakPolarHBondContact O-CB 3.32Å; L422-L426 WeakPolarHBondContact O-CG 3.43Å; L422-L426 PolarHBondContact O-N 3.23Å; R424-L426 VanDerWaalsContact C-N 3.32Å; R424-L426 PolarHBondContact O-N 2.75Å; L426-F430 HydrophobicContact CD2-CD2 3.72Å; L426-F430 HydrophobicContact CD2-CE2 3.84Å; L426-F430 WeakPolarHBondContact O-CB 3.31Å; L426-F430 PolarHBondContact O-N 3.29Å; L426-L432 HydrophobicContact CB-CD1 3.54Å; L426-L432 HydrophobicContact CD1-CD1 4.17Å; L426-L432 HydrophobicContact CG-CD1 4.38Å
427	N	70.3	Confident	72.1	Confident	43 Å²	43	84.2 Å²	84.2	23%	0.23	44%	0.436	C	S	.	.	H	α-helix	trans	-65.2	-44.8	174.5	-169.2	47.7	0	0	0	112.4	L423 R424 Y425 G431 L432 A433 L447	L423-N427 WeakPolarHBondContact O-CB 3.35Å; L423-N427 PolarHBondContact O-N 2.76Å; R424-N427 WeakPolarHBondContact O-CB 3.34Å; R424-N427 PolarHBondContact O-N 2.81Å; R424-N427 VanDerWaalsContact O-N 3.12Å; Y425-N427 VanDerWaalsContact C-N 3.32Å; Y425-N427 PolarHBondContact O-N 2.73Å; N427-G431 WeakPolarHBondContact O-CA 3.41Å; N427-G431 PolarHBondContact O-N 2.59Å; N427-L432 HydrophobicContact CB-CB 4.49Å; N427-A433 WeakPolarHBondContact OD1-CB 3.5Å; N427-A433 PolarHBondContact OD1-N 2.85Å; N427-L447 HydrophobicContact CB-CD2 3.84Å
428	D	71.4	Confident	70.9	Confident	112 Å²	112	89.2 Å²	89.2	60%	0.599	46%	0.459	S	S	*	.	H	α-helix	trans	-71.5	-39.2	-177.6	-71.8	-13.5	0	0	0	112.4	R424 Y425	R424-D428 IonicContact NE-OD2 2.75Å; R424-D428 PolarHBondContact O-N 2.62Å; Y425-D428 PolarHBondContact O-N 3.21Å
429	V	72.7	Confident	69.7	Low	79 Å²	79	90.8 Å²	90.8	48%	0.479	46%	0.459	S	S	.	.	H	α-helix	trans	-83.1	-43.6	-177.6	175.9	0	0	0	0	112.6	Y425	Y425-V429 HydrophobicContact CD1-CG2 4.45Å; Y425-V429 HydrophobicContact CD2-CG2 3.98Å; Y425-V429 HydrophobicContact CE1-CG2 4.11Å; Y425-V429 HydrophobicContact CE2-CG2 3.6Å; Y425-V429 HydrophobicContact CG-CG2 4.39Å; Y425-V429 WeakPolarHBondContact O-CB 3.29Å; Y425-V429 WeakPolarHBondContact O-CG2 3.37Å; Y425-V429 PolarHBondContact O-N 3.11Å
430	F	67.9	Low	68.3	Low	142 Å²	142	90.9 Å²	90.9	62%	0.623	47%	0.466	S	S	*	.	H	α-helix	trans	-103.2	-3.5	-173.6	-65.2	-77.8	0	0	0	113.7	L426 L432	L426-F430 HydrophobicContact CD2-CD2 3.72Å; L426-F430 HydrophobicContact CD2-CE2 3.84Å; L426-F430 WeakPolarHBondContact O-CB 3.31Å; L426-F430 PolarHBondContact O-N 3.29Å; F430-L432 VanDerWaalsContact C-N 3.34Å; F430-L432 PolarHBondContact O-N 3.35Å
431	G	64.5	Low	67.6	Low	29 Å²	29	96.6 Å²	96.6	30%	0.299	48%	0.478	S	S	.	.			trans	62.5	41.6	-176.7	0	0	0	0	0	111.8	N427 A433 S434	N427-G431 WeakPolarHBondContact O-CA 3.41Å; N427-G431 PolarHBondContact O-N 2.59Å; G431-A433 PolarHBondContact O-N 2.88Å; G431-A433 VanDerWaalsContact O-N 3.08Å; G431-S434 WeakPolarHBondContact O-CA 3.31Å; G431-S434 WeakPolarHBondContact O-CB 3.26Å; G431-S434 PolarHBondContact O-N 3.15Å; G431-S434 PolarHBondContact O-OG 3.09Å
432	L	59.6	Low	66.5	Low	44 Å²	44	91.6 Å²	91.6	23%	0.23	46%	0.462	C	S	.	.	H	α-helix	trans	-59.1	-25.5	-171	-135.4	146.3	0	0	0	113.1	L426 N427 F430 S434 F435 L436	L426-L432 HydrophobicContact CB-CD1 3.54Å; L426-L432 HydrophobicContact CD1-CD1 4.17Å; L426-L432 HydrophobicContact CG-CD1 4.38Å; N427-L432 HydrophobicContact CB-CB 4.49Å; F430-L432 VanDerWaalsContact C-N 3.34Å; F430-L432 PolarHBondContact O-N 3.35Å; L432-S434 VanDerWaalsContact C-N 3.28Å; L432-S434 PolarHBondContact O-N 3.11Å; L432-F435 PolarHBondContact O-N 2.77Å; L432-F435 VanDerWaalsContact O-N 3.14Å; L432-L436 HydrophobicContact CD2-CD1 3.26Å; L432-L436 HydrophobicContact CD2-CG 3.55Å; L432-L436 WeakPolarHBondContact O-CB 3.5Å; L432-L436 PolarHBondContact O-N 2.86Å
433	A	59.6	Low	65.1	Low	48 Å²	48	88.1 Å²	88.1	40%	0.397	45%	0.446	S	S	.	.	H	α-helix	trans	-56.1	-38.1	167.9	0	0	0	0	0	113.4	N427 G431 F435 G437 L447	N427-A433 WeakPolarHBondContact OD1-CB 3.5Å; N427-A433 PolarHBondContact OD1-N 2.85Å; G431-A433 PolarHBondContact O-N 2.88Å; G431-A433 VanDerWaalsContact O-N 3.08Å; A433-F435 VanDerWaalsContact C-N 3.34Å; A433-G437 PolarHBondContact O-N 2.84Å; A433-L447 HydrophobicContact CB-CD1 3.77Å
434	S	62.4	Low	64	Low	105 Å²	105	92.8 Å²	92.8	73%	0.734	47%	0.471	S	S	*	.	H	α-helix	trans	-71.3	-30.4	176.8	71.8	0	0	0	0	112.4	G431 L432	G431-S434 WeakPolarHBondContact O-CA 3.31Å; G431-S434 WeakPolarHBondContact O-CB 3.26Å; G431-S434 PolarHBondContact O-N 3.15Å; G431-S434 PolarHBondContact O-OG 3.09Å; L432-S434 VanDerWaalsContact C-N 3.28Å; L432-S434 PolarHBondContact O-N 3.11Å
435	F	60.4	Low	63.3	Low	160 Å²	160	93.5 Å²	93.5	70%	0.702	48%	0.48	S	S	*	.	H	α-helix	trans	-82.2	-42	178.6	-171.7	-99.1	0	0	0	112.5	L432 A433 G437	L432-F435 PolarHBondContact O-N 2.77Å; L432-F435 VanDerWaalsContact O-N 3.14Å; A433-F435 VanDerWaalsContact C-N 3.34Å; F435-G437 VanDerWaalsContact C-N 3.34Å
436	L	59.2	Low	62.2	Low	20 Å²	20	90.2 Å²	90.2	11%	0.105	47%	0.47	C	S	.	.	H	α-helix	trans	-81	-11	177.5	-74.8	176.1	0	0	0	113.8	L432 Q438 Y439 L442 A443 L446	L432-L436 HydrophobicContact CD2-CD1 3.26Å; L432-L436 HydrophobicContact CD2-CG 3.55Å; L432-L436 WeakPolarHBondContact O-CB 3.5Å; L432-L436 PolarHBondContact O-N 2.86Å; L436-Q438 PolarHBondContact O-N 3.33Å; L436-Y439 CarbonylContact O-C 3.33Å; L436-Y439 WeakPolarHBondContact O-CA 3.28Å; L436-Y439 PolarHBondContact O-N 2.91Å; L436-L442 HydrophobicContact CD2-CD2 3.57Å; L436-A443 HydrophobicContact CB-CB 4.27Å; L436-L446 HydrophobicContact CD1-CD1 4.2Å
437	G	56.9	Low	61.2	Low	39 Å²	39	89.3 Å²	89.3	40%	0.402	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-13.2	175	0	0	0	0	0	114.1	A433 F435 Y439	A433-G437 PolarHBondContact O-N 2.84Å; F435-G437 VanDerWaalsContact C-N 3.34Å; G437-Y439 VanDerWaalsContact C-N 3.26Å
438	Q	59.6	Low	60.4	Low	164 Å²	164	92.7 Å²	92.7	77%	0.766	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-14.2	170	-163.3	164.5	14.9	0	0	113.3	L436	L436-Q438 PolarHBondContact O-N 3.33Å
439	Y	60.4	Low	59.3	Low	133 Å²	133	90.9 Å²	90.9	52%	0.522	49%	0.491	S	S	.	.	S	Bend	trans	-129.2	74.2	177.4	-56.2	-77.7	0	0	0	109.4	L436 G437 W441 L442 A443	L436-Y439 CarbonylContact O-C 3.33Å; L436-Y439 WeakPolarHBondContact O-CA 3.28Å; L436-Y439 PolarHBondContact O-N 2.91Å; G437-Y439 VanDerWaalsContact C-N 3.26Å; Y439-W441 PolarHBondContact O-N 2.84Å; Y439-L442 WeakPolarHBondContact O-CB 2.95Å; Y439-L442 PolarHBondContact O-N 2.85Å; Y439-A443 PolarHBondContact O-N 3.19Å
440	D	56.2	Low	57.9	Low	130 Å²	130	97.2 Å²	97.2	70%	0.695	51%	0.506	S	S	*	.	H	α-helix	trans	-45.6	-37.9	-177.4	-87.3	-20.2	0	0	0	113.9	L442 A443 L444	D440-L442 VanDerWaalsContact C-N 3.33Å; D440-L442 PolarHBondContact O-N 2.9Å; D440-A443 PolarHBondContact O-N 2.83Å; D440-L444 WeakPolarHBondContact O-CB 3.36Å; D440-L444 PolarHBondContact O-N 2.88Å; D440-L444 VanDerWaalsContact O-N 3.1Å
441	W	65.6	Low	56.8	Low	177 Å²	177	97.5 Å²	97.5	67%	0.67	51%	0.507	S	S	*	.	H	α-helix	trans	-65.3	-34.9	179.3	77.6	-88.3	0	0	0	113.3	Y439 H445	Y439-W441 PolarHBondContact O-N 2.84Å; W441-H445 PolarHBondContact O-ND1 2.83Å; W441-H445 VanDerWaalsContact O-ND1 3.12Å
442	L	57.6	Low	55.9	Low	47 Å²	47	100 Å²	100	25%	0.246	52%	0.518	C	S	.	.	H	α-helix	trans	-77.3	-42.2	179.7	-136.3	96	0	0	0	110.6	L436 Y439 D440 L444 H445 L446	L436-L442 HydrophobicContact CD2-CD2 3.57Å; Y439-L442 WeakPolarHBondContact O-CB 2.95Å; Y439-L442 PolarHBondContact O-N 2.85Å; D440-L442 VanDerWaalsContact C-N 3.33Å; D440-L442 PolarHBondContact O-N 2.9Å; L442-L444 VanDerWaalsContact C-N 3.33Å; L442-L444 PolarHBondContact O-N 3.11Å; L442-H445 PolarHBondContact O-N 3.42Å; L442-L446 HydrophobicContact CB-CD1 4.47Å; L442-L446 HydrophobicContact CD2-CD1 3.51Å; L442-L446 HydrophobicContact CG-CD1 3.69Å; L442-L446 WeakPolarHBondContact O-CB 3.34Å; L442-L446 WeakPolarHBondContact O-CG 3.41Å; L442-L446 PolarHBondContact O-N 3.01Å
443	A	55.9	Low	55.6	Low	19 Å²	19	105.5 Å²	105.5	16%	0.157	54%	0.542	C	S	.	.	H	α-helix	trans	-61.5	-41.3	178.2	0	0	0	0	0	111.6	L436 Y439 D440 H445 L447	L436-A443 HydrophobicContact CB-CB 4.27Å; Y439-A443 PolarHBondContact O-N 3.19Å; D440-A443 PolarHBondContact O-N 2.83Å; A443-H445 VanDerWaalsContact C-N 3.32Å; A443-H445 PolarHBondContact O-N 3.44Å; A443-L447 WeakPolarHBondContact O-CB 3.23Å; A443-L447 PolarHBondContact O-N 3.26Å; A443-L447 VanDerWaalsContact O-N 3.1Å
444	L	56.8	Low	56	Low	143 Å²	143	108 Å²	108	75%	0.749	54%	0.541	S	S	*	.	H	α-helix	trans	-67.8	-28.5	179.2	-161.6	115.2	0	0	0	113.6	D440 L442	D440-L444 WeakPolarHBondContact O-CB 3.36Å; D440-L444 PolarHBondContact O-N 2.88Å; D440-L444 VanDerWaalsContact O-N 3.1Å; L442-L444 VanDerWaalsContact C-N 3.33Å; L442-L444 PolarHBondContact O-N 3.11Å
445	H	57.5	Low	56.9	Low	155 Å²	155	105.7 Å²	105.7	72%	0.718	52%	0.52	S	S	*	.	H	α-helix	trans	-90.3	-27.2	179.8	-82.2	69.2	0	0	0	113.8	W441 L442 A443	W441-H445 PolarHBondContact O-ND1 2.83Å; W441-H445 VanDerWaalsContact O-ND1 3.12Å; L442-H445 PolarHBondContact O-N 3.42Å; A443-H445 VanDerWaalsContact C-N 3.32Å; A443-H445 PolarHBondContact O-N 3.44Å
446	L	55.6	Low	58.1	Low	55 Å²	55	100.8 Å²	100.8	29%	0.288	50%	0.5	S	S	.	.	H	α-helix	trans	-100.5	-23.8	-173	-68.6	169.3	0	0	0	113.9	L423 L436 L442	L423-L446 HydrophobicContact CD1-CD2 4.48Å; L436-L446 HydrophobicContact CD1-CD1 4.2Å; L442-L446 HydrophobicContact CB-CD1 4.47Å; L442-L446 HydrophobicContact CD2-CD1 3.51Å; L442-L446 HydrophobicContact CG-CD1 3.69Å; L442-L446 WeakPolarHBondContact O-CB 3.34Å; L442-L446 WeakPolarHBondContact O-CG 3.41Å; L442-L446 PolarHBondContact O-N 3.01Å
447	L	55.7	Low	59.4	Low	32 Å²	32	103.1 Å²	103.1	17%	0.168	51%	0.507	C	S	.	.	S	Bend	trans	-111.9	105	-178.2	-61.4	172.8	0	0	0	109.1	N427 A433 A443 A449	N427-L447 HydrophobicContact CB-CD2 3.84Å; A433-L447 HydrophobicContact CB-CD1 3.77Å; A443-L447 WeakPolarHBondContact O-CB 3.23Å; A443-L447 PolarHBondContact O-N 3.26Å; A443-L447 VanDerWaalsContact O-N 3.1Å; L447-A449 PolarHBondContact O-N 3.3Å
448	P	53.9	Low	60.8	Low	113 Å²	113	103.3 Å²	103.3	73%	0.734	50%	0.499	S	S	*	.			trans	-61.4	113.7	170.6	24.3	-29.8	0	0	0	107.8	W450	P448-W450 PolarHBondContact O-N 2.79Å
449	A	47.2	Very low	62.1	Low	75 Å²	75	102.9 Å²	102.9	62%	0.62	50%	0.497	S	S	*	.			trans	-55.8	111.8	177.9	0	0	0	0	0	109.1	L447 K451	L447-A449 PolarHBondContact O-N 3.3Å; A449-K451 PolarHBondContact O-N 3.36Å
450	W	42.9	Very low	63.3	Low	211 Å²	211	100.7 Å²	100.7	80%	0.799	49%	0.49	S	S	*	.			trans	-64.4	106.6	174.9	-152.4	76.4	0	0	0	107.5	P448 P452	P448-W450 PolarHBondContact O-N 2.79Å; W450-P452 HydrophobicContact CZ3-CB 4.24Å; W450-P452 WeakPolarHBondContact O-CD 3.22Å
451	K	45.9	Very low	64.7	Low	148 Å²	148	94.6 Å²	94.6	64%	0.643	46%	0.458	S	S	*	.			trans	-88.6	111.6	172.5	-74	-173.8	179.6	178.6	0	107.4	A449 H453 R454	A449-K451 PolarHBondContact O-N 3.36Å; K451-H453 PolarHBondContact O-N 2.95Å; K451-R454 HydrophobicContact CB-CG 4.27Å
452	P	44.7	Very low	65.8	Low	82 Å²	82	87 Å²	87	53%	0.532	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	129.1	169	27.3	-30.8	0	0	0	107.1	W450	W450-P452 HydrophobicContact CZ3-CB 4.24Å; W450-P452 WeakPolarHBondContact O-CD 3.22Å
453	H	54.3	Low	67.5	Low	160 Å²	160	86.7 Å²	86.7	74%	0.741	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	40.1	-178.3	-41	-47.2	0	0	0	117.6	K451	K451-H453 PolarHBondContact O-N 2.95Å
454	R	68.3	Low	69.2	Low	99 Å²	99	86.3 Å²	86.3	37%	0.374	42%	0.42	S	S	.	.			trans	-66.3	135.6	156.6	-65.1	-166.9	-180	-166.9	-3.2	110.1	E370 K451 E456 R463	E370-R454 VanDerWaalsContact CD-NH1 3.32Å; E370-R454 IonicContact OE1-CZ 3.78Å; E370-R454 IonicContact OE1-NH1 3.15Å; E370-R454 PolarHBondContact OE1-NH1 2.77Å; E370-R454 IonicContact OE1-NH2 3.46Å; E370-R454 IonicContact OE2-NH1 3.93Å; K451-R454 HydrophobicContact CB-CG 4.27Å; R454-E456 HydrophobicContact CB-CG 4.07Å; R454-E456 WeakPolarHBondContact CD-OE1 3.43Å; R454-E456 IonicContact NH1-OE1 3.47Å; R454-E456 PolarHBondContact NH1-OE1 3.46Å; R454-E456 PolarHBondContact O-N 2.59Å; R454-R463 PolarHBondContact O-NH1 2.88Å
455	L	81.3	Confident	70.9	Confident	57 Å²	57	79.5 Å²	79.5	30%	0.298	39%	0.385	S	S	.	.			trans	-81.8	74	174.9	-72.1	165.9	0	0	0	108.6	L366 P367 L486	L366-L455 HydrophobicContact CD2-CB 4.42Å; L366-L455 HydrophobicContact CD2-CD2 4.35Å; P367-L455 WeakPolarHBondContact CD-O 3.48Å; P367-L455 WeakPolarHBondContact CG-O 3.48Å; L455-L486 HydrophobicContact CD1-CD1 3.83Å; L455-L486 HydrophobicContact CD2-CD1 3.38Å; L455-L486 HydrophobicContact CG-CD1 4.25Å
456	E	85.7	Confident	72.7	Confident	57 Å²	57	72.3 Å²	72.3	27%	0.266	35%	0.352	S	S	.	.			trans	-121.2	151	179	-67.1	172.8	-156.7	0	0	109.1	L366 R454	L366-E456 VanDerWaalsContact CD1-O 3.29Å; L366-E456 WeakPolarHBondContact CD1-O 3.34Å; R454-E456 HydrophobicContact CB-CG 4.07Å; R454-E456 WeakPolarHBondContact CD-OE1 3.43Å; R454-E456 IonicContact NH1-OE1 3.47Å; R454-E456 PolarHBondContact NH1-OE1 3.46Å; R454-E456 PolarHBondContact O-N 2.59Å
457	R	86.1	Confident	74.5	Confident	70 Å²	70	69.7 Å²	69.7	26%	0.264	34%	0.338	S	S	.	.			trans	-62	135.3	173.9	178.4	172.8	175.2	156.9	1.3	109.8	D365 L366 P367	D365-R457 IonicContact OD2-NH1 2.85Å; D365-R457 PolarHBondContact OD2-NH1 3.05Å; L366-R457 HydrophobicContact CB-CB 4.15Å; P367-R457 WeakPolarHBondContact O-CB 3.45Å; P367-R457 PolarHBondContact O-N 2.92Å
458	D	86.7	Confident	76.3	Confident	43 Å²	43	68.1 Å²	68.1	23%	0.23	33%	0.33	C	S	.	.			trans	-80.4	156.2	169.2	65.4	-46.4	0	0	0	110.5	F460 G461 L462 R463	D458-F460 PolarHBondContact O-N 3.24Å; D458-F460 VanDerWaalsContact O-N 3.07Å; D458-G461 PolarHBondContact O-N 2.98Å; D458-G461 VanDerWaalsContact OD1-C 3.25Å; D458-G461 WeakPolarHBondContact OD1-CA 3.46Å; D458-G461 PolarHBondContact OD1-N 2.8Å; D458-L462 VanDerWaalsContact CG-N 3.25Å; D458-L462 PolarHBondContact OD1-N 3.16Å; D458-L462 WeakPolarHBondContact OD2-CA 3.49Å; D458-L462 VanDerWaalsContact OD2-CB 3.26Å; D458-L462 WeakPolarHBondContact OD2-CB 3.48Å; D458-L462 PolarHBondContact OD2-N 3.16Å; D458-R463 PolarHBondContact OD1-N 2.64Å
459	H	85.1	Confident	78	Confident	154 Å²	154	62.8 Å²	62.8	71%	0.713	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-34.9	-176.2	-171.9	65.6	0	0	0	113.5
460	F	86.4	Confident	79.9	Confident	88 Å²	88	59.2 Å²	59.2	39%	0.386	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.6	-179.6	-60.4	-57.3	0	0	0	113.9	D458 L462 G920 M921	D458-F460 PolarHBondContact O-N 3.24Å; D458-F460 VanDerWaalsContact O-N 3.07Å; F460-L462 HydrophobicContact CB-CD1 3.85Å; F460-L462 HydrophobicContact CB-CG 3.7Å; F460-L462 HydrophobicContact CD2-CD1 4.41Å; F460-L462 PolarHBondContact O-N 3.01Å; F460-G920 CarbonylContact O-C 3.58Å; F460-G920 WeakPolarHBondContact O-CA 3.49Å; F460-G920 PolarHBondContact O-N 3.08Å; F460-M921 HydrophobicContact CB-CG 3.93Å; F460-M921 HydrophobicContact CB-SD 3.9Å; F460-M921 HydrophobicContact CD1-CG 3.97Å; F460-M921 HydrophobicContact CD1-SD 3.92Å; F460-M921 HydrophobicContact CG-CG 4.26Å; F460-M921 HydrophobicContact CG-SD 3.94Å
461	G	86.1	Confident	81.8	Confident	2 Å²	2	50.1 Å²	50.1	2%	0.021	24%	0.236	C	C	.	.	S	Bend	trans	60.7	30.6	-176.8	0	0	0	0	0	114	D458 K464	D458-G461 PolarHBondContact O-N 2.98Å; D458-G461 VanDerWaalsContact OD1-C 3.25Å; D458-G461 WeakPolarHBondContact OD1-CA 3.46Å; D458-G461 PolarHBondContact OD1-N 2.8Å; G461-K464 WeakPolarHBondContact O-CE 3.21Å
462	L	89.1	Confident	83.4	Confident	16 Å²	16	45.9 Å²	45.9	8%	0.084	22%	0.218	C	C	.	.			trans	-85.1	-14.9	178.4	-57.9	171.2	0	0	0	112.6	D458 F460 M921 T924 R946	D458-L462 VanDerWaalsContact CG-N 3.25Å; D458-L462 PolarHBondContact OD1-N 3.16Å; D458-L462 WeakPolarHBondContact OD2-CA 3.49Å; D458-L462 VanDerWaalsContact OD2-CB 3.26Å; D458-L462 WeakPolarHBondContact OD2-CB 3.48Å; D458-L462 PolarHBondContact OD2-N 3.16Å; F460-L462 HydrophobicContact CB-CD1 3.85Å; F460-L462 HydrophobicContact CB-CG 3.7Å; F460-L462 HydrophobicContact CD2-CD1 4.41Å; F460-L462 PolarHBondContact O-N 3.01Å; L462-M921 HydrophobicContact CD2-SD 4.33Å; L462-T924 WeakPolarHBondContact CD2-OG1 3.47Å; L462-R946 PolarHBondContact O-NH2 2.89Å
463	R	91.8	Very high	85.2	Confident	41 Å²	41	42 Å²	42	16%	0.155	19%	0.194	C	C	.	.			trans	-104	122.6	174.2	-170.3	-175	-180	-152.7	6.8	109.5	L366 R454 D458 D479 A481	L366-R463 HydrophobicContact CD1-CB 4.17Å; L366-R463 HydrophobicContact CD1-CG 3.61Å; R454-R463 PolarHBondContact O-NH1 2.88Å; D458-R463 PolarHBondContact OD1-N 2.64Å; R463-D479 WeakPolarHBondContact CG-OD1 3.47Å; R463-D479 IonicContact CZ-OD1 2.91Å; R463-D479 IonicContact CZ-OD2 2.7Å; R463-D479 IonicContact NE-OD1 2.96Å; R463-D479 PolarHBondContact NE-OD1 3.38Å; R463-D479 IonicContact NE-OD2 2.62Å; R463-D479 PolarHBondContact NE-OD2 3.2Å; R463-D479 IonicContact NH2-OD1 3.06Å; R463-D479 IonicContact NH2-OD2 2.56Å; R463-D479 PolarHBondContact NH2-OD2 2.78Å; R463-A481 HydrophobicContact CG-CB 3.92Å
464	K	92.2	Very high	86.8	Confident	11 Å²	11	34.7 Å²	34.7	5%	0.048	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	160.7	-175.7	-66	-159.1	173.6	-166.2	0	111.3	L363 I364 D365 G461 S480 P918 M926	L363-K464 HydrophobicContact CB-CD 4.13Å; L363-K464 HydrophobicContact CD2-CD 4.49Å; I364-K464 WeakPolarHBondContact O-CB 3.34Å; D365-K464 WeakPolarHBondContact OD1-CE 3.35Å; D365-K464 IonicContact OD1-NZ 3.44Å; D365-K464 PolarHBondContact OD1-NZ 2.95Å; G461-K464 WeakPolarHBondContact O-CE 3.21Å; K464-S480 PolarHBondContact N-OG 2.74Å; K464-S480 VanDerWaalsContact O-CB 3.23Å; K464-S480 WeakPolarHBondContact O-CB 3.46Å; K464-S480 PolarHBondContact O-N 3Å; K464-S480 PolarHBondContact O-OG 3.15Å; K464-P918 WeakPolarHBondContact CE-O 3.29Å; K464-P918 PolarHBondContact NZ-O 2.83Å; K464-M926 HydrophobicContact CD-CE 3.41Å; K464-M926 VanDerWaalsContact CD-CE 3.41Å; K464-M926 HydrophobicContact CD-SD 3.92Å; K464-M926 HydrophobicContact CG-CE 4.12Å; K464-M926 HydrophobicContact CG-SD 4Å
465	M	93.5	Very high	88	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	111.7	172.1	-166.6	65.7	-144.1	0	0	109.2	I364 L366 V467 M478 L486 W487 P540 I541	I364-M465 HydrophobicContact CB-CB 4.32Å; I364-M465 PolarHBondContact N-O 3.33Å; I364-M465 WeakPolarHBondContact O-CB 3.49Å; I364-M465 PolarHBondContact O-N 2.98Å; L366-M465 HydrophobicContact CD2-CB 4.14Å; M465-V467 HydrophobicContact CG-CG2 4.38Å; M465-M478 WeakPolarHBondContact CE-O 3.42Å; M465-L486 HydrophobicContact CE-CB 4.45Å; M465-L486 HydrophobicContact CE-CD1 3.91Å; M465-L486 HydrophobicContact CE-CG 4.49Å; M465-L486 HydrophobicContact SD-CD1 3.69Å; M465-W487 HydrophobicContact CE-CZ2 4.45Å; M465-P540 WeakPolarHBondContact CG-O 3.38Å; M465-I541 HydrophobicContact CB-CD1 4.17Å; M465-I541 HydrophobicContact CG-CD1 4.28Å
466	L	93.8	Very high	88.5	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.021	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	112.2	173	-76.4	161.4	0	0	0	108.9	L363 G477 M478 F928 F944	L363-L466 HydrophobicContact CD1-CD2 3.77Å; L363-L466 HydrophobicContact CD2-CD2 3.93Å; L363-L466 HydrophobicContact CG-CD2 3.55Å; L363-L466 HydrophobicContact CG-CG 4.46Å; L466-G477 CarbonylContact O-C 3.55Å; L466-G477 WeakPolarHBondContact O-CA 3.43Å; L466-M478 HydrophobicContact CB-CB 4.07Å; L466-M478 WeakPolarHBondContact CB-O 3.47Å; L466-M478 PolarHBondContact N-O 2.94Å; L466-M478 PolarHBondContact O-N 2.69Å; L466-F928 HydrophobicContact CD1-CD2 4.2Å; L466-F928 HydrophobicContact CD1-CE2 4.32Å; L466-F928 HydrophobicContact CD2-CB 4.4Å; L466-F928 HydrophobicContact CD2-CD2 3.99Å; L466-F928 HydrophobicContact CD2-CE2 4.49Å; L466-F928 HydrophobicContact CD2-CG 4.15Å; L466-F944 HydrophobicContact CD1-CD2 4.35Å
467	V	94.7	Very high	88.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	114.4	172.7	-177.6	0	0	0	0	108.9	T361 E362 I364 M465 V475 F476 W487 L506 F538 P540	T361-V467 CarbonylContact C-O 3.48Å; T361-V467 WeakPolarHBondContact CA-O 3.28Å; E362-V467 PolarHBondContact N-O 3.26Å; E362-V467 PolarHBondContact O-N 3.38Å; I364-V467 HydrophobicContact CD1-CB 4.34Å; I364-V467 HydrophobicContact CD1-CG2 3.67Å; M465-V467 HydrophobicContact CG-CG2 4.38Å; V467-V475 HydrophobicContact CG1-CG1 3.78Å; V467-F476 CarbonylContact C-O 3.56Å; V467-F476 WeakPolarHBondContact CA-O 3.44Å; V467-W487 HydrophobicContact CG1-CH2 4.12Å; V467-W487 HydrophobicContact CG2-CH2 4.41Å; V467-W487 HydrophobicContact CG2-CZ2 4.1Å; V467-L506 HydrophobicContact CB-CD2 3.98Å; V467-L506 HydrophobicContact CG1-CD1 4.32Å; V467-L506 HydrophobicContact CG1-CD2 3.58Å; V467-F538 HydrophobicContact CG1-CE2 4.16Å; V467-F538 HydrophobicContact CG1-CZ 4.17Å; V467-P540 HydrophobicContact CG2-CB 3.99Å
468	V	92.2	Very high	89.3	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.3	-172.2	-176.2	0	0	0	0	109.7	L355 V358 T361 V475 F476 M478 F928	L355-V468 HydrophobicContact CD2-CG1 4.22Å; V358-V468 HydrophobicContact CB-CG1 4.12Å; V358-V468 HydrophobicContact CG1-CG1 3.58Å; V358-V468 HydrophobicContact CG2-CG1 3.53Å; T361-V468 HydrophobicContact CG2-CG1 4.19Å; T361-V468 HydrophobicContact CG2-CG2 4.27Å; V468-V475 CarbonylContact O-C 3.59Å; V468-V475 WeakPolarHBondContact O-CA 3.1Å; V468-F476 HydrophobicContact CB-CB 4.43Å; V468-F476 PolarHBondContact N-O 3.38Å; V468-F476 PolarHBondContact O-N 3.39Å; V468-M478 HydrophobicContact CG2-SD 4.36Å; V468-F928 HydrophobicContact CG2-CZ 4.47Å
469	T	90.7	Very high	89.6	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	147.7	174.1	77	0	0	0	0	110.7	V358 V359 S360 R474 V475 F504 L506	V358-T469 WeakPolarHBondContact CA-O 3.28Å; V359-T469 PolarHBondContact N-O 3.2Å; S360-T469 PolarHBondContact N-OG1 2.96Å; S360-T469 PolarHBondContact O-N 3.18Å; S360-T469 PolarHBondContact O-OG1 2.95Å; S360-T469 WeakPolarHBondContact OG-CG2 3.26Å; S360-T469 PolarHBondContact OG-OG1 2.83Å; T469-R474 WeakPolarHBondContact CA-O 3.48Å; T469-V475 HydrophobicContact CG2-CG2 4.34Å; T469-F504 HydrophobicContact CG2-CD1 3.58Å; T469-F504 HydrophobicContact CG2-CE1 3.53Å; T469-F504 HydrophobicContact CG2-CG 4.15Å; T469-F504 HydrophobicContact CG2-CZ 4.09Å; T469-F504 WeakPolarHBondContact OG1-CB 3.22Å; T469-F504 WeakPolarHBondContact OG1-CG 3.37Å; T469-L506 HydrophobicContact CG2-CB 4.23Å; T469-L506 HydrophobicContact CG2-CD2 4.11Å
470	T	87.3	Confident	89.9	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152.1	-175.6	63.2	0	0	0	0	111.9	S354 L355 S357 Q472 G473 R474 F476 F504	S354-T470 VanDerWaalsContact O-CG2 3.24Å; S354-T470 WeakPolarHBondContact O-CG2 3.37Å; L355-T470 HydrophobicContact CD2-CG2 4.38Å; S357-T470 CarbonylContact O-C 3.58Å; S357-T470 VanDerWaalsContact O-CA 3.26Å; S357-T470 WeakPolarHBondContact O-CA 3.44Å; T470-Q472 PolarHBondContact O-N 3.25Å; T470-G473 PolarHBondContact O-N 2.97Å; T470-R474 PolarHBondContact N-O 3.21Å; T470-R474 WeakPolarHBondContact OG1-CB 3.44Å; T470-R474 PolarHBondContact OG1-N 2.8Å; T470-R474 VanDerWaalsContact OG1-N 3.16Å; T470-R474 PolarHBondContact OG1-O 2.94Å; T470-F476 HydrophobicContact CG2-CD2 3.87Å; T470-F476 HydrophobicContact CG2-CE2 3.71Å; T470-F504 WeakPolarHBondContact O-CD2 3.36Å
471	A	82.7	Confident	90.1	Very high	21 Å²	21	12 Å²	12	17%	0.174	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-14.7	177.4	0	0	0	0	0	113.5	S357 V359 K502	S357-A471 PolarHBondContact O-N 2.9Å; V359-A471 HydrophobicContact CG2-CB 3.77Å; A471-K502 HydrophobicContact CB-CD 4.05Å; A471-K502 WeakPolarHBondContact O-CD 3.46Å; A471-K502 WeakPolarHBondContact O-CE 3.27Å; A471-K502 PolarHBondContact O-NZ 2.9Å
472	Q	79.7	Confident	90.2	Very high	58 Å²	58	15.9 Å²	15.9	27%	0.271	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-6.9	178.3	-56.8	-172.1	15.4	0	0	113.7	D335 C336 T470	D335-Q472 PolarHBondContact O-OE1 2.96Å; C336-Q472 PolarHBondContact SG-NE2 3.18Å; T470-Q472 PolarHBondContact O-N 3.25Å
473	G	82.6	Confident	90.2	Very high	2 Å²	2	17.1 Å²	17.1	2%	0.021	11%	0.111	C	C	.	.	S	Bend	trans	99.5	6.2	-178.8	0	0	0	0	0	114.5	T470 N490	T470-G473 PolarHBondContact O-N 2.97Å; G473-N490 PolarHBondContact O-OD1 3.07Å
474	R	87.2	Confident	90.1	Very high	5 Å²	5	21 Å²	21	2%	0.019	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.8	179.5	-68.9	-172.6	147.6	177.7	-12.9	112.9	D335 T469 T470 F476 N490	D335-R474 HydrophobicContact CB-CG 4.46Å; D335-R474 VanDerWaalsContact CB-NE 3.32Å; D335-R474 IonicContact OD1-CZ 3.73Å; D335-R474 VanDerWaalsContact OD1-CZ 3.23Å; D335-R474 IonicContact OD1-NH1 2.81Å; D335-R474 PolarHBondContact OD1-NH1 3.38Å; D335-R474 IonicContact OD1-NH2 2.85Å; D335-R474 PolarHBondContact OD1-NH2 2.64Å; D335-R474 IonicContact OD2-CZ 3.46Å; D335-R474 IonicContact OD2-NE 3.27Å; D335-R474 PolarHBondContact OD2-NE 3.28Å; D335-R474 IonicContact OD2-NH1 2.93Å; D335-R474 IonicContact OD2-NH2 3.3Å; D335-R474 PolarHBondContact OD2-NH2 3.02Å; T469-R474 WeakPolarHBondContact CA-O 3.48Å; T470-R474 PolarHBondContact N-O 3.21Å; T470-R474 WeakPolarHBondContact OG1-CB 3.44Å; T470-R474 PolarHBondContact OG1-N 2.8Å; T470-R474 VanDerWaalsContact OG1-N 3.16Å; T470-R474 PolarHBondContact OG1-O 2.94Å; R474-F476 HydrophobicContact CB-CD2 4.33Å; R474-F476 HydrophobicContact CB-CE2 3.61Å; R474-F476 HydrophobicContact CB-CZ 4.16Å; R474-N490 HydrophobicContact CG-CB 4.06Å
475	V	92.3	Very high	90	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.1	171	-172	0	0	0	0	108.8	V467 V468 T469 W487 H488 F489 F504 F538	V467-V475 HydrophobicContact CG1-CG1 3.78Å; V468-V475 CarbonylContact O-C 3.59Å; V468-V475 WeakPolarHBondContact O-CA 3.1Å; T469-V475 HydrophobicContact CG2-CG2 4.34Å; V475-W487 HydrophobicContact CB-CZ3 4.37Å; V475-W487 HydrophobicContact CG1-CH2 3.84Å; V475-W487 HydrophobicContact CG1-CZ3 3.83Å; V475-H488 VanDerWaalsContact O-CA 3.26Å; V475-H488 WeakPolarHBondContact O-CA 3.23Å; V475-F489 HydrophobicContact CB-CD1 4.34Å; V475-F489 HydrophobicContact CB-CE1 3.86Å; V475-F489 HydrophobicContact CB-CE2 4.33Å; V475-F489 HydrophobicContact CB-CZ 3.84Å; V475-F489 HydrophobicContact CG1-CE1 4.06Å; V475-F489 HydrophobicContact CG1-CZ 4.23Å; V475-F489 HydrophobicContact CG2-CE1 4.41Å; V475-F489 HydrophobicContact CG2-CE2 4.13Å; V475-F489 HydrophobicContact CG2-CZ 3.87Å; V475-F489 PolarHBondContact N-O 3.27Å; V475-F489 VanDerWaalsContact N-O 3.07Å; V475-F489 PolarHBondContact O-N 2.93Å; V475-F504 HydrophobicContact CG2-CE1 4.07Å; V475-F504 HydrophobicContact CG2-CZ 3.64Å; V475-F538 HydrophobicContact CG1-CE2 4.18Å; V475-F538 HydrophobicContact CG1-CZ 3.96Å
476	F	93.4	Very high	89.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	141.9	178.4	-69.3	-88.5	0	0	0	110	Y352 S354 L355 V467 V468 T470 R474 V485 H488	Y352-F476 AromaticContact CD1-CE1 3.71Å; Y352-F476 HydrophobicContact CD1-CE1 3.71Å; Y352-F476 HydrophobicContact CD1-CZ 4.18Å; Y352-F476 HydrophobicContact CE1-CE1 4.33Å; Y352-F476 AromaticContact CG-CE1 3.99Å; Y352-F476 HydrophobicContact CG-CE1 3.99Å; S354-F476 VanDerWaalsContact OG-CE2 3.29Å; S354-F476 WeakPolarHBondContact OG-CE2 3.3Å; S354-F476 WeakPolarHBondContact OG-CZ 3.32Å; L355-F476 HydrophobicContact CD2-CB 4.16Å; L355-F476 HydrophobicContact CD2-CD1 4.31Å; L355-F476 HydrophobicContact CD2-CD2 3.52Å; L355-F476 HydrophobicContact CD2-CE2 3.97Å; L355-F476 HydrophobicContact CD2-CG 3.72Å; L355-F476 HydrophobicContact CG-CD2 4.27Å; L355-F476 HydrophobicContact CG-CE2 4.28Å; L355-F476 HydrophobicContact CG-CG 4.44Å; L355-F476 HydrophobicContact CG-CZ 4.47Å; V467-F476 CarbonylContact C-O 3.56Å; V467-F476 WeakPolarHBondContact CA-O 3.44Å; V468-F476 HydrophobicContact CB-CB 4.43Å; V468-F476 PolarHBondContact N-O 3.38Å; V468-F476 PolarHBondContact O-N 3.39Å; T470-F476 HydrophobicContact CG2-CD2 3.87Å; T470-F476 HydrophobicContact CG2-CE2 3.71Å; R474-F476 HydrophobicContact CB-CD2 4.33Å; R474-F476 HydrophobicContact CB-CE2 3.61Å; R474-F476 HydrophobicContact CB-CZ 4.16Å; F476-V485 HydrophobicContact CD1-CG1 3.87Å; F476-H488 HydrophobicContact CD1-CB 3.52Å; F476-H488 HydrophobicContact CE1-CB 3.63Å; F476-H488 HydrophobicContact CG-CB 4.28Å; F476-H488 HydrophobicContact CZ-CB 4.47Å
477	G	94.5	Very high	89.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.5	163.3	0	0	0	0	0	110.4	L466 V485 L486 W487	L466-G477 CarbonylContact O-C 3.55Å; L466-G477 WeakPolarHBondContact O-CA 3.43Å; G477-V485 CarbonylContact O-C 3.52Å; G477-L486 PolarHBondContact O-N 3.36Å; G477-W487 VanDerWaalsContact CA-CE2 3.49Å; G477-W487 PolarHBondContact N-O 3.17Å; G477-W487 PolarHBondContact O-N 3.04Å
478	M	93.6	Very high	89.6	Confident	17 Å²	17	29.3 Å²	29.3	8%	0.084	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.9	176.2	-59.4	172.6	65.5	0	0	111.7	L355 M465 L466 V468 G483 Q484 V485 L942	L355-M478 HydrophobicContact CD1-SD 4.22Å; L355-M478 HydrophobicContact CD2-SD 4.32Å; M465-M478 WeakPolarHBondContact CE-O 3.42Å; L466-M478 HydrophobicContact CB-CB 4.07Å; L466-M478 WeakPolarHBondContact CB-O 3.47Å; L466-M478 PolarHBondContact N-O 2.94Å; L466-M478 PolarHBondContact O-N 2.69Å; V468-M478 HydrophobicContact CG2-SD 4.36Å; M478-G483 WeakPolarHBondContact CE-O 3.18Å; M478-Q484 VanDerWaalsContact CA-O 3.3Å; M478-Q484 WeakPolarHBondContact CA-O 3.41Å; M478-V485 HydrophobicContact CG-CG2 3.97Å; M478-V485 HydrophobicContact SD-CG2 4.47Å; M478-L942 HydrophobicContact CE-CD1 4.45Å
479	D	92.9	Very high	89.5	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.8	170.8	178.7	11.7	0	0	0	110	R463 A481 T482 G483 Q484 L486	R463-D479 WeakPolarHBondContact CG-OD1 3.47Å; R463-D479 IonicContact CZ-OD1 2.91Å; R463-D479 IonicContact CZ-OD2 2.7Å; R463-D479 IonicContact NE-OD1 2.96Å; R463-D479 PolarHBondContact NE-OD1 3.38Å; R463-D479 IonicContact NE-OD2 2.62Å; R463-D479 PolarHBondContact NE-OD2 3.2Å; R463-D479 IonicContact NH2-OD1 3.06Å; R463-D479 IonicContact NH2-OD2 2.56Å; R463-D479 PolarHBondContact NH2-OD2 2.78Å; D479-A481 VanDerWaalsContact C-N 3.26Å; D479-A481 PolarHBondContact O-N 3.16Å; D479-A481 PolarHBondContact OD1-N 3.44Å; D479-T482 WeakPolarHBondContact CB-OG1 3.39Å; D479-T482 PolarHBondContact O-N 3.37Å; D479-T482 PolarHBondContact OD2-OG1 3.07Å; D479-G483 VanDerWaalsContact O-CA 3.27Å; D479-G483 WeakPolarHBondContact O-CA 3.35Å; D479-G483 PolarHBondContact O-N 2.84Å; D479-Q484 PolarHBondContact N-O 3.48Å; D479-L486 HydrophobicContact CB-CD1 4.17Å; D479-L486 HydrophobicContact CB-CG 4.37Å
480	S	92.3	Very high	89.3	Confident	8 Å²	8	33.7 Å²	33.7	6%	0.056	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-25.7	-177.8	76.7	0	0	0	0	113.7	K464 F944	K464-S480 PolarHBondContact N-OG 2.74Å; K464-S480 VanDerWaalsContact O-CB 3.23Å; K464-S480 WeakPolarHBondContact O-CB 3.46Å; K464-S480 PolarHBondContact O-N 3Å; K464-S480 PolarHBondContact O-OG 3.15Å; S480-F944 WeakPolarHBondContact O-CD1 3.2Å; S480-F944 WeakPolarHBondContact O-CE1 3.3Å
481	A	89.5	Confident	89.2	Confident	60 Å²	60	34.7 Å²	34.7	50%	0.496	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-36.1	-179.3	0	0	0	0	0	113	R463 D479	R463-A481 HydrophobicContact CG-CB 3.92Å; D479-A481 VanDerWaalsContact C-N 3.26Å; D479-A481 PolarHBondContact O-N 3.16Å; D479-A481 PolarHBondContact OD1-N 3.44Å
482	T	88.4	Confident	89.1	Confident	84 Å²	84	37.9 Å²	37.9	52%	0.515	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-19.8	-174	59.1	0	0	0	0	113.5	D479 Q484	D479-T482 WeakPolarHBondContact CB-OG1 3.39Å; D479-T482 PolarHBondContact O-N 3.37Å; D479-T482 PolarHBondContact OD2-OG1 3.07Å; T482-Q484 PolarHBondContact O-N 2.77Å; T482-Q484 PolarHBondContact OG1-N 3.32Å
483	G	88.8	Confident	89	Confident	42 Å²	42	37.1 Å²	37.1	43%	0.433	23%	0.234	S	C	.	.			trans	70.3	6.6	-171.1	0	0	0	0	0	113.9	M478 D479	M478-G483 WeakPolarHBondContact CE-O 3.18Å; D479-G483 VanDerWaalsContact O-CA 3.27Å; D479-G483 WeakPolarHBondContact O-CA 3.35Å; D479-G483 PolarHBondContact O-N 2.84Å
484	Q	89.6	Confident	89.2	Confident	124 Å²	124	37.1 Å²	37.1	58%	0.579	23%	0.234	S	C	*	.			trans	-72.9	133.7	-179.7	-175.4	176.8	-3.1	0	0	110.7	M478 D479 T482 L486	M478-Q484 VanDerWaalsContact CA-O 3.3Å; M478-Q484 WeakPolarHBondContact CA-O 3.41Å; D479-Q484 PolarHBondContact N-O 3.48Å; T482-Q484 PolarHBondContact O-N 2.77Å; T482-Q484 PolarHBondContact OG1-N 3.32Å; Q484-L486 PolarHBondContact O-N 2.87Å
485	V	90.1	Very high	89	Confident	34 Å²	34	39.7 Å²	39.7	21%	0.206	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	114.2	168.6	-179.4	0	0	0	0	108.6	Y352 L355 F476 G477 M478	Y352-V485 HydrophobicContact CD2-CG2 4.28Å; Y352-V485 HydrophobicContact CE2-CB 4.5Å; Y352-V485 HydrophobicContact CE2-CG2 4.43Å; L355-V485 HydrophobicContact CD1-CG2 4.39Å; F476-V485 HydrophobicContact CD1-CG1 3.87Å; G477-V485 CarbonylContact O-C 3.52Å; M478-V485 HydrophobicContact CG-CG2 3.97Å; M478-V485 HydrophobicContact SD-CG2 4.47Å
486	L	91.2	Very high	88.6	Confident	62 Å²	62	39.8 Å²	39.8	33%	0.325	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-41.9	-179.5	-61.2	179.1	0	0	0	111.9	L455 M465 G477 D479 Q484	L455-L486 HydrophobicContact CD1-CD1 3.83Å; L455-L486 HydrophobicContact CD2-CD1 3.38Å; L455-L486 HydrophobicContact CG-CD1 4.25Å; M465-L486 HydrophobicContact CE-CB 4.45Å; M465-L486 HydrophobicContact CE-CD1 3.91Å; M465-L486 HydrophobicContact CE-CG 4.49Å; M465-L486 HydrophobicContact SD-CD1 3.69Å; G477-L486 PolarHBondContact O-N 3.36Å; D479-L486 HydrophobicContact CB-CD1 4.17Å; D479-L486 HydrophobicContact CB-CG 4.37Å; Q484-L486 PolarHBondContact O-N 2.87Å
487	W	91.9	Very high	87.8	Confident	25 Å²	25	40 Å²	40	10%	0.095	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158.4	179.2	57.6	-102.2	0	0	0	110	M465 V467 V475 G477 F489 F538 P540 I541 T542 G543	M465-W487 HydrophobicContact CE-CZ2 4.45Å; V467-W487 HydrophobicContact CG1-CH2 4.12Å; V467-W487 HydrophobicContact CG2-CH2 4.41Å; V467-W487 HydrophobicContact CG2-CZ2 4.1Å; V475-W487 HydrophobicContact CB-CZ3 4.37Å; V475-W487 HydrophobicContact CG1-CH2 3.84Å; V475-W487 HydrophobicContact CG1-CZ3 3.83Å; G477-W487 VanDerWaalsContact CA-CE2 3.49Å; G477-W487 PolarHBondContact N-O 3.17Å; G477-W487 PolarHBondContact O-N 3.04Å; W487-F489 AromaticContact CE3-CD1 3.92Å; W487-F489 HydrophobicContact CE3-CD1 3.92Å; W487-F489 HydrophobicContact CE3-CE1 4.3Å; W487-F489 HydrophobicContact CH2-CE1 4.22Å; W487-F489 AromaticContact CZ3-CD1 3.59Å; W487-F489 HydrophobicContact CZ3-CD1 3.59Å; W487-F489 AromaticContact CZ3-CE1 3.54Å; W487-F489 HydrophobicContact CZ3-CE1 3.54Å; W487-F538 HydrophobicContact CH2-CD2 4.22Å; W487-F538 AromaticContact CH2-CE2 3.84Å; W487-F538 HydrophobicContact CH2-CE2 3.84Å; W487-P540 WeakPolarHBondContact CZ2-O 3.42Å; W487-P540 PolarHBondContact NE1-O 3.49Å; W487-I541 VanDerWaalsContact CD1-O 3.24Å; W487-I541 PolarHBondContact NE1-O 2.89Å; W487-T542 VanDerWaalsContact CD1-C 3.48Å; W487-G543 VanDerWaalsContact CE3-CA 3.44Å
488	H	90.8	Very high	86.4	Confident	68 Å²	68	42.7 Å²	42.7	32%	0.315	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	147.3	171.8	62.2	68.1	0	0	0	109.7	Y352 V475 F476	Y352-H488 AromaticContact CE1-CD2 3.69Å; Y352-H488 AromaticContact CE1-NE2 3.64Å; Y352-H488 AromaticContact CZ-CD2 3.88Å; Y352-H488 AromaticContact CZ-NE2 3.89Å; Y352-H488 PolarHBondContact OH-NE2 3.12Å; V475-H488 VanDerWaalsContact O-CA 3.26Å; V475-H488 WeakPolarHBondContact O-CA 3.23Å; F476-H488 HydrophobicContact CD1-CB 3.52Å; F476-H488 HydrophobicContact CE1-CB 3.63Å; F476-H488 HydrophobicContact CG-CB 4.28Å; F476-H488 HydrophobicContact CZ-CB 4.47Å
489	F	89.8	Confident	84.3	Confident	27 Å²	27	48.3 Å²	48.3	12%	0.118	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	164.4	173	71.9	-93.5	0	0	0	111.9	V475 W487 V491 V536 F538 G543 V545	V475-F489 HydrophobicContact CB-CD1 4.34Å; V475-F489 HydrophobicContact CB-CE1 3.86Å; V475-F489 HydrophobicContact CB-CE2 4.33Å; V475-F489 HydrophobicContact CB-CZ 3.84Å; V475-F489 HydrophobicContact CG1-CE1 4.06Å; V475-F489 HydrophobicContact CG1-CZ 4.23Å; V475-F489 HydrophobicContact CG2-CE1 4.41Å; V475-F489 HydrophobicContact CG2-CE2 4.13Å; V475-F489 HydrophobicContact CG2-CZ 3.87Å; V475-F489 PolarHBondContact N-O 3.27Å; V475-F489 VanDerWaalsContact N-O 3.07Å; V475-F489 PolarHBondContact O-N 2.93Å; W487-F489 AromaticContact CE3-CD1 3.92Å; W487-F489 HydrophobicContact CE3-CD1 3.92Å; W487-F489 HydrophobicContact CE3-CE1 4.3Å; W487-F489 HydrophobicContact CH2-CE1 4.22Å; W487-F489 AromaticContact CZ3-CD1 3.59Å; W487-F489 HydrophobicContact CZ3-CD1 3.59Å; W487-F489 AromaticContact CZ3-CE1 3.54Å; W487-F489 HydrophobicContact CZ3-CE1 3.54Å; F489-V491 HydrophobicContact CD2-CG2 4.37Å; F489-V491 HydrophobicContact CE2-CG2 4.27Å; F489-V536 HydrophobicContact CE2-CG1 4.2Å; F489-F538 HydrophobicContact CE1-CB 4.08Å; F489-F538 HydrophobicContact CE1-CD1 4.27Å; F489-F538 AromaticContact CE1-CD2 3.71Å; F489-F538 HydrophobicContact CE1-CD2 3.71Å; F489-F538 HydrophobicContact CE1-CE2 4.16Å; F489-F538 AromaticContact CE1-CG 3.77Å; F489-F538 HydrophobicContact CE1-CG 3.77Å; F489-F538 HydrophobicContact CZ-CB 3.95Å; F489-F538 AromaticContact CZ-CD1 3.66Å; F489-F538 HydrophobicContact CZ-CD1 3.66Å; F489-F538 AromaticContact CZ-CD2 3.97Å; F489-F538 HydrophobicContact CZ-CD2 3.97Å; F489-F538 HydrophobicContact CZ-CE1 4.07Å; F489-F538 HydrophobicContact CZ-CE2 4.36Å; F489-F538 AromaticContact CZ-CG 3.59Å; F489-F538 HydrophobicContact CZ-CG 3.59Å; F489-F538 HydrophobicContact CZ-CZ 4.39Å; F489-G543 WeakPolarHBondContact CD1-O 3.36Å; F489-V545 HydrophobicContact CD1-CG2 4.44Å; F489-V545 HydrophobicContact CD2-CG2 3.75Å; F489-V545 HydrophobicContact CE2-CG2 3.87Å; F489-V545 HydrophobicContact CG-CG2 4.08Å; F489-V545 HydrophobicContact CZ-CG2 4.28Å
490	N	86.3	Confident	82.4	Confident	65 Å²	65	50.6 Å²	50.6	35%	0.348	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	139.6	174.7	-170.3	-0.5	0	0	0	108.5	G473 R474	G473-N490 PolarHBondContact O-OD1 3.07Å; R474-N490 HydrophobicContact CG-CB 4.06Å
491	V	85.3	Confident	80.6	Confident	21 Å²	21	56.4 Å²	56.4	13%	0.127	38%	0.378	C	S	.	.			trans	-95.3	112.2	174.3	-176.5	0	0	0	0	108.9	F489 T494 V536 V548	F489-V491 HydrophobicContact CD2-CG2 4.37Å; F489-V491 HydrophobicContact CE2-CG2 4.27Å; V491-T494 HydrophobicContact CB-CG2 4.08Å; V491-T494 HydrophobicContact CG1-CG2 3.71Å; V491-T494 PolarHBondContact O-N 3.12Å; V491-T494 PolarHBondContact O-OG1 2.97Å; V491-V536 HydrophobicContact CG2-CG1 3.96Å; V491-V536 HydrophobicContact CG2-CG2 3.85Å; V491-V548 HydrophobicContact CG1-CG1 4.4Å
492	A	80.3	Confident	79.2	Confident	87 Å²	87	58.2 Å²	58.2	72%	0.719	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	139.8	-176.4	0	0	0	0	0	112.1	T494	A492-T494 VanDerWaalsContact C-N 3.28Å; A492-T494 PolarHBondContact O-N 2.97Å
493	G	79.3	Confident	78.3	Confident	42 Å²	42	58.4 Å²	58.4	43%	0.433	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	8	178.7	0	0	0	0	0	115.6	K528	G493-K528 WeakPolarHBondContact O-CB 3.41Å; G493-K528 PolarHBondContact O-N 3.04Å
494	T	84.8	Confident	77.7	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.012	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	158	176.8	68.4	0	0	0	0	112.8	V491 A492 L525 K526 K528 V534	V491-T494 HydrophobicContact CB-CG2 4.08Å; V491-T494 HydrophobicContact CG1-CG2 3.71Å; V491-T494 PolarHBondContact O-N 3.12Å; V491-T494 PolarHBondContact O-OG1 2.97Å; A492-T494 VanDerWaalsContact C-N 3.28Å; A492-T494 PolarHBondContact O-N 2.97Å; T494-L525 HydrophobicContact CG2-CD1 4.42Å; T494-L525 WeakPolarHBondContact OG1-CD1 3.36Å; T494-K526 CarbonylContact C-O 3.54Å; T494-K526 VanDerWaalsContact CA-O 3.29Å; T494-K526 WeakPolarHBondContact CA-O 3.4Å; T494-K528 WeakPolarHBondContact O-CE 3.36Å; T494-K528 PolarHBondContact O-NZ 3.08Å; T494-V534 HydrophobicContact CG2-CB 4.49Å; T494-V534 HydrophobicContact CG2-CG1 4.46Å; T494-V534 HydrophobicContact CG2-CG2 4.32Å
495	E	84.6	Confident	77.3	Confident	59 Å²	59	50.8 Å²	50.8	28%	0.276	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152	171.8	61.1	-178.8	-169.2	0	0	110	K526 K528	E495-K526 HydrophobicContact CG-CB 4.06Å; E495-K526 HydrophobicContact CG-CD 4.44Å; E495-K526 HydrophobicContact CG-CG 4.23Å; E495-K526 PolarHBondContact N-O 2.94Å; E495-K526 PolarHBondContact O-N 2.98Å; E495-K526 WeakPolarHBondContact OE1-CD 3.25Å; E495-K526 WeakPolarHBondContact OE1-CE 3.48Å; E495-K526 IonicContact OE1-NZ 3.86Å; E495-K526 PolarHBondContact OE1-NZ 3Å; E495-K528 HydrophobicContact CB-CG 4.08Å; E495-K528 HydrophobicContact CG-CG 4.08Å
