A0A3Q0KBM3_SCHMA Loading...

ER membrane protein complex subunit 1 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KBM3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,137 aa.

						>A0A3Q0KBM3_SCHMA|A0A3Q0KBM3
MHLSLWLLASLALSVNAIYEDQVDDLDWNQKFVGKVKYSKLKFDGTIPKNYFVGSELNVISSINLKDGSIVWRQVLDEDGELTGFELCGNKLFSLSSKHGTKLRAWDIKFGGVLWEALIDSSESSSGDIWCDENSGILVVAYDKGVDTYRLQTGEKLSSDRNMNSSSPNQINIVSGKTESSLTISLVEKYLDKSGHLDIDAPELSYIIIRTYPIPSSGLQLTPMVIKNYTIPSSVYNQHSCNIFGLHNIPTNAVVVCLSSERGRQGSLLRFSSVSSSSWDVITVKSTFANMVKLTDNDFLLTSSPLEPTTGAVYHLDSSGIPVLKYFVNNAMIGCLGTLNGRSYLFTLHHNVDQYFKNLALNIYDLESGELSKELPPRHFTLASHHGTIESISAIMFTDATGAPSFRLLLYTEDDAVQLIRQNGKQQWIREEALANIVAVEVIDLPVSEFQAKIEEEFNHASNNILEMFIQRLKSQMSQLVVWTRHWIYNIPNLFMAIVSSKPFFKHSSNGDLSKRRVLPSSSPSLQDYSSSDPSSFSSYSHSFPPRWQFSSHIPSLNVNNSTNNDNTIDNVDGDKLNVYKSSQIDSKLTSWDEKLTRDNFNVHKMLVIATSVGKLFGLESERGRIVWDYFVPSAKLLANEKFALFQQRNLAHFPLPPIMSLLFRSKKTNRRVLFSFNPITGVPSHEKGMDLYTLKSDIIQTVLEPGSVSERCEFIRPLLLLRADLDVEVYPSTCTPTYSSSDSQPLYIFTIEREQARLTGYRINPVSSDGKSLKATRVWRMLLSPDSNPVNKHIIVAAASRPPSEHIYSVGRVLGDRSVLYKYLNPNLIAVLTIGGDINSHTNTLMIYLIDVVAGRILYSAVHRRCSEPISLVHSENWIIYTYYNHKSLRNEATVIELYEPTKLSGELCASQSIPSPWQLFLNNLIPSWLLSNPSSLKGSGDLSSFSRFSSLFRASDVDGFCSSTGENSLIPQVLQQSYILNTPPRSGAVTVSVTERGITAKNIILALQRNSLIELPKTFFDPRRSLDMTSELMEEGVHPYAPVLPFSDQAIITYNQSIMRIRAIRTAPTGLESTGLVFAYGLDLFFTRISPSQTYDLLKEDFDYTAIATVTLGMIIASIVSCRLATRRAILRAWA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.7	Low	66.1	Low	196 Å²	196	123.9 Å²	123.9	97%	0.966	65%	0.645	S	S	*	*				0	-54.8	0	-96.5	176	84.9	0	0	113.1	L3 S4 L5	M1-L3 VanDerWaalsContact C-N 3.32Å; M1-L3 PolarHBondContact O-N 3.49Å; M1-S4 PolarHBondContact O-N 3Å; M1-S4 VanDerWaalsContact O-N 3.13Å; M1-L5 PolarHBondContact O-N 3.02Å
2	H	63.7	Low	65.3	Low	164 Å²	164	119.8 Å²	119.8	76%	0.759	64%	0.642	S	S	*	*	H	α-helix	trans	-56.9	-36.5	-175.8	-74.4	-64.1	0	0	0	115.3	L5 W6	H2-L5 PolarHBondContact O-N 3.33Å; H2-W6 PolarHBondContact O-N 3Å
3	L	66.3	Low	64.5	Low	145 Å²	145	121.8 Å²	121.8	76%	0.759	65%	0.652	S	S	*	*	H	α-helix	trans	-68.4	-34.9	178.6	-150.3	81.9	0	0	0	113.2	M1 W6 L7	M1-L3 VanDerWaalsContact C-N 3.32Å; M1-L3 PolarHBondContact O-N 3.49Å; L3-W6 PolarHBondContact O-N 3.34Å; L3-L7 PolarHBondContact O-N 3.08Å
4	S	69.3	Low	63.6	Low	73 Å²	73	119.5 Å²	119.5	51%	0.51	65%	0.65	S	S	.	*	H	α-helix	trans	-71.8	-35.3	178.3	156.4	0	0	0	0	111.8	M1 W6 L7 L8	M1-S4 PolarHBondContact O-N 3Å; M1-S4 VanDerWaalsContact O-N 3.13Å; S4-W6 VanDerWaalsContact C-N 3.34Å; S4-L7 PolarHBondContact O-N 2.88Å; S4-L8 PolarHBondContact O-N 3.13Å
5	L	70.3	Confident	62.6	Low	117 Å²	117	118.8 Å²	118.8	61%	0.613	65%	0.651	S	S	*	*	H	α-helix	trans	-65.9	-38.6	173.7	-118	112.1	0	0	0	111.6	M1 H2 A9	M1-L5 PolarHBondContact O-N 3.02Å; H2-L5 PolarHBondContact O-N 3.33Å; L5-A9 WeakPolarHBondContact O-CB 3.42Å; L5-A9 PolarHBondContact O-N 3.46Å
6	W	70.9	Confident	61.6	Low	206 Å²	206	121.6 Å²	121.6	78%	0.78	66%	0.664	S	S	*	*	H	α-helix	trans	-65.8	-40	174.6	-95.5	84	0	0	0	112.5	H2 L3 S4 A9 S10	H2-W6 PolarHBondContact O-N 3Å; L3-W6 PolarHBondContact O-N 3.34Å; S4-W6 VanDerWaalsContact C-N 3.34Å; W6-A9 PolarHBondContact O-N 2.96Å; W6-S10 PolarHBondContact O-N 3.48Å
7	L	71	Confident	61	Low	109 Å²	109	118.2 Å²	118.2	57%	0.571	66%	0.656	S	S	*	*	H	α-helix	trans	-67.3	-40.8	177.4	-129.7	112.4	0	0	0	111.9	L3 S4 S10 L11	L3-L7 PolarHBondContact O-N 3.08Å; S4-L7 PolarHBondContact O-N 2.88Å; L7-S10 WeakPolarHBondContact CA-OG 3.24Å; L7-S10 PolarHBondContact O-N 2.95Å; L7-S10 PolarHBondContact O-OG 3.43Å; L7-L11 PolarHBondContact O-N 3.32Å; L7-L11 VanDerWaalsContact O-N 3.08Å
8	L	65.5	Low	60.3	Low	118 Å²	118	116.1 Å²	116.1	62%	0.618	64%	0.643	S	S	*	*	H	α-helix	trans	-64.5	-39.2	173.4	-99.3	142.8	0	0	0	112.2	S4 S10 L11 A12	S4-L8 PolarHBondContact O-N 3.13Å; L8-S10 VanDerWaalsContact C-N 3.32Å; L8-S10 PolarHBondContact O-N 3.35Å; L8-L11 PolarHBondContact O-N 3.02Å; L8-A12 PolarHBondContact O-N 3.4Å
9	A	65.7	Low	59.9	Low	58 Å²	58	118.9 Å²	118.9	48%	0.479	64%	0.644	S	S	.	*	H	α-helix	trans	-65.6	-35.2	173.4	0	0	0	0	0	112.1	L5 W6 A12	L5-A9 WeakPolarHBondContact O-CB 3.42Å; L5-A9 PolarHBondContact O-N 3.46Å; W6-A9 PolarHBondContact O-N 2.96Å; A9-A12 PolarHBondContact O-N 3.22Å
10	S	66.9	Low	59.5	Low	64 Å²	64	122.1 Å²	122.1	45%	0.448	66%	0.655	S	S	.	*	H	α-helix	trans	-69.6	-31.5	176.9	73.6	0	0	0	0	113.5	W6 L7 L8 A12 L13	W6-S10 PolarHBondContact O-N 3.48Å; L7-S10 WeakPolarHBondContact CA-OG 3.24Å; L7-S10 PolarHBondContact O-N 2.95Å; L7-S10 PolarHBondContact O-OG 3.43Å; L8-S10 VanDerWaalsContact C-N 3.32Å; L8-S10 PolarHBondContact O-N 3.35Å; S10-A12 VanDerWaalsContact C-N 3.32Å; S10-L13 PolarHBondContact O-N 2.9Å
11	L	61.4	Low	59.2	Low	113 Å²	113	122 Å²	122	59%	0.592	65%	0.654	S	S	*	*	H	α-helix	trans	-73.2	-24.1	174.8	-76.5	158.4	0	0	0	112.5	L7 L8 L13 S14	L7-L11 PolarHBondContact O-N 3.32Å; L7-L11 VanDerWaalsContact O-N 3.08Å; L8-L11 PolarHBondContact O-N 3.02Å; L11-L13 VanDerWaalsContact C-N 3.29Å; L11-S14 PolarHBondContact O-OG 3.32Å
12	A	57.1	Low	59.3	Low	74 Å²	74	115.1 Å²	115.1	61%	0.612	62%	0.619	S	S	*	*	H	α-helix	trans	-73.7	-20.5	173.6	0	0	0	0	0	112.8	L8 A9 S10 S14	L8-A12 PolarHBondContact O-N 3.4Å; A9-A12 PolarHBondContact O-N 3.22Å; S10-A12 VanDerWaalsContact C-N 3.32Å; A12-S14 VanDerWaalsContact C-N 3.25Å; A12-S14 PolarHBondContact O-N 2.95Å
13	L	55.4	Low	59.1	Low	147 Å²	147	109.3 Å²	109.3	77%	0.77	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-7.7	178.1	-74.4	163.1	0	0	0	113.7	S10 L11	S10-L13 PolarHBondContact O-N 2.9Å; L11-L13 VanDerWaalsContact C-N 3.29Å
14	S	51.2	Low	58.9	Low	89 Å²	89	107.7 Å²	107.7	62%	0.622	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	21.5	-177.7	42.2	0	0	0	0	115.1	L11 A12	L11-S14 PolarHBondContact O-OG 3.32Å; A12-S14 VanDerWaalsContact C-N 3.25Å; A12-S14 PolarHBondContact O-N 2.95Å
15	V	48.2	Very low	58.8	Low	109 Å²	109	109.6 Å²	109.6	66%	0.661	59%	0.592	S	S	*	*			trans	-105.5	102.7	172	-176.1	0	0	0	0	109.2	A17	V15-A17 HydrophobicContact CG1-CB 4.08Å; V15-A17 PolarHBondContact O-N 2.88Å
16	N	46.6	Very low	59.1	Low	163 Å²	163	107.2 Å²	107.2	87%	0.872	58%	0.58	S	S	*	*			trans	-78.7	89.9	164.8	-73.5	-28.1	0	0	0	108
17	A	51.7	Low	59.9	Low	64 Å²	64	97.7 Å²	97.7	53%	0.529	54%	0.544	S	S	.	.			trans	-123.1	150	163.6	0	0	0	0	0	107.6	V15 Y19	V15-A17 HydrophobicContact CG1-CB 4.08Å; V15-A17 PolarHBondContact O-N 2.88Å; A17-Y19 PolarHBondContact O-N 3.08Å
18	I	48.9	Very low	60.9	Low	80 Å²	80	93.3 Å²	93.3	41%	0.41	52%	0.52	S	S	.	.			trans	-61.6	128.8	162	-77.4	166.8	0	0	0	106.2	Q22 V23 Y1056	I18-Q22 HydrophobicContact CG2-CB 3.73Å; I18-V23 HydrophobicContact CG2-CG2 4.23Å; I18-Y1056 HydrophobicContact CD1-CE1 4.08Å; I18-Y1056 WeakPolarHBondContact CD1-OH 3.47Å
19	Y	53.1	Low	62.1	Low	170 Å²	170	89.3 Å²	89.3	67%	0.667	50%	0.499	S	S	*	.			trans	-65.2	143.8	175.8	-71.7	-84.4	0	0	0	108.6	A17 D21 Q22	A17-Y19 PolarHBondContact O-N 3.08Å; Y19-D21 WeakPolarHBondContact CB-OD1 3.47Å; Y19-D21 PolarHBondContact O-N 3.31Å; Y19-Q22 PolarHBondContact O-N 2.99Å
20	E	50.8	Low	63.5	Low	183 Å²	183	88.7 Å²	88.7	86%	0.855	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-22.1	-179.8	-174.9	176.3	-172.9	0	0	112.6
21	D	53.1	Low	64.8	Low	119 Å²	119	91 Å²	91	64%	0.636	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-16.8	176.1	63.7	-12.9	0	0	0	114.7	Y19	Y19-D21 WeakPolarHBondContact CB-OD1 3.47Å; Y19-D21 PolarHBondContact O-N 3.31Å
22	Q	58.1	Low	66.5	Low	52 Å²	52	86.3 Å²	86.3	24%	0.243	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-14.2	174.5	-72.3	-176	-29.4	0	0	113.2	I18 Y19 D25	I18-Q22 HydrophobicContact CG2-CB 3.73Å; Y19-Q22 PolarHBondContact O-N 2.99Å; Q22-D25 WeakPolarHBondContact O-CB 3.25Å; Q22-D25 PolarHBondContact O-N 2.87Å
23	V	59.3	Low	68.3	Low	42 Å²	42	82.8 Å²	82.8	26%	0.255	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	135.4	170.6	-179.5	0	0	0	0	107.9	I18 D25	I18-V23 HydrophobicContact CG2-CG2 4.23Å; V23-D25 VanDerWaalsContact C-N 3.27Å; V23-D25 PolarHBondContact O-N 3.01Å
24	D	61.9	Low	70.2	Confident	112 Å²	112	75.9 Å²	75.9	60%	0.599	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	-2.4	-170.3	-55.1	-41.2	0	0	0	115.7	D27	D24-D27 CarbonylContact C-O 3.27Å; D24-D27 WeakPolarHBondContact CA-O 3.41Å; D24-D27 PolarHBondContact N-OD1 3.44Å
25	D	68	Low	72.3	Confident	112 Å²	112	73.7 Å²	73.7	60%	0.599	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-41.9	172.1	-81.2	-14.8	0	0	0	112.2	Q22 V23	Q22-D25 WeakPolarHBondContact O-CB 3.25Å; Q22-D25 PolarHBondContact O-N 2.87Å; V23-D25 VanDerWaalsContact C-N 3.27Å; V23-D25 PolarHBondContact O-N 3.01Å
26	L	77.3	Confident	74.6	Confident	68 Å²	68	69.7 Å²	69.7	36%	0.356	35%	0.353	S	S	.	.	S	Bend	trans	-106.7	-17.5	-178.3	-61.9	179.1	0	0	0	113.5
27	D	86.3	Confident	76.8	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.032	33%	0.326	C	S	.	.			trans	-126.3	163	-179.3	64.4	-20.3	0	0	0	111.3	D24 F1087 F1088	D24-D27 CarbonylContact C-O 3.27Å; D24-D27 WeakPolarHBondContact CA-O 3.41Å; D24-D27 PolarHBondContact N-OD1 3.44Å; D27-F1087 HydrophobicContact CB-CE2 4.32Å; D27-F1087 HydrophobicContact CB-CZ 4.2Å; D27-F1088 WeakPolarHBondContact CA-O 3.25Å; D27-F1088 WeakPolarHBondContact CB-O 3.16Å
28	W	92.1	Very high	78.9	Confident	17 Å²	17	65.1 Å²	65.1	6%	0.064	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	153.5	171	53.2	-97.8	0	0	0	111	Q30 L607 L619 S621 E622 G624 F1080 L1086 F1087 F1088	W28-Q30 HydrophobicContact CE3-CG 3.97Å; W28-Q30 HydrophobicContact CZ3-CG 4.07Å; W28-L607 HydrophobicContact CH2-CD1 4.44Å; W28-L607 HydrophobicContact CZ2-CD1 4.04Å; W28-L619 HydrophobicContact CH2-CD1 4.46Å; W28-S621 PolarHBondContact NE1-O 2.96Å; W28-E622 VanDerWaalsContact CD1-O 3.27Å; W28-G624 VanDerWaalsContact CE2-N 3.26Å; W28-G624 VanDerWaalsContact NE1-N 3.18Å; W28-F1080 HydrophobicContact CH2-CD2 4.09Å; W28-F1080 AromaticContact CH2-CE2 3.49Å; W28-F1080 HydrophobicContact CH2-CE2 3.49Å; W28-F1080 VanDerWaalsContact CH2-CE2 3.49Å; W28-F1080 HydrophobicContact CH2-CZ 4.43Å; W28-F1080 HydrophobicContact CZ2-CD2 4.39Å; W28-F1080 HydrophobicContact CZ2-CE2 4.2Å; W28-F1080 HydrophobicContact CZ3-CE2 4.2Å; W28-L1086 HydrophobicContact CH2-CB 4.45Å; W28-L1086 HydrophobicContact CZ3-CB 3.82Å; W28-F1087 WeakPolarHBondContact O-CA 3.49Å; W28-F1087 WeakPolarHBondContact O-CD2 3.41Å; W28-F1088 AromaticContact CD1-CD1 3.99Å; W28-F1088 HydrophobicContact CD2-CB 3.72Å; W28-F1088 AromaticContact CE2-CG 3.79Å; W28-F1088 HydrophobicContact CE3-CB 4.31Å; W28-F1088 HydrophobicContact CG-CB 4.21Å; W28-F1088 HydrophobicContact CH2-CB 4.06Å; W28-F1088 HydrophobicContact CZ2-CB 3.37Å; W28-F1088 HydrophobicContact CZ2-CD2 4.35Å; W28-F1088 AromaticContact CZ2-CG 3.95Å; W28-F1088 HydrophobicContact CZ2-CG 3.95Å; W28-F1088 HydrophobicContact CZ3-CB 4.46Å; W28-F1088 PolarHBondContact N-O 2.8Å; W28-F1088 VanDerWaalsContact N-O 3.08Å; W28-F1088 VanDerWaalsContact NE1-CB 3.34Å; W28-F1088 AromaticContact NE1-CD1 3.48Å; W28-F1088 AromaticContact NE1-CG 3.53Å; W28-F1088 PolarHBondContact O-N 2.95Å
29	N	92.1	Very high	81	Confident	34 Å²	34	63.1 Å²	63.1	18%	0.182	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.8	-178.7	-177.3	-6.8	0	0	0	110.7	Q1058 I1060 L1086 F1087	N29-Q1058 VanDerWaalsContact CB-OE1 3.22Å; N29-Q1058 PolarHBondContact ND2-OE1 3.35Å; N29-I1060 VanDerWaalsContact ND2-CD1 3.29Å; N29-I1060 WeakPolarHBondContact ND2-CD1 3.43Å; N29-L1086 WeakPolarHBondContact CA-O 3.42Å; N29-L1086 PolarHBondContact OD1-O 3.04Å; N29-F1087 HydrophobicContact CB-CD2 4.14Å
30	Q	93.4	Very high	82.9	Confident	45 Å²	45	57.8 Å²	57.8	21%	0.21	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.6	174.8	-62.6	-177.4	20.9	0	0	111.4	W28 F32 G624 D1085 L1086	W28-Q30 HydrophobicContact CE3-CG 3.97Å; W28-Q30 HydrophobicContact CZ3-CG 4.07Å; Q30-F32 HydrophobicContact CB-CE2 3.6Å; Q30-F32 HydrophobicContact CB-CZ 3.94Å; Q30-G624 PolarHBondContact NE2-O 2.92Å; Q30-D1085 WeakPolarHBondContact O-CA 3.5Å; Q30-L1086 HydrophobicContact CB-CB 4.28Å; Q30-L1086 PolarHBondContact N-O 2.96Å; Q30-L1086 PolarHBondContact O-N 3.32Å
31	K	95.1	Very high	84.9	Confident	113 Å²	113	51 Å²	51	49%	0.491	26%	0.255	S	S	.	.			trans	-110.2	127.5	-173.9	-66.3	176.1	-175.4	169.6	0	111.5	I70 R430 D1085	K31-I70 HydrophobicContact CB-CD1 4.17Å; K31-I70 WeakPolarHBondContact O-CD1 3.24Å; K31-R430 PolarHBondContact O-NH2 3.42Å; K31-D1085 WeakPolarHBondContact CA-OD1 3.43Å
32	F	96.2	Very high	86.5	Confident	14 Å²	14	46.8 Å²	46.8	6%	0.061	23%	0.231	C	C	.	.			trans	-122.7	166.6	-179	-59.5	-82.6	0	0	0	112.4	Q30 R73 E432 L434 A435 L1084 D1085 L1086	Q30-F32 HydrophobicContact CB-CE2 3.6Å; Q30-F32 HydrophobicContact CB-CZ 3.94Å; F32-R73 WeakPolarHBondContact O-CD 3.43Å; F32-R73 PolarHBondContact O-NH1 3.49Å; F32-E432 WeakPolarHBondContact CB-OE2 3.34Å; F32-L434 HydrophobicContact CD1-CB 4.39Å; F32-L434 HydrophobicContact CD2-CB 4.34Å; F32-L434 HydrophobicContact CE1-CB 3.97Å; F32-L434 HydrophobicContact CE1-CD1 4.05Å; F32-L434 HydrophobicContact CE2-CB 3.93Å; F32-L434 HydrophobicContact CE2-CD1 4.47Å; F32-L434 HydrophobicContact CZ-CB 3.73Å; F32-L434 HydrophobicContact CZ-CD1 3.65Å; F32-L434 HydrophobicContact CZ-CG 4.35Å; F32-A435 HydrophobicContact CB-CB 3.87Å; F32-L1084 WeakPolarHBondContact CB-O 3.41Å; F32-D1085 PolarHBondContact N-OD1 2.86Å; F32-L1086 HydrophobicContact CD2-CG 4.46Å; F32-L1086 HydrophobicContact CE2-CD1 3.82Å; F32-L1086 HydrophobicContact CE2-CG 3.85Å; F32-L1086 HydrophobicContact CZ-CD1 4.39Å
33	V	95.4	Very high	87.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.			trans	-108.8	-33.3	176.1	174.4	0	0	0	0	109.6	V53 S55 V59 I70 E432	V33-V53 HydrophobicContact CG1-CG2 3.98Å; V33-S55 WeakPolarHBondContact O-CB 3.47Å; V33-S55 PolarHBondContact O-OG 2.99Å; V33-S55 VanDerWaalsContact O-OG 3.12Å; V33-V59 HydrophobicContact CB-CG1 4.42Å; V33-V59 HydrophobicContact CG1-CB 4.15Å; V33-V59 HydrophobicContact CG1-CG1 4.05Å; V33-V59 HydrophobicContact CG2-CG1 4.43Å; V33-I70 HydrophobicContact CG2-CD1 4.05Å; V33-E432 PolarHBondContact N-OE2 2.84Å
34	G	94.8	Very high	88.6	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.01	25%	0.248	C	C	.	.			trans	91.5	-177.6	-173.1	0	0	0	0	0	112.2	V36 E432	G34-V36 PolarHBondContact O-N 2.98Å; G34-V36 VanDerWaalsContact O-N 3.14Å; G34-E432 PolarHBondContact N-OE2 2.78Å
35	K	95.7	Very high	89.2	Confident	44 Å²	44	48.8 Å²	48.8	19%	0.191	26%	0.255	C	S	.	.	S	Bend	trans	-50.5	121.2	-177.9	-173.8	173.8	-169.8	153	0	110.9	K37 S55 E56 E390 D415	K35-K37 PolarHBondContact O-N 2.89Å; K35-S55 CarbonylContact O-C 3.6Å; K35-S55 WeakPolarHBondContact O-CA 3.37Å; K35-S55 VanDerWaalsContact O-CB 3.32Å; K35-S55 WeakPolarHBondContact O-CB 3.46Å; K35-E56 HydrophobicContact CB-CG 4.34Å; K35-E56 HydrophobicContact CD-CG 4.49Å; K35-E56 HydrophobicContact CG-CG 4.42Å; K35-E56 PolarHBondContact O-N 3.14Å; K35-E390 WeakPolarHBondContact CE-OE2 3.35Å; K35-E390 IonicContact NZ-OE1 3.74Å; K35-E390 PolarHBondContact NZ-OE1 2.86Å; K35-E390 VanDerWaalsContact NZ-OE1 3.16Å; K35-E390 IonicContact NZ-OE2 3.89Å; K35-E390 PolarHBondContact NZ-OE2 2.67Å; K35-D415 HydrophobicContact CB-CB 4.26Å; K35-D415 WeakPolarHBondContact CD-OD1 3.38Å; K35-D415 VanDerWaalsContact CE-OD1 3.25Å; K35-D415 WeakPolarHBondContact CE-OD1 3.31Å; K35-D415 HydrophobicContact CG-CB 4.3Å; K35-D415 WeakPolarHBondContact CG-OD1 3.46Å; K35-D415 IonicContact NZ-OD1 3.62Å; K35-D415 PolarHBondContact NZ-OD1 3.33Å
36	V	96.3	Very high	89.4	Confident	24 Å²	24	45.3 Å²	45.3	15%	0.145	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	118.3	-178.5	177.7	0	0	0	0	109.4	G34 Y38 V53 Y411 V417	G34-V36 PolarHBondContact O-N 2.98Å; G34-V36 VanDerWaalsContact O-N 3.14Å; V36-Y38 WeakPolarHBondContact CG1-O 3.47Å; V36-V53 HydrophobicContact CG1-CB 4.09Å; V36-V53 HydrophobicContact CG1-CG1 4.01Å; V36-V53 HydrophobicContact CG2-CB 4.28Å; V36-V53 HydrophobicContact CG2-CG1 4.27Å; V36-Y411 HydrophobicContact CB-CD1 4.2Å; V36-Y411 HydrophobicContact CB-CE1 3.95Å; V36-Y411 HydrophobicContact CG1-CD1 4.44Å; V36-Y411 HydrophobicContact CG1-CE1 3.78Å; V36-Y411 HydrophobicContact CG2-CE1 4.38Å; V36-V417 HydrophobicContact CG2-CG2 3.79Å
37	K	93.8	Very high	89.4	Confident	72 Å²	72	47.4 Å²	47.4	31%	0.313	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-42.7	175.9	-171.7	176	178.9	-175	0	111.5	K35 G54 E56 E81 L82	K35-K37 PolarHBondContact O-N 2.89Å; K37-G54 WeakPolarHBondContact CA-O 3.3Å; K37-G54 PolarHBondContact N-O 3.42Å; K37-E56 HydrophobicContact CB-CG 3.89Å; K37-E56 HydrophobicContact CD-CG 4.26Å; K37-E56 HydrophobicContact CG-CG 4.33Å; K37-E81 IonicContact NZ-OE1 2.86Å; K37-E81 PolarHBondContact NZ-OE1 3.34Å; K37-L82 PolarHBondContact NZ-O 2.84Å
38	Y	95.2	Very high	89.1	Confident	60 Å²	60	48 Å²	48	24%	0.235	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145.6	-179.9	-57.8	-79.8	0	0	0	111.1	V36 V53 G54 L82 T83 F85	V36-Y38 WeakPolarHBondContact CG1-O 3.47Å; Y38-V53 CarbonylContact O-C 3.57Å; Y38-V53 WeakPolarHBondContact O-CA 3.22Å; Y38-G54 PolarHBondContact N-O 3.05Å; Y38-G54 PolarHBondContact O-N 3.09Å; Y38-L82 HydrophobicContact CD2-CB 4.3Å; Y38-L82 HydrophobicContact CE2-CB 3.95Å; Y38-L82 WeakPolarHBondContact CE2-O 3.47Å; Y38-L82 PolarHBondContact OH-O 2.88Å; Y38-T83 PolarHBondContact OH-O 3.3Å; Y38-F85 VanDerWaalsContact CB-CD1 3.49Å; Y38-F85 HydrophobicContact CD1-CB 3.9Å; Y38-F85 HydrophobicContact CD2-CB 3.77Å; Y38-F85 HydrophobicContact CD2-CG 4.43Å; Y38-F85 HydrophobicContact CE2-CB 4.46Å; Y38-F85 HydrophobicContact CG-CB 3.46Å; Y38-F85 VanDerWaalsContact CG-CB 3.46Å; Y38-F85 HydrophobicContact CG-CD1 4.38Å; Y38-F85 HydrophobicContact CG-CG 4.11Å
39	S	93.8	Very high	88.6	Confident	38 Å²	38	52.6 Å²	52.6	27%	0.266	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	139.7	174.4	75.8	0	0	0	0	112	F52 Y411	S39-F52 CarbonylContact C-O 3.57Å; S39-F52 WeakPolarHBondContact CA-O 3.36Å; S39-Y411 WeakPolarHBondContact CB-OH 3.35Å; S39-Y411 PolarHBondContact OG-OH 3.37Å
40	K	93.2	Very high	88.3	Confident	58 Å²	58	52.7 Å²	52.7	25%	0.252	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.4	179.7	-64.6	-70.5	179.3	160	0	110	F52 F85 E86 L87	K40-F52 PolarHBondContact N-O 3.31Å; K40-F52 PolarHBondContact O-N 2.93Å; K40-F85 HydrophobicContact CB-CE1 4.31Å; K40-F85 WeakPolarHBondContact CE-O 3.35Å; K40-F85 HydrophobicContact CG-CD1 3.83Å; K40-F85 HydrophobicContact CG-CE1 3.94Å; K40-E86 WeakPolarHBondContact CE-OE2 3.48Å; K40-E86 IonicContact NZ-OE1 3.78Å; K40-E86 PolarHBondContact NZ-OE1 3.45Å; K40-E86 IonicContact NZ-OE2 3.97Å; K40-E86 PolarHBondContact NZ-OE2 3.01Å; K40-L87 HydrophobicContact CB-CB 4.02Å; K40-L87 HydrophobicContact CB-CD2 4.42Å; K40-L87 HydrophobicContact CG-CB 4.2Å
41	L	90.9	Very high	88.4	Confident	40 Å²	40	50.6 Å²	50.6	21%	0.209	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.7	179.3	-74.2	159.5	0	0	0	110	F43 Y51 L65 I395 L409	L41-F43 HydrophobicContact CB-CE2 3.85Å; L41-F43 HydrophobicContact CB-CZ 4.35Å; L41-Y51 HydrophobicContact CD2-CD2 3.61Å; L41-Y51 HydrophobicContact CD2-CG 4.07Å; L41-Y51 HydrophobicContact CG-CD2 4.09Å; L41-L65 HydrophobicContact CD2-CD1 4.31Å; L41-L65 HydrophobicContact CD2-CD2 4.18Å; L41-I395 HydrophobicContact CD1-CD1 4.04Å; L41-I395 HydrophobicContact CD1-CG1 3.66Å; L41-I395 HydrophobicContact CD2-CD1 3.87Å; L41-I395 HydrophobicContact CD2-CG1 4.37Å; L41-L409 HydrophobicContact CD1-CD1 4.31Å; L41-L409 HydrophobicContact CD2-CD1 4.39Å
42	K	88.2	Confident	88.5	Confident	31 Å²	31	45.2 Å²	45.2	14%	0.135	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128	173.6	-170.8	176.8	170.4	75.2	0	110.1	K49 N50 F52 L87 G89 N90 I108	K42-K49 PolarHBondContact O-N 3.45Å; K42-N50 HydrophobicContact CB-CB 4.24Å; K42-N50 PolarHBondContact N-O 2.84Å; K42-N50 PolarHBondContact O-N 2.94Å; K42-F52 HydrophobicContact CB-CE2 4.11Å; K42-L87 HydrophobicContact CB-CD2 3.85Å; K42-L87 HydrophobicContact CG-CD2 4.34Å; K42-G89 VanDerWaalsContact NZ-C 3.35Å; K42-G89 PolarHBondContact NZ-O 2.77Å; K42-N90 VanDerWaalsContact CE-OD1 3.27Å; K42-N90 WeakPolarHBondContact CE-OD1 3.37Å; K42-N90 PolarHBondContact NZ-OD1 3.5Å; K42-I108 HydrophobicContact CD-CD1 3.68Å
43	F	83.4	Confident	88.5	Confident	82 Å²	82	44.5 Å²	44.5	36%	0.36	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	151.2	174.2	-63.3	-95.1	0	0	0	110.7	L41 I47 P48 I395	L41-F43 HydrophobicContact CB-CE2 3.85Å; L41-F43 HydrophobicContact CB-CZ 4.35Å; F43-I47 WeakPolarHBondContact CA-O 3.31Å; F43-P48 HydrophobicContact CD1-CB 4.02Å; F43-P48 HydrophobicContact CE1-CB 3.85Å; F43-I395 HydrophobicContact CE1-CG2 3.91Å; F43-I395 HydrophobicContact CZ-CG2 4.11Å
44	D	77.4	Confident	88.5	Confident	93 Å²	93	44.5 Å²	44.5	50%	0.497	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	97.7	171.4	-161.4	-6	0	0	0	106.7	T46 I47 K49	D44-T46 PolarHBondContact O-N 2.9Å; D44-I47 PolarHBondContact N-O 2.83Å; D44-I47 PolarHBondContact O-N 2.98Å; D44-I47 VanDerWaalsContact O-N 3.08Å; D44-K49 HydrophobicContact CB-CB 4.44Å; D44-K49 HydrophobicContact CB-CD 4.09Å; D44-K49 IonicContact OD2-NZ 2.82Å; D44-K49 PolarHBondContact OD2-NZ 2.89Å
45	G	75.2	Confident	88.6	Confident	73 Å²	73	44.5 Å²	44.5	75%	0.753	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	-121.3	-161.6	0	0	0	0	0	111.1
46	T	71.4	Confident	88.6	Confident	38 Å²	38	47.3 Å²	47.3	23%	0.233	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	0.8	177.5	59.3	0	0	0	0	113.6	D44 L339 N340 F397 T398	D44-T46 PolarHBondContact O-N 2.9Å; T46-L339 HydrophobicContact CG2-CD1 4.11Å; T46-N340 WeakPolarHBondContact CG2-OD1 3.1Å; T46-F397 WeakPolarHBondContact O-CA 3.41Å; T46-F397 WeakPolarHBondContact O-CB 3.42Å; T46-T398 HydrophobicContact CG2-CG2 4.48Å; T46-T398 PolarHBondContact OG1-OG1 3.27Å
47	I	78.3	Confident	88.5	Confident	112 Å²	112	47.9 Å²	47.9	57%	0.574	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	124	-172.9	-57.5	173.4	0	0	0	109.4	F43 D44 K49	F43-I47 WeakPolarHBondContact CA-O 3.31Å; D44-I47 PolarHBondContact N-O 2.83Å; D44-I47 PolarHBondContact O-N 2.98Å; D44-I47 VanDerWaalsContact O-N 3.08Å; I47-K49 PolarHBondContact O-N 3.24Å
48	P	79.8	Confident	88.6	Confident	19 Å²	19	44.4 Å²	44.4	12%	0.123	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.9	174.8	30.6	-35.6	0	0	0	109.8	F43 L65 I395	F43-P48 HydrophobicContact CD1-CB 4.02Å; F43-P48 HydrophobicContact CE1-CB 3.85Å; P48-L65 HydrophobicContact CB-CD1 3.79Å; P48-L65 HydrophobicContact CG-CD1 4.45Å; P48-I395 HydrophobicContact CB-CG2 3.52Å; P48-I395 HydrophobicContact CG-CG2 3.67Å
49	K	80.3	Confident	88.7	Confident	113 Å²	113	41.6 Å²	41.6	49%	0.491	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-57.1	-173.2	-164.7	174.8	-166	156.4	0	112	K42 D44 I47	K42-K49 PolarHBondContact O-N 3.45Å; D44-K49 HydrophobicContact CB-CB 4.44Å; D44-K49 HydrophobicContact CB-CD 4.09Å; D44-K49 IonicContact OD2-NZ 2.82Å; D44-K49 PolarHBondContact OD2-NZ 2.89Å; I47-K49 PolarHBondContact O-N 3.24Å