496	P	83.2	Confident	77.2	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.032	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	156	170.6	-23.9	35	0	0	0	112.2	K502 F504	P496-K502 HydrophobicContact CB-CB 4.05Å; P496-K502 HydrophobicContact CB-CD 4.47Å; P496-K502 HydrophobicContact CG-CD 4.3Å; P496-F504 HydrophobicContact CB-CB 4.26Å; P496-F504 HydrophobicContact CB-CD2 4Å; P496-F504 HydrophobicContact CB-CG 4.39Å; P496-F504 HydrophobicContact CG-CD2 3.68Å; P496-F504 HydrophobicContact CG-CE2 4.23Å
497	L	77.7	Confident	77.2	Confident	5 Å²	5	48 Å²	48	3%	0.026	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-68.5	155.2	178.3	-64.2	170.3	0	0	0	111.4	F503 P505 V524 K526 L555	L497-F503 WeakPolarHBondContact CA-O 3.39Å; L497-F503 HydrophobicContact CB-CD1 4.43Å; L497-F503 WeakPolarHBondContact CB-O 3.18Å; L497-F503 HydrophobicContact CD1-CD1 4.44Å; L497-F503 PolarHBondContact N-O 3.14Å; L497-F503 PolarHBondContact O-N 3.17Å; L497-P505 HydrophobicContact CD1-CG 3.99Å; L497-V524 HydrophobicContact CD1-CB 4.13Å; L497-V524 HydrophobicContact CD1-CG1 3.86Å; L497-K526 HydrophobicContact CD2-CB 4Å; L497-L555 HydrophobicContact CD2-CB 4.44Å
498	G	64.3	Low	77.1	Confident	55 Å²	55	48.8 Å²	48.8	57%	0.567	31%	0.313	S	S	*	.			trans	94.1	143.2	173.9	0	0	0	0	0	115.2
499	S	49.2	Very low	77.1	Confident	136 Å²	136	45.6 Å²	45.6	95%	0.951	30%	0.298	S	S	*	.	S	Bend	trans	-87.6	-11.5	176.8	-171.9	0	0	0	0	113.5
500	G	53.8	Low	77.1	Confident	52 Å²	52	45.4 Å²	45.4	54%	0.536	30%	0.297	S	S	.	.	S	Bend	trans	-114.6	-125.6	-175.2	0	0	0	0	0	111.9	K502	G500-K502 PolarHBondContact O-N 3.3Å
501	P	54.9	Low	77.2	Confident	129 Å²	129	44.7 Å²	44.7	84%	0.838	30%	0.295	S	S	*	.	S	Bend	trans	-56.7	112	168.5	26.4	-31.4	0	0	0	107	F503	P501-F503 PolarHBondContact O-N 2.79Å; P501-F503 VanDerWaalsContact O-N 3.17Å
502	K	59.6	Low	77.3	Confident	99 Å²	99	44.3 Å²	44.3	43%	0.43	29%	0.293	S	S	.	.			trans	-57.3	123.5	-175.9	-75.3	179	176.3	176.4	0	108.1	V359 A471 P496 G500	V359-K502 WeakPolarHBondContact CG1-O 3.21Å; A471-K502 HydrophobicContact CB-CD 4.05Å; A471-K502 WeakPolarHBondContact O-CD 3.46Å; A471-K502 WeakPolarHBondContact O-CE 3.27Å; A471-K502 PolarHBondContact O-NZ 2.9Å; P496-K502 HydrophobicContact CB-CB 4.05Å; P496-K502 HydrophobicContact CB-CD 4.47Å; P496-K502 HydrophobicContact CG-CD 4.3Å; G500-K502 PolarHBondContact O-N 3.3Å
503	F	68.2	Low	77.3	Confident	87 Å²	87	42.6 Å²	42.6	38%	0.382	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-96.6	120.5	176.2	-178.6	-115.5	0	0	0	108.1	L497 P501 P505 H557	L497-F503 WeakPolarHBondContact CA-O 3.39Å; L497-F503 HydrophobicContact CB-CD1 4.43Å; L497-F503 WeakPolarHBondContact CB-O 3.18Å; L497-F503 HydrophobicContact CD1-CD1 4.44Å; L497-F503 PolarHBondContact N-O 3.14Å; L497-F503 PolarHBondContact O-N 3.17Å; P501-F503 PolarHBondContact O-N 2.79Å; P501-F503 VanDerWaalsContact O-N 3.17Å; F503-P505 HydrophobicContact CD1-CB 4.31Å; F503-P505 HydrophobicContact CD1-CG 3.99Å; F503-P505 HydrophobicContact CE1-CB 3.54Å; F503-P505 HydrophobicContact CE1-CG 3.59Å; F503-P505 HydrophobicContact CZ-CB 3.69Å; F503-P505 HydrophobicContact CZ-CG 4.26Å; F503-P505 WeakPolarHBondContact O-CD 3.19Å; F503-H557 AromaticContact CE1-ND1 3.91Å
504	F	77.2	Confident	77.2	Confident	1 Å²	1	44 Å²	44	0%	0.004	27%	0.271	C	S	.	.			trans	-122	82.4	178.7	-161.2	-44.2	0	0	0	107.3	V359 S360 T469 T470 V475 P496 L506 T523 L525	V359-F504 HydrophobicContact CB-CB 4.06Å; V359-F504 HydrophobicContact CG1-CB 3.67Å; S360-F504 VanDerWaalsContact CB-O 3.31Å; S360-F504 WeakPolarHBondContact CB-O 3Å; S360-F504 PolarHBondContact OG-O 3.37Å; T469-F504 HydrophobicContact CG2-CD1 3.58Å; T469-F504 HydrophobicContact CG2-CE1 3.53Å; T469-F504 HydrophobicContact CG2-CG 4.15Å; T469-F504 HydrophobicContact CG2-CZ 4.09Å; T469-F504 WeakPolarHBondContact OG1-CB 3.22Å; T469-F504 WeakPolarHBondContact OG1-CG 3.37Å; T470-F504 WeakPolarHBondContact O-CD2 3.36Å; V475-F504 HydrophobicContact CG2-CE1 4.07Å; V475-F504 HydrophobicContact CG2-CZ 3.64Å; P496-F504 HydrophobicContact CB-CB 4.26Å; P496-F504 HydrophobicContact CB-CD2 4Å; P496-F504 HydrophobicContact CB-CG 4.39Å; P496-F504 HydrophobicContact CG-CD2 3.68Å; P496-F504 HydrophobicContact CG-CE2 4.23Å; F504-L506 PolarHBondContact O-N 2.92Å; F504-T523 VanDerWaalsContact CD1-OG1 3.23Å; F504-T523 WeakPolarHBondContact CD1-OG1 3.14Å; F504-T523 HydrophobicContact CE1-CG2 3.95Å; F504-T523 WeakPolarHBondContact CE1-OG1 3.32Å; F504-L525 HydrophobicContact CD1-CD2 4.2Å; F504-L525 HydrophobicContact CD2-CD2 4.26Å; F504-L525 HydrophobicContact CE1-CD2 3.85Å; F504-L525 HydrophobicContact CE2-CD2 3.89Å; F504-L525 HydrophobicContact CG-CD2 4.4Å; F504-L525 HydrophobicContact CZ-CD2 3.66Å
505	P	81.7	Confident	76.8	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.032	29%	0.292	C	S	.	.			trans	-66.2	131.3	-177.9	25.8	-30.8	0	0	0	110	L497 F503 F507 T523 V524	L497-P505 HydrophobicContact CD1-CG 3.99Å; F503-P505 HydrophobicContact CD1-CB 4.31Å; F503-P505 HydrophobicContact CD1-CG 3.99Å; F503-P505 HydrophobicContact CE1-CB 3.54Å; F503-P505 HydrophobicContact CE1-CG 3.59Å; F503-P505 HydrophobicContact CZ-CB 3.69Å; F503-P505 HydrophobicContact CZ-CG 4.26Å; F503-P505 WeakPolarHBondContact O-CD 3.19Å; P505-F507 HydrophobicContact CB-CD2 4.43Å; P505-F507 HydrophobicContact CB-CE1 4.34Å; P505-F507 HydrophobicContact CB-CE2 3.56Å; P505-F507 HydrophobicContact CB-CZ 3.48Å; P505-F507 VanDerWaalsContact CB-CZ 3.48Å; P505-F507 HydrophobicContact CG-CE2 4.18Å; P505-F507 HydrophobicContact CG-CZ 4.42Å; P505-T523 WeakPolarHBondContact O-CA 3.4Å; P505-T523 WeakPolarHBondContact O-CB 3.49Å; P505-T523 PolarHBondContact O-OG1 3.22Å; P505-V524 HydrophobicContact CG-CB 3.97Å
506	L	87.6	Confident	76.6	Confident	11 Å²	11	51.3 Å²	51.3	6%	0.058	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123.7	173.4	179.2	60.4	0	0	0	107.1	E362 V467 T469 F504 C521 F538	E362-L506 HydrophobicContact CB-CD2 3.67Å; E362-L506 HydrophobicContact CB-CG 4.34Å; E362-L506 HydrophobicContact CG-CB 4.24Å; E362-L506 HydrophobicContact CG-CD2 3.52Å; E362-L506 HydrophobicContact CG-CG 3.77Å; V467-L506 HydrophobicContact CB-CD2 3.98Å; V467-L506 HydrophobicContact CG1-CD1 4.32Å; V467-L506 HydrophobicContact CG1-CD2 3.58Å; T469-L506 HydrophobicContact CG2-CB 4.23Å; T469-L506 HydrophobicContact CG2-CD2 4.11Å; F504-L506 PolarHBondContact O-N 2.92Å; L506-C521 HydrophobicContact CD1-CB 4.28Å; L506-F538 HydrophobicContact CD1-CE1 4.07Å; L506-F538 HydrophobicContact CD1-CZ 3.64Å
507	F	90.3	Very high	76.7	Confident	28 Å²	28	55.5 Å²	55.5	12%	0.123	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.2	-179.2	-55.6	-68.4	0	0	0	110.2	P505 Q509 C521 A522 V524 A558 L572	P505-F507 HydrophobicContact CB-CD2 4.43Å; P505-F507 HydrophobicContact CB-CE1 4.34Å; P505-F507 HydrophobicContact CB-CE2 3.56Å; P505-F507 HydrophobicContact CB-CZ 3.48Å; P505-F507 VanDerWaalsContact CB-CZ 3.48Å; P505-F507 HydrophobicContact CG-CE2 4.18Å; P505-F507 HydrophobicContact CG-CZ 4.42Å; F507-Q509 PolarHBondContact O-N 2.9Å; F507-C521 CarbonylContact O-C 3.49Å; F507-C521 VanDerWaalsContact O-CA 3.29Å; F507-C521 WeakPolarHBondContact O-CA 3.46Å; F507-A522 PolarHBondContact N-O 3.11Å; F507-A522 PolarHBondContact O-N 2.89Å; F507-V524 HydrophobicContact CE2-CG2 4.15Å; F507-A558 HydrophobicContact CE2-CB 3.71Å; F507-A558 HydrophobicContact CZ-CB 3.94Å; F507-A558 VanDerWaalsContact CZ-O 3.25Å; F507-A558 WeakPolarHBondContact CZ-O 3.36Å; F507-L572 HydrophobicContact CB-CD1 4.34Å; F507-L572 HydrophobicContact CB-CD2 3.64Å; F507-L572 HydrophobicContact CD1-CD2 4.3Å; F507-L572 HydrophobicContact CD2-CD1 3.95Å; F507-L572 HydrophobicContact CD2-CD2 3.95Å; F507-L572 HydrophobicContact CG-CD1 4.42Å; F507-L572 HydrophobicContact CG-CD2 3.7Å
508	V	90.3	Very high	77.2	Confident	40 Å²	40	58.1 Å²	58.1	24%	0.242	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	106.6	170.2	-175.4	0	0	0	0	108.1	I364 T511	I364-V508 HydrophobicContact CD1-CG2 4.17Å; I364-V508 HydrophobicContact CG1-CG2 4.15Å; V508-T511 HydrophobicContact CG1-CG2 3.95Å
509	Q	89.9	Confident	78.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-41.9	179	-66.3	-168.6	-67.8	0	0	111.5	F507 Q520 A522 L569 T570 L572	F507-Q509 PolarHBondContact O-N 2.9Å; Q509-Q520 PolarHBondContact N-O 3.35Å; Q509-A522 HydrophobicContact CG-CB 3.92Å; Q509-L569 HydrophobicContact CB-CD2 4.09Å; Q509-T570 PolarHBondContact NE2-O 2.75Å; Q509-T570 WeakPolarHBondContact O-CB 3.47Å; Q509-T570 PolarHBondContact O-N 3.48Å; Q509-T570 PolarHBondContact O-OG1 2.94Å; Q509-L572 HydrophobicContact CG-CD1 4.37Å; Q509-L572 HydrophobicContact CG-CG 4.5Å
510	R	90.1	Very high	80.7	Confident	23 Å²	23	50.5 Å²	50.5	9%	0.087	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	129.5	177.9	178.9	171.2	66.8	-143.7	-4.6	110.2	Y514 A518 A519 Q520 Q567 L569	R510-Y514 HydrophobicContact CG-CD2 3.74Å; R510-Y514 HydrophobicContact CG-CE2 4.34Å; R510-A518 PolarHBondContact NE-O 3.44Å; R510-A518 PolarHBondContact NH2-O 2.88Å; R510-A519 WeakPolarHBondContact O-CA 3.34Å; R510-Q520 PolarHBondContact N-O 2.8Å; R510-Q520 PolarHBondContact O-N 3.17Å; R510-Q567 PolarHBondContact NH1-O 2.95Å; R510-Q567 VanDerWaalsContact NH1-O 3.15Å; R510-L569 HydrophobicContact CB-CD2 3.9Å
511	T	88.8	Confident	82.6	Confident	50 Å²	50	48 Å²	48	31%	0.307	26%	0.26	S	S	.	.			trans	-80	176	176.8	60.2	0	0	0	0	111.4	V508 A513	V508-T511 HydrophobicContact CG1-CG2 3.95Å; T511-A513 PolarHBondContact O-N 3.03Å
512	T	87.2	Confident	84.4	Confident	14 Å²	14	41.9 Å²	41.9	9%	0.086	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-0.4	175.5	50.7	0	0	0	0	114.3	D365 L366 Y514 A519 I541	D365-T512 WeakPolarHBondContact O-CG2 3.12Å; D365-T512 PolarHBondContact O-OG1 2.7Å; L366-T512 PolarHBondContact O-OG1 3.3Å; L366-T512 VanDerWaalsContact O-OG1 3.07Å; T512-Y514 PolarHBondContact O-N 3.07Å; T512-A519 HydrophobicContact CG2-CB 3.72Å; T512-I541 HydrophobicContact CG2-CD1 3.94Å; T512-I541 HydrophobicContact CG2-CG1 3.93Å
513	A	80.2	Confident	86	Confident	51 Å²	51	37.1 Å²	37.1	42%	0.421	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-31	-179.3	0	0	0	0	0	112.7	T511 Y515	T511-A513 PolarHBondContact O-N 3.03Å; A513-Y515 PolarHBondContact O-N 3.3Å
514	Y	77.8	Confident	87	Confident	70 Å²	70	33 Å²	33	28%	0.275	18%	0.182	S	C	.	.			trans	-81.5	92.3	176.3	-67.4	-80.5	0	0	0	111.2	R510 T512 S516 R517 E665	R510-Y514 HydrophobicContact CG-CD2 3.74Å; R510-Y514 HydrophobicContact CG-CE2 4.34Å; T512-Y514 PolarHBondContact O-N 3.07Å; Y514-S516 VanDerWaalsContact C-N 3.26Å; Y514-S516 PolarHBondContact O-N 3.04Å; Y514-S516 VanDerWaalsContact O-N 3.15Å; Y514-R517 CarbonylContact O-C 3.51Å; Y514-R517 PolarHBondContact O-N 2.54Å; Y514-E665 WeakPolarHBondContact CE2-OE1 3.43Å; Y514-E665 WeakPolarHBondContact CE2-OE2 3.43Å; Y514-E665 PolarHBondContact OH-OE1 2.71Å; Y514-E665 PolarHBondContact OH-OE2 2.97Å
515	Y	76	Confident	87.7	Confident	114 Å²	114	33.1 Å²	33.1	45%	0.447	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-42.4	179.9	168.8	-114.6	0	0	0	114	T373 E377 A513 R517	T373-Y515 HydrophobicContact CG2-CD2 3.18Å; T373-Y515 HydrophobicContact CG2-CE2 3.23Å; T373-Y515 HydrophobicContact CG2-CG 4.04Å; E377-Y515 HydrophobicContact CG-CD1 4.37Å; E377-Y515 HydrophobicContact CG-CE1 3.91Å; A513-Y515 PolarHBondContact O-N 3.3Å; Y515-R517 PolarHBondContact O-N 3.06Å
516	S	80.4	Confident	88.1	Confident	102 Å²	102	36.3 Å²	36.3	71%	0.713	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-9.7	-177	57.9	0	0	0	0	114.5	Y514	Y514-S516 VanDerWaalsContact C-N 3.26Å; Y514-S516 PolarHBondContact O-N 3.04Å; Y514-S516 VanDerWaalsContact O-N 3.15Å
517	R	85.2	Confident	88.2	Confident	93 Å²	93	39 Å²	39	35%	0.351	21%	0.205	S	C	.	.	S	Bend	trans	-136.9	129.6	-170.3	-62.7	172.2	179.8	-115.2	6.9	110.9	Y514 Y515 Q567	Y514-R517 CarbonylContact O-C 3.51Å; Y514-R517 PolarHBondContact O-N 2.54Å; Y515-R517 PolarHBondContact O-N 3.06Å; R517-Q567 PolarHBondContact NH1-O 2.73Å
518	A	89.1	Confident	87.9	Confident	59 Å²	59	43.9 Å²	43.9	49%	0.488	23%	0.226	S	C	.	.			trans	-59.5	145	179.4	0	0	0	0	0	112.5	R510	R510-A518 PolarHBondContact NE-O 3.44Å; R510-A518 PolarHBondContact NH2-O 2.88Å
519	A	92.2	Very high	87.7	Confident	8 Å²	8	46.9 Å²	46.9	7%	0.066	25%	0.249	C	C	.	.			trans	-61.8	150.2	171.2	0	0	0	0	0	110.9	R510 T512 P540 I541	R510-A519 WeakPolarHBondContact O-CA 3.34Å; T512-A519 HydrophobicContact CG2-CB 3.72Å; A519-P540 HydrophobicContact CB-CG 3.79Å; A519-I541 HydrophobicContact CB-CG1 4.48Å
520	Q	93.5	Very high	87.5	Confident	23 Å²	23	51 Å²	51	11%	0.107	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	128.2	-177.9	-176.4	171.1	-13.1	0	0	110.9	Q509 R510 L569	Q509-Q520 PolarHBondContact N-O 3.35Å; R510-Q520 PolarHBondContact N-O 2.8Å; R510-Q520 PolarHBondContact O-N 3.17Å; Q520-L569 HydrophobicContact CB-CD2 4.17Å; Q520-L569 HydrophobicContact CG-CD2 4.43Å
521	C	94	Very high	87.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	154.6	169.5	-76.1	0	0	0	0	109.9	I364 L506 F507 T537 F538 P540	I364-C521 WeakPolarHBondContact CD1-SG 3.32Å; L506-C521 HydrophobicContact CD1-CB 4.28Å; F507-C521 CarbonylContact O-C 3.49Å; F507-C521 VanDerWaalsContact O-CA 3.29Å; F507-C521 WeakPolarHBondContact O-CA 3.46Å; C521-T537 CarbonylContact O-C 3.58Å; C521-T537 VanDerWaalsContact O-CA 3.31Å; C521-T537 WeakPolarHBondContact O-CA 3.02Å; C521-F538 HydrophobicContact CB-CD1 4.43Å; C521-F538 HydrophobicContact CB-CD2 4.37Å; C521-F538 HydrophobicContact CB-CE1 3.94Å; C521-F538 HydrophobicContact CB-CE2 3.86Å; C521-F538 HydrophobicContact CB-CZ 3.65Å; C521-F538 PolarHBondContact N-O 3.01Å; C521-F538 PolarHBondContact O-N 3.13Å; C521-P540 HydrophobicContact CB-CB 4.4Å
522	A	93.4	Very high	87.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.7	174.4	0	0	0	0	0	109.4	F507 Q509 V536 T537 L572	F507-A522 PolarHBondContact N-O 3.11Å; F507-A522 PolarHBondContact O-N 2.89Å; Q509-A522 HydrophobicContact CG-CB 3.92Å; A522-V536 CarbonylContact C-O 3.59Å; A522-V536 WeakPolarHBondContact CA-O 3.39Å; A522-T537 HydrophobicContact CB-CG2 4.14Å; A522-L572 HydrophobicContact CB-CD1 3.51Å
523	T	92	Very high	87.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	154.1	168.6	-174.4	0	0	0	0	110.3	F504 P505 V536 F538	F504-T523 VanDerWaalsContact CD1-OG1 3.23Å; F504-T523 WeakPolarHBondContact CD1-OG1 3.14Å; F504-T523 HydrophobicContact CE1-CG2 3.95Å; F504-T523 WeakPolarHBondContact CE1-OG1 3.32Å; P505-T523 WeakPolarHBondContact O-CA 3.4Å; P505-T523 WeakPolarHBondContact O-CB 3.49Å; P505-T523 PolarHBondContact O-OG1 3.22Å; T523-V536 HydrophobicContact CG2-CB 3.83Å; T523-V536 HydrophobicContact CG2-CG1 4.45Å; T523-V536 PolarHBondContact N-O 2.93Å; T523-V536 PolarHBondContact O-N 2.78Å; T523-F538 HydrophobicContact CG2-CE1 4.08Å
524	V	90.7	Very high	88	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.1	-178.2	-172.5	0	0	0	0	108.9	L497 P505 F507 V534 V535 L555 A558 L574	L497-V524 HydrophobicContact CD1-CB 4.13Å; L497-V524 HydrophobicContact CD1-CG1 3.86Å; P505-V524 HydrophobicContact CG-CB 3.97Å; F507-V524 HydrophobicContact CE2-CG2 4.15Å; V524-V534 WeakPolarHBondContact CA-O 3.25Å; V524-V535 HydrophobicContact CG2-CG2 4.38Å; V524-L555 HydrophobicContact CG1-CD1 3.21Å; V524-A558 HydrophobicContact CB-CB 4.21Å; V524-A558 HydrophobicContact CG1-CB 4.4Å; V524-A558 HydrophobicContact CG2-CB 3.72Å; V524-L574 HydrophobicContact CG2-CD2 3.94Å
525	L	90.9	Very high	88.6	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	174.5	-176.5	-60.6	174.2	0	0	0	110	T494 F504 G533 V534 V536	T494-L525 HydrophobicContact CG2-CD1 4.42Å; T494-L525 WeakPolarHBondContact OG1-CD1 3.36Å; F504-L525 HydrophobicContact CD1-CD2 4.2Å; F504-L525 HydrophobicContact CD2-CD2 4.26Å; F504-L525 HydrophobicContact CE1-CD2 3.85Å; F504-L525 HydrophobicContact CE2-CD2 3.89Å; F504-L525 HydrophobicContact CG-CD2 4.4Å; F504-L525 HydrophobicContact CZ-CD2 3.66Å; L525-G533 CarbonylContact O-C 3.58Å; L525-G533 WeakPolarHBondContact O-CA 3.42Å; L525-V534 HydrophobicContact CB-CB 4.47Å; L525-V534 PolarHBondContact N-O 3.34Å; L525-V534 PolarHBondContact O-N 3.23Å; L525-V536 HydrophobicContact CD1-CG2 4.04Å
526	K	89.8	Confident	89.5	Confident	73 Å²	73	38.4 Å²	38.4	32%	0.317	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.2	172	172.5	177.1	168.8	-136.3	0	109.9	T494 E495 L497 G531 N532	T494-K526 CarbonylContact C-O 3.54Å; T494-K526 VanDerWaalsContact CA-O 3.29Å; T494-K526 WeakPolarHBondContact CA-O 3.4Å; E495-K526 HydrophobicContact CG-CB 4.06Å; E495-K526 HydrophobicContact CG-CD 4.44Å; E495-K526 HydrophobicContact CG-CG 4.23Å; E495-K526 PolarHBondContact N-O 2.94Å; E495-K526 PolarHBondContact O-N 2.98Å; E495-K526 WeakPolarHBondContact OE1-CD 3.25Å; E495-K526 WeakPolarHBondContact OE1-CE 3.48Å; E495-K526 IonicContact OE1-NZ 3.86Å; E495-K526 PolarHBondContact OE1-NZ 3Å; L497-K526 HydrophobicContact CD2-CB 4Å; K526-G531 VanDerWaalsContact CE-CA 3.44Å; K526-N532 CarbonylContact C-O 3.55Å; K526-N532 WeakPolarHBondContact CA-O 3.45Å
527	R	90.6	Very high	90.1	Very high	67 Å²	67	33.5 Å²	33.5	25%	0.253	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	129.6	174.9	-173.7	153.3	-75.3	-164.8	-1.4	110.5	S529 G531 N532 V534 D550	R527-S529 VanDerWaalsContact C-N 3.34Å; R527-S529 WeakPolarHBondContact CG-OG 3.47Å; R527-S529 PolarHBondContact O-N 2.92Å; R527-G531 WeakPolarHBondContact O-CA 3.04Å; R527-G531 PolarHBondContact O-N 3.44Å; R527-N532 PolarHBondContact N-O 2.91Å; R527-V534 HydrophobicContact CB-CG2 3.88Å; R527-D550 IonicContact CZ-OD1 3.33Å; R527-D550 IonicContact CZ-OD2 3.72Å; R527-D550 IonicContact NE-OD1 2.59Å; R527-D550 PolarHBondContact NE-OD1 2.89Å; R527-D550 VanDerWaalsContact NH1-CG 3.3Å; R527-D550 IonicContact NH1-OD1 2.62Å; R527-D550 PolarHBondContact NH1-OD1 2.9Å; R527-D550 IonicContact NH1-OD2 2.83Å; R527-D550 PolarHBondContact NH1-OD2 2.74Å; R527-D550 IonicContact NH2-OD1 3.77Å; R527-D550 PolarHBondContact NH2-OD1 3.28Å; R527-D550 IonicContact NH2-OD2 3.51Å; R527-D550 PolarHBondContact NH2-OD2 2.85Å
528	K	84.4	Confident	90.6	Very high	130 Å²	130	29.1 Å²	29.1	57%	0.565	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-34	-176.7	-72.4	176.9	174.2	164.3	0	113.5	G493 T494 E495	G493-K528 WeakPolarHBondContact O-CB 3.41Å; G493-K528 PolarHBondContact O-N 3.04Å; T494-K528 WeakPolarHBondContact O-CE 3.36Å; T494-K528 PolarHBondContact O-NZ 3.08Å; E495-K528 HydrophobicContact CB-CG 4.08Å; E495-K528 HydrophobicContact CG-CG 4.08Å
529	S	84.7	Confident	90.9	Very high	104 Å²	104	27.6 Å²	27.6	73%	0.727	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-44.7	-176	53.5	0	0	0	0	113.1	R527	R527-S529 VanDerWaalsContact C-N 3.34Å; R527-S529 WeakPolarHBondContact CG-OG 3.47Å; R527-S529 PolarHBondContact O-N 2.92Å
530	T	87.2	Confident	90.9	Very high	87 Å²	87	27.2 Å²	27.2	53%	0.534	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-26.1	-173.6	56	0	0	0	0	113.4	N532	T530-N532 VanDerWaalsContact C-N 3.27Å; T530-N532 PolarHBondContact OG1-N 3.24Å
531	G	85.8	Confident	90.9	Very high	17 Å²	17	27.1 Å²	27.1	18%	0.175	15%	0.145	C	C	.	.			trans	78.6	6.6	-169.6	0	0	0	0	0	114.8	K526 R527	K526-G531 VanDerWaalsContact CE-CA 3.44Å; R527-G531 WeakPolarHBondContact O-CA 3.04Å; R527-G531 PolarHBondContact O-N 3.44Å
532	N	89.5	Confident	90.7	Very high	39 Å²	39	30.2 Å²	30.2	21%	0.209	16%	0.164	C	C	.	.			trans	-74	156.8	177.7	-66.1	0.6	0	0	0	112	K526 R527 T530 L551 E552	K526-N532 CarbonylContact C-O 3.55Å; K526-N532 WeakPolarHBondContact CA-O 3.45Å; R527-N532 PolarHBondContact N-O 2.91Å; T530-N532 VanDerWaalsContact C-N 3.27Å; T530-N532 PolarHBondContact OG1-N 3.24Å; N532-L551 WeakPolarHBondContact CB-O 3.46Å; N532-L551 PolarHBondContact ND2-O 2.83Å; N532-E552 PolarHBondContact ND2-O 2.81Å
533	G	88.5	Confident	90.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	148.5	172.8	0	0	0	0	0	112.4	L525 L551 F553	L525-G533 CarbonylContact O-C 3.58Å; L525-G533 WeakPolarHBondContact O-CA 3.42Å; G533-L551 VanDerWaalsContact O-CB 3.25Å; G533-L551 WeakPolarHBondContact O-CB 3.25Å; G533-L551 PolarHBondContact O-N 2.82Å; G533-F553 PolarHBondContact N-O 2.85Å
534	V	91.6	Very high	90.6	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	124.1	174.4	-177.4	0	0	0	0	107.5	T494 V524 L525 R527 V536 V548 I549 D550	T494-V534 HydrophobicContact CG2-CB 4.49Å; T494-V534 HydrophobicContact CG2-CG1 4.46Å; T494-V534 HydrophobicContact CG2-CG2 4.32Å; V524-V534 WeakPolarHBondContact CA-O 3.25Å; L525-V534 HydrophobicContact CB-CB 4.47Å; L525-V534 PolarHBondContact N-O 3.34Å; L525-V534 PolarHBondContact O-N 3.23Å; R527-V534 HydrophobicContact CB-CG2 3.88Å; V534-V536 HydrophobicContact CG1-CG2 4.05Å; V534-V548 HydrophobicContact CG1-CG1 3.65Å; V534-I549 CarbonylContact C-O 3.59Å; V534-I549 WeakPolarHBondContact CA-O 3.38Å; V534-D550 WeakPolarHBondContact CG1-OD1 3.35Å; V534-D550 WeakPolarHBondContact CG2-OD1 3.29Å
535	V	92.1	Very high	90.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.1	173.9	-176.8	0	0	0	0	108	V524 I549 L551 L574 F585	V524-V535 HydrophobicContact CG2-CG2 4.38Å; V535-I549 HydrophobicContact CB-CB 4.28Å; V535-I549 PolarHBondContact N-O 3.42Å; V535-I549 PolarHBondContact O-N 3.49Å; V535-L551 HydrophobicContact CG2-CD1 4.21Å; V535-L574 HydrophobicContact CG2-CD1 3.67Å; V535-L574 HydrophobicContact CG2-CD2 4.26Å; V535-F585 HydrophobicContact CG1-CD1 4.13Å; V535-F585 HydrophobicContact CG1-CE1 4.03Å; V535-F585 HydrophobicContact CG1-CZ 4.49Å
536	V	93.3	Very high	90.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.8	179.4	-179.2	0	0	0	0	107.7	F489 V491 A522 T523 L525 V534 V545 V548	F489-V536 HydrophobicContact CE2-CG1 4.2Å; V491-V536 HydrophobicContact CG2-CG1 3.96Å; V491-V536 HydrophobicContact CG2-CG2 3.85Å; A522-V536 CarbonylContact C-O 3.59Å; A522-V536 WeakPolarHBondContact CA-O 3.39Å; T523-V536 HydrophobicContact CG2-CB 3.83Å; T523-V536 HydrophobicContact CG2-CG1 4.45Å; T523-V536 PolarHBondContact N-O 2.93Å; T523-V536 PolarHBondContact O-N 2.78Å; L525-V536 HydrophobicContact CD1-CG2 4.04Å; V534-V536 HydrophobicContact CG1-CG2 4.05Å; V536-V545 HydrophobicContact CG1-CG1 3.97Å; V536-V548 HydrophobicContact CG1-CG2 4.35Å; V536-V548 HydrophobicContact CG2-CG1 4.33Å; V536-V548 HydrophobicContact CG2-CG2 4.48Å
537	T	94.2	Very high	90.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.9	172.1	62.3	0	0	0	0	110.1	C521 A522 V546 E547 F585	C521-T537 CarbonylContact O-C 3.58Å; C521-T537 VanDerWaalsContact O-CA 3.31Å; C521-T537 WeakPolarHBondContact O-CA 3.02Å; A522-T537 HydrophobicContact CB-CG2 4.14Å; T537-V546 PolarHBondContact O-N 2.82Å; T537-E547 PolarHBondContact N-O 2.98Å; T537-E547 PolarHBondContact O-N 2.95Å; T537-E547 WeakPolarHBondContact OG1-CB 3.45Å; T537-E547 PolarHBondContact OG1-N 3.34Å; T537-E547 VanDerWaalsContact OG1-N 3.11Å; T537-E547 PolarHBondContact OG1-O 3.41Å; T537-F585 HydrophobicContact CG2-CE1 3.56Å; T537-F585 HydrophobicContact CG2-CZ 3.59Å
538	F	94.9	Very high	90.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.6	-176.1	63.9	-85	0	0	0	111.1	V467 V475 W487 F489 L506 C521 T523 P540 D544	V467-F538 HydrophobicContact CG1-CE2 4.16Å; V467-F538 HydrophobicContact CG1-CZ 4.17Å; V475-F538 HydrophobicContact CG1-CE2 4.18Å; V475-F538 HydrophobicContact CG1-CZ 3.96Å; W487-F538 HydrophobicContact CH2-CD2 4.22Å; W487-F538 AromaticContact CH2-CE2 3.84Å; W487-F538 HydrophobicContact CH2-CE2 3.84Å; F489-F538 HydrophobicContact CE1-CB 4.08Å; F489-F538 HydrophobicContact CE1-CD1 4.27Å; F489-F538 AromaticContact CE1-CD2 3.71Å; F489-F538 HydrophobicContact CE1-CD2 3.71Å; F489-F538 HydrophobicContact CE1-CE2 4.16Å; F489-F538 AromaticContact CE1-CG 3.77Å; F489-F538 HydrophobicContact CE1-CG 3.77Å; F489-F538 HydrophobicContact CZ-CB 3.95Å; F489-F538 AromaticContact CZ-CD1 3.66Å; F489-F538 HydrophobicContact CZ-CD1 3.66Å; F489-F538 AromaticContact CZ-CD2 3.97Å; F489-F538 HydrophobicContact CZ-CD2 3.97Å; F489-F538 HydrophobicContact CZ-CE1 4.07Å; F489-F538 HydrophobicContact CZ-CE2 4.36Å; F489-F538 AromaticContact CZ-CG 3.59Å; F489-F538 HydrophobicContact CZ-CG 3.59Å; F489-F538 HydrophobicContact CZ-CZ 4.39Å; L506-F538 HydrophobicContact CD1-CE1 4.07Å; L506-F538 HydrophobicContact CD1-CZ 3.64Å; C521-F538 HydrophobicContact CB-CD1 4.43Å; C521-F538 HydrophobicContact CB-CD2 4.37Å; C521-F538 HydrophobicContact CB-CE1 3.94Å; C521-F538 HydrophobicContact CB-CE2 3.86Å; C521-F538 HydrophobicContact CB-CZ 3.65Å; C521-F538 PolarHBondContact N-O 3.01Å; C521-F538 PolarHBondContact O-N 3.13Å; T523-F538 HydrophobicContact CG2-CE1 4.08Å; F538-P540 WeakPolarHBondContact O-CD 3.46Å; F538-D544 CarbonylContact C-O 3.6Å; F538-D544 VanDerWaalsContact CA-O 3.25Å; F538-D544 WeakPolarHBondContact CA-O 2.99Å; F538-D544 WeakPolarHBondContact CB-O 3.39Å
539	N	94.7	Very high	91	Very high	27 Å²	27	36.2 Å²	36.2	14%	0.144	22%	0.218	C	C	.	.			trans	-81.3	117.8	171.9	-176.3	-20.6	0	0	0	109.2	I541 T542 G543 D544	N539-I541 PolarHBondContact O-N 3.15Å; N539-I541 PolarHBondContact OD1-N 2.62Å; N539-T542 WeakPolarHBondContact CB-OG1 3.42Å; N539-T542 PolarHBondContact ND2-OG1 3.49Å; N539-G543 VanDerWaalsContact O-CA 3.3Å; N539-G543 WeakPolarHBondContact O-CA 3.36Å; N539-G543 PolarHBondContact O-N 2.56Å; N539-D544 PolarHBondContact N-O 3.2Å
540	P	93.6	Very high	91.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-14.6	-178.3	28.2	-35	0	0	0	114.4	I364 M465 V467 W487 A519 C521 F538	I364-P540 HydrophobicContact CD1-CB 3.32Å; I364-P540 HydrophobicContact CD1-CG 3.83Å; I364-P540 HydrophobicContact CG2-CG 4.26Å; M465-P540 WeakPolarHBondContact CG-O 3.38Å; V467-P540 HydrophobicContact CG2-CB 3.99Å; W487-P540 WeakPolarHBondContact CZ2-O 3.42Å; W487-P540 PolarHBondContact NE1-O 3.49Å; A519-P540 HydrophobicContact CB-CG 3.79Å; C521-P540 HydrophobicContact CB-CB 4.4Å; F538-P540 WeakPolarHBondContact O-CD 3.46Å
541	I	92.3	Very high	91.2	Very high	21 Å²	21	31.1 Å²	31.1	11%	0.108	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-44.7	-179.8	-54.8	-56.2	0	0	0	110.9	I364 P367 M465 W487 T512 A519 N539	I364-I541 HydrophobicContact CG2-CD1 4.4Å; P367-I541 HydrophobicContact CG-CG2 4.44Å; M465-I541 HydrophobicContact CB-CD1 4.17Å; M465-I541 HydrophobicContact CG-CD1 4.28Å; W487-I541 VanDerWaalsContact CD1-O 3.24Å; W487-I541 PolarHBondContact NE1-O 2.89Å; T512-I541 HydrophobicContact CG2-CD1 3.94Å; T512-I541 HydrophobicContact CG2-CG1 3.93Å; A519-I541 HydrophobicContact CB-CG1 4.48Å; N539-I541 PolarHBondContact O-N 3.15Å; N539-I541 PolarHBondContact OD1-N 2.62Å
542	T	90.3	Very high	91.2	Very high	65 Å²	65	38 Å²	38	40%	0.399	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-24.4	-177.4	60.4	0	0	0	0	113.7	W487 N539 D544	W487-T542 VanDerWaalsContact CD1-C 3.48Å; N539-T542 WeakPolarHBondContact CB-OG1 3.42Å; N539-T542 PolarHBondContact ND2-OG1 3.49Å; T542-D544 VanDerWaalsContact C-N 3.29Å; T542-D544 WeakPolarHBondContact CB-OD2 3.26Å; T542-D544 VanDerWaalsContact OG1-CG 3.25Å; T542-D544 PolarHBondContact OG1-N 3.29Å; T542-D544 PolarHBondContact OG1-OD2 3.32Å
543	G	90.3	Very high	91.1	Very high	10 Å²	10	37.8 Å²	37.8	10%	0.103	21%	0.205	C	C	.	.			trans	82.6	4.3	-172.6	0	0	0	0	0	114.1	W487 F489 N539 V545	W487-G543 VanDerWaalsContact CE3-CA 3.44Å; F489-G543 WeakPolarHBondContact CD1-O 3.36Å; N539-G543 VanDerWaalsContact O-CA 3.3Å; N539-G543 WeakPolarHBondContact O-CA 3.36Å; N539-G543 PolarHBondContact O-N 2.56Å; G543-V545 PolarHBondContact O-N 3.41Å
544	D	92.5	Very high	91	Very high	104 Å²	104	40 Å²	40	56%	0.556	22%	0.219	S	C	*	.			trans	-70	126.4	179.8	-59.5	-43.5	0	0	0	110.4	F538 N539 T542 V546	F538-D544 CarbonylContact C-O 3.6Å; F538-D544 VanDerWaalsContact CA-O 3.25Å; F538-D544 WeakPolarHBondContact CA-O 2.99Å; F538-D544 WeakPolarHBondContact CB-O 3.39Å; N539-D544 PolarHBondContact N-O 3.2Å; T542-D544 VanDerWaalsContact C-N 3.29Å; T542-D544 WeakPolarHBondContact CB-OD2 3.26Å; T542-D544 VanDerWaalsContact OG1-CG 3.25Å; T542-D544 PolarHBondContact OG1-N 3.29Å; T542-D544 PolarHBondContact OG1-OD2 3.32Å; D544-V546 PolarHBondContact O-N 3.06Å
545	V	92.3	Very high	90.6	Very high	62 Å²	62	40.8 Å²	40.8	38%	0.376	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.3	175.5	-178.1	0	0	0	0	108.6	F489 V536 G543 V548	F489-V545 HydrophobicContact CD1-CG2 4.44Å; F489-V545 HydrophobicContact CD2-CG2 3.75Å; F489-V545 HydrophobicContact CE2-CG2 3.87Å; F489-V545 HydrophobicContact CG-CG2 4.08Å; F489-V545 HydrophobicContact CZ-CG2 4.28Å; V536-V545 HydrophobicContact CG1-CG1 3.97Å; G543-V545 PolarHBondContact O-N 3.41Å; V545-V548 HydrophobicContact CG1-CG2 3.6Å
546	V	90.6	Very high	90	Very high	92 Å²	92	43.2 Å²	43.2	56%	0.558	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	-51.9	-176.9	177.2	0	0	0	0	110.2	T537 D544	T537-V546 PolarHBondContact O-N 2.82Å; D544-V546 PolarHBondContact O-N 3.06Å
547	E	90.8	Very high	89.4	Confident	71 Å²	71	47 Å²	47	33%	0.332	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	137.6	-177.1	-162.8	-179.9	-172.6	0	0	110.5	T537 I549 Q631	T537-E547 PolarHBondContact N-O 2.98Å; T537-E547 PolarHBondContact O-N 2.95Å; T537-E547 WeakPolarHBondContact OG1-CB 3.45Å; T537-E547 PolarHBondContact OG1-N 3.34Å; T537-E547 VanDerWaalsContact OG1-N 3.11Å; T537-E547 PolarHBondContact OG1-O 3.41Å; E547-I549 HydrophobicContact CG-CD1 4.3Å; E547-I549 HydrophobicContact CG-CG1 3.85Å; E547-Q631 PolarHBondContact OE1-NE2 2.79Å
548	V	91.2	Very high	89	Confident	57 Å²	57	47 Å²	47	35%	0.345	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.9	170.8	-178.6	0	0	0	0	107.8	V491 V534 V536 V545	V491-V548 HydrophobicContact CG1-CG1 4.4Å; V534-V548 HydrophobicContact CG1-CG1 3.65Å; V536-V548 HydrophobicContact CG1-CG2 4.35Å; V536-V548 HydrophobicContact CG2-CG1 4.33Å; V536-V548 HydrophobicContact CG2-CG2 4.48Å; V545-V548 HydrophobicContact CG1-CG2 3.6Å
549	I	90.1	Very high	88.5	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115	-176.5	-61.5	170.8	0	0	0	108.3	V534 V535 E547 L551 F585 Q631 V632	V534-I549 CarbonylContact C-O 3.59Å; V534-I549 WeakPolarHBondContact CA-O 3.38Å; V535-I549 HydrophobicContact CB-CB 4.28Å; V535-I549 PolarHBondContact N-O 3.42Å; V535-I549 PolarHBondContact O-N 3.49Å; E547-I549 HydrophobicContact CG-CD1 4.3Å; E547-I549 HydrophobicContact CG-CG1 3.85Å; I549-L551 HydrophobicContact CG2-CD2 4.05Å; I549-F585 HydrophobicContact CD1-CD2 3.87Å; I549-F585 HydrophobicContact CD1-CE2 3.13Å; I549-F585 HydrophobicContact CD1-CZ 3.7Å; I549-Q631 HydrophobicContact CD1-CB 4.06Å; I549-Q631 HydrophobicContact CG1-CB 4.4Å; I549-Q631 HydrophobicContact CG2-CB 4.06Å; I549-Q631 VanDerWaalsContact CG2-OE1 3.3Å; I549-V632 HydrophobicContact CG2-CG2 4.31Å
550	D	89.6	Confident	88	Confident	75 Å²	75	50 Å²	50	40%	0.401	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120	174.1	-71.8	-37.1	0	0	0	110	R527 V534	R527-D550 IonicContact CZ-OD1 3.33Å; R527-D550 IonicContact CZ-OD2 3.72Å; R527-D550 IonicContact NE-OD1 2.59Å; R527-D550 PolarHBondContact NE-OD1 2.89Å; R527-D550 VanDerWaalsContact NH1-CG 3.3Å; R527-D550 IonicContact NH1-OD1 2.62Å; R527-D550 PolarHBondContact NH1-OD1 2.9Å; R527-D550 IonicContact NH1-OD2 2.83Å; R527-D550 PolarHBondContact NH1-OD2 2.74Å; R527-D550 IonicContact NH2-OD1 3.77Å; R527-D550 PolarHBondContact NH2-OD1 3.28Å; R527-D550 IonicContact NH2-OD2 3.51Å; R527-D550 PolarHBondContact NH2-OD2 2.85Å; V534-D550 WeakPolarHBondContact CG1-OD1 3.35Å; V534-D550 WeakPolarHBondContact CG2-OD1 3.29Å
551	L	87.3	Confident	87.3	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.052	28%	0.281	C	S	.	.			trans	-83.4	149.4	175.7	-53.5	175.8	0	0	0	110.1	N532 G533 V535 I549 F553 L555 L574 V632	N532-L551 WeakPolarHBondContact CB-O 3.46Å; N532-L551 PolarHBondContact ND2-O 2.83Å; G533-L551 VanDerWaalsContact O-CB 3.25Å; G533-L551 WeakPolarHBondContact O-CB 3.25Å; G533-L551 PolarHBondContact O-N 2.82Å; V535-L551 HydrophobicContact CG2-CD1 4.21Å; I549-L551 HydrophobicContact CG2-CD2 4.05Å; L551-F553 HydrophobicContact CB-CD1 4.35Å; L551-F553 HydrophobicContact CB-CE1 4.21Å; L551-F553 HydrophobicContact CB-CZ 4.35Å; L551-F553 HydrophobicContact CD1-CE2 4.14Å; L551-F553 HydrophobicContact CD1-CZ 4.08Å; L551-F553 HydrophobicContact CD2-CE1 4.48Å; L551-F553 HydrophobicContact CD2-CZ 4.37Å; L551-F553 PolarHBondContact O-N 3.48Å; L551-L555 HydrophobicContact CD1-CD1 3.39Å; L551-L555 HydrophobicContact CD1-CD2 3.91Å; L551-L555 HydrophobicContact CD1-CG 3.66Å; L551-L574 HydrophobicContact CD1-CD1 4.15Å; L551-V632 HydrophobicContact CD2-CG2 3.55Å
552	E	85.7	Confident	86.5	Confident	161 Å²	161	51 Å²	51	75%	0.752	29%	0.289	S	S	*	.	S	Bend	trans	-83	-1.3	176.8	-63.2	-176.6	175.7	0	0	112.6	N532	N532-E552 PolarHBondContact ND2-O 2.81Å
553	F	86.4	Confident	85.8	Confident	35 Å²	35	49.4 Å²	49.4	15%	0.154	28%	0.277	C	S	.	.	S	Bend	trans	-132	151.9	-175.7	54.9	-89.3	0	0	0	112.4	G533 L551 L555 P576 Y583	G533-F553 PolarHBondContact N-O 2.85Å; L551-F553 HydrophobicContact CB-CD1 4.35Å; L551-F553 HydrophobicContact CB-CE1 4.21Å; L551-F553 HydrophobicContact CB-CZ 4.35Å; L551-F553 HydrophobicContact CD1-CE2 4.14Å; L551-F553 HydrophobicContact CD1-CZ 4.08Å; L551-F553 HydrophobicContact CD2-CE1 4.48Å; L551-F553 HydrophobicContact CD2-CZ 4.37Å; L551-F553 PolarHBondContact O-N 3.48Å; F553-L555 HydrophobicContact CD2-CD2 4.04Å; F553-L555 HydrophobicContact CE2-CD2 3.48Å; F553-L555 VanDerWaalsContact CE2-CD2 3.48Å; F553-L555 HydrophobicContact CE2-CG 4.35Å; F553-L555 HydrophobicContact CZ-CD2 4.47Å; F553-P576 HydrophobicContact CD2-CB 3.66Å; F553-P576 HydrophobicContact CE2-CB 3.97Å; F553-Y583 HydrophobicContact CD1-CE2 4.33Å; F553-Y583 HydrophobicContact CD2-CE2 4.41Å; F553-Y583 HydrophobicContact CE1-CD1 4.07Å; F553-Y583 HydrophobicContact CE1-CD2 4.03Å; F553-Y583 AromaticContact CE1-CE1 3.81Å; F553-Y583 HydrophobicContact CE1-CE1 3.81Å; F553-Y583 AromaticContact CE1-CE2 3.77Å; F553-Y583 HydrophobicContact CE1-CE2 3.77Å; F553-Y583 HydrophobicContact CE1-CG 4.17Å; F553-Y583 AromaticContact CE1-CZ 3.64Å; F553-Y583 AromaticContact CE2-CD2 3.67Å; F553-Y583 HydrophobicContact CE2-CD2 3.67Å; F553-Y583 AromaticContact CE2-CE2 3.81Å; F553-Y583 HydrophobicContact CE2-CE2 3.81Å; F553-Y583 HydrophobicContact CE2-CG 4.28Å; F553-Y583 AromaticContact CZ-CD1 3.89Å; F553-Y583 HydrophobicContact CZ-CD1 3.89Å; F553-Y583 AromaticContact CZ-CD2 3.32Å; F553-Y583 HydrophobicContact CZ-CD2 3.32Å; F553-Y583 HydrophobicContact CZ-CE1 4.03Å; F553-Y583 AromaticContact CZ-CE2 3.48Å; F553-Y583 HydrophobicContact CZ-CE2 3.48Å; F553-Y583 VanDerWaalsContact CZ-CE2 3.48Å; F553-Y583 AromaticContact CZ-CG 3.53Å; F553-Y583 HydrophobicContact CZ-CG 3.53Å; F553-Y583 AromaticContact CZ-CZ 3.83Å
554	P	86.5	Confident	85.3	Confident	46 Å²	46	50.4 Å²	50.4	30%	0.299	28%	0.279	S	S	.	.			trans	-70.2	135.4	171.5	27.9	-33.6	0	0	0	110.9	P576 L577	P554-P576 WeakPolarHBondContact O-CA 3.42Å; P554-L577 HydrophobicContact CB-CB 4.16Å; P554-L577 HydrophobicContact CB-CD2 4.35Å; P554-L577 HydrophobicContact CG-CB 4Å; P554-L577 HydrophobicContact CG-CD2 4.33Å; P554-L577 PolarHBondContact O-N 3.28Å
555	L	84.3	Confident	84.6	Confident	17 Å²	17	45.8 Å²	45.8	9%	0.089	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	143.6	174.2	-72.6	178.3	0	0	0	111.7	L497 V524 L551 F553 L574 W575	L497-L555 HydrophobicContact CD2-CB 4.44Å; V524-L555 HydrophobicContact CG1-CD1 3.21Å; L551-L555 HydrophobicContact CD1-CD1 3.39Å; L551-L555 HydrophobicContact CD1-CD2 3.91Å; L551-L555 HydrophobicContact CD1-CG 3.66Å; F553-L555 HydrophobicContact CD2-CD2 4.04Å; F553-L555 HydrophobicContact CE2-CD2 3.48Å; F553-L555 VanDerWaalsContact CE2-CD2 3.48Å; F553-L555 HydrophobicContact CE2-CG 4.35Å; F553-L555 HydrophobicContact CZ-CD2 4.47Å; L555-L574 HydrophobicContact CD1-CD2 4.39Å; L555-L574 HydrophobicContact CD2-CB 3.83Å; L555-W575 WeakPolarHBondContact CD2-O 3.27Å
556	C	79.3	Confident	83.9	Confident	52 Å²	52	47 Å²	47	35%	0.351	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-49.6	171	-179.1	0	0	0	0	111.1	W575 L577	C556-W575 PolarHBondContact N-O 2.59Å; C556-L577 HydrophobicContact CB-CD1 4.14Å
557	H	81.2	Confident	83.4	Confident	78 Å²	78	47.1 Å²	47.1	36%	0.361	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	159.5	-175.2	-172.7	68.9	0	0	0	110.4	F503 W575	F503-H557 AromaticContact CE1-ND1 3.91Å; H557-W575 PolarHBondContact O-N 3.17Å
558	A	85.2	Confident	82.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145.5	170.6	0	0	0	0	0	108	F507 V524 I573 L574	F507-A558 HydrophobicContact CE2-CB 3.71Å; F507-A558 HydrophobicContact CZ-CB 3.94Å; F507-A558 VanDerWaalsContact CZ-O 3.25Å; F507-A558 WeakPolarHBondContact CZ-O 3.36Å; V524-A558 HydrophobicContact CB-CB 4.21Å; V524-A558 HydrophobicContact CG1-CB 4.4Å; V524-A558 HydrophobicContact CG2-CB 3.72Å; A558-I573 CarbonylContact C-O 3.6Å; A558-I573 VanDerWaalsContact CA-O 3.25Å; A558-I573 WeakPolarHBondContact CA-O 3.4Å; A558-L574 HydrophobicContact CB-CD2 3.77Å
559	S	84.2	Confident	82.6	Confident	45 Å²	45	41.8 Å²	41.8	32%	0.315	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	152.3	177.6	-174.6	0	0	0	0	110.8	L572 I573	S559-L572 CarbonylContact O-C 3.53Å; S559-L572 WeakPolarHBondContact O-CA 3.24Å; S559-I573 PolarHBondContact N-O 2.86Å; S559-I573 PolarHBondContact O-N 2.96Å
560	S	83.3	Confident	82.5	Confident	45 Å²	45	42 Å²	42	32%	0.315	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	141.2	171.7	-167.5	0	0	0	0	109.6	T570	S560-T570 WeakPolarHBondContact OG-CG2 3.26Å
561	T	80.1	Confident	82.3	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	154.2	175.1	76.3	0	0	0	0	109.1	L563 T570 A571 I573 L584 F604	T561-L563 PolarHBondContact O-N 3.07Å; T561-L563 VanDerWaalsContact O-N 3.12Å; T561-T570 WeakPolarHBondContact O-CG2 3.27Å; T561-A571 WeakPolarHBondContact CA-O 3.08Å; T561-A571 WeakPolarHBondContact CB-O 3.29Å; T561-A571 PolarHBondContact N-O 3.4Å; T561-A571 WeakPolarHBondContact OG1-CB 3.37Å; T561-A571 PolarHBondContact OG1-O 3.4Å; T561-I573 HydrophobicContact CG2-CB 3.83Å; T561-I573 HydrophobicContact CG2-CG2 4Å; T561-L584 HydrophobicContact CG2-CD2 4.48Å; T561-F604 HydrophobicContact CG2-CE1 3.9Å; T561-F604 HydrophobicContact CG2-CZ 3.95Å
562	P	74.5	Confident	82.3	Confident	41 Å²	41	38 Å²	38	27%	0.266	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	-3.1	179.2	30.9	-37.4	0	0	0	114	I672	P562-I672 HydrophobicContact CB-CB 4.22Å; P562-I672 HydrophobicContact CB-CD1 3.65Å; P562-I672 HydrophobicContact CB-CG1 3.71Å; P562-I672 HydrophobicContact CB-CG2 3.46Å; P562-I672 VanDerWaalsContact CB-CG2 3.46Å; P562-I672 HydrophobicContact CG-CD1 4.49Å; P562-I672 HydrophobicContact CG-CG2 4.42Å
563	L	77.5	Confident	82.3	Confident	31 Å²	31	30.7 Å²	30.7	16%	0.162	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.5	-179.8	-65.3	167.6	0	0	0	110.5	T561 T570 A571 L589 L596 I602	T561-L563 PolarHBondContact O-N 3.07Å; T561-L563 VanDerWaalsContact O-N 3.12Å; L563-T570 CarbonylContact O-C 3.57Å; L563-T570 WeakPolarHBondContact O-CA 3.16Å; L563-A571 HydrophobicContact CB-CB 4.03Å; L563-A571 WeakPolarHBondContact O-CB 3.32Å; L563-A571 PolarHBondContact O-N 2.95Å; L563-L589 HydrophobicContact CB-CD2 4.47Å; L563-L596 HydrophobicContact CD1-CD1 3.75Å; L563-L596 HydrophobicContact CD1-CD2 4.05Å; L563-L596 HydrophobicContact CD1-CG 4.22Å; L563-L596 HydrophobicContact CD2-CD1 3.99Å; L563-L596 HydrophobicContact CD2-CG 4.19Å; L563-I602 HydrophobicContact CD1-CD1 3.45Å; L563-I602 VanDerWaalsContact CD1-CD1 3.45Å; L563-I602 HydrophobicContact CD2-CD1 3.84Å; L563-I602 HydrophobicContact CG-CD1 3.47Å; L563-I602 VanDerWaalsContact CG-CD1 3.47Å
564	K	77.9	Confident	82.4	Confident	31 Å²	31	29 Å²	29	14%	0.135	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.7	170.7	-67.4	179.9	-179.6	174.8	0	110	L569 E665 I670	K564-L569 CarbonylContact C-O 3.56Å; K564-L569 WeakPolarHBondContact CA-O 3.44Å; K564-E665 IonicContact NZ-OE1 3.73Å; K564-E665 PolarHBondContact NZ-OE1 3.26Å; K564-I670 HydrophobicContact CD-CD1 4.26Å; K564-I670 HydrophobicContact CD-CG2 4.47Å
565	D	78	Confident	82.3	Confident	6 Å²	6	28.2 Å²	28.2	3%	0.032	16%	0.162	C	C	.	.			trans	-68.7	155.2	167.7	-176	48.4	0	0	0	110.3	Q567 G568 L569 P586 S588 L589	D565-Q567 PolarHBondContact O-N 2.81Å; D565-Q567 WeakPolarHBondContact OD2-CB 3.36Å; D565-Q567 WeakPolarHBondContact OD2-CG 3.34Å; D565-Q567 PolarHBondContact OD2-N 2.91Å; D565-G568 PolarHBondContact O-N 2.88Å; D565-L569 HydrophobicContact CB-CB 4.25Å; D565-L569 PolarHBondContact N-O 3.01Å; D565-P586 HydrophobicContact CB-CG 4.37Å; D565-S588 WeakPolarHBondContact OD1-CB 3.37Å; D565-S588 PolarHBondContact OD1-OG 3.44Å; D565-S588 VanDerWaalsContact OD1-OG 3.09Å; D565-S588 WeakPolarHBondContact OD2-CB 3.46Å; D565-S588 PolarHBondContact OD2-OG 3.15Å; D565-L589 HydrophobicContact CB-CD2 4.22Å; D565-L589 HydrophobicContact CB-CG 4.23Å; D565-L589 PolarHBondContact OD1-N 3.08Å
566	P	78.3	Confident	82.3	Confident	89 Å²	89	27.7 Å²	27.7	58%	0.578	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.5	-20	164.8	-0.7	-19.7	0	0	0	115.6	G568	P566-G568 VanDerWaalsContact C-N 3.34Å
567	Q	79.5	Confident	82.2	Confident	93 Å²	93	30.2 Å²	30.2	44%	0.435	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.1	173.1	-62.7	-166.6	6.7	0	0	116.4	R510 R517 D565 L569	R510-Q567 PolarHBondContact NH1-O 2.95Å; R510-Q567 VanDerWaalsContact NH1-O 3.15Å; R517-Q567 PolarHBondContact NH1-O 2.73Å; D565-Q567 PolarHBondContact O-N 2.81Å; D565-Q567 WeakPolarHBondContact OD2-CB 3.36Å; D565-Q567 WeakPolarHBondContact OD2-CG 3.34Å; D565-Q567 PolarHBondContact OD2-N 2.91Å; Q567-L569 VanDerWaalsContact C-N 3.25Å; Q567-L569 HydrophobicContact CB-CD1 4.34Å; Q567-L569 HydrophobicContact CB-CG 4.32Å; Q567-L569 PolarHBondContact O-N 3.12Å
568	G	80.7	Confident	81.9	Confident	10 Å²	10	37 Å²	37	10%	0.103	19%	0.191	C	C	.	.	S	Bend	trans	73.9	13.7	-173.3	0	0	0	0	0	113.8	D565 P566	D565-G568 PolarHBondContact O-N 2.88Å; P566-G568 VanDerWaalsContact C-N 3.34Å
569	L	86.1	Confident	81	Confident	7 Å²	7	39.4 Å²	39.4	4%	0.037	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-85.6	123.8	177.5	-67.5	171	0	0	0	109.9	Q509 R510 Q520 K564 D565 Q567 P586	Q509-L569 HydrophobicContact CB-CD2 4.09Å; R510-L569 HydrophobicContact CB-CD2 3.9Å; Q520-L569 HydrophobicContact CB-CD2 4.17Å; Q520-L569 HydrophobicContact CG-CD2 4.43Å; K564-L569 CarbonylContact C-O 3.56Å; K564-L569 WeakPolarHBondContact CA-O 3.44Å; D565-L569 HydrophobicContact CB-CB 4.25Å; D565-L569 PolarHBondContact N-O 3.01Å; Q567-L569 VanDerWaalsContact C-N 3.25Å; Q567-L569 HydrophobicContact CB-CD1 4.34Å; Q567-L569 HydrophobicContact CB-CG 4.32Å; Q567-L569 PolarHBondContact O-N 3.12Å; L569-P586 HydrophobicContact CB-CG 4.02Å; L569-P586 HydrophobicContact CD1-CG 4.08Å
570	T	86.8	Confident	80.5	Confident	7 Å²	7	45.5 Å²	45.5	4%	0.043	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	129.5	173.7	-52.1	0	0	0	0	110	Q509 S560 T561 L563	Q509-T570 PolarHBondContact NE2-O 2.75Å; Q509-T570 WeakPolarHBondContact O-CB 3.47Å; Q509-T570 PolarHBondContact O-N 3.48Å; Q509-T570 PolarHBondContact O-OG1 2.94Å; S560-T570 WeakPolarHBondContact OG-CG2 3.26Å; T561-T570 WeakPolarHBondContact O-CG2 3.27Å; L563-T570 CarbonylContact O-C 3.57Å; L563-T570 WeakPolarHBondContact O-CA 3.16Å
571	A	85.4	Confident	80.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	139.9	-175.6	0	0	0	0	0	111.1	T561 L563 F585 L589	T561-A571 WeakPolarHBondContact CA-O 3.08Å; T561-A571 WeakPolarHBondContact CB-O 3.29Å; T561-A571 PolarHBondContact N-O 3.4Å; T561-A571 WeakPolarHBondContact OG1-CB 3.37Å; T561-A571 PolarHBondContact OG1-O 3.4Å; L563-A571 HydrophobicContact CB-CB 4.03Å; L563-A571 WeakPolarHBondContact O-CB 3.32Å; L563-A571 PolarHBondContact O-N 2.95Å; A571-F585 CarbonylContact C-O 3.49Å; A571-F585 WeakPolarHBondContact CA-O 3.3Å; A571-L589 HydrophobicContact CB-CD1 3.18Å; A571-L589 HydrophobicContact CB-CD2 4.28Å; A571-L589 HydrophobicContact CB-CG 4.33Å
572	L	87.5	Confident	80.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.3	176.1	-52.5	178.9	0	0	0	109	F507 Q509 A522 S559 L584 F585	F507-L572 HydrophobicContact CB-CD1 4.34Å; F507-L572 HydrophobicContact CB-CD2 3.64Å; F507-L572 HydrophobicContact CD1-CD2 4.3Å; F507-L572 HydrophobicContact CD2-CD1 3.95Å; F507-L572 HydrophobicContact CD2-CD2 3.95Å; F507-L572 HydrophobicContact CG-CD1 4.42Å; F507-L572 HydrophobicContact CG-CD2 3.7Å; Q509-L572 HydrophobicContact CG-CD1 4.37Å; Q509-L572 HydrophobicContact CG-CG 4.5Å; A522-L572 HydrophobicContact CB-CD1 3.51Å; S559-L572 CarbonylContact O-C 3.53Å; S559-L572 WeakPolarHBondContact O-CA 3.24Å; L572-L584 WeakPolarHBondContact O-CA 3.45Å; L572-F585 HydrophobicContact CD1-CD1 4.1Å; L572-F585 PolarHBondContact N-O 2.8Å; L572-F585 PolarHBondContact O-N 2.81Å
573	I	85.7	Confident	81.2	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.4	167	-167.1	162.1	0	0	0	109.2	A558 S559 T561 A582 Y583 L584 F604	A558-I573 CarbonylContact C-O 3.6Å; A558-I573 VanDerWaalsContact CA-O 3.25Å; A558-I573 WeakPolarHBondContact CA-O 3.4Å; S559-I573 PolarHBondContact N-O 2.86Å; S559-I573 PolarHBondContact O-N 2.96Å; T561-I573 HydrophobicContact CG2-CB 3.83Å; T561-I573 HydrophobicContact CG2-CG2 4Å; I573-A582 HydrophobicContact CD1-CB 3.7Å; I573-A582 HydrophobicContact CG1-CB 4.01Å; I573-Y583 CarbonylContact C-O 3.57Å; I573-Y583 WeakPolarHBondContact CA-O 3.36Å; I573-L584 HydrophobicContact CB-CD2 3.84Å; I573-L584 HydrophobicContact CD1-CD2 4.28Å; I573-L584 HydrophobicContact CG1-CD2 3.94Å; I573-F604 HydrophobicContact CB-CE1 4.18Å; I573-F604 HydrophobicContact CB-CZ 4.25Å; I573-F604 HydrophobicContact CD1-CD1 3.96Å; I573-F604 HydrophobicContact CD1-CD2 3.61Å; I573-F604 HydrophobicContact CD1-CE1 3.65Å; I573-F604 HydrophobicContact CD1-CE2 3.22Å; I573-F604 HydrophobicContact CD1-CG 3.95Å; I573-F604 HydrophobicContact CD1-CZ 3.25Å; I573-F604 HydrophobicContact CG1-CZ 4.35Å; I573-F604 HydrophobicContact CG2-CD1 4.08Å; I573-F604 HydrophobicContact CG2-CE1 3.69Å; I573-F604 HydrophobicContact CG2-CZ 4.27Å
574	L	87.6	Confident	81.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118	179	-55	177.2	0	0	0	107.7	V524 V535 L551 L555 A558 Y583 F585 V632	V524-L574 HydrophobicContact CG2-CD2 3.94Å; V535-L574 HydrophobicContact CG2-CD1 3.67Å; V535-L574 HydrophobicContact CG2-CD2 4.26Å; L551-L574 HydrophobicContact CD1-CD1 4.15Å; L555-L574 HydrophobicContact CD1-CD2 4.39Å; L555-L574 HydrophobicContact CD2-CB 3.83Å; A558-L574 HydrophobicContact CB-CD2 3.77Å; L574-Y583 PolarHBondContact N-O 2.92Å; L574-Y583 PolarHBondContact O-N 2.89Å; L574-F585 HydrophobicContact CD1-CB 4.2Å; L574-V632 HydrophobicContact CD1-CG1 4.06Å
575	W	84.6	Confident	81.9	Confident	30 Å²	30	44 Å²	44	11%	0.114	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	118.2	-177.3	-163.7	-98	0	0	0	110.8	L555 C556 H557 A582 Y617 V637	L555-W575 WeakPolarHBondContact CD2-O 3.27Å; C556-W575 PolarHBondContact N-O 2.59Å; H557-W575 PolarHBondContact O-N 3.17Å; W575-A582 HydrophobicContact CE3-CB 4.16Å; W575-A582 HydrophobicContact CZ3-CB 3.98Å; W575-Y617 AromaticContact CH2-CD1 3.86Å; W575-Y617 HydrophobicContact CH2-CD1 3.86Å; W575-Y617 AromaticContact CH2-CD2 3.92Å; W575-Y617 HydrophobicContact CH2-CD2 3.92Å; W575-Y617 HydrophobicContact CH2-CE1 4.02Å; W575-Y617 HydrophobicContact CH2-CE2 4.09Å; W575-Y617 AromaticContact CH2-CG 3.81Å; W575-Y617 HydrophobicContact CH2-CG 3.81Å; W575-Y617 HydrophobicContact CZ2-CD1 4.47Å; W575-Y617 HydrophobicContact CZ2-CD2 4.19Å; W575-Y617 HydrophobicContact CZ2-CE1 4.2Å; W575-Y617 AromaticContact CZ2-CE2 3.91Å; W575-Y617 HydrophobicContact CZ2-CE2 3.91Å; W575-Y617 HydrophobicContact CZ2-CG 4.46Å; W575-Y617 AromaticContact CZ2-CZ 3.93Å; W575-Y617 HydrophobicContact CZ3-CG 4.49Å; W575-V637 HydrophobicContact CH2-CG1 4.33Å; W575-V637 HydrophobicContact CZ3-CG1 4.39Å; W575-V637 HydrophobicContact CZ3-CG2 4.24Å
576	P	84.4	Confident	82.2	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.032	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	151.5	178	31.6	-34.9	0	0	0	110.9	F553 P554 R578 K581 Y583	F553-P576 HydrophobicContact CD2-CB 3.66Å; F553-P576 HydrophobicContact CE2-CB 3.97Å; P554-P576 WeakPolarHBondContact O-CA 3.42Å; P576-R578 PolarHBondContact O-N 3.5Å; P576-K581 VanDerWaalsContact CD-O 3.25Å; P576-K581 WeakPolarHBondContact CD-O 3.29Å; P576-K581 VanDerWaalsContact CG-O 3.25Å; P576-K581 WeakPolarHBondContact CG-O 3.41Å; P576-Y583 HydrophobicContact CB-CE2 4.36Å; P576-Y583 HydrophobicContact CG-CD2 4.31Å; P576-Y583 HydrophobicContact CG-CE2 4.09Å
577	L	78	Confident	82.1	Confident	105 Å²	105	41.9 Å²	41.9	55%	0.55	21%	0.207	S	C	.	.	S	Bend	trans	-65.7	-27.8	174	-173.1	68.3	0	0	0	112.3	P554 C556	P554-L577 HydrophobicContact CB-CB 4.16Å; P554-L577 HydrophobicContact CB-CD2 4.35Å; P554-L577 HydrophobicContact CG-CB 4Å; P554-L577 HydrophobicContact CG-CD2 4.33Å; P554-L577 PolarHBondContact O-N 3.28Å; C556-L577 HydrophobicContact CB-CD1 4.14Å
578	R	74.2	Confident	81.8	Confident	221 Å²	221	39.2 Å²	39.2	83%	0.834	20%	0.199	S	C	*	.	S	Bend	trans	-137.7	125.1	177.3	-64.2	-177.6	-179.2	179.3	-0.6	108.9	P576	P576-R578 PolarHBondContact O-N 3.5Å
579	G	67.6	Low	81.4	Confident	51 Å²	51	38.9 Å²	38.9	53%	0.526	19%	0.194	S	C	.	.			trans	134.9	146.6	175.6	0	0	0	0	0	112	K581	G579-K581 PolarHBondContact O-N 2.55Å
580	E	72.2	Confident	80.2	Confident	173 Å²	173	44.2 Å²	44.2	81%	0.808	22%	0.217	S	C	*	.	S	Bend	trans	-91.9	19.2	177.4	-60.7	-178.8	163.2	0	0	112.1
581	K	82.8	Confident	78.6	Confident	69 Å²	69	49.2 Å²	49.2	30%	0.3	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.4	-179.9	-60.7	-178.1	-178.2	-177.8	0	109.1	P576 G579 L623 D626 P634 W635	P576-K581 VanDerWaalsContact CD-O 3.25Å; P576-K581 WeakPolarHBondContact CD-O 3.29Å; P576-K581 VanDerWaalsContact CG-O 3.25Å; P576-K581 WeakPolarHBondContact CG-O 3.41Å; G579-K581 PolarHBondContact O-N 2.55Å; K581-L623 HydrophobicContact CD-CD1 3.8Å; K581-L623 HydrophobicContact CG-CD1 3.91Å; K581-D626 IonicContact NZ-OD2 3.81Å; K581-D626 PolarHBondContact NZ-OD2 2.89Å; K581-P634 HydrophobicContact CD-CB 4.22Å; K581-W635 WeakPolarHBondContact CA-O 3.43Å
582	A	84	Confident	77.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	153.2	167.6	0	0	0	0	0	109.7	I573 W575 L619 P634 W635 V637	I573-A582 HydrophobicContact CD1-CB 3.7Å; I573-A582 HydrophobicContact CG1-CB 4.01Å; W575-A582 HydrophobicContact CE3-CB 4.16Å; W575-A582 HydrophobicContact CZ3-CB 3.98Å; A582-L619 HydrophobicContact CB-CD1 4.32Å; A582-P634 CarbonylContact O-C 3.52Å; A582-P634 WeakPolarHBondContact O-CA 3.04Å; A582-W635 PolarHBondContact N-O 3.01Å; A582-W635 PolarHBondContact O-N 3.28Å; A582-V637 HydrophobicContact CB-CG2 3.53Å
583	Y	86.2	Confident	75.5	Confident	46 Å²	46	56.7 Å²	56.7	18%	0.18	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.9	176.1	-71.5	-89.7	0	0	0	110	F553 I573 L574 P576 V632 I633 P634	F553-Y583 HydrophobicContact CD1-CE2 4.33Å; F553-Y583 HydrophobicContact CD2-CE2 4.41Å; F553-Y583 HydrophobicContact CE1-CD1 4.07Å; F553-Y583 HydrophobicContact CE1-CD2 4.03Å; F553-Y583 AromaticContact CE1-CE1 3.81Å; F553-Y583 HydrophobicContact CE1-CE1 3.81Å; F553-Y583 AromaticContact CE1-CE2 3.77Å; F553-Y583 HydrophobicContact CE1-CE2 3.77Å; F553-Y583 HydrophobicContact CE1-CG 4.17Å; F553-Y583 AromaticContact CE1-CZ 3.64Å; F553-Y583 AromaticContact CE2-CD2 3.67Å; F553-Y583 HydrophobicContact CE2-CD2 3.67Å; F553-Y583 AromaticContact CE2-CE2 3.81Å; F553-Y583 HydrophobicContact CE2-CE2 3.81Å; F553-Y583 HydrophobicContact CE2-CG 4.28Å; F553-Y583 AromaticContact CZ-CD1 3.89Å; F553-Y583 HydrophobicContact CZ-CD1 3.89Å; F553-Y583 AromaticContact CZ-CD2 3.32Å; F553-Y583 HydrophobicContact CZ-CD2 3.32Å; F553-Y583 HydrophobicContact CZ-CE1 4.03Å; F553-Y583 AromaticContact CZ-CE2 3.48Å; F553-Y583 HydrophobicContact CZ-CE2 3.48Å; F553-Y583 VanDerWaalsContact CZ-CE2 3.48Å; F553-Y583 AromaticContact CZ-CG 3.53Å; F553-Y583 HydrophobicContact CZ-CG 3.53Å; F553-Y583 AromaticContact CZ-CZ 3.83Å; I573-Y583 CarbonylContact C-O 3.57Å; I573-Y583 WeakPolarHBondContact CA-O 3.36Å; L574-Y583 PolarHBondContact N-O 2.92Å; L574-Y583 PolarHBondContact O-N 2.89Å; P576-Y583 HydrophobicContact CB-CE2 4.36Å; P576-Y583 HydrophobicContact CG-CD2 4.31Å; P576-Y583 HydrophobicContact CG-CE2 4.09Å; Y583-V632 HydrophobicContact CD1-CB 4.48Å; Y583-V632 HydrophobicContact CD1-CG1 4.26Å; Y583-V632 HydrophobicContact CG-CG1 4.38Å; Y583-I633 WeakPolarHBondContact CA-O 3.31Å; Y583-P634 HydrophobicContact CD1-CB 4.09Å; Y583-P634 HydrophobicContact CE1-CB 3.76Å; Y583-P634 HydrophobicContact CE1-CG 4.47Å
584	L	85.6	Confident	73.8	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.3	177.8	-66.1	-172.9	0	0	0	112.1	T561 L572 I573 L619 V632 I633 W635	T561-L584 HydrophobicContact CG2-CD2 4.48Å; L572-L584 WeakPolarHBondContact O-CA 3.45Å; I573-L584 HydrophobicContact CB-CD2 3.84Å; I573-L584 HydrophobicContact CD1-CD2 4.28Å; I573-L584 HydrophobicContact CG1-CD2 3.94Å; L584-L619 HydrophobicContact CD1-CD2 4.05Å; L584-V632 WeakPolarHBondContact O-CG1 3.09Å; L584-I633 PolarHBondContact N-O 3.23Å; L584-I633 PolarHBondContact O-N 2.84Å; L584-W635 HydrophobicContact CD1-CD2 3.91Å; L584-W635 VanDerWaalsContact CD1-CE2 3.49Å; L584-W635 HydrophobicContact CD1-CG 4.13Å; L584-W635 HydrophobicContact CD1-CZ2 3.9Å; L584-W635 HydrophobicContact CG-CD2 4.48Å; L584-W635 HydrophobicContact CG-CG 4.17Å
585	F	85.7	Confident	72.1	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.013	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.3	177.8	176.4	-100.7	0	0	0	110.1	V535 T537 I549 A571 L572 L574 V632	V535-F585 HydrophobicContact CG1-CD1 4.13Å; V535-F585 HydrophobicContact CG1-CE1 4.03Å; V535-F585 HydrophobicContact CG1-CZ 4.49Å; T537-F585 HydrophobicContact CG2-CE1 3.56Å; T537-F585 HydrophobicContact CG2-CZ 3.59Å; I549-F585 HydrophobicContact CD1-CD2 3.87Å; I549-F585 HydrophobicContact CD1-CE2 3.13Å; I549-F585 HydrophobicContact CD1-CZ 3.7Å; A571-F585 CarbonylContact C-O 3.49Å; A571-F585 WeakPolarHBondContact CA-O 3.3Å; L572-F585 HydrophobicContact CD1-CD1 4.1Å; L572-F585 PolarHBondContact N-O 2.8Å; L572-F585 PolarHBondContact O-N 2.81Å; L574-F585 HydrophobicContact CD1-CB 4.2Å; F585-V632 HydrophobicContact CB-CG1 4.34Å
586	P	84.4	Confident	70.8	Confident	8 Å²	8	62.8 Å²	62.8	5%	0.052	33%	0.334	C	S	.	.	S	Bend	cis	-78.1	161.9	6.9	31.8	-36.3	0	0	0	114.3	D565 L569 S588 L589	D565-P586 HydrophobicContact CB-CG 4.37Å; L569-P586 HydrophobicContact CB-CG 4.02Å; L569-P586 HydrophobicContact CD1-CG 4.08Å; P586-S588 PolarHBondContact O-N 2.78Å; P586-L589 WeakPolarHBondContact O-CD1 3.49Å
587	P	75.5	Confident	69.4	Low	42 Å²	42	66 Å²	66	27%	0.273	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-73	-4.3	-178	29.2	-34.3	0	0	0	114.4	L589 K590 Q631 I633	P587-L589 PolarHBondContact O-N 2.82Å; P587-K590 VanDerWaalsContact O-CG 3.3Å; P587-K590 WeakPolarHBondContact O-CG 2.98Å; P587-Q631 WeakPolarHBondContact CB-O 3.18Å; P587-Q631 VanDerWaalsContact CD-O 3.26Å; P587-Q631 WeakPolarHBondContact CD-O 3.41Å; P587-Q631 VanDerWaalsContact CG-O 3.27Å; P587-Q631 WeakPolarHBondContact CG-O 3.07Å; P587-I633 HydrophobicContact CB-CD1 4.3Å; P587-I633 HydrophobicContact CB-CG1 4.41Å; P587-I633 WeakPolarHBondContact O-CD1 3.37Å
588	S	73.9	Confident	68.2	Low	37 Å²	37	68.2 Å²	68.2	26%	0.259	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-71.7	-15.9	179.7	39.6	0	0	0	0	113.8	D565 P586 K590 T591	D565-S588 WeakPolarHBondContact OD1-CB 3.37Å; D565-S588 PolarHBondContact OD1-OG 3.44Å; D565-S588 VanDerWaalsContact OD1-OG 3.09Å; D565-S588 WeakPolarHBondContact OD2-CB 3.46Å; D565-S588 PolarHBondContact OD2-OG 3.15Å; P586-S588 PolarHBondContact O-N 2.78Å; S588-K590 PolarHBondContact O-N 3.04Å; S588-T591 PolarHBondContact O-OG1 3.23Å
589	L	70.7	Confident	67.8	Low	3 Å²	3	60.5 Å²	60.5	2%	0.016	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-64.8	-2.7	174.6	-70.6	151.1	0	0	0	114.6	L563 D565 A571 P586 P587 T591 T592	L563-L589 HydrophobicContact CB-CD2 4.47Å; D565-L589 HydrophobicContact CB-CD2 4.22Å; D565-L589 HydrophobicContact CB-CG 4.23Å; D565-L589 PolarHBondContact OD1-N 3.08Å; A571-L589 HydrophobicContact CB-CD1 3.18Å; A571-L589 HydrophobicContact CB-CD2 4.28Å; A571-L589 HydrophobicContact CB-CG 4.33Å; P586-L589 WeakPolarHBondContact O-CD1 3.49Å; P587-L589 PolarHBondContact O-N 2.82Å; L589-T591 PolarHBondContact O-N 3.33Å; L589-T592 PolarHBondContact O-N 3.32Å; L589-T592 VanDerWaalsContact O-N 3.12Å; L589-T592 PolarHBondContact O-OG1 3.01Å
590	K	60.7	Low	68.1	Low	119 Å²	119	67.1 Å²	67.1	52%	0.517	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-51.6	-28.5	175.1	-72.6	172.3	-173.6	-178.6	0	112.7	P587 S588 I633	P587-K590 VanDerWaalsContact O-CG 3.3Å; P587-K590 WeakPolarHBondContact O-CG 2.98Å; S588-K590 PolarHBondContact O-N 3.04Å; K590-I633 HydrophobicContact CD-CD1 4.09Å; K590-I633 HydrophobicContact CG-CD1 3.35Å; K590-I633 HydrophobicContact CG-CG1 4.21Å
591	T	53.6	Low	68.4	Low	112 Å²	112	61.8 Å²	61.8	69%	0.687	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-82.2	-19.7	-174	-21.4	0	0	0	0	113.5	S588 L589 K593	S588-T591 PolarHBondContact O-OG1 3.23Å; L589-T591 PolarHBondContact O-N 3.33Å; T591-K593 PolarHBondContact O-N 2.96Å; T591-K593 VanDerWaalsContact O-N 3.14Å
592	T	56.1	Low	68.3	Low	33 Å²	33	59.5 Å²	59.5	20%	0.202	34%	0.335	C	S	.	.			trans	-88.8	32.2	-174.7	51.6	0	0	0	0	113.4	L589 S594 A595	L589-T592 PolarHBondContact O-N 3.32Å; L589-T592 VanDerWaalsContact O-N 3.12Å; L589-T592 PolarHBondContact O-OG1 3.01Å; T592-S594 PolarHBondContact O-N 2.89Å; T592-S594 VanDerWaalsContact O-N 3.09Å; T592-A595 PolarHBondContact O-N 3.13Å
593	K	53.1	Low	68.3	Low	125 Å²	125	62.1 Å²	62.1	54%	0.543	35%	0.345	S	S	.	.	H	α-helix	trans	-52.4	-31.1	179.7	-117.5	-177.6	-179.7	176.1	0	114	T591 H624	T591-K593 PolarHBondContact O-N 2.96Å; T591-K593 VanDerWaalsContact O-N 3.14Å; K593-H624 WeakPolarHBondContact CE-NE2 3.43Å; K593-H624 PolarHBondContact NZ-CD2 2.82Å; K593-H624 PolarHBondContact NZ-NE2 3.12Å
594	S	49.8	Very low	68.2	Low	104 Å²	104	61.3 Å²	61.3	73%	0.727	34%	0.343	S	S	*	.	H	α-helix	trans	-84.4	-19.4	-173.3	53.6	0	0	0	0	115	T592	T592-S594 PolarHBondContact O-N 2.89Å; T592-S594 VanDerWaalsContact O-N 3.09Å
595	A	50.8	Low	68.3	Low	55 Å²	55	62.8 Å²	62.8	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-86.1	-27.9	-172.3	0	0	0	0	0	113.6	T592	T592-A595 PolarHBondContact O-N 3.13Å
596	L	58.4	Low	68.3	Low	6 Å²	6	64.9 Å²	64.9	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-87.2	-29.1	-171.5	-93.4	126.7	0	0	0	114.7	L563 I602 L619 W635	L563-L596 HydrophobicContact CD1-CD1 3.75Å; L563-L596 HydrophobicContact CD1-CD2 4.05Å; L563-L596 HydrophobicContact CD1-CG 4.22Å; L563-L596 HydrophobicContact CD2-CD1 3.99Å; L563-L596 HydrophobicContact CD2-CG 4.19Å; L596-I602 HydrophobicContact CD2-CD1 3.77Å; L596-I602 HydrophobicContact CD2-CG1 4.11Å; L596-L619 HydrophobicContact CD2-CD2 3.49Å; L596-L619 VanDerWaalsContact CD2-CD2 3.49Å; L596-L619 HydrophobicContact CD2-CG 4.29Å; L596-W635 HydrophobicContact CB-CZ3 4.48Å; L596-W635 HydrophobicContact CD1-CH2 3.83Å; L596-W635 HydrophobicContact CD1-CZ3 4.23Å; L596-W635 HydrophobicContact CD2-CZ3 4.32Å
597	V	53.3	Low	68.3	Low	72 Å²	72	65.8 Å²	65.8	44%	0.436	37%	0.366	S	S	.	.	H	α-helix	trans	-87.9	-38.7	-167.3	-177.4	0	0	0	0	112.3	E621	V597-E621 HydrophobicContact CG2-CG 4.35Å
598	D	54.1	Low	68.7	Low	152 Å²	152	66.4 Å²	66.4	81%	0.813	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-22	-170.9	-69.1	-27.1	0	0	0	115.4
599	G	64.4	Low	68.9	Low	59 Å²	59	70.6 Å²	70.6	61%	0.608	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-45.5	-169.8	0	0	0	0	0	115.8
600	R	73.8	Confident	69.3	Low	191 Å²	191	76.8 Å²	76.8	72%	0.721	42%	0.415	S	S	*	.			trans	-146.6	89.6	-170.1	-65.8	-176.3	-177.3	174.8	-0.5	110.5
601	P	78.7	Confident	70.2	Confident	61 Å²	61	73.6 Å²	73.6	40%	0.396	41%	0.408	S	S	.	.			trans	-66.4	138.1	179.8	27.6	-34.1	0	0	0	110.9	Y603	P601-Y603 HydrophobicContact CB-CE2 3.97Å; P601-Y603 HydrophobicContact CG-CE2 3.81Å
602	I	81.2	Confident	71.6	Confident	20 Å²	20	68.3 Å²	68.3	10%	0.103	38%	0.375	C	S	.	.			trans	-100.2	126.8	176.5	-54.9	-175.3	0	0	0	109.2	L563 L596 F604 L619	L563-I602 HydrophobicContact CD1-CD1 3.45Å; L563-I602 VanDerWaalsContact CD1-CD1 3.45Å; L563-I602 HydrophobicContact CD2-CD1 3.84Å; L563-I602 HydrophobicContact CG-CD1 3.47Å; L563-I602 VanDerWaalsContact CG-CD1 3.47Å; L596-I602 HydrophobicContact CD2-CD1 3.77Å; L596-I602 HydrophobicContact CD2-CG1 4.11Å; I602-F604 HydrophobicContact CB-CE2 4.38Å; I602-F604 HydrophobicContact CB-CZ 4.43Å; I602-F604 HydrophobicContact CG2-CD2 4.39Å; I602-F604 HydrophobicContact CG2-CE1 3.91Å; I602-F604 HydrophobicContact CG2-CE2 3.65Å; I602-F604 HydrophobicContact CG2-CZ 3.36Å; I602-L619 HydrophobicContact CB-CB 4.46Å; I602-L619 PolarHBondContact O-N 2.91Å
603	Y	85.2	Confident	73.2	Confident	55 Å²	55	69.7 Å²	69.7	22%	0.216	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144.9	175.1	-59.4	-88.3	0	0	0	109.9	P601 Y617 K618 Q640 I740	P601-Y603 HydrophobicContact CB-CE2 3.97Å; P601-Y603 HydrophobicContact CG-CE2 3.81Å; Y603-Y617 CarbonylContact C-O 3.52Å; Y603-Y617 WeakPolarHBondContact CA-O 3.46Å; Y603-K618 HydrophobicContact CD1-CB 3.89Å; Y603-K618 HydrophobicContact CD1-CG 4.35Å; Y603-K618 HydrophobicContact CE1-CB 3.86Å; Y603-K618 HydrophobicContact CE1-CD 4.03Å; Y603-K618 HydrophobicContact CE1-CG 4.02Å; Y603-Q640 HydrophobicContact CD1-CG 4.15Å; Y603-Q640 HydrophobicContact CE1-CG 4.08Å; Y603-I740 HydrophobicContact CD1-CG2 4.15Å; Y603-I740 HydrophobicContact CD2-CD1 3.91Å; Y603-I740 HydrophobicContact CD2-CG1 4.03Å; Y603-I740 HydrophobicContact CD2-CG2 3.87Å; Y603-I740 HydrophobicContact CE1-CG2 4.15Å; Y603-I740 HydrophobicContact CE2-CD1 4.36Å; Y603-I740 HydrophobicContact CE2-CG2 3.85Å; Y603-I740 HydrophobicContact CG-CG1 4.23Å; Y603-I740 HydrophobicContact CG-CG2 4.02Å
604	F	83.5	Confident	74.9	Confident	29 Å²	29	63.8 Å²	63.8	13%	0.127	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.1	176.4	-62.3	-73.8	0	0	0	108.8	T561 I573 I602 S616 Y617 L619	T561-F604 HydrophobicContact CG2-CE1 3.9Å; T561-F604 HydrophobicContact CG2-CZ 3.95Å; I573-F604 HydrophobicContact CB-CE1 4.18Å; I573-F604 HydrophobicContact CB-CZ 4.25Å; I573-F604 HydrophobicContact CD1-CD1 3.96Å; I573-F604 HydrophobicContact CD1-CD2 3.61Å; I573-F604 HydrophobicContact CD1-CE1 3.65Å; I573-F604 HydrophobicContact CD1-CE2 3.22Å; I573-F604 HydrophobicContact CD1-CG 3.95Å; I573-F604 HydrophobicContact CD1-CZ 3.25Å; I573-F604 HydrophobicContact CG1-CZ 4.35Å; I573-F604 HydrophobicContact CG2-CD1 4.08Å; I573-F604 HydrophobicContact CG2-CE1 3.69Å; I573-F604 HydrophobicContact CG2-CZ 4.27Å; I602-F604 HydrophobicContact CB-CE2 4.38Å; I602-F604 HydrophobicContact CB-CZ 4.43Å; I602-F604 HydrophobicContact CG2-CD2 4.39Å; I602-F604 HydrophobicContact CG2-CE1 3.91Å; I602-F604 HydrophobicContact CG2-CE2 3.65Å; I602-F604 HydrophobicContact CG2-CZ 3.36Å; F604-S616 CarbonylContact O-C 3.5Å; F604-S616 VanDerWaalsContact O-CA 3.22Å; F604-S616 WeakPolarHBondContact O-CA 3.47Å; F604-Y617 PolarHBondContact N-O 3.18Å; F604-Y617 PolarHBondContact O-N 2.8Å; F604-L619 HydrophobicContact CE2-CB 4.01Å; F604-L619 HydrophobicContact CE2-CD1 4.39Å; F604-L619 HydrophobicContact CE2-CD2 4.26Å; F604-L619 HydrophobicContact CE2-CG 4.46Å
605	L	86.5	Confident	76.8	Confident	33 Å²	33	60.6 Å²	60.6	17%	0.173	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	115.7	174.9	-176.8	66.8	0	0	0	108.5	V607 A614 F641 F656 M658 A699 F737	L605-V607 HydrophobicContact CD2-CG2 4.11Å; L605-V607 HydrophobicContact CG-CG2 3.9Å; L605-A614 HydrophobicContact CD1-CB 4.3Å; L605-F641 HydrophobicContact CD1-CE2 4.2Å; L605-F641 HydrophobicContact CD1-CZ 3.83Å; L605-F656 HydrophobicContact CD2-CE2 4.48Å; L605-F656 HydrophobicContact CD2-CZ 3.74Å; L605-M658 HydrophobicContact CB-SD 4.31Å; L605-M658 HydrophobicContact CD2-CE 4.15Å; L605-M658 HydrophobicContact CD2-SD 3.83Å; L605-A699 HydrophobicContact CD2-CB 4.02Å; L605-F737 HydrophobicContact CD1-CE2 4.49Å; L605-F737 HydrophobicContact CD2-CE2 3.84Å; L605-F737 HydrophobicContact CD2-CZ 4.03Å
606	H	86.1	Confident	78.6	Confident	47 Å²	47	58 Å²	58	22%	0.218	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	117.8	173.8	178.5	-129.9	0	0	0	108.8	A614 E615 Y617	H606-A614 CarbonylContact O-C 3.59Å; H606-A614 WeakPolarHBondContact O-CA 3.06Å; H606-E615 PolarHBondContact N-O 2.81Å; H606-E615 PolarHBondContact O-N 2.91Å; H606-Y617 HydrophobicContact CB-CD2 4.29Å; H606-Y617 HydrophobicContact CB-CE2 4.09Å
607	V	84.4	Confident	80	Confident	27 Å²	27	59.2 Å²	59.2	16%	0.164	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.2	179.7	-175.1	0	0	0	0	109.4	L605 R609 A614 L645 I653 F656	L605-V607 HydrophobicContact CD2-CG2 4.11Å; L605-V607 HydrophobicContact CG-CG2 3.9Å; V607-R609 PolarHBondContact O-N 2.93Å; V607-A614 HydrophobicContact CG1-CB 4.49Å; V607-A614 HydrophobicContact CG2-CB 3.99Å; V607-L645 HydrophobicContact CG1-CD1 4.06Å; V607-I653 HydrophobicContact CG1-CD1 3.89Å; V607-F656 HydrophobicContact CG1-CD2 4.48Å; V607-F656 HydrophobicContact CG2-CD1 4.4Å; V607-F656 HydrophobicContact CG2-CD2 4.38Å; V607-F656 HydrophobicContact CG2-CE1 3.92Å; V607-F656 HydrophobicContact CG2-CE2 3.93Å; V607-F656 HydrophobicContact CG2-CZ 3.68Å
608	D	83.3	Confident	81.6	Confident	55 Å²	55	58.7 Å²	58.7	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	106.7	171.7	177	9.1	0	0	0	109.7	T610 S611 G612 L613	D608-T610 PolarHBondContact O-N 3.03Å; D608-T610 PolarHBondContact OD1-N 3.27Å; D608-T610 PolarHBondContact OD1-OG1 3.44Å; D608-T610 PolarHBondContact OD2-OG1 3.03Å; D608-S611 VanDerWaalsContact CB-OG 3.27Å; D608-S611 WeakPolarHBondContact CB-OG 3.38Å; D608-S611 PolarHBondContact OD1-N 3.49Å; D608-S611 VanDerWaalsContact OD2-CB 3.24Å; D608-S611 WeakPolarHBondContact OD2-CB 3.48Å; D608-S611 PolarHBondContact OD2-OG 3.18Å; D608-G612 WeakPolarHBondContact O-CA 3.42Å; D608-G612 PolarHBondContact O-N 3.3Å; D608-L613 PolarHBondContact N-O 3.01Å; D608-L613 PolarHBondContact O-N 3.21Å
609	R	79.2	Confident	83	Confident	125 Å²	125	51.6 Å²	51.6	47%	0.472	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.3	180	-63.3	-175.6	-179.2	-168.5	-3.8	113.2	V607 I653	V607-R609 PolarHBondContact O-N 2.93Å; R609-I653 HydrophobicContact CG-CG2 4.46Å
610	T	78.3	Confident	83.7	Confident	133 Å²	133	51.9 Å²	51.9	82%	0.816	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-39.7	-176.3	62.4	0	0	0	0	112.5	D608	D608-T610 PolarHBondContact O-N 3.03Å; D608-T610 PolarHBondContact OD1-N 3.27Å; D608-T610 PolarHBondContact OD1-OG1 3.44Å; D608-T610 PolarHBondContact OD2-OG1 3.03Å
611	S	81	Confident	83.8	Confident	51 Å²	51	48.6 Å²	48.6	36%	0.357	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.8	175.1	61.1	0	0	0	0	113.4	D608 L613	D608-S611 VanDerWaalsContact CB-OG 3.27Å; D608-S611 WeakPolarHBondContact CB-OG 3.38Å; D608-S611 PolarHBondContact OD1-N 3.49Å; D608-S611 VanDerWaalsContact OD2-CB 3.24Å; D608-S611 WeakPolarHBondContact OD2-CB 3.48Å; D608-S611 PolarHBondContact OD2-OG 3.18Å; S611-L613 VanDerWaalsContact C-N 3.28Å; S611-L613 PolarHBondContact OG-N 3.13Å
612	G	82.9	Confident	83.4	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.01	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	8.9	-174.9	0	0	0	0	0	113.9	D608 N644 L645	D608-G612 WeakPolarHBondContact O-CA 3.42Å; D608-G612 PolarHBondContact O-N 3.3Å; G612-N644 PolarHBondContact O-OD1 3.27Å; G612-L645 WeakPolarHBondContact O-CB 3.44Å; G612-L645 PolarHBondContact O-N 3.23Å
613	L	88.1	Confident	82.8	Confident	63 Å²	63	48 Å²	48	33%	0.33	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.6	-177.2	-65.1	171.6	0	0	0	111.3	D608 S611 T642 N644	D608-L613 PolarHBondContact N-O 3.01Å; D608-L613 PolarHBondContact O-N 3.21Å; S611-L613 VanDerWaalsContact C-N 3.28Å; S611-L613 PolarHBondContact OG-N 3.13Å; L613-T642 HydrophobicContact CD2-CG2 4.27Å; L613-N644 HydrophobicContact CD2-CB 4.17Å
614	A	88.8	Confident	81.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	115.8	168.5	0	0	0	0	0	109.5	L605 H606 V607 T642 L643 L645	L605-A614 HydrophobicContact CD1-CB 4.3Å; H606-A614 CarbonylContact O-C 3.59Å; H606-A614 WeakPolarHBondContact O-CA 3.06Å; V607-A614 HydrophobicContact CG1-CB 4.49Å; V607-A614 HydrophobicContact CG2-CB 3.99Å; A614-T642 WeakPolarHBondContact O-CA 3.39Å; A614-L643 HydrophobicContact CB-CB 4.34Å; A614-L643 PolarHBondContact N-O 2.78Å; A614-L643 PolarHBondContact O-N 2.76Å; A614-L645 HydrophobicContact CB-CD1 3.75Å; A614-L645 HydrophobicContact CB-CG 4.02Å
615	E	89.8	Confident	80.3	Confident	38 Å²	38	53.6 Å²	53.6	18%	0.178	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.7	-178.6	-62.2	-176.5	136.8	0	0	109.9	H606 Y617 K639 T642	H606-E615 PolarHBondContact N-O 2.81Å; H606-E615 PolarHBondContact O-N 2.91Å; E615-Y617 HydrophobicContact CB-CD2 4.35Å; E615-Y617 HydrophobicContact CB-CE2 3.56Å; E615-Y617 PolarHBondContact OE2-OH 2.99Å; E615-K639 IonicContact OE1-NZ 3.63Å; E615-K639 PolarHBondContact OE1-NZ 2.8Å; E615-T642 HydrophobicContact CG-CG2 4.1Å
616	S	89.8	Confident	78.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	148.9	174.8	66.8	0	0	0	0	112.4	F604 K639 Q640 F641	F604-S616 CarbonylContact O-C 3.5Å; F604-S616 VanDerWaalsContact O-CA 3.22Å; F604-S616 WeakPolarHBondContact O-CA 3.47Å; S616-K639 CarbonylContact O-C 3.47Å; S616-K639 WeakPolarHBondContact O-CA 3.45Å; S616-Q640 PolarHBondContact O-N 3.13Å; S616-Q640 WeakPolarHBondContact OG-CB 3.31Å; S616-F641 PolarHBondContact N-O 3.04Å; S616-F641 WeakPolarHBondContact OG-CD1 3.43Å; S616-F641 WeakPolarHBondContact OG-CE1 3.45Å; S616-F641 WeakPolarHBondContact OG-CG 3.46Å; S616-F641 PolarHBondContact OG-N 3.08Å
617	Y	88.3	Confident	76.9	Confident	31 Å²	31	59.7 Å²	59.7	12%	0.122	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	126.5	-167	-75.3	-72.7	0	0	0	109.1	W575 Y603 F604 H606 E615 V637 S638 K639	W575-Y617 AromaticContact CH2-CD1 3.86Å; W575-Y617 HydrophobicContact CH2-CD1 3.86Å; W575-Y617 AromaticContact CH2-CD2 3.92Å; W575-Y617 HydrophobicContact CH2-CD2 3.92Å; W575-Y617 HydrophobicContact CH2-CE1 4.02Å; W575-Y617 HydrophobicContact CH2-CE2 4.09Å; W575-Y617 AromaticContact CH2-CG 3.81Å; W575-Y617 HydrophobicContact CH2-CG 3.81Å; W575-Y617 HydrophobicContact CZ2-CD1 4.47Å; W575-Y617 HydrophobicContact CZ2-CD2 4.19Å; W575-Y617 HydrophobicContact CZ2-CE1 4.2Å; W575-Y617 AromaticContact CZ2-CE2 3.91Å; W575-Y617 HydrophobicContact CZ2-CE2 3.91Å; W575-Y617 HydrophobicContact CZ2-CG 4.46Å; W575-Y617 AromaticContact CZ2-CZ 3.93Å; W575-Y617 HydrophobicContact CZ3-CG 4.49Å; Y603-Y617 CarbonylContact C-O 3.52Å; Y603-Y617 WeakPolarHBondContact CA-O 3.46Å; F604-Y617 PolarHBondContact N-O 3.18Å; F604-Y617 PolarHBondContact O-N 2.8Å; H606-Y617 HydrophobicContact CB-CD2 4.29Å; H606-Y617 HydrophobicContact CB-CE2 4.09Å; E615-Y617 HydrophobicContact CB-CD2 4.35Å; E615-Y617 HydrophobicContact CB-CE2 3.56Å; E615-Y617 PolarHBondContact OE2-OH 2.99Å; Y617-V637 VanDerWaalsContact CB-CG1 3.46Å; Y617-V637 HydrophobicContact CD1-CG1 3.7Å; Y617-V637 HydrophobicContact CG-CG1 3.94Å; Y617-S638 CarbonylContact C-O 3.58Å; Y617-S638 WeakPolarHBondContact CA-O 3.34Å; Y617-K639 HydrophobicContact CD1-CB 4.14Å; Y617-K639 HydrophobicContact CD1-CG 4.47Å; Y617-K639 HydrophobicContact CE1-CB 3.93Å; Y617-K639 HydrophobicContact CE1-CD 4.24Å; Y617-K639 HydrophobicContact CE1-CG 4.05Å
618	K	86.8	Confident	75.1	Confident	61 Å²	61	61.1 Å²	61.1	27%	0.265	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.3	173.6	175.3	-175.9	175.9	-178.4	0	109.5	Y603 L620 V637 S638 Q640	Y603-K618 HydrophobicContact CD1-CB 3.89Å; Y603-K618 HydrophobicContact CD1-CG 4.35Å; Y603-K618 HydrophobicContact CE1-CB 3.86Å; Y603-K618 HydrophobicContact CE1-CD 4.03Å; Y603-K618 HydrophobicContact CE1-CG 4.02Å; K618-L620 HydrophobicContact CD-CD2 4.45Å; K618-V637 WeakPolarHBondContact O-CA 3.3Å; K618-S638 PolarHBondContact N-O 3.15Å; K618-S638 PolarHBondContact O-N 2.86Å; K618-S638 PolarHBondContact O-OG 2.73Å; K618-Q640 HydrophobicContact CB-CG 3.71Å
619	L	82.2	Confident	73.3	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	131.7	174.3	-161.4	63.5	0	0	0	110.1	A582 L584 L596 I602 F604 W635	A582-L619 HydrophobicContact CB-CD1 4.32Å; L584-L619 HydrophobicContact CD1-CD2 4.05Å; L596-L619 HydrophobicContact CD2-CD2 3.49Å; L596-L619 VanDerWaalsContact CD2-CD2 3.49Å; L596-L619 HydrophobicContact CD2-CG 4.29Å; I602-L619 HydrophobicContact CB-CB 4.46Å; I602-L619 PolarHBondContact O-N 2.91Å; F604-L619 HydrophobicContact CE2-CB 4.01Å; F604-L619 HydrophobicContact CE2-CD1 4.39Å; F604-L619 HydrophobicContact CE2-CD2 4.26Å; F604-L619 HydrophobicContact CE2-CG 4.46Å; L619-W635 HydrophobicContact CD1-CB 3.52Å; L619-W635 HydrophobicContact CD1-CD2 4.28Å; L619-W635 HydrophobicContact CD1-CE3 4.11Å; L619-W635 HydrophobicContact CD1-CG 4.08Å; L619-W635 HydrophobicContact CD2-CD2 4.39Å; L619-W635 HydrophobicContact CD2-CE3 3.99Å; L619-W635 HydrophobicContact CD2-CZ3 4.39Å; L619-W635 HydrophobicContact CG-CB 4.48Å; L619-W635 HydrophobicContact CG-CD2 4.4Å; L619-W635 HydrophobicContact CG-CE3 3.82Å; L619-W635 HydrophobicContact CG-CZ3 4.49Å
620	L	80	Confident	72.1	Confident	66 Å²	66	60.6 Å²	60.6	35%	0.346	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-100.4	-180	-64.1	178.3	0	0	0	110.3	K618 S636	K618-L620 HydrophobicContact CD-CD2 4.45Å; L620-S636 WeakPolarHBondContact CB-OG 3.11Å; L620-S636 PolarHBondContact N-O 2.82Å
621	E	75.1	Confident	71.6	Confident	121 Å²	121	58.1 Å²	58.1	57%	0.565	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	150.6	-171.8	-63.6	-177.7	-175.8	0	0	111.7	V597 L623 S636	V597-E621 HydrophobicContact CG2-CG 4.35Å; E621-L623 PolarHBondContact O-N 2.92Å; E621-S636 PolarHBondContact N-OG 2.98Å; E621-S636 VanDerWaalsContact N-OG 3.08Å; E621-S636 PolarHBondContact O-N 2.88Å; E621-S636 PolarHBondContact O-OG 2.82Å
622	A	71.3	Confident	71.3	Confident	15 Å²	15	55.9 Å²	55.9	12%	0.124	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	124.9	171.3	0	0	0	0	0	110.5	H624 I633 W635	A622-H624 PolarHBondContact O-CD2 2.93Å; A622-H624 PolarHBondContact O-N 3.48Å; A622-I633 HydrophobicContact CB-CG2 4.1Å; A622-W635 HydrophobicContact CB-CD2 4.01Å; A622-W635 HydrophobicContact CB-CE3 4.36Å; A622-W635 HydrophobicContact CB-CH2 4.26Å; A622-W635 HydrophobicContact CB-CZ2 3.89Å; A622-W635 HydrophobicContact CB-CZ3 4.48Å
623	L	68.8	Low	70.8	Confident	54 Å²	54	56.3 Å²	56.3	28%	0.283	32%	0.317	S	S	.	.			trans	-80.9	103.4	177.1	-73.2	155.1	0	0	0	108.5	K581 E621 S625 P634	K581-L623 HydrophobicContact CD-CD1 3.8Å; K581-L623 HydrophobicContact CG-CD1 3.91Å; E621-L623 PolarHBondContact O-N 2.92Å; L623-S625 VanDerWaalsContact C-N 3.31Å; L623-S625 PolarHBondContact O-N 2.72Å; L623-P634 HydrophobicContact CB-CB 4.43Å; L623-P634 HydrophobicContact CB-CG 4.25Å; L623-P634 PolarHBondContact N-O 3.17Å
624	H	61.8	Low	70.5	Confident	115 Å²	115	54 Å²	54	53%	0.532	31%	0.305	S	S	.	.			trans	-86.3	9.2	-176.6	-68.6	-64.3	0	0	0	114.9	K593 A622	K593-H624 WeakPolarHBondContact CE-NE2 3.43Å; K593-H624 PolarHBondContact NZ-CD2 2.82Å; K593-H624 PolarHBondContact NZ-NE2 3.12Å; A622-H624 PolarHBondContact O-CD2 2.93Å; A622-H624 PolarHBondContact O-N 3.48Å
625	S	53.1	Low	70	Confident	86 Å²	86	54.3 Å²	54.3	60%	0.601	31%	0.307	S	S	*	.			trans	-89.7	-12.9	-168.2	60.4	0	0	0	0	115.7	L623 P627	L623-S625 VanDerWaalsContact C-N 3.31Å; L623-S625 PolarHBondContact O-N 2.72Å; S625-P627 WeakPolarHBondContact O-CD 3.07Å
626	D	52.2	Low	69.6	Low	77 Å²	77	54 Å²	54	41%	0.412	31%	0.308	S	S	.	.			trans	-100.7	111.2	-171.3	-66.4	-15.6	0	0	0	110.7	K581 S628	K581-D626 IonicContact NZ-OD2 3.81Å; K581-D626 PolarHBondContact NZ-OD2 2.89Å; D626-S628 PolarHBondContact O-N 2.88Å
627	P	49.9	Very low	69.4	Low	132 Å²	132	55.1 Å²	55.1	86%	0.857	32%	0.315	S	S	*	.			trans	-81.8	30.7	-174.8	35.3	-36.2	0	0	0	113.3	S625	S625-P627 WeakPolarHBondContact O-CD 3.07Å
628	S	46	Very low	69.3	Low	56 Å²	56	55 Å²	55	39%	0.392	32%	0.319	S	S	.	.			trans	-68.8	146.2	170.5	50.8	0	0	0	0	109.7	D626 A630	D626-S628 PolarHBondContact O-N 2.88Å; S628-A630 PolarHBondContact O-N 3.36Å; S628-A630 VanDerWaalsContact OG-CB 3.25Å; S628-A630 WeakPolarHBondContact OG-CB 3.44Å
629	P	46.6	Very low	69.4	Low	128 Å²	128	57 Å²	57	83%	0.831	33%	0.328	S	S	*	.			trans	-68.7	34.2	169.1	32.7	-36.1	0	0	0	111.6	Q631	P629-Q631 PolarHBondContact O-N 2.78Å; P629-Q631 VanDerWaalsContact O-N 3.08Å
630	A	54	Low	69.7	Low	41 Å²	41	61.4 Å²	61.4	34%	0.339	35%	0.348	S	S	.	.			trans	-69.2	113.2	-169.3	0	0	0	0	0	108.6	S628 V632	S628-A630 PolarHBondContact O-N 3.36Å; S628-A630 VanDerWaalsContact OG-CB 3.25Å; S628-A630 WeakPolarHBondContact OG-CB 3.44Å; A630-V632 VanDerWaalsContact CB-O 3.31Å; A630-V632 WeakPolarHBondContact CB-O 3.21Å; A630-V632 PolarHBondContact O-N 3.01Å
631	Q	68.1	Low	70.2	Confident	81 Å²	81	59.8 Å²	59.8	38%	0.379	34%	0.338	S	S	.	.	S	Bend	trans	-57.5	-2.2	164.9	-71	160	-42	0	0	112.3	E547 I549 P587 P629	E547-Q631 PolarHBondContact OE1-NE2 2.79Å; I549-Q631 HydrophobicContact CD1-CB 4.06Å; I549-Q631 HydrophobicContact CG1-CB 4.4Å; I549-Q631 HydrophobicContact CG2-CB 4.06Å; I549-Q631 VanDerWaalsContact CG2-OE1 3.3Å; P587-Q631 WeakPolarHBondContact CB-O 3.18Å; P587-Q631 VanDerWaalsContact CD-O 3.26Å; P587-Q631 WeakPolarHBondContact CD-O 3.41Å; P587-Q631 VanDerWaalsContact CG-O 3.27Å; P587-Q631 WeakPolarHBondContact CG-O 3.07Å; P629-Q631 PolarHBondContact O-N 2.78Å; P629-Q631 VanDerWaalsContact O-N 3.08Å
632	V	72.6	Confident	71	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.03	33%	0.332	C	S	.	.	S	Bend	trans	-130.9	136	-179.8	-158.5	0	0	0	0	110.2	I549 L551 L574 Y583 L584 F585 A630	I549-V632 HydrophobicContact CG2-CG2 4.31Å; L551-V632 HydrophobicContact CD2-CG2 3.55Å; L574-V632 HydrophobicContact CD1-CG1 4.06Å; Y583-V632 HydrophobicContact CD1-CB 4.48Å; Y583-V632 HydrophobicContact CD1-CG1 4.26Å; Y583-V632 HydrophobicContact CG-CG1 4.38Å; L584-V632 WeakPolarHBondContact O-CG1 3.09Å; F585-V632 HydrophobicContact CB-CG1 4.34Å; A630-V632 VanDerWaalsContact CB-O 3.31Å; A630-V632 WeakPolarHBondContact CB-O 3.21Å; A630-V632 PolarHBondContact O-N 3.01Å
633	I	73.8	Confident	71.9	Confident	10 Å²	10	58.5 Å²	58.5	5%	0.051	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.9	-173.9	-57.8	155.7	0	0	0	109.1	Y583 L584 P587 K590 A622 W635	Y583-I633 WeakPolarHBondContact CA-O 3.31Å; L584-I633 PolarHBondContact N-O 3.23Å; L584-I633 PolarHBondContact O-N 2.84Å; P587-I633 HydrophobicContact CB-CD1 4.3Å; P587-I633 HydrophobicContact CB-CG1 4.41Å; P587-I633 WeakPolarHBondContact O-CD1 3.37Å; K590-I633 HydrophobicContact CD-CD1 4.09Å; K590-I633 HydrophobicContact CG-CD1 3.35Å; K590-I633 HydrophobicContact CG-CG1 4.21Å; A622-I633 HydrophobicContact CB-CG2 4.1Å; I633-W635 VanDerWaalsContact O-CD1 3.31Å
634	P	81.1	Confident	72.9	Confident	14 Å²	14	59.8 Å²	59.8	9%	0.091	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	137.4	170.8	29	-31.1	0	0	0	110.9	K581 A582 Y583 L623	K581-P634 HydrophobicContact CD-CB 4.22Å; A582-P634 CarbonylContact O-C 3.52Å; A582-P634 WeakPolarHBondContact O-CA 3.04Å; Y583-P634 HydrophobicContact CD1-CB 4.09Å; Y583-P634 HydrophobicContact CE1-CB 3.76Å; Y583-P634 HydrophobicContact CE1-CG 4.47Å; L623-P634 HydrophobicContact CB-CB 4.43Å; L623-P634 HydrophobicContact CB-CG 4.25Å; L623-P634 PolarHBondContact N-O 3.17Å