50	N	87.7	Confident	88.9	Confident	37 Å²	37	39.8 Å²	39.8	20%	0.198	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	144.9	-172	-60.2	-21	0	0	0	111.2	K42 F52	K42-N50 HydrophobicContact CB-CB 4.24Å; K42-N50 PolarHBondContact N-O 2.84Å; K42-N50 PolarHBondContact O-N 2.94Å; N50-F52 HydrophobicContact CB-CD2 4.41Å; N50-F52 HydrophobicContact CB-CE1 4.23Å; N50-F52 HydrophobicContact CB-CE2 3.53Å; N50-F52 HydrophobicContact CB-CZ 3.4Å
51	Y	94.2	Very high	89.1	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	117.1	175.1	171.8	-131.1	0	0	0	109.1	L41 V53 S62 I63 L65 L409 Y411 W428	L41-Y51 HydrophobicContact CD2-CD2 3.61Å; L41-Y51 HydrophobicContact CD2-CG 4.07Å; L41-Y51 HydrophobicContact CG-CD2 4.09Å; Y51-V53 HydrophobicContact CD1-CG1 4.32Å; Y51-V53 HydrophobicContact CD2-CG1 4.42Å; Y51-V53 HydrophobicContact CE1-CG1 3.59Å; Y51-V53 HydrophobicContact CE2-CG1 3.76Å; Y51-V53 VanDerWaalsContact OH-CG1 3.31Å; Y51-V53 WeakPolarHBondContact OH-CG1 3.42Å; Y51-S62 CarbonylContact O-C 3.5Å; Y51-S62 WeakPolarHBondContact O-CA 3.37Å; Y51-I63 HydrophobicContact CD1-CB 3.67Å; Y51-I63 HydrophobicContact CD1-CD1 4.32Å; Y51-I63 HydrophobicContact CD1-CG2 3.91Å; Y51-I63 HydrophobicContact CE1-CB 4.23Å; Y51-I63 HydrophobicContact CE1-CD1 4Å; Y51-I63 HydrophobicContact CE1-CG2 4.37Å; Y51-I63 PolarHBondContact O-N 3.5Å; Y51-L65 HydrophobicContact CD1-CD2 4.39Å; Y51-L65 HydrophobicContact CG-CD2 4.12Å; Y51-L409 HydrophobicContact CD2-CD1 3.88Å; Y51-L409 HydrophobicContact CE1-CD1 4.35Å; Y51-L409 HydrophobicContact CE1-CD2 4.28Å; Y51-L409 HydrophobicContact CE2-CD1 3.44Å; Y51-L409 VanDerWaalsContact CE2-CD1 3.44Å; Y51-L409 HydrophobicContact CG-CD1 4.47Å; Y51-Y411 WeakPolarHBondContact OH-CE1 3.41Å; Y51-Y411 PolarHBondContact OH-OH 3.38Å; Y51-W428 HydrophobicContact CE1-CH2 4.23Å
52	F	96.6	Very high	89.3	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.2	-178.7	-56.2	-74.8	0	0	0	110.1	S39 K40 K42 N50 S61 W72 F85 L87 L92 I108	S39-F52 CarbonylContact C-O 3.57Å; S39-F52 WeakPolarHBondContact CA-O 3.36Å; K40-F52 PolarHBondContact N-O 3.31Å; K40-F52 PolarHBondContact O-N 2.93Å; K42-F52 HydrophobicContact CB-CE2 4.11Å; N50-F52 HydrophobicContact CB-CD2 4.41Å; N50-F52 HydrophobicContact CB-CE1 4.23Å; N50-F52 HydrophobicContact CB-CE2 3.53Å; N50-F52 HydrophobicContact CB-CZ 3.4Å; F52-S61 CarbonylContact C-O 3.52Å; F52-S61 WeakPolarHBondContact CA-O 3.05Å; F52-W72 HydrophobicContact CD1-CH2 4.3Å; F52-W72 AromaticContact CD1-CZ2 3.78Å; F52-W72 HydrophobicContact CD1-CZ2 3.78Å; F52-W72 AromaticContact CE1-CZ2 3.68Å; F52-W72 HydrophobicContact CE1-CZ2 3.68Å; F52-F85 HydrophobicContact CB-CE1 4.23Å; F52-F85 HydrophobicContact CB-CZ 4.09Å; F52-L87 HydrophobicContact CD2-CD1 4.14Å; F52-L87 HydrophobicContact CD2-CD2 4.35Å; F52-L87 HydrophobicContact CE2-CD1 4.02Å; F52-L87 HydrophobicContact CE2-CD2 4.4Å; F52-L92 HydrophobicContact CB-CD1 4.42Å; F52-L92 HydrophobicContact CB-CD2 4.33Å; F52-L92 HydrophobicContact CD1-CD2 4.33Å; F52-L92 HydrophobicContact CG-CD2 4.42Å; F52-I108 HydrophobicContact CE1-CB 4.1Å; F52-I108 HydrophobicContact CE1-CG2 4.43Å; F52-I108 HydrophobicContact CE2-CB 4.48Å; F52-I108 HydrophobicContact CE2-CG2 4.36Å; F52-I108 HydrophobicContact CZ-CB 3.66Å; F52-I108 HydrophobicContact CZ-CG2 3.95Å
53	V	96.3	Very high	89.7	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145	-180	-64.9	0	0	0	0	110.9	V33 V36 Y38 Y51 I60 S61 I63	V33-V53 HydrophobicContact CG1-CG2 3.98Å; V36-V53 HydrophobicContact CG1-CB 4.09Å; V36-V53 HydrophobicContact CG1-CG1 4.01Å; V36-V53 HydrophobicContact CG2-CB 4.28Å; V36-V53 HydrophobicContact CG2-CG1 4.27Å; Y38-V53 CarbonylContact O-C 3.57Å; Y38-V53 WeakPolarHBondContact O-CA 3.22Å; Y51-V53 HydrophobicContact CD1-CG1 4.32Å; Y51-V53 HydrophobicContact CD2-CG1 4.42Å; Y51-V53 HydrophobicContact CE1-CG1 3.59Å; Y51-V53 HydrophobicContact CE2-CG1 3.76Å; Y51-V53 VanDerWaalsContact OH-CG1 3.31Å; Y51-V53 WeakPolarHBondContact OH-CG1 3.42Å; V53-I60 WeakPolarHBondContact O-CA 3.35Å; V53-S61 PolarHBondContact N-O 2.93Å; V53-S61 PolarHBondContact O-N 2.97Å; V53-I63 HydrophobicContact CB-CD1 4.45Å; V53-I63 HydrophobicContact CG1-CD1 4.04Å; V53-I63 HydrophobicContact CG2-CD1 3.53Å; V53-I63 HydrophobicContact CG2-CG1 4.09Å
54	G	97	Very high	90.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.7	167.2	0	0	0	0	0	109.2	K37 Y38 V59	K37-G54 WeakPolarHBondContact CA-O 3.3Å; K37-G54 PolarHBondContact N-O 3.42Å; Y38-G54 PolarHBondContact N-O 3.05Å; Y38-G54 PolarHBondContact O-N 3.09Å; G54-V59 CarbonylContact C-O 3.58Å; G54-V59 WeakPolarHBondContact CA-O 3.32Å
55	S	96.6	Very high	90.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	162.5	-177.9	74.3	0	0	0	0	113.5	V33 K35 L57 N58 V59	V33-S55 WeakPolarHBondContact O-CB 3.47Å; V33-S55 PolarHBondContact O-OG 2.99Å; V33-S55 VanDerWaalsContact O-OG 3.12Å; K35-S55 CarbonylContact O-C 3.6Å; K35-S55 WeakPolarHBondContact O-CA 3.37Å; K35-S55 VanDerWaalsContact O-CB 3.32Å; K35-S55 WeakPolarHBondContact O-CB 3.46Å; S55-L57 PolarHBondContact O-N 3.03Å; S55-L57 PolarHBondContact OG-N 3.34Å; S55-L57 VanDerWaalsContact OG-N 3.16Å; S55-N58 PolarHBondContact O-N 3.49Å; S55-N58 VanDerWaalsContact O-N 3.16Å; S55-N58 PolarHBondContact OG-N 3.29Å; S55-V59 PolarHBondContact N-O 3.02Å; S55-V59 VanDerWaalsContact OG-CB 3.3Å; S55-V59 WeakPolarHBondContact OG-CB 3.48Å; S55-V59 PolarHBondContact OG-N 3.4Å; S55-V59 PolarHBondContact OG-O 3.5Å
56	E	94.7	Very high	91.4	Very high	103 Å²	103	33.1 Å²	33.1	48%	0.481	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-30.2	165.8	-64.4	-170.3	167.4	0	0	112.4	K35 K37 N58	K35-E56 HydrophobicContact CB-CG 4.34Å; K35-E56 HydrophobicContact CD-CG 4.49Å; K35-E56 HydrophobicContact CG-CG 4.42Å; K35-E56 PolarHBondContact O-N 3.14Å; K37-E56 HydrophobicContact CB-CG 3.89Å; K37-E56 HydrophobicContact CD-CG 4.26Å; K37-E56 HydrophobicContact CG-CG 4.33Å; E56-N58 PolarHBondContact O-N 3.42Å
57	L	94.6	Very high	92.3	Very high	36 Å²	36	35.4 Å²	35.4	19%	0.188	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	17.2	174.7	-62.2	-179.1	0	0	0	113.9	S55 V59 A435 R1062 L1084	S55-L57 PolarHBondContact O-N 3.03Å; S55-L57 PolarHBondContact OG-N 3.34Å; S55-L57 VanDerWaalsContact OG-N 3.16Å; L57-V59 HydrophobicContact CB-CG2 4.38Å; L57-V59 PolarHBondContact O-N 2.92Å; L57-A435 HydrophobicContact CD1-CB 3.99Å; L57-R1062 VanDerWaalsContact O-CZ 3.25Å; L57-R1062 PolarHBondContact O-NH1 2.02Å; L57-R1062 PolarHBondContact O-NH2 3.5Å; L57-R1062 VanDerWaalsContact O-NH2 3.15Å; L57-L1084 HydrophobicContact CD1-CD1 4.05Å
58	N	96.1	Very high	92.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	60.5	41.8	178.6	-154	25.7	0	0	0	113.8	S55 E56 L76 D77 G80 L82 S96	S55-N58 PolarHBondContact O-N 3.49Å; S55-N58 VanDerWaalsContact O-N 3.16Å; S55-N58 PolarHBondContact OG-N 3.29Å; E56-N58 PolarHBondContact O-N 3.42Å; N58-L76 HydrophobicContact CB-CB 4.48Å; N58-L76 WeakPolarHBondContact ND2-CB 3.39Å; N58-L76 VanDerWaalsContact O-CB 3.25Å; N58-L76 WeakPolarHBondContact O-CB 3.24Å; N58-L76 WeakPolarHBondContact O-CG 3.19Å; N58-L76 PolarHBondContact O-N 2.96Å; N58-D77 PolarHBondContact ND2-O 2.9Å; N58-G80 WeakPolarHBondContact CB-O 3.49Å; N58-L82 WeakPolarHBondContact OD1-CG 3.35Å; N58-S96 PolarHBondContact ND2-OG 2.91Å; N58-S96 VanDerWaalsContact ND2-OG 3.1Å; N58-S96 PolarHBondContact OD1-OG 2.82Å
59	V	97.2	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.7	178.4	-176.7	0	0	0	0	109	V33 G54 S55 L57 R73 Q74 V75 L1084	V33-V59 HydrophobicContact CB-CG1 4.42Å; V33-V59 HydrophobicContact CG1-CB 4.15Å; V33-V59 HydrophobicContact CG1-CG1 4.05Å; V33-V59 HydrophobicContact CG2-CG1 4.43Å; G54-V59 CarbonylContact C-O 3.58Å; G54-V59 WeakPolarHBondContact CA-O 3.32Å; S55-V59 PolarHBondContact N-O 3.02Å; S55-V59 VanDerWaalsContact OG-CB 3.3Å; S55-V59 WeakPolarHBondContact OG-CB 3.48Å; S55-V59 PolarHBondContact OG-N 3.4Å; S55-V59 PolarHBondContact OG-O 3.5Å; L57-V59 HydrophobicContact CB-CG2 4.38Å; L57-V59 PolarHBondContact O-N 2.92Å; V59-R73 HydrophobicContact CG1-CG 3.49Å; V59-R73 VanDerWaalsContact CG1-CG 3.49Å; V59-Q74 WeakPolarHBondContact CA-O 3.42Å; V59-V75 HydrophobicContact CG1-CG2 4.12Å; V59-V75 HydrophobicContact CG2-CG1 4.28Å; V59-V75 HydrophobicContact CG2-CG2 4.21Å; V59-L1084 HydrophobicContact CG2-CD1 4.32Å; V59-L1084 HydrophobicContact CG2-CD2 3.75Å
60	I	97.8	Very high	94.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	136.6	175.2	-59.3	171.1	0	0	0	108.5	V53 W72 R73 Q74 L76 L82 F85 L92 S94 W106	V53-I60 WeakPolarHBondContact O-CA 3.35Å; I60-W72 HydrophobicContact CG2-CH2 3.95Å; I60-W72 HydrophobicContact CG2-CZ3 3.88Å; I60-R73 CarbonylContact O-C 3.59Å; I60-R73 WeakPolarHBondContact O-CA 3.4Å; I60-Q74 PolarHBondContact N-O 2.79Å; I60-Q74 PolarHBondContact O-N 3.41Å; I60-L76 HydrophobicContact CD1-CD1 3.88Å; I60-L76 HydrophobicContact CG1-CD1 4.31Å; I60-L82 HydrophobicContact CD1-CD2 4.16Å; I60-L82 HydrophobicContact CG1-CD1 3.92Å; I60-L82 HydrophobicContact CG1-CD2 4.27Å; I60-F85 HydrophobicContact CD1-CE2 4.43Å; I60-F85 HydrophobicContact CG1-CE2 4.14Å; I60-F85 HydrophobicContact CG2-CE2 3.74Å; I60-F85 HydrophobicContact CG2-CZ 4.21Å; I60-L92 HydrophobicContact CG2-CD2 3.7Å; I60-S94 VanDerWaalsContact CD1-CB 3.41Å; I60-S94 WeakPolarHBondContact CD1-OG 3.46Å; I60-W106 HydrophobicContact CD1-CZ2 3.85Å
61	S	96.9	Very high	94.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	152.8	-179.6	-174.2	0	0	0	0	113.1	F52 V53 W72	F52-S61 CarbonylContact C-O 3.52Å; F52-S61 WeakPolarHBondContact CA-O 3.05Å; V53-S61 PolarHBondContact N-O 2.93Å; V53-S61 PolarHBondContact O-N 2.97Å; S61-W72 VanDerWaalsContact CA-O 3.31Å; S61-W72 WeakPolarHBondContact CA-O 3.22Å; S61-W72 WeakPolarHBondContact CB-O 3.32Å; S61-W72 PolarHBondContact OG-O 2.94Å
62	S	96.5	Very high	94.7	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.6	161.3	179.5	0	0	0	0	109.3	Y51 V71 W72	Y51-S62 CarbonylContact O-C 3.5Å; Y51-S62 WeakPolarHBondContact O-CA 3.37Å; S62-V71 WeakPolarHBondContact O-CB 3.42Å; S62-V71 PolarHBondContact O-N 3.47Å; S62-W72 PolarHBondContact N-O 2.84Å; S62-W72 PolarHBondContact O-N 2.95Å
63	I	95	Very high	94.6	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.6	-179.4	-64.5	173.8	0	0	0	108.9	Y51 V53 L65 S69	Y51-I63 HydrophobicContact CD1-CB 3.67Å; Y51-I63 HydrophobicContact CD1-CD1 4.32Å; Y51-I63 HydrophobicContact CD1-CG2 3.91Å; Y51-I63 HydrophobicContact CE1-CB 4.23Å; Y51-I63 HydrophobicContact CE1-CD1 4Å; Y51-I63 HydrophobicContact CE1-CG2 4.37Å; Y51-I63 PolarHBondContact O-N 3.5Å; V53-I63 HydrophobicContact CB-CD1 4.45Å; V53-I63 HydrophobicContact CG1-CD1 4.04Å; V53-I63 HydrophobicContact CG2-CD1 3.53Å; V53-I63 HydrophobicContact CG2-CG1 4.09Å; I63-L65 PolarHBondContact O-N 3.32Å; I63-S69 WeakPolarHBondContact CA-O 3.48Å
64	N	92.9	Very high	94.6	Very high	58 Å²	58	36.8 Å²	36.8	31%	0.31	19%	0.185	S	C	.	.			trans	-74.7	121.7	175.8	-177.3	-9.9	0	0	0	110.3	K66 D67 G68 S69 V71	N64-K66 PolarHBondContact O-N 3.27Å; N64-K66 VanDerWaalsContact OD1-CB 3.3Å; N64-K66 WeakPolarHBondContact OD1-CB 3.43Å; N64-K66 PolarHBondContact OD1-N 2.95Å; N64-D67 VanDerWaalsContact CB-OD1 3.28Å; N64-D67 WeakPolarHBondContact CB-OD1 3.46Å; N64-D67 VanDerWaalsContact CG-OD1 3.24Å; N64-D67 PolarHBondContact ND2-OD1 3.1Å; N64-G68 VanDerWaalsContact O-CA 3.25Å; N64-G68 WeakPolarHBondContact O-CA 3.4Å; N64-G68 PolarHBondContact O-N 3.34Å; N64-S69 PolarHBondContact N-O 3.48Å; N64-V71 HydrophobicContact CB-CG2 3.85Å
65	L	90.1	Very high	94.6	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.052	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.9	179.7	-75.3	171.6	0	0	0	113.8	L41 P48 Y51 I63 I395 L419 Q427 W428	L41-L65 HydrophobicContact CD2-CD1 4.31Å; L41-L65 HydrophobicContact CD2-CD2 4.18Å; P48-L65 HydrophobicContact CB-CD1 3.79Å; P48-L65 HydrophobicContact CG-CD1 4.45Å; Y51-L65 HydrophobicContact CD1-CD2 4.39Å; Y51-L65 HydrophobicContact CG-CD2 4.12Å; I63-L65 PolarHBondContact O-N 3.32Å; L65-I395 HydrophobicContact CD2-CD1 3.78Å; L65-L419 WeakPolarHBondContact O-CD2 3.33Å; L65-Q427 PolarHBondContact O-NE2 2.78Å; L65-Q427 VanDerWaalsContact O-NE2 3.12Å; L65-W428 PolarHBondContact O-NE1 2.79Å
66	K	90.1	Very high	94.5	Very high	163 Å²	163	39.6 Å²	39.6	71%	0.709	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-48.2	-177	-171.7	-179.9	176.8	-174.8	0	112.1	N64 Q427	N64-K66 PolarHBondContact O-N 3.27Å; N64-K66 VanDerWaalsContact OD1-CB 3.3Å; N64-K66 WeakPolarHBondContact OD1-CB 3.43Å; N64-K66 PolarHBondContact OD1-N 2.95Å; K66-Q427 PolarHBondContact O-NE2 2.85Å
67	D	90	Very high	94.3	Very high	85 Å²	85	37.5 Å²	37.5	46%	0.455	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127	-8	-170	62.2	-6.9	0	0	0	113.8	N64 S69 W428	N64-D67 VanDerWaalsContact CB-OD1 3.28Å; N64-D67 WeakPolarHBondContact CB-OD1 3.46Å; N64-D67 VanDerWaalsContact CG-OD1 3.24Å; N64-D67 PolarHBondContact ND2-OD1 3.1Å; D67-S69 VanDerWaalsContact C-N 3.31Å; D67-S69 PolarHBondContact OD1-N 2.98Å; D67-S69 PolarHBondContact OD1-OG 2.86Å; D67-S69 PolarHBondContact OD2-OG 2.83Å; D67-W428 VanDerWaalsContact C-CD1 3.47Å; D67-W428 WeakPolarHBondContact O-CB 3.41Å
68	G	91.1	Very high	94.1	Very high	3 Å²	3	38.9 Å²	38.9	3%	0.031	20%	0.199	C	C	.	.			trans	77.1	13.3	-177	0	0	0	0	0	113.6	N64 R430	N64-G68 VanDerWaalsContact O-CA 3.25Å; N64-G68 WeakPolarHBondContact O-CA 3.4Å; N64-G68 PolarHBondContact O-N 3.34Å; G68-R430 VanDerWaalsContact O-CD 3.23Å; G68-R430 WeakPolarHBondContact O-CD 3.4Å; G68-R430 PolarHBondContact O-NH1 3.22Å
69	S	93.8	Very high	93.7	Very high	45 Å²	45	45.7 Å²	45.7	32%	0.315	24%	0.236	S	C	.	.			trans	-75.7	152.3	177	59.9	0	0	0	0	112	I63 N64 D67 V71	I63-S69 WeakPolarHBondContact CA-O 3.48Å; N64-S69 PolarHBondContact N-O 3.48Å; D67-S69 VanDerWaalsContact C-N 3.31Å; D67-S69 PolarHBondContact OD1-N 2.98Å; D67-S69 PolarHBondContact OD1-OG 2.86Å; D67-S69 PolarHBondContact OD2-OG 2.83Å; S69-V71 PolarHBondContact O-N 2.98Å
70	I	94.4	Very high	93.5	Very high	45 Å²	45	46.1 Å²	46.1	23%	0.231	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.2	175.6	-67.5	172.8	0	0	0	108.5	K31 V33 R73	K31-I70 HydrophobicContact CB-CD1 4.17Å; K31-I70 WeakPolarHBondContact O-CD1 3.24Å; V33-I70 HydrophobicContact CG2-CD1 4.05Å; I70-R73 HydrophobicContact CG2-CB 3.8Å
71	V	94.1	Very high	93.3	Very high	86 Å²	86	50.1 Å²	50.1	52%	0.521	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-47.8	173.7	-178.8	0	0	0	0	109.9	S62 N64 S69	S62-V71 WeakPolarHBondContact O-CB 3.42Å; S62-V71 PolarHBondContact O-N 3.47Å; N64-V71 HydrophobicContact CB-CG2 3.85Å; S69-V71 PolarHBondContact O-N 2.98Å
72	W	96.3	Very high	93.2	Very high	20 Å²	20	50.1 Å²	50.1	8%	0.076	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	154.9	171.3	58.3	-106.2	0	0	0	109.5	F52 I60 S61 S62 Q74 L92 I108 K109 G111	F52-W72 HydrophobicContact CD1-CH2 4.3Å; F52-W72 AromaticContact CD1-CZ2 3.78Å; F52-W72 HydrophobicContact CD1-CZ2 3.78Å; F52-W72 AromaticContact CE1-CZ2 3.68Å; F52-W72 HydrophobicContact CE1-CZ2 3.68Å; I60-W72 HydrophobicContact CG2-CH2 3.95Å; I60-W72 HydrophobicContact CG2-CZ3 3.88Å; S61-W72 VanDerWaalsContact CA-O 3.31Å; S61-W72 WeakPolarHBondContact CA-O 3.22Å; S61-W72 WeakPolarHBondContact CB-O 3.32Å; S61-W72 PolarHBondContact OG-O 2.94Å; S62-W72 PolarHBondContact N-O 2.84Å; S62-W72 PolarHBondContact O-N 2.95Å; W72-Q74 HydrophobicContact CE3-CG 4.42Å; W72-Q74 HydrophobicContact CZ3-CG 4.39Å; W72-L92 HydrophobicContact CH2-CD2 3.99Å; W72-I108 PolarHBondContact NE1-O 2.85Å; W72-K109 VanDerWaalsContact CD1-O 3.27Å; W72-G111 VanDerWaalsContact CD2-CA 3.45Å
73	R	95.4	Very high	93.1	Very high	44 Å²	44	50.1 Å²	50.1	17%	0.166	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	138.1	-179.9	176.8	-176.2	76.9	178.5	3.4	110	F32 V59 I60 I70 V75 D1085	F32-R73 WeakPolarHBondContact O-CD 3.43Å; F32-R73 PolarHBondContact O-NH1 3.49Å; V59-R73 HydrophobicContact CG1-CG 3.49Å; V59-R73 VanDerWaalsContact CG1-CG 3.49Å; I60-R73 CarbonylContact O-C 3.59Å; I60-R73 WeakPolarHBondContact O-CA 3.4Å; I70-R73 HydrophobicContact CG2-CB 3.8Å; R73-V75 HydrophobicContact CG-CG2 4.17Å; R73-D1085 IonicContact CZ-OD1 2.63Å; R73-D1085 IonicContact CZ-OD2 3.24Å; R73-D1085 IonicContact NH1-OD1 3.67Å; R73-D1085 PolarHBondContact NH1-OD1 2.94Å; R73-D1085 IonicContact NH1-OD2 2.97Å; R73-D1085 IonicContact NH2-OD1 3.99Å; R73-D1085 PolarHBondContact NH2-OD1 2.67Å; R73-D1085 IonicContact NH2-OD2 2.97Å; R73-D1085 PolarHBondContact NH2-OD2 3.45Å
74	Q	96.4	Very high	93.1	Very high	68 Å²	68	50 Å²	50	32%	0.318	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	116.7	171	-66	-65.2	-7.3	0	0	109.2	V59 I60 W72 W106 G111	V59-Q74 WeakPolarHBondContact CA-O 3.42Å; I60-Q74 PolarHBondContact N-O 2.79Å; I60-Q74 PolarHBondContact O-N 3.41Å; W72-Q74 HydrophobicContact CE3-CG 4.42Å; W72-Q74 HydrophobicContact CZ3-CG 4.39Å; Q74-W106 HydrophobicContact CB-CH2 4.08Å; Q74-W106 HydrophobicContact CB-CZ3 3.99Å; Q74-W106 HydrophobicContact CG-CE3 4.1Å; Q74-W106 HydrophobicContact CG-CH2 4.19Å; Q74-W106 HydrophobicContact CG-CZ3 3.58Å; Q74-G111 VanDerWaalsContact CG-O 3.28Å; Q74-G111 WeakPolarHBondContact CG-O 3.47Å; Q74-G111 PolarHBondContact NE2-O 3.36Å
75	V	95.7	Very high	93.2	Very high	39 Å²	39	47.4 Å²	47.4	24%	0.236	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.1	175.5	-179.9	0	0	0	0	107.1	V59 R73 M1061 R1062 L1084	V59-V75 HydrophobicContact CG1-CG2 4.12Å; V59-V75 HydrophobicContact CG2-CG1 4.28Å; V59-V75 HydrophobicContact CG2-CG2 4.21Å; R73-V75 HydrophobicContact CG-CG2 4.17Å; V75-M1061 HydrophobicContact CB-SD 4.41Å; V75-M1061 HydrophobicContact CG2-CB 4.4Å; V75-M1061 HydrophobicContact CG2-CG 3.95Å; V75-M1061 HydrophobicContact CG2-SD 4.42Å; V75-R1062 HydrophobicContact CG1-CG 4.37Å; V75-L1084 HydrophobicContact CB-CD2 4.45Å; V75-L1084 HydrophobicContact CG1-CD2 3.86Å; V75-L1084 HydrophobicContact CG2-CD2 3.67Å
76	L	95.2	Very high	93.5	Very high	20 Å²	20	49 Å²	49	11%	0.105	25%	0.252	C	S	.	.			trans	-84.7	-170.8	-178	-51.6	179.7	0	0	0	110.8	N58 I60 E78 L82 W106 R1062	N58-L76 HydrophobicContact CB-CB 4.48Å; N58-L76 WeakPolarHBondContact ND2-CB 3.39Å; N58-L76 VanDerWaalsContact O-CB 3.25Å; N58-L76 WeakPolarHBondContact O-CB 3.24Å; N58-L76 WeakPolarHBondContact O-CG 3.19Å; N58-L76 PolarHBondContact O-N 2.96Å; I60-L76 HydrophobicContact CD1-CD1 3.88Å; I60-L76 HydrophobicContact CG1-CD1 4.31Å; L76-E78 PolarHBondContact O-N 2.94Å; L76-L82 HydrophobicContact CD1-CD2 3.93Å; L76-W106 HydrophobicContact CD2-CH2 3.59Å; L76-W106 HydrophobicContact CD2-CZ2 3.72Å; L76-R1062 PolarHBondContact O-NH2 3.07Å
77	D	91.6	Very high	93.6	Very high	59 Å²	59	42.7 Å²	42.7	32%	0.316	23%	0.225	S	C	.	.			trans	-51.1	133.9	-178.9	-61.2	-40.8	0	0	0	111.5	N58 G80 K98 K102 R1062	N58-D77 PolarHBondContact ND2-O 2.9Å; D77-G80 PolarHBondContact O-N 3.4Å; D77-K98 HydrophobicContact CB-CB 3.86Å; D77-K98 HydrophobicContact CB-CG 3.85Å; D77-K102 IonicContact OD2-NZ 2.71Å; D77-K102 PolarHBondContact OD2-NZ 2.94Å; D77-R1062 PolarHBondContact O-NH2 3.41Å
78	E	88.6	Confident	93.7	Very high	65 Å²	65	39 Å²	39	30%	0.304	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	145.9	176.4	-78.1	179.4	-174.7	0	0	111.7	L76 G80 K98 R987 R1062	L76-E78 PolarHBondContact O-N 2.94Å; E78-G80 PolarHBondContact O-N 3.29Å; E78-K98 WeakPolarHBondContact O-CE 3.25Å; E78-R987 VanDerWaalsContact CD-NH1 3.29Å; E78-R987 IonicContact OE1-CZ 3.06Å; E78-R987 IonicContact OE1-NH1 3.17Å; E78-R987 PolarHBondContact OE1-NH1 3.21Å; E78-R987 IonicContact OE1-NH2 2.65Å; E78-R987 PolarHBondContact OE1-NH2 3.27Å; E78-R987 IonicContact OE2-CZ 3.8Å; E78-R987 IonicContact OE2-NH1 3.27Å; E78-R987 PolarHBondContact OE2-NH1 2.89Å; E78-R987 VanDerWaalsContact OE2-NH1 3.09Å; E78-R987 IonicContact OE2-NH2 3.63Å; E78-R987 PolarHBondContact OE2-NH2 3.05Å; E78-R1062 HydrophobicContact CG-CG 4.04Å; E78-R1062 VanDerWaalsContact OE1-CG 3.3Å; E78-R1062 WeakPolarHBondContact OE1-CG 3.3Å
79	D	88	Confident	93.5	Very high	143 Å²	143	40 Å²	40	77%	0.765	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	18.4	-173.4	-49.2	-37.8	0	0	0	114.1
80	G	93	Very high	93.3	Very high	9 Å²	9	42.8 Å²	42.8	9%	0.093	23%	0.228	C	C	.	.			trans	-85.7	167.2	167.9	0	0	0	0	0	111.2	N58 D77 E78 S97	N58-G80 WeakPolarHBondContact CB-O 3.49Å; D77-G80 PolarHBondContact O-N 3.4Å; E78-G80 PolarHBondContact O-N 3.29Å; G80-S97 VanDerWaalsContact CA-O 3.28Å; G80-S97 WeakPolarHBondContact CA-O 3.48Å
81	E	94	Very high	93.2	Very high	83 Å²	83	43 Å²	43	39%	0.388	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.8	179.3	-177.8	169.5	-171	0	0	110.8	K37 T83 S96 S97	K37-E81 IonicContact NZ-OE1 2.86Å; K37-E81 PolarHBondContact NZ-OE1 3.34Å; E81-T83 HydrophobicContact CG-CG2 4.29Å; E81-S96 CarbonylContact O-C 3.54Å; E81-S96 WeakPolarHBondContact O-CA 3.13Å; E81-S97 PolarHBondContact N-O 2.87Å; E81-S97 VanDerWaalsContact N-O 3.11Å; E81-S97 PolarHBondContact O-N 3.45Å
82	L	95.3	Very high	93.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	120.4	164.4	-75.1	173.9	0	0	0	108.8	K37 Y38 N58 I60 L76 L95	K37-L82 PolarHBondContact NZ-O 2.84Å; Y38-L82 HydrophobicContact CD2-CB 4.3Å; Y38-L82 HydrophobicContact CE2-CB 3.95Å; Y38-L82 WeakPolarHBondContact CE2-O 3.47Å; Y38-L82 PolarHBondContact OH-O 2.88Å; N58-L82 WeakPolarHBondContact OD1-CG 3.35Å; I60-L82 HydrophobicContact CD1-CD2 4.16Å; I60-L82 HydrophobicContact CG1-CD1 3.92Å; I60-L82 HydrophobicContact CG1-CD2 4.27Å; L76-L82 HydrophobicContact CD1-CD2 3.93Å; L82-L95 WeakPolarHBondContact CA-O 3.41Å
83	T	94.4	Very high	93.3	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	-21	179.9	49.8	0	0	0	0	112.8	Y38 E81 L95 S124 S125 G127	Y38-T83 PolarHBondContact OH-O 3.3Å; E81-T83 HydrophobicContact CG-CG2 4.29Å; T83-L95 PolarHBondContact N-O 3.48Å; T83-L95 VanDerWaalsContact OG1-CD2 3.32Å; T83-L95 WeakPolarHBondContact OG1-CD2 3.24Å; T83-L95 VanDerWaalsContact OG1-CG 3.25Å; T83-L95 WeakPolarHBondContact OG1-CG 3.3Å; T83-L95 PolarHBondContact OG1-O 3.41Å; T83-S124 WeakPolarHBondContact CG2-O 3.07Å; T83-S125 WeakPolarHBondContact CG2-O 3.47Å; T83-G127 CarbonylContact O-C 3.5Å
84	G	94.1	Very high	93.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	146.3	179.3	0	0	0	0	0	112.2	S94 L95	G84-S94 CarbonylContact O-C 3.57Å; G84-S94 WeakPolarHBondContact O-CA 3.23Å; G84-L95 PolarHBondContact N-O 3.13Å; G84-L95 PolarHBondContact O-N 2.99Å
85	F	96.2	Very high	93.4	Very high	5 Å²	5	32.6 Å²	32.6	2%	0.022	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	107.5	-175.2	-166.6	-103.2	0	0	0	111.4	Y38 K40 F52 I60 L92 F93	Y38-F85 VanDerWaalsContact CB-CD1 3.49Å; Y38-F85 HydrophobicContact CD1-CB 3.9Å; Y38-F85 HydrophobicContact CD2-CB 3.77Å; Y38-F85 HydrophobicContact CD2-CG 4.43Å; Y38-F85 HydrophobicContact CE2-CB 4.46Å; Y38-F85 HydrophobicContact CG-CB 3.46Å; Y38-F85 VanDerWaalsContact CG-CB 3.46Å; Y38-F85 HydrophobicContact CG-CD1 4.38Å; Y38-F85 HydrophobicContact CG-CG 4.11Å; K40-F85 HydrophobicContact CB-CE1 4.31Å; K40-F85 WeakPolarHBondContact CE-O 3.35Å; K40-F85 HydrophobicContact CG-CD1 3.83Å; K40-F85 HydrophobicContact CG-CE1 3.94Å; F52-F85 HydrophobicContact CB-CE1 4.23Å; F52-F85 HydrophobicContact CB-CZ 4.09Å; I60-F85 HydrophobicContact CD1-CE2 4.43Å; I60-F85 HydrophobicContact CG1-CE2 4.14Å; I60-F85 HydrophobicContact CG2-CE2 3.74Å; I60-F85 HydrophobicContact CG2-CZ 4.21Å; F85-L92 HydrophobicContact CD1-CD1 4.35Å; F85-L92 HydrophobicContact CD2-CD1 4.47Å; F85-L92 HydrophobicContact CE1-CD1 3.83Å; F85-L92 HydrophobicContact CE2-CD1 3.94Å; F85-L92 HydrophobicContact CE2-CD2 3.76Å; F85-L92 HydrophobicContact CE2-CG 4.08Å; F85-L92 HydrophobicContact CZ-CD1 3.62Å; F85-L92 HydrophobicContact CZ-CD2 3.68Å; F85-L92 HydrophobicContact CZ-CG 4.11Å; F85-F93 WeakPolarHBondContact CA-O 3.49Å
86	E	95	Very high	93.4	Very high	44 Å²	44	30.8 Å²	30.8	21%	0.206	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.5	-174.1	-166.5	53.7	-113.9	0	0	112.8	K40 F93 I129	K40-E86 WeakPolarHBondContact CE-OE2 3.48Å; K40-E86 IonicContact NZ-OE1 3.78Å; K40-E86 PolarHBondContact NZ-OE1 3.45Å; K40-E86 IonicContact NZ-OE2 3.97Å; K40-E86 PolarHBondContact NZ-OE2 3.01Å; E86-F93 PolarHBondContact N-O 3.16Å; E86-F93 PolarHBondContact O-N 3.42Å; E86-I129 HydrophobicContact CB-CB 3.87Å; E86-I129 HydrophobicContact CB-CG2 3.87Å; E86-I129 WeakPolarHBondContact CG-O 3.3Å
87	L	93.7	Very high	93.2	Very high	30 Å²	30	30.1 Å²	30.1	16%	0.157	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.1	179.3	178.6	72.3	0	0	0	109.7	K40 K42 F52 L92 I108	K40-L87 HydrophobicContact CB-CB 4.02Å; K40-L87 HydrophobicContact CB-CD2 4.42Å; K40-L87 HydrophobicContact CG-CB 4.2Å; K42-L87 HydrophobicContact CB-CD2 3.85Å; K42-L87 HydrophobicContact CG-CD2 4.34Å; F52-L87 HydrophobicContact CD2-CD1 4.14Å; F52-L87 HydrophobicContact CD2-CD2 4.35Å; F52-L87 HydrophobicContact CE2-CD1 4.02Å; F52-L87 HydrophobicContact CE2-CD2 4.4Å; L87-L92 HydrophobicContact CB-CD1 4.36Å; L87-L92 HydrophobicContact CD1-CB 4.4Å; L87-L92 HydrophobicContact CD1-CD1 4.34Å; L87-I108 HydrophobicContact CD1-CG2 3.97Å
88	C	91.9	Very high	93.2	Very high	7 Å²	7	29.2 Å²	29.2	5%	0.047	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	107.1	176.4	-138	0	0	0	0	110.9	N90 K91 F93 C131 L151	C88-N90 PolarHBondContact O-N 2.87Å; C88-K91 PolarHBondContact N-O 3.27Å; C88-K91 PolarHBondContact O-N 3.06Å; C88-K91 VanDerWaalsContact O-O 3.08Å; C88-F93 HydrophobicContact CB-CD2 4.05Å; C88-F93 HydrophobicContact CB-CE2 3.57Å; C88-C131 HydrophobicContact CB-CB 3.86Å; C88-C131 WeakPolarHBondContact CB-SG 3.45Å; C88-C131 WeakPolarHBondContact SG-CB 3.23Å; C88-C131 CovalentContact SG-SG 2.02Å; C88-C131 PolarHBondContact SG-SG 3.48Å; C88-L151 HydrophobicContact CB-CD1 4.31Å
89	G	86.6	Confident	93.1	Very high	25 Å²	25	33.2 Å²	33.2	26%	0.258	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.2	-109	-173.8	0	0	0	0	0	112.7	K42 E133	K42-G89 VanDerWaalsContact NZ-C 3.35Å; K42-G89 PolarHBondContact NZ-O 2.77Å; G89-E133 WeakPolarHBondContact CA-OE1 3.47Å; G89-E133 PolarHBondContact N-OE1 3.24Å
90	N	89.2	Confident	93.2	Very high	103 Å²	103	26.4 Å²	26.4	55%	0.551	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	15.4	-177.5	-70.4	-19.6	0	0	0	114.9	K42 C88 I108	K42-N90 VanDerWaalsContact CE-OD1 3.27Å; K42-N90 WeakPolarHBondContact CE-OD1 3.37Å; K42-N90 PolarHBondContact NZ-OD1 3.5Å; C88-N90 PolarHBondContact O-N 2.87Å; N90-I108 HydrophobicContact CB-CD1 4.15Å; N90-I108 WeakPolarHBondContact O-CG1 3.23Å
91	K	92.6	Very high	93.2	Very high	48 Å²	48	26 Å²	26	21%	0.209	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.1	178.6	-59.6	-175	-174.8	-172.8	0	110.6	C88 F93 L114 L151 Q152	C88-K91 PolarHBondContact N-O 3.27Å; C88-K91 PolarHBondContact O-N 3.06Å; C88-K91 VanDerWaalsContact O-O 3.08Å; K91-F93 HydrophobicContact CB-CE2 3.71Å; K91-F93 HydrophobicContact CB-CZ 3.86Å; K91-F93 HydrophobicContact CD-CZ 3.96Å; K91-L114 HydrophobicContact CD-CD1 3.84Å; K91-L114 HydrophobicContact CG-CD1 3.81Å; K91-L151 PolarHBondContact NZ-O 3.46Å; K91-L151 VanDerWaalsContact NZ-O 3.07Å; K91-Q152 PolarHBondContact NZ-O 3.38Å
92	L	96.3	Very high	93.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.4	171.3	177.5	73.3	0	0	0	108.3	F52 I60 W72 F85 L87 A105 W106 I108	F52-L92 HydrophobicContact CB-CD1 4.42Å; F52-L92 HydrophobicContact CB-CD2 4.33Å; F52-L92 HydrophobicContact CD1-CD2 4.33Å; F52-L92 HydrophobicContact CG-CD2 4.42Å; I60-L92 HydrophobicContact CG2-CD2 3.7Å; W72-L92 HydrophobicContact CH2-CD2 3.99Å; F85-L92 HydrophobicContact CD1-CD1 4.35Å; F85-L92 HydrophobicContact CD2-CD1 4.47Å; F85-L92 HydrophobicContact CE1-CD1 3.83Å; F85-L92 HydrophobicContact CE2-CD1 3.94Å; F85-L92 HydrophobicContact CE2-CD2 3.76Å; F85-L92 HydrophobicContact CE2-CG 4.08Å; F85-L92 HydrophobicContact CZ-CD1 3.62Å; F85-L92 HydrophobicContact CZ-CD2 3.68Å; F85-L92 HydrophobicContact CZ-CG 4.11Å; L87-L92 HydrophobicContact CB-CD1 4.36Å; L87-L92 HydrophobicContact CD1-CB 4.4Å; L87-L92 HydrophobicContact CD1-CD1 4.34Å; L92-A105 CarbonylContact O-C 3.55Å; L92-W106 HydrophobicContact CB-CB 4.2Å; L92-W106 PolarHBondContact N-O 3.28Å; L92-W106 VanDerWaalsContact O-CD1 3.27Å; L92-W106 PolarHBondContact O-N 3.32Å; L92-I108 HydrophobicContact CB-CG2 4.15Å
93	F	97.2	Very high	93.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139	178.4	-63.5	-85.1	0	0	0	109.8	F85 E86 C88 K91 R104 A105 W115 I129 L138 L151	F85-F93 WeakPolarHBondContact CA-O 3.49Å; E86-F93 PolarHBondContact N-O 3.16Å; E86-F93 PolarHBondContact O-N 3.42Å; C88-F93 HydrophobicContact CB-CD2 4.05Å; C88-F93 HydrophobicContact CB-CE2 3.57Å; K91-F93 HydrophobicContact CB-CE2 3.71Å; K91-F93 HydrophobicContact CB-CZ 3.86Å; K91-F93 HydrophobicContact CD-CZ 3.96Å; F93-R104 VanDerWaalsContact CA-O 3.31Å; F93-R104 WeakPolarHBondContact CA-O 3.15Å; F93-A105 HydrophobicContact CD1-CB 3.78Å; F93-A105 HydrophobicContact CE1-CB 3.44Å; F93-A105 VanDerWaalsContact CE1-CB 3.44Å; F93-A105 HydrophobicContact CZ-CB 4.3Å; F93-W115 HydrophobicContact CD1-CH2 4.39Å; F93-W115 HydrophobicContact CD1-CZ2 4.27Å; F93-W115 HydrophobicContact CE1-CH2 4.12Å; F93-W115 AromaticContact CE1-CZ2 3.57Å; F93-W115 HydrophobicContact CE1-CZ2 3.57Å; F93-I129 HydrophobicContact CB-CD1 4.02Å; F93-I129 HydrophobicContact CB-CG2 4.08Å; F93-L138 HydrophobicContact CD1-CD1 4.2Å; F93-L138 HydrophobicContact CD1-CD2 3.75Å; F93-L138 HydrophobicContact CD2-CD1 4.22Å; F93-L138 HydrophobicContact CE1-CD1 4.39Å; F93-L138 HydrophobicContact CE1-CD2 3.78Å; F93-L138 HydrophobicContact CE2-CD1 4.43Å; F93-L138 HydrophobicContact CG-CD1 4.11Å; F93-L138 HydrophobicContact CG-CD2 4.44Å; F93-L151 HydrophobicContact CE1-CD1 4.23Å; F93-L151 HydrophobicContact CE2-CD1 3.58Å; F93-L151 HydrophobicContact CZ-CD1 3.32Å; F93-L151 HydrophobicContact CZ-CG 4.13Å
94	S	96.7	Very high	93.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.3	175.1	69.6	0	0	0	0	111.4	I60 G84 R104 W106	I60-S94 VanDerWaalsContact CD1-CB 3.41Å; I60-S94 WeakPolarHBondContact CD1-OG 3.46Å; G84-S94 CarbonylContact O-C 3.57Å; G84-S94 WeakPolarHBondContact O-CA 3.23Å; S94-R104 PolarHBondContact N-O 3.5Å; S94-R104 PolarHBondContact O-N 2.83Å; S94-W106 PolarHBondContact OG-NE1 2.81Å
95	L	95.9	Very high	93.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.2	167.9	-167.4	64.3	0	0	0	108	L82 T83 G84 T101 I119 I129 V140	L82-L95 WeakPolarHBondContact CA-O 3.41Å; T83-L95 PolarHBondContact N-O 3.48Å; T83-L95 VanDerWaalsContact OG1-CD2 3.32Å; T83-L95 WeakPolarHBondContact OG1-CD2 3.24Å; T83-L95 VanDerWaalsContact OG1-CG 3.25Å; T83-L95 WeakPolarHBondContact OG1-CG 3.3Å; T83-L95 PolarHBondContact OG1-O 3.41Å; G84-L95 PolarHBondContact N-O 3.13Å; G84-L95 PolarHBondContact O-N 2.99Å; L95-T101 HydrophobicContact CD1-CG2 3.39Å; L95-T101 HydrophobicContact CD2-CG2 4.21Å; L95-T101 HydrophobicContact CG-CG2 3.8Å; L95-I119 HydrophobicContact CD1-CD1 3.35Å; L95-I119 HydrophobicContact CD1-CG1 4.39Å; L95-I129 HydrophobicContact CB-CD1 4Å; L95-I129 HydrophobicContact CB-CG1 4.42Å; L95-V140 HydrophobicContact CD1-CG1 3.99Å; L95-V140 HydrophobicContact CD2-CG1 4.15Å
96	S	95.3	Very high	93.5	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.007	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.7	-179.4	-176.7	0	0	0	0	109.6	N58 E81 K102	N58-S96 PolarHBondContact ND2-OG 2.91Å; N58-S96 VanDerWaalsContact ND2-OG 3.1Å; N58-S96 PolarHBondContact OD1-OG 2.82Å; E81-S96 CarbonylContact O-C 3.54Å; E81-S96 WeakPolarHBondContact O-CA 3.13Å; S96-K102 PolarHBondContact N-O 3.12Å; S96-K102 PolarHBondContact O-N 3.3Å
97	S	92.3	Very high	93.5	Very high	7 Å²	7	24.5 Å²	24.5	5%	0.049	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.6	-175.4	-65	0	0	0	0	110.6	G80 E81 G100 T101 S124	G80-S97 VanDerWaalsContact CA-O 3.28Å; G80-S97 WeakPolarHBondContact CA-O 3.48Å; E81-S97 PolarHBondContact N-O 2.87Å; E81-S97 VanDerWaalsContact N-O 3.11Å; E81-S97 PolarHBondContact O-N 3.45Å; S97-G100 WeakPolarHBondContact CA-O 3.41Å; S97-T101 PolarHBondContact OG-OG1 3.48Å; S97-S124 WeakPolarHBondContact CB-O 3.33Å; S97-S124 PolarHBondContact OG-N 3.39Å; S97-S124 PolarHBondContact OG-O 3.22Å
98	K	91.1	Very high	93.5	Very high	40 Å²	40	23.5 Å²	23.5	17%	0.174	12%	0.12	C	C	.	.	S	Bend	trans	-165.8	122.9	169.3	-174.5	59.4	171.6	-170.5	0	109.3	D77 E78 G100	D77-K98 HydrophobicContact CB-CB 3.86Å; D77-K98 HydrophobicContact CB-CG 3.85Å; E78-K98 WeakPolarHBondContact O-CE 3.25Å; K98-G100 CarbonylContact C-O 3.53Å; K98-G100 PolarHBondContact N-O 3.28Å; K98-G100 PolarHBondContact O-N 3.41Å
99	H	86.5	Confident	93.4	Very high	149 Å²	149	30.1 Å²	30.1	69%	0.69	15%	0.148	S	C	*	.	S	Bend	trans	51.9	38.9	-171.1	-55.9	-55.2	0	0	0	112.5	E123	H99-E123 PolarHBondContact N-OE1 2.84Å
100	G	90.8	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	117.1	163.6	-170.9	0	0	0	0	0	112.7	S97 K98 D120 S121	S97-G100 WeakPolarHBondContact CA-O 3.41Å; K98-G100 CarbonylContact C-O 3.53Å; K98-G100 PolarHBondContact N-O 3.28Å; K98-G100 PolarHBondContact O-N 3.41Å; G100-D120 CarbonylContact C-O 3.49Å; G100-D120 VanDerWaalsContact CA-O 3.26Å; G100-D120 WeakPolarHBondContact CA-O 3.22Å; G100-S121 WeakPolarHBondContact CA-O 3.41Å
101	T	92.9	Very high	93.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.6	-179.5	-68	0	0	0	0	109.6	L95 S97 I119 D120 S122 S124	L95-T101 HydrophobicContact CD1-CG2 3.39Å; L95-T101 HydrophobicContact CD2-CG2 4.21Å; L95-T101 HydrophobicContact CG-CG2 3.8Å; S97-T101 PolarHBondContact OG-OG1 3.48Å; T101-I119 HydrophobicContact CG2-CB 4.49Å; T101-I119 HydrophobicContact CG2-CD1 4.29Å; T101-I119 WeakPolarHBondContact O-CB 3.49Å; T101-I119 PolarHBondContact O-N 2.94Å; T101-D120 PolarHBondContact N-O 3.28Å; T101-S122 PolarHBondContact N-O 2.91Å; T101-S122 PolarHBondContact OG1-O 3.23Å; T101-S124 VanDerWaalsContact OG1-CB 3.29Å; T101-S124 WeakPolarHBondContact OG1-CB 3.46Å; T101-S124 PolarHBondContact OG1-N 2.85Å; T101-S124 PolarHBondContact OG1-OG 3.22Å
102	K	95.2	Very high	93.9	Very high	41 Å²	41	30.9 Å²	30.9	18%	0.178	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.5	-173.9	-59.9	172.7	-167.2	165	0	110.7	D77 S96 R104 L118	D77-K102 IonicContact OD2-NZ 2.71Å; D77-K102 PolarHBondContact OD2-NZ 2.94Å; S96-K102 PolarHBondContact N-O 3.12Å; S96-K102 PolarHBondContact O-N 3.3Å; K102-R104 VanDerWaalsContact CD-NH2 3.29Å; K102-L118 HydrophobicContact CG-CD1 3.93Å
103	L	96	Very high	93.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130.6	169.7	-176.8	58.3	0	0	0	109.6	W115 E116 A117 I119 I129 L138 V140 Y149	L103-W115 HydrophobicContact CB-CZ3 4.48Å; L103-W115 HydrophobicContact CD2-CH2 3.66Å; L103-W115 HydrophobicContact CD2-CZ3 3.73Å; L103-W115 HydrophobicContact CG-CH2 3.97Å; L103-W115 HydrophobicContact CG-CZ3 3.8Å; L103-E116 CarbonylContact O-C 3.6Å; L103-E116 WeakPolarHBondContact O-CA 3.37Å; L103-A117 PolarHBondContact N-O 3.36Å; L103-A117 PolarHBondContact O-N 3.49Å; L103-I119 HydrophobicContact CB-CD1 3.87Å; L103-I119 HydrophobicContact CB-CG1 3.91Å; L103-I129 HydrophobicContact CD1-CD1 4Å; L103-I129 HydrophobicContact CD1-CG1 4.48Å; L103-L138 HydrophobicContact CD1-CD2 4.49Å; L103-L138 HydrophobicContact CD2-CD2 3.84Å; L103-V140 HydrophobicContact CD1-CG1 4.49Å; L103-V140 HydrophobicContact CD1-CG2 3.87Å; L103-V140 HydrophobicContact CD2-CG2 3.62Å; L103-V140 HydrophobicContact CG-CG2 4.38Å; L103-Y149 HydrophobicContact CD2-CD2 3.79Å; L103-Y149 HydrophobicContact CD2-CE2 3.84Å; L103-Y149 HydrophobicContact CD2-CG 4.15Å
104	R	96.1	Very high	93.8	Very high	17 Å²	17	38.3 Å²	38.3	6%	0.064	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.7	176.6	-66.7	173.4	178.7	122.9	-0.3	110.8	F93 S94 K102 W106 E116	F93-R104 VanDerWaalsContact CA-O 3.31Å; F93-R104 WeakPolarHBondContact CA-O 3.15Å; S94-R104 PolarHBondContact N-O 3.5Å; S94-R104 PolarHBondContact O-N 2.83Å; K102-R104 VanDerWaalsContact CD-NH2 3.29Å; R104-W106 HydrophobicContact CB-CZ2 3.85Å; R104-W106 HydrophobicContact CG-CZ2 4.2Å; R104-E116 HydrophobicContact CG-CB 4.23Å; R104-E116 HydrophobicContact CG-CG 3.88Å; R104-E116 IonicContact CZ-OE2 3.37Å; R104-E116 VanDerWaalsContact CZ-OE2 3.24Å; R104-E116 IonicContact NE-OE2 2.77Å; R104-E116 PolarHBondContact NE-OE2 3.46Å; R104-E116 IonicContact NH2-OE2 2.69Å; R104-E116 PolarHBondContact NH2-OE2 2.83Å
105	A	96.8	Very high	93.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.5	166.6	0	0	0	0	0	109.2	L92 F93 V113 L114 W115	L92-A105 CarbonylContact O-C 3.55Å; F93-A105 HydrophobicContact CD1-CB 3.78Å; F93-A105 HydrophobicContact CE1-CB 3.44Å; F93-A105 VanDerWaalsContact CE1-CB 3.44Å; F93-A105 HydrophobicContact CZ-CB 4.3Å; A105-V113 CarbonylContact O-C 3.6Å; A105-L114 HydrophobicContact CB-CB 4.25Å; A105-L114 PolarHBondContact O-N 3.24Å; A105-W115 HydrophobicContact CB-CD2 3.67Å; A105-W115 VanDerWaalsContact CB-CE2 3.41Å; A105-W115 HydrophobicContact CB-CE3 4.3Å; A105-W115 HydrophobicContact CB-CG 4.01Å; A105-W115 HydrophobicContact CB-CH2 4.42Å; A105-W115 HydrophobicContact CB-CZ2 3.85Å; A105-W115 PolarHBondContact N-O 2.79Å
106	W	96.5	Very high	93.7	Very high	5 Å²	5	44.6 Å²	44.6	2%	0.019	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.5	-175.4	-53.4	93.2	0	0	0	110.9	I60 Q74 L76 L92 S94 R104 I108 G112 V113	I60-W106 HydrophobicContact CD1-CZ2 3.85Å; Q74-W106 HydrophobicContact CB-CH2 4.08Å; Q74-W106 HydrophobicContact CB-CZ3 3.99Å; Q74-W106 HydrophobicContact CG-CE3 4.1Å; Q74-W106 HydrophobicContact CG-CH2 4.19Å; Q74-W106 HydrophobicContact CG-CZ3 3.58Å; L76-W106 HydrophobicContact CD2-CH2 3.59Å; L76-W106 HydrophobicContact CD2-CZ2 3.72Å; L92-W106 HydrophobicContact CB-CB 4.2Å; L92-W106 PolarHBondContact N-O 3.28Å; L92-W106 VanDerWaalsContact O-CD1 3.27Å; L92-W106 PolarHBondContact O-N 3.32Å; S94-W106 PolarHBondContact OG-NE1 2.81Å; R104-W106 HydrophobicContact CB-CZ2 3.85Å; R104-W106 HydrophobicContact CG-CZ2 4.2Å; W106-I108 PolarHBondContact O-N 3.09Å; W106-G112 CarbonylContact C-O 3.52Å; W106-G112 WeakPolarHBondContact CA-O 3.23Å; W106-V113 HydrophobicContact CD2-CG2 4.42Å; W106-V113 HydrophobicContact CE3-CG2 3.66Å; W106-V113 HydrophobicContact CH2-CG2 3.63Å; W106-V113 HydrophobicContact CZ2-CG2 4.4Å; W106-V113 HydrophobicContact CZ3-CB 4.42Å; W106-V113 HydrophobicContact CZ3-CG2 3.2Å
107	D	94.7	Very high	93.6	Very high	42 Å²	42	45.5 Å²	45.5	23%	0.225	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	120.1	165.8	-174.5	-13.1	0	0	0	109.3	K109 G111 G112 L114	D107-K109 PolarHBondContact O-N 2.88Å; D107-K109 WeakPolarHBondContact OD1-CB 3.2Å; D107-K109 PolarHBondContact OD1-N 3.41Å; D107-G111 VanDerWaalsContact O-CA 3.23Å; D107-G111 WeakPolarHBondContact O-CA 3.37Å; D107-G111 PolarHBondContact O-N 3.21Å; D107-G112 PolarHBondContact N-O 3.19Å; D107-L114 HydrophobicContact CB-CD2 4.06Å; D107-L114 HydrophobicContact CB-CG 4.24Å
108	I	92.2	Very high	93.7	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.046	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.4	179.5	63.7	166.3	0	0	0	113.8	K42 F52 W72 L87 N90 L92 W106	K42-I108 HydrophobicContact CD-CD1 3.68Å; F52-I108 HydrophobicContact CE1-CB 4.1Å; F52-I108 HydrophobicContact CE1-CG2 4.43Å; F52-I108 HydrophobicContact CE2-CB 4.48Å; F52-I108 HydrophobicContact CE2-CG2 4.36Å; F52-I108 HydrophobicContact CZ-CB 3.66Å; F52-I108 HydrophobicContact CZ-CG2 3.95Å; W72-I108 PolarHBondContact NE1-O 2.85Å; L87-I108 HydrophobicContact CD1-CG2 3.97Å; N90-I108 HydrophobicContact CB-CD1 4.15Å; N90-I108 WeakPolarHBondContact O-CG1 3.23Å; L92-I108 HydrophobicContact CB-CG2 4.15Å; W106-I108 PolarHBondContact O-N 3.09Å
109	K	91.2	Very high	93.7	Very high	145 Å²	145	48.4 Å²	48.4	63%	0.63	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-50.1	-175.5	-67.8	-177.7	-179.6	177.7	0	112	W72 D107	W72-K109 VanDerWaalsContact CD1-O 3.27Å; D107-K109 PolarHBondContact O-N 2.88Å; D107-K109 WeakPolarHBondContact OD1-CB 3.2Å; D107-K109 PolarHBondContact OD1-N 3.41Å
110	F	90.9	Very high	93.7	Very high	160 Å²	160	42.1 Å²	42.1	70%	0.702	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-11.2	-172.9	-56.3	-70	0	0	0	113.6	G112	F110-G112 VanDerWaalsContact C-N 3.33Å
111	G	93	Very high	93.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.			trans	74.7	19.9	-176.2	0	0	0	0	0	114	W72 Q74 D107	W72-G111 VanDerWaalsContact CD2-CA 3.45Å; Q74-G111 VanDerWaalsContact CG-O 3.28Å; Q74-G111 WeakPolarHBondContact CG-O 3.47Å; Q74-G111 PolarHBondContact NE2-O 3.36Å; D107-G111 VanDerWaalsContact O-CA 3.23Å; D107-G111 WeakPolarHBondContact O-CA 3.37Å; D107-G111 PolarHBondContact O-N 3.21Å
112	G	95.5	Very high	93.2	Very high	32 Å²	32	48.1 Å²	48.1	33%	0.33	26%	0.255	S	S	.	.			trans	-78.7	148.2	175.4	0	0	0	0	0	112.1	W106 D107 F110 L114	W106-G112 CarbonylContact C-O 3.52Å; W106-G112 WeakPolarHBondContact CA-O 3.23Å; D107-G112 PolarHBondContact N-O 3.19Å; F110-G112 VanDerWaalsContact C-N 3.33Å; G112-L114 PolarHBondContact O-N 3.36Å
113	V	95.5	Very high	92.9	Very high	71 Å²	71	51.1 Å²	51.1	43%	0.43	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	121	172.1	-178.9	0	0	0	0	109	A105 W106 W115 E116	A105-V113 CarbonylContact O-C 3.6Å; W106-V113 HydrophobicContact CD2-CG2 4.42Å; W106-V113 HydrophobicContact CE3-CG2 3.66Å; W106-V113 HydrophobicContact CH2-CG2 3.63Å; W106-V113 HydrophobicContact CZ2-CG2 4.4Å; W106-V113 HydrophobicContact CZ3-CB 4.42Å; W106-V113 HydrophobicContact CZ3-CG2 3.2Å; V113-W115 WeakPolarHBondContact CG1-O 3.48Å; V113-E116 HydrophobicContact CG1-CB 4.22Å
114	L	94.9	Very high	92.6	Very high	85 Å²	85	51.3 Å²	51.3	45%	0.445	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-44	173	-65.6	175.3	0	0	0	111.1	K91 A105 D107 G112	K91-L114 HydrophobicContact CD-CD1 3.84Å; K91-L114 HydrophobicContact CG-CD1 3.81Å; A105-L114 HydrophobicContact CB-CB 4.25Å; A105-L114 PolarHBondContact O-N 3.24Å; D107-L114 HydrophobicContact CB-CD2 4.06Å; D107-L114 HydrophobicContact CB-CG 4.24Å; G112-L114 PolarHBondContact O-N 3.36Å
115	W	95.5	Very high	92.2	Very high	29 Å²	29	53.1 Å²	53.1	11%	0.11	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	156	172.2	55.6	-105.7	0	0	0	110.1	F93 L103 A105 V113 A117 L138 L151 Q152 G154	F93-W115 HydrophobicContact CD1-CH2 4.39Å; F93-W115 HydrophobicContact CD1-CZ2 4.27Å; F93-W115 HydrophobicContact CE1-CH2 4.12Å; F93-W115 AromaticContact CE1-CZ2 3.57Å; F93-W115 HydrophobicContact CE1-CZ2 3.57Å; L103-W115 HydrophobicContact CB-CZ3 4.48Å; L103-W115 HydrophobicContact CD2-CH2 3.66Å; L103-W115 HydrophobicContact CD2-CZ3 3.73Å; L103-W115 HydrophobicContact CG-CH2 3.97Å; L103-W115 HydrophobicContact CG-CZ3 3.8Å; A105-W115 HydrophobicContact CB-CD2 3.67Å; A105-W115 VanDerWaalsContact CB-CE2 3.41Å; A105-W115 HydrophobicContact CB-CE3 4.3Å; A105-W115 HydrophobicContact CB-CG 4.01Å; A105-W115 HydrophobicContact CB-CH2 4.42Å; A105-W115 HydrophobicContact CB-CZ2 3.85Å; A105-W115 PolarHBondContact N-O 2.79Å; V113-W115 WeakPolarHBondContact CG1-O 3.48Å; W115-A117 HydrophobicContact CZ3-CB 4.35Å; W115-L138 HydrophobicContact CH2-CD2 3.62Å; W115-L138 HydrophobicContact CZ2-CD2 3.97Å; W115-L151 PolarHBondContact NE1-O 2.85Å; W115-Q152 PolarHBondContact NE1-O 3.11Å; W115-G154 VanDerWaalsContact CD2-CA 3.49Å; W115-G154 VanDerWaalsContact CE2-CA 3.42Å
116	E	95.1	Very high	91.8	Very high	104 Å²	104	53.5 Å²	53.5	49%	0.486	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141.8	178.1	179.7	179.8	102	0	0	109.6	L103 R104 V113	L103-E116 CarbonylContact O-C 3.6Å; L103-E116 WeakPolarHBondContact O-CA 3.37Å; R104-E116 HydrophobicContact CG-CB 4.23Å; R104-E116 HydrophobicContact CG-CG 3.88Å; R104-E116 IonicContact CZ-OE2 3.37Å; R104-E116 VanDerWaalsContact CZ-OE2 3.24Å; R104-E116 IonicContact NE-OE2 2.77Å; R104-E116 PolarHBondContact NE-OE2 3.46Å; R104-E116 IonicContact NH2-OE2 2.69Å; R104-E116 PolarHBondContact NH2-OE2 2.83Å; V113-E116 HydrophobicContact CG1-CB 4.22Å
117	A	93.7	Very high	91.6	Very high	19 Å²	19	53.6 Å²	53.6	16%	0.157	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	130.4	172.8	0	0	0	0	0	110.8	L103 W115 I119 Y149	L103-A117 PolarHBondContact N-O 3.36Å; L103-A117 PolarHBondContact O-N 3.49Å; W115-A117 HydrophobicContact CZ3-CB 4.35Å; A117-I119 PolarHBondContact O-N 2.92Å; A117-Y149 HydrophobicContact CB-CE1 3.97Å
118	L	93.2	Very high	91.5	Very high	105 Å²	105	53.2 Å²	53.2	55%	0.55	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	111.6	167.5	-177.5	68.7	0	0	0	108.4	K102 D120	K102-L118 HydrophobicContact CG-CD1 3.93Å; L118-D120 WeakPolarHBondContact CD1-O 2.68Å
119	I	90.7	Very high	91.6	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-50.1	-177.9	-50.4	-169.3	0	0	0	110.1	L95 T101 L103 A117 V140 Y142 D147 R161	L95-I119 HydrophobicContact CD1-CD1 3.35Å; L95-I119 HydrophobicContact CD1-CG1 4.39Å; T101-I119 HydrophobicContact CG2-CB 4.49Å; T101-I119 HydrophobicContact CG2-CD1 4.29Å; T101-I119 WeakPolarHBondContact O-CB 3.49Å; T101-I119 PolarHBondContact O-N 2.94Å; L103-I119 HydrophobicContact CB-CD1 3.87Å; L103-I119 HydrophobicContact CB-CG1 3.91Å; A117-I119 PolarHBondContact O-N 2.92Å; I119-V140 HydrophobicContact CD1-CB 4.24Å; I119-V140 HydrophobicContact CD1-CG1 3.49Å; I119-V140 VanDerWaalsContact CD1-CG1 3.49Å; I119-Y142 HydrophobicContact CG2-CD1 3.57Å; I119-Y142 HydrophobicContact CG2-CD2 4.48Å; I119-Y142 HydrophobicContact CG2-CE1 3.23Å; I119-Y142 HydrophobicContact CG2-CE2 4.19Å; I119-Y142 HydrophobicContact CG2-CG 4.21Å; I119-D147 VanDerWaalsContact CG2-OD2 3.25Å; I119-D147 WeakPolarHBondContact CG2-OD2 3.19Å; I119-R161 PolarHBondContact O-NH2 2.91Å; I119-R161 VanDerWaalsContact O-NH2 3.12Å