635	W	78.6	Confident	74	Confident	7 Å²	7	54.3 Å²	54.3	3%	0.027	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.8	175.2	-73.8	68.6	0	0	0	109.7	K581 A582 L584 L596 L619 A622 I633	K581-W635 WeakPolarHBondContact CA-O 3.43Å; A582-W635 PolarHBondContact N-O 3.01Å; A582-W635 PolarHBondContact O-N 3.28Å; L584-W635 HydrophobicContact CD1-CD2 3.91Å; L584-W635 VanDerWaalsContact CD1-CE2 3.49Å; L584-W635 HydrophobicContact CD1-CG 4.13Å; L584-W635 HydrophobicContact CD1-CZ2 3.9Å; L584-W635 HydrophobicContact CG-CD2 4.48Å; L584-W635 HydrophobicContact CG-CG 4.17Å; L596-W635 HydrophobicContact CB-CZ3 4.48Å; L596-W635 HydrophobicContact CD1-CH2 3.83Å; L596-W635 HydrophobicContact CD1-CZ3 4.23Å; L596-W635 HydrophobicContact CD2-CZ3 4.32Å; L619-W635 HydrophobicContact CD1-CB 3.52Å; L619-W635 HydrophobicContact CD1-CD2 4.28Å; L619-W635 HydrophobicContact CD1-CE3 4.11Å; L619-W635 HydrophobicContact CD1-CG 4.08Å; L619-W635 HydrophobicContact CD2-CD2 4.39Å; L619-W635 HydrophobicContact CD2-CE3 3.99Å; L619-W635 HydrophobicContact CD2-CZ3 4.39Å; L619-W635 HydrophobicContact CG-CB 4.48Å; L619-W635 HydrophobicContact CG-CD2 4.4Å; L619-W635 HydrophobicContact CG-CE3 3.82Å; L619-W635 HydrophobicContact CG-CZ3 4.49Å; A622-W635 HydrophobicContact CB-CD2 4.01Å; A622-W635 HydrophobicContact CB-CE3 4.36Å; A622-W635 HydrophobicContact CB-CH2 4.26Å; A622-W635 HydrophobicContact CB-CZ2 3.89Å; A622-W635 HydrophobicContact CB-CZ3 4.48Å; I633-W635 VanDerWaalsContact O-CD1 3.31Å
636	S	82.2	Confident	75.3	Confident	30 Å²	30	51.4 Å²	51.4	21%	0.21	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	142.9	171.3	56.3	0	0	0	0	109.9	L620 E621	L620-S636 WeakPolarHBondContact CB-OG 3.11Å; L620-S636 PolarHBondContact N-O 2.82Å; E621-S636 PolarHBondContact N-OG 2.98Å; E621-S636 VanDerWaalsContact N-OG 3.08Å; E621-S636 PolarHBondContact O-N 2.88Å; E621-S636 PolarHBondContact O-OG 2.82Å
637	V	84.6	Confident	76	Confident	24 Å²	24	54.2 Å²	54.2	15%	0.145	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.1	-174.7	-162.7	0	0	0	0	107.9	W575 A582 Y617 K618	W575-V637 HydrophobicContact CH2-CG1 4.33Å; W575-V637 HydrophobicContact CZ3-CG1 4.39Å; W575-V637 HydrophobicContact CZ3-CG2 4.24Å; A582-V637 HydrophobicContact CB-CG2 3.53Å; Y617-V637 VanDerWaalsContact CB-CG1 3.46Å; Y617-V637 HydrophobicContact CD1-CG1 3.7Å; Y617-V637 HydrophobicContact CG-CG1 3.94Å; K618-V637 WeakPolarHBondContact O-CA 3.3Å
638	S	86.2	Confident	77.1	Confident	29 Å²	29	52.5 Å²	52.5	20%	0.203	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.2	173.2	52	0	0	0	0	110	Y617 K618 Q640	Y617-S638 CarbonylContact C-O 3.58Å; Y617-S638 WeakPolarHBondContact CA-O 3.34Å; K618-S638 PolarHBondContact N-O 3.15Å; K618-S638 PolarHBondContact O-N 2.86Å; K618-S638 PolarHBondContact O-OG 2.73Å; S638-Q640 PolarHBondContact O-N 3.45Å; S638-Q640 PolarHBondContact O-NE2 2.87Å; S638-Q640 PolarHBondContact OG-NE2 3Å; S638-Q640 VanDerWaalsContact OG-NE2 3.08Å
639	K	88.9	Confident	78.2	Confident	104 Å²	104	59.4 Å²	59.4	45%	0.452	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	125.9	174.3	-172.1	168.7	172.7	174.9	0	109.6	E615 S616 Y617 T642	E615-K639 IonicContact OE1-NZ 3.63Å; E615-K639 PolarHBondContact OE1-NZ 2.8Å; S616-K639 CarbonylContact O-C 3.47Å; S616-K639 WeakPolarHBondContact O-CA 3.45Å; Y617-K639 HydrophobicContact CD1-CB 4.14Å; Y617-K639 HydrophobicContact CD1-CG 4.47Å; Y617-K639 HydrophobicContact CE1-CB 3.93Å; Y617-K639 HydrophobicContact CE1-CD 4.24Å; Y617-K639 HydrophobicContact CE1-CG 4.05Å; K639-T642 WeakPolarHBondContact CE-OG1 2.99Å; K639-T642 PolarHBondContact NZ-OG1 2.91Å
640	Q	89.2	Confident	79.4	Confident	95 Å²	95	55.1 Å²	55.1	44%	0.444	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-54.5	-174.9	-62.6	-64	-54.1	0	0	111.6	Y603 S616 K618 S638	Y603-Q640 HydrophobicContact CD1-CG 4.15Å; Y603-Q640 HydrophobicContact CE1-CG 4.08Å; S616-Q640 PolarHBondContact O-N 3.13Å; S616-Q640 WeakPolarHBondContact OG-CB 3.31Å; K618-Q640 HydrophobicContact CB-CG 3.71Å; S638-Q640 PolarHBondContact O-N 3.45Å; S638-Q640 PolarHBondContact O-NE2 2.87Å; S638-Q640 PolarHBondContact OG-NE2 3Å; S638-Q640 VanDerWaalsContact OG-NE2 3.08Å
641	F	91.1	Very high	80.8	Confident	31 Å²	31	53.9 Å²	53.9	14%	0.136	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	163.9	174.8	72.3	-102.9	0	0	0	112.1	L605 S616 L643 G739 I740 T741 G742	L605-F641 HydrophobicContact CD1-CE2 4.2Å; L605-F641 HydrophobicContact CD1-CZ 3.83Å; S616-F641 PolarHBondContact N-O 3.04Å; S616-F641 WeakPolarHBondContact OG-CD1 3.43Å; S616-F641 WeakPolarHBondContact OG-CE1 3.45Å; S616-F641 WeakPolarHBondContact OG-CG 3.46Å; S616-F641 PolarHBondContact OG-N 3.08Å; F641-L643 HydrophobicContact CD2-CB 4.07Å; F641-L643 HydrophobicContact CE2-CB 3.97Å; F641-G739 WeakPolarHBondContact CE1-O 3.12Å; F641-I740 WeakPolarHBondContact CD1-O 2.98Å; F641-I740 WeakPolarHBondContact CE1-O 3.45Å; F641-T741 VanDerWaalsContact CD1-C 3.47Å; F641-G742 VanDerWaalsContact CZ-CA 3.45Å
642	T	91.5	Very high	81.6	Confident	69 Å²	69	52.2 Å²	52.2	42%	0.423	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.6	166.7	-57.5	0	0	0	0	107.8	L613 A614 E615 K639	L613-T642 HydrophobicContact CD2-CG2 4.27Å; A614-T642 WeakPolarHBondContact O-CA 3.39Å; E615-T642 HydrophobicContact CG-CG2 4.1Å; K639-T642 WeakPolarHBondContact CE-OG1 2.99Å; K639-T642 PolarHBondContact NZ-OG1 2.91Å
643	L	89.9	Confident	82.2	Confident	40 Å²	40	52.4 Å²	52.4	21%	0.209	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	121.5	177.8	-178.1	66.4	0	0	0	107.8	A614 F641 L645 F737	A614-L643 HydrophobicContact CB-CB 4.34Å; A614-L643 PolarHBondContact N-O 2.78Å; A614-L643 PolarHBondContact O-N 2.76Å; F641-L643 HydrophobicContact CD2-CB 4.07Å; F641-L643 HydrophobicContact CE2-CB 3.97Å; L643-L645 HydrophobicContact CD2-CD2 3.56Å; L643-L645 HydrophobicContact CD2-CG 4.46Å; L643-L645 HydrophobicContact CG-CD2 4.01Å; L643-L645 PolarHBondContact O-N 3.31Å; L643-F737 HydrophobicContact CD2-CD1 4.46Å; L643-F737 HydrophobicContact CD2-CD2 3.96Å; L643-F737 HydrophobicContact CD2-CE2 4.21Å; L643-F737 HydrophobicContact CD2-CG 4.08Å
644	N	90.2	Very high	82.8	Confident	81 Å²	81	54 Å²	54	43%	0.433	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	108.7	168.4	-170.9	12.3	0	0	0	108.5	G612 L613 T646	G612-N644 PolarHBondContact O-OD1 3.27Å; L613-N644 HydrophobicContact CD2-CB 4.17Å; N644-T646 VanDerWaalsContact C-N 3.34Å; N644-T646 PolarHBondContact ND2-O 3.08Å; N644-T646 PolarHBondContact OD1-N 3.3Å; N644-T646 PolarHBondContact OD1-OG1 3.5Å
645	L	84.9	Confident	83	Confident	1 Å²	1	55 Å²	55	1%	0.005	29%	0.292	C	S	.	.	S	Bend	trans	-79.1	-24.1	179.6	-65.4	172.8	0	0	0	111.3	V607 G612 A614 L643 I647 I653 A701 I703 L735 F737	V607-L645 HydrophobicContact CG1-CD1 4.06Å; G612-L645 WeakPolarHBondContact O-CB 3.44Å; G612-L645 PolarHBondContact O-N 3.23Å; A614-L645 HydrophobicContact CB-CD1 3.75Å; A614-L645 HydrophobicContact CB-CG 4.02Å; L643-L645 HydrophobicContact CD2-CD2 3.56Å; L643-L645 HydrophobicContact CD2-CG 4.46Å; L643-L645 HydrophobicContact CG-CD2 4.01Å; L643-L645 PolarHBondContact O-N 3.31Å; L645-I647 VanDerWaalsContact C-N 3.3Å; L645-I647 PolarHBondContact O-N 2.69Å; L645-I647 VanDerWaalsContact O-N 3.09Å; L645-I653 HydrophobicContact CB-CD1 3.97Å; L645-I653 HydrophobicContact CB-CG1 4.34Å; L645-I653 HydrophobicContact CD1-CD1 3.55Å; L645-I653 HydrophobicContact CD1-CG1 4.45Å; L645-I653 HydrophobicContact CG-CD1 4.38Å; L645-A701 HydrophobicContact CD1-CB 4.14Å; L645-A701 HydrophobicContact CD2-CB 4.43Å; L645-I703 HydrophobicContact CB-CD1 4.44Å; L645-I703 VanDerWaalsContact O-CD1 3.23Å; L645-I703 WeakPolarHBondContact O-CD1 3.5Å; L645-L735 HydrophobicContact CD2-CD2 3.8Å; L645-F737 HydrophobicContact CD1-CE1 4.46Å; L645-F737 HydrophobicContact CD2-CD1 4.23Å; L645-F737 HydrophobicContact CD2-CE1 3.82Å; L645-F737 HydrophobicContact CD2-CZ 4.25Å
646	T	79.1	Confident	83.4	Confident	25 Å²	25	56.3 Å²	56.3	15%	0.153	30%	0.298	C	S	.	.			trans	-86.6	74	175.9	48.5	0	0	0	0	109.9	N644 E648 S651	N644-T646 VanDerWaalsContact C-N 3.34Å; N644-T646 PolarHBondContact ND2-O 3.08Å; N644-T646 PolarHBondContact OD1-N 3.3Å; N644-T646 PolarHBondContact OD1-OG1 3.5Å; T646-E648 PolarHBondContact O-N 2.92Å; T646-S651 WeakPolarHBondContact CA-OG 3.38Å; T646-S651 WeakPolarHBondContact CB-OG 3.39Å; T646-S651 VanDerWaalsContact CG2-O 3.24Å; T646-S651 WeakPolarHBondContact CG2-O 3.49Å; T646-S651 WeakPolarHBondContact CG2-OG 3.44Å
647	I	68.4	Low	83.6	Confident	135 Å²	135	57.6 Å²	57.6	69%	0.692	30%	0.301	S	S	*	.			trans	-60.9	-36.4	-177.4	-57.6	172	0	0	0	111.1	L645	L645-I647 VanDerWaalsContact C-N 3.3Å; L645-I647 PolarHBondContact O-N 2.69Å; L645-I647 VanDerWaalsContact O-N 3.09Å
648	E	72	Confident	83.6	Confident	97 Å²	97	60.1 Å²	60.1	45%	0.453	31%	0.312	S	S	.	.	S	Bend	trans	-104.4	136.4	-178.7	-70	-178	-154.6	0	0	110.4	T646 G650 S651 L705	T646-E648 PolarHBondContact O-N 2.92Å; E648-G650 PolarHBondContact O-N 2.81Å; E648-S651 WeakPolarHBondContact O-CB 3.07Å; E648-S651 PolarHBondContact O-N 3.29Å; E648-S651 PolarHBondContact O-OG 3.47Å; E648-L705 HydrophobicContact CB-CD2 3.57Å; E648-L705 HydrophobicContact CG-CD2 4.29Å; E648-L705 VanDerWaalsContact OE2-CD1 3.3Å; E648-L705 WeakPolarHBondContact OE2-CD1 3.48Å; E648-L705 WeakPolarHBondContact OE2-CD2 3.46Å
649	E	69.7	Low	83	Confident	200 Å²	200	59.4 Å²	59.4	94%	0.935	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	130.2	176	-66.8	-173.9	172.7	0	0	110.2
650	G	71.9	Confident	81.6	Confident	38 Å²	38	59.4 Å²	59.4	39%	0.392	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	-3.9	-176	0	0	0	0	0	115.2	E648 K706	E648-G650 PolarHBondContact O-N 2.81Å; G650-K706 WeakPolarHBondContact O-CA 3Å; G650-K706 WeakPolarHBondContact O-CB 3.41Å; G650-K706 VanDerWaalsContact O-CG 3.25Å; G650-K706 WeakPolarHBondContact O-CG 3.47Å; G650-K706 PolarHBondContact O-N 3.35Å
651	S	83	Confident	79.7	Confident	15 Å²	15	59.5 Å²	59.5	11%	0.105	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	149.9	172.7	58.1	0	0	0	0	112.8	T646 E648 R704	T646-S651 WeakPolarHBondContact CA-OG 3.38Å; T646-S651 WeakPolarHBondContact CB-OG 3.39Å; T646-S651 VanDerWaalsContact CG2-O 3.24Å; T646-S651 WeakPolarHBondContact CG2-O 3.49Å; T646-S651 WeakPolarHBondContact CG2-OG 3.44Å; E648-S651 WeakPolarHBondContact O-CB 3.07Å; E648-S651 PolarHBondContact O-N 3.29Å; E648-S651 PolarHBondContact O-OG 3.47Å; S651-R704 CarbonylContact C-O 3.48Å; S651-R704 VanDerWaalsContact CA-O 3.25Å; S651-R704 WeakPolarHBondContact CA-O 3.3Å
652	E	85.4	Confident	77.1	Confident	47 Å²	47	59.7 Å²	59.7	22%	0.22	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.7	173.5	71.1	169.8	-173.1	0	0	111.6	V654 I703 R704 K706	E652-V654 HydrophobicContact CG-CG2 4.14Å; E652-V654 PolarHBondContact O-N 3.38Å; E652-I703 WeakPolarHBondContact O-CA 3.37Å; E652-R704 HydrophobicContact CG-CB 4.4Å; E652-R704 PolarHBondContact N-O 2.86Å; E652-R704 PolarHBondContact O-N 2.85Å; E652-R704 IonicContact OE1-CZ 2.62Å; E652-R704 IonicContact OE1-NE 2.88Å; E652-R704 IonicContact OE1-NH1 2.9Å; E652-R704 PolarHBondContact OE1-NH1 2.93Å; E652-R704 IonicContact OE1-NH2 3.29Å; E652-R704 PolarHBondContact OE1-NH2 3.27Å; E652-K706 VanDerWaalsContact CD-CE 3.41Å; E652-K706 HydrophobicContact CG-CG 4.38Å; E652-K706 WeakPolarHBondContact OE2-CE 3.4Å; E652-K706 IonicContact OE2-NZ 2.65Å; E652-K706 PolarHBondContact OE2-NZ 3.19Å
653	I	85.7	Confident	74.2	Confident	9 Å²	9	58.5 Å²	58.5	5%	0.046	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	112.5	172.7	-56.6	170.7	0	0	0	107.8	V607 R609 L645 F656	V607-I653 HydrophobicContact CG1-CD1 3.89Å; R609-I653 HydrophobicContact CG-CG2 4.46Å; L645-I653 HydrophobicContact CB-CD1 3.97Å; L645-I653 HydrophobicContact CB-CG1 4.34Å; L645-I653 HydrophobicContact CD1-CD1 3.55Å; L645-I653 HydrophobicContact CD1-CG1 4.45Å; L645-I653 HydrophobicContact CG-CD1 4.38Å; I653-F656 HydrophobicContact CG2-CB 4.33Å
654	V	84.4	Confident	71.3	Confident	44 Å²	44	60.4 Å²	60.4	27%	0.267	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-43.7	-178.8	-178.4	0	0	0	0	111.1	E652 L702 R704 Y757	E652-V654 HydrophobicContact CG-CG2 4.14Å; E652-V654 PolarHBondContact O-N 3.38Å; V654-L702 HydrophobicContact CB-CD2 3.96Å; V654-L702 HydrophobicContact CG2-CD2 4.36Å; V654-L702 PolarHBondContact N-O 2.76Å; V654-R704 HydrophobicContact CG2-CB 3.42Å; V654-R704 VanDerWaalsContact CG2-CB 3.42Å; V654-R704 HydrophobicContact CG2-CG 4.41Å; V654-Y757 HydrophobicContact CB-CD2 4.49Å; V654-Y757 HydrophobicContact CG1-CD2 3.72Å; V654-Y757 HydrophobicContact CG1-CE2 4.38Å; V654-Y757 HydrophobicContact CG1-CG 4.5Å
655	D	85.5	Confident	68.4	Low	35 Å²	35	59.2 Å²	59.2	19%	0.187	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.7	177.2	-160.1	10.4	0	0	0	110.8	L702 L759	D655-L702 HydrophobicContact CB-CB 4.32Å; D655-L702 PolarHBondContact O-N 2.59Å; D655-L759 HydrophobicContact CB-CB 4.5Å; D655-L759 WeakPolarHBondContact OD2-CB 3.5Å
656	F	87.2	Confident	65.6	Low	33 Å²	33	61.8 Å²	61.8	15%	0.145	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	126.1	-178.8	177.7	-97.5	0	0	0	109.2	L605 V607 I653 M658 A699 V700 A701 F737	L605-F656 HydrophobicContact CD2-CE2 4.48Å; L605-F656 HydrophobicContact CD2-CZ 3.74Å; V607-F656 HydrophobicContact CG1-CD2 4.48Å; V607-F656 HydrophobicContact CG2-CD1 4.4Å; V607-F656 HydrophobicContact CG2-CD2 4.38Å; V607-F656 HydrophobicContact CG2-CE1 3.92Å; V607-F656 HydrophobicContact CG2-CE2 3.93Å; V607-F656 HydrophobicContact CG2-CZ 3.68Å; I653-F656 HydrophobicContact CG2-CB 4.33Å; F656-M658 HydrophobicContact CE1-CG 3.57Å; F656-M658 HydrophobicContact CE1-SD 3.96Å; F656-M658 HydrophobicContact CZ-CG 3.56Å; F656-M658 HydrophobicContact CZ-SD 3.96Å; F656-A699 HydrophobicContact CE2-CB 3.94Å; F656-A699 HydrophobicContact CZ-CB 3.82Å; F656-V700 WeakPolarHBondContact CA-O 2.97Å; F656-A701 HydrophobicContact CD2-CB 4.09Å; F656-F737 AromaticContact CE2-CE1 3.97Å; F656-F737 HydrophobicContact CE2-CE1 3.97Å; F656-F737 AromaticContact CE2-CZ 3.75Å; F656-F737 HydrophobicContact CE2-CZ 3.75Å; F656-F737 HydrophobicContact CZ-CZ 4.36Å
657	Q	86.5	Confident	63.4	Low	58 Å²	58	68.9 Å²	68.9	27%	0.271	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	143.8	176.2	-68.3	-160.7	1.4	0	0	111.5	V700 L759 I760 V761	Q657-V700 PolarHBondContact N-O 2.89Å; Q657-V700 PolarHBondContact O-N 2.92Å; Q657-L759 HydrophobicContact CB-CD2 4.2Å; Q657-L759 HydrophobicContact CG-CD2 4.26Å; Q657-L759 HydrophobicContact CG-CG 4.38Å; Q657-L759 PolarHBondContact NE2-O 3.32Å; Q657-L759 PolarHBondContact OE1-O 3.35Å; Q657-I760 VanDerWaalsContact OE1-CA 3.3Å; Q657-V761 HydrophobicContact CB-CG2 3.97Å
658	M	84.9	Confident	61.3	Low	77 Å²	77	66.7 Å²	66.7	38%	0.379	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153.1	164.8	-65.7	-176.2	71	0	0	107.6	L605 F656 H660 A699	L605-M658 HydrophobicContact CB-SD 4.31Å; L605-M658 HydrophobicContact CD2-CE 4.15Å; L605-M658 HydrophobicContact CD2-SD 3.83Å; F656-M658 HydrophobicContact CE1-CG 3.57Å; F656-M658 HydrophobicContact CE1-SD 3.96Å; F656-M658 HydrophobicContact CZ-CG 3.56Å; F656-M658 HydrophobicContact CZ-SD 3.96Å; M658-H660 PolarHBondContact O-N 3.31Å; M658-A699 HydrophobicContact CE-CB 4.37Å; M658-A699 HydrophobicContact CG-CB 3.83Å; M658-A699 HydrophobicContact SD-CB 4.47Å
659	K	74.7	Confident	59	Low	13 Å²	13	66.2 Å²	66.2	6%	0.057	37%	0.374	C	S	.	.			trans	-57.4	125.1	174.9	-170.7	172.1	178.6	172.4	0	109.5	L661 A674 I698 E763	K659-L661 PolarHBondContact O-N 3.25Å; K659-A674 HydrophobicContact CD-CB 4.12Å; K659-A674 HydrophobicContact CG-CB 4.31Å; K659-I698 HydrophobicContact CB-CG2 4.28Å; K659-I698 PolarHBondContact N-O 3.21Å; K659-E763 PolarHBondContact NZ-O 3.1Å
660	H	59.2	Low	56.9	Low	105 Å²	105	61.3 Å²	61.3	49%	0.486	35%	0.353	S	S	.	.			trans	-59.8	126.4	-176	-156.9	-103.4	0	0	0	110.4	M658 D662 A674 A675	M658-H660 PolarHBondContact O-N 3.31Å; H660-D662 IonicContact CE1-OD1 2.92Å; H660-D662 PolarHBondContact CE1-OD1 2.7Å; H660-D662 IonicContact CE1-OD2 2.83Å; H660-D662 IonicContact CG-OD2 2.89Å; H660-D662 IonicContact ND1-OD1 3.23Å; H660-D662 PolarHBondContact ND1-OD1 2.77Å; H660-D662 IonicContact ND1-OD2 3.08Å; H660-D662 PolarHBondContact ND1-OD2 2.66Å; H660-A674 WeakPolarHBondContact O-CA 3.1Å; H660-A675 PolarHBondContact O-N 3.04Å; H660-A675 VanDerWaalsContact O-N 3.12Å
661	L	48.3	Very low	54.8	Low	97 Å²	97	65.1 Å²	65.1	51%	0.508	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	87.8	174.8	-99.2	141.7	0	0	0	107.6	K659 I672	K659-L661 PolarHBondContact O-N 3.25Å; L661-I672 HydrophobicContact CD2-CG2 3.99Å
662	D	37.8	Very low	52.2	Low	34 Å²	34	67.2 Å²	67.2	18%	0.182	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	124.4	172.6	-75.9	-53.3	0	0	0	111.5	H660 F664	H660-D662 IonicContact CE1-OD1 2.92Å; H660-D662 PolarHBondContact CE1-OD1 2.7Å; H660-D662 IonicContact CE1-OD2 2.83Å; H660-D662 IonicContact CG-OD2 2.89Å; H660-D662 IonicContact ND1-OD1 3.23Å; H660-D662 PolarHBondContact ND1-OD1 2.77Å; H660-D662 IonicContact ND1-OD2 3.08Å; H660-D662 PolarHBondContact ND1-OD2 2.66Å; D662-F664 HydrophobicContact CB-CD2 3.54Å; D662-F664 HydrophobicContact CB-CE2 3.48Å; D662-F664 VanDerWaalsContact CB-CE2 3.48Å; D662-F664 PolarHBondContact O-N 2.85Å
663	V	29.8	Very low	49.6	Very low	44 Å²	44	69.3 Å²	69.3	27%	0.267	38%	0.379	S	S	.	.			trans	-86.6	87.4	172.1	-174.7	0	0	0	0	108.7
664	F	29.3	Very low	47.8	Very low	80 Å²	80	69.6 Å²	69.6	35%	0.351	38%	0.383	S	S	.	.			trans	-91.6	128.6	170.1	-80.2	-79.9	0	0	0	111.3	D662 P918	D662-F664 HydrophobicContact CB-CD2 3.54Å; D662-F664 HydrophobicContact CB-CE2 3.48Å; D662-F664 VanDerWaalsContact CB-CE2 3.48Å; D662-F664 PolarHBondContact O-N 2.85Å; F664-P918 HydrophobicContact CE1-CG 3.82Å; F664-P918 HydrophobicContact CE2-CG 4.4Å; F664-P918 HydrophobicContact CZ-CG 3.46Å; F664-P918 VanDerWaalsContact CZ-CG 3.46Å
665	E	28.2	Very low	46.5	Very low	56 Å²	56	68.2 Å²	68.2	26%	0.262	38%	0.375	S	S	.	.			trans	-93.9	126.7	170.1	-74.3	177.7	163.8	0	0	110.6	Y514 K564	Y514-E665 WeakPolarHBondContact CE2-OE1 3.43Å; Y514-E665 WeakPolarHBondContact CE2-OE2 3.43Å; Y514-E665 PolarHBondContact OH-OE1 2.71Å; Y514-E665 PolarHBondContact OH-OE2 2.97Å; K564-E665 IonicContact NZ-OE1 3.73Å; K564-E665 PolarHBondContact NZ-OE1 3.26Å
666	C	27.2	Very low	45.9	Very low	55 Å²	55	69 Å²	69	37%	0.372	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-120.8	124.6	160.7	-71.7	0	0	0	0	108.3	G668	C666-G668 PolarHBondContact O-N 2.76Å
667	L	31.5	Very low	45.8	Very low	174 Å²	174	68.8 Å²	68.8	91%	0.911	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.8	72.1	162.2	-77.4	147.5	0	0	0	115.9	C669	L667-C669 PolarHBondContact O-N 2.71Å
668	G	24.9	Very low	45.9	Very low	90 Å²	90	71.7 Å²	71.7	93%	0.928	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	-4.5	160.9	0	0	0	0	0	117.5	C666	C666-G668 PolarHBondContact O-N 2.76Å
669	C	23.4	Very low	46.2	Very low	86 Å²	86	70.5 Å²	70.5	58%	0.581	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-112.8	121.7	174.2	-66.8	0	0	0	0	109.8	L667 E671	L667-C669 PolarHBondContact O-N 2.71Å; C669-E671 PolarHBondContact O-N 3.46Å
670	I	26.6	Very low	47	Very low	98 Å²	98	74.7 Å²	74.7	50%	0.503	41%	0.411	S	S	.	.			trans	-79	99.6	174.1	-60.1	168.4	0	0	0	107.6	K564 I672	K564-I670 HydrophobicContact CD-CD1 4.26Å; K564-I670 HydrophobicContact CD-CG2 4.47Å; I670-I672 HydrophobicContact CG2-CG1 4.46Å
671	E	26.6	Very low	48.5	Very low	117 Å²	117	70.3 Å²	70.3	55%	0.547	40%	0.395	S	S	.	.			trans	-110.8	122.1	166.3	-59.7	-168.1	139.4	0	0	109.9	C669 F673	C669-E671 PolarHBondContact O-N 3.46Å; E671-F673 HydrophobicContact CB-CD2 3.73Å; E671-F673 HydrophobicContact CB-CE2 3.13Å; E671-F673 HydrophobicContact CB-CZ 3.6Å; E671-F673 HydrophobicContact CG-CE2 3.98Å; E671-F673 HydrophobicContact CG-CZ 4.14Å; E671-F673 WeakPolarHBondContact OE2-CE2 3.45Å; E671-F673 WeakPolarHBondContact OE2-CZ 3.48Å
672	I	29.9	Very low	50.6	Low	60 Å²	60	69.2 Å²	69.2	31%	0.308	38%	0.384	S	S	.	.			trans	-90.7	107.2	179.5	-61	145.4	0	0	0	106.2	P562 L661 I670	P562-I672 HydrophobicContact CB-CB 4.22Å; P562-I672 HydrophobicContact CB-CD1 3.65Å; P562-I672 HydrophobicContact CB-CG1 3.71Å; P562-I672 HydrophobicContact CB-CG2 3.46Å; P562-I672 VanDerWaalsContact CB-CG2 3.46Å; P562-I672 HydrophobicContact CG-CD1 4.49Å; P562-I672 HydrophobicContact CG-CG2 4.42Å; L661-I672 HydrophobicContact CD2-CG2 3.99Å; I670-I672 HydrophobicContact CG2-CG1 4.46Å
673	F	29.3	Very low	53.2	Low	90 Å²	90	72.3 Å²	72.3	40%	0.395	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.6	178.1	-65.6	-64.3	0	0	0	111.1	E671 K676	E671-F673 HydrophobicContact CB-CD2 3.73Å; E671-F673 HydrophobicContact CB-CE2 3.13Å; E671-F673 HydrophobicContact CB-CZ 3.6Å; E671-F673 HydrophobicContact CG-CE2 3.98Å; E671-F673 HydrophobicContact CG-CZ 4.14Å; E671-F673 WeakPolarHBondContact OE2-CE2 3.45Å; E671-F673 WeakPolarHBondContact OE2-CZ 3.48Å; F673-K676 HydrophobicContact CB-CG 4.43Å
674	A	47.6	Very low	56	Low	16 Å²	16	71.7 Å²	71.7	13%	0.132	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.5	147.2	149.3	0	0	0	0	0	108.7	K659 H660 K676 P696	K659-A674 HydrophobicContact CD-CB 4.12Å; K659-A674 HydrophobicContact CG-CB 4.31Å; H660-A674 WeakPolarHBondContact O-CA 3.1Å; A674-K676 PolarHBondContact O-N 3.42Å; A674-K676 VanDerWaalsContact O-N 3.11Å; A674-P696 HydrophobicContact CB-CB 4.04Å
675	A	57.9	Low	58.5	Low	14 Å²	14	68.6 Å²	68.6	12%	0.116	39%	0.39	C	S	.	.	S	Bend	trans	-24.2	115	-177.6	0	0	0	0	0	112.7	H660 V677	H660-A675 PolarHBondContact O-N 3.04Å; H660-A675 VanDerWaalsContact O-N 3.12Å; A675-V677 WeakPolarHBondContact O-CG2 3.04Å; A675-V677 PolarHBondContact O-N 2.97Å
676	K	73.3	Confident	61.2	Low	52 Å²	52	70.7 Å²	70.7	23%	0.226	40%	0.403	C	S	.	.			trans	-51.3	137.9	-170.6	-78.3	167.2	174.3	176.6	0	110	F673 A674 E827 A829	F673-K676 HydrophobicContact CB-CG 4.43Å; A674-K676 PolarHBondContact O-N 3.42Å; A674-K676 VanDerWaalsContact O-N 3.11Å; K676-E827 WeakPolarHBondContact CD-O 3.4Å; K676-E827 PolarHBondContact NZ-O 2.83Å; K676-A829 WeakPolarHBondContact O-CB 3.49Å
677	V	85.3	Confident	64	Low	29 Å²	29	78.9 Å²	78.9	18%	0.176	43%	0.425	C	S	.	.			trans	-120.1	114.3	178	-173.4	0	0	0	0	107.4	A675 S679 L694 E763	A675-V677 WeakPolarHBondContact O-CG2 3.04Å; A675-V677 PolarHBondContact O-N 2.97Å; V677-S679 VanDerWaalsContact CG1-O 3.31Å; V677-S679 WeakPolarHBondContact CG1-O 3.21Å; V677-L694 HydrophobicContact CB-CD1 4.47Å; V677-L694 HydrophobicContact CG1-CD1 4.04Å; V677-L694 HydrophobicContact CG1-CD2 4.26Å; V677-L694 HydrophobicContact CG2-CD2 4.21Å; V677-E763 HydrophobicContact CG2-CB 4.4Å; V677-E763 HydrophobicContact CG2-CG 4.01Å
678	H	87.9	Confident	66.8	Low	119 Å²	119	71.9 Å²	71.9	55%	0.551	39%	0.391	S	S	*	.	S	Bend	trans	-69	-45.6	-178.3	178.4	-110.3	0	0	0	112.3	A829 I830	H678-A829 WeakPolarHBondContact CB-O 3.46Å; H678-I830 HydrophobicContact CB-CG1 4.14Å
679	S	90.9	Very high	70	Confident	51 Å²	51	69.7 Å²	69.7	36%	0.357	36%	0.36	S	S	.	.			trans	-111.2	125.7	-178.4	64.2	0	0	0	0	112.8	V677 G681 K692	V677-S679 VanDerWaalsContact CG1-O 3.31Å; V677-S679 WeakPolarHBondContact CG1-O 3.21Å; S679-G681 VanDerWaalsContact C-N 3.31Å; S679-K692 PolarHBondContact O-NZ 3.02Å
680	Q	91.3	Very high	73.3	Confident	101 Å²	101	66.1 Å²	66.1	47%	0.472	34%	0.335	S	S	.	.	S	Bend	trans	-73.9	-21.9	177.5	-61.3	-62.2	-35.3	0	0	113.1	K692	Q680-K692 WeakPolarHBondContact O-CB 3.37Å; Q680-K692 PolarHBondContact O-N 2.78Å
681	G	92.4	Very high	76.6	Confident	14 Å²	14	64.3 Å²	64.3	14%	0.144	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	167.4	-178.8	0	0	0	0	0	112	S679 L690	S679-G681 VanDerWaalsContact C-N 3.31Å; G681-L690 CarbonylContact C-O 3.57Å; G681-L690 VanDerWaalsContact CA-O 3.26Å; G681-L690 WeakPolarHBondContact CA-O 3.34Å
682	R	91.8	Very high	79.8	Confident	74 Å²	74	60 Å²	60	28%	0.279	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.8	176.1	-172.4	168.9	-174.2	179.3	-5.6	109.2	V689 L690 D853	R682-V689 WeakPolarHBondContact O-CA 3.44Å; R682-L690 PolarHBondContact N-O 2.87Å; R682-L690 PolarHBondContact O-N 2.77Å; R682-D853 IonicContact CZ-OD2 2.76Å; R682-D853 IonicContact NH1-OD1 2.87Å; R682-D853 IonicContact NH1-OD2 3.5Å; R682-D853 PolarHBondContact NH1-OD2 3.41Å; R682-D853 IonicContact NH2-OD2 3.49Å; R682-D853 PolarHBondContact NH2-OD2 2.88Å
683	V	92.2	Very high	82.9	Confident	99 Å²	99	57.7 Å²	57.7	60%	0.6	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	129	176.2	-176.4	0	0	0	0	108.8	S688	V683-S688 WeakPolarHBondContact CA-O 3.47Å
684	L	88.8	Confident	85.8	Confident	30 Å²	30	54.6 Å²	54.6	16%	0.157	28%	0.276	C	S	.	.			trans	-90.3	164.6	175.2	-59.4	-175.1	0	0	0	110.8	N686 R687 S688 L690 E885	L684-N686 WeakPolarHBondContact CB-OD1 3.4Å; L684-N686 PolarHBondContact O-N 2.78Å; L684-R687 WeakPolarHBondContact O-CA 3.5Å; L684-R687 PolarHBondContact O-N 2.8Å; L684-S688 WeakPolarHBondContact CD1-OG 3.46Å; L684-S688 PolarHBondContact N-O 2.85Å; L684-L690 HydrophobicContact CD1-CB 4.18Å; L684-L690 HydrophobicContact CD2-CB 4.08Å; L684-L690 HydrophobicContact CD2-CD2 4.49Å; L684-L690 HydrophobicContact CG-CB 4.14Å; L684-E885 WeakPolarHBondContact CA-OE1 3.24Å; L684-E885 WeakPolarHBondContact CB-OE1 3.46Å; L684-E885 WeakPolarHBondContact CD2-OE1 3.2Å
685	G	80.9	Confident	87.9	Confident	16 Å²	16	53.9 Å²	53.9	17%	0.165	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-36.9	-175.8	0	0	0	0	0	113.2	R687 E885	G685-R687 PolarHBondContact O-N 2.94Å; G685-E885 PolarHBondContact N-OE1 2.8Å
686	N	84.8	Confident	89.3	Confident	100 Å²	100	55 Å²	55	54%	0.535	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	8.9	174.8	68.4	-5.7	0	0	0	114.7	L684 S688	L684-N686 WeakPolarHBondContact CB-OD1 3.4Å; L684-N686 PolarHBondContact O-N 2.78Å; N686-S688 VanDerWaalsContact CG-OG 3.32Å; N686-S688 PolarHBondContact ND2-OG 2.9Å; N686-S688 PolarHBondContact O-N 2.93Å; N686-S688 VanDerWaalsContact OD1-CB 3.28Å; N686-S688 WeakPolarHBondContact OD1-CB 3.48Å; N686-S688 PolarHBondContact OD1-N 2.94Å; N686-S688 PolarHBondContact OD1-OG 2.83Å
687	R	86.3	Confident	90.1	Very high	226 Å²	226	54.6 Å²	54.6	85%	0.853	28%	0.277	S	S	*	.	S	Bend	trans	66.5	8.4	-175.4	-48.9	175.7	-178.8	175.8	-0.4	115.3	L684 G685	L684-R687 WeakPolarHBondContact O-CA 3.5Å; L684-R687 PolarHBondContact O-N 2.8Å; G685-R687 PolarHBondContact O-N 2.94Å
688	S	90.1	Very high	90.3	Very high	27 Å²	27	53.4 Å²	53.4	19%	0.189	27%	0.27	C	S	.	.			trans	-75.5	166.4	167.6	70.6	0	0	0	0	110.5	V683 L684 N686	V683-S688 WeakPolarHBondContact CA-O 3.47Å; L684-S688 WeakPolarHBondContact CD1-OG 3.46Å; L684-S688 PolarHBondContact N-O 2.85Å; N686-S688 VanDerWaalsContact CG-OG 3.32Å; N686-S688 PolarHBondContact ND2-OG 2.9Å; N686-S688 PolarHBondContact O-N 2.93Å; N686-S688 VanDerWaalsContact OD1-CB 3.28Å; N686-S688 WeakPolarHBondContact OD1-CB 3.48Å; N686-S688 PolarHBondContact OD1-N 2.94Å; N686-S688 PolarHBondContact OD1-OG 2.83Å
689	V	92.6	Very high	90.5	Very high	45 Å²	45	47.8 Å²	47.8	27%	0.273	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.4	-179.1	-177.8	0	0	0	0	108.8	R682 Y691 E789	R682-V689 WeakPolarHBondContact O-CA 3.44Å; V689-Y691 HydrophobicContact CB-CE2 4.28Å; V689-Y691 HydrophobicContact CG1-CD1 4.03Å; V689-Y691 HydrophobicContact CG1-CD2 4.44Å; V689-Y691 HydrophobicContact CG1-CE1 3.82Å; V689-Y691 HydrophobicContact CG1-CE2 4.24Å; V689-Y691 HydrophobicContact CG1-CG 4.36Å; V689-E789 WeakPolarHBondContact O-CA 3.44Å
690	L	93.7	Very high	90.7	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	106.4	170	-174.6	66.9	0	0	0	108.7	G681 R682 L684 Y786 Y808	G681-L690 CarbonylContact C-O 3.57Å; G681-L690 VanDerWaalsContact CA-O 3.26Å; G681-L690 WeakPolarHBondContact CA-O 3.34Å; R682-L690 PolarHBondContact N-O 2.87Å; R682-L690 PolarHBondContact O-N 2.77Å; L684-L690 HydrophobicContact CD1-CB 4.18Å; L684-L690 HydrophobicContact CD2-CB 4.08Å; L684-L690 HydrophobicContact CD2-CD2 4.49Å; L684-L690 HydrophobicContact CG-CB 4.14Å; L690-Y786 HydrophobicContact CB-CD1 4.45Å; L690-Y786 HydrophobicContact CD1-CD1 4.39Å; L690-Y786 HydrophobicContact CD1-CG 4.35Å; L690-Y786 HydrophobicContact CD2-CD1 3.54Å; L690-Y786 HydrophobicContact CD2-CD2 4.02Å; L690-Y786 HydrophobicContact CD2-CE1 3.62Å; L690-Y786 HydrophobicContact CD2-CE2 4.1Å; L690-Y786 HydrophobicContact CD2-CG 3.72Å; L690-Y786 HydrophobicContact CG-CD1 3.46Å; L690-Y786 VanDerWaalsContact CG-CD1 3.46Å; L690-Y786 HydrophobicContact CG-CE1 3.91Å; L690-Y786 HydrophobicContact CG-CG 3.82Å; L690-Y808 HydrophobicContact CD2-CE2 4.44Å
691	Y	95.3	Very high	90.7	Very high	60 Å²	60	40.5 Å²	40.5	24%	0.235	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	133.6	-176.9	-67.9	-76.2	0	0	0	111.6	V689 Y786 E787 G788 E789 Q791	V689-Y691 HydrophobicContact CB-CE2 4.28Å; V689-Y691 HydrophobicContact CG1-CD1 4.03Å; V689-Y691 HydrophobicContact CG1-CD2 4.44Å; V689-Y691 HydrophobicContact CG1-CE1 3.82Å; V689-Y691 HydrophobicContact CG1-CE2 4.24Å; V689-Y691 HydrophobicContact CG1-CG 4.36Å; Y691-Y786 CarbonylContact O-C 3.52Å; Y691-Y786 WeakPolarHBondContact O-CA 3.48Å; Y691-Y786 WeakPolarHBondContact O-CB 3.41Å; Y691-Y786 WeakPolarHBondContact O-CD1 3.35Å; Y691-E787 PolarHBondContact O-N 2.85Å; Y691-G788 PolarHBondContact N-O 2.94Å; Y691-E789 WeakPolarHBondContact CD2-O 3.35Å; Y691-E789 WeakPolarHBondContact CE2-O 3.45Å; Y691-Q791 HydrophobicContact CD1-CG 3.36Å; Y691-Q791 HydrophobicContact CD2-CG 3.55Å; Y691-Q791 HydrophobicContact CE1-CG 3.62Å; Y691-Q791 HydrophobicContact CE2-CG 3.81Å; Y691-Q791 HydrophobicContact CG-CG 3.29Å
692	K	94.2	Very high	90.7	Very high	28 Å²	28	39.9 Å²	39.9	12%	0.122	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	141.6	-179.3	-65.3	177.8	178.1	176.1	0	109.8	S679 Q680 L694 E763 N764 Y786	S679-K692 PolarHBondContact O-NZ 3.02Å; Q680-K692 WeakPolarHBondContact O-CB 3.37Å; Q680-K692 PolarHBondContact O-N 2.78Å; K692-L694 HydrophobicContact CB-CD1 4.22Å; K692-L694 HydrophobicContact CB-CD2 4.07Å; K692-L694 HydrophobicContact CB-CG 3.84Å; K692-L694 HydrophobicContact CD-CD2 4.39Å; K692-L694 PolarHBondContact O-N 2.77Å; K692-E763 IonicContact NZ-OE2 2.59Å; K692-E763 PolarHBondContact NZ-OE2 3.01Å; K692-N764 HydrophobicContact CB-CB 3.96Å; K692-N764 HydrophobicContact CD-CB 4.5Å; K692-N764 HydrophobicContact CG-CB 4.46Å; K692-Y786 HydrophobicContact CG-CD1 4.46Å; K692-Y786 HydrophobicContact CG-CE1 4.22Å
693	Y	93.7	Very high	90.7	Very high	10 Å²	10	36.8 Å²	36.8	4%	0.039	19%	0.186	C	C	.	.			trans	-79.7	102.2	170.1	-179.8	-102.6	0	0	0	109.7	N695 I698 V745 N764 M785 F797 L803 P805	Y693-N695 HydrophobicContact CD1-CB 4.32Å; Y693-N695 HydrophobicContact CE1-CB 3.59Å; Y693-N695 PolarHBondContact OH-ND2 2.85Å; Y693-I698 HydrophobicContact CE1-CD1 4.43Å; Y693-V745 HydrophobicContact CE1-CG1 4.28Å; Y693-N764 WeakPolarHBondContact O-CB 3.43Å; Y693-M785 HydrophobicContact CD1-CB 3.98Å; Y693-M785 HydrophobicContact CD1-SD 4.18Å; Y693-M785 HydrophobicContact CG-CB 4.25Å; Y693-M785 PolarHBondContact N-O 2.91Å; Y693-F797 HydrophobicContact CE2-CE2 4.3Å; Y693-F797 HydrophobicContact CE2-CZ 4.48Å; Y693-L803 HydrophobicContact CD2-CD2 3.81Å; Y693-L803 HydrophobicContact CD2-CG 4.42Å; Y693-L803 HydrophobicContact CE2-CB 4.15Å; Y693-L803 HydrophobicContact CE2-CD2 3.79Å; Y693-L803 HydrophobicContact CE2-CG 4.13Å; Y693-P805 HydrophobicContact CD1-CB 4.05Å; Y693-P805 HydrophobicContact CD1-CG 4.13Å; Y693-P805 HydrophobicContact CD2-CB 3.79Å; Y693-P805 HydrophobicContact CD2-CG 4.31Å; Y693-P805 HydrophobicContact CE1-CG 4.21Å; Y693-P805 HydrophobicContact CE2-CB 4.3Å; Y693-P805 HydrophobicContact CE2-CG 4.37Å; Y693-P805 HydrophobicContact CG-CB 3.64Å; Y693-P805 HydrophobicContact CG-CG 4.18Å
694	L	91	Very high	90.6	Very high	25 Å²	25	35 Å²	35	13%	0.131	17%	0.168	C	C	.	.			trans	-109.7	61.2	-172	-65.6	173.8	0	0	0	112.3	V677 K692 P696 E763 N764	V677-L694 HydrophobicContact CB-CD1 4.47Å; V677-L694 HydrophobicContact CG1-CD1 4.04Å; V677-L694 HydrophobicContact CG1-CD2 4.26Å; V677-L694 HydrophobicContact CG2-CD2 4.21Å; K692-L694 HydrophobicContact CB-CD1 4.22Å; K692-L694 HydrophobicContact CB-CD2 4.07Å; K692-L694 HydrophobicContact CB-CG 3.84Å; K692-L694 HydrophobicContact CD-CD2 4.39Å; K692-L694 PolarHBondContact O-N 2.77Å; L694-P696 VanDerWaalsContact O-CD 3.27Å; L694-P696 WeakPolarHBondContact O-CD 3.09Å; L694-E763 HydrophobicContact CD2-CB 4.42Å; L694-N764 HydrophobicContact CD2-CB 3.95Å
695	N	90.8	Very high	90.3	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.011	17%	0.169	C	C	.	.			trans	-71.7	115.3	172.3	-172	-15.3	0	0	0	110.3	Y693 N697 I698 D738 F797	Y693-N695 HydrophobicContact CD1-CB 4.32Å; Y693-N695 HydrophobicContact CE1-CB 3.59Å; Y693-N695 PolarHBondContact OH-ND2 2.85Å; N695-N697 PolarHBondContact O-N 2.8Å; N695-N697 PolarHBondContact OD1-N 2.85Å; N695-I698 HydrophobicContact CB-CB 4.26Å; N695-I698 WeakPolarHBondContact O-CG2 3.03Å; N695-D738 PolarHBondContact ND2-OD2 2.82Å; N695-F797 HydrophobicContact CB-CE1 3.82Å; N695-F797 HydrophobicContact CB-CE2 4.15Å; N695-F797 HydrophobicContact CB-CZ 3.45Å; N695-F797 VanDerWaalsContact CB-CZ 3.45Å; N695-F797 VanDerWaalsContact CG-CZ 3.42Å; N695-F797 VanDerWaalsContact OD1-CE1 3.25Å; N695-F797 WeakPolarHBondContact OD1-CE1 3.2Å
696	P	88.1	Confident	89.7	Confident	38 Å²	38	39.5 Å²	39.5	25%	0.247	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.6	178.5	29.9	-33.1	0	0	0	112.7	A674 L694 F797	A674-P696 HydrophobicContact CB-CB 4.04Å; L694-P696 VanDerWaalsContact O-CD 3.27Å; L694-P696 WeakPolarHBondContact O-CD 3.09Å; P696-F797 HydrophobicContact CG-CD1 4.19Å
697	N	89.5	Confident	88.6	Confident	42 Å²	42	39.8 Å²	39.8	23%	0.225	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	16.3	-173.5	-48.4	-52.3	0	0	0	112.5	N695 G739 I740 S799	N695-N697 PolarHBondContact O-N 2.8Å; N695-N697 PolarHBondContact OD1-N 2.85Å; N697-G739 WeakPolarHBondContact O-CA 3.17Å; N697-G739 PolarHBondContact O-N 2.9Å; N697-I740 HydrophobicContact CB-CD1 4.12Å; N697-I740 HydrophobicContact CB-CG1 4.02Å; N697-I740 WeakPolarHBondContact ND2-CD1 3.3Å; N697-S799 PolarHBondContact ND2-OG 3.3Å
698	I	90.7	Very high	86.8	Confident	5 Å²	5	37 Å²	37	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.4	-179.4	-164.6	164.4	0	0	0	111.1	K659 Y693 N695 A736 V761 M785	K659-I698 HydrophobicContact CB-CG2 4.28Å; K659-I698 PolarHBondContact N-O 3.21Å; Y693-I698 HydrophobicContact CE1-CD1 4.43Å; N695-I698 HydrophobicContact CB-CB 4.26Å; N695-I698 WeakPolarHBondContact O-CG2 3.03Å; I698-A736 HydrophobicContact CD1-CB 4.36Å; I698-V761 HydrophobicContact CG2-CG1 4.21Å; I698-M785 HydrophobicContact CD1-CE 3.59Å; I698-M785 HydrophobicContact CD1-SD 3.9Å
699	A	92.4	Very high	84.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141	174.4	0	0	0	0	0	109.2	L605 F656 M658 A736 F737	L605-A699 HydrophobicContact CD2-CB 4.02Å; F656-A699 HydrophobicContact CE2-CB 3.94Å; F656-A699 HydrophobicContact CZ-CB 3.82Å; M658-A699 HydrophobicContact CE-CB 4.37Å; M658-A699 HydrophobicContact CG-CB 3.83Å; M658-A699 HydrophobicContact SD-CB 4.47Å; A699-A736 WeakPolarHBondContact O-CA 3.25Å; A699-F737 HydrophobicContact CB-CD1 4.31Å; A699-F737 HydrophobicContact CB-CD2 4.17Å; A699-F737 HydrophobicContact CB-CE1 3.87Å; A699-F737 HydrophobicContact CB-CE2 3.72Å; A699-F737 HydrophobicContact CB-CG 4.45Å; A699-F737 HydrophobicContact CB-CZ 3.57Å; A699-F737 PolarHBondContact N-O 3.11Å; A699-F737 PolarHBondContact O-N 3.46Å; A699-F737 VanDerWaalsContact O-O 3.1Å
700	V	93.4	Very high	81.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	123.9	-179.5	-172.9	0	0	0	0	109.3	F656 Q657 V734 L735 A736 L759 V761 I766	F656-V700 WeakPolarHBondContact CA-O 2.97Å; Q657-V700 PolarHBondContact N-O 2.89Å; Q657-V700 PolarHBondContact O-N 2.92Å; V700-V734 HydrophobicContact CG1-CG1 3.73Å; V700-L735 WeakPolarHBondContact CA-O 2.91Å; V700-A736 HydrophobicContact CG2-CB 4.13Å; V700-L759 HydrophobicContact CB-CD2 4.11Å; V700-L759 HydrophobicContact CG1-CD1 3.94Å; V700-L759 HydrophobicContact CG1-CD2 3.86Å; V700-L759 HydrophobicContact CG1-CG 4.47Å; V700-V761 HydrophobicContact CB-CG2 3.74Å; V700-V761 HydrophobicContact CG2-CG1 4.39Å; V700-V761 HydrophobicContact CG2-CG2 3.49Å; V700-V761 VanDerWaalsContact CG2-CG2 3.49Å; V700-I766 HydrophobicContact CG1-CD1 4.36Å; V700-I766 HydrophobicContact CG1-CG2 4.27Å; V700-I766 HydrophobicContact CG2-CD1 3.64Å; V700-I766 HydrophobicContact CG2-CG1 4.17Å
701	A	92.7	Very high	79	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	134.8	176.5	0	0	0	0	0	110.4	L645 F656 I703 L735 F737	L645-A701 HydrophobicContact CD1-CB 4.14Å; L645-A701 HydrophobicContact CD2-CB 4.43Å; F656-A701 HydrophobicContact CD2-CB 4.09Å; A701-I703 HydrophobicContact CB-CG1 4.38Å; A701-L735 PolarHBondContact N-O 3.29Å; A701-L735 PolarHBondContact O-N 2.96Å; A701-F737 HydrophobicContact CB-CE1 4.25Å
702	L	92.2	Very high	76.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	111.7	169.6	-168	154.6	0	0	0	108.8	V654 D655 I732 V734 Y757	V654-L702 HydrophobicContact CB-CD2 3.96Å; V654-L702 HydrophobicContact CG2-CD2 4.36Å; V654-L702 PolarHBondContact N-O 2.76Å; D655-L702 HydrophobicContact CB-CB 4.32Å; D655-L702 PolarHBondContact O-N 2.59Å; L702-I732 HydrophobicContact CD2-CB 4.47Å; L702-I732 HydrophobicContact CD2-CG2 4.39Å; L702-V734 HydrophobicContact CG-CG2 4.46Å; L702-Y757 HydrophobicContact CD1-CG 4.48Å; L702-Y757 HydrophobicContact CD2-CD1 4.23Å; L702-Y757 HydrophobicContact CD2-CD2 4.48Å; L702-Y757 HydrophobicContact CD2-CG 4.04Å
703	I	91.8	Very high	73.9	Confident	10 Å²	10	59.4 Å²	59.4	5%	0.051	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.8	-173.4	-57.9	153	0	0	0	108.5	L645 E652 A701 I732 T733 L735	L645-I703 HydrophobicContact CB-CD1 4.44Å; L645-I703 VanDerWaalsContact O-CD1 3.23Å; L645-I703 WeakPolarHBondContact O-CD1 3.5Å; E652-I703 WeakPolarHBondContact O-CA 3.37Å; A701-I703 HydrophobicContact CB-CG1 4.38Å; I703-I732 CarbonylContact O-C 3.55Å; I703-I732 VanDerWaalsContact O-CA 3.29Å; I703-I732 WeakPolarHBondContact O-CA 3.13Å; I703-T733 PolarHBondContact N-O 3.32Å; I703-T733 PolarHBondContact O-N 3.06Å; I703-L735 HydrophobicContact CD1-CB 4.16Å; I703-L735 HydrophobicContact CD1-CD2 4.36Å
704	R	89.1	Confident	71.4	Confident	60 Å²	60	65.3 Å²	65.3	23%	0.226	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.8	176.7	-172.9	-172	85.2	-161.5	0.8	110	S651 E652 V654 V730 I732 Y757	S651-R704 CarbonylContact C-O 3.48Å; S651-R704 VanDerWaalsContact CA-O 3.25Å; S651-R704 WeakPolarHBondContact CA-O 3.3Å; E652-R704 HydrophobicContact CG-CB 4.4Å; E652-R704 PolarHBondContact N-O 2.86Å; E652-R704 PolarHBondContact O-N 2.85Å; E652-R704 IonicContact OE1-CZ 2.62Å; E652-R704 IonicContact OE1-NE 2.88Å; E652-R704 IonicContact OE1-NH1 2.9Å; E652-R704 PolarHBondContact OE1-NH1 2.93Å; E652-R704 IonicContact OE1-NH2 3.29Å; E652-R704 PolarHBondContact OE1-NH2 3.27Å; V654-R704 HydrophobicContact CG2-CB 3.42Å; V654-R704 VanDerWaalsContact CG2-CB 3.42Å; V654-R704 HydrophobicContact CG2-CG 4.41Å; R704-V730 HydrophobicContact CG-CG1 3.38Å; R704-I732 HydrophobicContact CB-CG2 4.47Å; R704-I732 HydrophobicContact CG-CG2 4.36Å; R704-Y757 WeakPolarHBondContact CD-OH 3.45Å
705	L	83.2	Confident	69.1	Low	34 Å²	34	66.9 Å²	66.9	18%	0.178	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.1	171.3	-77.3	151	0	0	0	110.5	E648 D731	E648-L705 HydrophobicContact CB-CD2 3.57Å; E648-L705 HydrophobicContact CG-CD2 4.29Å; E648-L705 VanDerWaalsContact OE2-CD1 3.3Å; E648-L705 WeakPolarHBondContact OE2-CD1 3.48Å; E648-L705 WeakPolarHBondContact OE2-CD2 3.46Å; L705-D731 HydrophobicContact CD1-CB 4.04Å; L705-D731 PolarHBondContact N-O 2.77Å
706	K	68.1	Low	66.7	Low	107 Å²	107	69.1 Å²	69.1	47%	0.465	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-76.9	133.8	167.3	-67.2	175	167	146.6	0	108.8	G650 E652	G650-K706 WeakPolarHBondContact O-CA 3Å; G650-K706 WeakPolarHBondContact O-CB 3.41Å; G650-K706 VanDerWaalsContact O-CG 3.25Å; G650-K706 WeakPolarHBondContact O-CG 3.47Å; G650-K706 PolarHBondContact O-N 3.35Å; E652-K706 VanDerWaalsContact CD-CE 3.41Å; E652-K706 HydrophobicContact CG-CG 4.38Å; E652-K706 WeakPolarHBondContact OE2-CE 3.4Å; E652-K706 IonicContact OE2-NZ 2.65Å; E652-K706 PolarHBondContact OE2-NZ 3.19Å