120	D	87.8	Confident	91.6	Very high	16 Å²	16	47.9 Å²	47.9	9%	0.086	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	149.1	-179	-167.5	44.6	0	0	0	111.3	G100 T101 L118 S122 Y142 K144	G100-D120 CarbonylContact C-O 3.49Å; G100-D120 VanDerWaalsContact CA-O 3.26Å; G100-D120 WeakPolarHBondContact CA-O 3.22Å; T101-D120 PolarHBondContact N-O 3.28Å; L118-D120 WeakPolarHBondContact CD1-O 2.68Å; D120-S122 VanDerWaalsContact C-N 3.26Å; D120-S122 PolarHBondContact O-N 3.19Å; D120-S122 WeakPolarHBondContact OD2-CB 3.09Å; D120-S122 PolarHBondContact OD2-N 3.3Å; D120-S122 PolarHBondContact OD2-OG 3.15Å; D120-Y142 HydrophobicContact CB-CD2 4.3Å; D120-Y142 HydrophobicContact CB-CE2 3.77Å; D120-K144 IonicContact OD2-NZ 2.62Å
121	S	87.3	Confident	91.5	Very high	97 Å²	97	41.3 Å²	41.3	68%	0.678	24%	0.239	S	C	*	.	S	Bend	trans	-76.6	-15.5	178.5	57.3	0	0	0	0	112.9	G100	G100-S121 WeakPolarHBondContact CA-O 3.41Å
122	S	86.6	Confident	91.2	Very high	29 Å²	29	42.5 Å²	42.5	20%	0.203	25%	0.245	C	C	.	.	S	Bend	trans	-91.2	154.3	173.9	74.7	0	0	0	0	112.4	T101 D120 K144	T101-S122 PolarHBondContact N-O 2.91Å; T101-S122 PolarHBondContact OG1-O 3.23Å; D120-S122 VanDerWaalsContact C-N 3.26Å; D120-S122 PolarHBondContact O-N 3.19Å; D120-S122 WeakPolarHBondContact OD2-CB 3.09Å; D120-S122 PolarHBondContact OD2-N 3.3Å; D120-S122 PolarHBondContact OD2-OG 3.15Å; S122-K144 WeakPolarHBondContact OG-CD 3.44Å; S122-K144 WeakPolarHBondContact OG-CE 3.23Å; S122-K144 PolarHBondContact OG-NZ 3.2Å
123	E	87.8	Confident	90.6	Very high	105 Å²	105	46.3 Å²	46.3	49%	0.491	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-77.4	131.2	175.3	-63.6	176.7	173.5	0	0	109.1	H99	H99-E123 PolarHBondContact N-OE1 2.84Å
124	S	89	Confident	90	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.021	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-102.4	133.3	174.6	-53.2	0	0	0	0	108.9	T83 S97 T101 D143	T83-S124 WeakPolarHBondContact CG2-O 3.07Å; S97-S124 WeakPolarHBondContact CB-O 3.33Å; S97-S124 PolarHBondContact OG-N 3.39Å; S97-S124 PolarHBondContact OG-O 3.22Å; T101-S124 VanDerWaalsContact OG1-CB 3.29Å; T101-S124 WeakPolarHBondContact OG1-CB 3.46Å; T101-S124 PolarHBondContact OG1-N 2.85Å; T101-S124 PolarHBondContact OG1-OG 3.22Å; S124-D143 WeakPolarHBondContact CA-OD2 3.33Å
125	S	88.2	Confident	89.2	Confident	55 Å²	55	47.4 Å²	47.4	39%	0.385	26%	0.262	S	S	.	.	S	Bend	trans	-82.7	-25.7	176.1	59.5	0	0	0	0	112.5	T83 D143 P168	T83-S125 WeakPolarHBondContact CG2-O 3.47Å; S125-D143 PolarHBondContact N-OD2 3.19Å; S125-D143 PolarHBondContact OG-OD2 2.96Å; S125-P168 PolarHBondContact OG-O 3.06Å
126	S	88.8	Confident	88.7	Confident	8 Å²	8	46.8 Å²	46.8	6%	0.056	27%	0.265	C	S	.	.			trans	-135.2	157.8	179.1	75.4	0	0	0	0	111.7	D143 P168 I171	S126-D143 WeakPolarHBondContact CA-OD1 3.29Å; S126-D143 PolarHBondContact N-OD1 3.43Å; S126-D143 PolarHBondContact OG-OD1 2.77Å; S126-P168 PolarHBondContact OG-O 3.35Å; S126-I171 WeakPolarHBondContact OG-CD1 3.49Å; S126-I171 WeakPolarHBondContact OG-CG1 3.36Å
127	G	91.3	Very high	88.4	Confident	8 Å²	8	42.1 Å²	42.1	8%	0.082	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	170.8	175.7	0	0	0	0	0	111.8	T83 A141	T83-G127 CarbonylContact O-C 3.5Å; G127-A141 CarbonylContact C-O 3.54Å; G127-A141 WeakPolarHBondContact CA-O 3.45Å
128	D	92.6	Very high	88.2	Confident	34 Å²	34	41.2 Å²	41.2	18%	0.182	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	158.2	176	-163.6	12.4	0	0	0	110.1	A141 I171 N172 I173	D128-A141 PolarHBondContact N-O 2.87Å; D128-A141 PolarHBondContact O-N 3.36Å; D128-I171 HydrophobicContact CB-CG2 4.3Å; D128-N172 WeakPolarHBondContact OD2-CA 3.5Å; D128-I173 HydrophobicContact CB-CB 4.5Å; D128-I173 HydrophobicContact CB-CD1 4.11Å; D128-I173 HydrophobicContact CB-CG1 4.02Å; D128-I173 VanDerWaalsContact O-CD1 3.3Å; D128-I173 WeakPolarHBondContact O-CD1 3.43Å; D128-I173 PolarHBondContact OD2-N 3.33Å
129	I	94.5	Very high	88.1	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	128.1	-177.7	-60.3	167.5	0	0	0	108.3	E86 F93 L95 L103 L138 V140	E86-I129 HydrophobicContact CB-CB 3.87Å; E86-I129 HydrophobicContact CB-CG2 3.87Å; E86-I129 WeakPolarHBondContact CG-O 3.3Å; F93-I129 HydrophobicContact CB-CD1 4.02Å; F93-I129 HydrophobicContact CB-CG2 4.08Å; L95-I129 HydrophobicContact CB-CD1 4Å; L95-I129 HydrophobicContact CB-CG1 4.42Å; L103-I129 HydrophobicContact CD1-CD1 4Å; L103-I129 HydrophobicContact CD1-CG1 4.48Å; I129-L138 HydrophobicContact CG2-CD1 3.47Å; I129-L138 VanDerWaalsContact CG2-CD1 3.47Å; I129-L138 HydrophobicContact CG2-CG 4.38Å; I129-V140 HydrophobicContact CG1-CG1 4.25Å; I129-V140 HydrophobicContact CG1-CG2 4.3Å; I129-V140 HydrophobicContact CG2-CG2 4.39Å
130	W	91.3	Very high	88.2	Confident	40 Å²	40	36 Å²	36	15%	0.152	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.9	171.4	179.6	89.8	0	0	0	110.5	D132 L138 V139 I173 S175 L182 I184	W130-D132 HydrophobicContact CH2-CB 3.34Å; W130-D132 HydrophobicContact CZ2-CB 3.84Å; W130-D132 HydrophobicContact CZ3-CB 3.99Å; W130-L138 CarbonylContact O-C 3.5Å; W130-L138 WeakPolarHBondContact O-CA 3.05Å; W130-V139 HydrophobicContact CE3-CB 4.35Å; W130-V139 HydrophobicContact CE3-CG2 4.22Å; W130-V139 PolarHBondContact N-O 3.15Å; W130-V139 PolarHBondContact O-N 2.83Å; W130-I173 HydrophobicContact CB-CB 4.03Å; W130-I173 HydrophobicContact CB-CD1 4.22Å; W130-I173 HydrophobicContact CB-CG2 3.46Å; W130-I173 VanDerWaalsContact CB-CG2 3.46Å; W130-I173 HydrophobicContact CG-CG2 4.02Å; W130-S175 VanDerWaalsContact CE2-CB 3.44Å; W130-S175 VanDerWaalsContact NE1-CB 3.31Å; W130-S175 PolarHBondContact NE1-OG 3.29Å; W130-L182 HydrophobicContact CH2-CD1 3.84Å; W130-L182 HydrophobicContact CH2-CD2 3.44Å; W130-L182 VanDerWaalsContact CH2-CD2 3.44Å; W130-L182 HydrophobicContact CH2-CG 4.2Å; W130-L182 HydrophobicContact CZ2-CD1 4.07Å; W130-L182 HydrophobicContact CZ2-CD2 4.45Å; W130-L182 HydrophobicContact CZ3-CD2 3.88Å; W130-I184 HydrophobicContact CD2-CD1 3.81Å; W130-I184 HydrophobicContact CE3-CD1 3.3Å; W130-I184 HydrophobicContact CE3-CG1 4.45Å; W130-I184 HydrophobicContact CG-CD1 4.44Å; W130-I184 HydrophobicContact CH2-CD1 4.39Å; W130-I184 HydrophobicContact CZ3-CD1 3.65Å
131	C	90.3	Very high	88.5	Confident	21 Å²	21	35.3 Å²	35.3	14%	0.142	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	154.6	180	71.9	0	0	0	0	111.8	C88 I137 L138 L151	C88-C131 HydrophobicContact CB-CB 3.86Å; C88-C131 WeakPolarHBondContact CB-SG 3.45Å; C88-C131 WeakPolarHBondContact SG-CB 3.23Å; C88-C131 CovalentContact SG-SG 2.02Å; C88-C131 PolarHBondContact SG-SG 3.48Å; C131-I137 WeakPolarHBondContact CA-O 2.99Å; C131-L138 HydrophobicContact CB-CD1 3.69Å; C131-L151 HydrophobicContact CB-CD1 3.95Å
132	D	85.6	Confident	88.7	Confident	25 Å²	25	30.8 Å²	30.8	13%	0.134	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	120.3	168.5	167.6	43.1	0	0	0	110.1	W130 N134 S135 G136 I137	W130-D132 HydrophobicContact CH2-CB 3.34Å; W130-D132 HydrophobicContact CZ2-CB 3.84Å; W130-D132 HydrophobicContact CZ3-CB 3.99Å; D132-N134 VanDerWaalsContact C-N 3.25Å; D132-N134 PolarHBondContact O-N 3.44Å; D132-N134 WeakPolarHBondContact OD1-CB 3.47Å; D132-N134 PolarHBondContact OD1-N 3.29Å; D132-N134 PolarHBondContact OD1-ND2 3.06Å; D132-S135 WeakPolarHBondContact CB-OG 3.5Å; D132-S135 PolarHBondContact O-OG 3.16Å; D132-S135 VanDerWaalsContact OD2-CB 3.28Å; D132-S135 WeakPolarHBondContact OD2-CB 3.4Å; D132-S135 PolarHBondContact OD2-N 3.48Å; D132-S135 PolarHBondContact OD2-OG 3.26Å; D132-G136 WeakPolarHBondContact O-CA 3.25Å; D132-G136 PolarHBondContact O-N 3.05Å; D132-I137 PolarHBondContact N-O 3.01Å; D132-I137 VanDerWaalsContact N-O 3.08Å; D132-I137 PolarHBondContact O-N 3.32Å
133	E	83	Confident	88.8	Confident	113 Å²	113	29.9 Å²	29.9	53%	0.528	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-28.8	-179.1	-65.6	-156.9	127.4	0	0	112.5	G89 G136 L151	G89-E133 WeakPolarHBondContact CA-OE1 3.47Å; G89-E133 PolarHBondContact N-OE1 3.24Å; E133-G136 PolarHBondContact O-N 3.34Å; E133-L151 HydrophobicContact CG-CD2 4.29Å
134	N	82.3	Confident	88.8	Confident	136 Å²	136	30 Å²	30	73%	0.727	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-44.2	-177.5	-60.9	-54.5	0	0	0	111.8	D132 G136	D132-N134 VanDerWaalsContact C-N 3.25Å; D132-N134 PolarHBondContact O-N 3.44Å; D132-N134 WeakPolarHBondContact OD1-CB 3.47Å; D132-N134 PolarHBondContact OD1-N 3.29Å; D132-N134 PolarHBondContact OD1-ND2 3.06Å; N134-G136 VanDerWaalsContact C-N 3.34Å
135	S	79.2	Confident	88.8	Confident	42 Å²	42	29.8 Å²	29.8	29%	0.294	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.5	173.4	55.9	0	0	0	0	112.7	D132 I137	D132-S135 WeakPolarHBondContact CB-OG 3.5Å; D132-S135 PolarHBondContact O-OG 3.16Å; D132-S135 VanDerWaalsContact OD2-CB 3.28Å; D132-S135 WeakPolarHBondContact OD2-CB 3.4Å; D132-S135 PolarHBondContact OD2-N 3.48Å; D132-S135 PolarHBondContact OD2-OG 3.26Å; S135-I137 PolarHBondContact O-N 3.27Å
136	G	84.9	Confident	88.9	Confident	17 Å²	17	27.3 Å²	27.3	18%	0.175	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	24.6	-174.8	0	0	0	0	0	112.6	D132 E133 N134 L151	D132-G136 WeakPolarHBondContact O-CA 3.25Å; D132-G136 PolarHBondContact O-N 3.05Å; E133-G136 PolarHBondContact O-N 3.34Å; N134-G136 VanDerWaalsContact C-N 3.34Å; G136-L151 VanDerWaalsContact O-CB 3.24Å; G136-L151 WeakPolarHBondContact O-CB 3.46Å; G136-L151 PolarHBondContact O-N 3.18Å
137	I	87.5	Confident	89	Confident	5 Å²	5	26.9 Å²	26.9	3%	0.026	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	141.9	-175.2	-64.1	175.8	0	0	0	110	C131 D132 S135 V139 T148 I214	C131-I137 WeakPolarHBondContact CA-O 2.99Å; D132-I137 PolarHBondContact N-O 3.01Å; D132-I137 VanDerWaalsContact N-O 3.08Å; D132-I137 PolarHBondContact O-N 3.32Å; S135-I137 PolarHBondContact O-N 3.27Å; I137-V139 HydrophobicContact CG2-CG2 4.04Å; I137-T148 HydrophobicContact CG2-CG2 3.32Å; I137-I214 HydrophobicContact CD1-CG2 3.68Å
138	L	91.3	Very high	88.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.3	173.5	-180	74.8	0	0	0	108.1	F93 L103 W115 I129 W130 C131 V140 T148 Y149 L151	F93-L138 HydrophobicContact CD1-CD1 4.2Å; F93-L138 HydrophobicContact CD1-CD2 3.75Å; F93-L138 HydrophobicContact CD2-CD1 4.22Å; F93-L138 HydrophobicContact CE1-CD1 4.39Å; F93-L138 HydrophobicContact CE1-CD2 3.78Å; F93-L138 HydrophobicContact CE2-CD1 4.43Å; F93-L138 HydrophobicContact CG-CD1 4.11Å; F93-L138 HydrophobicContact CG-CD2 4.44Å; L103-L138 HydrophobicContact CD1-CD2 4.49Å; L103-L138 HydrophobicContact CD2-CD2 3.84Å; W115-L138 HydrophobicContact CH2-CD2 3.62Å; W115-L138 HydrophobicContact CZ2-CD2 3.97Å; I129-L138 HydrophobicContact CG2-CD1 3.47Å; I129-L138 VanDerWaalsContact CG2-CD1 3.47Å; I129-L138 HydrophobicContact CG2-CG 4.38Å; W130-L138 CarbonylContact O-C 3.5Å; W130-L138 WeakPolarHBondContact O-CA 3.05Å; C131-L138 HydrophobicContact CB-CD1 3.69Å; L138-V140 HydrophobicContact CD2-CG2 4.25Å; L138-V140 HydrophobicContact CG-CG2 4.08Å; L138-T148 CarbonylContact O-C 3.41Å; L138-T148 WeakPolarHBondContact O-CA 3.31Å; L138-Y149 PolarHBondContact N-O 2Å; L138-Y149 PolarHBondContact O-N 3.03Å; L138-L151 HydrophobicContact CB-CD1 4.02Å; L138-L151 HydrophobicContact CD1-CD1 4.1Å
139	V	91	Very high	88.9	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.2	176.5	-179.8	0	0	0	0	108.8	W130 I137 V146 D147 T148 I173 I184 I214	W130-V139 HydrophobicContact CE3-CB 4.35Å; W130-V139 HydrophobicContact CE3-CG2 4.22Å; W130-V139 PolarHBondContact N-O 3.15Å; W130-V139 PolarHBondContact O-N 2.83Å; I137-V139 HydrophobicContact CG2-CG2 4.04Å; V139-V146 HydrophobicContact CG1-CG2 3.58Å; V139-D147 WeakPolarHBondContact CA-O 3.35Å; V139-T148 HydrophobicContact CG2-CG2 4.22Å; V139-I173 HydrophobicContact CG1-CD1 4.32Å; V139-I184 HydrophobicContact CB-CD1 3.82Å; V139-I184 HydrophobicContact CG1-CD1 4.12Å; V139-I184 HydrophobicContact CG2-CD1 3.55Å; V139-I214 HydrophobicContact CG2-CD1 3.74Å
140	V	92.9	Very high	88.7	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.8	-177.4	-175	0	0	0	0	108.9	L95 L103 I119 I129 L138 V146 D147 Y149	L95-V140 HydrophobicContact CD1-CG1 3.99Å; L95-V140 HydrophobicContact CD2-CG1 4.15Å; L103-V140 HydrophobicContact CD1-CG1 4.49Å; L103-V140 HydrophobicContact CD1-CG2 3.87Å; L103-V140 HydrophobicContact CD2-CG2 3.62Å; L103-V140 HydrophobicContact CG-CG2 4.38Å; I119-V140 HydrophobicContact CD1-CB 4.24Å; I119-V140 HydrophobicContact CD1-CG1 3.49Å; I119-V140 VanDerWaalsContact CD1-CG1 3.49Å; I129-V140 HydrophobicContact CG1-CG1 4.25Å; I129-V140 HydrophobicContact CG1-CG2 4.3Å; I129-V140 HydrophobicContact CG2-CG2 4.39Å; L138-V140 HydrophobicContact CD2-CG2 4.25Å; L138-V140 HydrophobicContact CG-CG2 4.08Å; V140-V146 WeakPolarHBondContact O-CA 3.25Å; V140-D147 PolarHBondContact N-O 3.23Å; V140-D147 PolarHBondContact O-N 2.81Å; V140-Y149 HydrophobicContact CB-CE2 4.47Å; V140-Y149 HydrophobicContact CG2-CD2 4.23Å; V140-Y149 HydrophobicContact CG2-CE2 4.44Å
141	A	92.2	Very high	88.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.9	177.1	0	0	0	0	0	110.4	G127 D128 V146 I171 I173 L186	G127-A141 CarbonylContact C-O 3.54Å; G127-A141 WeakPolarHBondContact CA-O 3.45Å; D128-A141 PolarHBondContact N-O 2.87Å; D128-A141 PolarHBondContact O-N 3.36Å; A141-V146 HydrophobicContact CB-CB 4.47Å; A141-V146 HydrophobicContact CB-CG2 4.33Å; A141-I171 HydrophobicContact CB-CG2 3.65Å; A141-I173 HydrophobicContact CB-CD1 3.76Å; A141-I173 HydrophobicContact CB-CG1 3.87Å; A141-L186 HydrophobicContact CB-CD1 3.29Å; A141-L186 HydrophobicContact CB-CD2 4.37Å; A141-L186 HydrophobicContact CB-CG 4.46Å
142	Y	92.1	Very high	88.4	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	167.5	-174.5	61.8	-80.7	0	0	0	109.1	I119 D120 K144 G145 I171	I119-Y142 HydrophobicContact CG2-CD1 3.57Å; I119-Y142 HydrophobicContact CG2-CD2 4.48Å; I119-Y142 HydrophobicContact CG2-CE1 3.23Å; I119-Y142 HydrophobicContact CG2-CE2 4.19Å; I119-Y142 HydrophobicContact CG2-CG 4.21Å; D120-Y142 HydrophobicContact CB-CD2 4.3Å; D120-Y142 HydrophobicContact CB-CE2 3.77Å; Y142-K144 HydrophobicContact CD2-CB 4.18Å; Y142-K144 HydrophobicContact CE2-CB 3.8Å; Y142-K144 PolarHBondContact O-N 2.9Å; Y142-G145 WeakPolarHBondContact CD1-O 3.44Å; Y142-G145 VanDerWaalsContact CE1-C 3.46Å; Y142-G145 WeakPolarHBondContact CE1-O 3.36Å; Y142-G145 PolarHBondContact N-O 3.2Å; Y142-G145 PolarHBondContact O-N 2.95Å; Y142-I171 WeakPolarHBondContact O-CD1 3.16Å
143	D	89.5	Confident	88.5	Confident	11 Å²	11	37.4 Å²	37.4	6%	0.059	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-29.4	-170.1	-70.5	2.7	0	0	0	116.1	S124 S125 S126 P168	S124-D143 WeakPolarHBondContact CA-OD2 3.33Å; S125-D143 PolarHBondContact N-OD2 3.19Å; S125-D143 PolarHBondContact OG-OD2 2.96Å; S126-D143 WeakPolarHBondContact CA-OD1 3.29Å; S126-D143 PolarHBondContact N-OD1 3.43Å; S126-D143 PolarHBondContact OG-OD1 2.77Å; D143-P168 HydrophobicContact CB-CG 4.46Å
144	K	87.3	Confident	88.8	Confident	106 Å²	106	32.7 Å²	32.7	46%	0.461	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-0.7	-176.5	-67.4	-173.2	-179.2	171.1	0	115	D120 S122 Y142 M163	D120-K144 IonicContact OD2-NZ 2.62Å; S122-K144 WeakPolarHBondContact OG-CD 3.44Å; S122-K144 WeakPolarHBondContact OG-CE 3.23Å; S122-K144 PolarHBondContact OG-NZ 3.2Å; Y142-K144 HydrophobicContact CD2-CB 4.18Å; Y142-K144 HydrophobicContact CE2-CB 3.8Å; Y142-K144 PolarHBondContact O-N 2.9Å; K144-M163 VanDerWaalsContact O-CG 3.3Å; K144-M163 WeakPolarHBondContact O-CG 3.23Å
145	G	88.5	Confident	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.2	-174.8	-179.4	0	0	0	0	0	115.9	Y142 D160	Y142-G145 WeakPolarHBondContact CD1-O 3.44Å; Y142-G145 VanDerWaalsContact CE1-C 3.46Å; Y142-G145 WeakPolarHBondContact CE1-O 3.36Å; Y142-G145 PolarHBondContact N-O 3.2Å; Y142-G145 PolarHBondContact O-N 2.95Å; G145-D160 CarbonylContact C-O 3.56Å; G145-D160 WeakPolarHBondContact CA-O 3.26Å
146	V	90.4	Very high	89.7	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.012	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.2	173.8	60.5	0	0	0	0	109.9	V139 V140 A141 D160 L186 Y212 L221	V139-V146 HydrophobicContact CG1-CG2 3.58Å; V140-V146 WeakPolarHBondContact O-CA 3.25Å; A141-V146 HydrophobicContact CB-CB 4.47Å; A141-V146 HydrophobicContact CB-CG2 4.33Å; V146-D160 HydrophobicContact CG1-CB 4Å; V146-D160 PolarHBondContact N-O 2.77Å; V146-D160 PolarHBondContact O-N 3.17Å; V146-L186 HydrophobicContact CB-CD2 4.33Å; V146-Y212 HydrophobicContact CG1-CE1 3.96Å; V146-Y212 HydrophobicContact CG1-CE2 3.85Å; V146-L221 HydrophobicContact CG1-CD1 4.33Å; V146-L221 HydrophobicContact CG2-CD1 4.45Å
147	D	91	Very high	89.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.8	-178.6	-75.3	-17.5	0	0	0	110.5	I119 V139 V140 Y149 K156 S158 S159	I119-D147 VanDerWaalsContact CG2-OD2 3.25Å; I119-D147 WeakPolarHBondContact CG2-OD2 3.19Å; V139-D147 WeakPolarHBondContact CA-O 3.35Å; V140-D147 PolarHBondContact N-O 3.23Å; V140-D147 PolarHBondContact O-N 2.81Å; D147-Y149 HydrophobicContact CB-CD2 4.19Å; D147-Y149 HydrophobicContact CB-CE2 3.43Å; D147-Y149 VanDerWaalsContact CB-CE2 3.43Å; D147-Y149 PolarHBondContact OD2-OH 3.34Å; D147-K156 VanDerWaalsContact CG-CE 3.47Å; D147-K156 WeakPolarHBondContact OD1-CE 3.31Å; D147-K156 IonicContact OD1-NZ 3.04Å; D147-K156 PolarHBondContact OD1-NZ 2.97Å; D147-K156 WeakPolarHBondContact OD2-CE 3.4Å; D147-K156 IonicContact OD2-NZ 2.67Å; D147-K156 PolarHBondContact OD2-NZ 3.37Å; D147-S158 WeakPolarHBondContact CA-O 3.31Å; D147-S159 VanDerWaalsContact OD1-CA 3.25Å; D147-S159 WeakPolarHBondContact OD1-CA 3.49Å; D147-S159 WeakPolarHBondContact OD1-CB 3.28Å; D147-S159 PolarHBondContact OD1-OG 2.97Å
148	T	90.5	Very high	89.9	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.012	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.2	172.4	-58.4	0	0	0	0	109.8	I137 L138 V139 L157 S158 L221	I137-T148 HydrophobicContact CG2-CG2 3.32Å; L138-T148 CarbonylContact O-C 3.41Å; L138-T148 WeakPolarHBondContact O-CA 3.31Å; V139-T148 HydrophobicContact CG2-CG2 4.22Å; T148-L157 HydrophobicContact CG2-CB 4.32Å; T148-L157 HydrophobicContact CG2-CD1 4.2Å; T148-L157 PolarHBondContact O-N 3.5Å; T148-S158 WeakPolarHBondContact CB-OG 3.46Å; T148-S158 PolarHBondContact N-O 3.25Å; T148-S158 PolarHBondContact O-N 2.67Å; T148-L221 WeakPolarHBondContact OG1-CD1 3.35Å; T148-L221 WeakPolarHBondContact OG1-CG 3.2Å
149	Y	90.9	Very high	89.7	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.016	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	154.1	179.8	-65.9	-92.4	0	0	0	111.1	L103 A117 L138 V140 D147 G154 E155 K156	L103-Y149 HydrophobicContact CD2-CD2 3.79Å; L103-Y149 HydrophobicContact CD2-CE2 3.84Å; L103-Y149 HydrophobicContact CD2-CG 4.15Å; A117-Y149 HydrophobicContact CB-CE1 3.97Å; L138-Y149 PolarHBondContact N-O 2Å; L138-Y149 PolarHBondContact O-N 3.03Å; V140-Y149 HydrophobicContact CB-CE2 4.47Å; V140-Y149 HydrophobicContact CG2-CD2 4.23Å; V140-Y149 HydrophobicContact CG2-CE2 4.44Å; D147-Y149 HydrophobicContact CB-CD2 4.19Å; D147-Y149 HydrophobicContact CB-CE2 3.43Å; D147-Y149 VanDerWaalsContact CB-CE2 3.43Å; D147-Y149 PolarHBondContact OD2-OH 3.34Å; Y149-G154 WeakPolarHBondContact CD1-O 3.46Å; Y149-E155 CarbonylContact C-O 3.55Å; Y149-E155 VanDerWaalsContact CA-O 3.26Å; Y149-E155 WeakPolarHBondContact CA-O 3.33Å; Y149-K156 HydrophobicContact CD1-CB 3.91Å; Y149-K156 HydrophobicContact CD1-CG 4.43Å; Y149-K156 HydrophobicContact CE1-CB 3.66Å; Y149-K156 HydrophobicContact CE1-CD 4.23Å; Y149-K156 HydrophobicContact CE1-CG 4.03Å
150	R	90.4	Very high	89.5	Confident	104 Å²	104	37.6 Å²	37.6	39%	0.392	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	119.8	167.8	-177.1	160.1	-77.5	148.5	-6.1	109.7	Q152 T153 G154 E155 L157	R150-Q152 PolarHBondContact O-N 3.33Å; R150-Q152 VanDerWaalsContact O-N 3.09Å; R150-T153 PolarHBondContact O-N 3.29Å; R150-G154 PolarHBondContact O-N 3.16Å; R150-E155 HydrophobicContact CB-CB 4.28Å; R150-E155 PolarHBondContact N-O 3.3Å; R150-E155 IonicContact NH1-OE2 3.01Å; R150-E155 PolarHBondContact NH1-OE2 2.94Å; R150-L157 HydrophobicContact CB-CD1 4.34Å; R150-L157 HydrophobicContact CB-CD2 4.35Å; R150-L157 HydrophobicContact CB-CG 4.4Å
151	L	88.6	Confident	89	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.063	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.7	-173.9	-170	73.4	0	0	0	113.6	C88 K91 F93 W115 C131 E133 G136 L138	C88-L151 HydrophobicContact CB-CD1 4.31Å; K91-L151 PolarHBondContact NZ-O 3.46Å; K91-L151 VanDerWaalsContact NZ-O 3.07Å; F93-L151 HydrophobicContact CE1-CD1 4.23Å; F93-L151 HydrophobicContact CE2-CD1 3.58Å; F93-L151 HydrophobicContact CZ-CD1 3.32Å; F93-L151 HydrophobicContact CZ-CG 4.13Å; W115-L151 PolarHBondContact NE1-O 2.85Å; C131-L151 HydrophobicContact CB-CD1 3.95Å; E133-L151 HydrophobicContact CG-CD2 4.29Å; G136-L151 VanDerWaalsContact O-CB 3.24Å; G136-L151 WeakPolarHBondContact O-CB 3.46Å; G136-L151 PolarHBondContact O-N 3.18Å; L138-L151 HydrophobicContact CB-CD1 4.02Å; L138-L151 HydrophobicContact CD1-CD1 4.1Å
152	Q	87.7	Confident	88.2	Confident	147 Å²	147	49.3 Å²	49.3	69%	0.687	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-50.5	-177.5	-67.9	-174.6	6	0	0	112.8	K91 W115 R150	K91-Q152 PolarHBondContact NZ-O 3.38Å; W115-Q152 PolarHBondContact NE1-O 3.11Å; R150-Q152 PolarHBondContact O-N 3.33Å; R150-Q152 VanDerWaalsContact O-N 3.09Å
153	T	88.5	Confident	87.2	Confident	82 Å²	82	50.6 Å²	50.6	50%	0.503	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-18.2	-167.6	53.6	0	0	0	0	114.3	R150 E155	R150-T153 PolarHBondContact O-N 3.29Å; T153-E155 PolarHBondContact O-N 2.93Å; T153-E155 WeakPolarHBondContact OG1-CB 3.3Å; T153-E155 PolarHBondContact OG1-N 2.76Å
154	G	89	Confident	86.3	Confident	13 Å²	13	53 Å²	53	13%	0.134	26%	0.259	C	S	.	.			trans	73.7	13	-170.1	0	0	0	0	0	113.6	W115 Y149 R150 K156	W115-G154 VanDerWaalsContact CD2-CA 3.49Å; W115-G154 VanDerWaalsContact CE2-CA 3.42Å; Y149-G154 WeakPolarHBondContact CD1-O 3.46Å; R150-G154 PolarHBondContact O-N 3.16Å; G154-K156 PolarHBondContact O-N 2.82Å
155	E	89.9	Confident	85.5	Confident	102 Å²	102	54.5 Å²	54.5	48%	0.477	28%	0.282	S	S	.	.			trans	-67.2	126.8	175.1	-177.7	-173	-170.7	0	0	109.9	Y149 R150 T153 L157	Y149-E155 CarbonylContact C-O 3.55Å; Y149-E155 VanDerWaalsContact CA-O 3.26Å; Y149-E155 WeakPolarHBondContact CA-O 3.33Å; R150-E155 HydrophobicContact CB-CB 4.28Å; R150-E155 PolarHBondContact N-O 3.3Å; R150-E155 IonicContact NH1-OE2 3.01Å; R150-E155 PolarHBondContact NH1-OE2 2.94Å; T153-E155 PolarHBondContact O-N 2.93Å; T153-E155 WeakPolarHBondContact OG1-CB 3.3Å; T153-E155 PolarHBondContact OG1-N 2.76Å; E155-L157 PolarHBondContact O-N 3.28Å
156	K	89.6	Confident	85	Confident	81 Å²	81	57 Å²	57	35%	0.352	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	119.3	176.2	-174.6	166.2	172	166	0	109.9	D147 Y149 G154 S159	D147-K156 VanDerWaalsContact CG-CE 3.47Å; D147-K156 WeakPolarHBondContact OD1-CE 3.31Å; D147-K156 IonicContact OD1-NZ 3.04Å; D147-K156 PolarHBondContact OD1-NZ 2.97Å; D147-K156 WeakPolarHBondContact OD2-CE 3.4Å; D147-K156 IonicContact OD2-NZ 2.67Å; D147-K156 PolarHBondContact OD2-NZ 3.37Å; Y149-K156 HydrophobicContact CD1-CB 3.91Å; Y149-K156 HydrophobicContact CD1-CG 4.43Å; Y149-K156 HydrophobicContact CE1-CB 3.66Å; Y149-K156 HydrophobicContact CE1-CD 4.23Å; Y149-K156 HydrophobicContact CE1-CG 4.03Å; G154-K156 PolarHBondContact O-N 2.82Å; K156-S159 WeakPolarHBondContact CE-OG 3.46Å; K156-S159 PolarHBondContact NZ-OG 2.98Å