707	E	61.3	Low	64.9	Low	106 Å²	106	74.3 Å²	74.3	50%	0.495	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-79.3	124.3	166.1	-163	165.2	169.7	0	0	108.9	Q709 C728	E707-Q709 PolarHBondContact O-N 3.34Å; E707-C728 PolarHBondContact OE1-SG 2.75Å; E707-C728 WeakPolarHBondContact OE2-CA 3.31Å; E707-C728 WeakPolarHBondContact OE2-CB 3.45Å; E707-C728 PolarHBondContact OE2-SG 3.37Å
708	E	48.1	Very low	62.5	Low	168 Å²	168	78.6 Å²	78.6	79%	0.785	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-63.7	119.8	165.5	-74.3	-167.8	147.6	0	0	108	V710	E708-V710 VanDerWaalsContact C-N 3.31Å; E708-V710 PolarHBondContact O-N 2.91Å
709	Q	41.9	Very low	60.1	Low	189 Å²	189	86.8 Å²	86.8	88%	0.883	47%	0.471	S	S	*	.			trans	-62.2	100.2	165.7	-69.5	-157.6	-5.9	0	0	107.5	E707 S711	E707-Q709 PolarHBondContact O-N 3.34Å; Q709-S711 PolarHBondContact O-N 3.33Å
710	V	37.3	Very low	57.6	Low	133 Å²	133	94.8 Å²	94.8	81%	0.806	51%	0.513	S	S	*	.			trans	-53.4	108.6	168.3	177.3	0	0	0	0	106.6	E708 T712	E708-V710 VanDerWaalsContact C-N 3.31Å; E708-V710 PolarHBondContact O-N 2.91Å; V710-T712 PolarHBondContact O-N 3.45Å
711	S	34.4	Very low	55.1	Low	84 Å²	84	100 Å²	100	59%	0.587	54%	0.544	S	S	*	.			trans	-51.5	122.2	-174.1	53.5	0	0	0	0	110.2	Q709 V713	Q709-S711 PolarHBondContact O-N 3.33Å; S711-V713 PolarHBondContact O-N 3.19Å
712	T	39.4	Very low	52.5	Low	123 Å²	123	105.3 Å²	105.3	76%	0.755	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	23.3	-179.8	35	0	0	0	0	115	V710	V710-T712 PolarHBondContact O-N 3.45Å
713	V	42.7	Very low	50	Low	111 Å²	111	111.8 Å²	111.8	67%	0.673	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-33	179.6	-175.2	0	0	0	0	112	S711	S711-V713 PolarHBondContact O-N 3.19Å
714	L	40.4	Very low	47.4	Very low	134 Å²	134	117 Å²	117	70%	0.702	64%	0.644	S	S	*	*	S	Bend	trans	-88.3	-27	173.5	-105.1	89.5	0	0	0	113.8	G716 L717	L714-G716 PolarHBondContact O-N 3.4Å; L714-L717 PolarHBondContact O-N 3.38Å
715	A	43.6	Very low	45	Very low	58 Å²	58	120.9 Å²	120.9	48%	0.479	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67	-19.9	177.1	0	0	0	0	0	113
716	G	40.9	Very low	42.9	Very low	50 Å²	50	127.8 Å²	127.8	52%	0.515	70%	0.701	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.8	-15.5	174.6	0	0	0	0	0	115.1	L714	L714-G716 PolarHBondContact O-N 3.4Å
717	L	48.9	Very low	41.9	Very low	147 Å²	147	129.7 Å²	129.7	77%	0.77	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-10.3	-176.3	-90.8	150.3	0	0	0	113.9	L714	L714-L717 PolarHBondContact O-N 3.38Å
718	L	40.6	Very low	41.3	Very low	131 Å²	131	127.9 Å²	127.9	69%	0.686	70%	0.703	S	S	*	*			trans	-115.9	70	177.8	-74	164.2	0	0	0	110.4	L720	L718-L720 PolarHBondContact O-N 2.79Å
719	Q	40.1	Very low	41.9	Very low	177 Å²	177	123.3 Å²	123.3	83%	0.827	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	22.2	-179.1	-82.7	-171.5	-13	0	0	115.6
720	L	40.1	Very low	43.5	Very low	169 Å²	169	115.4 Å²	115.4	89%	0.885	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	16.4	-173.7	-77	168	0	0	0	115.8	L718	L718-L720 PolarHBondContact O-N 2.79Å
721	V	40.9	Very low	45.9	Very low	109 Å²	109	110.4 Å²	110.4	66%	0.661	62%	0.621	S	S	*	*	S	Bend	trans	-123.4	124.8	171.8	-173.8	0	0	0	0	109.3	I723	V721-I723 PolarHBondContact O-N 2.75Å
722	P	37.7	Very low	48.6	Very low	112 Å²	112	106.5 Å²	106.5	73%	0.727	59%	0.593	S	S	*	*			trans	-65.9	106.8	174.2	27.5	-29.9	0	0	0	107.6	T724	P722-T724 PolarHBondContact O-N 2.76Å
723	I	39.6	Very low	51.2	Low	136 Å²	136	102 Å²	102	70%	0.697	57%	0.566	S	S	*	*			trans	-63.5	94.8	166.9	-58.2	170.9	0	0	0	105.4	V721 N725	V721-I723 PolarHBondContact O-N 2.75Å; I723-N725 PolarHBondContact O-N 3.02Å
724	T	37.4	Very low	53.6	Low	118 Å²	118	97 Å²	97	72%	0.724	54%	0.535	S	S	*	.			trans	-53.3	130.2	163.1	40.3	0	0	0	0	106.6	P722 Q726	P722-T724 PolarHBondContact O-N 2.76Å; T724-Q726 VanDerWaalsContact C-N 3.28Å; T724-Q726 PolarHBondContact O-N 3.43Å
725	N	37.4	Very low	56.2	Low	143 Å²	143	91.3 Å²	91.3	77%	0.765	51%	0.505	S	S	*	.			trans	-46.1	87.4	178.3	-76	-48	0	0	0	111.5	I723 R727	I723-N725 PolarHBondContact O-N 3.02Å; N725-R727 PolarHBondContact O-N 3.18Å
726	Q	39	Very low	58.6	Low	178 Å²	178	88.7 Å²	88.7	83%	0.832	48%	0.484	S	S	*	.			trans	-78.2	79.6	168.4	-138.5	169.7	1.8	0	0	104.9	T724 C728	T724-Q726 VanDerWaalsContact C-N 3.28Å; T724-Q726 PolarHBondContact O-N 3.43Å; Q726-C728 VanDerWaalsContact C-N 3.33Å; Q726-C728 PolarHBondContact O-N 2.79Å
727	R	47.2	Very low	61	Low	148 Å²	148	86.3 Å²	86.3	56%	0.558	46%	0.459	S	S	*	.			trans	-65.6	100.2	171.5	-76.7	-175.5	-178.3	169.5	0.1	107	N725 T729	N725-R727 PolarHBondContact O-N 3.18Å; R727-T729 WeakPolarHBondContact O-CG2 3.49Å; R727-T729 PolarHBondContact O-N 2.8Å; R727-T729 VanDerWaalsContact O-N 3.08Å
728	C	49.7	Very low	63.1	Low	67 Å²	67	79.7 Å²	79.7	45%	0.453	43%	0.425	S	S	.	.			trans	-15	97	157.9	-66	0	0	0	0	113.4	E707 Q726	E707-C728 PolarHBondContact OE1-SG 2.75Å; E707-C728 WeakPolarHBondContact OE2-CA 3.31Å; E707-C728 WeakPolarHBondContact OE2-CB 3.45Å; E707-C728 PolarHBondContact OE2-SG 3.37Å; Q726-C728 VanDerWaalsContact C-N 3.33Å; Q726-C728 PolarHBondContact O-N 2.79Å
729	T	59.6	Low	65.4	Low	72 Å²	72	73.7 Å²	73.7	44%	0.442	40%	0.395	S	S	.	.			trans	-90	106	177.3	51.1	0	0	0	0	109.2	R727 R752	R727-T729 WeakPolarHBondContact O-CG2 3.49Å; R727-T729 PolarHBondContact O-N 2.8Å; R727-T729 VanDerWaalsContact O-N 3.08Å; T729-R752 HydrophobicContact CG2-CG 3.72Å
730	V	76.1	Confident	67.8	Low	24 Å²	24	66.7 Å²	66.7	15%	0.145	36%	0.362	C	S	.	.			trans	-85.2	123.8	175.4	-177.6	0	0	0	0	109.4	R704 R752 A753 N754	R704-V730 HydrophobicContact CG-CG1 3.38Å; V730-R752 CarbonylContact O-C 3.56Å; V730-R752 VanDerWaalsContact O-C 3.31Å; V730-R752 WeakPolarHBondContact O-CA 3.47Å; V730-R752 PolarHBondContact O-N 2.88Å; V730-A753 PolarHBondContact O-N 2.81Å; V730-N754 WeakPolarHBondContact CB-OD1 3.4Å
731	D	87.7	Confident	70.1	Confident	28 Å²	28	61.1 Å²	61.1	15%	0.15	34%	0.336	C	S	.	.			trans	-100.1	148.8	173.1	-65.7	-12.4	0	0	0	110.1	L705 K749 E750 N751 R752	L705-D731 HydrophobicContact CD1-CB 4.04Å; L705-D731 PolarHBondContact N-O 2.77Å; D731-K749 WeakPolarHBondContact OD2-CE 3.34Å; D731-K749 IonicContact OD2-NZ 2.72Å; D731-K749 PolarHBondContact OD2-NZ 3.04Å; D731-E750 WeakPolarHBondContact CA-O 3.46Å; D731-N751 WeakPolarHBondContact OD1-CA 3.47Å; D731-N751 PolarHBondContact OD2-OD1 3.01Å; D731-R752 PolarHBondContact OD1-N 2.71Å
732	I	91.3	Very high	72.5	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	148.1	172.4	68	177	0	0	0	110.9	L702 I703 R704 K749 E750 A753 Y757 F770	L702-I732 HydrophobicContact CD2-CB 4.47Å; L702-I732 HydrophobicContact CD2-CG2 4.39Å; I703-I732 CarbonylContact O-C 3.55Å; I703-I732 VanDerWaalsContact O-CA 3.29Å; I703-I732 WeakPolarHBondContact O-CA 3.13Å; R704-I732 HydrophobicContact CB-CG2 4.47Å; R704-I732 HydrophobicContact CG-CG2 4.36Å; I732-K749 WeakPolarHBondContact O-CA 3.46Å; I732-E750 HydrophobicContact CD1-CB 4.26Å; I732-E750 HydrophobicContact CG1-CB 3.75Å; I732-E750 HydrophobicContact CG1-CG 4.36Å; I732-E750 PolarHBondContact N-O 2.83Å; I732-E750 PolarHBondContact O-N 3.37Å; I732-A753 HydrophobicContact CB-CB 4.35Å; I732-A753 HydrophobicContact CD1-CB 3.68Å; I732-A753 HydrophobicContact CG1-CB 3.61Å; I732-A753 HydrophobicContact CG2-CB 4.02Å; I732-Y757 HydrophobicContact CD1-CD1 4.21Å; I732-Y757 HydrophobicContact CD1-CE1 4.18Å; I732-Y757 HydrophobicContact CG2-CD1 4.23Å; I732-Y757 HydrophobicContact CG2-CE1 3.45Å; I732-Y757 VanDerWaalsContact CG2-CE1 3.45Å; I732-F770 HydrophobicContact CD1-CB 4.05Å; I732-F770 HydrophobicContact CD1-CD1 3.97Å; I732-F770 HydrophobicContact CD1-CG 4.01Å
733	T	93.5	Very high	75	Confident	30 Å²	30	55.2 Å²	55.2	18%	0.184	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.4	172.3	-56.9	0	0	0	0	109.2	I703 V748	I703-T733 PolarHBondContact N-O 3.32Å; I703-T733 PolarHBondContact O-N 3.06Å; T733-V748 CarbonylContact C-O 3.59Å; T733-V748 WeakPolarHBondContact CA-O 3.31Å
734	V	93.9	Very high	77.5	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.1	172.1	-178.9	0	0	0	0	107.6	V700 L702 A747 V748 Y768	V700-V734 HydrophobicContact CG1-CG1 3.73Å; L702-V734 HydrophobicContact CG-CG2 4.46Å; V734-A747 WeakPolarHBondContact O-CA 3.26Å; V734-V748 PolarHBondContact N-O 2.89Å; V734-V748 PolarHBondContact O-N 2.81Å; V734-Y768 HydrophobicContact CG2-CD1 4.21Å; V734-Y768 HydrophobicContact CG2-CD2 3.84Å; V734-Y768 HydrophobicContact CG2-CE1 4.29Å; V734-Y768 HydrophobicContact CG2-CE2 3.88Å; V734-Y768 HydrophobicContact CG2-CG 4.01Å
735	L	94.5	Very high	80.1	Confident	14 Å²	14	48.5 Å²	48.5	7%	0.073	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114.2	-177.9	178	65.9	0	0	0	110	L645 V700 A701 I703 F737 P744 A747	L645-L735 HydrophobicContact CD2-CD2 3.8Å; V700-L735 WeakPolarHBondContact CA-O 2.91Å; A701-L735 PolarHBondContact N-O 3.29Å; A701-L735 PolarHBondContact O-N 2.96Å; I703-L735 HydrophobicContact CD1-CB 4.16Å; I703-L735 HydrophobicContact CD1-CD2 4.36Å; L735-F737 HydrophobicContact CG-CD1 4.37Å; L735-P744 HydrophobicContact CD1-CB 4.02Å; L735-A747 HydrophobicContact CD1-CB 3.81Å
736	A	93.8	Very high	82.8	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.033	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.9	168.4	0	0	0	0	0	109.7	I698 A699 V700 V745 H746 I766	I698-A736 HydrophobicContact CD1-CB 4.36Å; A699-A736 WeakPolarHBondContact O-CA 3.25Å; V700-A736 HydrophobicContact CG2-CB 4.13Å; A736-V745 PolarHBondContact O-N 3.01Å; A736-H746 PolarHBondContact N-O 3.35Å; A736-H746 PolarHBondContact O-N 2.66Å; A736-I766 HydrophobicContact CB-CD1 4.05Å
737	F	93	Very high	85.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160.2	179.8	67.2	-86	0	0	0	111.3	L605 L643 L645 F656 A699 A701 L735 R743	L605-F737 HydrophobicContact CD1-CE2 4.49Å; L605-F737 HydrophobicContact CD2-CE2 3.84Å; L605-F737 HydrophobicContact CD2-CZ 4.03Å; L643-F737 HydrophobicContact CD2-CD1 4.46Å; L643-F737 HydrophobicContact CD2-CD2 3.96Å; L643-F737 HydrophobicContact CD2-CE2 4.21Å; L643-F737 HydrophobicContact CD2-CG 4.08Å; L645-F737 HydrophobicContact CD1-CE1 4.46Å; L645-F737 HydrophobicContact CD2-CD1 4.23Å; L645-F737 HydrophobicContact CD2-CE1 3.82Å; L645-F737 HydrophobicContact CD2-CZ 4.25Å; F656-F737 AromaticContact CE2-CE1 3.97Å; F656-F737 HydrophobicContact CE2-CE1 3.97Å; F656-F737 AromaticContact CE2-CZ 3.75Å; F656-F737 HydrophobicContact CE2-CZ 3.75Å; F656-F737 HydrophobicContact CZ-CZ 4.36Å; A699-F737 HydrophobicContact CB-CD1 4.31Å; A699-F737 HydrophobicContact CB-CD2 4.17Å; A699-F737 HydrophobicContact CB-CE1 3.87Å; A699-F737 HydrophobicContact CB-CE2 3.72Å; A699-F737 HydrophobicContact CB-CG 4.45Å; A699-F737 HydrophobicContact CB-CZ 3.57Å; A699-F737 PolarHBondContact N-O 3.11Å; A699-F737 PolarHBondContact O-N 3.46Å; A699-F737 VanDerWaalsContact O-O 3.1Å; A701-F737 HydrophobicContact CB-CE1 4.25Å; L735-F737 HydrophobicContact CG-CD1 4.37Å; F737-R743 CarbonylContact C-O 3.48Å; F737-R743 VanDerWaalsContact CA-O 3.27Å; F737-R743 WeakPolarHBondContact CA-O 3.28Å; F737-R743 WeakPolarHBondContact CB-O 3.39Å
738	D	92.3	Very high	87.7	Confident	7 Å²	7	32.7 Å²	32.7	4%	0.037	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124.7	176.6	-169.7	-59	0	0	0	110.7	N695 I740 T741 G742 R743 S799	N695-D738 PolarHBondContact ND2-OD2 2.82Å; D738-I740 VanDerWaalsContact C-N 3.27Å; D738-I740 PolarHBondContact O-N 2.89Å; D738-I740 WeakPolarHBondContact OD1-CB 3.29Å; D738-I740 PolarHBondContact OD1-N 3.1Å; D738-T741 WeakPolarHBondContact CB-OG1 3.45Å; D738-T741 PolarHBondContact OD1-N 2.89Å; D738-G742 WeakPolarHBondContact O-CA 3.5Å; D738-G742 PolarHBondContact O-N 3.18Å; D738-R743 PolarHBondContact N-O 3.15Å; D738-S799 WeakPolarHBondContact OD1-CB 3.18Å; D738-S799 PolarHBondContact OD1-OG 3.17Å; D738-S799 WeakPolarHBondContact OD2-CB 3.48Å; D738-S799 PolarHBondContact OD2-OG 3.25Å
739	G	88.6	Confident	89.7	Confident	6 Å²	6	34.1 Å²	34.1	6%	0.062	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-16	-177.6	0	0	0	0	0	115.2	F641 N697	F641-G739 WeakPolarHBondContact CE1-O 3.12Å; N697-G739 WeakPolarHBondContact O-CA 3.17Å; N697-G739 PolarHBondContact O-N 2.9Å
740	I	89.6	Confident	91.3	Very high	29 Å²	29	32 Å²	32	15%	0.149	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-46.3	177.5	-62.8	-177.6	0	0	0	111.2	Y603 F641 N697 D738 L800	Y603-I740 HydrophobicContact CD1-CG2 4.15Å; Y603-I740 HydrophobicContact CD2-CD1 3.91Å; Y603-I740 HydrophobicContact CD2-CG1 4.03Å; Y603-I740 HydrophobicContact CD2-CG2 3.87Å; Y603-I740 HydrophobicContact CE1-CG2 4.15Å; Y603-I740 HydrophobicContact CE2-CD1 4.36Å; Y603-I740 HydrophobicContact CE2-CG2 3.85Å; Y603-I740 HydrophobicContact CG-CG1 4.23Å; Y603-I740 HydrophobicContact CG-CG2 4.02Å; F641-I740 WeakPolarHBondContact CD1-O 2.98Å; F641-I740 WeakPolarHBondContact CE1-O 3.45Å; N697-I740 HydrophobicContact CB-CD1 4.12Å; N697-I740 HydrophobicContact CB-CG1 4.02Å; N697-I740 WeakPolarHBondContact ND2-CD1 3.3Å; D738-I740 VanDerWaalsContact C-N 3.27Å; D738-I740 PolarHBondContact O-N 2.89Å; D738-I740 WeakPolarHBondContact OD1-CB 3.29Å; D738-I740 PolarHBondContact OD1-N 3.1Å; I740-L800 HydrophobicContact CG2-CD2 4.5Å
741	T	90.2	Very high	92	Very high	53 Å²	53	35.5 Å²	35.5	33%	0.325	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-19.4	-175.3	60	0	0	0	0	113.8	F641 D738 R743 S799 L800	F641-T741 VanDerWaalsContact CD1-C 3.47Å; D738-T741 WeakPolarHBondContact CB-OG1 3.45Å; D738-T741 PolarHBondContact OD1-N 2.89Å; T741-R743 PolarHBondContact O-N 3.01Å; T741-R743 PolarHBondContact OG1-N 3.3Å; T741-S799 WeakPolarHBondContact CG2-O 3.43Å; T741-L800 HydrophobicContact CG2-CD2 4.21Å
742	G	89.9	Confident	92	Very high	8 Å²	8	39.5 Å²	39.5	8%	0.082	21%	0.209	C	C	.	.			trans	75.2	5.6	-174.5	0	0	0	0	0	113.5	F641 D738	F641-G742 VanDerWaalsContact CZ-CA 3.45Å; D738-G742 WeakPolarHBondContact O-CA 3.5Å; D738-G742 PolarHBondContact O-N 3.18Å
743	R	91.5	Very high	92	Very high	88 Å²	88	39.5 Å²	39.5	33%	0.332	21%	0.209	S	C	.	.			trans	-68.4	127.5	-179.5	-173.9	-176	-176.9	-156	3.1	110	F737 D738 T741 V745 E804	F737-R743 CarbonylContact C-O 3.48Å; F737-R743 VanDerWaalsContact CA-O 3.27Å; F737-R743 WeakPolarHBondContact CA-O 3.28Å; F737-R743 WeakPolarHBondContact CB-O 3.39Å; D738-R743 PolarHBondContact N-O 3.15Å; T741-R743 PolarHBondContact O-N 3.01Å; T741-R743 PolarHBondContact OG1-N 3.3Å; R743-V745 PolarHBondContact O-N 3.17Å; R743-E804 IonicContact CZ-OE1 3.27Å; R743-E804 IonicContact NH2-OE1 3.05Å; R743-E804 PolarHBondContact NH2-OE1 3.07Å
744	P	91.6	Very high	91.8	Very high	81 Å²	81	39.7 Å²	39.7	53%	0.526	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	126.8	170.1	29.3	-33.5	0	0	0	109.5	L735	L735-P744 HydrophobicContact CD1-CB 4.02Å
745	V	92.5	Very high	91.5	Very high	32 Å²	32	42.7 Å²	42.7	19%	0.194	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-50.2	178.5	178.3	0	0	0	0	109.8	Y693 A736 R743 M785 P805	Y693-V745 HydrophobicContact CE1-CG1 4.28Å; A736-V745 PolarHBondContact O-N 3.01Å; R743-V745 PolarHBondContact O-N 3.17Å; V745-M785 HydrophobicContact CG1-SD 4.4Å; V745-P805 HydrophobicContact CG1-CG 3.48Å; V745-P805 VanDerWaalsContact CG1-CG 3.48Å
746	H	93.9	Very high	91.3	Very high	62 Å²	62	43.6 Å²	43.6	29%	0.287	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	147.4	179.4	-168.9	71.4	0	0	0	111	A736 V748 L783 V807	A736-H746 PolarHBondContact N-O 3.35Å; A736-H746 PolarHBondContact O-N 2.66Å; H746-V748 VanDerWaalsContact NE2-CG2 3.26Å; H746-V748 WeakPolarHBondContact NE2-CG2 3.45Å; H746-L783 VanDerWaalsContact CD2-CD2 3.43Å; H746-L783 WeakPolarHBondContact CD2-CD2 3.49Å; H746-V807 HydrophobicContact CB-CG2 4.22Å
747	A	93.8	Very high	91.2	Very high	57 Å²	57	44.4 Å²	44.4	47%	0.471	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132	177.8	0	0	0	0	0	110.5	V734 L735	V734-A747 WeakPolarHBondContact O-CA 3.26Å; L735-A747 HydrophobicContact CD1-CB 3.81Å
748	V	94.1	Very high	91.2	Very high	18 Å²	18	45.9 Å²	45.9	11%	0.109	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.3	175.8	177.8	0	0	0	0	109.4	T733 V734 H746 E750 L783	T733-V748 CarbonylContact C-O 3.59Å; T733-V748 WeakPolarHBondContact CA-O 3.31Å; V734-V748 PolarHBondContact N-O 2.89Å; V734-V748 PolarHBondContact O-N 2.81Å; H746-V748 VanDerWaalsContact NE2-CG2 3.26Å; H746-V748 WeakPolarHBondContact NE2-CG2 3.45Å; V748-E750 HydrophobicContact CG1-CG 4.46Å; V748-L783 HydrophobicContact CG2-CD2 3.65Å
749	K	93.3	Very high	91.2	Very high	98 Å²	98	45.8 Å²	45.8	43%	0.426	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.2	173.5	-178.6	173.2	177.7	169.1	0	109.9	D731 I732 N751	D731-K749 WeakPolarHBondContact OD2-CE 3.34Å; D731-K749 IonicContact OD2-NZ 2.72Å; D731-K749 PolarHBondContact OD2-NZ 3.04Å; I732-K749 WeakPolarHBondContact O-CA 3.46Å; K749-N751 WeakPolarHBondContact CE-OD1 3.21Å
750	E	93	Very high	91.4	Very high	28 Å²	28	46.1 Å²	46.1	13%	0.131	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.1	172.7	-61.4	-70.4	-179.4	0	0	109.6	D731 I732 V748 A753 Y768 F770 H809	D731-E750 WeakPolarHBondContact CA-O 3.46Å; I732-E750 HydrophobicContact CD1-CB 4.26Å; I732-E750 HydrophobicContact CG1-CB 3.75Å; I732-E750 HydrophobicContact CG1-CG 4.36Å; I732-E750 PolarHBondContact N-O 2.83Å; I732-E750 PolarHBondContact O-N 3.37Å; V748-E750 HydrophobicContact CG1-CG 4.46Å; E750-A753 HydrophobicContact CB-CB 4.27Å; E750-Y768 HydrophobicContact CG-CE2 3.92Å; E750-Y768 PolarHBondContact OE1-OH 2.8Å; E750-F770 HydrophobicContact CB-CE1 4.44Å; E750-F770 HydrophobicContact CB-CE2 4.49Å; E750-F770 HydrophobicContact CB-CZ 4.13Å; E750-F770 HydrophobicContact CG-CE1 3.92Å; E750-F770 HydrophobicContact CG-CZ 3.91Å; E750-H809 IonicContact OE1-CE1 3.85Å; E750-H809 PolarHBondContact OE1-CE1 2.71Å; E750-H809 IonicContact OE1-NE2 2.79Å; E750-H809 PolarHBondContact OE1-NE2 2.78Å
751	N	90.1	Very high	91.5	Very high	97 Å²	97	45.6 Å²	45.6	52%	0.519	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	141.6	-177.7	-57.6	-42.8	0	0	0	110.9	D731 K749	D731-N751 WeakPolarHBondContact OD1-CA 3.47Å; D731-N751 PolarHBondContact OD2-OD1 3.01Å; K749-N751 WeakPolarHBondContact CE-OD1 3.21Å
752	R	88.1	Confident	91.5	Very high	112 Å²	112	43.7 Å²	43.7	42%	0.423	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	42.6	176.6	-50.5	-178.3	177.9	-175.6	1.1	114	T729 V730 D731 E773	T729-R752 HydrophobicContact CG2-CG 3.72Å; V730-R752 CarbonylContact O-C 3.56Å; V730-R752 VanDerWaalsContact O-C 3.31Å; V730-R752 WeakPolarHBondContact O-CA 3.47Å; V730-R752 PolarHBondContact O-N 2.88Å; D731-R752 PolarHBondContact OD1-N 2.71Å; R752-E773 HydrophobicContact CB-CB 4.29Å; R752-E773 PolarHBondContact O-N 3.38Å
753	A	90.9	Very high	91.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	107.2	-179.8	0	0	0	0	0	111.2	V730 I732 E750 Y757 F770	V730-A753 PolarHBondContact O-N 2.81Å; I732-A753 HydrophobicContact CB-CB 4.35Å; I732-A753 HydrophobicContact CD1-CB 3.68Å; I732-A753 HydrophobicContact CG1-CB 3.61Å; I732-A753 HydrophobicContact CG2-CB 4.02Å; E750-A753 HydrophobicContact CB-CB 4.27Å; A753-Y757 WeakPolarHBondContact O-CE1 3.36Å; A753-Y757 PolarHBondContact O-OH 3.37Å; A753-F770 HydrophobicContact CB-CB 4.13Å; A753-F770 HydrophobicContact CB-CD2 3.37Å; A753-F770 HydrophobicContact CB-CE2 3.91Å; A753-F770 HydrophobicContact CB-CG 3.84Å
754	N	90	Very high	91.5	Very high	34 Å²	34	40.3 Å²	40.3	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	161.5	179.3	-78.2	-24.1	0	0	0	112.2	V730 Y757 W771 E773	V730-N754 WeakPolarHBondContact CB-OD1 3.4Å; N754-Y757 VanDerWaalsContact C-CZ 3.5Å; N754-Y757 WeakPolarHBondContact CA-OH 3.47Å; N754-Y757 WeakPolarHBondContact O-CE1 3.34Å; N754-W771 HydrophobicContact CB-CB 4.24Å; N754-W771 PolarHBondContact N-O 3.01Å; N754-W771 WeakPolarHBondContact O-CB 3.43Å; N754-W771 PolarHBondContact O-N 3.31Å; N754-E773 PolarHBondContact ND2-OE2 2.95Å
755	P	88	Confident	91.6	Very high	69 Å²	69	36.8 Å²	36.8	45%	0.448	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	159.7	177	26.5	-34.6	0	0	0	112.6	Y757	P755-Y757 HydrophobicContact CB-CD2 3.87Å; P755-Y757 HydrophobicContact CB-CE2 3.59Å; P755-Y757 WeakPolarHBondContact CD-OH 3.09Å; P755-Y757 HydrophobicContact CG-CE2 4.22Å
756	P	89.7	Confident	91.8	Very high	33 Å²	33	35.4 Å²	35.4	21%	0.214	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-81.4	144.3	9.2	33.1	-35.1	0	0	0	112.1	K817 I818	P756-K817 HydrophobicContact CG-CD 4.5Å; P756-K817 HydrophobicContact CG-CG 4.17Å; P756-I818 VanDerWaalsContact CG-O 3.28Å; P756-I818 WeakPolarHBondContact CG-O 3.34Å
757	Y	91.6	Very high	91.8	Very high	21 Å²	21	32.5 Å²	32.5	8%	0.082	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.4	174.9	-49.6	-75.8	0	0	0	109	V654 L702 R704 I732 A753 N754 P755 S769 F770	V654-Y757 HydrophobicContact CB-CD2 4.49Å; V654-Y757 HydrophobicContact CG1-CD2 3.72Å; V654-Y757 HydrophobicContact CG1-CE2 4.38Å; V654-Y757 HydrophobicContact CG1-CG 4.5Å; L702-Y757 HydrophobicContact CD1-CG 4.48Å; L702-Y757 HydrophobicContact CD2-CD1 4.23Å; L702-Y757 HydrophobicContact CD2-CD2 4.48Å; L702-Y757 HydrophobicContact CD2-CG 4.04Å; R704-Y757 WeakPolarHBondContact CD-OH 3.45Å; I732-Y757 HydrophobicContact CD1-CD1 4.21Å; I732-Y757 HydrophobicContact CD1-CE1 4.18Å; I732-Y757 HydrophobicContact CG2-CD1 4.23Å; I732-Y757 HydrophobicContact CG2-CE1 3.45Å; I732-Y757 VanDerWaalsContact CG2-CE1 3.45Å; A753-Y757 WeakPolarHBondContact O-CE1 3.36Å; A753-Y757 PolarHBondContact O-OH 3.37Å; N754-Y757 VanDerWaalsContact C-CZ 3.5Å; N754-Y757 WeakPolarHBondContact CA-OH 3.47Å; N754-Y757 WeakPolarHBondContact O-CE1 3.34Å; P755-Y757 HydrophobicContact CB-CD2 3.87Å; P755-Y757 HydrophobicContact CB-CE2 3.59Å; P755-Y757 WeakPolarHBondContact CD-OH 3.09Å; P755-Y757 HydrophobicContact CG-CE2 4.22Å; Y757-S769 WeakPolarHBondContact CA-O 3.4Å; Y757-F770 HydrophobicContact CD1-CB 3.84Å; Y757-F770 HydrophobicContact CE1-CB 4.04Å
758	H	92.5	Very high	91.9	Very high	31 Å²	31	29.8 Å²	29.8	14%	0.144	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.8	171.4	-60.2	-67.2	0	0	0	106.9	Y768 S769 I818 T819 L821	H758-Y768 CarbonylContact O-C 3.58Å; H758-Y768 WeakPolarHBondContact O-CA 3.35Å; H758-Y768 WeakPolarHBondContact O-CB 3.19Å; H758-S769 WeakPolarHBondContact CB-OG 3.1Å; H758-S769 PolarHBondContact CD2-OG 3.43Å; H758-S769 PolarHBondContact N-O 3.36Å; H758-S769 PolarHBondContact O-N 2.8Å; H758-I818 PolarHBondContact NE2-O 3Å; H758-T819 VanDerWaalsContact CE1-C 3.42Å; H758-T819 PolarHBondContact CE1-O 3.07Å; H758-T819 PolarHBondContact NE2-O 2.84Å; H758-L821 HydrophobicContact CB-CB 4.22Å; H758-L821 HydrophobicContact CB-CD1 3.58Å; H758-L821 HydrophobicContact CB-CG 3.85Å
759	L	92.7	Very high	92	Very high	4 Å²	4	29 Å²	29	2%	0.021	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.9	176.3	178.6	63.8	0	0	0	108.2	D655 Q657 V700 I766 V767	D655-L759 HydrophobicContact CB-CB 4.5Å; D655-L759 WeakPolarHBondContact OD2-CB 3.5Å; Q657-L759 HydrophobicContact CB-CD2 4.2Å; Q657-L759 HydrophobicContact CG-CD2 4.26Å; Q657-L759 HydrophobicContact CG-CG 4.38Å; Q657-L759 PolarHBondContact NE2-O 3.32Å; Q657-L759 PolarHBondContact OE1-O 3.35Å; V700-L759 HydrophobicContact CB-CD2 4.11Å; V700-L759 HydrophobicContact CG1-CD1 3.94Å; V700-L759 HydrophobicContact CG1-CD2 3.86Å; V700-L759 HydrophobicContact CG1-CG 4.47Å; L759-I766 HydrophobicContact CD1-CG2 3.64Å; L759-V767 CarbonylContact C-O 3.54Å
760	I	92.3	Very high	92.1	Very high	13 Å²	13	24.3 Å²	24.3	7%	0.067	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129.3	173.1	-67.1	-169.9	0	0	0	108.1	Q657 C762 W765 I766 V767 L821 V823 L835	Q657-I760 VanDerWaalsContact OE1-CA 3.3Å; I760-C762 HydrophobicContact CG2-CB 4.46Å; I760-W765 HydrophobicContact CG2-CH2 4.44Å; I760-W765 HydrophobicContact CG2-CZ3 4.1Å; I760-I766 CarbonylContact O-C 3.59Å; I760-I766 WeakPolarHBondContact O-CA 3.2Å; I760-V767 HydrophobicContact CB-CB 4.5Å; I760-V767 PolarHBondContact N-O 3.49Å; I760-V767 PolarHBondContact O-N 3.1Å; I760-L821 HydrophobicContact CD1-CB 3.42Å; I760-L821 VanDerWaalsContact CD1-CB 3.42Å; I760-L821 HydrophobicContact CG1-CB 4.13Å; I760-V823 HydrophobicContact CD1-CG2 4.06Å; I760-V823 HydrophobicContact CG2-CG2 3.53Å; I760-L835 HydrophobicContact CD1-CD2 3.94Å
761	V	92	Very high	92.1	Very high	18 Å²	18	27.1 Å²	27.1	11%	0.109	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118	172.1	-175.9	0	0	0	0	108.7	Q657 I698 V700 I766	Q657-V761 HydrophobicContact CB-CG2 3.97Å; I698-V761 HydrophobicContact CG2-CG1 4.21Å; V700-V761 HydrophobicContact CB-CG2 3.74Å; V700-V761 HydrophobicContact CG2-CG1 4.39Å; V700-V761 HydrophobicContact CG2-CG2 3.49Å; V700-V761 VanDerWaalsContact CG2-CG2 3.49Å; V761-I766 HydrophobicContact CG2-CG1 4.44Å
762	C	90.3	Very high	92.3	Very high	13 Å²	13	23 Å²	23	9%	0.088	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	133.5	-179.9	-173.8	0	0	0	0	110.5	I760 N764 W765	I760-C762 HydrophobicContact CG2-CB 4.46Å; C762-N764 PolarHBondContact O-N 3.17Å; C762-W765 HydrophobicContact CB-CD2 4.14Å; C762-W765 HydrophobicContact CB-CE3 4.3Å; C762-W765 HydrophobicContact CB-CH2 3.83Å; C762-W765 HydrophobicContact CB-CZ2 3.56Å; C762-W765 HydrophobicContact CB-CZ3 4.17Å; C762-W765 PolarHBondContact N-O 3.4Å; C762-W765 VanDerWaalsContact O-CD1 3.26Å; C762-W765 PolarHBondContact O-N 3.49Å; C762-W765 PolarHBondContact O-NE1 2.8Å
763	E	88.3	Confident	92.4	Very high	19 Å²	19	19.8 Å²	19.8	9%	0.089	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	-97.6	-178.4	-58	-174.2	-169.7	0	0	114.7	K659 V677 K692 L694 R833	K659-E763 PolarHBondContact NZ-O 3.1Å; V677-E763 HydrophobicContact CG2-CB 4.4Å; V677-E763 HydrophobicContact CG2-CG 4.01Å; K692-E763 IonicContact NZ-OE2 2.59Å; K692-E763 PolarHBondContact NZ-OE2 3.01Å; L694-E763 HydrophobicContact CD2-CB 4.42Å; E763-R833 IonicContact OE1-NE 3.35Å; E763-R833 PolarHBondContact OE1-NE 3.33Å
764	N	92.9	Very high	92.4	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.032	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	7.8	-179.2	73.2	-55.1	0	0	0	112.8	K692 Y693 L694 C762 M785	K692-N764 HydrophobicContact CB-CB 3.96Å; K692-N764 HydrophobicContact CD-CB 4.5Å; K692-N764 HydrophobicContact CG-CB 4.46Å; Y693-N764 WeakPolarHBondContact O-CB 3.43Å; L694-N764 HydrophobicContact CD2-CB 3.95Å; C762-N764 PolarHBondContact O-N 3.17Å; N764-M785 PolarHBondContact ND2-O 3.31Å; N764-M785 PolarHBondContact O-N 2.92Å
765	W	94.1	Very high	92.5	Very high	8 Å²	8	29.6 Å²	29.6	3%	0.03	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	149.7	-172.9	59.2	-95.9	0	0	0	112.5	I760 C762 V767 L783 E784 V823 R833 L835 K849	I760-W765 HydrophobicContact CG2-CH2 4.44Å; I760-W765 HydrophobicContact CG2-CZ3 4.1Å; C762-W765 HydrophobicContact CB-CD2 4.14Å; C762-W765 HydrophobicContact CB-CE3 4.3Å; C762-W765 HydrophobicContact CB-CH2 3.83Å; C762-W765 HydrophobicContact CB-CZ2 3.56Å; C762-W765 HydrophobicContact CB-CZ3 4.17Å; C762-W765 PolarHBondContact N-O 3.4Å; C762-W765 VanDerWaalsContact O-CD1 3.26Å; C762-W765 PolarHBondContact O-N 3.49Å; C762-W765 PolarHBondContact O-NE1 2.8Å; W765-V767 HydrophobicContact CE3-CB 4.26Å; W765-V767 HydrophobicContact CE3-CG2 3.51Å; W765-V767 HydrophobicContact CZ3-CB 3.94Å; W765-V767 HydrophobicContact CZ3-CG2 3.4Å; W765-V767 VanDerWaalsContact CZ3-CG2 3.4Å; W765-L783 CarbonylContact C-O 3.31Å; W765-L783 WeakPolarHBondContact CA-O 3.48Å; W765-L783 WeakPolarHBondContact CB-O 3.43Å; W765-E784 HydrophobicContact CB-CG 3.85Å; W765-V823 HydrophobicContact CH2-CG1 4.27Å; W765-V823 HydrophobicContact CH2-CG2 3.58Å; W765-V823 HydrophobicContact CZ2-CG1 4.31Å; W765-V823 HydrophobicContact CZ2-CG2 4.36Å; W765-V823 HydrophobicContact CZ3-CG2 4.36Å; W765-R833 HydrophobicContact CZ2-CB 4.32Å; W765-L835 HydrophobicContact CH2-CD2 4.15Å; W765-L835 HydrophobicContact CH2-CG 4.36Å; W765-L835 HydrophobicContact CZ3-CD2 4.29Å; W765-K849 HydrophobicContact CD2-CD 4.12Å; W765-K849 VanDerWaalsContact CD2-CE 3.41Å; W765-K849 HydrophobicContact CE3-CD 4.3Å; W765-K849 HydrophobicContact CH2-CD 4.12Å; W765-K849 HydrophobicContact CZ2-CD 3.99Å; W765-K849 HydrophobicContact CZ2-CG 4.27Å; W765-K849 HydrophobicContact CZ3-CD 4.3Å
766	I	95.3	Very high	92.8	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.9	-178.7	-57.2	166.9	0	0	0	106.7	V700 A736 L759 I760 V761 V782 L783 M785	V700-I766 HydrophobicContact CG1-CD1 4.36Å; V700-I766 HydrophobicContact CG1-CG2 4.27Å; V700-I766 HydrophobicContact CG2-CD1 3.64Å; V700-I766 HydrophobicContact CG2-CG1 4.17Å; A736-I766 HydrophobicContact CB-CD1 4.05Å; L759-I766 HydrophobicContact CD1-CG2 3.64Å; I760-I766 CarbonylContact O-C 3.59Å; I760-I766 WeakPolarHBondContact O-CA 3.2Å; V761-I766 HydrophobicContact CG2-CG1 4.44Å; I766-V782 CarbonylContact O-C 3.57Å; I766-V782 WeakPolarHBondContact O-CA 3.2Å; I766-L783 HydrophobicContact CB-CB 4.32Å; I766-L783 HydrophobicContact CB-CD1 3.94Å; I766-L783 HydrophobicContact CG2-CD1 4.09Å; I766-L783 PolarHBondContact N-O 3.01Å; I766-L783 PolarHBondContact O-N 3.32Å; I766-M785 HydrophobicContact CD1-CE 3.82Å; I766-M785 HydrophobicContact CG1-CE 4.11Å
767	V	95.4	Very high	93	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.6	173.2	169.7	0	0	0	0	108.2	L759 I760 W765 V780 S781 V782 L835	L759-V767 CarbonylContact C-O 3.54Å; I760-V767 HydrophobicContact CB-CB 4.5Å; I760-V767 PolarHBondContact N-O 3.49Å; I760-V767 PolarHBondContact O-N 3.1Å; W765-V767 HydrophobicContact CE3-CB 4.26Å; W765-V767 HydrophobicContact CE3-CG2 3.51Å; W765-V767 HydrophobicContact CZ3-CB 3.94Å; W765-V767 HydrophobicContact CZ3-CG2 3.4Å; W765-V767 VanDerWaalsContact CZ3-CG2 3.4Å; V767-V780 HydrophobicContact CG1-CG1 3.74Å; V767-S781 WeakPolarHBondContact CA-O 3.23Å; V767-V782 HydrophobicContact CG2-CB 4.42Å; V767-V782 HydrophobicContact CG2-CG1 4.06Å; V767-V782 HydrophobicContact CG2-CG2 4.08Å; V767-L835 HydrophobicContact CG1-CD2 4.49Å; V767-L835 HydrophobicContact CG2-CD1 4.33Å
768	Y	95.7	Very high	93.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.1	173.5	62.5	-77.6	0	0	0	110.6	V734 E750 H758 F770 V780 S781 L783 H809	V734-Y768 HydrophobicContact CG2-CD1 4.21Å; V734-Y768 HydrophobicContact CG2-CD2 3.84Å; V734-Y768 HydrophobicContact CG2-CE1 4.29Å; V734-Y768 HydrophobicContact CG2-CE2 3.88Å; V734-Y768 HydrophobicContact CG2-CG 4.01Å; E750-Y768 HydrophobicContact CG-CE2 3.92Å; E750-Y768 PolarHBondContact OE1-OH 2.8Å; H758-Y768 CarbonylContact O-C 3.58Å; H758-Y768 WeakPolarHBondContact O-CA 3.35Å; H758-Y768 WeakPolarHBondContact O-CB 3.19Å; Y768-F770 AromaticContact CD2-CD1 3.86Å; Y768-F770 HydrophobicContact CD2-CD1 3.86Å; Y768-F770 HydrophobicContact CD2-CE1 4.08Å; Y768-F770 AromaticContact CE2-CD1 3.85Å; Y768-F770 HydrophobicContact CE2-CD1 3.85Å; Y768-F770 AromaticContact CE2-CE1 3.62Å; Y768-F770 HydrophobicContact CE2-CE1 3.62Å; Y768-V780 WeakPolarHBondContact O-CA 2.86Å; Y768-S781 VanDerWaalsContact CE1-CB 3.41Å; Y768-S781 PolarHBondContact N-O 3.33Å; Y768-S781 PolarHBondContact O-N 2.74Å; Y768-S781 VanDerWaalsContact OH-CB 3.26Å; Y768-S781 WeakPolarHBondContact OH-CB 3.13Å; Y768-L783 HydrophobicContact CD1-CD1 3.91Å; Y768-L783 HydrophobicContact CE1-CD1 3.41Å; Y768-L783 VanDerWaalsContact CE1-CD1 3.41Å; Y768-H809 PolarHBondContact OH-NE2 2.95Å
769	S	95.5	Very high	93.3	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.3	177.9	72.9	0	0	0	0	111.4	Y757 H758 E779	Y757-S769 WeakPolarHBondContact CA-O 3.4Å; H758-S769 WeakPolarHBondContact CB-OG 3.1Å; H758-S769 PolarHBondContact CD2-OG 3.43Å; H758-S769 PolarHBondContact N-O 3.36Å; H758-S769 PolarHBondContact O-N 2.8Å; S769-E779 VanDerWaalsContact CA-O 3.23Å; S769-E779 WeakPolarHBondContact CA-O 3.44Å
770	F	95.1	Very high	93.5	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	167.2	177.5	58.5	-87.2	0	0	0	110.6	I732 E750 A753 Y757 Y768 N772 E779	I732-F770 HydrophobicContact CD1-CB 4.05Å; I732-F770 HydrophobicContact CD1-CD1 3.97Å; I732-F770 HydrophobicContact CD1-CG 4.01Å; E750-F770 HydrophobicContact CB-CE1 4.44Å; E750-F770 HydrophobicContact CB-CE2 4.49Å; E750-F770 HydrophobicContact CB-CZ 4.13Å; E750-F770 HydrophobicContact CG-CE1 3.92Å; E750-F770 HydrophobicContact CG-CZ 3.91Å; A753-F770 HydrophobicContact CB-CB 4.13Å; A753-F770 HydrophobicContact CB-CD2 3.37Å; A753-F770 HydrophobicContact CB-CE2 3.91Å; A753-F770 HydrophobicContact CB-CG 3.84Å; Y757-F770 HydrophobicContact CD1-CB 3.84Å; Y757-F770 HydrophobicContact CE1-CB 4.04Å; Y768-F770 AromaticContact CD2-CD1 3.86Å; Y768-F770 HydrophobicContact CD2-CD1 3.86Å; Y768-F770 HydrophobicContact CD2-CE1 4.08Å; Y768-F770 AromaticContact CE2-CD1 3.85Å; Y768-F770 HydrophobicContact CE2-CD1 3.85Å; Y768-F770 AromaticContact CE2-CE1 3.62Å; Y768-F770 HydrophobicContact CE2-CE1 3.62Å; F770-N772 HydrophobicContact CE2-CB 4.13Å; F770-E779 HydrophobicContact CE1-CB 4.37Å; F770-E779 HydrophobicContact CE2-CB 4.12Å; F770-E779 HydrophobicContact CZ-CB 3.97Å; F770-E779 PolarHBondContact N-O 2.96Å; F770-E779 PolarHBondContact O-N 3.2Å
771	W	94.4	Very high	93.7	Very high	86 Å²	86	34.7 Å²	34.7	33%	0.326	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	112.8	172.3	179.5	-91.1	0	0	0	110.5	N754 E773 R776	N754-W771 HydrophobicContact CB-CB 4.24Å; N754-W771 PolarHBondContact N-O 3.01Å; N754-W771 WeakPolarHBondContact O-CB 3.43Å; N754-W771 PolarHBondContact O-N 3.31Å; W771-E773 PolarHBondContact O-N 3.02Å; W771-R776 VanDerWaalsContact CH2-O 3.25Å; W771-R776 WeakPolarHBondContact CH2-O 3.46Å; W771-R776 HydrophobicContact CZ2-CB 4.09Å; W771-R776 WeakPolarHBondContact CZ2-O 3.4Å
772	N	93.6	Very high	93.9	Very high	11 Å²	11	33.8 Å²	33.8	6%	0.059	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	114.2	176.1	-169.4	-42.4	0	0	0	110.3	F770 K774 Y775 R776 R777 E779	F770-N772 HydrophobicContact CE2-CB 4.13Å; N772-K774 VanDerWaalsContact OD1-CB 3.24Å; N772-K774 WeakPolarHBondContact OD1-CB 3.49Å; N772-K774 PolarHBondContact OD1-N 2.74Å; N772-Y775 PolarHBondContact OD1-N 3.01Å; N772-R776 WeakPolarHBondContact O-CA 3.49Å; N772-R776 PolarHBondContact O-N 3.37Å; N772-R777 PolarHBondContact N-O 3.19Å; N772-R777 PolarHBondContact O-N 3.31Å; N772-E779 HydrophobicContact CB-CG 4.09Å; N772-E779 PolarHBondContact ND2-OE1 2.9Å; N772-E779 PolarHBondContact ND2-OE2 2.75Å
773	E	90.1	Very high	94.2	Very high	45 Å²	45	33.4 Å²	33.4	21%	0.21	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-31.9	-179.1	-175	172.7	177.4	0	0	112.9	R752 N754 W771 Y775	R752-E773 HydrophobicContact CB-CB 4.29Å; R752-E773 PolarHBondContact O-N 3.38Å; N754-E773 PolarHBondContact ND2-OE2 2.95Å; W771-E773 PolarHBondContact O-N 3.02Å; E773-Y775 VanDerWaalsContact C-N 3.32Å; E773-Y775 PolarHBondContact O-N 3.23Å
774	K	91.1	Very high	94.5	Very high	120 Å²	120	32.9 Å²	32.9	52%	0.522	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-45.4	179.1	-172.6	-177.9	174.9	-168.4	0	111	N772	N772-K774 VanDerWaalsContact OD1-CB 3.24Å; N772-K774 WeakPolarHBondContact OD1-CB 3.49Å; N772-K774 PolarHBondContact OD1-N 2.74Å
775	Y	91.9	Very high	94.6	Very high	120 Å²	120	32.9 Å²	32.9	47%	0.471	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-5.5	-177	-59.1	-67.6	0	0	0	113.9	N772 E773 R777	N772-Y775 PolarHBondContact OD1-N 3.01Å; E773-Y775 VanDerWaalsContact C-N 3.32Å; E773-Y775 PolarHBondContact O-N 3.23Å; Y775-R777 PolarHBondContact O-N 2.94Å
776	R	93.1	Very high	94.7	Very high	170 Å²	170	32.6 Å²	32.6	64%	0.642	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	50.1	-179.4	-57.4	-174.9	-175.3	171.7	6.6	113.4	W771 N772	W771-R776 VanDerWaalsContact CH2-O 3.25Å; W771-R776 WeakPolarHBondContact CH2-O 3.46Å; W771-R776 HydrophobicContact CZ2-CB 4.09Å; W771-R776 WeakPolarHBondContact CZ2-O 3.4Å; N772-R776 WeakPolarHBondContact O-CA 3.49Å; N772-R776 PolarHBondContact O-N 3.37Å
777	R	94.6	Very high	94.6	Very high	83 Å²	83	34.5 Å²	34.5	31%	0.313	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	159.3	-178.4	66.8	-167.5	-177.4	-176.6	3.5	110.9	N772 Y775 E779 I813	N772-R777 PolarHBondContact N-O 3.19Å; N772-R777 PolarHBondContact O-N 3.31Å; Y775-R777 PolarHBondContact O-N 2.94Å; R777-E779 HydrophobicContact CG-CG 4.17Å; R777-E779 IonicContact CZ-OE1 3.46Å; R777-E779 VanDerWaalsContact CZ-OE1 3.3Å; R777-E779 IonicContact NE-OE1 2.78Å; R777-E779 PolarHBondContact NE-OE1 2.79Å; R777-E779 IonicContact NH2-OE1 3.2Å; R777-E779 PolarHBondContact NH2-OE1 3.25Å; R777-I813 HydrophobicContact CB-CG2 4.43Å; R777-I813 HydrophobicContact CG-CG2 4.33Å; R777-I813 VanDerWaalsContact CZ-CD1 3.42Å
778	T	95.5	Very high	94.4	Very high	8 Å²	8	35.2 Å²	35.2	5%	0.049	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.2	171.8	-48.2	0	0	0	0	109	F814 Q816 I818	T778-F814 WeakPolarHBondContact CB-O 3.3Å; T778-F814 HydrophobicContact CG2-CB 4.4Å; T778-F814 PolarHBondContact O-N 3.15Å; T778-Q816 VanDerWaalsContact CB-O 3.28Å; T778-Q816 WeakPolarHBondContact CB-O 3.19Å; T778-Q816 PolarHBondContact OG1-O 2.98Å; T778-I818 HydrophobicContact CG2-CD1 3.94Å; T778-I818 HydrophobicContact CG2-CG1 4.16Å
779	E	96.1	Very high	94.2	Very high	13 Å²	13	41.4 Å²	41.4	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.4	174	-67.4	-178.7	168.8	0	0	109.4	S769 F770 N772 R777 Y812	S769-E779 VanDerWaalsContact CA-O 3.23Å; S769-E779 WeakPolarHBondContact CA-O 3.44Å; F770-E779 HydrophobicContact CE1-CB 4.37Å; F770-E779 HydrophobicContact CE2-CB 4.12Å; F770-E779 HydrophobicContact CZ-CB 3.97Å; F770-E779 PolarHBondContact N-O 2.96Å; F770-E779 PolarHBondContact O-N 3.2Å; N772-E779 HydrophobicContact CB-CG 4.09Å; N772-E779 PolarHBondContact ND2-OE1 2.9Å; N772-E779 PolarHBondContact ND2-OE2 2.75Å; R777-E779 HydrophobicContact CG-CG 4.17Å; R777-E779 IonicContact CZ-OE1 3.46Å; R777-E779 VanDerWaalsContact CZ-OE1 3.3Å; R777-E779 IonicContact NE-OE1 2.78Å; R777-E779 PolarHBondContact NE-OE1 2.79Å; R777-E779 IonicContact NH2-OE1 3.2Å; R777-E779 PolarHBondContact NH2-OE1 3.25Å; E779-Y812 CarbonylContact C-O 3.51Å; E779-Y812 WeakPolarHBondContact CA-O 3.39Å
780	V	95.9	Very high	93.9	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.018	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.6	175.6	180	0	0	0	0	106.8	V767 Y768 Y812 F814 I818 L852	V767-V780 HydrophobicContact CG1-CG1 3.74Å; Y768-V780 WeakPolarHBondContact O-CA 2.86Å; V780-Y812 PolarHBondContact N-O 3.32Å; V780-Y812 PolarHBondContact O-N 3.13Å; V780-F814 HydrophobicContact CG2-CB 3.96Å; V780-I818 HydrophobicContact CG2-CD1 3.69Å; V780-L852 HydrophobicContact CG1-CD1 4.32Å; V780-L852 HydrophobicContact CG1-CD2 4.23Å
781	S	96.3	Very high	93.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	142.9	-177	-63.8	0	0	0	0	110.5	V767 Y768 S811	V767-S781 WeakPolarHBondContact CA-O 3.23Å; Y768-S781 VanDerWaalsContact CE1-CB 3.41Å; Y768-S781 PolarHBondContact N-O 3.33Å; Y768-S781 PolarHBondContact O-N 2.74Å; Y768-S781 VanDerWaalsContact OH-CB 3.26Å; Y768-S781 WeakPolarHBondContact OH-CB 3.13Å; S781-S811 WeakPolarHBondContact OG-CB 3.27Å; S781-S811 PolarHBondContact OG-OG 2.96Å
782	V	96.4	Very high	93.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.3	-175.4	-171.1	0	0	0	0	108.4	I766 V767 E784 H809 Q810 Y812 L852	I766-V782 CarbonylContact O-C 3.57Å; I766-V782 WeakPolarHBondContact O-CA 3.2Å; V767-V782 HydrophobicContact CG2-CB 4.42Å; V767-V782 HydrophobicContact CG2-CG1 4.06Å; V767-V782 HydrophobicContact CG2-CG2 4.08Å; V782-E784 HydrophobicContact CG1-CG 4.34Å; V782-H809 WeakPolarHBondContact O-CA 3.46Å; V782-H809 PolarHBondContact O-CD2 2.93Å; V782-Q810 PolarHBondContact N-O 3.12Å; V782-Q810 PolarHBondContact O-N 3.39Å; V782-Q810 VanDerWaalsContact O-N 3.08Å; V782-Y812 HydrophobicContact CG2-CD2 4.21Å; V782-Y812 HydrophobicContact CG2-CE2 4.18Å; V782-L852 HydrophobicContact CG2-CB 3.65Å; V782-L852 HydrophobicContact CG2-CD2 3.75Å; V782-L852 HydrophobicContact CG2-CG 4.16Å
783	L	96.3	Very high	93	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135.5	162.4	-54.6	101	0	0	0	109.5	H746 V748 W765 I766 Y768 V807 Y808	H746-L783 VanDerWaalsContact CD2-CD2 3.43Å; H746-L783 WeakPolarHBondContact CD2-CD2 3.49Å; V748-L783 HydrophobicContact CG2-CD2 3.65Å; W765-L783 CarbonylContact C-O 3.31Å; W765-L783 WeakPolarHBondContact CA-O 3.48Å; W765-L783 WeakPolarHBondContact CB-O 3.43Å; I766-L783 HydrophobicContact CB-CB 4.32Å; I766-L783 HydrophobicContact CB-CD1 3.94Å; I766-L783 HydrophobicContact CG2-CD1 4.09Å; I766-L783 PolarHBondContact N-O 3.01Å; I766-L783 PolarHBondContact O-N 3.32Å; Y768-L783 HydrophobicContact CD1-CD1 3.91Å; Y768-L783 HydrophobicContact CE1-CD1 3.41Å; Y768-L783 VanDerWaalsContact CE1-CD1 3.41Å; L783-V807 HydrophobicContact CB-CG1 4.29Å; L783-V807 HydrophobicContact CD2-CG1 3.91Å; L783-Y808 CarbonylContact C-O 3.58Å; L783-Y808 VanDerWaalsContact CA-O 3.31Å; L783-Y808 WeakPolarHBondContact CA-O 3.47Å
784	E	95.7	Very high	92.9	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.4	165.8	-64.8	-165.8	164.2	0	0	109.9	W765 V782 Y786 V807 Y808 K849 P854	W765-E784 HydrophobicContact CB-CG 3.85Å; V782-E784 HydrophobicContact CG1-CG 4.34Å; E784-Y786 HydrophobicContact CB-CD2 4.37Å; E784-Y786 HydrophobicContact CB-CE2 3.65Å; E784-Y786 WeakPolarHBondContact OE2-CE2 3.44Å; E784-Y786 PolarHBondContact OE2-OH 2.86Å; E784-V807 WeakPolarHBondContact O-CA 3.5Å; E784-Y808 PolarHBondContact N-O 3.36Å; E784-Y808 PolarHBondContact O-N 3.44Å; E784-K849 IonicContact OE1-NZ 3.28Å; E784-K849 PolarHBondContact OE1-NZ 2.86Å; E784-P854 HydrophobicContact CB-CG 3.85Å; E784-P854 VanDerWaalsContact CD-CD 3.41Å; E784-P854 HydrophobicContact CG-CG 3.62Å
785	M	95.3	Very high	92.8	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.025	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.7	179.9	-63.8	170.1	-74.1	0	0	110.2	Y693 I698 V745 N764 I766 P805 L806 V807	Y693-M785 HydrophobicContact CD1-CB 3.98Å; Y693-M785 HydrophobicContact CD1-SD 4.18Å; Y693-M785 HydrophobicContact CG-CB 4.25Å; Y693-M785 PolarHBondContact N-O 2.91Å; I698-M785 HydrophobicContact CD1-CE 3.59Å; I698-M785 HydrophobicContact CD1-SD 3.9Å; V745-M785 HydrophobicContact CG1-SD 4.4Å; N764-M785 PolarHBondContact ND2-O 3.31Å; N764-M785 PolarHBondContact O-N 2.92Å; I766-M785 HydrophobicContact CD1-CE 3.82Å; I766-M785 HydrophobicContact CG1-CE 4.11Å; M785-P805 HydrophobicContact CB-CB 4Å; M785-P805 HydrophobicContact CB-CG 4.4Å; M785-P805 HydrophobicContact CG-CB 4.49Å; M785-P805 HydrophobicContact CG-CG 4.41Å; M785-L806 CarbonylContact C-O 3.4Å; M785-L806 WeakPolarHBondContact CA-O 3.31Å; M785-V807 HydrophobicContact CG-CG1 4.36Å; M785-V807 HydrophobicContact CG-CG2 4.08Å
786	Y	95.4	Very high	92.5	Very high	3 Å²	3	52.2 Å²	52.2	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.3	179.2	-66.7	-83.5	0	0	0	110.4	L690 Y691 K692 E784 P805 L806 Y808	L690-Y786 HydrophobicContact CB-CD1 4.45Å; L690-Y786 HydrophobicContact CD1-CD1 4.39Å; L690-Y786 HydrophobicContact CD1-CG 4.35Å; L690-Y786 HydrophobicContact CD2-CD1 3.54Å; L690-Y786 HydrophobicContact CD2-CD2 4.02Å; L690-Y786 HydrophobicContact CD2-CE1 3.62Å; L690-Y786 HydrophobicContact CD2-CE2 4.1Å; L690-Y786 HydrophobicContact CD2-CG 3.72Å; L690-Y786 HydrophobicContact CG-CD1 3.46Å; L690-Y786 VanDerWaalsContact CG-CD1 3.46Å; L690-Y786 HydrophobicContact CG-CE1 3.91Å; L690-Y786 HydrophobicContact CG-CG 3.82Å; Y691-Y786 CarbonylContact O-C 3.52Å; Y691-Y786 WeakPolarHBondContact O-CA 3.48Å; Y691-Y786 WeakPolarHBondContact O-CB 3.41Å; Y691-Y786 WeakPolarHBondContact O-CD1 3.35Å; K692-Y786 HydrophobicContact CG-CD1 4.46Å; K692-Y786 HydrophobicContact CG-CE1 4.22Å; E784-Y786 HydrophobicContact CB-CD2 4.37Å; E784-Y786 HydrophobicContact CB-CE2 3.65Å; E784-Y786 WeakPolarHBondContact OE2-CE2 3.44Å; E784-Y786 PolarHBondContact OE2-OH 2.86Å; Y786-P805 CarbonylContact O-C 3.51Å; Y786-P805 WeakPolarHBondContact O-CA 3.14Å; Y786-P805 WeakPolarHBondContact O-CB 3.49Å; Y786-L806 PolarHBondContact N-O 2.79Å; Y786-L806 PolarHBondContact O-N 3.42Å; Y786-Y808 AromaticContact CD2-CD2 3.54Å; Y786-Y808 HydrophobicContact CD2-CD2 3.54Å; Y786-Y808 AromaticContact CD2-CE2 3.71Å; Y786-Y808 HydrophobicContact CD2-CE2 3.71Å; Y786-Y808 AromaticContact CE2-CD2 3.72Å; Y786-Y808 HydrophobicContact CE2-CD2 3.72Å; Y786-Y808 HydrophobicContact CE2-CE2 4.08Å
787	E	93.4	Very high	92.1	Very high	41 Å²	41	47.8 Å²	47.8	19%	0.192	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-33.4	174.7	179.3	168.1	-153	0	0	111.4	Y691 A792 L803	Y691-E787 PolarHBondContact O-N 2.85Å; E787-A792 WeakPolarHBondContact OE1-CA 3.21Å; E787-A792 WeakPolarHBondContact OE1-CB 3.04Å; E787-A792 PolarHBondContact OE1-N 2.62Å; E787-L803 HydrophobicContact CB-CD2 4.44Å; E787-L803 HydrophobicContact CG-CD1 4.38Å; E787-L803 HydrophobicContact CG-CD2 3.83Å; E787-L803 VanDerWaalsContact OE1-CD2 3.25Å; E787-L803 WeakPolarHBondContact OE1-CD2 3.44Å
788	G	91.7	Very high	91.8	Very high	17 Å²	17	45.9 Å²	45.9	18%	0.175	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.1	-159	-177.1	0	0	0	0	0	111.5	Y691 V790	Y691-G788 PolarHBondContact N-O 2.94Å; G788-V790 VanDerWaalsContact C-N 3.34Å
789	E	90.2	Very high	91.3	Very high	129 Å²	129	46 Å²	46	60%	0.603	27%	0.272	S	S	*	.	S	Bend	trans	-81.8	-13.3	177	-63.6	-175.5	175.5	0	0	113.4	V689 Y691	V689-E789 WeakPolarHBondContact O-CA 3.44Å; Y691-E789 WeakPolarHBondContact CD2-O 3.35Å; Y691-E789 WeakPolarHBondContact CE2-O 3.45Å
790	V	89.7	Confident	90.8	Very high	115 Å²	115	50.8 Å²	50.8	70%	0.697	30%	0.298	S	S	*	.	S	Bend	trans	-124.8	134.9	-178.8	-178.6	0	0	0	0	109	G788	G788-V790 VanDerWaalsContact C-N 3.34Å
791	Q	88.9	Confident	90.4	Very high	53 Å²	53	59.7 Å²	59.7	25%	0.248	33%	0.332	C	S	.	.			trans	-84	135.6	173.2	-60.9	-177.2	-54.4	0	0	110.5	Y691	Y691-Q791 HydrophobicContact CD1-CG 3.36Å; Y691-Q791 HydrophobicContact CD2-CG 3.55Å; Y691-Q791 HydrophobicContact CE1-CG 3.62Å; Y691-Q791 HydrophobicContact CE2-CG 3.81Å; Y691-Q791 HydrophobicContact CG-CG 3.29Å
792	A	87.2	Confident	89.6	Confident	78 Å²	78	64.2 Å²	64.2	65%	0.645	36%	0.362	S	S	*	.	S	Bend	trans	-68.9	-40.3	174	0	0	0	0	0	111.4	E787 L803	E787-A792 WeakPolarHBondContact OE1-CA 3.21Å; E787-A792 WeakPolarHBondContact OE1-CB 3.04Å; E787-A792 PolarHBondContact OE1-N 2.62Å; A792-L803 HydrophobicContact CB-CD1 4.06Å
793	N	89.1	Confident	89.2	Confident	76 Å²	76	66.3 Å²	66.3	41%	0.406	37%	0.373	S	S	.	.			trans	-150	114.5	172.6	-172.4	-14.7	0	0	0	111.7	T795 S796	N793-T795 PolarHBondContact O-N 3.26Å; N793-T795 PolarHBondContact OD1-N 3.03Å; N793-T795 PolarHBondContact OD1-OG1 3.48Å; N793-S796 PolarHBondContact ND2-O 3.31Å; N793-S796 PolarHBondContact ND2-OG 3.24Å; N793-S796 PolarHBondContact OD1-N 2.66Å
794	P	86.9	Confident	88.8	Confident	99 Å²	99	73.1 Å²	73.1	64%	0.643	40%	0.404	S	S	*	.	S	Bend	trans	-77.1	-17.6	-179.3	29.9	-34.9	0	0	0	114.2
795	T	88.8	Confident	88.7	Confident	124 Å²	124	73.7 Å²	73.7	76%	0.761	41%	0.409	S	S	*	.	S	Bend	trans	-94.4	-35.8	-171	60.1	0	0	0	0	113.6	N793	N793-T795 PolarHBondContact O-N 3.26Å; N793-T795 PolarHBondContact OD1-N 3.03Å; N793-T795 PolarHBondContact OD1-OG1 3.48Å
796	S	85.9	Confident	88.7	Confident	66 Å²	66	77.3 Å²	77.3	46%	0.462	43%	0.428	S	S	.	.			trans	-150.7	136.2	-174.5	65.6	0	0	0	0	110.9	N793	N793-S796 PolarHBondContact ND2-O 3.31Å; N793-S796 PolarHBondContact ND2-OG 3.24Å; N793-S796 PolarHBondContact OD1-N 2.66Å
797	F	86	Confident	88.7	Confident	78 Å²	78	78.8 Å²	78.8	34%	0.342	44%	0.437	S	S	.	.			trans	-94.2	131.6	168	-172.9	-83.4	0	0	0	109.7	Y693 N695 P696	Y693-F797 HydrophobicContact CE2-CE2 4.3Å; Y693-F797 HydrophobicContact CE2-CZ 4.48Å; N695-F797 HydrophobicContact CB-CE1 3.82Å; N695-F797 HydrophobicContact CB-CE2 4.15Å; N695-F797 HydrophobicContact CB-CZ 3.45Å; N695-F797 VanDerWaalsContact CB-CZ 3.45Å; N695-F797 VanDerWaalsContact CG-CZ 3.42Å; N695-F797 VanDerWaalsContact OD1-CE1 3.25Å; N695-F797 WeakPolarHBondContact OD1-CE1 3.2Å; P696-F797 HydrophobicContact CG-CD1 4.19Å
798	S	87	Confident	88.8	Confident	43 Å²	43	80.8 Å²	80.8	30%	0.301	44%	0.444	S	S	.	.			trans	-133.5	120.3	172.4	171.6	0	0	0	0	109.8	L800 Y801	S798-L800 PolarHBondContact O-N 3.48Å; S798-L800 VanDerWaalsContact O-N 3.09Å; S798-L800 PolarHBondContact OG-N 3.24Å; S798-Y801 PolarHBondContact O-N 3.28Å; S798-Y801 VanDerWaalsContact O-N 3.13Å
799	S	86.2	Confident	88.9	Confident	10 Å²	10	83.7 Å²	83.7	7%	0.07	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.2	176.5	-72.3	0	0	0	0	114.3	N697 D738 T741 Y801	N697-S799 PolarHBondContact ND2-OG 3.3Å; D738-S799 WeakPolarHBondContact OD1-CB 3.18Å; D738-S799 PolarHBondContact OD1-OG 3.17Å; D738-S799 WeakPolarHBondContact OD2-CB 3.48Å; D738-S799 PolarHBondContact OD2-OG 3.25Å; T741-S799 WeakPolarHBondContact CG2-O 3.43Å; S799-Y801 VanDerWaalsContact C-N 3.28Å
800	L	85.3	Confident	89.2	Confident	113 Å²	113	78.8 Å²	78.8	59%	0.592	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-22.7	178.7	-60.7	177.6	0	0	0	112.4	I740 T741 S798 P802	I740-L800 HydrophobicContact CG2-CD2 4.5Å; T741-L800 HydrophobicContact CG2-CD2 4.21Å; S798-L800 PolarHBondContact O-N 3.48Å; S798-L800 VanDerWaalsContact O-N 3.09Å; S798-L800 PolarHBondContact OG-N 3.24Å; L800-P802 VanDerWaalsContact O-CD 3.31Å; L800-P802 WeakPolarHBondContact O-CD 3.25Å
801	Y	86.9	Confident	89.4	Confident	190 Å²	190	74.9 Å²	74.9	75%	0.745	41%	0.408	S	S	*	.	S	Bend	trans	-93	108.6	173.2	-65	-72	0	0	0	108.8	S798 S799 L803	S798-Y801 PolarHBondContact O-N 3.28Å; S798-Y801 VanDerWaalsContact O-N 3.13Å; S799-Y801 VanDerWaalsContact C-N 3.28Å; Y801-L803 PolarHBondContact O-N 2.95Å; Y801-L803 VanDerWaalsContact O-N 3.15Å
802	P	79.7	Confident	89.7	Confident	95 Å²	95	72.4 Å²	72.4	62%	0.617	40%	0.396	S	S	*	.			trans	-64.4	116.5	-177.4	23.2	-31.1	0	0	0	110.6	L800	L800-P802 VanDerWaalsContact O-CD 3.31Å; L800-P802 WeakPolarHBondContact O-CD 3.25Å
803	L	87.5	Confident	90.2	Very high	45 Å²	45	69.7 Å²	69.7	24%	0.236	37%	0.37	C	S	.	.			trans	-116.1	129.6	171.9	-174.9	71.2	0	0	0	109	Y693 E787 A792 Y801	Y693-L803 HydrophobicContact CD2-CD2 3.81Å; Y693-L803 HydrophobicContact CD2-CG 4.42Å; Y693-L803 HydrophobicContact CE2-CB 4.15Å; Y693-L803 HydrophobicContact CE2-CD2 3.79Å; Y693-L803 HydrophobicContact CE2-CG 4.13Å; E787-L803 HydrophobicContact CB-CD2 4.44Å; E787-L803 HydrophobicContact CG-CD1 4.38Å; E787-L803 HydrophobicContact CG-CD2 3.83Å; E787-L803 VanDerWaalsContact OE1-CD2 3.25Å; E787-L803 WeakPolarHBondContact OE1-CD2 3.44Å; A792-L803 HydrophobicContact CB-CD1 4.06Å; Y801-L803 PolarHBondContact O-N 2.95Å; Y801-L803 VanDerWaalsContact O-N 3.15Å
804	E	89.1	Confident	90.5	Very high	147 Å²	147	66.1 Å²	66.1	69%	0.687	35%	0.351	S	S	*	.			trans	-98.2	114.6	177.7	-71.2	-179.7	-173.4	0	0	109.7	R743	R743-E804 IonicContact CZ-OE1 3.27Å; R743-E804 IonicContact NH2-OE1 3.05Å; R743-E804 PolarHBondContact NH2-OE1 3.07Å
805	P	93.7	Very high	90.8	Very high	20 Å²	20	65.5 Å²	65.5	13%	0.13	35%	0.347	C	S	.	.			trans	-80.4	149.7	-179	30.4	-32.8	0	0	0	112.8	Y693 V745 M785 Y786 V807	Y693-P805 HydrophobicContact CD1-CB 4.05Å; Y693-P805 HydrophobicContact CD1-CG 4.13Å; Y693-P805 HydrophobicContact CD2-CB 3.79Å; Y693-P805 HydrophobicContact CD2-CG 4.31Å; Y693-P805 HydrophobicContact CE1-CG 4.21Å; Y693-P805 HydrophobicContact CE2-CB 4.3Å; Y693-P805 HydrophobicContact CE2-CG 4.37Å; Y693-P805 HydrophobicContact CG-CB 3.64Å; Y693-P805 HydrophobicContact CG-CG 4.18Å; V745-P805 HydrophobicContact CG1-CG 3.48Å; V745-P805 VanDerWaalsContact CG1-CG 3.48Å; M785-P805 HydrophobicContact CB-CB 4Å; M785-P805 HydrophobicContact CB-CG 4.4Å; M785-P805 HydrophobicContact CG-CB 4.49Å; M785-P805 HydrophobicContact CG-CG 4.41Å; Y786-P805 CarbonylContact O-C 3.51Å; Y786-P805 WeakPolarHBondContact O-CA 3.14Å; Y786-P805 WeakPolarHBondContact O-CB 3.49Å; P805-V807 HydrophobicContact CG-CG2 4.26Å; P805-V807 PolarHBondContact O-N 3.36Å
806	L	94.5	Very high	91	Very high	81 Å²	81	63.7 Å²	63.7	42%	0.424	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	118.6	161	-177.6	67.9	0	0	0	109.3	M785 Y786 Y808	M785-L806 CarbonylContact C-O 3.4Å; M785-L806 WeakPolarHBondContact CA-O 3.31Å; Y786-L806 PolarHBondContact N-O 2.79Å; Y786-L806 PolarHBondContact O-N 3.42Å; L806-Y808 HydrophobicContact CD2-CE2 3.65Å; L806-Y808 WeakPolarHBondContact CD2-OH 3.41Å; L806-Y808 HydrophobicContact CG-CE2 3.98Å
807	V	95.5	Very high	91.3	Very high	35 Å²	35	65.6 Å²	65.6	21%	0.212	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.1	-176.5	-169.6	0	0	0	0	110.4	H746 L783 E784 M785 P805	H746-V807 HydrophobicContact CB-CG2 4.22Å; L783-V807 HydrophobicContact CB-CG1 4.29Å; L783-V807 HydrophobicContact CD2-CG1 3.91Å; E784-V807 WeakPolarHBondContact O-CA 3.5Å; M785-V807 HydrophobicContact CG-CG1 4.36Å; M785-V807 HydrophobicContact CG-CG2 4.08Å; P805-V807 HydrophobicContact CG-CG2 4.26Å; P805-V807 PolarHBondContact O-N 3.36Å
808	Y	95.1	Very high	91.6	Very high	83 Å²	83	62 Å²	62	33%	0.325	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.9	168.2	-64.4	-81.4	0	0	0	109.6	L690 L783 E784 Y786 L806 R855	L690-Y808 HydrophobicContact CD2-CE2 4.44Å; L783-Y808 CarbonylContact C-O 3.58Å; L783-Y808 VanDerWaalsContact CA-O 3.31Å; L783-Y808 WeakPolarHBondContact CA-O 3.47Å; E784-Y808 PolarHBondContact N-O 3.36Å; E784-Y808 PolarHBondContact O-N 3.44Å; Y786-Y808 AromaticContact CD2-CD2 3.54Å; Y786-Y808 HydrophobicContact CD2-CD2 3.54Å; Y786-Y808 AromaticContact CD2-CE2 3.71Å; Y786-Y808 HydrophobicContact CD2-CE2 3.71Å; Y786-Y808 AromaticContact CE2-CD2 3.72Å; Y786-Y808 HydrophobicContact CE2-CD2 3.72Å; Y786-Y808 HydrophobicContact CE2-CE2 4.08Å; L806-Y808 HydrophobicContact CD2-CE2 3.65Å; L806-Y808 WeakPolarHBondContact CD2-OH 3.41Å; L806-Y808 HydrophobicContact CG-CE2 3.98Å; Y808-R855 HydrophobicContact CD2-CG 4.43Å; Y808-R855 HydrophobicContact CG-CG 4.36Å
809	H	95.1	Very high	91.8	Very high	77 Å²	77	61.7 Å²	61.7	36%	0.356	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.5	-178.5	173.5	-123	0	0	0	110.5	E750 Y768 V782	E750-H809 IonicContact OE1-CE1 3.85Å; E750-H809 PolarHBondContact OE1-CE1 2.71Å; E750-H809 IonicContact OE1-NE2 2.79Å; E750-H809 PolarHBondContact OE1-NE2 2.78Å; Y768-H809 PolarHBondContact OH-NE2 2.95Å; V782-H809 WeakPolarHBondContact O-CA 3.46Å; V782-H809 PolarHBondContact O-CD2 2.93Å
810	Q	94.5	Very high	92	Very high	27 Å²	27	61.7 Å²	61.7	13%	0.126	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	142.8	174.8	-163.6	164.8	38.2	0	0	110.6	V782 Y812 D853 P854 R856 Y890	V782-Q810 PolarHBondContact N-O 3.12Å; V782-Q810 PolarHBondContact O-N 3.39Å; V782-Q810 VanDerWaalsContact O-N 3.08Å; Q810-Y812 HydrophobicContact CB-CE2 4.08Å; Q810-Y812 HydrophobicContact CG-CE2 3.99Å; Q810-Y812 PolarHBondContact OE1-OH 3.06Å; Q810-D853 PolarHBondContact OE1-O 3.45Å; Q810-P854 HydrophobicContact CB-CB 3.79Å; Q810-P854 PolarHBondContact OE1-O 3.48Å; Q810-R856 PolarHBondContact NE2-O 3.41Å; Q810-R856 VanDerWaalsContact NE2-O 3.08Å; Q810-Y890 VanDerWaalsContact CD-CD2 3.44Å; Q810-Y890 HydrophobicContact CG-CD2 4.19Å; Q810-Y890 HydrophobicContact CG-CE2 3.71Å
811	S	94.6	Very high	92.3	Very high	33 Å²	33	57.3 Å²	57.3	23%	0.231	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.2	179.7	-61.2	0	0	0	0	111.2	S781 Y890	S781-S811 WeakPolarHBondContact OG-CB 3.27Å; S781-S811 PolarHBondContact OG-OG 2.96Å; S811-Y890 PolarHBondContact O-OH 2.94Å
812	Y	96.1	Very high	92.6	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	157.6	-179.4	-64.5	-93.9	0	0	0	110.4	E779 V780 V782 Q810 F851 L852 D853 R856 Y890 L894	E779-Y812 CarbonylContact C-O 3.51Å; E779-Y812 WeakPolarHBondContact CA-O 3.39Å; V780-Y812 PolarHBondContact N-O 3.32Å; V780-Y812 PolarHBondContact O-N 3.13Å; V782-Y812 HydrophobicContact CG2-CD2 4.21Å; V782-Y812 HydrophobicContact CG2-CE2 4.18Å; Q810-Y812 HydrophobicContact CB-CE2 4.08Å; Q810-Y812 HydrophobicContact CG-CE2 3.99Å; Q810-Y812 PolarHBondContact OE1-OH 3.06Å; Y812-F851 WeakPolarHBondContact CE1-O 3.31Å; Y812-L852 HydrophobicContact CD1-CD2 4.37Å; Y812-L852 HydrophobicContact CD2-CD2 3.35Å; Y812-L852 HydrophobicContact CE2-CD2 3.87Å; Y812-L852 HydrophobicContact CG-CD2 3.65Å; Y812-D853 PolarHBondContact OH-O 3.35Å; Y812-R856 WeakPolarHBondContact OH-CD 3.03Å; Y812-Y890 HydrophobicContact CD1-CE2 4.04Å; Y812-Y890 AromaticContact CE1-CD2 3.8Å; Y812-Y890 HydrophobicContact CE1-CD2 3.8Å; Y812-Y890 AromaticContact CE1-CE2 3.66Å; Y812-Y890 HydrophobicContact CE1-CE2 3.66Å; Y812-L894 HydrophobicContact CD1-CD2 4.02Å; Y812-L894 HydrophobicContact CG-CD2 4.32Å
813	I	96.7	Very high	93.2	Very high	20 Å²	20	44.8 Å²	44.8	10%	0.103	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.6	179.2	-55.8	163.3	0	0	0	108.1	R777 P892 D893 L894	R777-I813 HydrophobicContact CB-CG2 4.43Å; R777-I813 HydrophobicContact CG-CG2 4.33Å; R777-I813 VanDerWaalsContact CZ-CD1 3.42Å; I813-P892 HydrophobicContact CD1-CB 3.98Å; I813-P892 HydrophobicContact CG1-CB 4.48Å; I813-P892 PolarHBondContact N-O 3.15Å; I813-D893 WeakPolarHBondContact CD1-OD1 3.49Å; I813-L894 PolarHBondContact O-N 3.41Å
814	F	95.9	Very high	93.5	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.3	171	-167.9	-110.6	0	0	0	109.3	T778 V780 Q816 I818 I837 M839 L894 I896	T778-F814 WeakPolarHBondContact CB-O 3.3Å; T778-F814 HydrophobicContact CG2-CB 4.4Å; T778-F814 PolarHBondContact O-N 3.15Å; V780-F814 HydrophobicContact CG2-CB 3.96Å; F814-Q816 HydrophobicContact CD1-CB 4.28Å; F814-Q816 VanDerWaalsContact CD1-O 3.22Å; F814-Q816 WeakPolarHBondContact CD1-O 3.32Å; F814-Q816 HydrophobicContact CE1-CB 3.83Å; F814-Q816 PolarHBondContact O-N 3.44Å; F814-I818 HydrophobicContact CB-CD1 4.42Å; F814-I818 HydrophobicContact CD1-CD1 3.77Å; F814-I818 HydrophobicContact CD1-CG1 3.54Å; F814-I818 HydrophobicContact CE1-CD1 4.32Å; F814-I818 HydrophobicContact CE1-CG1 3.77Å; F814-I818 HydrophobicContact CG-CD1 4.2Å; F814-I818 HydrophobicContact CG-CG1 4.44Å; F814-I837 HydrophobicContact CD2-CD1 4.44Å; F814-I837 HydrophobicContact CE1-CG2 3.89Å; F814-I837 HydrophobicContact CE2-CD1 4.01Å; F814-I837 HydrophobicContact CE2-CG2 4.49Å; F814-I837 HydrophobicContact CZ-CD1 4.32Å; F814-I837 HydrophobicContact CZ-CG2 3.79Å; F814-M839 HydrophobicContact CE1-CG 4.21Å; F814-M839 HydrophobicContact CE1-SD 4.34Å; F814-M839 HydrophobicContact CZ-CG 4.32Å; F814-M839 HydrophobicContact CZ-SD 4.06Å; F814-L894 HydrophobicContact CD2-CB 4.27Å; F814-L894 HydrophobicContact CD2-CD1 4.23Å; F814-I896 HydrophobicContact CE1-CD1 4.32Å; F814-I896 HydrophobicContact CE2-CD1 3.91Å; F814-I896 HydrophobicContact CE2-CG1 3.9Å; F814-I896 HydrophobicContact CZ-CD1 3.68Å; F814-I896 HydrophobicContact CZ-CG1 4.12Å
815	P	93.2	Very high	93.5	Very high	86 Å²	86	38 Å²	38	56%	0.558	20%	0.197	S	C	*	.	S	Bend	trans	-73.7	-12.5	-168.6	27.9	-35.1	0	0	0	114	I896	P815-I896 HydrophobicContact CG-CD1 3.52Å; P815-I896 HydrophobicContact CG-CG1 3.86Å
816	Q	92.6	Very high	93.4	Very high	87 Å²	87	37.6 Å²	37.6	41%	0.407	20%	0.195	S	C	.	.	S	Bend	trans	-116.1	171.2	179.3	-70.1	-72.2	-8.5	0	0	111.2	T778 F814 M839 I896	T778-Q816 VanDerWaalsContact CB-O 3.28Å; T778-Q816 WeakPolarHBondContact CB-O 3.19Å; T778-Q816 PolarHBondContact OG1-O 2.98Å; F814-Q816 HydrophobicContact CD1-CB 4.28Å; F814-Q816 VanDerWaalsContact CD1-O 3.22Å; F814-Q816 WeakPolarHBondContact CD1-O 3.32Å; F814-Q816 HydrophobicContact CE1-CB 3.83Å; F814-Q816 PolarHBondContact O-N 3.44Å; Q816-M839 HydrophobicContact CB-CG 4.39Å; Q816-M839 HydrophobicContact CB-SD 4.15Å; Q816-M839 HydrophobicContact CG-SD 4.19Å; Q816-I896 HydrophobicContact CB-CD1 4.24Å; Q816-I896 HydrophobicContact CG-CD1 3.76Å
817	K	92.2	Very high	93	Very high	106 Å²	106	36.5 Å²	36.5	46%	0.461	19%	0.187	S	C	.	.			trans	-80.7	148.4	169	-177.6	170.6	176	162.1	0	110	P756 P840	P756-K817 HydrophobicContact CG-CD 4.5Å; P756-K817 HydrophobicContact CG-CG 4.17Å; K817-P840 HydrophobicContact CB-CG 4.21Å; K817-P840 WeakPolarHBondContact O-CD 3.29Å
818	I	93.2	Very high	92.7	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	20%	0.202	C	C	.	.			trans	-106.5	130.1	179.7	-58.9	170.7	0	0	0	109.7	P756 H758 T778 V780 F814 L821 I837	P756-I818 VanDerWaalsContact CG-O 3.28Å; P756-I818 WeakPolarHBondContact CG-O 3.34Å; H758-I818 PolarHBondContact NE2-O 3Å; T778-I818 HydrophobicContact CG2-CD1 3.94Å; T778-I818 HydrophobicContact CG2-CG1 4.16Å; V780-I818 HydrophobicContact CG2-CD1 3.69Å; F814-I818 HydrophobicContact CB-CD1 4.42Å; F814-I818 HydrophobicContact CD1-CD1 3.77Å; F814-I818 HydrophobicContact CD1-CG1 3.54Å; F814-I818 HydrophobicContact CE1-CD1 4.32Å; F814-I818 HydrophobicContact CE1-CG1 3.77Å; F814-I818 HydrophobicContact CG-CD1 4.2Å; F814-I818 HydrophobicContact CG-CG1 4.44Å; I818-L821 HydrophobicContact CD1-CD2 4.33Å; I818-L821 HydrophobicContact CG2-CD1 4.48Å; I818-L821 HydrophobicContact CG2-CD2 3.59Å; I818-L821 HydrophobicContact CG2-CG 3.69Å; I818-I837 HydrophobicContact CB-CG2 4.4Å; I818-I837 HydrophobicContact CD1-CG2 4.15Å; I818-I837 HydrophobicContact CG1-CG2 3.78Å; I818-I837 HydrophobicContact CG2-CG2 3.91Å
819	T	90.8	Very high	92.4	Very high	38 Å²	38	36.9 Å²	36.9	23%	0.233	19%	0.19	C	C	.	.	S	Bend	trans	-98.9	-35.4	179.2	53.4	0	0	0	0	113.4	H758 A838 P840	H758-T819 VanDerWaalsContact CE1-C 3.42Å; H758-T819 PolarHBondContact CE1-O 3.07Å; H758-T819 PolarHBondContact NE2-O 2.84Å; T819-A838 PolarHBondContact N-O 2.93Å; T819-A838 VanDerWaalsContact OG1-CB 3.27Å; T819-A838 WeakPolarHBondContact OG1-CB 3.41Å; T819-A838 PolarHBondContact OG1-O 2.86Å; T819-P840 HydrophobicContact CG2-CB 4.07Å
820	S	90.2	Very high	92.2	Very high	10 Å²	10	37 Å²	37	7%	0.07	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	148.5	174.8	-175.4	0	0	0	0	108.6	A838	S820-A838 PolarHBondContact O-N 3.13Å
821	L	91.4	Very high	92.2	Very high	20 Å²	20	36 Å²	36	11%	0.105	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.5	169.2	-66.4	178.9	0	0	0	109.7	H758 I760 I818 L836 I837	H758-L821 HydrophobicContact CB-CB 4.22Å; H758-L821 HydrophobicContact CB-CD1 3.58Å; H758-L821 HydrophobicContact CB-CG 3.85Å; I760-L821 HydrophobicContact CD1-CB 3.42Å; I760-L821 VanDerWaalsContact CD1-CB 3.42Å; I760-L821 HydrophobicContact CG1-CB 4.13Å; I818-L821 HydrophobicContact CD1-CD2 4.33Å; I818-L821 HydrophobicContact CG2-CD1 4.48Å; I818-L821 HydrophobicContact CG2-CD2 3.59Å; I818-L821 HydrophobicContact CG2-CG 3.69Å; L821-L836 CarbonylContact C-O 3.46Å; L821-L836 WeakPolarHBondContact CA-O 3.18Å; L821-I837 HydrophobicContact CD2-CB 4.01Å; L821-I837 HydrophobicContact CD2-CD1 4.31Å; L821-I837 HydrophobicContact CD2-CG1 3.63Å; L821-I837 HydrophobicContact CD2-CG2 3.84Å
822	A	92.6	Very high	92.1	Very high	11 Å²	11	37.6 Å²	37.6	9%	0.091	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	174	167.2	0	0	0	0	0	111	L835 L836 I914	A822-L835 CarbonylContact O-C 3.56Å; A822-L835 WeakPolarHBondContact O-CA 3.34Å; A822-L836 HydrophobicContact CB-CB 4.38Å; A822-L836 PolarHBondContact N-O 2.91Å; A822-L836 PolarHBondContact O-N 3.07Å; A822-I914 HydrophobicContact CB-CB 3.65Å; A822-I914 HydrophobicContact CB-CD1 4.46Å; A822-I914 HydrophobicContact CB-CG2 3.75Å
823	V	93.5	Very high	91.9	Very high	12 Å²	12	38.5 Å²	38.5	7%	0.073	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.6	178.8	178.9	0	0	0	0	110	I760 W765 R833 F834 L835 T916	I760-V823 HydrophobicContact CD1-CG2 4.06Å; I760-V823 HydrophobicContact CG2-CG2 3.53Å; W765-V823 HydrophobicContact CH2-CG1 4.27Å; W765-V823 HydrophobicContact CH2-CG2 3.58Å; W765-V823 HydrophobicContact CZ2-CG1 4.31Å; W765-V823 HydrophobicContact CZ2-CG2 4.36Å; W765-V823 HydrophobicContact CZ3-CG2 4.36Å; V823-R833 HydrophobicContact CG1-CB 3.97Å; V823-R833 HydrophobicContact CG1-CG 4.39Å; V823-F834 WeakPolarHBondContact CA-O 3.42Å; V823-L835 HydrophobicContact CG2-CD2 3.68Å; V823-L835 HydrophobicContact CG2-CG 4.42Å; V823-T916 WeakPolarHBondContact O-CB 3.5Å; V823-T916 VanDerWaalsContact O-CG2 3.25Å; V823-T916 WeakPolarHBondContact O-CG2 3.36Å; V823-T916 PolarHBondContact O-OG1 3.35Å
824	T	93.4	Very high	91.8	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	20%	0.201	C	C	.	.			trans	-68.3	141.5	175.4	56.8	0	0	0	0	112.1	R833 F834 L836 P949	T824-R833 VanDerWaalsContact O-CD 3.27Å; T824-R833 WeakPolarHBondContact O-CD 3.32Å; T824-R833 PolarHBondContact O-NH1 3.38Å; T824-F834 HydrophobicContact CG2-CB 4.04Å; T824-F834 PolarHBondContact N-O 2.77Å; T824-F834 PolarHBondContact OG1-N 2.88Å; T824-F834 PolarHBondContact OG1-O 2.93Å; T824-L836 HydrophobicContact CG2-CD1 4.25Å; T824-L836 HydrophobicContact CG2-CD2 4.09Å; T824-L836 HydrophobicContact CG2-CG 4.13Å; T824-P949 HydrophobicContact CG2-CG 4.14Å
825	E	89.1	Confident	91.7	Very high	47 Å²	47	38.8 Å²	38.8	22%	0.22	20%	0.201	C	C	.	.			trans	-127.1	136.5	-177.9	-61.1	-169.6	167.3	0	0	113	R833 P918 S925	E825-R833 VanDerWaalsContact CA-NH1 3.35Å; E825-P918 WeakPolarHBondContact O-CA 3.16Å; E825-S925 PolarHBondContact N-OG 3.27Å; E825-S925 VanDerWaalsContact N-OG 3.12Å; E825-S925 VanDerWaalsContact O-CB 3.24Å; E825-S925 WeakPolarHBondContact O-CB 3.3Å; E825-S925 PolarHBondContact O-OG 2.9Å
826	T	91.6	Very high	91.8	Very high	12 Å²	12	34.7 Å²	34.7	7%	0.074	18%	0.175	C	C	.	.			trans	-136.6	158.5	-179.6	64.2	0	0	0	0	109.6	K828 A829 T831 E922	T826-K828 PolarHBondContact O-N 2.89Å; T826-A829 WeakPolarHBondContact OG1-CA 3.22Å; T826-A829 PolarHBondContact OG1-N 3.24Å; T826-T831 HydrophobicContact CG2-CG2 4.44Å; T826-E922 WeakPolarHBondContact CB-O 3.49Å; T826-E922 WeakPolarHBondContact CB-OE1 3.39Å; T826-E922 WeakPolarHBondContact CG2-O 3.4Å; T826-E922 PolarHBondContact OG1-OE1 2.86Å
827	E	85.9	Confident	91.9	Very high	58 Å²	58	30.7 Å²	30.7	27%	0.271	16%	0.156	S	C	.	.	S	Bend	trans	-63.4	-37.3	-167.7	-167.6	-168.8	154	0	0	113.3	K676 P918 E922	K676-E827 WeakPolarHBondContact CD-O 3.4Å; K676-E827 PolarHBondContact NZ-O 2.83Å; E827-P918 HydrophobicContact CB-CB 4.41Å; E827-E922 PolarHBondContact N-OE2 3.41Å
828	K	89.1	Confident	92	Very high	118 Å²	118	25.7 Å²	25.7	51%	0.513	14%	0.135	S	C	.	.	S	Bend	trans	-112	-5.5	-178.4	-61.7	179.5	-178.5	172.8	0	113.4	T826 I830 E922	T826-K828 PolarHBondContact O-N 2.89Å; K828-I830 HydrophobicContact CB-CD1 3.92Å; K828-I830 HydrophobicContact CB-CG1 3.87Å; K828-I830 HydrophobicContact CD-CD1 4.1Å; K828-I830 PolarHBondContact O-N 3.32Å; K828-E922 WeakPolarHBondContact CA-OE2 3.39Å; K828-E922 WeakPolarHBondContact CB-OE2 3.35Å; K828-E922 PolarHBondContact N-OE2 3.29Å
829	A	88.5	Confident	92	Very high	9 Å²	9	25.7 Å²	25.7	7%	0.074	14%	0.135	C	C	.	.	S	Bend	trans	53.8	36.6	-177	0	0	0	0	0	113.9	K676 H678 T826 E922	K676-A829 WeakPolarHBondContact O-CB 3.49Å; H678-A829 WeakPolarHBondContact CB-O 3.46Å; T826-A829 WeakPolarHBondContact OG1-CA 3.22Å; T826-A829 PolarHBondContact OG1-N 3.24Å; A829-E922 PolarHBondContact N-OE1 3.27Å; A829-E922 VanDerWaalsContact N-OE1 3.1Å
830	I	92	Very high	91.9	Very high	80 Å²	80	26.6 Å²	26.6	41%	0.41	14%	0.141	S	C	.	.			trans	-81.1	-42.2	172.3	-60.6	174.9	0	0	0	109.1	H678 K828 E922	H678-I830 HydrophobicContact CB-CG1 4.14Å; K828-I830 HydrophobicContact CB-CD1 3.92Å; K828-I830 HydrophobicContact CB-CG1 3.87Å; K828-I830 HydrophobicContact CD-CD1 4.1Å; K828-I830 PolarHBondContact O-N 3.32Å; I830-E922 HydrophobicContact CB-CG 3.89Å; I830-E922 HydrophobicContact CD1-CG 4.3Å; I830-E922 HydrophobicContact CG1-CG 4.36Å; I830-E922 PolarHBondContact N-OE1 2.89Å
831	T	92.9	Very high	91.8	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.031	16%	0.158	C	C	.	.	S	Bend	trans	-62.1	135.2	176.2	-64.6	0	0	0	0	109.9	T826 R833 E922 P949 A950 F953	T826-T831 HydrophobicContact CG2-CG2 4.44Å; T831-R833 PolarHBondContact O-N 3.36Å; T831-E922 PolarHBondContact N-OE1 3.1Å; T831-E922 PolarHBondContact OG1-O 3Å; T831-P949 HydrophobicContact CG2-CB 3.88Å; T831-P949 HydrophobicContact CG2-CG 3.92Å; T831-A950 HydrophobicContact CG2-CB 4.15Å; T831-F953 WeakPolarHBondContact OG1-CE1 3.16Å
832	P	92.6	Very high	91.7	Very high	67 Å²	67	29.9 Å²	29.9	44%	0.435	15%	0.154	S	C	.	.	P	Polyproline II helix	trans	-56.1	138.5	176.8	23.5	-35.5	0	0	0	111.5	F834 A950	P832-F834 HydrophobicContact CB-CD2 4.47Å; P832-F834 HydrophobicContact CB-CE2 4.12Å; P832-F834 HydrophobicContact CG-CE2 3.94Å; P832-F834 WeakPolarHBondContact O-CD2 3.33Å; P832-A950 HydrophobicContact CG-CB 3.87Å
833	R	91.8	Very high	91.7	Very high	20 Å²	20	29.5 Å²	29.5	8%	0.075	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-73.7	135.3	176.4	-58	-64.8	-171.2	155.8	0	110.5	E763 W765 V823 T824 E825 T831 K849	E763-R833 IonicContact OE1-NE 3.35Å; E763-R833 PolarHBondContact OE1-NE 3.33Å; W765-R833 HydrophobicContact CZ2-CB 4.32Å; V823-R833 HydrophobicContact CG1-CB 3.97Å; V823-R833 HydrophobicContact CG1-CG 4.39Å; T824-R833 VanDerWaalsContact O-CD 3.27Å; T824-R833 WeakPolarHBondContact O-CD 3.32Å; T824-R833 PolarHBondContact O-NH1 3.38Å; E825-R833 VanDerWaalsContact CA-NH1 3.35Å; T831-R833 PolarHBondContact O-N 3.36Å; R833-K849 WeakPolarHBondContact O-CB 3.21Å; R833-K849 PolarHBondContact O-N 3.23Å; R833-K849 VanDerWaalsContact O-N 3.15Å
834	F	94.7	Very high	91.8	Very high	24 Å²	24	28.9 Å²	28.9	11%	0.105	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.5	174.4	-80.7	-129.5	0	0	0	109.3	V823 T824 P832 E846 L847 P848 P949	V823-F834 WeakPolarHBondContact CA-O 3.42Å; T824-F834 HydrophobicContact CG2-CB 4.04Å; T824-F834 PolarHBondContact N-O 2.77Å; T824-F834 PolarHBondContact OG1-N 2.88Å; T824-F834 PolarHBondContact OG1-O 2.93Å; P832-F834 HydrophobicContact CB-CD2 4.47Å; P832-F834 HydrophobicContact CB-CE2 4.12Å; P832-F834 HydrophobicContact CG-CE2 3.94Å; P832-F834 WeakPolarHBondContact O-CD2 3.33Å; F834-E846 HydrophobicContact CB-CG 3.94Å; F834-E846 HydrophobicContact CD1-CG 3.26Å; F834-E846 VanDerWaalsContact CD1-OE1 3.25Å; F834-E846 WeakPolarHBondContact CD1-OE1 3.12Å; F834-E846 HydrophobicContact CE1-CG 4.01Å; F834-E846 HydrophobicContact CG-CG 4.03Å; F834-L847 CarbonylContact C-O 3.48Å; F834-L847 WeakPolarHBondContact CA-O 3.18Å; F834-P848 VanDerWaalsContact CD1-CA 3.45Å; F834-P848 HydrophobicContact CD1-CB 3.94Å; F834-P848 HydrophobicContact CD1-CG 3.82Å; F834-P848 HydrophobicContact CD2-CB 4.32Å; F834-P848 HydrophobicContact CE1-CB 3.69Å; F834-P848 HydrophobicContact CE1-CG 3.33Å; F834-P848 HydrophobicContact CE2-CB 3.99Å; F834-P848 HydrophobicContact CE2-CG 4.47Å; F834-P848 HydrophobicContact CG-CB 4.34Å; F834-P848 HydrophobicContact CZ-CB 3.69Å; F834-P848 HydrophobicContact CZ-CG 3.69Å; F834-P949 HydrophobicContact CB-CB 4.39Å; F834-P949 HydrophobicContact CD1-CB 4.43Å; F834-P949 HydrophobicContact CD2-CB 3.36Å; F834-P949 HydrophobicContact CD2-CG 4.44Å; F834-P949 HydrophobicContact CE1-CB 4.48Å; F834-P949 HydrophobicContact CE2-CB 3.52Å; F834-P949 WeakPolarHBondContact CE2-O 3.37Å; F834-P949 HydrophobicContact CG-CB 3.84Å; F834-P949 HydrophobicContact CZ-CB 4.07Å; F834-P949 WeakPolarHBondContact CZ-O 3.34Å
835	L	94.6	Very high	91.9	Very high	2 Å²	2	29 Å²	29	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.4	176.2	-78.3	153.1	0	0	0	109.4	I760 W765 V767 A822 V823 L847 K849 L852	I760-L835 HydrophobicContact CD1-CD2 3.94Å; W765-L835 HydrophobicContact CH2-CD2 4.15Å; W765-L835 HydrophobicContact CH2-CG 4.36Å; W765-L835 HydrophobicContact CZ3-CD2 4.29Å; V767-L835 HydrophobicContact CG1-CD2 4.49Å; V767-L835 HydrophobicContact CG2-CD1 4.33Å; A822-L835 CarbonylContact O-C 3.56Å; A822-L835 WeakPolarHBondContact O-CA 3.34Å; V823-L835 HydrophobicContact CG2-CD2 3.68Å; V823-L835 HydrophobicContact CG2-CG 4.42Å; L835-L847 PolarHBondContact N-O 2.91Å; L835-L847 PolarHBondContact O-N 3.03Å; L835-K849 HydrophobicContact CD1-CD 4.49Å; L835-L852 HydrophobicContact CD1-CD1 3.2Å
836	L	95.4	Very high	92.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.2	174.9	-57.7	175.6	0	0	0	108.4	L821 A822 T824 V845 E846 I902 I914 T916 V927	L821-L836 CarbonylContact C-O 3.46Å; L821-L836 WeakPolarHBondContact CA-O 3.18Å; A822-L836 HydrophobicContact CB-CB 4.38Å; A822-L836 PolarHBondContact N-O 2.91Å; A822-L836 PolarHBondContact O-N 3.07Å; T824-L836 HydrophobicContact CG2-CD1 4.25Å; T824-L836 HydrophobicContact CG2-CD2 4.09Å; T824-L836 HydrophobicContact CG2-CG 4.13Å; L836-V845 WeakPolarHBondContact CA-O 3.42Å; L836-E846 HydrophobicContact CD2-CB 4.07Å; L836-E846 HydrophobicContact CD2-CG 4.43Å; L836-I902 HydrophobicContact CD2-CD1 4.5Å; L836-I914 HydrophobicContact CB-CD1 4.22Å; L836-I914 HydrophobicContact CD1-CG2 3.92Å; L836-T916 HydrophobicContact CD1-CG2 3.46Å; L836-T916 VanDerWaalsContact CD1-CG2 3.46Å; L836-V927 HydrophobicContact CD1-CB 4.33Å; L836-V927 HydrophobicContact CD1-CG1 3.69Å; L836-V927 HydrophobicContact CD1-CG2 3.64Å
837	I	95.4	Very high	92.3	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.015	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	110.1	-174.3	-49.7	-174.6	0	0	0	109.1	F814 I818 L821 I844 V845 L847	F814-I837 HydrophobicContact CD2-CD1 4.44Å; F814-I837 HydrophobicContact CE1-CG2 3.89Å; F814-I837 HydrophobicContact CE2-CD1 4.01Å; F814-I837 HydrophobicContact CE2-CG2 4.49Å; F814-I837 HydrophobicContact CZ-CD1 4.32Å; F814-I837 HydrophobicContact CZ-CG2 3.79Å; I818-I837 HydrophobicContact CB-CG2 4.4Å; I818-I837 HydrophobicContact CD1-CG2 4.15Å; I818-I837 HydrophobicContact CG1-CG2 3.78Å; I818-I837 HydrophobicContact CG2-CG2 3.91Å; L821-I837 HydrophobicContact CD2-CB 4.01Å; L821-I837 HydrophobicContact CD2-CD1 4.31Å; L821-I837 HydrophobicContact CD2-CG1 3.63Å; L821-I837 HydrophobicContact CD2-CG2 3.84Å; I837-I844 WeakPolarHBondContact O-CA 3.26Å; I837-V845 PolarHBondContact N-O 3.45Å; I837-V845 PolarHBondContact O-N 3.09Å; I837-L847 HydrophobicContact CD1-CB 4.27Å; I837-L847 HydrophobicContact CD1-CD2 4.1Å
838	A	94.1	Very high	92.7	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	130.7	173	0	0	0	0	0	111.3	T819 S820 I844 V911 I914	T819-A838 PolarHBondContact N-O 2.93Å; T819-A838 VanDerWaalsContact OG1-CB 3.27Å; T819-A838 WeakPolarHBondContact OG1-CB 3.41Å; T819-A838 PolarHBondContact OG1-O 2.86Å; S820-A838 PolarHBondContact O-N 3.13Å; A838-I844 HydrophobicContact CB-CG1 4.31Å; A838-V911 HydrophobicContact CB-CB 3.69Å; A838-V911 HydrophobicContact CB-CG1 3.85Å; A838-V911 HydrophobicContact CB-CG2 4.04Å; A838-I914 HydrophobicContact CB-CD1 4.05Å
839	M	92.1	Very high	92.9	Very high	1 Å²	1	21 Å²	21	1%	0.005	11%	0.113	C	C	.	.			trans	-106.6	155.2	-179.1	-65.1	175.3	-71.4	0	0	111.4	F814 Q816 F841 G842 G843 V845 I896	F814-M839 HydrophobicContact CE1-CG 4.21Å; F814-M839 HydrophobicContact CE1-SD 4.34Å; F814-M839 HydrophobicContact CZ-CG 4.32Å; F814-M839 HydrophobicContact CZ-SD 4.06Å; Q816-M839 HydrophobicContact CB-CG 4.39Å; Q816-M839 HydrophobicContact CB-SD 4.15Å; Q816-M839 HydrophobicContact CG-SD 4.19Å; M839-F841 VanDerWaalsContact C-N 3.28Å; M839-F841 HydrophobicContact CB-CD1 3.79Å; M839-F841 HydrophobicContact CB-CE1 3.6Å; M839-F841 HydrophobicContact CB-CZ 4.3Å; M839-F841 HydrophobicContact CE-CE1 3.48Å; M839-F841 VanDerWaalsContact CE-CE1 3.48Å; M839-F841 HydrophobicContact CE-CE2 4.24Å; M839-F841 HydrophobicContact CE-CZ 3.23Å; M839-F841 HydrophobicContact CG-CE1 4.13Å; M839-F841 PolarHBondContact O-N 3.17Å; M839-F841 HydrophobicContact SD-CD1 4.45Å; M839-F841 HydrophobicContact SD-CE1 3.41Å; M839-F841 WeakPolarHBondContact SD-CE1 3.41Å; M839-F841 HydrophobicContact SD-CZ 3.84Å; M839-G842 WeakPolarHBondContact O-CA 3.11Å; M839-G842 PolarHBondContact O-N 2.7Å; M839-G843 WeakPolarHBondContact CE-O 3.14Å; M839-G843 PolarHBondContact N-O 3.33Å; M839-V845 HydrophobicContact CE-CB 4.21Å; M839-V845 HydrophobicContact CE-CG2 3.34Å; M839-V845 HydrophobicContact SD-CG2 4.32Å; M839-I896 HydrophobicContact SD-CD1 3.93Å
840	P	89.3	Confident	93	Very high	58 Å²	58	23.6 Å²	23.6	38%	0.377	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.3	-175.2	26	-37.6	0	0	0	114.6	K817 T819 G842	K817-P840 HydrophobicContact CB-CG 4.21Å; K817-P840 WeakPolarHBondContact O-CD 3.29Å; T819-P840 HydrophobicContact CG2-CB 4.07Å; P840-G842 PolarHBondContact O-N 2.92Å
841	F	88	Confident	93	Very high	97 Å²	97	22.2 Å²	22.2	43%	0.425	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-5.1	174.4	71.6	-97.3	0	0	0	113	M839 H909	M839-F841 VanDerWaalsContact C-N 3.28Å; M839-F841 HydrophobicContact CB-CD1 3.79Å; M839-F841 HydrophobicContact CB-CE1 3.6Å; M839-F841 HydrophobicContact CB-CZ 4.3Å; M839-F841 HydrophobicContact CE-CE1 3.48Å; M839-F841 VanDerWaalsContact CE-CE1 3.48Å; M839-F841 HydrophobicContact CE-CE2 4.24Å; M839-F841 HydrophobicContact CE-CZ 3.23Å; M839-F841 HydrophobicContact CG-CE1 4.13Å; M839-F841 PolarHBondContact O-N 3.17Å; M839-F841 HydrophobicContact SD-CD1 4.45Å; M839-F841 HydrophobicContact SD-CE1 3.41Å; M839-F841 WeakPolarHBondContact SD-CE1 3.41Å; M839-F841 HydrophobicContact SD-CZ 3.84Å; F841-H909 PolarHBondContact O-CE1 2.88Å; F841-H909 VanDerWaalsContact O-CE1 3.23Å
842	G	89.4	Confident	93	Very high	1 Å²	1	22 Å²	22	1%	0.01	12%	0.12	C	C	.	.	S	Bend	trans	95.5	7.1	173.5	0	0	0	0	0	115.5	M839 P840 N903 S907 V908	M839-G842 WeakPolarHBondContact O-CA 3.11Å; M839-G842 PolarHBondContact O-N 2.7Å; P840-G842 PolarHBondContact O-N 2.92Å; G842-N903 PolarHBondContact O-ND2 2.96Å; G842-S907 WeakPolarHBondContact O-CA 3.48Å; G842-V908 WeakPolarHBondContact CA-O 3.45Å; G842-V908 PolarHBondContact O-N 2.83Å
843	G	92.6	Very high	93.1	Very high	3 Å²	3	19 Å²	19	3%	0.031	10%	0.101	C	C	.	.			trans	-79.6	141.2	168.5	0	0	0	0	0	111.8	M839 N903	M839-G843 WeakPolarHBondContact CE-O 3.14Å; M839-G843 PolarHBondContact N-O 3.33Å; G843-N903 WeakPolarHBondContact CA-OD1 3.48Å
844	I	95.1	Very high	93.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	114.9	172.3	-55.4	170.4	0	0	0	107.4	I837 A838 I901 I902 N903 I914 A929 F943	I837-I844 WeakPolarHBondContact O-CA 3.26Å; A838-I844 HydrophobicContact CB-CG1 4.31Å; I844-I901 CarbonylContact O-C 3.46Å; I844-I901 VanDerWaalsContact O-CA 3.31Å; I844-I901 WeakPolarHBondContact O-CA 3.34Å; I844-I902 HydrophobicContact CB-CD1 3.99Å; I844-I902 HydrophobicContact CB-CG1 3.73Å; I844-I902 HydrophobicContact CG2-CD1 3.55Å; I844-I902 HydrophobicContact CG2-CG1 3.8Å; I844-I902 PolarHBondContact O-N 3.43Å; I844-N903 PolarHBondContact N-OD1 3.2Å; I844-I914 HydrophobicContact CG2-CD1 4.41Å; I844-A929 HydrophobicContact CD1-CB 3.56Å; I844-F943 HydrophobicContact CD1-CD1 4.26Å
845	V	95.2	Very high	92.9	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.012	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.2	179.4	161.4	0	0	0	0	109.8	L836 I837 M839 I896 H900 I901	L836-V845 WeakPolarHBondContact CA-O 3.42Å; I837-V845 PolarHBondContact N-O 3.45Å; I837-V845 PolarHBondContact O-N 3.09Å; M839-V845 HydrophobicContact CE-CB 4.21Å; M839-V845 HydrophobicContact CE-CG2 3.34Å; M839-V845 HydrophobicContact SD-CG2 4.32Å; V845-I896 HydrophobicContact CG2-CG2 4.02Å; V845-H900 WeakPolarHBondContact CA-O 3.43Å; V845-H900 HydrophobicContact CG1-CB 4.42Å; V845-I901 HydrophobicContact CG2-CG1 3.74Å
846	E	95.1	Very high	92.6	Very high	25 Å²	25	19.5 Å²	19.5	12%	0.117	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.7	167.3	167	172.9	-146.6	0	0	109.6	F834 L836 H900 I902 V947	F834-E846 HydrophobicContact CB-CG 3.94Å; F834-E846 HydrophobicContact CD1-CG 3.26Å; F834-E846 VanDerWaalsContact CD1-OE1 3.25Å; F834-E846 WeakPolarHBondContact CD1-OE1 3.12Å; F834-E846 HydrophobicContact CE1-CG 4.01Å; F834-E846 HydrophobicContact CG-CG 4.03Å; L836-E846 HydrophobicContact CD2-CB 4.07Å; L836-E846 HydrophobicContact CD2-CG 4.43Å; E846-H900 PolarHBondContact N-O 2.86Å; E846-H900 WeakPolarHBondContact O-CB 3.42Å; E846-I902 HydrophobicContact CB-CG2 3.74Å; E846-V947 WeakPolarHBondContact OE1-CG1 3.48Å; E846-V947 WeakPolarHBondContact OE2-CG1 3.34Å