157	L	88.5	Confident	84.6	Confident	36 Å²	36	60.4 Å²	60.4	19%	0.188	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-43.8	-178.3	-59.9	180	0	0	0	111.9	T148 R150 E155	T148-L157 HydrophobicContact CG2-CB 4.32Å; T148-L157 HydrophobicContact CG2-CD1 4.2Å; T148-L157 PolarHBondContact O-N 3.5Å; R150-L157 HydrophobicContact CB-CD1 4.34Å; R150-L157 HydrophobicContact CB-CD2 4.35Å; R150-L157 HydrophobicContact CB-CG 4.4Å; E155-L157 PolarHBondContact O-N 3.28Å
158	S	87.6	Confident	84.2	Confident	15 Å²	15	60.5 Å²	60.5	11%	0.105	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	163	-178.8	54	0	0	0	0	111.9	D147 T148 G218 L221	D147-S158 WeakPolarHBondContact CA-O 3.31Å; T148-S158 WeakPolarHBondContact CB-OG 3.46Å; T148-S158 PolarHBondContact N-O 3.25Å; T148-S158 PolarHBondContact O-N 2.67Å; S158-G218 PolarHBondContact OG-O 3.39Å; S158-L221 WeakPolarHBondContact OG-CG 3.27Å
159	S	87.7	Confident	83.9	Confident	50 Å²	50	65.1 Å²	65.1	35%	0.35	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	133.3	-174.2	-162.6	0	0	0	0	110.2	D147 K156	D147-S159 VanDerWaalsContact OD1-CA 3.25Å; D147-S159 WeakPolarHBondContact OD1-CA 3.49Å; D147-S159 WeakPolarHBondContact OD1-CB 3.28Å; D147-S159 PolarHBondContact OD1-OG 2.97Å; K156-S159 WeakPolarHBondContact CE-OG 3.46Å; K156-S159 PolarHBondContact NZ-OG 2.98Å
160	D	86.9	Confident	83.6	Confident	20 Å²	20	68.6 Å²	68.6	11%	0.107	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	117.6	166	178.9	17.6	0	0	0	109.3	G145 V146 N162 Y212 L221	G145-D160 CarbonylContact C-O 3.56Å; G145-D160 WeakPolarHBondContact CA-O 3.26Å; V146-D160 HydrophobicContact CG1-CB 4Å; V146-D160 PolarHBondContact N-O 2.77Å; V146-D160 PolarHBondContact O-N 3.17Å; D160-N162 VanDerWaalsContact OD1-CB 3.31Å; D160-N162 WeakPolarHBondContact OD1-CB 3.41Å; D160-N162 PolarHBondContact OD1-N 2.83Å; D160-Y212 HydrophobicContact CB-CE1 4.14Å; D160-Y212 VanDerWaalsContact OD2-CE1 3.31Å; D160-Y212 WeakPolarHBondContact OD2-CE1 3.48Å; D160-Y212 PolarHBondContact OD2-OH 2.94Å; D160-L221 HydrophobicContact CB-CB 4.43Å
161	R	82.4	Confident	83.4	Confident	140 Å²	140	63.9 Å²	63.9	53%	0.528	35%	0.348	S	S	.	.			trans	-109	15.7	-177.9	-65.7	-174.9	171.4	-160.6	-7.8	112.9	I119 M163	I119-R161 PolarHBondContact O-NH2 2.91Å; I119-R161 VanDerWaalsContact O-NH2 3.12Å; R161-M163 PolarHBondContact O-N 3.33Å
162	N	74.2	Confident	83.1	Confident	106 Å²	106	65.2 Å²	65.2	57%	0.567	36%	0.355	S	S	*	.			trans	-82.9	66.8	-177.1	-168.8	26.7	0	0	0	112.1	D160 R210	D160-N162 VanDerWaalsContact OD1-CB 3.31Å; D160-N162 WeakPolarHBondContact OD1-CB 3.41Å; D160-N162 PolarHBondContact OD1-N 2.83Å; N162-R210 VanDerWaalsContact O-CZ 3.29Å; N162-R210 PolarHBondContact O-NH1 3.38Å; N162-R210 PolarHBondContact O-NH2 3.44Å
163	M	71.5	Confident	82.9	Confident	29 Å²	29	59 Å²	59	14%	0.143	33%	0.326	C	S	.	.			trans	-101.6	160.5	177.9	-66	-52.3	127.4	0	0	113	K144 R161 L186 R210	K144-M163 VanDerWaalsContact O-CG 3.3Å; K144-M163 WeakPolarHBondContact O-CG 3.23Å; R161-M163 PolarHBondContact O-N 3.33Å; M163-L186 HydrophobicContact CE-CD2 4.47Å; M163-R210 PolarHBondContact SD-NE 3.28Å; M163-R210 VanDerWaalsContact SD-NE 3.44Å
164	N	70.7	Confident	82.4	Confident	63 Å²	63	55.9 Å²	55.9	34%	0.337	31%	0.307	S	S	.	.			trans	-66.2	163.3	175.3	-72.1	-3.7	0	0	0	111.4	S166 I208	N164-S166 VanDerWaalsContact C-N 3.35Å; N164-S166 PolarHBondContact O-N 2.83Å; N164-I208 WeakPolarHBondContact ND2-CD1 3.43Å
165	S	70.3	Confident	81.8	Confident	137 Å²	137	57 Å²	57	96%	0.958	31%	0.313	S	S	*	.	S	Bend	trans	-65.1	-34.2	-180	-175.3	0	0	0	0	113.4
166	S	78.4	Confident	80.8	Confident	51 Å²	51	53 Å²	53	36%	0.357	30%	0.3	S	S	.	.	S	Bend	trans	-80.3	145.3	176.6	50.3	0	0	0	0	111.7	N164 Y190 Y206	N164-S166 VanDerWaalsContact C-N 3.35Å; N164-S166 PolarHBondContact O-N 2.83Å; S166-Y190 VanDerWaalsContact O-CE1 3.28Å; S166-Y190 WeakPolarHBondContact O-CE1 3.48Å; S166-Y190 WeakPolarHBondContact OG-CE1 3.38Å; S166-Y206 PolarHBondContact OG-OH 2.73Å; S166-Y206 VanDerWaalsContact OG-OH 3.06Å
167	S	82.4	Confident	79.5	Confident	74 Å²	74	54.9 Å²	54.9	52%	0.517	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-77.1	134.3	171.1	56	0	0	0	0	110.8
168	P	83.1	Confident	78	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.013	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-67.6	149.7	173.2	27.2	-31.1	0	0	0	110.7	S125 S126 D143 I171 E188 Y190	S125-P168 PolarHBondContact OG-O 3.06Å; S126-P168 PolarHBondContact OG-O 3.35Å; D143-P168 HydrophobicContact CB-CG 4.46Å; P168-I171 HydrophobicContact CB-CG1 4.06Å; P168-I171 HydrophobicContact CG-CD1 3.57Å; P168-I171 HydrophobicContact CG-CG1 3.6Å; P168-E188 HydrophobicContact CB-CB 4.15Å; P168-Y190 VanDerWaalsContact CA-CE1 3.46Å; P168-Y190 HydrophobicContact CB-CD1 4.35Å; P168-Y190 HydrophobicContact CB-CE1 3.86Å; P168-Y190 HydrophobicContact CB-CE2 4.31Å
169	N	83	Confident	76.6	Confident	100 Å²	100	64 Å²	64	54%	0.535	35%	0.35	S	S	.	.	S	Bend	trans	-81.8	-31.8	175	-175.6	80.3	0	0	0	111.8	K189 L191	N169-K189 PolarHBondContact N-O 2.78Å; N169-L191 HydrophobicContact CB-CD1 3.72Å
170	Q	85.4	Confident	75.2	Confident	77 Å²	77	67.3 Å²	67.3	36%	0.36	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	135.3	175.8	-174.6	-179.9	21.3	0	0	109.5	N172 K189	Q170-N172 PolarHBondContact NE2-OD1 3.37Å; Q170-K189 HydrophobicContact CB-CB 4.31Å; Q170-K189 HydrophobicContact CB-CD 4.3Å; Q170-K189 PolarHBondContact N-O 3.25Å; Q170-K189 PolarHBondContact O-N 3.21Å
171	I	86.9	Confident	74.2	Confident	4 Å²	4	68.4 Å²	68.4	2%	0.021	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.7	171.4	-70.7	168.6	0	0	0	108.2	S126 D128 A141 Y142 P168 L186 V187 E188	S126-I171 WeakPolarHBondContact OG-CD1 3.49Å; S126-I171 WeakPolarHBondContact OG-CG1 3.36Å; D128-I171 HydrophobicContact CB-CG2 4.3Å; A141-I171 HydrophobicContact CB-CG2 3.65Å; Y142-I171 WeakPolarHBondContact O-CD1 3.16Å; P168-I171 HydrophobicContact CB-CG1 4.06Å; P168-I171 HydrophobicContact CG-CD1 3.57Å; P168-I171 HydrophobicContact CG-CG1 3.6Å; I171-L186 HydrophobicContact CG2-CD1 3.39Å; I171-V187 CarbonylContact C-O 3.5Å; I171-V187 VanDerWaalsContact CA-O 3.29Å; I171-V187 WeakPolarHBondContact CA-O 3.13Å; I171-E188 HydrophobicContact CG1-CG 4.39Å
172	N	82.4	Confident	73.7	Confident	41 Å²	41	62.7 Å²	62.7	22%	0.219	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.2	169.1	-62.7	-23.2	0	0	0	110	D128 Q170 V187	D128-N172 WeakPolarHBondContact OD2-CA 3.5Å; Q170-N172 PolarHBondContact NE2-OD1 3.37Å; N172-V187 HydrophobicContact CB-CB 4.38Å; N172-V187 PolarHBondContact N-O 2.91Å; N172-V187 WeakPolarHBondContact O-CB 3.09Å; N172-V187 PolarHBondContact O-N 2.7Å
173	I	83.4	Confident	73.8	Confident	16 Å²	16	57.9 Å²	57.9	8%	0.082	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.2	174.2	-64.5	168.1	0	0	0	109.1	D128 W130 V139 A141 I184 L186	D128-I173 HydrophobicContact CB-CB 4.5Å; D128-I173 HydrophobicContact CB-CD1 4.11Å; D128-I173 HydrophobicContact CB-CG1 4.02Å; D128-I173 VanDerWaalsContact O-CD1 3.3Å; D128-I173 WeakPolarHBondContact O-CD1 3.43Å; D128-I173 PolarHBondContact OD2-N 3.33Å; W130-I173 HydrophobicContact CB-CB 4.03Å; W130-I173 HydrophobicContact CB-CD1 4.22Å; W130-I173 HydrophobicContact CB-CG2 3.46Å; W130-I173 VanDerWaalsContact CB-CG2 3.46Å; W130-I173 HydrophobicContact CG-CG2 4.02Å; V139-I173 HydrophobicContact CG1-CD1 4.32Å; A141-I173 HydrophobicContact CB-CD1 3.76Å; A141-I173 HydrophobicContact CB-CG1 3.87Å; I173-I184 HydrophobicContact CG2-CD1 4.32Å; I173-I184 HydrophobicContact CG2-CG2 3.44Å; I173-I184 VanDerWaalsContact CG2-CG2 3.44Å; I173-L186 HydrophobicContact CG1-CD1 4.26Å
174	V	77.4	Confident	74.1	Confident	16 Å²	16	56.7 Å²	56.7	10%	0.097	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.4	175.5	-175.6	0	0	0	0	109.7	I184 S185 V187 I243	V174-I184 CarbonylContact O-C 3.59Å; V174-I184 WeakPolarHBondContact O-CA 3.37Å; V174-S185 PolarHBondContact N-O 3.08Å; V174-S185 PolarHBondContact O-N 3.17Å; V174-V187 HydrophobicContact CG2-CG2 4.29Å; V174-I243 HydrophobicContact CB-CG2 4.28Å; V174-I243 HydrophobicContact CG1-CG2 4.26Å; V174-I243 HydrophobicContact CG2-CB 4.1Å; V174-I243 HydrophobicContact CG2-CG2 3.96Å
175	S	76.1	Confident	74.4	Confident	36 Å²	36	54 Å²	54	25%	0.252	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	136.7	175.3	59.5	0	0	0	0	112.1	W130 T183	W130-S175 VanDerWaalsContact CE2-CB 3.44Å; W130-S175 VanDerWaalsContact NE1-CB 3.31Å; W130-S175 PolarHBondContact NE1-OG 3.29Å; S175-T183 CarbonylContact C-O 3.35Å; S175-T183 WeakPolarHBondContact CA-O 3.35Å
176	G	68	Low	74.9	Confident	20 Å²	20	47.5 Å²	47.5	21%	0.206	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.3	164.2	0	0	0	0	0	109.7	T183	G176-T183 PolarHBondContact N-O 2.91Å; G176-T183 PolarHBondContact O-N 3.41Å; G176-T183 PolarHBondContact O-OG1 3.29Å
177	K	63.7	Low	74.8	Confident	120 Å²	120	45.3 Å²	45.3	52%	0.522	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.8	177.4	-169.6	171.2	-179.7	172.3	0	110.3	L182	K177-L182 HydrophobicContact CB-CD1 4.25Å; K177-L182 HydrophobicContact CG-CD1 4.5Å
178	T	57.5	Low	74.9	Confident	32 Å²	32	42 Å²	42	20%	0.196	23%	0.232	C	C	.	.			trans	-107.3	172.6	165.7	60.3	0	0	0	0	109.1	S180 S181 P250	T178-S180 PolarHBondContact O-N 3.36Å; T178-S181 PolarHBondContact N-O 3.2Å; T178-S181 PolarHBondContact OG1-N 2.88Å; T178-S181 PolarHBondContact OG1-O 2.83Å; T178-S181 PolarHBondContact OG1-OG 2.93Å; T178-P250 HydrophobicContact CG2-CB 4.43Å
179	E	57.4	Low	74.8	Confident	211 Å²	211	42.6 Å²	42.6	99%	0.986	23%	0.234	S	C	*	.	S	Bend	trans	-56.9	-32.3	177.6	-67.5	-173.7	167.8	0	0	113
180	S	58.5	Low	74.7	Confident	118 Å²	118	38 Å²	38	83%	0.825	21%	0.21	S	C	*	.	S	Bend	trans	-112.6	-20.1	-172.8	58.9	0	0	0	0	115.2	T178	T178-S180 PolarHBondContact O-N 3.36Å
181	S	64.9	Low	74.1	Confident	43 Å²	43	36.4 Å²	36.4	30%	0.301	20%	0.203	S	C	.	.			trans	-141.4	141.5	-175.4	69.8	0	0	0	0	113.1	T178	T178-S181 PolarHBondContact N-O 3.2Å; T178-S181 PolarHBondContact OG1-N 2.88Å; T178-S181 PolarHBondContact OG1-O 2.83Å; T178-S181 PolarHBondContact OG1-OG 2.93Å
182	L	72.6	Confident	73.1	Confident	20 Å²	20	40.2 Å²	40.2	11%	0.105	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.1	169.9	176.9	70.6	0	0	0	107.6	W130 K177 I214	W130-L182 HydrophobicContact CH2-CD1 3.84Å; W130-L182 HydrophobicContact CH2-CD2 3.44Å; W130-L182 VanDerWaalsContact CH2-CD2 3.44Å; W130-L182 HydrophobicContact CH2-CG 4.2Å; W130-L182 HydrophobicContact CZ2-CD1 4.07Å; W130-L182 HydrophobicContact CZ2-CD2 4.45Å; W130-L182 HydrophobicContact CZ3-CD2 3.88Å; K177-L182 HydrophobicContact CB-CD1 4.25Å; K177-L182 HydrophobicContact CG-CD1 4.5Å; L182-I214 HydrophobicContact CB-CB 4.38Å; L182-I214 HydrophobicContact CD2-CB 4.01Å; L182-I214 HydrophobicContact CD2-CD1 4.13Å; L182-I214 HydrophobicContact CD2-CG2 4.12Å; L182-I214 HydrophobicContact CG-CB 4.28Å; L182-I214 PolarHBondContact O-N 3.27Å
183	T	75.7	Confident	72	Confident	6 Å²	6	46.8 Å²	46.8	4%	0.037	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	145.7	170.1	58.8	0	0	0	0	109.9	S175 G176 Y212 P250	S175-T183 CarbonylContact C-O 3.35Å; S175-T183 WeakPolarHBondContact CA-O 3.35Å; G176-T183 PolarHBondContact N-O 2.91Å; G176-T183 PolarHBondContact O-N 3.41Å; G176-T183 PolarHBondContact O-OG1 3.29Å; T183-Y212 CarbonylContact C-O 3.52Å; T183-Y212 WeakPolarHBondContact CA-O 3.34Å; T183-P250 HydrophobicContact CG2-CB 3.73Å; T183-P250 PolarHBondContact OG1-O 3.21Å
184	I	78.4	Confident	70.5	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.015	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127	172.2	-70.3	-166.8	0	0	0	109.2	W130 V139 I173 V174 T211 Y212 I214	W130-I184 HydrophobicContact CD2-CD1 3.81Å; W130-I184 HydrophobicContact CE3-CD1 3.3Å; W130-I184 HydrophobicContact CE3-CG1 4.45Å; W130-I184 HydrophobicContact CG-CD1 4.44Å; W130-I184 HydrophobicContact CH2-CD1 4.39Å; W130-I184 HydrophobicContact CZ3-CD1 3.65Å; V139-I184 HydrophobicContact CB-CD1 3.82Å; V139-I184 HydrophobicContact CG1-CD1 4.12Å; V139-I184 HydrophobicContact CG2-CD1 3.55Å; I173-I184 HydrophobicContact CG2-CD1 4.32Å; I173-I184 HydrophobicContact CG2-CG2 3.44Å; I173-I184 VanDerWaalsContact CG2-CG2 3.44Å; V174-I184 CarbonylContact O-C 3.59Å; V174-I184 WeakPolarHBondContact O-CA 3.37Å; I184-T211 CarbonylContact O-C 3.52Å; I184-T211 WeakPolarHBondContact O-CA 3.44Å; I184-Y212 PolarHBondContact N-O 3.45Å; I184-Y212 PolarHBondContact O-N 2.95Å; I184-I214 HydrophobicContact CB-CD1 4.06Å; I184-I214 HydrophobicContact CD1-CD1 3.18Å; I184-I214 HydrophobicContact CD1-CG1 4.44Å; I184-I214 HydrophobicContact CG1-CD1 3.42Å; I184-I214 VanDerWaalsContact CG1-CD1 3.42Å; I184-I214 HydrophobicContact CG1-CG1 4.27Å
185	S	77.1	Confident	68.9	Low	6 Å²	6	52.8 Å²	52.8	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	115	171.4	-60.4	0	0	0	0	109.3	V174 R210 T211	V174-S185 PolarHBondContact N-O 3.08Å; V174-S185 PolarHBondContact O-N 3.17Å; S185-R210 CarbonylContact C-O 3.51Å; S185-R210 WeakPolarHBondContact CA-O 3.4Å; S185-T211 PolarHBondContact OG-OG1 2.87Å
186	L	80.1	Confident	67.3	Low	2 Å²	2	59.6 Å²	59.6	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	131.8	169.2	177.4	62	0	0	0	109.3	A141 V146 M163 I171 I173 E188 I209 R210 Y212	A141-L186 HydrophobicContact CB-CD1 3.29Å; A141-L186 HydrophobicContact CB-CD2 4.37Å; A141-L186 HydrophobicContact CB-CG 4.46Å; V146-L186 HydrophobicContact CB-CD2 4.33Å; M163-L186 HydrophobicContact CE-CD2 4.47Å; I171-L186 HydrophobicContact CG2-CD1 3.39Å; I173-L186 HydrophobicContact CG1-CD1 4.26Å; L186-E188 HydrophobicContact CD2-CG 4.4Å; L186-E188 VanDerWaalsContact CD2-OE1 3.25Å; L186-E188 WeakPolarHBondContact CD2-OE1 3.22Å; L186-E188 HydrophobicContact CG-CG 4.27Å; L186-I209 CarbonylContact O-C 3.59Å; L186-I209 VanDerWaalsContact O-CA 3.27Å; L186-I209 WeakPolarHBondContact O-CA 3.43Å; L186-R210 HydrophobicContact CB-CB 4.32Å; L186-R210 PolarHBondContact N-O 2.79Å; L186-R210 PolarHBondContact O-N 3.04Å; L186-Y212 HydrophobicContact CB-CE2 4.22Å
187	V	77.7	Confident	66	Low	5 Å²	5	67.1 Å²	67.1	3%	0.03	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	113.1	-177.2	-175.5	0	0	0	0	109.1	I171 N172 V174 I207 I208 I243	I171-V187 CarbonylContact C-O 3.5Å; I171-V187 VanDerWaalsContact CA-O 3.29Å; I171-V187 WeakPolarHBondContact CA-O 3.13Å; N172-V187 HydrophobicContact CB-CB 4.38Å; N172-V187 PolarHBondContact N-O 2.91Å; N172-V187 WeakPolarHBondContact O-CB 3.09Å; N172-V187 PolarHBondContact O-N 2.7Å; V174-V187 HydrophobicContact CG2-CG2 4.29Å; V187-I207 HydrophobicContact CG1-CG2 4.06Å; V187-I208 WeakPolarHBondContact CA-O 3.3Å; V187-I243 HydrophobicContact CB-CD1 3.89Å; V187-I243 HydrophobicContact CG1-CD1 3.43Å; V187-I243 VanDerWaalsContact CG1-CD1 3.43Å; V187-I243 HydrophobicContact CG2-CB 4.27Å; V187-I243 HydrophobicContact CG2-CD1 3.19Å; V187-I243 HydrophobicContact CG2-CG1 4.24Å
188	E	83	Confident	65	Low	3 Å²	3	69 Å²	69	1%	0.014	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.1	179.3	-64.7	153.8	-153.1	0	0	109	P168 I171 L186 Y190 I207 I208 R210	P168-E188 HydrophobicContact CB-CB 4.15Å; I171-E188 HydrophobicContact CG1-CG 4.39Å; L186-E188 HydrophobicContact CD2-CG 4.4Å; L186-E188 VanDerWaalsContact CD2-OE1 3.25Å; L186-E188 WeakPolarHBondContact CD2-OE1 3.22Å; L186-E188 HydrophobicContact CG-CG 4.27Å; E188-Y190 HydrophobicContact CB-CD2 4.36Å; E188-Y190 HydrophobicContact CB-CE2 3.58Å; E188-Y190 PolarHBondContact OE2-OH 2.61Å; E188-I207 CarbonylContact O-C 3.55Å; E188-I207 WeakPolarHBondContact O-CA 3.06Å; E188-I208 HydrophobicContact CB-CB 4.24Å; E188-I208 PolarHBondContact N-O 3.49Å; E188-I208 PolarHBondContact O-N 3.11Å; E188-R210 WeakPolarHBondContact OE1-CD 3.47Å; E188-R210 IonicContact OE1-NE 3.11Å; E188-R210 PolarHBondContact OE1-NE 2.85Å; E188-R210 VanDerWaalsContact OE1-NE 3.11Å; E188-R210 IonicContact OE2-NE 3.68Å; E188-R210 IonicContact OE2-NH2 3.98Å
189	K	81	Confident	64.3	Low	15 Å²	15	74.5 Å²	74.5	7%	0.065	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.8	175.2	-59.1	-177.2	-170.2	165.8	0	110	N169 Q170 L204 I207 C241	N169-K189 PolarHBondContact N-O 2.78Å; Q170-K189 HydrophobicContact CB-CB 4.31Å; Q170-K189 HydrophobicContact CB-CD 4.3Å; Q170-K189 PolarHBondContact N-O 3.25Å; Q170-K189 PolarHBondContact O-N 3.21Å; K189-L204 HydrophobicContact CB-CD2 4.13Å; K189-I207 HydrophobicContact CG-CG1 4.4Å; K189-C241 WeakPolarHBondContact CE-O 3.45Å; K189-C241 PolarHBondContact NZ-O 3.28Å
190	Y	81.5	Confident	63.7	Low	5 Å²	5	71.4 Å²	71.4	2%	0.02	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.4	178.1	-66.3	-88.9	0	0	0	110.5	S166 P168 E188 S205 Y206 I208	S166-Y190 VanDerWaalsContact O-CE1 3.28Å; S166-Y190 WeakPolarHBondContact O-CE1 3.48Å; S166-Y190 WeakPolarHBondContact OG-CE1 3.38Å; P168-Y190 VanDerWaalsContact CA-CE1 3.46Å; P168-Y190 HydrophobicContact CB-CD1 4.35Å; P168-Y190 HydrophobicContact CB-CE1 3.86Å; P168-Y190 HydrophobicContact CB-CE2 4.31Å; E188-Y190 HydrophobicContact CB-CD2 4.36Å; E188-Y190 HydrophobicContact CB-CE2 3.58Å; E188-Y190 PolarHBondContact OE2-OH 2.61Å; Y190-S205 PolarHBondContact O-N 3.12Å; Y190-S205 PolarHBondContact O-OG 3.27Å; Y190-Y206 HydrophobicContact CD1-CE2 4.23Å; Y190-Y206 AromaticContact CD2-CD2 3.66Å; Y190-Y206 HydrophobicContact CD2-CD2 3.66Å; Y190-Y206 AromaticContact CD2-CE2 3.18Å; Y190-Y206 HydrophobicContact CD2-CE2 3.18Å; Y190-Y206 AromaticContact CD2-CZ 3.78Å; Y190-Y206 HydrophobicContact CE2-CD2 4.42Å; Y190-Y206 AromaticContact CE2-CE2 3.73Å; Y190-Y206 HydrophobicContact CE2-CE2 3.73Å; Y190-Y206 HydrophobicContact CG-CD2 4.11Å; Y190-Y206 HydrophobicContact CG-CE1 4.21Å; Y190-Y206 AromaticContact CG-CE2 3.45Å; Y190-Y206 HydrophobicContact CG-CE2 3.45Å; Y190-Y206 VanDerWaalsContact CG-CE2 3.45Å; Y190-Y206 AromaticContact CG-CZ 3.51Å; Y190-Y206 PolarHBondContact N-O 3.19Å; Y190-I208 HydrophobicContact CD2-CG1 4.49Å; Y190-I208 HydrophobicContact CE2-CB 4.45Å; Y190-I208 HydrophobicContact CE2-CD1 3.89Å; Y190-I208 HydrophobicContact CE2-CG1 4.14Å
191	L	73.7	Confident	63.2	Low	43 Å²	43	69.7 Å²	69.7	23%	0.225	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.6	170.2	-85.9	80.9	0	0	0	109.1	N169 P202 E203 L204	N169-L191 HydrophobicContact CB-CD1 3.72Å; L191-P202 HydrophobicContact CD2-CB 3.4Å; L191-P202 VanDerWaalsContact CD2-CB 3.4Å; L191-P202 HydrophobicContact CD2-CG 3.53Å; L191-P202 WeakPolarHBondContact CD2-O 3.3Å; L191-E203 CarbonylContact C-O 3.56Å; L191-E203 VanDerWaalsContact CA-O 3.25Å; L191-E203 WeakPolarHBondContact CA-O 3.3Å; L191-E203 WeakPolarHBondContact CB-O 3.39Å; L191-E203 WeakPolarHBondContact CG-O 3.4Å; L191-L204 HydrophobicContact CD1-CD2 3.42Å; L191-L204 VanDerWaalsContact CD1-CD2 3.42Å; L191-L204 HydrophobicContact CD1-CG 3.85Å; L191-L204 HydrophobicContact CG-CD2 4.16Å; L191-L204 HydrophobicContact CG-CG 4.14Å
192	D	64.6	Low	62.4	Low	84 Å²	84	71.7 Å²	71.7	45%	0.449	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.9	169.8	-165.6	-0.5	0	0	0	109.7	S194 E203	D192-S194 VanDerWaalsContact OD1-CB 3.26Å; D192-S194 WeakPolarHBondContact OD1-CB 3.33Å; D192-S194 PolarHBondContact OD1-N 2.83Å; D192-S194 PolarHBondContact OD1-OG 2.91Å; D192-S194 VanDerWaalsContact OD1-OG 3.04Å; D192-S194 PolarHBondContact OD2-OG 3.39Å; D192-E203 PolarHBondContact N-O 3.23Å
193	K	59	Low	61.7	Low	178 Å²	178	74 Å²	74	77%	0.774	42%	0.415	S	S	*	.			trans	-101.5	-0.2	175.5	-67.6	-175.3	-179.4	177.5	0	112.1	G195	K193-G195 PolarHBondContact O-N 3.43Å
194	S	51.6	Low	60.8	Low	91 Å²	91	74.9 Å²	74.9	64%	0.636	42%	0.419	S	S	*	.			trans	-71.7	10.3	-172.7	73.1	0	0	0	0	115.5	D192 H196	D192-S194 VanDerWaalsContact OD1-CB 3.26Å; D192-S194 WeakPolarHBondContact OD1-CB 3.33Å; D192-S194 PolarHBondContact OD1-N 2.83Å; D192-S194 PolarHBondContact OD1-OG 2.91Å; D192-S194 VanDerWaalsContact OD1-OG 3.04Å; D192-S194 PolarHBondContact OD2-OG 3.39Å; S194-H196 PolarHBondContact O-N 3.26Å
195	G	45.5	Very low	60.2	Low	67 Å²	67	76 Å²	76	69%	0.691	43%	0.427	S	S	*	.			trans	-66.1	123.2	171.6	0	0	0	0	0	112	K193	K193-G195 PolarHBondContact O-N 3.43Å
196	H	42.2	Very low	59.9	Low	180 Å²	180	78.6 Å²	78.6	83%	0.833	44%	0.436	S	S	*	.			trans	-38.2	140.1	166	-83.3	-80	0	0	0	112.5	S194 D198	S194-H196 PolarHBondContact O-N 3.26Å; H196-D198 PolarHBondContact O-N 3.31Å
197	L	41.1	Very low	59.8	Low	177 Å²	177	78.5 Å²	78.5	93%	0.927	44%	0.436	S	S	*	.	S	Bend	trans	-6.6	-1.7	167.9	-134.4	81.1	0	0	0	123	I199	L197-I199 PolarHBondContact O-N 2.81Å
198	D	41.8	Very low	59.8	Low	160 Å²	160	78.3 Å²	78.3	86%	0.856	44%	0.435	S	S	*	.			trans	-75.7	116.8	169	-86.8	-24.6	0	0	0	110.1	H196 D200	H196-D198 PolarHBondContact O-N 3.31Å; D198-D200 PolarHBondContact O-N 3.19Å; D198-D200 VanDerWaalsContact O-N 3.08Å
199	I	42.3	Very low	59.6	Low	148 Å²	148	78.1 Å²	78.1	76%	0.759	43%	0.434	S	S	*	.			trans	-59.8	103.1	168.6	-60.8	155.8	0	0	0	106.5	L197	L197-I199 PolarHBondContact O-N 2.81Å
200	D	45.1	Very low	59.6	Low	146 Å²	146	77.7 Å²	77.7	78%	0.781	43%	0.432	S	S	*	.	S	Bend	trans	167.5	128.8	140.8	-82	-28	0	0	0	112.4	D198	D198-D200 PolarHBondContact O-N 3.19Å; D198-D200 VanDerWaalsContact O-N 3.08Å
201	A	47.3	Very low	59.4	Low	81 Å²	81	77.6 Å²	77.6	67%	0.669	43%	0.432	S	S	*	.			trans	57.1	123.5	169.1	0	0	0	0	0	118.8
202	P	49.5	Very low	59.7	Low	86 Å²	86	75.6 Å²	75.6	56%	0.558	42%	0.421	S	S	*	.			trans	-66.8	140.8	169	35.5	-37.7	0	0	0	109.2	L191	L191-P202 HydrophobicContact CD2-CB 3.4Å; L191-P202 VanDerWaalsContact CD2-CB 3.4Å; L191-P202 HydrophobicContact CD2-CG 3.53Å; L191-P202 WeakPolarHBondContact CD2-O 3.3Å
203	E	57.1	Low	60.3	Low	67 Å²	67	73.9 Å²	73.9	31%	0.313	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.5	-172.7	-75.2	-177.9	-169.7	0	0	111.9	L191 D192 S205 S233 R262	L191-E203 CarbonylContact C-O 3.56Å; L191-E203 VanDerWaalsContact CA-O 3.25Å; L191-E203 WeakPolarHBondContact CA-O 3.3Å; L191-E203 WeakPolarHBondContact CB-O 3.39Å; L191-E203 WeakPolarHBondContact CG-O 3.4Å; D192-E203 PolarHBondContact N-O 3.23Å; E203-S205 PolarHBondContact O-N 2.03Å; E203-S233 VanDerWaalsContact CB-OG 3.28Å; E203-S233 WeakPolarHBondContact CB-OG 3.35Å; E203-S233 VanDerWaalsContact CD-OG 3.24Å; E203-S233 WeakPolarHBondContact OE2-CB 3.38Å; E203-S233 PolarHBondContact OE2-OG 2.9Å; E203-R262 IonicContact OE1-CZ 2.86Å; E203-R262 IonicContact OE1-NH1 3.43Å; E203-R262 IonicContact OE1-NH2 2.91Å; E203-R262 PolarHBondContact OE1-NH2 2.7Å
204	L	57.9	Low	60.9	Low	26 Å²	26	66 Å²	66	14%	0.136	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	120.5	174.9	-83.1	158.1	0	0	0	110.3	K189 L191 Q238	K189-L204 HydrophobicContact CB-CD2 4.13Å; L191-L204 HydrophobicContact CD1-CD2 3.42Å; L191-L204 VanDerWaalsContact CD1-CD2 3.42Å; L191-L204 HydrophobicContact CD1-CG 3.85Å; L191-L204 HydrophobicContact CG-CD2 4.16Å; L191-L204 HydrophobicContact CG-CG 4.14Å; L204-Q238 HydrophobicContact CB-CB 4.24Å; L204-Q238 VanDerWaalsContact CB-OE1 3.24Å; L204-Q238 HydrophobicContact CD1-CB 3.75Å; L204-Q238 VanDerWaalsContact CD1-OE1 3.27Å
205	S	64.4	Low	61.6	Low	26 Å²	26	64.3 Å²	64.3	18%	0.182	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-48	-173.7	58.2	0	0	0	0	112.7	Y190 E203 I231	Y190-S205 PolarHBondContact O-N 3.12Å; Y190-S205 PolarHBondContact O-OG 3.27Å; E203-S205 PolarHBondContact O-N 2.03Å; S205-I231 PolarHBondContact O-N 2.7Å
206	Y	72.7	Confident	62.5	Low	60 Å²	60	67 Å²	67	24%	0.235	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	158.4	177.4	61.4	-86.8	0	0	0	113	S166 Y190 I208 Y229	S166-Y206 PolarHBondContact OG-OH 2.73Å; S166-Y206 VanDerWaalsContact OG-OH 3.06Å; Y190-Y206 HydrophobicContact CD1-CE2 4.23Å; Y190-Y206 AromaticContact CD2-CD2 3.66Å; Y190-Y206 HydrophobicContact CD2-CD2 3.66Å; Y190-Y206 AromaticContact CD2-CE2 3.18Å; Y190-Y206 HydrophobicContact CD2-CE2 3.18Å; Y190-Y206 AromaticContact CD2-CZ 3.78Å; Y190-Y206 HydrophobicContact CE2-CD2 4.42Å; Y190-Y206 AromaticContact CE2-CE2 3.73Å; Y190-Y206 HydrophobicContact CE2-CE2 3.73Å; Y190-Y206 HydrophobicContact CG-CD2 4.11Å; Y190-Y206 HydrophobicContact CG-CE1 4.21Å; Y190-Y206 AromaticContact CG-CE2 3.45Å; Y190-Y206 HydrophobicContact CG-CE2 3.45Å; Y190-Y206 VanDerWaalsContact CG-CE2 3.45Å; Y190-Y206 AromaticContact CG-CZ 3.51Å; Y190-Y206 PolarHBondContact N-O 3.19Å; Y206-I208 HydrophobicContact CD2-CD1 4.1Å; Y206-I208 HydrophobicContact CD2-CG1 3.92Å; Y206-I208 HydrophobicContact CE2-CD1 3.78Å; Y206-I208 HydrophobicContact CE2-CG1 4.09Å; Y206-Y229 CarbonylContact C-O 3.56Å; Y206-Y229 WeakPolarHBondContact CA-O 3.23Å; Y206-Y229 VanDerWaalsContact CB-O 3.3Å; Y206-Y229 WeakPolarHBondContact CB-O 3.14Å
207	I	76.7	Confident	63.4	Low	1 Å²	1	61.3 Å²	61.3	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.9	179.2	-61	173.4	0	0	0	108.5	V187 E188 K189 I209 Y229 I231 C241 V255	V187-I207 HydrophobicContact CG1-CG2 4.06Å; E188-I207 CarbonylContact O-C 3.55Å; E188-I207 WeakPolarHBondContact O-CA 3.06Å; K189-I207 HydrophobicContact CG-CG1 4.4Å; I207-I209 HydrophobicContact CG2-CG1 4.26Å; I207-Y229 PolarHBondContact N-O 2.87Å; I207-Y229 PolarHBondContact O-N 3.09Å; I207-I231 HydrophobicContact CD1-CD1 3.68Å; I207-I231 HydrophobicContact CG1-CD1 3.82Å; I207-C241 HydrophobicContact CD1-CB 4.05Å; I207-V255 HydrophobicContact CD1-CG1 4.41Å
208	I	78.4	Confident	64.3	Low	0 Å²	0	53 Å²	53	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.9	174.9	-60.5	-176.9	0	0	0	109.3	N164 V187 E188 Y190 Y206 R210 I226 K227 N228	N164-I208 WeakPolarHBondContact ND2-CD1 3.43Å; V187-I208 WeakPolarHBondContact CA-O 3.3Å; E188-I208 HydrophobicContact CB-CB 4.24Å; E188-I208 PolarHBondContact N-O 3.49Å; E188-I208 PolarHBondContact O-N 3.11Å; Y190-I208 HydrophobicContact CD2-CG1 4.49Å; Y190-I208 HydrophobicContact CE2-CB 4.45Å; Y190-I208 HydrophobicContact CE2-CD1 3.89Å; Y190-I208 HydrophobicContact CE2-CG1 4.14Å; Y206-I208 HydrophobicContact CD2-CD1 4.1Å; Y206-I208 HydrophobicContact CD2-CG1 3.92Å; Y206-I208 HydrophobicContact CE2-CD1 3.78Å; Y206-I208 HydrophobicContact CE2-CG1 4.09Å; I208-R210 HydrophobicContact CG2-CG 4.12Å; I208-I226 HydrophobicContact CG2-CG2 4.38Å; I208-K227 WeakPolarHBondContact CA-O 3.31Å; I208-N228 HydrophobicContact CG1-CB 4.45Å
209	I	78.1	Confident	65.1	Low	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.6	177.6	-53.3	168.3	0	0	0	109	L186 I207 I226 K227 Y229 I243 V255 V274	L186-I209 CarbonylContact O-C 3.59Å; L186-I209 VanDerWaalsContact O-CA 3.27Å; L186-I209 WeakPolarHBondContact O-CA 3.43Å; I207-I209 HydrophobicContact CG2-CG1 4.26Å; I209-I226 WeakPolarHBondContact O-CA 3.34Å; I209-K227 PolarHBondContact N-O 3.2Å; I209-K227 PolarHBondContact O-N 3.23Å; I209-Y229 HydrophobicContact CD1-CD2 3.9Å; I209-Y229 HydrophobicContact CD1-CE2 3.5Å; I209-Y229 HydrophobicContact CG1-CD2 4.41Å; I209-Y229 HydrophobicContact CG1-CE2 4.28Å; I209-I243 HydrophobicContact CD1-CD1 3.77Å; I209-I243 HydrophobicContact CG1-CD1 3.99Å; I209-V255 HydrophobicContact CD1-CG2 3.12Å; I209-V255 HydrophobicContact CG1-CG2 4.36Å; I209-V274 HydrophobicContact CD1-CG2 3.83Å; I209-V274 HydrophobicContact CG2-CG2 4.05Å
210	R	80.7	Confident	66.2	Low	6 Å²	6	50.7 Å²	50.7	2%	0.023	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120	177.4	-57.5	176.1	-173.4	-100.6	-2.7	109.2	N162 M163 S185 L186 E188 I208 Y212 V225 I226	N162-R210 VanDerWaalsContact O-CZ 3.29Å; N162-R210 PolarHBondContact O-NH1 3.38Å; N162-R210 PolarHBondContact O-NH2 3.44Å; M163-R210 PolarHBondContact SD-NE 3.28Å; M163-R210 VanDerWaalsContact SD-NE 3.44Å; S185-R210 CarbonylContact C-O 3.51Å; S185-R210 WeakPolarHBondContact CA-O 3.4Å; L186-R210 HydrophobicContact CB-CB 4.32Å; L186-R210 PolarHBondContact N-O 2.79Å; L186-R210 PolarHBondContact O-N 3.04Å; E188-R210 WeakPolarHBondContact OE1-CD 3.47Å; E188-R210 IonicContact OE1-NE 3.11Å; E188-R210 PolarHBondContact OE1-NE 2.85Å; E188-R210 VanDerWaalsContact OE1-NE 3.11Å; E188-R210 IonicContact OE2-NE 3.68Å; E188-R210 IonicContact OE2-NH2 3.98Å; I208-R210 HydrophobicContact CG2-CG 4.12Å; R210-Y212 HydrophobicContact CB-CD2 4.44Å; R210-Y212 HydrophobicContact CB-CE2 3.58Å; R210-V225 WeakPolarHBondContact CA-O 3.35Å; R210-I226 HydrophobicContact CG-CG1 4.26Å; R210-I226 HydrophobicContact CG-CG2 4.27Å
211	T	78.4	Confident	67.2	Low	2 Å²	2	44.4 Å²	44.4	1%	0.012	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.4	-178.7	-50.4	0	0	0	0	110.7	I184 S185 P223 M224 V225	I184-T211 CarbonylContact O-C 3.52Å; I184-T211 WeakPolarHBondContact O-CA 3.44Å; S185-T211 PolarHBondContact OG-OG1 2.87Å; T211-P223 CarbonylContact O-C 3.53Å; T211-P223 WeakPolarHBondContact O-CA 3.18Å; T211-M224 PolarHBondContact O-N 3.05Å; T211-V225 PolarHBondContact N-O 2.74Å
212	Y	79.4	Confident	68.3	Low	1 Å²	1	44.2 Å²	44.2	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.4	-179.3	-61.8	-91.3	0	0	0	110	V146 D160 T183 I184 L186 R210 L221 P223	V146-Y212 HydrophobicContact CG1-CE1 3.96Å; V146-Y212 HydrophobicContact CG1-CE2 3.85Å; D160-Y212 HydrophobicContact CB-CE1 4.14Å; D160-Y212 VanDerWaalsContact OD2-CE1 3.31Å; D160-Y212 WeakPolarHBondContact OD2-CE1 3.48Å; D160-Y212 PolarHBondContact OD2-OH 2.94Å; T183-Y212 CarbonylContact C-O 3.52Å; T183-Y212 WeakPolarHBondContact CA-O 3.34Å; I184-Y212 PolarHBondContact N-O 3.45Å; I184-Y212 PolarHBondContact O-N 2.95Å; L186-Y212 HydrophobicContact CB-CE2 4.22Å; R210-Y212 HydrophobicContact CB-CD2 4.44Å; R210-Y212 HydrophobicContact CB-CE2 3.58Å; Y212-L221 HydrophobicContact CD1-CB 4.06Å; Y212-L221 HydrophobicContact CD1-CD2 3.73Å; Y212-L221 HydrophobicContact CD1-CG 4.49Å; Y212-L221 HydrophobicContact CE1-CB 4.37Å; Y212-L221 HydrophobicContact CG-CD2 3.88Å; Y212-P223 HydrophobicContact CD1-CB 4.17Å; Y212-P223 HydrophobicContact CE1-CB 3.71Å; Y212-P223 HydrophobicContact CE1-CG 4.09Å
213	P	77.2	Confident	69.2	Low	48 Å²	48	41.9 Å²	41.9	31%	0.312	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.4	165.9	30.7	-29.8	0	0	0	109	P215 M224	P213-P215 VanDerWaalsContact O-CD 3.24Å; P213-P215 WeakPolarHBondContact O-CD 3.14Å; P213-M224 HydrophobicContact CG-CB 4.35Å
214	I	71.1	Confident	70	Confident	12 Å²	12	43.5 Å²	43.5	6%	0.062	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	104.8	176.5	-59.6	-173.1	0	0	0	108.2	I137 V139 L182 I184	I137-I214 HydrophobicContact CD1-CG2 3.68Å; V139-I214 HydrophobicContact CG2-CD1 3.74Å; L182-I214 HydrophobicContact CB-CB 4.38Å; L182-I214 HydrophobicContact CD2-CB 4.01Å; L182-I214 HydrophobicContact CD2-CD1 4.13Å; L182-I214 HydrophobicContact CD2-CG2 4.12Å; L182-I214 HydrophobicContact CG-CB 4.28Å; L182-I214 PolarHBondContact O-N 3.27Å; I184-I214 HydrophobicContact CB-CD1 4.06Å; I184-I214 HydrophobicContact CD1-CD1 3.18Å; I184-I214 HydrophobicContact CD1-CG1 4.44Å; I184-I214 HydrophobicContact CG1-CD1 3.42Å; I184-I214 VanDerWaalsContact CG1-CD1 3.42Å; I184-I214 HydrophobicContact CG1-CG1 4.27Å
215	P	67.4	Low	70.5	Confident	57 Å²	57	44.1 Å²	44.1	37%	0.37	25%	0.253	S	S	.	.			trans	-64.9	151.6	170.1	27.5	-31.9	0	0	0	109.2	P213 S217 G218	P213-P215 VanDerWaalsContact O-CD 3.24Å; P213-P215 WeakPolarHBondContact O-CD 3.14Å; P215-S217 PolarHBondContact O-N 2.97Å; P215-G218 PolarHBondContact O-N 3.48Å
216	S	63.7	Low	70.9	Confident	123 Å²	123	46.5 Å²	46.5	86%	0.86	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-22	174.5	51.5	0	0	0	0	113.6
217	S	61.9	Low	70.9	Confident	60 Å²	60	46.1 Å²	46.1	42%	0.42	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-15.1	175.3	60.8	0	0	0	0	114.9	P215 L219	P215-S217 PolarHBondContact O-N 2.97Å; S217-L219 PolarHBondContact O-N 2.6Å
218	G	59.3	Low	70.9	Confident	2 Å²	2	50.9 Å²	50.9	2%	0.021	29%	0.288	C	S	.	.			trans	68.9	7.5	178.1	0	0	0	0	0	116.6	S158 P215 Q220	S158-G218 PolarHBondContact OG-O 3.39Å; P215-G218 PolarHBondContact O-N 3.48Å; G218-Q220 PolarHBondContact O-N 2.87Å
219	L	58.4	Low	70.8	Confident	126 Å²	126	51.1 Å²	51.1	66%	0.66	29%	0.289	S	S	*	.			trans	-76.4	-24.1	-161.2	-80.7	162.2	0	0	0	116.3	S217	S217-L219 PolarHBondContact O-N 2.6Å
220	Q	66.5	Low	70.4	Confident	135 Å²	135	56.1 Å²	56.1	63%	0.631	32%	0.319	S	S	*	.			trans	-146.7	113.9	-176	-154	171.7	4.6	0	0	112.9	G218 T222	G218-Q220 PolarHBondContact O-N 2.87Å; Q220-T222 HydrophobicContact CG-CG2 4.27Å; Q220-T222 PolarHBondContact O-N 2.76Å
221	L	65.4	Low	69.8	Low	13 Å²	13	56.2 Å²	56.2	7%	0.068	32%	0.32	C	S	.	.			trans	-88.5	94.2	168	-79.2	169.5	0	0	0	108.7	V146 T148 S158 D160 Y212	V146-L221 HydrophobicContact CG1-CD1 4.33Å; V146-L221 HydrophobicContact CG2-CD1 4.45Å; T148-L221 WeakPolarHBondContact OG1-CD1 3.35Å; T148-L221 WeakPolarHBondContact OG1-CG 3.2Å; S158-L221 WeakPolarHBondContact OG-CG 3.27Å; D160-L221 HydrophobicContact CB-CB 4.43Å; Y212-L221 HydrophobicContact CD1-CB 4.06Å; Y212-L221 HydrophobicContact CD1-CD2 3.73Å; Y212-L221 HydrophobicContact CD1-CG 4.49Å; Y212-L221 HydrophobicContact CE1-CB 4.37Å; Y212-L221 HydrophobicContact CG-CD2 3.88Å
222	T	69.9	Low	69	Low	77 Å²	77	59.1 Å²	59.1	47%	0.472	34%	0.339	S	S	.	.			trans	-115.1	128.8	161.9	45.8	0	0	0	0	108.4	Q220 M224	Q220-T222 HydrophobicContact CG-CG2 4.27Å; Q220-T222 PolarHBondContact O-N 2.76Å; T222-M224 PolarHBondContact O-N 3.03Å
223	P	68.5	Low	68	Low	37 Å²	37	60.1 Å²	60.1	24%	0.24	35%	0.346	C	S	.	.			trans	-67.2	122.9	179.6	26.9	-30.7	0	0	0	108.5	T211 Y212 I226	T211-P223 CarbonylContact O-C 3.53Å; T211-P223 WeakPolarHBondContact O-CA 3.18Å; Y212-P223 HydrophobicContact CD1-CB 4.17Å; Y212-P223 HydrophobicContact CE1-CB 3.71Å; Y212-P223 HydrophobicContact CE1-CG 4.09Å; P223-I226 HydrophobicContact CB-CD1 4.24Å; P223-I226 HydrophobicContact CB-CG1 3.94Å; P223-I226 HydrophobicContact CG-CD1 3.89Å; P223-I226 HydrophobicContact CG-CG1 4.16Å
224	M	73.5	Confident	67.1	Low	102 Å²	102	62.3 Å²	62.3	50%	0.502	36%	0.363	S	S	.	.	S	Bend	trans	-75.6	-32.8	175.9	-174	176.6	74.3	0	0	111	T211 P213 T222 T251	T211-M224 PolarHBondContact O-N 3.05Å; P213-M224 HydrophobicContact CG-CB 4.35Å; T222-M224 PolarHBondContact O-N 3.03Å; M224-T251 HydrophobicContact CE-CG2 3.33Å
225	V	69.8	Low	66.3	Low	38 Å²	38	64.6 Å²	64.6	23%	0.23	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	131.3	-178.4	-177.6	0	0	0	0	109.6	R210 T211 K227 V274	R210-V225 WeakPolarHBondContact CA-O 3.35Å; T211-V225 PolarHBondContact N-O 2.74Å; V225-K227 HydrophobicContact CG1-CG 3.95Å; V225-V274 HydrophobicContact CG1-CG1 4.24Å
226	I	71.2	Confident	65.9	Low	76 Å²	76	64 Å²	64	39%	0.39	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.5	171.1	-56.3	173.5	0	0	0	107.7	I208 I209 R210 P223	I208-I226 HydrophobicContact CG2-CG2 4.38Å; I209-I226 WeakPolarHBondContact O-CA 3.34Å; R210-I226 HydrophobicContact CG-CG1 4.26Å; R210-I226 HydrophobicContact CG-CG2 4.27Å; P223-I226 HydrophobicContact CB-CD1 4.24Å; P223-I226 HydrophobicContact CB-CG1 3.94Å; P223-I226 HydrophobicContact CG-CD1 3.89Å; P223-I226 HydrophobicContact CG-CG1 4.16Å
227	K	74.3	Confident	65.8	Low	52 Å²	52	61.6 Å²	61.6	23%	0.226	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	133.4	179.2	-71.9	-82.7	-175.8	151.8	0	110.4	I208 I209 V225 Y229 V274 S275 S276	I208-K227 WeakPolarHBondContact CA-O 3.31Å; I209-K227 PolarHBondContact N-O 3.2Å; I209-K227 PolarHBondContact O-N 3.23Å; V225-K227 HydrophobicContact CG1-CG 3.95Å; K227-Y229 HydrophobicContact CB-CD2 4.39Å; K227-Y229 HydrophobicContact CB-CE2 3.61Å; K227-V274 WeakPolarHBondContact CE-O 3.29Å; K227-V274 HydrophobicContact CG-CG1 4.34Å; K227-V274 WeakPolarHBondContact CG-O 3.31Å; K227-S275 PolarHBondContact NZ-O 2.87Å; K227-S276 PolarHBondContact NZ-O 2.68Å
228	N	76.8	Confident	65.8	Low	102 Å²	102	60.3 Å²	60.3	55%	0.545	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.8	178.5	-61.2	-4.3	0	0	0	108.1	I208	I208-N228 HydrophobicContact CG1-CB 4.45Å
229	Y	74.3	Confident	66.2	Low	5 Å²	5	64.7 Å²	64.7	2%	0.02	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	111.4	176.4	-64	-86.3	0	0	0	108.9	Y206 I207 I209 K227 S272 S273 V274 S276 W279	Y206-Y229 CarbonylContact C-O 3.56Å; Y206-Y229 WeakPolarHBondContact CA-O 3.23Å; Y206-Y229 VanDerWaalsContact CB-O 3.3Å; Y206-Y229 WeakPolarHBondContact CB-O 3.14Å; I207-Y229 PolarHBondContact N-O 2.87Å; I207-Y229 PolarHBondContact O-N 3.09Å; I209-Y229 HydrophobicContact CD1-CD2 3.9Å; I209-Y229 HydrophobicContact CD1-CE2 3.5Å; I209-Y229 HydrophobicContact CG1-CD2 4.41Å; I209-Y229 HydrophobicContact CG1-CE2 4.28Å; K227-Y229 HydrophobicContact CB-CD2 4.39Å; K227-Y229 HydrophobicContact CB-CE2 3.61Å; Y229-S272 WeakPolarHBondContact CE1-OG 3.42Å; Y229-S273 PolarHBondContact OH-O 2.95Å; Y229-V274 VanDerWaalsContact OH-CA 3.26Å; Y229-V274 WeakPolarHBondContact OH-CA 3.31Å; Y229-V274 PolarHBondContact OH-O 3.46Å; Y229-S276 PolarHBondContact OH-O 2.88Å; Y229-W279 VanDerWaalsContact CB-CZ2 3.48Å; Y229-W279 HydrophobicContact CD1-CD2 4.47Å; Y229-W279 AromaticContact CD1-CE2 3.87Å; Y229-W279 HydrophobicContact CD1-CZ2 4.01Å; Y229-W279 AromaticContact CD1-NE1 3.96Å; Y229-W279 AromaticContact CG-CZ2 3.92Å; Y229-W279 HydrophobicContact CG-CZ2 3.92Å
230	T	71.4	Confident	67.1	Low	104 Å²	104	59.4 Å²	59.4	64%	0.638	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	141.6	169.8	52.4	0	0	0	0	109.5	W279	T230-W279 PolarHBondContact O-NE1 3.03Å; T230-W279 VanDerWaalsContact O-NE1 3.15Å
231	I	66.7	Low	67.6	Low	8 Å²	8	53 Å²	53	4%	0.041	30%	0.296	C	S	.	.			trans	-113.8	123.8	175.7	-68.2	141.7	0	0	0	107.3	S205 I207 S233 Q238 W279	S205-I231 PolarHBondContact O-N 2.7Å; I207-I231 HydrophobicContact CD1-CD1 3.68Å; I207-I231 HydrophobicContact CG1-CD1 3.82Å; I231-S233 VanDerWaalsContact C-N 3.35Å; I231-S233 PolarHBondContact O-N 2.95Å; I231-Q238 VanDerWaalsContact CD1-NE2 3.3Å; I231-Q238 HydrophobicContact CG2-CG 3.97Å; I231-Q238 VanDerWaalsContact CG2-NE2 3.31Å; I231-W279 HydrophobicContact CD1-CZ2 4.36Å; I231-W279 HydrophobicContact CG1-CZ2 4.05Å
232	P	62.4	Low	68.2	Low	64 Å²	64	53.9 Å²	53.9	42%	0.416	30%	0.301	S	S	.	.			trans	-71.2	90.7	176.7	26.5	-30.7	0	0	0	110.2	S234 Y236	P232-S234 VanDerWaalsContact C-N 3.31Å; P232-S234 PolarHBondContact O-N 2.9Å; P232-Y236 HydrophobicContact CG-CD2 4.2Å; P232-Y236 HydrophobicContact CG-CE2 4.28Å; P232-Y236 WeakPolarHBondContact O-CD2 3.35Å
233	S	58.3	Low	68.5	Low	21 Å²	21	50.7 Å²	50.7	15%	0.147	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-30.6	-178.1	-166.1	0	0	0	0	113.6	E203 I231 V235 Y236	E203-S233 VanDerWaalsContact CB-OG 3.28Å; E203-S233 WeakPolarHBondContact CB-OG 3.35Å; E203-S233 VanDerWaalsContact CD-OG 3.24Å; E203-S233 WeakPolarHBondContact OE2-CB 3.38Å; E203-S233 PolarHBondContact OE2-OG 2.9Å; I231-S233 VanDerWaalsContact C-N 3.35Å; I231-S233 PolarHBondContact O-N 2.95Å; S233-V235 PolarHBondContact O-N 3.38Å; S233-Y236 PolarHBondContact O-N 2.87Å; S233-Y236 VanDerWaalsContact O-N 3.16Å
234	S	57.7	Low	68.9	Low	95 Å²	95	48.9 Å²	48.9	66%	0.664	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.6	-179.4	56.4	0	0	0	0	114.2	P232	P232-S234 VanDerWaalsContact C-N 3.31Å; P232-S234 PolarHBondContact O-N 2.9Å
235	V	55.9	Low	68.6	Low	60 Å²	60	44.6 Å²	44.6	36%	0.364	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-23.3	-177.2	-174.3	0	0	0	0	111.9	S233 E261 R262	S233-V235 PolarHBondContact O-N 3.38Å; V235-E261 HydrophobicContact CG1-CG 4.22Å; V235-R262 PolarHBondContact O-N 3.38Å
236	Y	58.4	Low	68.2	Low	45 Å²	45	43.5 Å²	43.5	18%	0.176	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	134.8	-167.6	-55.7	-84.3	0	0	0	113.6	P232 S233 S260 E261 L268 R270	P232-Y236 HydrophobicContact CG-CD2 4.2Å; P232-Y236 HydrophobicContact CG-CE2 4.28Å; P232-Y236 WeakPolarHBondContact O-CD2 3.35Å; S233-Y236 PolarHBondContact O-N 2.87Å; S233-Y236 VanDerWaalsContact O-N 3.16Å; Y236-S260 CarbonylContact C-O 3.44Å; Y236-S260 WeakPolarHBondContact CA-O 3.28Å; Y236-E261 VanDerWaalsContact CD1-CA 3.44Å; Y236-E261 HydrophobicContact CD1-CB 3.61Å; Y236-E261 HydrophobicContact CD1-CG 3.87Å; Y236-E261 HydrophobicContact CE1-CB 3.52Å; Y236-E261 HydrophobicContact CE1-CG 3.45Å; Y236-E261 VanDerWaalsContact CE1-CG 3.45Å; Y236-L268 HydrophobicContact CD1-CD1 3.65Å; Y236-L268 HydrophobicContact CE1-CD1 3.38Å; Y236-R270 VanDerWaalsContact CG-NH1 3.26Å
237	N	61.5	Low	67.4	Low	72 Å²	72	45.2 Å²	45.2	39%	0.385	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	110.3	169.3	-67.7	-9.4	0	0	0	109.4	H239 S259 S260 R262	N237-H239 PolarHBondContact O-ND1 3.41Å; N237-S259 CarbonylContact O-C 3.56Å; N237-S259 WeakPolarHBondContact O-CA 3.22Å; N237-S260 PolarHBondContact N-O 3.14Å; N237-S260 PolarHBondContact O-N 2.68Å; N237-R262 PolarHBondContact OD1-NE 3.47Å; N237-R262 PolarHBondContact OD1-NH2 2.93Å; N237-R262 VanDerWaalsContact OD1-NH2 3.17Å
238	Q	61.7	Low	66.4	Low	32 Å²	32	49.8 Å²	49.8	15%	0.15	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	140.2	174.2	-74	-157.5	-28.3	0	0	111.9	L204 I231	L204-Q238 HydrophobicContact CB-CB 4.24Å; L204-Q238 VanDerWaalsContact CB-OE1 3.24Å; L204-Q238 HydrophobicContact CD1-CB 3.75Å; L204-Q238 VanDerWaalsContact CD1-OE1 3.27Å; I231-Q238 VanDerWaalsContact CD1-NE2 3.3Å; I231-Q238 HydrophobicContact CG2-CG 3.97Å; I231-Q238 VanDerWaalsContact CG2-NE2 3.31Å
239	H	68	Low	65.3	Low	95 Å²	95	48.2 Å²	48.2	44%	0.44	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-45.8	179.4	-64.3	74.6	0	0	0	111.4	N237 L258 A289	N237-H239 PolarHBondContact O-ND1 3.41Å; H239-L258 HydrophobicContact CB-CD2 4.43Å; H239-L258 PolarHBondContact N-O 2.83Å; H239-A289 VanDerWaalsContact CB-O 3.3Å; H239-A289 WeakPolarHBondContact CB-O 3.32Å; H239-A289 PolarHBondContact CD2-O 2.88Å
240	S	76.5	Confident	64.1	Low	14 Å²	14	50.3 Å²	50.3	10%	0.098	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	143.3	-172.2	59.3	0	0	0	0	112	C257 L258 N290 M291	S240-C257 CarbonylContact O-C 3.49Å; S240-C257 WeakPolarHBondContact O-CA 3.12Å; S240-L258 PolarHBondContact O-N 2.96Å; S240-L258 WeakPolarHBondContact OG-CB 3.5Å; S240-N290 WeakPolarHBondContact CB-OD1 3.47Å; S240-M291 WeakPolarHBondContact OG-CB 3.45Å; S240-M291 PolarHBondContact OG-N 2.95Å; S240-M291 VanDerWaalsContact OG-N 3.11Å
241	C	77.4	Confident	63.3	Low	2 Å²	2	47.6 Å²	47.6	1%	0.014	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	136.1	174.2	-65.8	0	0	0	0	110.9	K189 I207 V256 C257	K189-C241 WeakPolarHBondContact CE-O 3.45Å; K189-C241 PolarHBondContact NZ-O 3.28Å; I207-C241 HydrophobicContact CD1-CB 4.05Å; C241-V256 CarbonylContact C-O 3.51Å; C241-V256 WeakPolarHBondContact CA-O 3.34Å; C241-C257 HydrophobicContact CB-CB 4.1Å; C241-C257 WeakPolarHBondContact CB-SG 3.33Å; C241-C257 WeakPolarHBondContact SG-CB 3.41Å; C241-C257 CovalentContact SG-SG 2.04Å; C241-C257 PolarHBondContact SG-SG 2.92Å
242	N	79.1	Confident	63	Low	31 Å²	31	48.5 Å²	48.5	17%	0.166	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	158.5	176	-73.1	-50.4	0	0	0	110.8	F244 V256 M291	N242-F244 HydrophobicContact CB-CE2 3.85Å; N242-F244 HydrophobicContact CB-CZ 3.99Å; N242-V256 PolarHBondContact N-O 3.26Å; N242-V256 PolarHBondContact O-N 3.49Å; N242-V256 VanDerWaalsContact O-O 3.13Å; N242-M291 HydrophobicContact CB-SD 4.03Å; N242-M291 PolarHBondContact ND2-O 2.85Å
243	I	74.9	Confident	63.3	Low	9 Å²	9	45.8 Å²	45.8	5%	0.046	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.6	175.9	-77.1	166.9	0	0	0	110.5	V174 V187 I209 A253 V254 V255 K293	V174-I243 HydrophobicContact CB-CG2 4.28Å; V174-I243 HydrophobicContact CG1-CG2 4.26Å; V174-I243 HydrophobicContact CG2-CB 4.1Å; V174-I243 HydrophobicContact CG2-CG2 3.96Å; V187-I243 HydrophobicContact CB-CD1 3.89Å; V187-I243 HydrophobicContact CG1-CD1 3.43Å; V187-I243 VanDerWaalsContact CG1-CD1 3.43Å; V187-I243 HydrophobicContact CG2-CB 4.27Å; V187-I243 HydrophobicContact CG2-CD1 3.19Å; V187-I243 HydrophobicContact CG2-CG1 4.24Å; I209-I243 HydrophobicContact CD1-CD1 3.77Å; I209-I243 HydrophobicContact CG1-CD1 3.99Å; I243-A253 HydrophobicContact CG2-CB 3.82Å; I243-V254 WeakPolarHBondContact CA-O 3.48Å; I243-V255 HydrophobicContact CD1-CB 4.34Å; I243-V255 HydrophobicContact CD1-CG1 4.23Å; I243-V255 HydrophobicContact CD1-CG2 3.6Å; I243-V255 HydrophobicContact CG1-CB 3.93Å; I243-V255 HydrophobicContact CG1-CG1 3.89Å; I243-V255 HydrophobicContact CG1-CG2 3.64Å; I243-K293 PolarHBondContact O-NZ 3.37Å
244	F	76.9	Confident	64.3	Low	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.8	-175	-60.4	-90.3	0	0	0	108	N242 A253 V254 V256 K293 D296 F299 L316	N242-F244 HydrophobicContact CB-CE2 3.85Å; N242-F244 HydrophobicContact CB-CZ 3.99Å; F244-A253 CarbonylContact O-C 3.56Å; F244-A253 VanDerWaalsContact O-CA 3.26Å; F244-A253 WeakPolarHBondContact O-CA 3.49Å; F244-V254 PolarHBondContact N-O 2.96Å; F244-V254 PolarHBondContact O-N 3.31Å; F244-V256 HydrophobicContact CD2-CB 4.36Å; F244-V256 HydrophobicContact CD2-CG2 3.76Å; F244-V256 HydrophobicContact CE2-CB 3.91Å; F244-V256 HydrophobicContact CE2-CG2 3.74Å; F244-K293 HydrophobicContact CE1-CD 4.34Å; F244-K293 HydrophobicContact CE1-CG 3.89Å; F244-K293 HydrophobicContact CZ-CG 4.44Å; F244-D296 VanDerWaalsContact CB-O 3.27Å; F244-D296 WeakPolarHBondContact CB-O 3.49Å; F244-D296 VanDerWaalsContact CD1-O 3.31Å; F244-D296 WeakPolarHBondContact CD1-O 3.36Å; F244-F299 HydrophobicContact CE1-CB 3.89Å; F244-F299 AromaticContact CE1-CD1 3.83Å; F244-F299 HydrophobicContact CE1-CD1 3.83Å; F244-F299 HydrophobicContact CE1-CG 4.28Å; F244-F299 AromaticContact CE2-CD1 3.99Å; F244-F299 HydrophobicContact CE2-CD1 3.99Å; F244-F299 HydrophobicContact CE2-CE1 4.45Å; F244-F299 HydrophobicContact CZ-CB 3.6Å; F244-F299 AromaticContact CZ-CD1 3.41Å; F244-F299 HydrophobicContact CZ-CD1 3.41Å; F244-F299 VanDerWaalsContact CZ-CD1 3.41Å; F244-F299 HydrophobicContact CZ-CE1 4.29Å; F244-F299 AromaticContact CZ-CG 3.73Å; F244-F299 HydrophobicContact CZ-CG 3.73Å; F244-L316 HydrophobicContact CB-CD1 3.09Å; F244-L316 HydrophobicContact CD1-CD1 3.73Å; F244-L316 HydrophobicContact CD2-CD1 3.55Å; F244-L316 HydrophobicContact CE2-CD1 4.39Å; F244-L316 HydrophobicContact CG-CD1 3.16Å; F244-L316 HydrophobicContact CG-CG 4.5Å