847	L	94.6	Very high	91.8	Very high	5 Å²	5	21.8 Å²	21.8	3%	0.026	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.7	-179.4	-175.5	72.6	0	0	0	110.6	F834 L835 I837 K849 F851 L852 L894	F834-L847 CarbonylContact C-O 3.48Å; F834-L847 WeakPolarHBondContact CA-O 3.18Å; L835-L847 PolarHBondContact N-O 2.91Å; L835-L847 PolarHBondContact O-N 3.03Å; I837-L847 HydrophobicContact CD1-CB 4.27Å; I837-L847 HydrophobicContact CD1-CD2 4.1Å; L847-K849 PolarHBondContact O-N 3.41Å; L847-F851 HydrophobicContact CD1-CB 4.15Å; L847-F851 HydrophobicContact CD1-CD2 4.12Å; L847-F851 HydrophobicContact CD1-CG 4.15Å; L847-F851 HydrophobicContact CG-CB 4.32Å; L847-L852 HydrophobicContact CD2-CD1 3.87Å; L847-L852 HydrophobicContact CD2-CG 4.28Å; L847-L894 HydrophobicContact CD2-CD1 4.07Å; L847-L894 HydrophobicContact CD2-CD2 4.34Å
848	P	94.4	Very high	90.6	Very high	16 Å²	16	24.9 Å²	24.9	10%	0.104	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	135.5	176.3	-15	20.9	0	0	0	112.3	F834 S850 F851	F834-P848 VanDerWaalsContact CD1-CA 3.45Å; F834-P848 HydrophobicContact CD1-CB 3.94Å; F834-P848 HydrophobicContact CD1-CG 3.82Å; F834-P848 HydrophobicContact CD2-CB 4.32Å; F834-P848 HydrophobicContact CE1-CB 3.69Å; F834-P848 HydrophobicContact CE1-CG 3.33Å; F834-P848 HydrophobicContact CE2-CB 3.99Å; F834-P848 HydrophobicContact CE2-CG 4.47Å; F834-P848 HydrophobicContact CG-CB 4.34Å; F834-P848 HydrophobicContact CZ-CB 3.69Å; F834-P848 HydrophobicContact CZ-CG 3.69Å; P848-S850 PolarHBondContact O-N 2.87Å; P848-S850 VanDerWaalsContact O-N 3.08Å; P848-F851 HydrophobicContact CB-CD2 3.92Å; P848-F851 HydrophobicContact CB-CE2 4.37Å; P848-F851 HydrophobicContact CG-CD2 3.71Å; P848-F851 HydrophobicContact CG-CE2 3.78Å; P848-F851 WeakPolarHBondContact O-CB 3.13Å; P848-F851 PolarHBondContact O-N 2.82Å
849	K	93.2	Very high	89	Confident	21 Å²	21	29.5 Å²	29.5	9%	0.091	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-58.7	-24	175.9	175.3	61.1	-179.3	69	0	112.8	W765 E784 R833 L835 L847 F851 L852	W765-K849 HydrophobicContact CD2-CD 4.12Å; W765-K849 VanDerWaalsContact CD2-CE 3.41Å; W765-K849 HydrophobicContact CE3-CD 4.3Å; W765-K849 HydrophobicContact CH2-CD 4.12Å; W765-K849 HydrophobicContact CZ2-CD 3.99Å; W765-K849 HydrophobicContact CZ2-CG 4.27Å; W765-K849 HydrophobicContact CZ3-CD 4.3Å; E784-K849 IonicContact OE1-NZ 3.28Å; E784-K849 PolarHBondContact OE1-NZ 2.86Å; R833-K849 WeakPolarHBondContact O-CB 3.21Å; R833-K849 PolarHBondContact O-N 3.23Å; R833-K849 VanDerWaalsContact O-N 3.15Å; L835-K849 HydrophobicContact CD1-CD 4.49Å; L847-K849 PolarHBondContact O-N 3.41Å; K849-F851 PolarHBondContact O-N 2.94Å; K849-L852 HydrophobicContact CD-CB 4.32Å; K849-L852 PolarHBondContact NZ-O 3.48Å; K849-L852 CarbonylContact O-C 3.6Å; K849-L852 WeakPolarHBondContact O-CA 3.35Å; K849-L852 PolarHBondContact O-N 2.9Å
850	S	90.6	Very high	87.1	Confident	65 Å²	65	31 Å²	31	46%	0.455	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-58.7	-28.5	175.4	61.5	0	0	0	0	112.7	P848 L852 R856	P848-S850 PolarHBondContact O-N 2.87Å; P848-S850 VanDerWaalsContact O-N 3.08Å; S850-L852 PolarHBondContact O-N 2.92Å; S850-R856 VanDerWaalsContact C-NH2 3.26Å; S850-R856 PolarHBondContact O-NE 3.42Å; S850-R856 PolarHBondContact O-NH2 3.01Å
851	F	92.6	Very high	85.3	Confident	50 Å²	50	33.6 Å²	33.6	22%	0.219	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-62.7	-26	172.2	-80.4	-82.7	0	0	0	114.1	Y812 L847 P848 K849 R856 L894 P895	Y812-F851 WeakPolarHBondContact CE1-O 3.31Å; L847-F851 HydrophobicContact CD1-CB 4.15Å; L847-F851 HydrophobicContact CD1-CD2 4.12Å; L847-F851 HydrophobicContact CD1-CG 4.15Å; L847-F851 HydrophobicContact CG-CB 4.32Å; P848-F851 HydrophobicContact CB-CD2 3.92Å; P848-F851 HydrophobicContact CB-CE2 4.37Å; P848-F851 HydrophobicContact CG-CD2 3.71Å; P848-F851 HydrophobicContact CG-CE2 3.78Å; P848-F851 WeakPolarHBondContact O-CB 3.13Å; P848-F851 PolarHBondContact O-N 2.82Å; K849-F851 PolarHBondContact O-N 2.94Å; F851-R856 VanDerWaalsContact CA-CZ 3.43Å; F851-R856 PolarHBondContact O-NH1 2.81Å; F851-R856 VanDerWaalsContact O-NH1 3.14Å; F851-L894 HydrophobicContact CB-CD2 4.25Å; F851-P895 HydrophobicContact CD1-CG 4.44Å; F851-P895 HydrophobicContact CE1-CG 3.98Å; F851-P895 HydrophobicContact CZ-CG 4.42Å
852	L	93.5	Very high	83.6	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-114.3	49.5	-172.7	-73.4	172.4	0	0	0	109.7	V780 V782 Y812 L835 L847 K849 S850 L894	V780-L852 HydrophobicContact CG1-CD1 4.32Å; V780-L852 HydrophobicContact CG1-CD2 4.23Å; V782-L852 HydrophobicContact CG2-CB 3.65Å; V782-L852 HydrophobicContact CG2-CD2 3.75Å; V782-L852 HydrophobicContact CG2-CG 4.16Å; Y812-L852 HydrophobicContact CD1-CD2 4.37Å; Y812-L852 HydrophobicContact CD2-CD2 3.35Å; Y812-L852 HydrophobicContact CE2-CD2 3.87Å; Y812-L852 HydrophobicContact CG-CD2 3.65Å; L835-L852 HydrophobicContact CD1-CD1 3.2Å; L847-L852 HydrophobicContact CD2-CD1 3.87Å; L847-L852 HydrophobicContact CD2-CG 4.28Å; K849-L852 HydrophobicContact CD-CB 4.32Å; K849-L852 PolarHBondContact NZ-O 3.48Å; K849-L852 CarbonylContact O-C 3.6Å; K849-L852 WeakPolarHBondContact O-CA 3.35Å; K849-L852 PolarHBondContact O-N 2.9Å; S850-L852 PolarHBondContact O-N 2.92Å; L852-L894 HydrophobicContact CD2-CD1 4Å; L852-L894 HydrophobicContact CD2-CD2 4.12Å
853	D	92.9	Very high	81.7	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.027	22%	0.216	C	C	.	.			trans	-99.2	117.9	177.2	-176.5	-16.9	0	0	0	108.8	R682 Q810 Y812 R855 R856	R682-D853 IonicContact CZ-OD2 2.76Å; R682-D853 IonicContact NH1-OD1 2.87Å; R682-D853 IonicContact NH1-OD2 3.5Å; R682-D853 PolarHBondContact NH1-OD2 3.41Å; R682-D853 IonicContact NH2-OD2 3.49Å; R682-D853 PolarHBondContact NH2-OD2 2.88Å; Q810-D853 PolarHBondContact OE1-O 3.45Å; Y812-D853 PolarHBondContact OH-O 3.35Å; D853-R855 PolarHBondContact O-N 2.88Å; D853-R855 VanDerWaalsContact O-N 3.14Å; D853-R855 WeakPolarHBondContact OD1-CB 3.43Å; D853-R855 WeakPolarHBondContact OD1-CG 3.42Å; D853-R855 PolarHBondContact OD1-N 2.92Å; D853-R855 IonicContact OD1-NE 2.59Å; D853-R855 PolarHBondContact OD1-NE 3.33Å; D853-R855 IonicContact OD2-NE 2.86Å; D853-R855 IonicContact OD2-NH2 3.91Å; D853-R856 HydrophobicContact CB-CG 4.06Å; D853-R856 WeakPolarHBondContact O-CG 3.26Å; D853-R856 PolarHBondContact O-N 3.09Å
854	P	93	Very high	79.7	Confident	13 Å²	13	41.4 Å²	41.4	8%	0.084	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-9.3	-176.4	31.8	-37.5	0	0	0	113.7	E784 Q810 R856	E784-P854 HydrophobicContact CB-CG 3.85Å; E784-P854 VanDerWaalsContact CD-CD 3.41Å; E784-P854 HydrophobicContact CG-CG 3.62Å; Q810-P854 HydrophobicContact CB-CB 3.79Å; Q810-P854 PolarHBondContact OE1-O 3.48Å; P854-R856 VanDerWaalsContact C-N 3.27Å
855	R	89.3	Confident	77.3	Confident	32 Å²	32	49.9 Å²	49.9	12%	0.121	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	2.7	178.8	-52.9	-179.9	-54.7	141	27.7	112.7	Y808 D853 T857 E885	Y808-R855 HydrophobicContact CD2-CG 4.43Å; Y808-R855 HydrophobicContact CG-CG 4.36Å; D853-R855 PolarHBondContact O-N 2.88Å; D853-R855 VanDerWaalsContact O-N 3.14Å; D853-R855 WeakPolarHBondContact OD1-CB 3.43Å; D853-R855 WeakPolarHBondContact OD1-CG 3.42Å; D853-R855 PolarHBondContact OD1-N 2.92Å; D853-R855 IonicContact OD1-NE 2.59Å; D853-R855 PolarHBondContact OD1-NE 3.33Å; D853-R855 IonicContact OD2-NE 2.86Å; D853-R855 IonicContact OD2-NH2 3.91Å; R855-T857 PolarHBondContact O-N 2.83Å; R855-E885 IonicContact CZ-OE2 2.81Å; R855-E885 IonicContact NH1-OE2 3.7Å; R855-E885 PolarHBondContact NH1-OE2 2.99Å; R855-E885 IonicContact NH2-OE2 2.77Å; R855-E885 PolarHBondContact NH2-OE2 3.33Å
856	R	89.1	Confident	74.9	Confident	10 Å²	10	57.9 Å²	57.9	4%	0.038	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-69.9	122.2	177.5	-67.8	-179.4	167.6	-149.8	-12.2	110.4	Q810 Y812 S850 F851 D853 P854 I887 I888	Q810-R856 PolarHBondContact NE2-O 3.41Å; Q810-R856 VanDerWaalsContact NE2-O 3.08Å; Y812-R856 WeakPolarHBondContact OH-CD 3.03Å; S850-R856 VanDerWaalsContact C-NH2 3.26Å; S850-R856 PolarHBondContact O-NE 3.42Å; S850-R856 PolarHBondContact O-NH2 3.01Å; F851-R856 VanDerWaalsContact CA-CZ 3.43Å; F851-R856 PolarHBondContact O-NH1 2.81Å; F851-R856 VanDerWaalsContact O-NH1 3.14Å; D853-R856 HydrophobicContact CB-CG 4.06Å; D853-R856 WeakPolarHBondContact O-CG 3.26Å; D853-R856 PolarHBondContact O-N 3.09Å; P854-R856 VanDerWaalsContact C-N 3.27Å; R856-I887 HydrophobicContact CB-CG2 4.41Å; R856-I887 HydrophobicContact CG-CG2 3.78Å; R856-I888 WeakPolarHBondContact CD-O 3.08Å; R856-I888 WeakPolarHBondContact CG-O 3.31Å; R856-I888 VanDerWaalsContact NH2-CB 3.3Å
857	T	78.4	Confident	73	Confident	49 Å²	49	58.2 Å²	58.2	30%	0.301	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-92.3	145.9	179.8	54	0	0	0	0	111.8	R855 Y890	R855-T857 PolarHBondContact O-N 2.83Å; T857-Y890 WeakPolarHBondContact O-CB 3.49Å; T857-Y890 PolarHBondContact O-N 3.48Å
858	V	71.2	Confident	71.2	Confident	68 Å²	68	65.3 Å²	65.3	41%	0.412	33%	0.334	S	S	.	.	S	Bend	trans	-71.7	134.6	174.3	-170.9	0	0	0	0	108.9	L860 E863 Y890	V858-L860 PolarHBondContact O-N 3.37Å; V858-E863 HydrophobicContact CB-CG 4.25Å; V858-E863 HydrophobicContact CG1-CG 4.37Å; V858-Y890 HydrophobicContact CG2-CD1 3.73Å; V858-Y890 HydrophobicContact CG2-CE1 4.42Å; V858-Y890 HydrophobicContact CG2-CG 4.35Å
859	N	59.1	Low	69.6	Low	97 Å²	97	68 Å²	68	52%	0.519	35%	0.347	S	S	.	.			trans	3.4	101.9	176.2	-85.8	-22.8	0	0	0	115.9	T861 Q862	N859-T861 PolarHBondContact O-N 2.89Å; N859-Q862 PolarHBondContact O-N 2.89Å
860	L	52.7	Low	68.4	Low	33 Å²	33	70.3 Å²	70.3	17%	0.173	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	0.4	-171.8	-67.7	150.8	0	0	0	117.4	V858 L864 V879	V858-L860 PolarHBondContact O-N 3.37Å; L860-L864 WeakPolarHBondContact O-CD1 3.46Å; L860-V879 HydrophobicContact CB-CG1 4.31Å; L860-V879 HydrophobicContact CB-CG2 4Å; L860-V879 HydrophobicContact CD1-CG1 4.24Å; L860-V879 HydrophobicContact CD2-CB 3.98Å; L860-V879 HydrophobicContact CD2-CG1 4.01Å; L860-V879 HydrophobicContact CD2-CG2 3.66Å; L860-V879 HydrophobicContact CG-CG1 4.41Å; L860-V879 HydrophobicContact CG-CG2 4.4Å
861	T	51.1	Low	67.1	Low	112 Å²	112	72.5 Å²	72.5	69%	0.687	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.1	-18.3	-172.3	49.5	0	0	0	0	115.5	N859	N859-T861 PolarHBondContact O-N 2.89Å
862	Q	52.3	Low	65.9	Low	145 Å²	145	75.7 Å²	75.7	68%	0.678	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-39.6	-175.5	-76.1	-179.3	-25.3	0	0	113.2	N859 K865	N859-Q862 PolarHBondContact O-N 2.89Å; Q862-K865 WeakPolarHBondContact O-CB 3.41Å
863	E	49.1	Very low	64.7	Low	93 Å²	93	78.4 Å²	78.4	44%	0.435	41%	0.409	S	S	.	.	S	Bend	trans	-74.4	-41	177.8	-75	-96.7	138.9	0	0	111.3	V858 K865 W866	V858-E863 HydrophobicContact CB-CG 4.25Å; V858-E863 HydrophobicContact CG1-CG 4.37Å; E863-K865 PolarHBondContact O-N 2.97Å; E863-W866 VanDerWaalsContact C-CD1 3.41Å; E863-W866 VanDerWaalsContact C-NE1 3.31Å; E863-W866 HydrophobicContact CB-CZ2 4.43Å; E863-W866 VanDerWaalsContact CB-NE1 3.27Å; E863-W866 PolarHBondContact O-N 3.46Å; E863-W866 PolarHBondContact O-NE1 2.81Å; E863-W866 WeakPolarHBondContact OE2-CZ2 3.1Å; E863-W866 PolarHBondContact OE2-NE1 3.13Å
864	L	51.1	Low	63.4	Low	28 Å²	28	79 Å²	79	15%	0.147	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-14.2	179.7	-67.1	155.5	0	0	0	112.9	L860 W866 I874 I878 V879	L860-L864 WeakPolarHBondContact O-CD1 3.46Å; L864-W866 VanDerWaalsContact C-N 3.34Å; L864-I874 HydrophobicContact CB-CB 4.28Å; L864-I874 HydrophobicContact CB-CD1 3.7Å; L864-I874 HydrophobicContact CB-CG1 3.87Å; L864-I874 HydrophobicContact CB-CG2 3.44Å; L864-I874 VanDerWaalsContact CB-CG2 3.44Å; L864-I874 HydrophobicContact CD1-CG2 3.28Å; L864-I874 HydrophobicContact CD2-CG1 4.21Å; L864-I874 HydrophobicContact CD2-CG2 4.07Å; L864-I874 HydrophobicContact CG-CG2 3.72Å; L864-I874 WeakPolarHBondContact O-CD1 3.15Å; L864-I878 HydrophobicContact CD1-CG2 4.31Å; L864-I878 HydrophobicContact CD2-CD1 3.52Å; L864-V879 HydrophobicContact CD1-CG2 4.26Å
865	K	45.3	Very low	62.1	Low	177 Å²	177	82 Å²	82	77%	0.77	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-24.6	171.9	-138.2	178.9	-174.6	-177	0	113.2	Q862 E863	Q862-K865 WeakPolarHBondContact O-CB 3.41Å; E863-K865 PolarHBondContact O-N 2.97Å
866	W	43.8	Very low	61	Low	170 Å²	170	84.9 Å²	84.9	64%	0.644	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-15.5	177.3	61	-118.5	0	0	0	113.5	E863 L864 N868	E863-W866 VanDerWaalsContact C-CD1 3.41Å; E863-W866 VanDerWaalsContact C-NE1 3.31Å; E863-W866 HydrophobicContact CB-CZ2 4.43Å; E863-W866 VanDerWaalsContact CB-NE1 3.27Å; E863-W866 PolarHBondContact O-N 3.46Å; E863-W866 PolarHBondContact O-NE1 2.81Å; E863-W866 WeakPolarHBondContact OE2-CZ2 3.1Å; E863-W866 PolarHBondContact OE2-NE1 3.13Å; L864-W866 VanDerWaalsContact C-N 3.34Å; W866-N868 VanDerWaalsContact C-N 3.3Å; W866-N868 PolarHBondContact O-N 3.3Å
867	A	56.4	Low	59.9	Low	33 Å²	33	90.7 Å²	90.7	27%	0.273	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	1.5	-177.3	0	0	0	0	0	114.4	L869	A867-L869 HydrophobicContact CB-CD1 3.74Å; A867-L869 PolarHBondContact O-N 3.09Å
868	N	56.4	Low	59.3	Low	154 Å²	154	91.1 Å²	91.1	82%	0.824	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	19.6	-175.3	-75.8	-26.5	0	0	0	115	W866	W866-N868 VanDerWaalsContact C-N 3.3Å; W866-N868 PolarHBondContact O-N 3.3Å
869	L	61.3	Low	59.1	Low	73 Å²	73	88.3 Å²	88.3	38%	0.382	45%	0.454	S	S	.	.			trans	-80	141.7	171.7	-83.1	111.2	0	0	0	110.4	A867 I873 I874	A867-L869 HydrophobicContact CB-CD1 3.74Å; A867-L869 PolarHBondContact O-N 3.09Å; L869-I873 HydrophobicContact CD2-CB 4.19Å; L869-I873 HydrophobicContact CD2-CG2 3.59Å; L869-I874 HydrophobicContact CB-CD1 3.9Å; L869-I874 HydrophobicContact CB-CG1 3.77Å; L869-I874 VanDerWaalsContact O-CD1 3.29Å; L869-I874 WeakPolarHBondContact O-CD1 3.39Å
870	P	67.6	Low	59.6	Low	69 Å²	69	87.1 Å²	87.1	45%	0.448	45%	0.447	S	S	.	.			trans	-52.9	138.1	171.3	-21.7	29.2	0	0	0	110.8	L872 I873 I874	P870-L872 PolarHBondContact O-N 2.67Å; P870-I873 HydrophobicContact CB-CD1 4.38Å; P870-I873 HydrophobicContact CB-CG1 4.2Å; P870-I873 HydrophobicContact CG-CD1 3.81Å; P870-I873 HydrophobicContact CG-CG1 4.18Å; P870-I873 PolarHBondContact O-N 2.91Å; P870-I874 PolarHBondContact O-N 3.19Å
871	P	63	Low	60.5	Low	111 Å²	111	86.8 Å²	86.8	72%	0.721	45%	0.447	S	S	*	.	H	α-helix	trans	-56.9	-26.5	-177.2	20.3	-31.6	0	0	0	113.2	L875	P871-L875 WeakPolarHBondContact O-CB 3.26Å; P871-L875 PolarHBondContact O-N 2.97Å; P871-L875 VanDerWaalsContact O-N 3.16Å
872	L	66.6	Low	61.5	Low	117 Å²	117	82.3 Å²	82.3	61%	0.613	42%	0.421	S	S	*	.	H	α-helix	trans	-71	-37.3	176.7	-164.4	129.4	0	0	0	112.7	P870 L875 I876	P870-L872 PolarHBondContact O-N 2.67Å; L872-L875 PolarHBondContact O-N 2.7Å; L872-I876 HydrophobicContact CD2-CD1 3.44Å; L872-I876 VanDerWaalsContact CD2-CD1 3.44Å; L872-I876 HydrophobicContact CG-CD1 3.95Å; L872-I876 WeakPolarHBondContact O-CB 3.36Å; L872-I876 WeakPolarHBondContact O-CD1 3.28Å; L872-I876 WeakPolarHBondContact O-CG1 3.29Å; L872-I876 PolarHBondContact O-N 3.44Å
873	I	69.5	Low	62.6	Low	57 Å²	57	83.4 Å²	83.4	29%	0.292	42%	0.419	S	S	.	.	H	α-helix	trans	-70.7	-45.1	178.6	-61.1	-175	0	0	0	110.2	L869 P870 L875 I876 E877	L869-I873 HydrophobicContact CD2-CB 4.19Å; L869-I873 HydrophobicContact CD2-CG2 3.59Å; P870-I873 HydrophobicContact CB-CD1 4.38Å; P870-I873 HydrophobicContact CB-CG1 4.2Å; P870-I873 HydrophobicContact CG-CD1 3.81Å; P870-I873 HydrophobicContact CG-CG1 4.18Å; P870-I873 PolarHBondContact O-N 2.91Å; I873-L875 VanDerWaalsContact C-N 3.26Å; I873-L875 PolarHBondContact O-N 3.01Å; I873-I876 PolarHBondContact O-N 3.48Å; I873-I876 VanDerWaalsContact O-N 3.13Å; I873-E877 HydrophobicContact CG2-CG 4.07Å; I873-E877 WeakPolarHBondContact CG2-OE2 3.18Å; I873-E877 WeakPolarHBondContact O-CB 3.39Å; I873-E877 PolarHBondContact O-N 3.29Å
874	I	65.3	Low	64.1	Low	17 Å²	17	85.3 Å²	85.3	9%	0.087	43%	0.427	C	S	.	.	H	α-helix	trans	-54	-46.8	174.5	-70	159.4	0	0	0	110.9	L864 L869 P870 I878 V879	L864-I874 HydrophobicContact CB-CB 4.28Å; L864-I874 HydrophobicContact CB-CD1 3.7Å; L864-I874 HydrophobicContact CB-CG1 3.87Å; L864-I874 HydrophobicContact CB-CG2 3.44Å; L864-I874 VanDerWaalsContact CB-CG2 3.44Å; L864-I874 HydrophobicContact CD1-CG2 3.28Å; L864-I874 HydrophobicContact CD2-CG1 4.21Å; L864-I874 HydrophobicContact CD2-CG2 4.07Å; L864-I874 HydrophobicContact CG-CG2 3.72Å; L864-I874 WeakPolarHBondContact O-CD1 3.15Å; L869-I874 HydrophobicContact CB-CD1 3.9Å; L869-I874 HydrophobicContact CB-CG1 3.77Å; L869-I874 VanDerWaalsContact O-CD1 3.29Å; L869-I874 WeakPolarHBondContact O-CD1 3.39Å; P870-I874 PolarHBondContact O-N 3.19Å; I874-I878 PolarHBondContact O-N 3.46Å; I874-V879 HydrophobicContact CG2-CG2 4Å; I874-V879 WeakPolarHBondContact O-CG2 3.48Å; I874-V879 PolarHBondContact O-N 3.39Å; I874-V879 VanDerWaalsContact O-N 3.1Å
875	L	65.1	Low	65.6	Low	77 Å²	77	86.4 Å²	86.4	40%	0.403	43%	0.432	S	S	.	.	I	π-helix	trans	-61.2	-46.3	178.7	-176	66.6	0	0	0	111.2	P871 L872 I873 V879 L880	P871-L875 WeakPolarHBondContact O-CB 3.26Å; P871-L875 PolarHBondContact O-N 2.97Å; P871-L875 VanDerWaalsContact O-N 3.16Å; L872-L875 PolarHBondContact O-N 2.7Å; I873-L875 VanDerWaalsContact C-N 3.26Å; I873-L875 PolarHBondContact O-N 3.01Å; L875-V879 HydrophobicContact CD1-CB 4.14Å; L875-V879 HydrophobicContact CD1-CG1 4.04Å; L875-L880 HydrophobicContact CD1-CG 4.24Å; L875-L880 HydrophobicContact CG-CD1 4.13Å; L875-L880 HydrophobicContact CG-CG 4.14Å; L875-L880 VanDerWaalsContact O-CB 3.3Å; L875-L880 WeakPolarHBondContact O-CB 3.27Å; L875-L880 WeakPolarHBondContact O-CG 3.44Å; L875-L880 PolarHBondContact O-N 2.79Å
876	I	66.7	Low	67.5	Low	92 Å²	92	80.7 Å²	80.7	47%	0.472	42%	0.423	S	S	.	.	I	π-helix	trans	-75.8	-42.1	-173.6	-67.3	168.8	0	0	0	113.2	L872 I873 L880 P881	L872-I876 HydrophobicContact CD2-CD1 3.44Å; L872-I876 VanDerWaalsContact CD2-CD1 3.44Å; L872-I876 HydrophobicContact CG-CD1 3.95Å; L872-I876 WeakPolarHBondContact O-CB 3.36Å; L872-I876 WeakPolarHBondContact O-CD1 3.28Å; L872-I876 WeakPolarHBondContact O-CG1 3.29Å; L872-I876 PolarHBondContact O-N 3.44Å; I873-I876 PolarHBondContact O-N 3.48Å; I873-I876 VanDerWaalsContact O-N 3.13Å; I876-L880 HydrophobicContact CG1-CD1 4.44Å; I876-P881 WeakPolarHBondContact O-CD 3.48Å; I876-P881 WeakPolarHBondContact O-CG 3.35Å
877	E	65.9	Low	69.4	Low	132 Å²	132	73.9 Å²	73.9	62%	0.617	40%	0.399	S	S	*	.	I	π-helix	trans	-92.1	-25.2	-170.5	-66.9	-174.1	172.2	0	0	113.6	I873	I873-E877 HydrophobicContact CG2-CG 4.07Å; I873-E877 WeakPolarHBondContact CG2-OE2 3.18Å; I873-E877 WeakPolarHBondContact O-CB 3.39Å; I873-E877 PolarHBondContact O-N 3.29Å
878	I	65.5	Low	70.9	Confident	59 Å²	59	75.8 Å²	75.8	30%	0.303	40%	0.404	S	S	.	.	I	π-helix	trans	-121.1	-52.8	-172.7	-58.5	171.2	0	0	0	110.8	L864 I874 S882	L864-I878 HydrophobicContact CD1-CG2 4.31Å; L864-I878 HydrophobicContact CD2-CD1 3.52Å; I874-I878 PolarHBondContact O-N 3.46Å; I878-S882 VanDerWaalsContact O-CB 3.23Å; I878-S882 WeakPolarHBondContact O-CB 3.47Å; I878-S882 PolarHBondContact O-N 2.94Å; I878-S882 VanDerWaalsContact O-N 3.16Å; I878-S882 PolarHBondContact O-OG 2.86Å
879	V	67.9	Low	72.4	Confident	8 Å²	8	71.5 Å²	71.5	5%	0.048	39%	0.385	C	S	.	.	I	π-helix	trans	-73.3	-48.5	-170.7	-179.8	0	0	0	0	112.6	L860 L864 I874 L875 R883	L860-V879 HydrophobicContact CB-CG1 4.31Å; L860-V879 HydrophobicContact CB-CG2 4Å; L860-V879 HydrophobicContact CD1-CG1 4.24Å; L860-V879 HydrophobicContact CD2-CB 3.98Å; L860-V879 HydrophobicContact CD2-CG1 4.01Å; L860-V879 HydrophobicContact CD2-CG2 3.66Å; L860-V879 HydrophobicContact CG-CG1 4.41Å; L860-V879 HydrophobicContact CG-CG2 4.4Å; L864-V879 HydrophobicContact CD1-CG2 4.26Å; I874-V879 HydrophobicContact CG2-CG2 4Å; I874-V879 WeakPolarHBondContact O-CG2 3.48Å; I874-V879 PolarHBondContact O-N 3.39Å; I874-V879 VanDerWaalsContact O-N 3.1Å; L875-V879 HydrophobicContact CD1-CB 4.14Å; L875-V879 HydrophobicContact CD1-CG1 4.04Å; V879-R883 WeakPolarHBondContact O-CB 3.09Å; V879-R883 WeakPolarHBondContact O-CG 3.4Å; V879-R883 PolarHBondContact O-N 3.16Å; V879-R883 VanDerWaalsContact O-N 3.07Å
880	L	69.6	Low	73.8	Confident	72 Å²	72	70.8 Å²	70.8	38%	0.377	38%	0.377	S	S	.	.	H	α-helix	trans	-64.4	-48.9	-180	-73	172.4	0	0	0	111.4	L875 I876 S882 R883 E884	L875-L880 HydrophobicContact CD1-CG 4.24Å; L875-L880 HydrophobicContact CG-CD1 4.13Å; L875-L880 HydrophobicContact CG-CG 4.14Å; L875-L880 VanDerWaalsContact O-CB 3.3Å; L875-L880 WeakPolarHBondContact O-CB 3.27Å; L875-L880 WeakPolarHBondContact O-CG 3.44Å; L875-L880 PolarHBondContact O-N 2.79Å; I876-L880 HydrophobicContact CG1-CD1 4.44Å; L880-S882 VanDerWaalsContact C-N 3.35Å; L880-S882 PolarHBondContact O-N 2.77Å; L880-R883 PolarHBondContact O-N 3.3Å; L880-R883 VanDerWaalsContact O-N 3.13Å; L880-E884 WeakPolarHBondContact O-CG 3.29Å; L880-E884 PolarHBondContact O-N 2.91Å
881	P	70.4	Confident	74.9	Confident	27 Å²	27	69.9 Å²	69.9	18%	0.175	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-40	178.4	-25.5	37.2	0	0	0	112.7	I876 R883 E884 E885	I876-P881 WeakPolarHBondContact O-CD 3.48Å; I876-P881 WeakPolarHBondContact O-CG 3.35Å; P881-R883 VanDerWaalsContact C-N 3.3Å; P881-R883 PolarHBondContact O-N 3.49Å; P881-E884 PolarHBondContact O-N 3.23Å; P881-E885 WeakPolarHBondContact O-CG 3.01Å; P881-E885 PolarHBondContact O-N 3.46Å
882	S	72.4	Confident	76.3	Confident	18 Å²	18	66.9 Å²	66.9	13%	0.126	36%	0.356	C	S	.	.	H	α-helix	trans	-63.8	-35.5	176.8	-60.2	0	0	0	0	112.6	I878 L880 G886 I887	I878-S882 VanDerWaalsContact O-CB 3.23Å; I878-S882 WeakPolarHBondContact O-CB 3.47Å; I878-S882 PolarHBondContact O-N 2.94Å; I878-S882 VanDerWaalsContact O-N 3.16Å; I878-S882 PolarHBondContact O-OG 2.86Å; L880-S882 VanDerWaalsContact C-N 3.35Å; L880-S882 PolarHBondContact O-N 2.77Å; S882-G886 PolarHBondContact O-N 2.83Å; S882-I887 PolarHBondContact O-N 3.46Å
883	R	76	Confident	77.6	Confident	168 Å²	168	66.3 Å²	66.3	63%	0.634	35%	0.354	S	S	*	.	H	α-helix	trans	-73.6	-36.2	175.9	-77.4	-179.6	172.7	179.3	-1.3	112.3	V879 L880 P881 E885 G886	V879-R883 WeakPolarHBondContact O-CB 3.09Å; V879-R883 WeakPolarHBondContact O-CG 3.4Å; V879-R883 PolarHBondContact O-N 3.16Å; V879-R883 VanDerWaalsContact O-N 3.07Å; L880-R883 PolarHBondContact O-N 3.3Å; L880-R883 VanDerWaalsContact O-N 3.13Å; P881-R883 VanDerWaalsContact C-N 3.3Å; P881-R883 PolarHBondContact O-N 3.49Å; R883-E885 VanDerWaalsContact C-N 3.35Å; R883-G886 PolarHBondContact O-N 3.49Å
884	E	80.2	Confident	78.7	Confident	133 Å²	133	63.9 Å²	63.9	62%	0.621	34%	0.341	S	S	*	.	H	α-helix	trans	-66.1	-36.7	174.1	-72.9	174.7	174.2	0	0	111.9	L880 P881 G886	L880-E884 WeakPolarHBondContact O-CG 3.29Å; L880-E884 PolarHBondContact O-N 2.91Å; P881-E884 PolarHBondContact O-N 3.23Å; E884-G886 PolarHBondContact O-N 3.17Å
885	E	82.4	Confident	79.9	Confident	50 Å²	50	66.2 Å²	66.2	23%	0.234	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-12.7	173.7	-73.7	-177.5	-140.2	0	0	114	L684 G685 R855 P881 R883 I887	L684-E885 WeakPolarHBondContact CA-OE1 3.24Å; L684-E885 WeakPolarHBondContact CB-OE1 3.46Å; L684-E885 WeakPolarHBondContact CD2-OE1 3.2Å; G685-E885 PolarHBondContact N-OE1 2.8Å; R855-E885 IonicContact CZ-OE2 2.81Å; R855-E885 IonicContact NH1-OE2 3.7Å; R855-E885 PolarHBondContact NH1-OE2 2.99Å; R855-E885 IonicContact NH2-OE2 2.77Å; R855-E885 PolarHBondContact NH2-OE2 3.33Å; P881-E885 WeakPolarHBondContact O-CG 3.01Å; P881-E885 PolarHBondContact O-N 3.46Å; R883-E885 VanDerWaalsContact C-N 3.35Å; E885-I887 VanDerWaalsContact C-N 3.33Å; E885-I887 HydrophobicContact CB-CD1 4.11Å; E885-I887 HydrophobicContact CB-CG1 3.82Å; E885-I887 WeakPolarHBondContact OE2-CD1 3.39Å
886	G	84.6	Confident	81	Confident	57 Å²	57	65.1 Å²	65.1	59%	0.588	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	28.3	-174.6	0	0	0	0	0	113.7	S882 R883 E884 I888	S882-G886 PolarHBondContact O-N 2.83Å; R883-G886 PolarHBondContact O-N 3.49Å; E884-G886 PolarHBondContact O-N 3.17Å; G886-I888 PolarHBondContact O-N 2.81Å
887	I	85.4	Confident	82.1	Confident	28 Å²	28	62.3 Å²	62.3	14%	0.144	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-71	120.8	177.5	-60.5	174.9	0	0	0	109.2	R856 S882 E885	R856-I887 HydrophobicContact CB-CG2 4.41Å; R856-I887 HydrophobicContact CG-CG2 3.78Å; S882-I887 PolarHBondContact O-N 3.46Å; E885-I887 VanDerWaalsContact C-N 3.33Å; E885-I887 HydrophobicContact CB-CD1 4.11Å; E885-I887 HydrophobicContact CB-CG1 3.82Å; E885-I887 WeakPolarHBondContact OE2-CD1 3.39Å
888	I	87.4	Confident	83.4	Confident	72 Å²	72	61.9 Å²	61.9	37%	0.369	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-68.4	134	173.6	-60.2	159.6	0	0	0	108.1	R856 G886	R856-I888 WeakPolarHBondContact CD-O 3.08Å; R856-I888 WeakPolarHBondContact CG-O 3.31Å; R856-I888 VanDerWaalsContact NH2-CB 3.3Å; G886-I888 PolarHBondContact O-N 2.81Å
889	P	87.2	Confident	84.6	Confident	65 Å²	65	64.9 Å²	64.9	42%	0.422	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-59.2	153.8	179.5	25.8	-35.5	0	0	0	111.7	A891	P889-A891 PolarHBondContact O-N 2.92Å
890	Y	90.1	Very high	85.8	Confident	57 Å²	57	67.5 Å²	67.5	22%	0.224	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-63.8	120.6	179.9	177.5	-105.9	0	0	0	111.2	Q810 S811 Y812 T857 V858 P892	Q810-Y890 VanDerWaalsContact CD-CD2 3.44Å; Q810-Y890 HydrophobicContact CG-CD2 4.19Å; Q810-Y890 HydrophobicContact CG-CE2 3.71Å; S811-Y890 PolarHBondContact O-OH 2.94Å; Y812-Y890 HydrophobicContact CD1-CE2 4.04Å; Y812-Y890 AromaticContact CE1-CD2 3.8Å; Y812-Y890 HydrophobicContact CE1-CD2 3.8Å; Y812-Y890 AromaticContact CE1-CE2 3.66Å; Y812-Y890 HydrophobicContact CE1-CE2 3.66Å; T857-Y890 WeakPolarHBondContact O-CB 3.49Å; T857-Y890 PolarHBondContact O-N 3.48Å; V858-Y890 HydrophobicContact CG2-CD1 3.73Å; V858-Y890 HydrophobicContact CG2-CE1 4.42Å; V858-Y890 HydrophobicContact CG2-CG 4.35Å; Y890-P892 HydrophobicContact CE1-CB 3.96Å; Y890-P892 HydrophobicContact CE1-CG 4.34Å
891	A	91.1	Very high	86.9	Confident	50 Å²	50	65.5 Å²	65.5	41%	0.413	37%	0.366	S	S	.	.			trans	-123.6	117.7	167.5	0	0	0	0	0	106.8	P889 D893	P889-A891 PolarHBondContact O-N 2.92Å; A891-D893 VanDerWaalsContact C-N 3.31Å; A891-D893 PolarHBondContact O-N 3.21Å
892	P	92.1	Very high	88.1	Confident	49 Å²	49	65.4 Å²	65.4	32%	0.318	36%	0.364	S	S	.	.	S	Bend	trans	-67.4	-33.4	-174.7	26.4	-34.5	0	0	0	112	I813 Y890	I813-P892 HydrophobicContact CD1-CB 3.98Å; I813-P892 HydrophobicContact CG1-CB 4.48Å; I813-P892 PolarHBondContact N-O 3.15Å; Y890-P892 HydrophobicContact CE1-CB 3.96Å; Y890-P892 HydrophobicContact CE1-CG 4.34Å
893	D	94	Very high	89.1	Confident	105 Å²	105	64.6 Å²	64.6	56%	0.561	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-83.7	120.4	179.8	-62.1	-45.8	0	0	0	111.2	I813 A891	I813-D893 WeakPolarHBondContact CD1-OD1 3.49Å; A891-D893 VanDerWaalsContact C-N 3.31Å; A891-D893 PolarHBondContact O-N 3.21Å
894	L	93.6	Very high	89.8	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.031	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-78.8	129.6	176.1	-65.4	170.5	0	0	0	110.7	Y812 I813 F814 L847 F851 L852	Y812-L894 HydrophobicContact CD1-CD2 4.02Å; Y812-L894 HydrophobicContact CG-CD2 4.32Å; I813-L894 PolarHBondContact O-N 3.41Å; F814-L894 HydrophobicContact CD2-CB 4.27Å; F814-L894 HydrophobicContact CD2-CD1 4.23Å; L847-L894 HydrophobicContact CD2-CD1 4.07Å; L847-L894 HydrophobicContact CD2-CD2 4.34Å; F851-L894 HydrophobicContact CB-CD2 4.25Å; L852-L894 HydrophobicContact CD2-CD1 4Å; L852-L894 HydrophobicContact CD2-CD2 4.12Å
895	P	89.5	Confident	90.3	Very high	65 Å²	65	63.8 Å²	63.8	42%	0.422	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-71.9	136.4	179.4	29.4	-33.7	0	0	0	111.1	F851	F851-P895 HydrophobicContact CD1-CG 4.44Å; F851-P895 HydrophobicContact CE1-CG 3.98Å; F851-P895 HydrophobicContact CZ-CG 4.42Å
896	I	88.6	Confident	90.7	Very high	55 Å²	55	65.3 Å²	65.3	28%	0.282	37%	0.37	S	S	.	.			trans	-106.3	98.4	164.3	-59.3	-178.5	0	0	0	107	F814 P815 Q816 M839 V845	F814-I896 HydrophobicContact CE1-CD1 4.32Å; F814-I896 HydrophobicContact CE2-CD1 3.91Å; F814-I896 HydrophobicContact CE2-CG1 3.9Å; F814-I896 HydrophobicContact CZ-CD1 3.68Å; F814-I896 HydrophobicContact CZ-CG1 4.12Å; P815-I896 HydrophobicContact CG-CD1 3.52Å; P815-I896 HydrophobicContact CG-CG1 3.86Å; Q816-I896 HydrophobicContact CB-CD1 4.24Å; Q816-I896 HydrophobicContact CG-CD1 3.76Å; M839-I896 HydrophobicContact SD-CD1 3.93Å; V845-I896 HydrophobicContact CG2-CG2 4.02Å
897	A	91	Very high	91	Very high	33 Å²	33	65.2 Å²	65.2	27%	0.273	36%	0.36	S	S	.	.			trans	-94.8	140.2	172.9	0	0	0	0	0	109.7	D899 H900	A897-D899 VanDerWaalsContact C-N 3.27Å; A897-D899 WeakPolarHBondContact CB-OD1 3.2Å; A897-D899 PolarHBondContact O-N 3.46Å; A897-H900 PolarHBondContact O-N 3.01Å
898	T	91.6	Very high	91.1	Very high	123 Å²	123	64 Å²	64	76%	0.755	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-71.3	-23.6	-172	48.6	0	0	0	0	113.2	H900 I901	T898-H900 VanDerWaalsContact C-N 3.29Å; T898-I901 HydrophobicContact CG2-CD1 4.49Å; T898-I901 WeakPolarHBondContact O-CB 3.48Å; T898-I901 PolarHBondContact O-N 3.22Å
899	D	91.7	Very high	91.1	Very high	122 Å²	122	63.9 Å²	63.9	65%	0.652	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-67.9	-26.2	172	58.6	-31.1	0	0	0	112.9	A897 I901	A897-D899 VanDerWaalsContact C-N 3.27Å; A897-D899 WeakPolarHBondContact CB-OD1 3.2Å; A897-D899 PolarHBondContact O-N 3.46Å; D899-I901 VanDerWaalsContact C-N 3.26Å; D899-I901 PolarHBondContact O-N 3.28Å
900	H	92	Very high	90.8	Very high	63 Å²	63	61.8 Å²	61.8	29%	0.292	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-81.1	-0.2	174	-64.1	-45.1	0	0	0	113.9	V845 E846 A897 T898 I902	V845-H900 WeakPolarHBondContact CA-O 3.43Å; V845-H900 HydrophobicContact CG1-CB 4.42Å; E846-H900 PolarHBondContact N-O 2.86Å; E846-H900 WeakPolarHBondContact O-CB 3.42Å; A897-H900 PolarHBondContact O-N 3.01Å; T898-H900 VanDerWaalsContact C-N 3.29Å; H900-I902 PolarHBondContact O-N 3.02Å
901	I	94.7	Very high	90.7	Very high	30 Å²	30	59.2 Å²	59.2	15%	0.154	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-83.8	103.7	177.6	-59.4	176.7	0	0	0	109.5	I844 V845 T898 D899 N903 Y904	I844-I901 CarbonylContact O-C 3.46Å; I844-I901 VanDerWaalsContact O-CA 3.31Å; I844-I901 WeakPolarHBondContact O-CA 3.34Å; V845-I901 HydrophobicContact CG2-CG1 3.74Å; T898-I901 HydrophobicContact CG2-CD1 4.49Å; T898-I901 WeakPolarHBondContact O-CB 3.48Å; T898-I901 PolarHBondContact O-N 3.22Å; D899-I901 VanDerWaalsContact C-N 3.26Å; D899-I901 PolarHBondContact O-N 3.28Å; I901-N903 WeakPolarHBondContact CG2-OD1 3.33Å; I901-N903 PolarHBondContact O-N 3.46Å; I901-Y904 PolarHBondContact O-N 3.44Å
902	I	95	Very high	90.4	Very high	24 Å²	24	59.9 Å²	59.9	12%	0.123	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-23.1	-171.5	67.1	171.8	0	0	0	113.8	L836 I844 E846 H900 V927 F943 T945 V947	L836-I902 HydrophobicContact CD2-CD1 4.5Å; I844-I902 HydrophobicContact CB-CD1 3.99Å; I844-I902 HydrophobicContact CB-CG1 3.73Å; I844-I902 HydrophobicContact CG2-CD1 3.55Å; I844-I902 HydrophobicContact CG2-CG1 3.8Å; I844-I902 PolarHBondContact O-N 3.43Å; E846-I902 HydrophobicContact CB-CG2 3.74Å; H900-I902 PolarHBondContact O-N 3.02Å; I902-V927 HydrophobicContact CD1-CG1 4.11Å; I902-F943 HydrophobicContact CD1-CE1 4.35Å; I902-F943 HydrophobicContact CG1-CE1 4.29Å; I902-T945 HydrophobicContact CB-CG2 4.49Å; I902-T945 HydrophobicContact CD1-CG2 3.97Å; I902-T945 HydrophobicContact CG1-CG2 4.46Å; I902-V947 HydrophobicContact CD1-CG2 4.35Å; I902-V947 HydrophobicContact CG2-CG2 4.15Å
903	N	93.9	Very high	90	Very high	1 Å²	1	59 Å²	59	1%	0.005	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	9.1	-177.9	69.5	-42.9	0	0	0	113.9	G842 G843 I844 I901 N905 L906 F943	G842-N903 PolarHBondContact O-ND2 2.96Å; G843-N903 WeakPolarHBondContact CA-OD1 3.48Å; I844-N903 PolarHBondContact N-OD1 3.2Å; I901-N903 WeakPolarHBondContact CG2-OD1 3.33Å; I901-N903 PolarHBondContact O-N 3.46Å; N903-N905 PolarHBondContact O-N 2.95Å; N903-L906 PolarHBondContact ND2-O 2.93Å; N903-L906 WeakPolarHBondContact O-CA 3.19Å; N903-L906 PolarHBondContact O-N 3.34Å; N903-F943 HydrophobicContact CB-CD1 4.15Å; N903-F943 HydrophobicContact CB-CD2 4.39Å; N903-F943 HydrophobicContact CB-CE1 3.65Å; N903-F943 HydrophobicContact CB-CE2 3.94Å; N903-F943 HydrophobicContact CB-CG 4.5Å; N903-F943 HydrophobicContact CB-CZ 3.54Å
904	Y	90.6	Very high	89.8	Confident	154 Å²	154	55 Å²	55	60%	0.604	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.2	-105.1	171.6	48.8	-84.1	0	0	0	113.4	I901 L906	I901-Y904 PolarHBondContact O-N 3.44Å; Y904-L906 HydrophobicContact CD2-CG 4.28Å; Y904-L906 HydrophobicContact CE2-CB 4.45Å; Y904-L906 HydrophobicContact CE2-CD1 3.66Å; Y904-L906 HydrophobicContact CE2-CG 3.55Å; Y904-L906 WeakPolarHBondContact OH-CD1 3.48Å
905	N	90.8	Very high	89.7	Confident	131 Å²	131	55.9 Å²	55.9	70%	0.701	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	5.7	180	71.7	-2.1	0	0	0	114.5	N903 S907	N903-N905 PolarHBondContact O-N 2.95Å; N905-S907 PolarHBondContact O-N 2.87Å
906	L	91.1	Very high	89.8	Confident	82 Å²	82	53.7 Å²	53.7	43%	0.429	29%	0.292	S	S	.	.			trans	-97.2	71.2	177.6	-60.3	-177.1	0	0	0	110.3	N903 Y904 V908 F943	N903-L906 PolarHBondContact ND2-O 2.93Å; N903-L906 WeakPolarHBondContact O-CA 3.19Å; N903-L906 PolarHBondContact O-N 3.34Å; Y904-L906 HydrophobicContact CD2-CG 4.28Å; Y904-L906 HydrophobicContact CE2-CB 4.45Å; Y904-L906 HydrophobicContact CE2-CD1 3.66Å; Y904-L906 HydrophobicContact CE2-CG 3.55Å; Y904-L906 WeakPolarHBondContact OH-CD1 3.48Å; L906-V908 PolarHBondContact O-N 3.35Å; L906-F943 HydrophobicContact CB-CD2 4.47Å; L906-F943 HydrophobicContact CB-CE2 4.4Å; L906-F943 HydrophobicContact CD1-CD2 4.44Å; L906-F943 HydrophobicContact CD1-CE2 4.13Å
907	S	89.6	Confident	89.9	Confident	54 Å²	54	51.4 Å²	51.4	38%	0.378	28%	0.281	S	S	.	.			trans	-60.7	124.8	-179	57.3	0	0	0	0	111.9	G842 N905	G842-S907 WeakPolarHBondContact O-CA 3.48Å; N905-S907 PolarHBondContact O-N 2.87Å
908	V	88.3	Confident	89.9	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	27%	0.272	C	S	.	.			trans	-104.8	106.7	176.7	-173.4	0	0	0	0	108.7	G842 L906 V911 D941 F943	G842-V908 WeakPolarHBondContact CA-O 3.45Å; G842-V908 PolarHBondContact O-N 2.83Å; L906-V908 PolarHBondContact O-N 3.35Å; V908-V911 HydrophobicContact CB-CG2 3.87Å; V908-V911 HydrophobicContact CG1-CG2 3.59Å; V908-V911 WeakPolarHBondContact O-CG2 3.4Å; V908-D941 HydrophobicContact CG1-CB 4.25Å; V908-D941 WeakPolarHBondContact CG1-O 3.3Å; V908-F943 HydrophobicContact CG2-CB 3.42Å; V908-F943 VanDerWaalsContact CG2-CB 3.42Å; V908-F943 HydrophobicContact CG2-CG 4.01Å
909	H	86	Confident	89.9	Confident	69 Å²	69	44.7 Å²	44.7	32%	0.319	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	144.7	-178.2	-69.1	-69.3	0	0	0	112.4	F841 V911	F841-H909 PolarHBondContact O-CE1 2.88Å; F841-H909 VanDerWaalsContact O-CE1 3.23Å; H909-V911 VanDerWaalsContact C-N 3.33Å; H909-V911 PolarHBondContact O-N 2.7Å
910	G	82.7	Confident	89.7	Confident	22 Å²	22	40.4 Å²	40.4	23%	0.227	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	33.2	171.8	0	0	0	0	0	114.2	H912 G931 L932	G910-H912 PolarHBondContact O-N 3.02Å; G910-H912 VanDerWaalsContact O-N 3.08Å; G910-G931 CarbonylContact O-C 3.39Å; G910-L932 PolarHBondContact O-N 2.9Å
911	V	87.7	Confident	89.6	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.4	116	176	-176.5	0	0	0	0	109.6	A838 V908 H909 I914 A929 A930	A838-V911 HydrophobicContact CB-CB 3.69Å; A838-V911 HydrophobicContact CB-CG1 3.85Å; A838-V911 HydrophobicContact CB-CG2 4.04Å; V908-V911 HydrophobicContact CB-CG2 3.87Å; V908-V911 HydrophobicContact CG1-CG2 3.59Å; V908-V911 WeakPolarHBondContact O-CG2 3.4Å; H909-V911 VanDerWaalsContact C-N 3.33Å; H909-V911 PolarHBondContact O-N 2.7Å; V911-I914 HydrophobicContact CG1-CD1 4.33Å; V911-I914 HydrophobicContact CG1-CG1 3.69Å; V911-A929 HydrophobicContact CG1-CB 4.24Å; V911-A930 WeakPolarHBondContact CA-O 3.46Å
912	H	84.5	Confident	89.4	Confident	64 Å²	64	37.3 Å²	37.3	30%	0.296	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	-25.8	179.8	73.2	81.6	0	0	0	112.3	V358 G910 A930 L932	V358-H912 PolarHBondContact O-CE1 2.99Å; V358-H912 PolarHBondContact O-NE2 3.12Å; G910-H912 PolarHBondContact O-N 3.02Å; G910-H912 VanDerWaalsContact O-N 3.08Å; H912-A930 PolarHBondContact CD2-O 2.83Å; H912-A930 PolarHBondContact N-O 3.46Å; H912-L932 HydrophobicContact CB-CB 3.98Å; H912-L932 HydrophobicContact CB-CD1 4.47Å
913	S	83.4	Confident	89.4	Confident	31 Å²	31	36.1 Å²	36.1	22%	0.217	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	140.1	176.7	62.1	0	0	0	0	110.6	A930	S913-A930 PolarHBondContact O-N 3.47Å
914	I	90.4	Very high	89.4	Confident	19 Å²	19	36.4 Å²	36.4	10%	0.097	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	119.8	168.1	-58.9	168	0	0	0	106.2	A822 L836 A838 I844 V911 T916 V927 F928 A929	A822-I914 HydrophobicContact CB-CB 3.65Å; A822-I914 HydrophobicContact CB-CD1 4.46Å; A822-I914 HydrophobicContact CB-CG2 3.75Å; L836-I914 HydrophobicContact CB-CD1 4.22Å; L836-I914 HydrophobicContact CD1-CG2 3.92Å; A838-I914 HydrophobicContact CB-CD1 4.05Å; I844-I914 HydrophobicContact CG2-CD1 4.41Å; V911-I914 HydrophobicContact CG1-CD1 4.33Å; V911-I914 HydrophobicContact CG1-CG1 3.69Å; I914-T916 HydrophobicContact CG2-CG2 4.39Å; I914-V927 HydrophobicContact CG2-CG1 3.72Å; I914-F928 CarbonylContact C-O 3.5Å; I914-F928 WeakPolarHBondContact CA-O 3.43Å; I914-A929 HydrophobicContact CG1-CB 4.34Å
915	C	90.2	Very high	89.5	Confident	26 Å²	26	29 Å²	29	18%	0.176	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	131.2	172.1	-172.8	0	0	0	0	108.2	T361 F928	T361-C915 VanDerWaalsContact OG1-CB 3.29Å; T361-C915 WeakPolarHBondContact OG1-CB 3.2Å; C915-F928 HydrophobicContact CB-CB 4.37Å; C915-F928 PolarHBondContact N-O 3.24Å; C915-F928 PolarHBondContact O-N 3.12Å
916	T	92	Very high	89.6	Confident	18 Å²	18	22.9 Å²	22.9	11%	0.11	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	149.2	171.4	51.5	0	0	0	0	109	V823 L836 I914 M926 V927	V823-T916 WeakPolarHBondContact O-CB 3.5Å; V823-T916 VanDerWaalsContact O-CG2 3.25Å; V823-T916 WeakPolarHBondContact O-CG2 3.36Å; V823-T916 PolarHBondContact O-OG1 3.35Å; L836-T916 HydrophobicContact CD1-CG2 3.46Å; L836-T916 VanDerWaalsContact CD1-CG2 3.46Å; I914-T916 HydrophobicContact CG2-CG2 4.39Å; T916-M926 CarbonylContact C-O 3.53Å; T916-M926 VanDerWaalsContact CA-O 3.26Å; T916-M926 WeakPolarHBondContact CA-O 3.46Å; T916-V927 HydrophobicContact CG2-CG2 4.2Å
917	A	90.8	Very high	89.8	Confident	8 Å²	8	19 Å²	19	7%	0.066	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	145.6	175.2	0	0	0	0	0	110.3	L363 M926	L363-A917 HydrophobicContact CB-CB 3.77Å; L363-A917 HydrophobicContact CD1-CB 4.08Å; L363-A917 HydrophobicContact CD2-CB 3.98Å; L363-A917 HydrophobicContact CG-CB 4.13Å; A917-M926 HydrophobicContact CB-CE 4.32Å; A917-M926 PolarHBondContact N-O 3.39Å; A917-M926 PolarHBondContact O-N 3.1Å
918	P	91.6	Very high	90	Very high	11 Å²	11	16.6 Å²	16.6	7%	0.071	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	143.1	174.6	28.9	-34.5	0	0	0	110.4	K464 F664 E825 E827 M926	K464-P918 WeakPolarHBondContact CE-O 3.29Å; K464-P918 PolarHBondContact NZ-O 2.83Å; F664-P918 HydrophobicContact CE1-CG 3.82Å; F664-P918 HydrophobicContact CE2-CG 4.4Å; F664-P918 HydrophobicContact CZ-CG 3.46Å; F664-P918 VanDerWaalsContact CZ-CG 3.46Å; E825-P918 WeakPolarHBondContact O-CA 3.16Å; E827-P918 HydrophobicContact CB-CB 4.41Å; P918-M926 WeakPolarHBondContact O-CE 3.33Å
919	S	90.4	Very high	90.2	Very high	4 Å²	4	16.4 Å²	16.4	3%	0.028	10%	0.102	C	C	.	.			trans	-87.8	177.4	163.7	75.5	0	0	0	0	110.6	M921 T924	S919-M921 PolarHBondContact O-N 3Å; S919-M921 PolarHBondContact OG-N 3.01Å; S919-M921 PolarHBondContact OG-O 2.97Å; S919-T924 WeakPolarHBondContact CB-O 3.44Å; S919-T924 WeakPolarHBondContact CB-OG1 3.43Å; S919-T924 PolarHBondContact OG-O 3.49Å; S919-T924 PolarHBondContact OG-OG1 2.87Å
920	G	87.7	Confident	90.3	Very high	31 Å²	31	13.1 Å²	13.1	32%	0.32	9%	0.087	S	C	.	.	S	Bend	trans	-72	-4.1	168.5	0	0	0	0	0	113.5	F460	F460-G920 CarbonylContact O-C 3.58Å; F460-G920 WeakPolarHBondContact O-CA 3.49Å; F460-G920 PolarHBondContact O-N 3.08Å