245	G	66.7	Low	65.3	Low	11 Å²	11	40.3 Å²	40.3	11%	0.113	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	117.8	172.9	0	0	0	0	0	108.4	H247	G245-H247 PolarHBondContact O-N 2.86Å
246	L	61.8	Low	66.7	Low	15 Å²	15	37.5 Å²	37.5	8%	0.079	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-74.6	127.2	171.9	-91.5	70.9	0	0	0	109.8	N252 V254 D317 S318	L246-N252 WeakPolarHBondContact CB-O 3.37Å; L246-N252 PolarHBondContact N-O 3.08Å; L246-N252 VanDerWaalsContact N-O 3.14Å; L246-V254 HydrophobicContact CD1-CB 4.2Å; L246-V254 HydrophobicContact CD1-CG2 3.56Å; L246-D317 WeakPolarHBondContact CD2-O 3.12Å; L246-S318 WeakPolarHBondContact CD2-O 3.07Å
247	H	55.3	Low	68	Low	113 Å²	113	35.3 Å²	35.3	52%	0.523	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	138.4	168.1	-74.5	-85.3	0	0	0	110.1	G245	G245-H247 PolarHBondContact O-N 2.86Å
248	N	53.8	Low	69.1	Low	148 Å²	148	31.9 Å²	31.9	79%	0.791	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.5	-8.4	177.9	-55.6	-23.6	0	0	0	118.6
249	I	53.1	Low	70	Confident	69 Å²	69	30.4 Å²	30.4	35%	0.354	16%	0.164	S	C	.	.			trans	-133.2	108.4	175.3	-54.8	169.3	0	0	0	109.5	T251 N252	I249-T251 PolarHBondContact O-N 3.31Å; I249-N252 HydrophobicContact CB-CB 3.98Å; I249-N252 WeakPolarHBondContact CD1-ND2 3Å; I249-N252 HydrophobicContact CG2-CB 3.9Å; I249-N252 PolarHBondContact O-N 3.28Å; I249-N252 VanDerWaalsContact O-N 3.12Å
250	P	49.5	Very low	70.4	Confident	49 Å²	49	27.2 Å²	27.2	32%	0.318	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.7	-173.1	21.9	-31.3	0	0	0	114	T178 T183	T178-P250 HydrophobicContact CG2-CB 4.43Å; T183-P250 HydrophobicContact CG2-CB 3.73Å; T183-P250 PolarHBondContact OG1-O 3.21Å
251	T	52.9	Low	70.2	Confident	46 Å²	46	28.5 Å²	28.5	28%	0.282	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-6.2	-177.3	55.4	0	0	0	0	115	M224 I249 A253	M224-T251 HydrophobicContact CE-CG2 3.33Å; I249-T251 PolarHBondContact O-N 3.31Å; T251-A253 PolarHBondContact O-N 2.97Å
252	N	62.3	Low	69.7	Low	27 Å²	27	34.2 Å²	34.2	14%	0.144	18%	0.178	C	C	.	.			trans	-102.2	75.6	-179.5	-77.1	-3.6	0	0	0	110	L246 I249 S273 S275	L246-N252 WeakPolarHBondContact CB-O 3.37Å; L246-N252 PolarHBondContact N-O 3.08Å; L246-N252 VanDerWaalsContact N-O 3.14Å; I249-N252 HydrophobicContact CB-CB 3.98Å; I249-N252 WeakPolarHBondContact CD1-ND2 3Å; I249-N252 HydrophobicContact CG2-CB 3.9Å; I249-N252 PolarHBondContact O-N 3.28Å; I249-N252 VanDerWaalsContact O-N 3.12Å; N252-S273 PolarHBondContact OD1-OG 2.87Å; N252-S275 PolarHBondContact OD1-OG 3.38Å
253	A	68.2	Low	69.1	Low	7 Å²	7	37 Å²	37	6%	0.058	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	149.7	150	0	0	0	0	0	108.5	I243 F244 T251 V274	I243-A253 HydrophobicContact CG2-CB 3.82Å; F244-A253 CarbonylContact O-C 3.56Å; F244-A253 VanDerWaalsContact O-CA 3.26Å; F244-A253 WeakPolarHBondContact O-CA 3.49Å; T251-A253 PolarHBondContact O-N 2.97Å; A253-V274 HydrophobicContact CB-CG2 3.62Å; A253-V274 WeakPolarHBondContact O-CB 3.46Å; A253-V274 WeakPolarHBondContact O-CG2 3.49Å; A253-V274 PolarHBondContact O-N 2.86Å
254	V	78.5	Confident	68.6	Low	1 Å²	1	45 Å²	45	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.2	172.9	175.1	0	0	0	0	107.9	I243 F244 L246 V256 F271 S272 L316 G320	I243-V254 WeakPolarHBondContact CA-O 3.48Å; F244-V254 PolarHBondContact N-O 2.96Å; F244-V254 PolarHBondContact O-N 3.31Å; L246-V254 HydrophobicContact CD1-CB 4.2Å; L246-V254 HydrophobicContact CD1-CG2 3.56Å; V254-V256 HydrophobicContact CG1-CG2 3.99Å; V254-F271 HydrophobicContact CG1-CB 4.19Å; V254-S272 WeakPolarHBondContact CA-O 3.49Å; V254-L316 HydrophobicContact CG1-CD2 4.31Å; V254-G320 WeakPolarHBondContact CG1-O 3.46Å
255	V	79.4	Confident	68.1	Low	1 Å²	1	54.5 Å²	54.5	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.1	168.1	-167	0	0	0	0	108.3	I207 I209 I243 F271 S272 W279	I207-V255 HydrophobicContact CD1-CG1 4.41Å; I209-V255 HydrophobicContact CD1-CG2 3.12Å; I209-V255 HydrophobicContact CG1-CG2 4.36Å; I243-V255 HydrophobicContact CD1-CB 4.34Å; I243-V255 HydrophobicContact CD1-CG1 4.23Å; I243-V255 HydrophobicContact CD1-CG2 3.6Å; I243-V255 HydrophobicContact CG1-CB 3.93Å; I243-V255 HydrophobicContact CG1-CG1 3.89Å; I243-V255 HydrophobicContact CG1-CG2 3.64Å; V255-F271 CarbonylContact O-C 3.58Å; V255-F271 WeakPolarHBondContact O-CA 3.49Å; V255-F271 WeakPolarHBondContact O-CB 3.22Å; V255-S272 PolarHBondContact N-O 2.9Å; V255-S272 PolarHBondContact O-N 3.41Å; V255-W279 HydrophobicContact CB-CH2 4.07Å; V255-W279 HydrophobicContact CB-CZ3 4.18Å; V255-W279 HydrophobicContact CG1-CH2 3.79Å; V255-W279 HydrophobicContact CG1-CZ3 4.21Å
256	V	85.1	Confident	68.3	Low	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.2	168.3	-166.2	0	0	0	0	108.8	C241 N242 F244 V254 L269 R270 F271 M291 F299 L316 P322	C241-V256 CarbonylContact C-O 3.51Å; C241-V256 WeakPolarHBondContact CA-O 3.34Å; N242-V256 PolarHBondContact N-O 3.26Å; N242-V256 PolarHBondContact O-N 3.49Å; N242-V256 VanDerWaalsContact O-O 3.13Å; F244-V256 HydrophobicContact CD2-CB 4.36Å; F244-V256 HydrophobicContact CD2-CG2 3.76Å; F244-V256 HydrophobicContact CE2-CB 3.91Å; F244-V256 HydrophobicContact CE2-CG2 3.74Å; V254-V256 HydrophobicContact CG1-CG2 3.99Å; V256-L269 HydrophobicContact CG1-CD2 3.96Å; V256-R270 CarbonylContact C-O 3.54Å; V256-R270 VanDerWaalsContact CA-O 3.29Å; V256-R270 WeakPolarHBondContact CA-O 3.42Å; V256-F271 HydrophobicContact CB-CB 4.48Å; V256-F271 HydrophobicContact CG1-CB 4.35Å; V256-F271 HydrophobicContact CG2-CB 4.05Å; V256-M291 HydrophobicContact CB-CE 4.1Å; V256-M291 HydrophobicContact CB-SD 4.46Å; V256-M291 HydrophobicContact CG1-CE 3.57Å; V256-F299 HydrophobicContact CG1-CE1 4.35Å; V256-F299 HydrophobicContact CG1-CZ 3.91Å; V256-F299 HydrophobicContact CG2-CE1 4.38Å; V256-L316 HydrophobicContact CG2-CD2 4.11Å; V256-P322 HydrophobicContact CG1-CG 4.24Å; V256-P322 HydrophobicContact CG2-CG 4.17Å
257	C	84.6	Confident	69.2	Low	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.1	179.7	-74.5	0	0	0	0	110.3	S240 C241 R270	S240-C257 CarbonylContact O-C 3.49Å; S240-C257 WeakPolarHBondContact O-CA 3.12Å; C241-C257 HydrophobicContact CB-CB 4.1Å; C241-C257 WeakPolarHBondContact CB-SG 3.33Å; C241-C257 WeakPolarHBondContact SG-CB 3.41Å; C241-C257 CovalentContact SG-SG 2.04Å; C241-C257 PolarHBondContact SG-SG 2.92Å; C257-R270 HydrophobicContact CB-CB 4.25Å; C257-R270 PolarHBondContact N-O 3.29Å; C257-R270 PolarHBondContact O-N 2.96Å
258	L	84.8	Confident	70.5	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123.6	168.4	-174.6	65.1	0	0	0	109.4	H239 S240 L269 F288 M291 L301	H239-L258 HydrophobicContact CB-CD2 4.43Å; H239-L258 PolarHBondContact N-O 2.83Å; S240-L258 PolarHBondContact O-N 2.96Å; S240-L258 WeakPolarHBondContact OG-CB 3.5Å; L258-L269 HydrophobicContact CD1-CD2 4.17Å; L258-F288 HydrophobicContact CD1-CB 4.33Å; L258-F288 HydrophobicContact CD2-CB 4.14Å; L258-M291 HydrophobicContact CB-CB 4.4Å; L258-M291 HydrophobicContact CB-CE 4.12Å; L258-L301 HydrophobicContact CD1-CD1 4.49Å; L258-L301 HydrophobicContact CD1-CD2 4.25Å; L258-L301 HydrophobicContact CD2-CD2 4.37Å
259	S	80.8	Confident	72	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	159.5	179.8	60.7	0	0	0	0	111.2	N237 S267 L268 R270	N237-S259 CarbonylContact O-C 3.56Å; N237-S259 WeakPolarHBondContact O-CA 3.22Å; S259-S267 CarbonylContact O-C 3.57Å; S259-S267 WeakPolarHBondContact O-CA 3.44Å; S259-L268 PolarHBondContact N-O 3.17Å; S259-L268 PolarHBondContact O-N 3.39Å; S259-L268 PolarHBondContact OG-O 3.32Å; S259-R270 PolarHBondContact OG-NH1 3.17Å
260	S	76.4	Confident	73.4	Confident	28 Å²	28	39.1 Å²	39.1	20%	0.196	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.5	171.4	-171.3	0	0	0	0	108.8	Y236 N237 G266	Y236-S260 CarbonylContact C-O 3.44Å; Y236-S260 WeakPolarHBondContact CA-O 3.28Å; N237-S260 PolarHBondContact N-O 3.14Å; N237-S260 PolarHBondContact O-N 2.68Å; S260-G266 PolarHBondContact OG-O 3.42Å
261	E	72.2	Confident	75.1	Confident	41 Å²	41	37.5 Å²	37.5	19%	0.192	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	133.5	175.5	-169.5	168.1	-157.1	0	0	110.3	V235 Y236 G263 R264 L268	V235-E261 HydrophobicContact CG1-CG 4.22Å; Y236-E261 VanDerWaalsContact CD1-CA 3.44Å; Y236-E261 HydrophobicContact CD1-CB 3.61Å; Y236-E261 HydrophobicContact CD1-CG 3.87Å; Y236-E261 HydrophobicContact CE1-CB 3.52Å; Y236-E261 HydrophobicContact CE1-CG 3.45Å; Y236-E261 VanDerWaalsContact CE1-CG 3.45Å; E261-G263 PolarHBondContact O-N 3.17Å; E261-R264 HydrophobicContact CB-CB 4.27Å; E261-R264 PolarHBondContact O-N 3.37Å; E261-R264 VanDerWaalsContact OE2-CD 3.3Å; E261-R264 WeakPolarHBondContact OE2-CD 3.25Å; E261-R264 IonicContact OE2-CZ 3.55Å; E261-R264 IonicContact OE2-NE 3.54Å; E261-R264 IonicContact OE2-NH1 3.05Å; E261-R264 PolarHBondContact OE2-NH1 3.42Å; E261-L268 HydrophobicContact CB-CD1 3.87Å
262	R	67.4	Low	76.4	Confident	123 Å²	123	35.3 Å²	35.3	46%	0.464	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	123.5	176.8	-75.4	-176.2	177.4	-176.5	-1.4	109.5	E203 V235 N237	E203-R262 IonicContact OE1-CZ 2.86Å; E203-R262 IonicContact OE1-NH1 3.43Å; E203-R262 IonicContact OE1-NH2 2.91Å; E203-R262 PolarHBondContact OE1-NH2 2.7Å; V235-R262 PolarHBondContact O-N 3.38Å; N237-R262 PolarHBondContact OD1-NE 3.47Å; N237-R262 PolarHBondContact OD1-NH2 2.93Å; N237-R262 VanDerWaalsContact OD1-NH2 3.17Å
263	G	65.9	Low	76.9	Confident	90 Å²	90	35 Å²	35	93%	0.928	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.5	-7.5	178.8	0	0	0	0	0	115.7	E261	E261-G263 PolarHBondContact O-N 3.17Å
264	R	66.1	Low	76.8	Confident	176 Å²	176	34.8 Å²	34.8	66%	0.664	18%	0.182	S	C	*	.	S	Bend	trans	-106.5	143.9	169.2	-75.5	-163.1	179.3	148.6	-10.6	111.7	E261	E261-R264 HydrophobicContact CB-CB 4.27Å; E261-R264 PolarHBondContact O-N 3.37Å; E261-R264 VanDerWaalsContact OE2-CD 3.3Å; E261-R264 WeakPolarHBondContact OE2-CD 3.25Å; E261-R264 IonicContact OE2-CZ 3.55Å; E261-R264 IonicContact OE2-NE 3.54Å; E261-R264 IonicContact OE2-NH1 3.05Å; E261-R264 PolarHBondContact OE2-NH1 3.42Å
265	Q	65.9	Low	76.2	Confident	199 Å²	199	38.2 Å²	38.2	93%	0.93	21%	0.207	S	C	*	.	S	Bend	trans	-84.8	111.4	166.9	-68.6	-177.8	-16.9	0	0	108.5
266	G	70.8	Confident	75.7	Confident	11 Å²	11	39.9 Å²	39.9	11%	0.113	22%	0.218	C	C	.	.	S	Bend	trans	149.8	148.4	176.1	0	0	0	0	0	112.8	S260	S260-G266 PolarHBondContact OG-O 3.42Å
267	S	79.8	Confident	74.7	Confident	2 Å²	2	45 Å²	45	1%	0.014	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	149.8	175.5	-62.8	0	0	0	0	111.5	S259 V284 S286 F288	S259-S267 CarbonylContact O-C 3.57Å; S259-S267 WeakPolarHBondContact O-CA 3.44Å; S267-V284 WeakPolarHBondContact O-CA 3.32Å; S267-V284 VanDerWaalsContact O-CB 3.32Å; S267-V284 WeakPolarHBondContact O-CB 3.06Å; S267-V284 PolarHBondContact O-N 3.26Å; S267-S286 PolarHBondContact N-O 2.78Å; S267-F288 PolarHBondContact OG-N 2.96Å; S267-F288 PolarHBondContact OG-O 3.09Å
268	L	83.8	Confident	74.2	Confident	12 Å²	12	48 Å²	48	6%	0.063	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	124.8	178.4	-65.5	158.7	0	0	0	108.1	Y236 S259 E261 V281 I282 T283	Y236-L268 HydrophobicContact CD1-CD1 3.65Å; Y236-L268 HydrophobicContact CE1-CD1 3.38Å; S259-L268 PolarHBondContact N-O 3.17Å; S259-L268 PolarHBondContact O-N 3.39Å; S259-L268 PolarHBondContact OG-O 3.32Å; E261-L268 HydrophobicContact CB-CD1 3.87Å; L268-V281 HydrophobicContact CB-CG1 4.04Å; L268-V281 HydrophobicContact CD2-CG1 3.73Å; L268-V281 HydrophobicContact CG-CG1 4.39Å; L268-I282 WeakPolarHBondContact CA-O 3.14Å; L268-T283 HydrophobicContact CD2-CG2 4.1Å
269	L	84.9	Confident	73.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	111.8	166.4	-73.6	174.5	0	0	0	108.2	V256 L258 V281 I282 V284 M291 F299 L301 Y314 P322	V256-L269 HydrophobicContact CG1-CD2 3.96Å; L258-L269 HydrophobicContact CD1-CD2 4.17Å; L269-V281 WeakPolarHBondContact O-CA 3.48Å; L269-I282 HydrophobicContact CB-CB 4.29Å; L269-I282 PolarHBondContact N-O 2.54Å; L269-I282 PolarHBondContact O-N 2.69Å; L269-V284 HydrophobicContact CB-CG2 4.33Å; L269-V284 HydrophobicContact CD1-CG2 3.89Å; L269-V284 HydrophobicContact CG-CG2 3.71Å; L269-M291 HydrophobicContact CD2-CE 3.59Å; L269-F299 HydrophobicContact CD1-CE2 4.33Å; L269-F299 HydrophobicContact CD1-CZ 4.25Å; L269-F299 HydrophobicContact CD2-CE2 4.09Å; L269-F299 HydrophobicContact CD2-CZ 4.4Å; L269-L301 HydrophobicContact CD1-CD1 4.14Å; L269-L301 HydrophobicContact CD2-CD1 4.07Å; L269-L301 HydrophobicContact CD2-CD2 4.12Å; L269-L301 HydrophobicContact CG-CD1 4.28Å; L269-Y314 HydrophobicContact CD1-CD1 3.92Å; L269-Y314 HydrophobicContact CD1-CD2 4.23Å; L269-Y314 HydrophobicContact CD1-CE1 3.68Å; L269-Y314 HydrophobicContact CD1-CE2 4.01Å; L269-Y314 HydrophobicContact CD1-CG 4.2Å; L269-P322 HydrophobicContact CD1-CB 4.49Å
270	R	82.8	Confident	74	Confident	8 Å²	8	54.1 Å²	54.1	3%	0.03	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.2	167.7	-62.7	-163.1	163.4	97.9	21.5	108.8	Y236 V256 C257 S259 W279 D280 V281	Y236-R270 VanDerWaalsContact CG-NH1 3.26Å; V256-R270 CarbonylContact C-O 3.54Å; V256-R270 VanDerWaalsContact CA-O 3.29Å; V256-R270 WeakPolarHBondContact CA-O 3.42Å; C257-R270 HydrophobicContact CB-CB 4.25Å; C257-R270 PolarHBondContact N-O 3.29Å; C257-R270 PolarHBondContact O-N 2.96Å; S259-R270 PolarHBondContact OG-NH1 3.17Å; R270-W279 HydrophobicContact CB-CD2 4.39Å; R270-W279 HydrophobicContact CB-CE3 3.69Å; R270-W279 HydrophobicContact CB-CZ3 4.04Å; R270-D280 CarbonylContact C-O 3.57Å; R270-D280 WeakPolarHBondContact CA-O 3.15Å; R270-V281 HydrophobicContact CG-CG1 4.37Å; R270-V281 HydrophobicContact CG-CG2 4.1Å
271	F	85.7	Confident	74.2	Confident	15 Å²	15	56.1 Å²	56.1	7%	0.066	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	151.7	172.6	66.5	-75.2	0	0	0	110.9	V254 V255 V256 D280 I282 I321 P322	V254-F271 HydrophobicContact CG1-CB 4.19Å; V255-F271 CarbonylContact O-C 3.58Å; V255-F271 WeakPolarHBondContact O-CA 3.49Å; V255-F271 WeakPolarHBondContact O-CB 3.22Å; V256-F271 HydrophobicContact CB-CB 4.48Å; V256-F271 HydrophobicContact CG1-CB 4.35Å; V256-F271 HydrophobicContact CG2-CB 4.05Å; F271-D280 HydrophobicContact CD1-CB 4.28Å; F271-D280 HydrophobicContact CD2-CB 4.45Å; F271-D280 HydrophobicContact CE1-CB 3.69Å; F271-D280 HydrophobicContact CE2-CB 3.92Å; F271-D280 HydrophobicContact CZ-CB 3.51Å; F271-D280 PolarHBondContact N-O 2.91Å; F271-D280 PolarHBondContact O-N 3.36Å; F271-I282 HydrophobicContact CD1-CD1 3.98Å; F271-I282 HydrophobicContact CD1-CG1 4.48Å; F271-I282 HydrophobicContact CE1-CD1 3.35Å; F271-I282 HydrophobicContact CE1-CG1 3.71Å; F271-I282 HydrophobicContact CZ-CD1 4.01Å; F271-I321 HydrophobicContact CE2-CB 4.27Å; F271-I321 HydrophobicContact CE2-CG1 3.94Å; F271-I321 HydrophobicContact CE2-CG2 4.27Å; F271-I321 HydrophobicContact CZ-CG1 4.35Å; F271-I321 HydrophobicContact CZ-CG2 4.04Å; F271-P322 HydrophobicContact CB-CG 3.98Å; F271-P322 HydrophobicContact CD1-CG 3.85Å; F271-P322 VanDerWaalsContact CD2-CD 3.46Å; F271-P322 HydrophobicContact CD2-CG 4.27Å; F271-P322 HydrophobicContact CE1-CG 4.49Å; F271-P322 VanDerWaalsContact CG-CD 3.41Å; F271-P322 HydrophobicContact CG-CG 3.74Å
272	S	78.7	Confident	74.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	133.7	174	-166.6	0	0	0	0	108.3	Y229 V254 V255 S278	Y229-S272 WeakPolarHBondContact CE1-OG 3.42Å; V254-S272 WeakPolarHBondContact CA-O 3.49Å; V255-S272 PolarHBondContact N-O 2.9Å; V255-S272 PolarHBondContact O-N 3.41Å; S272-S278 WeakPolarHBondContact CB-O 3.33Å; S272-S278 PolarHBondContact OG-O 2.75Å
273	S	74.2	Confident	75.4	Confident	21 Å²	21	55.7 Å²	55.7	15%	0.147	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	142.7	165.7	177.4	0	0	0	0	109.3	Y229 N252 S275 S276	Y229-S273 PolarHBondContact OH-O 2.95Å; N252-S273 PolarHBondContact OD1-OG 2.87Å; S273-S275 PolarHBondContact O-N 2.83Å; S273-S275 VanDerWaalsContact O-N 3.11Å; S273-S275 PolarHBondContact OG-N 3.39Å; S273-S275 PolarHBondContact OG-OG 3.4Å; S273-S276 WeakPolarHBondContact O-CA 3.41Å; S273-S276 WeakPolarHBondContact O-CB 3.45Å; S273-S276 PolarHBondContact O-N 2.7Å
274	V	65.7	Low	76	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.4	174.3	172.2	0	0	0	0	111.8	I209 V225 K227 Y229 A253	I209-V274 HydrophobicContact CD1-CG2 3.83Å; I209-V274 HydrophobicContact CG2-CG2 4.05Å; V225-V274 HydrophobicContact CG1-CG1 4.24Å; K227-V274 WeakPolarHBondContact CE-O 3.29Å; K227-V274 HydrophobicContact CG-CG1 4.34Å; K227-V274 WeakPolarHBondContact CG-O 3.31Å; Y229-V274 VanDerWaalsContact OH-CA 3.26Å; Y229-V274 WeakPolarHBondContact OH-CA 3.31Å; Y229-V274 PolarHBondContact OH-O 3.46Å; A253-V274 HydrophobicContact CB-CG2 3.62Å; A253-V274 WeakPolarHBondContact O-CB 3.46Å; A253-V274 WeakPolarHBondContact O-CG2 3.49Å; A253-V274 PolarHBondContact O-N 2.86Å
275	S	65	Low	76.3	Confident	74 Å²	74	53.7 Å²	53.7	52%	0.517	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-27.6	173.6	45.3	0	0	0	0	113.6	K227 N252 S273	K227-S275 PolarHBondContact NZ-O 2.87Å; N252-S275 PolarHBondContact OD1-OG 3.38Å; S273-S275 PolarHBondContact O-N 2.83Å; S273-S275 VanDerWaalsContact O-N 3.11Å; S273-S275 PolarHBondContact OG-N 3.39Å; S273-S275 PolarHBondContact OG-OG 3.4Å
276	S	68.5	Low	76.7	Confident	36 Å²	36	46 Å²	46	25%	0.252	27%	0.266	S	S	.	.			trans	-84.5	158.2	178.6	-172.2	0	0	0	0	112.5	K227 Y229 S273 S278	K227-S276 PolarHBondContact NZ-O 2.68Å; Y229-S276 PolarHBondContact OH-O 2.88Å; S273-S276 WeakPolarHBondContact O-CA 3.41Å; S273-S276 WeakPolarHBondContact O-CB 3.45Å; S273-S276 PolarHBondContact O-N 2.7Å; S276-S278 PolarHBondContact OG-N 2.66Å; S276-S278 PolarHBondContact OG-O 3.43Å; S276-S278 PolarHBondContact OG-OG 2.95Å
277	S	65.3	Low	76.9	Confident	106 Å²	106	47.5 Å²	47.5	74%	0.741	27%	0.273	S	S	*	.	S	Bend	trans	-111.5	-5.3	171.6	59.6	0	0	0	0	113.7
278	S	74.4	Confident	76.8	Confident	63 Å²	63	47.8 Å²	47.8	44%	0.441	27%	0.274	S	S	.	.	S	Bend	trans	-104.5	143.9	177	56.5	0	0	0	0	110.8	S272 S276	S272-S278 WeakPolarHBondContact CB-O 3.33Å; S272-S278 PolarHBondContact OG-O 2.75Å; S276-S278 PolarHBondContact OG-N 2.66Å; S276-S278 PolarHBondContact OG-O 3.43Å; S276-S278 PolarHBondContact OG-OG 2.95Å
279	W	77.1	Confident	76.5	Confident	48 Å²	48	48.8 Å²	48.8	18%	0.182	28%	0.284	C	S	.	.			trans	-81.6	124.4	168	-71.9	103.4	0	0	0	109.3	Y229 T230 I231 V255 R270	Y229-W279 VanDerWaalsContact CB-CZ2 3.48Å; Y229-W279 HydrophobicContact CD1-CD2 4.47Å; Y229-W279 AromaticContact CD1-CE2 3.87Å; Y229-W279 HydrophobicContact CD1-CZ2 4.01Å; Y229-W279 AromaticContact CD1-NE1 3.96Å; Y229-W279 AromaticContact CG-CZ2 3.92Å; Y229-W279 HydrophobicContact CG-CZ2 3.92Å; T230-W279 PolarHBondContact O-NE1 3.03Å; T230-W279 VanDerWaalsContact O-NE1 3.15Å; I231-W279 HydrophobicContact CD1-CZ2 4.36Å; I231-W279 HydrophobicContact CG1-CZ2 4.05Å; V255-W279 HydrophobicContact CB-CH2 4.07Å; V255-W279 HydrophobicContact CB-CZ3 4.18Å; V255-W279 HydrophobicContact CG1-CH2 3.79Å; V255-W279 HydrophobicContact CG1-CZ3 4.21Å; R270-W279 HydrophobicContact CB-CD2 4.39Å; R270-W279 HydrophobicContact CB-CE3 3.69Å; R270-W279 HydrophobicContact CB-CZ3 4.04Å
280	D	82.9	Confident	76.5	Confident	82 Å²	82	52.4 Å²	52.4	44%	0.439	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	148	163.4	-64.9	-43.7	0	0	0	108.8	R270 F271	R270-D280 CarbonylContact C-O 3.57Å; R270-D280 WeakPolarHBondContact CA-O 3.15Å; F271-D280 HydrophobicContact CD1-CB 4.28Å; F271-D280 HydrophobicContact CD2-CB 4.45Å; F271-D280 HydrophobicContact CE1-CB 3.69Å; F271-D280 HydrophobicContact CE2-CB 3.92Å; F271-D280 HydrophobicContact CZ-CB 3.51Å; F271-D280 PolarHBondContact N-O 2.91Å; F271-D280 PolarHBondContact O-N 3.36Å
281	V	81.3	Confident	76.8	Confident	69 Å²	69	52.4 Å²	52.4	42%	0.418	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.8	-174.1	-170.3	0	0	0	0	109.8	L268 L269 R270	L268-V281 HydrophobicContact CB-CG1 4.04Å; L268-V281 HydrophobicContact CD2-CG1 3.73Å; L268-V281 HydrophobicContact CG-CG1 4.39Å; L269-V281 WeakPolarHBondContact O-CA 3.48Å; R270-V281 HydrophobicContact CG-CG1 4.37Å; R270-V281 HydrophobicContact CG-CG2 4.1Å
282	I	84.8	Confident	76.9	Confident	47 Å²	47	53.5 Å²	53.5	24%	0.241	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.6	169.6	-71.4	157.4	0	0	0	108.2	L268 L269 F271 I321 P322	L268-I282 WeakPolarHBondContact CA-O 3.14Å; L269-I282 HydrophobicContact CB-CB 4.29Å; L269-I282 PolarHBondContact N-O 2.54Å; L269-I282 PolarHBondContact O-N 2.69Å; F271-I282 HydrophobicContact CD1-CD1 3.98Å; F271-I282 HydrophobicContact CD1-CG1 4.48Å; F271-I282 HydrophobicContact CE1-CD1 3.35Å; F271-I282 HydrophobicContact CE1-CG1 3.71Å; F271-I282 HydrophobicContact CZ-CD1 4.01Å; I282-I321 HydrophobicContact CD1-CG2 4.41Å; I282-P322 HydrophobicContact CD1-CB 4.33Å; I282-P322 HydrophobicContact CD1-CG 4.4Å; I282-P322 WeakPolarHBondContact CD1-O 3.25Å
283	T	80.5	Confident	77.4	Confident	109 Å²	109	57 Å²	57	67%	0.669	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	122.5	170.7	-49.1	0	0	0	0	109.9	L268	L268-T283 HydrophobicContact CD2-CG2 4.1Å
284	V	78.9	Confident	78.1	Confident	6 Å²	6	56.8 Å²	56.8	4%	0.036	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.2	177.1	-166.8	0	0	0	0	108.3	S267 L269 S286 F288	S267-V284 WeakPolarHBondContact O-CA 3.32Å; S267-V284 VanDerWaalsContact O-CB 3.32Å; S267-V284 WeakPolarHBondContact O-CB 3.06Å; S267-V284 PolarHBondContact O-N 3.26Å; L269-V284 HydrophobicContact CB-CG2 4.33Å; L269-V284 HydrophobicContact CD1-CG2 3.89Å; L269-V284 HydrophobicContact CG-CG2 3.71Å; V284-S286 PolarHBondContact O-N 3.14Å; V284-F288 HydrophobicContact CG1-CD2 3.83Å; V284-F288 HydrophobicContact CG1-CE2 3.44Å; V284-F288 VanDerWaalsContact CG1-CE2 3.44Å
285	K	72	Confident	79.1	Confident	217 Å²	217	58.4 Å²	58.4	94%	0.943	33%	0.334	S	S	*	.	S	Bend	trans	-63.4	-24.6	-175.4	-68.8	-177.3	178.6	178.5	0	113.7
286	S	74.3	Confident	79.8	Confident	37 Å²	37	58.2 Å²	58.2	26%	0.259	33%	0.328	S	S	.	.	S	Bend	trans	-108.4	155.5	-177.2	-157.9	0	0	0	0	111.3	S267 V284 F288	S267-S286 PolarHBondContact N-O 2.78Å; V284-S286 PolarHBondContact O-N 3.14Å; S286-F288 WeakPolarHBondContact O-CD2 3.22Å
287	T	74.3	Confident	80.5	Confident	44 Å²	44	58.4 Å²	58.4	27%	0.27	33%	0.326	S	S	.	.			trans	-80.8	124.9	170.9	38.8	0	0	0	0	110	E307	T287-E307 PolarHBondContact OG1-OE1 2.8Å; T287-E307 PolarHBondContact OG1-OE2 2.89Å