921	M	91	Very high	89.8	Confident	9 Å²	9	12.1 Å²	12.1	4%	0.044	8%	0.076	C	C	.	.	S	Bend	trans	-106.6	137.2	172.7	-63.3	177.3	58.3	0	0	111.1	F460 L462 S919 S923 T924 D954 M955	F460-M921 HydrophobicContact CB-CG 3.93Å; F460-M921 HydrophobicContact CB-SD 3.9Å; F460-M921 HydrophobicContact CD1-CG 3.97Å; F460-M921 HydrophobicContact CD1-SD 3.92Å; F460-M921 HydrophobicContact CG-CG 4.26Å; F460-M921 HydrophobicContact CG-SD 3.94Å; L462-M921 HydrophobicContact CD2-SD 4.33Å; S919-M921 PolarHBondContact O-N 3Å; S919-M921 PolarHBondContact OG-N 3.01Å; S919-M921 PolarHBondContact OG-O 2.97Å; M921-S923 VanDerWaalsContact C-N 3.33Å; M921-S923 PolarHBondContact O-N 3.12Å; M921-T924 HydrophobicContact CB-CG2 4.32Å; M921-T924 HydrophobicContact CE-CG2 4.03Å; M921-T924 PolarHBondContact O-N 3.02Å; M921-T924 HydrophobicContact SD-CG2 4.27Å; M921-D954 HydrophobicContact CE-CB 3.82Å; M921-M955 HydrophobicContact CE-CB 3.87Å; M921-M955 HydrophobicContact CE-CG 3.24Å; M921-M955 HydrophobicContact CE-SD 3.43Å; M921-M955 WeakPolarHBondContact CE-SD 3.48Å; M921-M955 HydrophobicContact SD-CG 3.87Å; M921-M955 HydrophobicContact SD-SD 3.52Å
922	E	90.8	Very high	88.6	Confident	19 Å²	19	15.1 Å²	15.1	9%	0.089	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-32.4	-178.5	-177.5	54	-151.8	0	0	112.4	T826 E827 K828 A829 I830 T831 T924 F953 D954	T826-E922 WeakPolarHBondContact CB-O 3.49Å; T826-E922 WeakPolarHBondContact CB-OE1 3.39Å; T826-E922 WeakPolarHBondContact CG2-O 3.4Å; T826-E922 PolarHBondContact OG1-OE1 2.86Å; E827-E922 PolarHBondContact N-OE2 3.41Å; K828-E922 WeakPolarHBondContact CA-OE2 3.39Å; K828-E922 WeakPolarHBondContact CB-OE2 3.35Å; K828-E922 PolarHBondContact N-OE2 3.29Å; A829-E922 PolarHBondContact N-OE1 3.27Å; A829-E922 VanDerWaalsContact N-OE1 3.1Å; I830-E922 HydrophobicContact CB-CG 3.89Å; I830-E922 HydrophobicContact CD1-CG 4.3Å; I830-E922 HydrophobicContact CG1-CG 4.36Å; I830-E922 PolarHBondContact N-OE1 2.89Å; T831-E922 PolarHBondContact N-OE1 3.1Å; T831-E922 PolarHBondContact OG1-O 3Å; E922-T924 VanDerWaalsContact C-N 3.29Å; E922-T924 PolarHBondContact O-N 3.47Å; E922-F953 HydrophobicContact CB-CZ 4.44Å; E922-F953 HydrophobicContact CG-CZ 4.25Å; E922-D954 PolarHBondContact N-OD2 3.02Å
923	S	93.7	Very high	87	Confident	0 Å²	0	15 Å²	15	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.8	178.3	51.5	0	0	0	0	115.4	M921 S948 G951 F953 D954	M921-S923 VanDerWaalsContact C-N 3.33Å; M921-S923 PolarHBondContact O-N 3.12Å; S923-S948 VanDerWaalsContact O-CA 3.31Å; S923-S948 WeakPolarHBondContact O-CA 3.31Å; S923-G951 WeakPolarHBondContact CB-O 3.41Å; S923-F953 VanDerWaalsContact CB-CE1 3.44Å; S923-D954 WeakPolarHBondContact CB-OD2 3.46Å; S923-D954 PolarHBondContact N-OD2 3.26Å; S923-D954 PolarHBondContact OG-OD2 3.43Å; S923-D954 VanDerWaalsContact OG-OD2 3.1Å
924	T	93.5	Very high	85.2	Confident	6 Å²	6	18.2 Å²	18.2	4%	0.037	11%	0.113	C	C	.	.			trans	-124.6	137.8	-173.2	87.2	0	0	0	0	113.3	L462 S919 M921 E922 V947	L462-T924 WeakPolarHBondContact CD2-OG1 3.47Å; S919-T924 WeakPolarHBondContact CB-O 3.44Å; S919-T924 WeakPolarHBondContact CB-OG1 3.43Å; S919-T924 PolarHBondContact OG-O 3.49Å; S919-T924 PolarHBondContact OG-OG1 2.87Å; M921-T924 HydrophobicContact CB-CG2 4.32Å; M921-T924 HydrophobicContact CE-CG2 4.03Å; M921-T924 PolarHBondContact O-N 3.02Å; M921-T924 HydrophobicContact SD-CG2 4.27Å; E922-T924 VanDerWaalsContact C-N 3.29Å; E922-T924 PolarHBondContact O-N 3.47Å; T924-V947 WeakPolarHBondContact CA-O 3.34Å
925	S	93.3	Very high	82.8	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.2	176.8	-169.2	0	0	0	0	109.6	E825 R946 V947	E825-S925 PolarHBondContact N-OG 3.27Å; E825-S925 VanDerWaalsContact N-OG 3.12Å; E825-S925 VanDerWaalsContact O-CB 3.24Å; E825-S925 WeakPolarHBondContact O-CB 3.3Å; E825-S925 PolarHBondContact O-OG 2.9Å; S925-R946 CarbonylContact O-C 3.34Å; S925-R946 WeakPolarHBondContact O-CA 3.31Å; S925-V947 PolarHBondContact N-O 3.43Å; S925-V947 PolarHBondContact O-N 3.46Å
926	M	93.4	Very high	80.7	Confident	1 Å²	1	30 Å²	30	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	137.6	174.6	-73.3	166.2	-65.6	0	0	110.1	L363 K464 T916 A917 P918 F944 R946	L363-M926 HydrophobicContact CD2-CB 4.1Å; L363-M926 HydrophobicContact CD2-CE 4.45Å; L363-M926 HydrophobicContact CD2-SD 4.24Å; K464-M926 HydrophobicContact CD-CE 3.41Å; K464-M926 VanDerWaalsContact CD-CE 3.41Å; K464-M926 HydrophobicContact CD-SD 3.92Å; K464-M926 HydrophobicContact CG-CE 4.12Å; K464-M926 HydrophobicContact CG-SD 4Å; T916-M926 CarbonylContact C-O 3.53Å; T916-M926 VanDerWaalsContact CA-O 3.26Å; T916-M926 WeakPolarHBondContact CA-O 3.46Å; A917-M926 HydrophobicContact CB-CE 4.32Å; A917-M926 PolarHBondContact N-O 3.39Å; A917-M926 PolarHBondContact O-N 3.1Å; P918-M926 WeakPolarHBondContact O-CE 3.33Å; M926-F944 HydrophobicContact CB-CE2 3.88Å; M926-F944 HydrophobicContact CB-CZ 3.92Å; M926-F944 HydrophobicContact CG-CE2 4.27Å; M926-F944 HydrophobicContact CG-CZ 3.78Å; M926-F944 HydrophobicContact SD-CZ 4.01Å; M926-R946 HydrophobicContact CG-CG 4.19Å
927	V	94.3	Very high	78.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.4	-177.7	-178.3	0	0	0	0	109	L836 I902 I914 T916 F944 T945 V947	L836-V927 HydrophobicContact CD1-CB 4.33Å; L836-V927 HydrophobicContact CD1-CG1 3.69Å; L836-V927 HydrophobicContact CD1-CG2 3.64Å; I902-V927 HydrophobicContact CD1-CG1 4.11Å; I914-V927 HydrophobicContact CG2-CG1 3.72Å; T916-V927 HydrophobicContact CG2-CG2 4.2Å; V927-F944 WeakPolarHBondContact O-CA 3.43Å; V927-F944 WeakPolarHBondContact O-CD2 3.47Å; V927-T945 HydrophobicContact CB-CG2 4.22Å; V927-T945 PolarHBondContact N-O 3.47Å; V927-T945 PolarHBondContact O-N 3.02Å; V927-V947 HydrophobicContact CB-CG2 4.39Å; V927-V947 HydrophobicContact CG2-CB 4.14Å; V927-V947 HydrophobicContact CG2-CG2 3.58Å
928	F	94.2	Very high	75.7	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.018	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	117.7	172.3	-177.6	-100.1	0	0	0	109.6	T361 L466 V468 I914 C915 A930 L942 F943 F944	T361-F928 HydrophobicContact CG2-CD1 3.78Å; T361-F928 HydrophobicContact CG2-CE1 3.46Å; T361-F928 VanDerWaalsContact CG2-CE1 3.46Å; L466-F928 HydrophobicContact CD1-CD2 4.2Å; L466-F928 HydrophobicContact CD1-CE2 4.32Å; L466-F928 HydrophobicContact CD2-CB 4.4Å; L466-F928 HydrophobicContact CD2-CD2 3.99Å; L466-F928 HydrophobicContact CD2-CE2 4.49Å; L466-F928 HydrophobicContact CD2-CG 4.15Å; V468-F928 HydrophobicContact CG2-CZ 4.47Å; I914-F928 CarbonylContact C-O 3.5Å; I914-F928 WeakPolarHBondContact CA-O 3.43Å; C915-F928 HydrophobicContact CB-CB 4.37Å; C915-F928 PolarHBondContact N-O 3.24Å; C915-F928 PolarHBondContact O-N 3.12Å; F928-A930 HydrophobicContact CE1-CB 4.08Å; F928-L942 HydrophobicContact CE2-CB 4.26Å; F928-L942 HydrophobicContact CZ-CB 4.21Å; F928-L942 HydrophobicContact CZ-CD1 4.23Å; F928-L942 HydrophobicContact CZ-CD2 3.93Å; F928-L942 HydrophobicContact CZ-CG 4.34Å; F928-F943 CarbonylContact C-O 3.52Å; F928-F943 WeakPolarHBondContact CA-O 3.42Å; F928-F944 HydrophobicContact CB-CD2 4.12Å; F928-F944 HydrophobicContact CD2-CB 4.19Å; F928-F944 HydrophobicContact CD2-CD2 4.16Å
929	A	92.6	Very high	73.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.4	176.6	0	0	0	0	0	110.4	I844 V911 I914 F943	I844-A929 HydrophobicContact CD1-CB 3.56Å; V911-A929 HydrophobicContact CG1-CB 4.24Å; I914-A929 HydrophobicContact CG1-CB 4.34Å; A929-F943 HydrophobicContact CB-CB 4.45Å; A929-F943 PolarHBondContact N-O 3Å; A929-F943 PolarHBondContact O-N 2.92Å
930	A	87.9	Confident	72.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.1	175.9	0	0	0	0	0	110.7	V358 V911 H912 S913 F928 L942	V358-A930 HydrophobicContact CB-CB 4.03Å; V358-A930 HydrophobicContact CG1-CB 4.13Å; V358-A930 HydrophobicContact CG2-CB 4.4Å; V911-A930 WeakPolarHBondContact CA-O 3.46Å; H912-A930 PolarHBondContact CD2-O 2.83Å; H912-A930 PolarHBondContact N-O 3.46Å; S913-A930 PolarHBondContact O-N 3.47Å; F928-A930 HydrophobicContact CE1-CB 4.08Å; A930-L942 HydrophobicContact CB-CD2 4.13Å
931	G	72.3	Confident	71.9	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	151.5	170.2	0	0	0	0	0	112.5	G910 T940 D941	G910-G931 CarbonylContact O-C 3.39Å; G931-T940 WeakPolarHBondContact O-CG2 3.38Å; G931-D941 PolarHBondContact N-O 2.89Å
932	L	63.3	Low	71.8	Confident	65 Å²	65	52 Å²	52	34%	0.34	27%	0.265	S	S	.	.			trans	-116.2	144.6	170.8	-160.4	119	0	0	0	110.3	G910 H912 V934	G910-L932 PolarHBondContact O-N 2.9Å; H912-L932 HydrophobicContact CB-CB 3.98Å; H912-L932 HydrophobicContact CB-CD1 4.47Å; L932-V934 VanDerWaalsContact C-N 3.3Å; L932-V934 HydrophobicContact CB-CG2 4.25Å; L932-V934 HydrophobicContact CD2-CG2 3.75Å; L932-V934 PolarHBondContact O-N 2.93Å
933	V	49.5	Very low	71.9	Confident	62 Å²	62	51.8 Å²	51.8	38%	0.376	26%	0.264	S	S	.	.			trans	-72.2	84.5	168	-173	0	0	0	0	109.1	A356 N935 T940	A356-V933 HydrophobicContact CB-CG2 4.21Å; V933-N935 WeakPolarHBondContact CG1-O 3.2Å; V933-N935 PolarHBondContact O-N 3.12Å; V933-T940 HydrophobicContact CB-CG2 4.34Å; V933-T940 HydrophobicContact CG2-CG2 3.36Å
934	V	45.3	Very low	71.9	Confident	98 Å²	98	54 Å²	54	59%	0.594	27%	0.274	S	S	*	.	S	Bend	trans	-77.6	-13.1	174.9	-179.4	0	0	0	0	111.6	L932	L932-V934 VanDerWaalsContact C-N 3.3Å; L932-V934 HydrophobicContact CB-CG2 4.25Å; L932-V934 HydrophobicContact CD2-CG2 3.75Å; L932-V934 PolarHBondContact O-N 2.93Å
935	N	41.3	Very low	72	Confident	121 Å²	121	55.3 Å²	55.3	65%	0.647	28%	0.282	S	S	*	.	S	Bend	trans	-150.7	146.8	171.7	-77.9	-54.5	0	0	0	110.1	V933 L937 A938	V933-N935 WeakPolarHBondContact CG1-O 3.2Å; V933-N935 PolarHBondContact O-N 3.12Å; N935-L937 PolarHBondContact O-N 3.34Å; N935-A938 PolarHBondContact O-N 2.89Å
936	K	45	Very low	72	Confident	172 Å²	172	60.7 Å²	60.7	75%	0.748	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-2.9	-178.1	-83.4	-176.4	-179.8	179.9	0	116.4	E20	E20-K936 IonicContact OE2-NZ 3.19Å; E20-K936 PolarHBondContact OE2-NZ 3.42Å
937	L	39.7	Very low	72.1	Confident	169 Å²	169	60.9 Å²	60.9	89%	0.885	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-2.7	178.3	-89.2	127.5	0	0	0	114.5	N935	N935-L937 PolarHBondContact O-N 3.34Å
938	A	38.9	Very low	72.1	Confident	35 Å²	35	63 Å²	63	29%	0.289	32%	0.318	S	S	.	.			trans	-85.1	124.7	179.3	0	0	0	0	0	110.1	N935 T940	N935-A938 PolarHBondContact O-N 2.89Å; A938-T940 PolarHBondContact O-N 2.76Å
939	R	47.9	Very low	71.9	Confident	192 Å²	192	63.5 Å²	63.5	73%	0.725	32%	0.321	S	S	*	.			trans	-66.7	127.5	169.9	-65.4	177.9	-179.3	175.6	-0.6	108.1
940	T	58.5	Low	71.8	Confident	33 Å²	33	66 Å²	66	20%	0.202	34%	0.343	C	S	.	.			trans	-87.9	110.4	169.2	18.9	0	0	0	0	109	A356 G931 V933 A938	A356-T940 HydrophobicContact CB-CG2 3.9Å; A356-T940 WeakPolarHBondContact CB-OG1 3.48Å; A356-T940 VanDerWaalsContact O-CG2 3.3Å; A356-T940 WeakPolarHBondContact O-CG2 3.41Å; G931-T940 WeakPolarHBondContact O-CG2 3.38Å; V933-T940 HydrophobicContact CB-CG2 4.34Å; V933-T940 HydrophobicContact CG2-CG2 3.36Å; A938-T940 PolarHBondContact O-N 2.76Å
941	D	82.4	Confident	71.9	Confident	56 Å²	56	67.8 Å²	67.8	30%	0.299	36%	0.36	S	S	.	.			trans	-114.1	136.6	-178.3	-57.1	-37	0	0	0	107.8	V908 G931	V908-D941 HydrophobicContact CG1-CB 4.25Å; V908-D941 WeakPolarHBondContact CG1-O 3.3Å; G931-D941 PolarHBondContact N-O 2.89Å
942	L	89.7	Confident	72.8	Confident	57 Å²	57	69.9 Å²	69.9	30%	0.298	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.1	169.1	-58.3	178.6	0	0	0	106.8	L355 V358 M478 F928 A930	L355-L942 HydrophobicContact CB-CD1 4.3Å; V358-L942 HydrophobicContact CG2-CD2 3.88Å; M478-L942 HydrophobicContact CE-CD1 4.45Å; F928-L942 HydrophobicContact CE2-CB 4.26Å; F928-L942 HydrophobicContact CZ-CB 4.21Å; F928-L942 HydrophobicContact CZ-CD1 4.23Å; F928-L942 HydrophobicContact CZ-CD2 3.93Å; F928-L942 HydrophobicContact CZ-CG 4.34Å; A930-L942 HydrophobicContact CB-CD2 4.13Å
943	F	93.2	Very high	74.1	Confident	15 Å²	15	72 Å²	72	7%	0.066	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.3	178.6	176.9	-103.9	0	0	0	110.1	I844 I902 N903 L906 V908 F928 A929 T945	I844-F943 HydrophobicContact CD1-CD1 4.26Å; I902-F943 HydrophobicContact CD1-CE1 4.35Å; I902-F943 HydrophobicContact CG1-CE1 4.29Å; N903-F943 HydrophobicContact CB-CD1 4.15Å; N903-F943 HydrophobicContact CB-CD2 4.39Å; N903-F943 HydrophobicContact CB-CE1 3.65Å; N903-F943 HydrophobicContact CB-CE2 3.94Å; N903-F943 HydrophobicContact CB-CG 4.5Å; N903-F943 HydrophobicContact CB-CZ 3.54Å; L906-F943 HydrophobicContact CB-CD2 4.47Å; L906-F943 HydrophobicContact CB-CE2 4.4Å; L906-F943 HydrophobicContact CD1-CD2 4.44Å; L906-F943 HydrophobicContact CD1-CE2 4.13Å; V908-F943 HydrophobicContact CG2-CB 3.42Å; V908-F943 VanDerWaalsContact CG2-CB 3.42Å; V908-F943 HydrophobicContact CG2-CG 4.01Å; F928-F943 CarbonylContact C-O 3.52Å; F928-F943 WeakPolarHBondContact CA-O 3.42Å; A929-F943 HydrophobicContact CB-CB 4.45Å; A929-F943 PolarHBondContact N-O 3Å; A929-F943 PolarHBondContact O-N 2.92Å; F943-T945 HydrophobicContact CD1-CG2 4.41Å; F943-T945 HydrophobicContact CE1-CG2 3.45Å; F943-T945 VanDerWaalsContact CE1-CG2 3.45Å; F943-T945 HydrophobicContact CZ-CG2 3.86Å
944	F	94.4	Very high	76.1	Confident	48 Å²	48	73 Å²	73	21%	0.211	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.5	176.9	-179	-102.8	0	0	0	109	L363 L466 S480 M926 V927 F928	L363-F944 HydrophobicContact CD2-CE2 3.85Å; L363-F944 HydrophobicContact CD2-CZ 4.48Å; L466-F944 HydrophobicContact CD1-CD2 4.35Å; S480-F944 WeakPolarHBondContact O-CD1 3.2Å; S480-F944 WeakPolarHBondContact O-CE1 3.3Å; M926-F944 HydrophobicContact CB-CE2 3.88Å; M926-F944 HydrophobicContact CB-CZ 3.92Å; M926-F944 HydrophobicContact CG-CE2 4.27Å; M926-F944 HydrophobicContact CG-CZ 3.78Å; M926-F944 HydrophobicContact SD-CZ 4.01Å; V927-F944 WeakPolarHBondContact O-CA 3.43Å; V927-F944 WeakPolarHBondContact O-CD2 3.47Å; F928-F944 HydrophobicContact CB-CD2 4.12Å; F928-F944 HydrophobicContact CD2-CB 4.19Å; F928-F944 HydrophobicContact CD2-CD2 4.16Å
945	T	94.5	Very high	78.1	Confident	33 Å²	33	71.6 Å²	71.6	20%	0.202	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	169.2	174.8	-166	0	0	0	0	111	I902 V927 F943 V947	I902-T945 HydrophobicContact CB-CG2 4.49Å; I902-T945 HydrophobicContact CD1-CG2 3.97Å; I902-T945 HydrophobicContact CG1-CG2 4.46Å; V927-T945 HydrophobicContact CB-CG2 4.22Å; V927-T945 PolarHBondContact N-O 3.47Å; V927-T945 PolarHBondContact O-N 3.02Å; F943-T945 HydrophobicContact CD1-CG2 4.41Å; F943-T945 HydrophobicContact CE1-CG2 3.45Å; F943-T945 VanDerWaalsContact CE1-CG2 3.45Å; F943-T945 HydrophobicContact CZ-CG2 3.86Å; T945-V947 HydrophobicContact CG2-CG2 4.09Å
946	R	94.1	Very high	80.5	Confident	112 Å²	112	70.8 Å²	70.8	42%	0.423	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.3	171.3	-61	169	-172.8	154.2	-0.2	108.1	L462 S925 M926	L462-R946 PolarHBondContact O-NH2 2.89Å; S925-R946 CarbonylContact O-C 3.34Å; S925-R946 WeakPolarHBondContact O-CA 3.31Å; M926-R946 HydrophobicContact CG-CG 4.19Å
947	V	94.6	Very high	82.6	Confident	6 Å²	6	70.6 Å²	70.6	4%	0.036	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.2	-178.6	177.8	0	0	0	0	108.1	E846 I902 T924 S925 V927 T945 P949	E846-V947 WeakPolarHBondContact OE1-CG1 3.48Å; E846-V947 WeakPolarHBondContact OE2-CG1 3.34Å; I902-V947 HydrophobicContact CD1-CG2 4.35Å; I902-V947 HydrophobicContact CG2-CG2 4.15Å; T924-V947 WeakPolarHBondContact CA-O 3.34Å; S925-V947 PolarHBondContact N-O 3.43Å; S925-V947 PolarHBondContact O-N 3.46Å; V927-V947 HydrophobicContact CB-CG2 4.39Å; V927-V947 HydrophobicContact CG2-CB 4.14Å; V927-V947 HydrophobicContact CG2-CG2 3.58Å; T945-V947 HydrophobicContact CG2-CG2 4.09Å; V947-P949 HydrophobicContact CG1-CG 4.39Å; V947-P949 WeakPolarHBondContact O-CD 3.38Å
948	S	94.2	Very high	84.9	Confident	45 Å²	45	70.1 Å²	70.1	32%	0.315	37%	0.368	S	S	.	.			trans	-121.4	85.8	179.7	-56.6	0	0	0	0	109.5	S923 A950 G951	S923-S948 VanDerWaalsContact O-CA 3.31Å; S923-S948 WeakPolarHBondContact O-CA 3.31Å; S948-A950 VanDerWaalsContact C-N 3.3Å; S948-A950 PolarHBondContact O-N 3.09Å; S948-G951 PolarHBondContact O-N 3.04Å
949	P	91.6	Very high	87.3	Confident	13 Å²	13	72.2 Å²	72.2	8%	0.084	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-34	-166.5	-22.4	30.1	0	0	0	114.6	T824 T831 F834 V947	T824-P949 HydrophobicContact CG2-CG 4.14Å; T831-P949 HydrophobicContact CG2-CB 3.88Å; T831-P949 HydrophobicContact CG2-CG 3.92Å; F834-P949 HydrophobicContact CB-CB 4.39Å; F834-P949 HydrophobicContact CD1-CB 4.43Å; F834-P949 HydrophobicContact CD2-CB 3.36Å; F834-P949 HydrophobicContact CD2-CG 4.44Å; F834-P949 HydrophobicContact CE1-CB 4.48Å; F834-P949 HydrophobicContact CE2-CB 3.52Å; F834-P949 WeakPolarHBondContact CE2-O 3.37Å; F834-P949 HydrophobicContact CG-CB 3.84Å; F834-P949 HydrophobicContact CZ-CB 4.07Å; F834-P949 WeakPolarHBondContact CZ-O 3.34Å; V947-P949 HydrophobicContact CG1-CG 4.39Å; V947-P949 WeakPolarHBondContact O-CD 3.38Å
950	A	89.8	Confident	89.4	Confident	54 Å²	54	66.8 Å²	66.8	45%	0.446	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	16.8	174.5	0	0	0	0	0	113.6	T831 P832 S948 F953	T831-A950 HydrophobicContact CG2-CB 4.15Å; P832-A950 HydrophobicContact CG-CB 3.87Å; S948-A950 VanDerWaalsContact C-N 3.3Å; S948-A950 PolarHBondContact O-N 3.09Å; A950-F953 HydrophobicContact CB-CD1 4.3Å; A950-F953 HydrophobicContact CB-CE1 4.29Å
951	G	90.6	Very high	91.1	Very high	36 Å²	36	69.5 Å²	69.5	37%	0.371	39%	0.388	S	S	.	.			trans	72.3	163.7	-164	0	0	0	0	0	112.3	S923 S948 F953	S923-G951 WeakPolarHBondContact CB-O 3.41Å; S948-G951 PolarHBondContact O-N 3.04Å; G951-F953 VanDerWaalsContact C-N 3.3Å; G951-F953 WeakPolarHBondContact O-CD1 3.46Å; G951-F953 PolarHBondContact O-N 3.46Å
952	A	89.7	Confident	91.6	Very high	45 Å²	45	72.3 Å²	72.3	37%	0.372	40%	0.399	S	S	.	.			trans	-80.9	70.7	-176.7	0	0	0	0	0	111.8	D954 M955	A952-D954 VanDerWaalsContact C-N 3.26Å; A952-D954 PolarHBondContact O-N 2.96Å; A952-M955 HydrophobicContact CB-CB 4.16Å; A952-M955 PolarHBondContact O-N 2.84Å
953	F	91.7	Very high	91.9	Very high	110 Å²	110	79.7 Å²	79.7	48%	0.482	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-19	-176.2	60.2	-98.6	0	0	0	114.2	T831 E922 S923 A950 G951	T831-F953 WeakPolarHBondContact OG1-CE1 3.16Å; E922-F953 HydrophobicContact CB-CZ 4.44Å; E922-F953 HydrophobicContact CG-CZ 4.25Å; S923-F953 VanDerWaalsContact CB-CE1 3.44Å; A950-F953 HydrophobicContact CB-CD1 4.3Å; A950-F953 HydrophobicContact CB-CE1 4.29Å; G951-F953 VanDerWaalsContact C-N 3.3Å; G951-F953 WeakPolarHBondContact O-CD1 3.46Å; G951-F953 PolarHBondContact O-N 3.46Å
954	D	91.3	Very high	92	Very high	82 Å²	82	85.2 Å²	85.2	44%	0.439	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-5.4	176.5	-57	-46.2	0	0	0	113.2	M921 E922 S923 A952	M921-D954 HydrophobicContact CE-CB 3.82Å; E922-D954 PolarHBondContact N-OD2 3.02Å; S923-D954 WeakPolarHBondContact CB-OD2 3.46Å; S923-D954 PolarHBondContact N-OD2 3.26Å; S923-D954 PolarHBondContact OG-OD2 3.43Å; S923-D954 VanDerWaalsContact OG-OD2 3.1Å; A952-D954 VanDerWaalsContact C-N 3.26Å; A952-D954 PolarHBondContact O-N 2.96Å
955	M	88.2	Confident	92.1	Very high	69 Å²	69	86.3 Å²	86.3	34%	0.34	45%	0.454	S	S	.	.	S	Bend	trans	-109.4	143.3	179.2	-99.7	170.3	88.1	0	0	111	M921 A952	M921-M955 HydrophobicContact CE-CB 3.87Å; M921-M955 HydrophobicContact CE-CG 3.24Å; M921-M955 HydrophobicContact CE-SD 3.43Å; M921-M955 WeakPolarHBondContact CE-SD 3.48Å; M921-M955 HydrophobicContact SD-CG 3.87Å; M921-M955 HydrophobicContact SD-SD 3.52Å; A952-M955 HydrophobicContact CB-CB 4.16Å; A952-M955 PolarHBondContact O-N 2.84Å
956	L	89.7	Confident	92.2	Very high	104 Å²	104	86.5 Å²	86.5	55%	0.545	46%	0.46	S	S	.	.			trans	-62.6	138.7	165.4	-169.6	67.4	0	0	0	108.6	D958 F960	L956-D958 PolarHBondContact O-N 3Å; L956-F960 HydrophobicContact CD1-CB 4.41Å; L956-F960 HydrophobicContact CD1-CD1 4.42Å; L956-F960 HydrophobicContact CD1-CD2 3.78Å; L956-F960 HydrophobicContact CD1-CE2 4.01Å; L956-F960 HydrophobicContact CD1-CG 3.97Å; L956-F960 HydrophobicContact CD1-CZ 4.39Å; L956-F960 HydrophobicContact CD2-CB 4.15Å; L956-F960 HydrophobicContact CD2-CD1 3.8Å; L956-F960 HydrophobicContact CD2-CE1 4.24Å; L956-F960 HydrophobicContact CD2-CG 3.94Å; L956-F960 HydrophobicContact CG-CB 4.02Å; L956-F960 HydrophobicContact CG-CD1 4.37Å; L956-F960 HydrophobicContact CG-CD2 4.31Å; L956-F960 HydrophobicContact CG-CG 4Å
957	K	90.1	Very high	92.3	Very high	169 Å²	169	85.5 Å²	85.5	74%	0.735	47%	0.466	S	S	*	.			trans	-60.2	137.3	179.9	-63.2	-179.2	-179.8	-179.4	0	110.5	G959 F960	K957-G959 PolarHBondContact O-N 3.49Å; K957-F960 WeakPolarHBondContact O-CB 3.36Å; K957-F960 PolarHBondContact O-N 3.17Å
958	D	87.2	Confident	92.5	Very high	159 Å²	159	88.2 Å²	88.2	85%	0.85	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-33.5	176	-63.9	-26.3	0	0	0	112.4	L956 F960	L956-D958 PolarHBondContact O-N 3Å; D958-F960 PolarHBondContact O-N 2.82Å
959	G	90.8	Very high	92.6	Very high	78 Å²	78	91 Å²	91	80%	0.804	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	18.7	175.9	0	0	0	0	0	114.9	K957 D961	K957-G959 PolarHBondContact O-N 3.49Å; G959-D961 PolarHBondContact O-N 3.03Å
960	F	91.6	Very high	92.9	Very high	78 Å²	78	95.5 Å²	95.5	34%	0.342	52%	0.516	S	S	.	.			trans	-71.1	123.9	179.7	-173.4	-98.7	0	0	0	111.4	L956 K957 D958 H962 I965	L956-F960 HydrophobicContact CD1-CB 4.41Å; L956-F960 HydrophobicContact CD1-CD1 4.42Å; L956-F960 HydrophobicContact CD1-CD2 3.78Å; L956-F960 HydrophobicContact CD1-CE2 4.01Å; L956-F960 HydrophobicContact CD1-CG 3.97Å; L956-F960 HydrophobicContact CD1-CZ 4.39Å; L956-F960 HydrophobicContact CD2-CB 4.15Å; L956-F960 HydrophobicContact CD2-CD1 3.8Å; L956-F960 HydrophobicContact CD2-CE1 4.24Å; L956-F960 HydrophobicContact CD2-CG 3.94Å; L956-F960 HydrophobicContact CG-CB 4.02Å; L956-F960 HydrophobicContact CG-CD1 4.37Å; L956-F960 HydrophobicContact CG-CD2 4.31Å; L956-F960 HydrophobicContact CG-CG 4Å; K957-F960 WeakPolarHBondContact O-CB 3.36Å; K957-F960 PolarHBondContact O-N 3.17Å; D958-F960 PolarHBondContact O-N 2.82Å; F960-H962 AromaticContact CD1-CD2 3.89Å; F960-H962 AromaticContact CD1-CE1 3.67Å; F960-H962 AromaticContact CD1-CG 3.95Å; F960-H962 AromaticContact CD1-ND1 3.8Å; F960-H962 AromaticContact CD1-NE2 3.71Å; F960-H962 PolarHBondContact O-CE1 2.8Å; F960-H962 PolarHBondContact O-N 3.41Å; F960-H962 VanDerWaalsContact O-N 3.08Å; F960-H962 PolarHBondContact O-ND1 3.39Å; F960-I965 HydrophobicContact CE1-CD1 3.59Å; F960-I965 HydrophobicContact CE2-CD1 4Å; F960-I965 HydrophobicContact CZ-CD1 3.15Å
961	D	93.9	Very high	93.3	Very high	90 Å²	90	94.8 Å²	94.8	48%	0.481	51%	0.513	S	S	.	.			trans	-82.5	89.6	-177.9	-167.3	-16	0	0	0	111.7	G959 W963 F964	G959-D961 PolarHBondContact O-N 3.03Å; D961-W963 VanDerWaalsContact C-N 3.31Å; D961-W963 PolarHBondContact OD1-N 2.93Å; D961-W963 VanDerWaalsContact OD1-N 3.09Å; D961-F964 HydrophobicContact CB-CB 4.02Å; D961-F964 PolarHBondContact OD1-N 3.49Å; D961-F964 WeakPolarHBondContact OD2-CB 3.38Å
962	H	93.5	Very high	93.7	Very high	116 Å²	116	98.4 Å²	98.4	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-66.2	-33.9	176.8	-61.6	81.6	0	0	0	112.1	F960 A966	F960-H962 AromaticContact CD1-CD2 3.89Å; F960-H962 AromaticContact CD1-CE1 3.67Å; F960-H962 AromaticContact CD1-CG 3.95Å; F960-H962 AromaticContact CD1-ND1 3.8Å; F960-H962 AromaticContact CD1-NE2 3.71Å; F960-H962 PolarHBondContact O-CE1 2.8Å; F960-H962 PolarHBondContact O-N 3.41Å; F960-H962 VanDerWaalsContact O-N 3.08Å; F960-H962 PolarHBondContact O-ND1 3.39Å; H962-A966 WeakPolarHBondContact O-CB 3.17Å; H962-A966 PolarHBondContact O-N 2.99Å
963	W	94.6	Very high	94.1	Very high	211 Å²	211	99.4 Å²	99.4	80%	0.799	53%	0.528	S	S	*	.	H	α-helix	trans	-70.9	-39.5	-177.1	-74.6	108.2	0	0	0	112	D961 A966 T967	D961-W963 VanDerWaalsContact C-N 3.31Å; D961-W963 PolarHBondContact OD1-N 2.93Å; D961-W963 VanDerWaalsContact OD1-N 3.09Å; W963-A966 PolarHBondContact O-N 3.08Å; W963-T967 WeakPolarHBondContact O-CB 3.35Å; W963-T967 PolarHBondContact O-N 3.14Å; W963-T967 PolarHBondContact O-OG1 2.82Å
964	F	96.3	Very high	94.3	Very high	132 Å²	132	99 Å²	99	58%	0.579	53%	0.53	S	S	*	.	H	α-helix	trans	-58.4	-51.3	175.3	176.3	-106.4	0	0	0	111.3	D961 A966 T967 V968	D961-F964 HydrophobicContact CB-CB 4.02Å; D961-F964 PolarHBondContact OD1-N 3.49Å; D961-F964 WeakPolarHBondContact OD2-CB 3.38Å; F964-A966 PolarHBondContact O-N 2.98Å; F964-T967 PolarHBondContact O-N 2.96Å; F964-V968 HydrophobicContact CD2-CG2 4.43Å; F964-V968 HydrophobicContact CE1-CG2 4.26Å; F964-V968 HydrophobicContact CE2-CG2 4.07Å; F964-V968 HydrophobicContact CZ-CG2 3.97Å; F964-V968 WeakPolarHBondContact O-CG2 3.4Å; F964-V968 PolarHBondContact O-N 3Å
965	I	96.2	Very high	94.6	Very high	70 Å²	70	97.5 Å²	97.5	36%	0.359	53%	0.529	S	S	.	.	H	α-helix	trans	-64	-42.9	-179.9	-64.6	174.5	0	0	0	111	F960 T967 V968 L969	F960-I965 HydrophobicContact CE1-CD1 3.59Å; F960-I965 HydrophobicContact CE2-CD1 4Å; F960-I965 HydrophobicContact CZ-CD1 3.15Å; I965-T967 VanDerWaalsContact C-N 3.33Å; I965-T967 PolarHBondContact O-N 3.35Å; I965-V968 PolarHBondContact O-N 3.46Å; I965-L969 HydrophobicContact CG2-CD1 3.99Å; I965-L969 HydrophobicContact CG2-CG 4.38Å; I965-L969 WeakPolarHBondContact O-CB 3.31Å; I965-L969 WeakPolarHBondContact O-CG 3.31Å; I965-L969 PolarHBondContact O-N 2.93Å
966	A	96.4	Very high	95	Very high	38 Å²	38	96.9 Å²	96.9	31%	0.314	54%	0.535	S	S	.	.	H	α-helix	trans	-59.7	-43.4	176.4	0	0	0	0	0	112	H962 W963 F964 L969 I970	H962-A966 WeakPolarHBondContact O-CB 3.17Å; H962-A966 PolarHBondContact O-N 2.99Å; W963-A966 PolarHBondContact O-N 3.08Å; F964-A966 PolarHBondContact O-N 2.98Å; A966-L969 PolarHBondContact O-N 3.34Å; A966-I970 VanDerWaalsContact O-CG1 3.31Å; A966-I970 WeakPolarHBondContact O-CG1 3.49Å; A966-I970 PolarHBondContact O-N 3.35Å
967	T	97.1	Very high	95.4	Very high	90 Å²	90	97.5 Å²	97.5	55%	0.552	54%	0.536	S	S	*	.	H	α-helix	trans	-64.7	-43.6	178.5	-57.6	0	0	0	0	111.6	W963 F964 I965 I970 G971	W963-T967 WeakPolarHBondContact O-CB 3.35Å; W963-T967 PolarHBondContact O-N 3.14Å; W963-T967 PolarHBondContact O-OG1 2.82Å; F964-T967 PolarHBondContact O-N 2.96Å; I965-T967 VanDerWaalsContact C-N 3.33Å; I965-T967 PolarHBondContact O-N 3.35Å; T967-I970 PolarHBondContact O-N 2.63Å; T967-G971 PolarHBondContact O-N 3.46Å
968	V	97.7	Very high	95.7	Very high	64 Å²	64	91.9 Å²	91.9	39%	0.388	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-43.5	176	172.2	0	0	0	0	110.9	F964 I965 G971 L972	F964-V968 HydrophobicContact CD2-CG2 4.43Å; F964-V968 HydrophobicContact CE1-CG2 4.26Å; F964-V968 HydrophobicContact CE2-CG2 4.07Å; F964-V968 HydrophobicContact CZ-CG2 3.97Å; F964-V968 WeakPolarHBondContact O-CG2 3.4Å; F964-V968 PolarHBondContact O-N 3Å; I965-V968 PolarHBondContact O-N 3.46Å; V968-G971 PolarHBondContact O-N 3.41Å; V968-L972 HydrophobicContact CG1-CD1 3.86Å; V968-L972 HydrophobicContact CG1-CG 4.28Å; V968-L972 WeakPolarHBondContact O-CB 3.33Å; V968-L972 VanDerWaalsContact O-CG 3.31Å; V968-L972 WeakPolarHBondContact O-CG 3.27Å; V968-L972 PolarHBondContact O-N 2.97Å
969	L	97.7	Very high	96.1	Very high	104 Å²	104	88 Å²	88	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-62.7	-44.2	177.7	-74.9	171.7	0	0	0	112.4	I965 A966 S973	I965-L969 HydrophobicContact CG2-CD1 3.99Å; I965-L969 HydrophobicContact CG2-CG 4.38Å; I965-L969 WeakPolarHBondContact O-CB 3.31Å; I965-L969 WeakPolarHBondContact O-CG 3.31Å; I965-L969 PolarHBondContact O-N 2.93Å; A966-L969 PolarHBondContact O-N 3.34Å; L969-S973 WeakPolarHBondContact O-CB 3.35Å; L969-S973 PolarHBondContact O-N 2.85Å; L969-S973 PolarHBondContact O-OG 2.89Å
970	I	97.6	Very high	96.3	Very high	107 Å²	107	90.2 Å²	90.2	55%	0.549	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-45.9	176.2	-67.7	166.5	0	0	0	110.2	A966 T967 L972 S973 L974	A966-I970 VanDerWaalsContact O-CG1 3.31Å; A966-I970 WeakPolarHBondContact O-CG1 3.49Å; A966-I970 PolarHBondContact O-N 3.35Å; T967-I970 PolarHBondContact O-N 2.63Å; I970-L972 PolarHBondContact O-N 2.74Å; I970-S973 PolarHBondContact O-N 3.37Å; I970-L974 HydrophobicContact CG2-CD1 3.86Å; I970-L974 HydrophobicContact CG2-CG 4.33Å; I970-L974 WeakPolarHBondContact O-CB 3.38Å; I970-L974 WeakPolarHBondContact O-CG 3.35Å; I970-L974 PolarHBondContact O-N 3.46Å
971	G	97.9	Very high	96.5	Very high	38 Å²	38	95 Å²	95	39%	0.392	51%	0.507	S	S	.	.	H	α-helix	trans	-58.9	-47.2	178.2	0	0	0	0	0	112.5	T967 V968 S973 L974 A975	T967-G971 PolarHBondContact O-N 3.46Å; V968-G971 PolarHBondContact O-N 3.41Å; G971-S973 PolarHBondContact O-N 2.84Å; G971-L974 PolarHBondContact O-N 2.84Å; G971-A975 VanDerWaalsContact O-CB 3.26Å; G971-A975 WeakPolarHBondContact O-CB 3.37Å; G971-A975 PolarHBondContact O-N 3.22Å
972	L	98.1	Very high	96.6	Very high	112 Å²	112	96 Å²	96	59%	0.586	51%	0.511	S	S	*	.	H	α-helix	trans	-64.5	-38.4	176	-72.5	175.1	0	0	0	112.1	V968 I970 A975 A976	V968-L972 HydrophobicContact CG1-CD1 3.86Å; V968-L972 HydrophobicContact CG1-CG 4.28Å; V968-L972 WeakPolarHBondContact O-CB 3.33Å; V968-L972 VanDerWaalsContact O-CG 3.31Å; V968-L972 WeakPolarHBondContact O-CG 3.27Å; V968-L972 PolarHBondContact O-N 2.97Å; I970-L972 PolarHBondContact O-N 2.74Å; L972-A975 PolarHBondContact O-N 3.49Å; L972-A976 VanDerWaalsContact O-CB 3.27Å; L972-A976 WeakPolarHBondContact O-CB 3.26Å; L972-A976 PolarHBondContact O-N 3.46Å
973	S	97.7	Very high	96.7	Very high	67 Å²	67	93.8 Å²	93.8	47%	0.469	51%	0.506	S	S	.	.	H	α-helix	trans	-66.5	-44.3	177.6	-60	0	0	0	0	112.1	L969 I970 G971 A976 M977	L969-S973 WeakPolarHBondContact O-CB 3.35Å; L969-S973 PolarHBondContact O-N 2.85Å; L969-S973 PolarHBondContact O-OG 2.89Å; I970-S973 PolarHBondContact O-N 3.37Å; G971-S973 PolarHBondContact O-N 2.84Å; S973-A976 PolarHBondContact O-N 2.89Å; S973-M977 WeakPolarHBondContact O-CG 3.42Å; S973-M977 PolarHBondContact O-N 3Å
974	L	97.2	Very high	96.7	Very high	102 Å²	102	91.4 Å²	91.4	53%	0.534	50%	0.497	S	S	.	.	H	α-helix	trans	-63.9	-44.3	174.7	-71.1	171.6	0	0	0	111.2	I970 G971 A976 M977 A978	I970-L974 HydrophobicContact CG2-CD1 3.86Å; I970-L974 HydrophobicContact CG2-CG 4.33Å; I970-L974 WeakPolarHBondContact O-CB 3.38Å; I970-L974 WeakPolarHBondContact O-CG 3.35Å; I970-L974 PolarHBondContact O-N 3.46Å; G971-L974 PolarHBondContact O-N 2.84Å; L974-A976 VanDerWaalsContact C-N 3.34Å; L974-A976 PolarHBondContact O-N 3.5Å; L974-M977 HydrophobicContact CD2-CE 3.73Å; L974-M977 HydrophobicContact CG-CE 4.46Å; L974-M977 PolarHBondContact O-N 3.07Å; L974-A978 WeakPolarHBondContact O-CB 3.17Å; L974-A978 PolarHBondContact O-N 2.91Å
975	A	97.1	Very high	96.6	Very high	50 Å²	50	89.7 Å²	89.7	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-61.8	-40.4	175.7	0	0	0	0	0	111.8	G971 L972 A978 T979	G971-A975 VanDerWaalsContact O-CB 3.26Å; G971-A975 WeakPolarHBondContact O-CB 3.37Å; G971-A975 PolarHBondContact O-N 3.22Å; L972-A975 PolarHBondContact O-N 3.49Å; A975-A978 PolarHBondContact O-N 3.09Å; A975-T979 WeakPolarHBondContact O-CB 3.5Å; A975-T979 VanDerWaalsContact O-CG2 3.27Å; A975-T979 WeakPolarHBondContact O-CG2 3.27Å; A975-T979 PolarHBondContact O-N 2.77Å; A975-T979 PolarHBondContact O-OG1 2.85Å
976	A	97.3	Very high	96.6	Very high	55 Å²	55	92.8 Å²	92.8	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-40	175.6	0	0	0	0	0	112.3	L972 S973 L974 T979 K980	L972-A976 VanDerWaalsContact O-CB 3.27Å; L972-A976 WeakPolarHBondContact O-CB 3.26Å; L972-A976 PolarHBondContact O-N 3.46Å; S973-A976 PolarHBondContact O-N 2.89Å; L974-A976 VanDerWaalsContact C-N 3.34Å; L974-A976 PolarHBondContact O-N 3.5Å; A976-T979 WeakPolarHBondContact CA-OG1 3.49Å; A976-T979 PolarHBondContact O-OG1 2.9Å; A976-T979 VanDerWaalsContact O-OG1 3.09Å; A976-K980 WeakPolarHBondContact O-CB 3.38Å; A976-K980 PolarHBondContact O-N 3.41Å
977	M	96.6	Very high	96.5	Very high	118 Å²	118	95.3 Å²	95.3	58%	0.581	51%	0.51	S	S	*	.	H	α-helix	trans	-67.3	-42.4	175.1	-72.3	-172.6	-69.1	0	0	112.1	S973 L974 R981	S973-M977 WeakPolarHBondContact O-CG 3.42Å; S973-M977 PolarHBondContact O-N 3Å; L974-M977 HydrophobicContact CD2-CE 3.73Å; L974-M977 HydrophobicContact CG-CE 4.46Å; L974-M977 PolarHBondContact O-N 3.07Å; M977-R981 PolarHBondContact O-N 3.27Å
978	A	96.3	Very high	96.3	Very high	51 Å²	51	94.5 Å²	94.5	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-48.9	177	0	0	0	0	0	111.3	L974 A975 R981 L982	L974-A978 WeakPolarHBondContact O-CB 3.17Å; L974-A978 PolarHBondContact O-N 2.91Å; A975-A978 PolarHBondContact O-N 3.09Å; A978-R981 WeakPolarHBondContact O-CB 3.41Å; A978-R981 PolarHBondContact O-N 3.13Å; A978-L982 WeakPolarHBondContact O-CG 3.32Å; A978-L982 PolarHBondContact O-N 3.3Å
979	T	96.2	Very high	96.1	Very high	76 Å²	76	96 Å²	96	47%	0.466	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-43.1	177.8	51	0	0	0	0	111.6	A975 A976 R981 L982 T983	A975-T979 WeakPolarHBondContact O-CB 3.5Å; A975-T979 VanDerWaalsContact O-CG2 3.27Å; A975-T979 WeakPolarHBondContact O-CG2 3.27Å; A975-T979 PolarHBondContact O-N 2.77Å; A975-T979 PolarHBondContact O-OG1 2.85Å; A976-T979 WeakPolarHBondContact CA-OG1 3.49Å; A976-T979 PolarHBondContact O-OG1 2.9Å; A976-T979 VanDerWaalsContact O-OG1 3.09Å; T979-R981 VanDerWaalsContact C-N 3.26Å; T979-R981 PolarHBondContact O-N 3.14Å; T979-L982 PolarHBondContact O-N 3.27Å; T979-L982 VanDerWaalsContact O-N 3.14Å; T979-T983 WeakPolarHBondContact O-CB 3.46Å; T979-T983 PolarHBondContact O-N 2.82Å; T979-T983 PolarHBondContact O-OG1 3Å
980	K	96.3	Very high	95.9	Very high	125 Å²	125	95.1 Å²	95.1	54%	0.543	51%	0.506	S	S	.	.	H	α-helix	trans	-55.9	-40.4	173.5	-178	176.6	-177.4	175.9	0	112.4	A976 R984	A976-K980 WeakPolarHBondContact O-CB 3.38Å; A976-K980 PolarHBondContact O-N 3.41Å; K980-R984 WeakPolarHBondContact O-CB 3.49Å; K980-R984 VanDerWaalsContact O-CG 3.32Å; K980-R984 WeakPolarHBondContact O-CG 3.35Å; K980-R984 PolarHBondContact O-N 3.31Å; K980-R984 VanDerWaalsContact O-N 3.11Å
981	R	95.6	Very high	95.7	Very high	180 Å²	180	93.9 Å²	93.9	68%	0.679	51%	0.512	S	S	*	.	H	α-helix	trans	-68	-44.6	176.9	-171.5	175.6	179.9	165.4	0.2	111.5	M977 A978 T979 R984 Q985	M977-R981 PolarHBondContact O-N 3.27Å; A978-R981 WeakPolarHBondContact O-CB 3.41Å; A978-R981 PolarHBondContact O-N 3.13Å; T979-R981 VanDerWaalsContact C-N 3.26Å; T979-R981 PolarHBondContact O-N 3.14Å; R981-R984 PolarHBondContact O-N 3.11Å; R981-Q985 WeakPolarHBondContact O-CG 3.42Å; R981-Q985 PolarHBondContact O-N 3.5Å; R981-Q985 VanDerWaalsContact O-N 3.13Å
982	L	95.9	Very high	95.3	Very high	109 Å²	109	103 Å²	103	57%	0.571	53%	0.534	S	S	*	.	H	α-helix	trans	-64.6	-43.4	178.6	-69.4	171.3	0	0	0	112.2	A978 T979 Q985 K986	A978-L982 WeakPolarHBondContact O-CG 3.32Å; A978-L982 PolarHBondContact O-N 3.3Å; T979-L982 PolarHBondContact O-N 3.27Å; T979-L982 VanDerWaalsContact O-N 3.14Å; L982-Q985 PolarHBondContact O-N 3.11Å; L982-K986 PolarHBondContact O-N 3.09Å
983	T	95.3	Very high	94.5	Very high	71 Å²	71	109.8 Å²	109.8	44%	0.436	55%	0.552	S	S	.	*	H	α-helix	trans	-65.3	-44.2	177.8	-53	0	0	0	0	111.1	T979 Q985 K986 D987	T979-T983 WeakPolarHBondContact O-CB 3.46Å; T979-T983 PolarHBondContact O-N 2.82Å; T979-T983 PolarHBondContact O-OG1 3Å; T983-Q985 VanDerWaalsContact C-N 3.28Å; T983-Q985 PolarHBondContact O-N 2.93Å; T983-K986 PolarHBondContact O-N 2.95Å; T983-K986 VanDerWaalsContact O-N 3.11Å; T983-D987 WeakPolarHBondContact O-CB 3.43Å; T983-D987 VanDerWaalsContact O-CG 3.24Å; T983-D987 PolarHBondContact O-N 2.96Å
984	R	95.2	Very high	94.3	Very high	160 Å²	160	112 Å²	112	60%	0.604	56%	0.556	S	S	*	*	H	α-helix	trans	-55.8	-43.7	173.8	-79.9	177.1	173.8	-174.8	-5.3	112.3	K980 R981 T988	K980-R984 WeakPolarHBondContact O-CB 3.49Å; K980-R984 VanDerWaalsContact O-CG 3.32Å; K980-R984 WeakPolarHBondContact O-CG 3.35Å; K980-R984 PolarHBondContact O-N 3.31Å; K980-R984 VanDerWaalsContact O-N 3.11Å; R981-R984 PolarHBondContact O-N 3.11Å; R984-T988 VanDerWaalsContact O-CG2 3.3Å; R984-T988 WeakPolarHBondContact O-CG2 3.3Å; R984-T988 PolarHBondContact O-N 3.5Å; R984-T988 PolarHBondContact O-OG1 2.78Å; R984-T988 VanDerWaalsContact O-OG1 3.09Å
985	Q	93.8	Very high	94.2	Very high	96 Å²	96	112.5 Å²	112.5	45%	0.449	56%	0.558	S	S	.	*	H	α-helix	trans	-63.3	-46.6	176.4	-73.2	176.9	-16.9	0	0	111.3	R981 L982 T983 D987 T988 I989	R981-Q985 WeakPolarHBondContact O-CG 3.42Å; R981-Q985 PolarHBondContact O-N 3.5Å; R981-Q985 VanDerWaalsContact O-N 3.13Å; L982-Q985 PolarHBondContact O-N 3.11Å; T983-Q985 VanDerWaalsContact C-N 3.28Å; T983-Q985 PolarHBondContact O-N 2.93Å; Q985-D987 PolarHBondContact O-N 3.19Å; Q985-T988 WeakPolarHBondContact CA-OG1 3.33Å; Q985-T988 PolarHBondContact O-N 3.33Å; Q985-T988 PolarHBondContact O-OG1 2.95Å; Q985-I989 VanDerWaalsContact O-CG1 3.31Å; Q985-I989 WeakPolarHBondContact O-CG1 3.31Å; Q985-I989 PolarHBondContact O-N 3.3Å
986	K	94.9	Very high	94	Very high	135 Å²	135	115.9 Å²	115.9	59%	0.587	57%	0.566	S	S	*	*	H	α-helix	trans	-60.8	-45.6	177.4	-173.7	178.1	178	-179.9	0	112.3	L982 T983 I989 N990	L982-K986 PolarHBondContact O-N 3.09Å; T983-K986 PolarHBondContact O-N 2.95Å; T983-K986 VanDerWaalsContact O-N 3.11Å; K986-I989 PolarHBondContact O-N 2.73Å; K986-N990 WeakPolarHBondContact O-CB 3.43Å; K986-N990 PolarHBondContact O-N 3.36Å
987	D	94.8	Very high	93.8	Very high	91 Å²	91	119.5 Å²	119.5	49%	0.487	57%	0.572	S	S	.	*	H	α-helix	trans	-64.4	-41.6	178.8	-67.5	-15.6	0	0	0	111.1	T983 Q985 N990 A991	T983-D987 WeakPolarHBondContact O-CB 3.43Å; T983-D987 VanDerWaalsContact O-CG 3.24Å; T983-D987 PolarHBondContact O-N 2.96Å; Q985-D987 PolarHBondContact O-N 3.19Å; D987-N990 PolarHBondContact O-N 2.95Å; D987-A991 WeakPolarHBondContact O-CB 3.42Å; D987-A991 PolarHBondContact O-N 2.89Å
988	T	92.8	Very high	93.6	Very high	73 Å²	73	119.6 Å²	119.6	45%	0.448	57%	0.572	S	S	.	*	H	α-helix	trans	-60.8	-49.4	173.1	54	0	0	0	0	111.2	R984 Q985 N990 A991 W992	R984-T988 VanDerWaalsContact O-CG2 3.3Å; R984-T988 WeakPolarHBondContact O-CG2 3.3Å; R984-T988 PolarHBondContact O-N 3.5Å; R984-T988 PolarHBondContact O-OG1 2.78Å; R984-T988 VanDerWaalsContact O-OG1 3.09Å; Q985-T988 WeakPolarHBondContact CA-OG1 3.33Å; Q985-T988 PolarHBondContact O-N 3.33Å; Q985-T988 PolarHBondContact O-OG1 2.95Å; T988-N990 VanDerWaalsContact C-N 3.28Å; T988-N990 PolarHBondContact O-N 3.05Å; T988-A991 PolarHBondContact O-N 2.89Å; T988-W992 PolarHBondContact O-N 3.38Å
989	I	94.3	Very high	93.5	Very high	97 Å²	97	124.2 Å²	124.2	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-59	-41.2	179	-68.8	165.4	0	0	0	111.4	Q985 K986 A991 W992 R993	Q985-I989 VanDerWaalsContact O-CG1 3.31Å; Q985-I989 WeakPolarHBondContact O-CG1 3.31Å; Q985-I989 PolarHBondContact O-N 3.3Å; K986-I989 PolarHBondContact O-N 2.73Å; I989-A991 VanDerWaalsContact C-N 3.34Å; I989-W992 PolarHBondContact O-N 3.26Å; I989-R993 PolarHBondContact O-N 3.41Å
990	N	94	Very high	93.3	Very high	84 Å²	84	127.6 Å²	127.6	45%	0.449	59%	0.59	S	S	.	*	H	α-helix	trans	-67.8	-32.2	176.3	-76.5	-12	0	0	0	112.8	K986 D987 T988	K986-N990 WeakPolarHBondContact O-CB 3.43Å; K986-N990 PolarHBondContact O-N 3.36Å; D987-N990 PolarHBondContact O-N 2.95Å; T988-N990 VanDerWaalsContact C-N 3.28Å; T988-N990 PolarHBondContact O-N 3.05Å
991	A	92.3	Very high	93	Very high	82 Å²	82	127.8 Å²	127.8	68%	0.678	59%	0.593	S	S	*	*	H	α-helix	trans	-77.2	-25.1	176.1	0	0	0	0	0	113.3	D987 T988 I989	D987-A991 WeakPolarHBondContact O-CB 3.42Å; D987-A991 PolarHBondContact O-N 2.89Å; T988-A991 PolarHBondContact O-N 2.89Å; I989-A991 VanDerWaalsContact C-N 3.34Å
992	W	90.3	Very high	92.8	Very high	230 Å²	230	123.5 Å²	123.5	87%	0.871	59%	0.586	S	S	*	*	H	α-helix	trans	-80.7	-17.2	173.5	-74.8	106.2	0	0	0	113.3	T988 I989	T988-W992 PolarHBondContact O-N 3.38Å; I989-W992 PolarHBondContact O-N 3.26Å
993	R	80.3	Confident	92.5	Very high	254 Å²	254	124.8 Å²	124.8	96%	0.958	59%	0.588	S	S	*	*			trans	-85.6	0	170.2	-78.2	-175.9	177.8	-178.4	-0.5	110.2	I989	I989-R993 PolarHBondContact O-N 3.41Å

Retrieved 993 of 993 residues in 650.3 ms (Link to these results)

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