288	F	78	Confident	81.8	Confident	7 Å²	7	54 Å²	54	3%	0.031	29%	0.294	C	S	.	.			trans	-124.6	141	177	-67.7	-72.3	0	0	0	109.4	L258 S267 V284 S286 L301 T302 T310 A312	L258-F288 HydrophobicContact CD1-CB 4.33Å; L258-F288 HydrophobicContact CD2-CB 4.14Å; S267-F288 PolarHBondContact OG-N 2.96Å; S267-F288 PolarHBondContact OG-O 3.09Å; V284-F288 HydrophobicContact CG1-CD2 3.83Å; V284-F288 HydrophobicContact CG1-CE2 3.44Å; V284-F288 VanDerWaalsContact CG1-CE2 3.44Å; S286-F288 WeakPolarHBondContact O-CD2 3.22Å; F288-L301 HydrophobicContact CB-CB 4.08Å; F288-L301 HydrophobicContact CD1-CB 3.57Å; F288-L301 HydrophobicContact CD2-CB 4.03Å; F288-L301 HydrophobicContact CD2-CD1 3.77Å; F288-L301 HydrophobicContact CE1-CB 3.94Å; F288-L301 HydrophobicContact CE2-CB 4.36Å; F288-L301 HydrophobicContact CE2-CD1 4.11Å; F288-L301 HydrophobicContact CG-CB 3.61Å; F288-L301 HydrophobicContact CG-CD1 4.14Å; F288-L301 HydrophobicContact CZ-CB 4.32Å; F288-T302 CarbonylContact C-O 3.53Å; F288-T302 WeakPolarHBondContact CA-O 3.48Å; F288-T310 WeakPolarHBondContact CE1-O 3.25Å; F288-A312 HydrophobicContact CE1-CB 4.16Å; F288-A312 HydrophobicContact CE2-CB 4.17Å; F288-A312 HydrophobicContact CZ-CB 3.55Å
289	A	77.3	Confident	82.6	Confident	33 Å²	33	51 Å²	51	27%	0.273	27%	0.273	S	S	.	.			trans	-93.1	-38.4	-176.1	0	0	0	0	0	112.4	H239 T302	H239-A289 VanDerWaalsContact CB-O 3.3Å; H239-A289 WeakPolarHBondContact CB-O 3.32Å; H239-A289 PolarHBondContact CD2-O 2.88Å; A289-T302 PolarHBondContact N-O 2.95Å
290	N	84.9	Confident	83.4	Confident	77 Å²	77	48.7 Å²	48.7	41%	0.412	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	153.9	-173.2	-164.6	11.2	0	0	0	112.8	S240 T302	S240-N290 WeakPolarHBondContact CB-OD1 3.47Å; N290-T302 WeakPolarHBondContact CB-OG1 3.23Å; N290-T302 PolarHBondContact N-O 2.79Å; N290-T302 PolarHBondContact O-N 3.49Å; N290-T302 PolarHBondContact O-OG1 2.85Å
291	M	88.2	Confident	83.8	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.034	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.8	175.8	-176.6	-166.8	-72.9	0	0	110.8	S240 N242 V256 L258 L269 F299 L300 L301	S240-M291 WeakPolarHBondContact OG-CB 3.45Å; S240-M291 PolarHBondContact OG-N 2.95Å; S240-M291 VanDerWaalsContact OG-N 3.11Å; N242-M291 HydrophobicContact CB-SD 4.03Å; N242-M291 PolarHBondContact ND2-O 2.85Å; V256-M291 HydrophobicContact CB-CE 4.1Å; V256-M291 HydrophobicContact CB-SD 4.46Å; V256-M291 HydrophobicContact CG1-CE 3.57Å; L258-M291 HydrophobicContact CB-CB 4.4Å; L258-M291 HydrophobicContact CB-CE 4.12Å; L269-M291 HydrophobicContact CD2-CE 3.59Å; M291-F299 HydrophobicContact CE-CD2 4.11Å; M291-F299 HydrophobicContact CE-CE2 3.87Å; M291-F299 HydrophobicContact CE-CZ 4.47Å; M291-F299 HydrophobicContact CG-CB 4.29Å; M291-F299 HydrophobicContact CG-CD2 3.72Å; M291-F299 HydrophobicContact CG-CE2 4.4Å; M291-F299 HydrophobicContact CG-CG 4.27Å; M291-F299 HydrophobicContact SD-CD2 4.05Å; M291-F299 HydrophobicContact SD-CE2 4.38Å; M291-F299 HydrophobicContact SD-CG 4.4Å; M291-L300 WeakPolarHBondContact CA-O 3.38Å; M291-L301 HydrophobicContact CB-CD2 3.89Å; M291-L301 HydrophobicContact CE-CD2 4.06Å; M291-L301 HydrophobicContact CG-CD2 3.88Å
292	V	88.9	Confident	84.1	Confident	39 Å²	39	41.7 Å²	41.7	24%	0.236	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119.5	176.5	-176.1	0	0	0	0	109.2	L294 F299 L300 T302	V292-L294 HydrophobicContact CG1-CD2 4.44Å; V292-L294 PolarHBondContact O-N 3.09Å; V292-F299 WeakPolarHBondContact O-CA 3.4Å; V292-F299 WeakPolarHBondContact O-CB 3.4Å; V292-L300 HydrophobicContact CB-CB 4.5Å; V292-L300 PolarHBondContact N-O 2.94Å; V292-L300 PolarHBondContact O-N 3.06Å; V292-T302 HydrophobicContact CG2-CG2 4.3Å
293	K	88.8	Confident	84.1	Confident	72 Å²	72	39.6 Å²	39.6	31%	0.313	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	126.9	171.3	-178.3	176.2	177.7	-177	0	108.9	I243 F244 T295 D296	I243-K293 PolarHBondContact O-NZ 3.37Å; F244-K293 HydrophobicContact CE1-CD 4.34Å; F244-K293 HydrophobicContact CE1-CG 3.89Å; F244-K293 HydrophobicContact CZ-CG 4.44Å; K293-T295 WeakPolarHBondContact CE-O 3.39Å; K293-T295 WeakPolarHBondContact CG-O 3.47Å; K293-D296 WeakPolarHBondContact CE-OD1 3.32Å; K293-D296 IonicContact NZ-OD1 2.86Å; K293-D296 PolarHBondContact NZ-OD1 2.92Å
294	L	89.9	Confident	83.9	Confident	17 Å²	17	35.8 Å²	35.8	9%	0.089	19%	0.192	C	C	.	.			trans	-101	-58.9	178.5	-60.5	176.9	0	0	0	110.3	V292 D298 L300 V313 L336 L345 L366	V292-L294 HydrophobicContact CG1-CD2 4.44Å; V292-L294 PolarHBondContact O-N 3.09Å; L294-D298 HydrophobicContact CB-CB 4.39Å; L294-D298 WeakPolarHBondContact CB-O 3.35Å; L294-D298 PolarHBondContact N-O 3.39Å; L294-L300 HydrophobicContact CD1-CB 4.04Å; L294-L300 HydrophobicContact CD2-CB 4.31Å; L294-L300 HydrophobicContact CG-CB 4.23Å; L294-V313 HydrophobicContact CD1-CG1 4.5Å; L294-L336 HydrophobicContact CD2-CB 4.35Å; L294-L336 WeakPolarHBondContact O-CD2 3.39Å; L294-L345 HydrophobicContact CD1-CD1 3.74Å; L294-L345 HydrophobicContact CD1-CD2 4.26Å; L294-L345 HydrophobicContact CD2-CD1 3.6Å; L294-L345 HydrophobicContact CG-CD1 4.33Å; L294-L366 HydrophobicContact CD1-CD1 3.71Å
295	T	86.7	Confident	83.3	Confident	37 Å²	37	39.1 Å²	39.1	23%	0.227	21%	0.214	C	C	.	.	S	Bend	trans	-125.5	-174.4	177.9	68.2	0	0	0	0	109.2	K293 N297 D298 L336 L366	K293-T295 WeakPolarHBondContact CE-O 3.39Å; K293-T295 WeakPolarHBondContact CG-O 3.47Å; T295-N297 PolarHBondContact O-N 3.34Å; T295-N297 PolarHBondContact OG1-N 2.86Å; T295-D298 PolarHBondContact N-O 2.84Å; T295-D298 VanDerWaalsContact N-O 3.1Å; T295-D298 VanDerWaalsContact OG1-CB 3.25Å; T295-D298 WeakPolarHBondContact OG1-CB 3.19Å; T295-D298 PolarHBondContact OG1-N 3.31Å; T295-D298 PolarHBondContact OG1-OD2 2.85Å; T295-L336 HydrophobicContact CG2-CD2 4.13Å; T295-L366 HydrophobicContact CG2-CD2 3.62Å
296	D	78.3	Confident	82.8	Confident	70 Å²	70	36.9 Å²	36.9	37%	0.374	21%	0.211	S	C	.	.	S	Bend	trans	-70.4	-12.8	174.8	-70.3	-38.9	0	0	0	114	F244 K293	F244-D296 VanDerWaalsContact CB-O 3.27Å; F244-D296 WeakPolarHBondContact CB-O 3.49Å; F244-D296 VanDerWaalsContact CD1-O 3.31Å; F244-D296 WeakPolarHBondContact CD1-O 3.36Å; K293-D296 WeakPolarHBondContact CE-OD1 3.32Å; K293-D296 IonicContact NZ-OD1 2.86Å; K293-D296 PolarHBondContact NZ-OD1 2.92Å
297	N	84.2	Confident	82.1	Confident	39 Å²	39	38.7 Å²	38.7	21%	0.209	22%	0.215	C	C	.	.	S	Bend	trans	-123.7	-18.9	177.9	-60.1	-27.4	0	0	0	113.7	T295 L316	T295-N297 PolarHBondContact O-N 3.34Å; T295-N297 PolarHBondContact OG1-N 2.86Å; N297-L316 PolarHBondContact O-N 3.39Å
298	D	91.4	Very high	81.4	Confident	14 Å²	14	42.2 Å²	42.2	8%	0.075	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	142.8	-175.3	-54.9	-54.8	0	0	0	112.3	L294 T295 Y314 H315	L294-D298 HydrophobicContact CB-CB 4.39Å; L294-D298 WeakPolarHBondContact CB-O 3.35Å; L294-D298 PolarHBondContact N-O 3.39Å; T295-D298 PolarHBondContact N-O 2.84Å; T295-D298 VanDerWaalsContact N-O 3.1Å; T295-D298 VanDerWaalsContact OG1-CB 3.25Å; T295-D298 WeakPolarHBondContact OG1-CB 3.19Å; T295-D298 PolarHBondContact OG1-N 3.31Å; T295-D298 PolarHBondContact OG1-OD2 2.85Å; D298-Y314 WeakPolarHBondContact CA-O 3.42Å; D298-H315 WeakPolarHBondContact OD1-CB 3.27Å; D298-H315 IonicContact OD1-CE1 3.84Å; D298-H315 IonicContact OD1-CG 3.46Å; D298-H315 IonicContact OD1-ND1 2.72Å; D298-H315 PolarHBondContact OD1-ND1 2.71Å
299	F	92.9	Very high	80.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.5	172.7	63	-89.1	0	0	0	112.6	F244 V256 L269 M291 V292 L301 V313 Y314 L316 P322	F244-F299 HydrophobicContact CE1-CB 3.89Å; F244-F299 AromaticContact CE1-CD1 3.83Å; F244-F299 HydrophobicContact CE1-CD1 3.83Å; F244-F299 HydrophobicContact CE1-CG 4.28Å; F244-F299 AromaticContact CE2-CD1 3.99Å; F244-F299 HydrophobicContact CE2-CD1 3.99Å; F244-F299 HydrophobicContact CE2-CE1 4.45Å; F244-F299 HydrophobicContact CZ-CB 3.6Å; F244-F299 AromaticContact CZ-CD1 3.41Å; F244-F299 HydrophobicContact CZ-CD1 3.41Å; F244-F299 VanDerWaalsContact CZ-CD1 3.41Å; F244-F299 HydrophobicContact CZ-CE1 4.29Å; F244-F299 AromaticContact CZ-CG 3.73Å; F244-F299 HydrophobicContact CZ-CG 3.73Å; V256-F299 HydrophobicContact CG1-CE1 4.35Å; V256-F299 HydrophobicContact CG1-CZ 3.91Å; V256-F299 HydrophobicContact CG2-CE1 4.38Å; L269-F299 HydrophobicContact CD1-CE2 4.33Å; L269-F299 HydrophobicContact CD1-CZ 4.25Å; L269-F299 HydrophobicContact CD2-CE2 4.09Å; L269-F299 HydrophobicContact CD2-CZ 4.4Å; M291-F299 HydrophobicContact CE-CD2 4.11Å; M291-F299 HydrophobicContact CE-CE2 3.87Å; M291-F299 HydrophobicContact CE-CZ 4.47Å; M291-F299 HydrophobicContact CG-CB 4.29Å; M291-F299 HydrophobicContact CG-CD2 3.72Å; M291-F299 HydrophobicContact CG-CE2 4.4Å; M291-F299 HydrophobicContact CG-CG 4.27Å; M291-F299 HydrophobicContact SD-CD2 4.05Å; M291-F299 HydrophobicContact SD-CE2 4.38Å; M291-F299 HydrophobicContact SD-CG 4.4Å; V292-F299 WeakPolarHBondContact O-CA 3.4Å; V292-F299 WeakPolarHBondContact O-CB 3.4Å; F299-L301 HydrophobicContact CD2-CD2 3.97Å; F299-L301 HydrophobicContact CD2-CG 4.35Å; F299-L301 HydrophobicContact CE2-CD2 3.88Å; F299-L301 HydrophobicContact CE2-CG 4.15Å; F299-V313 WeakPolarHBondContact O-CA 3.48Å; F299-Y314 HydrophobicContact CE2-CD2 4.08Å; F299-Y314 AromaticContact CE2-CG 3.94Å; F299-Y314 HydrophobicContact CE2-CG 3.94Å; F299-Y314 HydrophobicContact CZ-CD1 4.41Å; F299-Y314 HydrophobicContact CZ-CD2 4.42Å; F299-Y314 AromaticContact CZ-CG 3.81Å; F299-Y314 HydrophobicContact CZ-CG 3.81Å; F299-Y314 PolarHBondContact N-O 3.44Å; F299-Y314 PolarHBondContact O-N 3.33Å; F299-L316 HydrophobicContact CE1-CG 4.47Å; F299-P322 HydrophobicContact CE1-CB 4.23Å; F299-P322 HydrophobicContact CZ-CB 3.99Å
300	L	92.8	Very high	81.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.6	176.6	174.5	67.1	0	0	0	110	M291 V292 L294 T302 V313 V328 L345 T347	M291-L300 WeakPolarHBondContact CA-O 3.38Å; V292-L300 HydrophobicContact CB-CB 4.5Å; V292-L300 PolarHBondContact N-O 2.94Å; V292-L300 PolarHBondContact O-N 3.06Å; L294-L300 HydrophobicContact CD1-CB 4.04Å; L294-L300 HydrophobicContact CD2-CB 4.31Å; L294-L300 HydrophobicContact CG-CB 4.23Å; L300-T302 HydrophobicContact CD2-CG2 3.64Å; L300-T302 HydrophobicContact CG-CG2 3.87Å; L300-V313 HydrophobicContact CD1-CG2 3.89Å; L300-V328 HydrophobicContact CD1-CG2 3.68Å; L300-L345 HydrophobicContact CD1-CD2 4.5Å; L300-L345 HydrophobicContact CD2-CD1 4.24Å; L300-T347 HydrophobicContact CD2-CG2 4.29Å
301	L	90.6	Very high	81.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	127.1	161.7	-57.3	-175	0	0	0	109.4	L258 L269 F288 M291 F299 G311 A312 Y314	L258-L301 HydrophobicContact CD1-CD1 4.49Å; L258-L301 HydrophobicContact CD1-CD2 4.25Å; L258-L301 HydrophobicContact CD2-CD2 4.37Å; L269-L301 HydrophobicContact CD1-CD1 4.14Å; L269-L301 HydrophobicContact CD2-CD1 4.07Å; L269-L301 HydrophobicContact CD2-CD2 4.12Å; L269-L301 HydrophobicContact CG-CD1 4.28Å; F288-L301 HydrophobicContact CB-CB 4.08Å; F288-L301 HydrophobicContact CD1-CB 3.57Å; F288-L301 HydrophobicContact CD2-CB 4.03Å; F288-L301 HydrophobicContact CD2-CD1 3.77Å; F288-L301 HydrophobicContact CE1-CB 3.94Å; F288-L301 HydrophobicContact CE2-CB 4.36Å; F288-L301 HydrophobicContact CE2-CD1 4.11Å; F288-L301 HydrophobicContact CG-CB 3.61Å; F288-L301 HydrophobicContact CG-CD1 4.14Å; F288-L301 HydrophobicContact CZ-CB 4.32Å; M291-L301 HydrophobicContact CB-CD2 3.89Å; M291-L301 HydrophobicContact CE-CD2 4.06Å; M291-L301 HydrophobicContact CG-CD2 3.88Å; F299-L301 HydrophobicContact CD2-CD2 3.97Å; F299-L301 HydrophobicContact CD2-CG 4.35Å; F299-L301 HydrophobicContact CE2-CD2 3.88Å; F299-L301 HydrophobicContact CE2-CG 4.15Å; L301-G311 WeakPolarHBondContact O-CA 3.31Å; L301-A312 HydrophobicContact CB-CB 4.48Å; L301-A312 PolarHBondContact N-O 2.84Å; L301-A312 PolarHBondContact O-N 3.35Å; L301-A312 VanDerWaalsContact O-N 3.09Å; L301-Y314 HydrophobicContact CD1-CD2 3.97Å; L301-Y314 HydrophobicContact CD1-CE2 3.65Å; L301-Y314 HydrophobicContact CG-CD2 4.2Å; L301-Y314 HydrophobicContact CG-CE2 4.34Å
302	T	88.9	Confident	81.4	Confident	4 Å²	4	39.2 Å²	39.2	3%	0.025	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	143.1	-177.9	52.5	0	0	0	0	110.6	F288 A289 N290 V292 L300 A331 M332	F288-T302 CarbonylContact C-O 3.53Å; F288-T302 WeakPolarHBondContact CA-O 3.48Å; A289-T302 PolarHBondContact N-O 2.95Å; N290-T302 WeakPolarHBondContact CB-OG1 3.23Å; N290-T302 PolarHBondContact N-O 2.79Å; N290-T302 PolarHBondContact O-N 3.49Å; N290-T302 PolarHBondContact O-OG1 2.85Å; V292-T302 HydrophobicContact CG2-CG2 4.3Å; L300-T302 HydrophobicContact CD2-CG2 3.64Å; L300-T302 HydrophobicContact CG-CG2 3.87Å; T302-A331 VanDerWaalsContact CA-O 3.26Å; T302-A331 WeakPolarHBondContact CA-O 3.49Å; T302-A331 VanDerWaalsContact CB-O 3.28Å; T302-A331 WeakPolarHBondContact CB-O 3.25Å; T302-M332 WeakPolarHBondContact CB-O 3.46Å
303	S	83.4	Confident	81.6	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.021	21%	0.21	C	C	.	.			trans	-82.1	163.7	-179.4	63.1	0	0	0	0	111.4	T309 A331	S303-T309 WeakPolarHBondContact OG-CA 3.4Å; S303-T309 WeakPolarHBondContact OG-CB 3.44Å; S303-T309 WeakPolarHBondContact OG-CG2 3.42Å; S303-A331 PolarHBondContact N-O 3.42Å
304	S	76.3	Confident	81.8	Confident	28 Å²	28	34.6 Å²	34.6	20%	0.196	20%	0.198	C	C	.	.			trans	-67.8	160	168.2	78.3	0	0	0	0	111.2	L306	S304-L306 PolarHBondContact O-N 2.86Å
305	P	67	Low	81.8	Confident	77 Å²	77	37 Å²	37	50%	0.5	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.2	179.8	-15.9	29.4	0	0	0	114.3	M332	P305-M332 HydrophobicContact CB-CE 4.06Å; P305-M332 HydrophobicContact CB-CG 4.46Å; P305-M332 HydrophobicContact CB-SD 4.07Å; P305-M332 HydrophobicContact CG-CE 3.88Å; P305-M332 HydrophobicContact CG-CG 4.39Å; P305-M332 HydrophobicContact CG-SD 4.36Å
306	L	62.8	Low	81.9	Confident	169 Å²	169	35.4 Å²	35.4	89%	0.885	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-14.2	-171.3	-71.4	153.5	0	0	0	113.4	S304	S304-L306 PolarHBondContact O-N 2.86Å
307	E	59.6	Low	82.2	Confident	76 Å²	76	34.3 Å²	34.3	36%	0.355	19%	0.192	S	C	.	.	S	Bend	trans	-107.2	159.1	-172.9	-71.9	177.5	168.3	0	0	111.1	T287 T309	T287-E307 PolarHBondContact OG1-OE1 2.8Å; T287-E307 PolarHBondContact OG1-OE2 2.89Å; E307-T309 VanDerWaalsContact O-CG2 3.27Å; E307-T309 WeakPolarHBondContact O-CG2 3.5Å; E307-T309 PolarHBondContact O-N 2.81Å
308	P	58.2	Low	81.7	Confident	117 Å²	117	37.9 Å²	37.9	76%	0.76	22%	0.221	S	C	*	.			trans	-55.3	115.2	169.4	22.6	-32.1	0	0	0	109.3	T310	P308-T310 VanDerWaalsContact C-N 3.32Å; P308-T310 PolarHBondContact O-N 2.76Å
309	T	66.8	Low	81	Confident	12 Å²	12	40.3 Å²	40.3	7%	0.074	24%	0.238	C	C	.	.			trans	-79.9	77.8	-162.5	57.1	0	0	0	0	112.7	S303 E307 N329 N330 A331 M332 H349	S303-T309 WeakPolarHBondContact OG-CA 3.4Å; S303-T309 WeakPolarHBondContact OG-CB 3.44Å; S303-T309 WeakPolarHBondContact OG-CG2 3.42Å; E307-T309 VanDerWaalsContact O-CG2 3.27Å; E307-T309 WeakPolarHBondContact O-CG2 3.5Å; E307-T309 PolarHBondContact O-N 2.81Å; T309-N329 CarbonylContact O-C 3.58Å; T309-N330 WeakPolarHBondContact O-CA 3.16Å; T309-N330 PolarHBondContact O-N 3.01Å; T309-N330 VanDerWaalsContact OG1-CA 3.31Å; T309-N330 WeakPolarHBondContact OG1-CA 3.5Å; T309-A331 PolarHBondContact O-N 2.76Å; T309-A331 VanDerWaalsContact O-N 3.14Å; T309-M332 HydrophobicContact CG2-CB 4.26Å; T309-H349 WeakPolarHBondContact CG2-CD2 3.47Å
310	T	82.3	Confident	80.2	Confident	50 Å²	50	40.4 Å²	40.4	31%	0.307	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.8	167	57.3	0	0	0	0	109.5	F288 P308 V328	F288-T310 WeakPolarHBondContact CE1-O 3.25Å; P308-T310 VanDerWaalsContact C-N 3.32Å; P308-T310 PolarHBondContact O-N 2.76Å; T310-V328 CarbonylContact C-O 3.49Å; T310-V328 WeakPolarHBondContact CA-O 2.81Å
311	G	88.1	Confident	79.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	160.9	170.4	0	0	0	0	0	110.8	L301 F327 V328	L301-G311 WeakPolarHBondContact O-CA 3.31Å; G311-F327 CarbonylContact O-C 3.58Å; G311-F327 WeakPolarHBondContact O-CA 3.1Å; G311-V328 PolarHBondContact N-O 3.49Å; G311-V328 PolarHBondContact O-N 2.88Å
312	A	91.2	Very high	79.8	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.7	174.5	0	0	0	0	0	110.2	F288 L301 Y314 L324 F327	F288-A312 HydrophobicContact CE1-CB 4.16Å; F288-A312 HydrophobicContact CE2-CB 4.17Å; F288-A312 HydrophobicContact CZ-CB 3.55Å; L301-A312 HydrophobicContact CB-CB 4.48Å; L301-A312 PolarHBondContact N-O 2.84Å; L301-A312 PolarHBondContact O-N 3.35Å; L301-A312 VanDerWaalsContact O-N 3.09Å; A312-Y314 HydrophobicContact CB-CD2 4.23Å; A312-Y314 HydrophobicContact CB-CE2 3.75Å; A312-L324 HydrophobicContact CB-CD1 3.88Å; A312-F327 HydrophobicContact CB-CD1 3.89Å; A312-F327 HydrophobicContact CB-CE1 3.89Å
313	V	93.1	Very high	79.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.6	174.4	-179.5	0	0	0	0	108.5	L294 F299 L300 K325 Y326 V328 L345 L366	L294-V313 HydrophobicContact CD1-CG1 4.5Å; F299-V313 WeakPolarHBondContact O-CA 3.48Å; L300-V313 HydrophobicContact CD1-CG2 3.89Å; V313-K325 HydrophobicContact CG1-CB 4.48Å; V313-K325 WeakPolarHBondContact O-CB 3.29Å; V313-K325 PolarHBondContact O-N 3.47Å; V313-Y326 HydrophobicContact CB-CD2 4.08Å; V313-Y326 HydrophobicContact CB-CE2 3.69Å; V313-Y326 HydrophobicContact CG1-CE2 4.27Å; V313-Y326 HydrophobicContact CG2-CD2 4.1Å; V313-Y326 HydrophobicContact CG2-CE2 3.47Å; V313-Y326 VanDerWaalsContact CG2-CE2 3.47Å; V313-Y326 PolarHBondContact N-O 2.86Å; V313-Y326 PolarHBondContact O-N 3.29Å; V313-V328 HydrophobicContact CG2-CG1 4.2Å; V313-L345 HydrophobicContact CG2-CD2 3.49Å; V313-L345 VanDerWaalsContact CG2-CD2 3.49Å; V313-L366 HydrophobicContact CG1-CD1 4.5Å
314	Y	92.4	Very high	80.2	Confident	14 Å²	14	50.3 Å²	50.3	6%	0.055	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	141.1	176.1	-79.6	-100.5	0	0	0	109.7	L269 D298 F299 L301 A312 P322 V323 L324	L269-Y314 HydrophobicContact CD1-CD1 3.92Å; L269-Y314 HydrophobicContact CD1-CD2 4.23Å; L269-Y314 HydrophobicContact CD1-CE1 3.68Å; L269-Y314 HydrophobicContact CD1-CE2 4.01Å; L269-Y314 HydrophobicContact CD1-CG 4.2Å; D298-Y314 WeakPolarHBondContact CA-O 3.42Å; F299-Y314 HydrophobicContact CE2-CD2 4.08Å; F299-Y314 AromaticContact CE2-CG 3.94Å; F299-Y314 HydrophobicContact CE2-CG 3.94Å; F299-Y314 HydrophobicContact CZ-CD1 4.41Å; F299-Y314 HydrophobicContact CZ-CD2 4.42Å; F299-Y314 AromaticContact CZ-CG 3.81Å; F299-Y314 HydrophobicContact CZ-CG 3.81Å; F299-Y314 PolarHBondContact N-O 3.44Å; F299-Y314 PolarHBondContact O-N 3.33Å; L301-Y314 HydrophobicContact CD1-CD2 3.97Å; L301-Y314 HydrophobicContact CD1-CE2 3.65Å; L301-Y314 HydrophobicContact CG-CD2 4.2Å; L301-Y314 HydrophobicContact CG-CE2 4.34Å; A312-Y314 HydrophobicContact CB-CD2 4.23Å; A312-Y314 HydrophobicContact CB-CE2 3.75Å; Y314-P322 HydrophobicContact CD1-CB 3.97Å; Y314-V323 WeakPolarHBondContact CA-O 3Å; Y314-L324 HydrophobicContact CD1-CB 4.28Å; Y314-L324 HydrophobicContact CD2-CD1 4.3Å; Y314-L324 HydrophobicContact CE1-CB 3.81Å; Y314-L324 HydrophobicContact CE1-CD1 4.48Å; Y314-L324 HydrophobicContact CE2-CD1 3.83Å
315	H	91.2	Very high	80.9	Confident	67 Å²	67	52.7 Å²	52.7	31%	0.31	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	137.1	172.7	-179.1	70.1	0	0	0	108.9	D298 V323 K325	D298-H315 WeakPolarHBondContact OD1-CB 3.27Å; D298-H315 IonicContact OD1-CE1 3.84Å; D298-H315 IonicContact OD1-CG 3.46Å; D298-H315 IonicContact OD1-ND1 2.72Å; D298-H315 PolarHBondContact OD1-ND1 2.71Å; H315-V323 PolarHBondContact N-O 2.94Å; H315-V323 PolarHBondContact O-N 2.84Å; H315-K325 HydrophobicContact CB-CB 4.45Å; H315-K325 HydrophobicContact CB-CD 4.3Å
316	L	87.6	Confident	82.1	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	118.2	169.6	-68.9	168.7	0	0	0	109.4	F244 V254 V256 N297 F299 P322	F244-L316 HydrophobicContact CB-CD1 3.09Å; F244-L316 HydrophobicContact CD1-CD1 3.73Å; F244-L316 HydrophobicContact CD2-CD1 3.55Å; F244-L316 HydrophobicContact CE2-CD1 4.39Å; F244-L316 HydrophobicContact CG-CD1 3.16Å; F244-L316 HydrophobicContact CG-CG 4.5Å; V254-L316 HydrophobicContact CG1-CD2 4.31Å; V256-L316 HydrophobicContact CG2-CD2 4.11Å; N297-L316 PolarHBondContact O-N 3.39Å; F299-L316 HydrophobicContact CE1-CG 4.47Å; L316-P322 HydrophobicContact CD2-CB 4.16Å; L316-P322 HydrophobicContact CD2-CG 3.74Å
317	D	84.5	Confident	83.5	Confident	47 Å²	47	48.2 Å²	48.2	25%	0.251	27%	0.266	S	S	.	.			trans	-66.2	175	173.1	73.8	9.8	0	0	0	111.8	L246 S319 G320 I321 V323	L246-D317 WeakPolarHBondContact CD2-O 3.12Å; D317-S319 VanDerWaalsContact CG-OG 3.23Å; D317-S319 PolarHBondContact O-N 2.79Å; D317-S319 VanDerWaalsContact OD1-CA 3.31Å; D317-S319 WeakPolarHBondContact OD1-CA 3.23Å; D317-S319 WeakPolarHBondContact OD1-CB 3.46Å; D317-S319 PolarHBondContact OD1-N 3.31Å; D317-S319 PolarHBondContact OD1-OG 2.88Å; D317-S319 PolarHBondContact OD2-OG 3.41Å; D317-S319 VanDerWaalsContact OD2-OG 3.12Å; D317-G320 PolarHBondContact O-N 2.93Å; D317-G320 PolarHBondContact OD1-N 3.04Å; D317-I321 PolarHBondContact N-O 2.86Å; D317-I321 VanDerWaalsContact N-O 3.11Å; D317-I321 PolarHBondContact OD1-N 3.21Å; D317-V323 HydrophobicContact CB-CG2 4.25Å
318	S	75.5	Confident	85	Confident	115 Å²	115	44.6 Å²	44.6	80%	0.804	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-13.2	179	56.1	0	0	0	0	114.4	L246	L246-S318 WeakPolarHBondContact CD2-O 3.07Å
319	S	76	Confident	86.5	Confident	64 Å²	64	43.3 Å²	43.3	45%	0.448	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-11.9	175.2	76.9	0	0	0	0	113.1	D317 I321	D317-S319 VanDerWaalsContact CG-OG 3.23Å; D317-S319 PolarHBondContact O-N 2.79Å; D317-S319 VanDerWaalsContact OD1-CA 3.31Å; D317-S319 WeakPolarHBondContact OD1-CA 3.23Å; D317-S319 WeakPolarHBondContact OD1-CB 3.46Å; D317-S319 PolarHBondContact OD1-N 3.31Å; D317-S319 PolarHBondContact OD1-OG 2.88Å; D317-S319 PolarHBondContact OD2-OG 3.41Å; D317-S319 VanDerWaalsContact OD2-OG 3.12Å; S319-I321 VanDerWaalsContact OG-CD1 3.32Å; S319-I321 WeakPolarHBondContact OG-CD1 3.27Å; S319-I321 WeakPolarHBondContact OG-CG1 3.33Å
320	G	76.2	Confident	87.5	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.031	24%	0.241	C	C	.	.	S	Bend	trans	92.8	16	179.6	0	0	0	0	0	113.8	V254 D317	V254-G320 WeakPolarHBondContact CG1-O 3.46Å; D317-G320 PolarHBondContact O-N 2.93Å; D317-G320 PolarHBondContact OD1-N 3.04Å
321	I	85.5	Confident	87.8	Confident	71 Å²	71	42.1 Å²	42.1	36%	0.364	23%	0.227	S	C	.	.			trans	-90.3	128.3	179.2	-61.6	171.4	0	0	0	108.7	F271 I282 D317 S319 V323	F271-I321 HydrophobicContact CE2-CB 4.27Å; F271-I321 HydrophobicContact CE2-CG1 3.94Å; F271-I321 HydrophobicContact CE2-CG2 4.27Å; F271-I321 HydrophobicContact CZ-CG1 4.35Å; F271-I321 HydrophobicContact CZ-CG2 4.04Å; I282-I321 HydrophobicContact CD1-CG2 4.41Å; D317-I321 PolarHBondContact N-O 2.86Å; D317-I321 VanDerWaalsContact N-O 3.11Å; D317-I321 PolarHBondContact OD1-N 3.21Å; S319-I321 VanDerWaalsContact OG-CD1 3.32Å; S319-I321 WeakPolarHBondContact OG-CD1 3.27Å; S319-I321 WeakPolarHBondContact OG-CG1 3.33Å; I321-V323 PolarHBondContact O-N 3.37Å; I321-V323 VanDerWaalsContact O-N 3.17Å
322	P	89	Confident	87.9	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.032	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	112.1	172.4	-17.5	28.6	0	0	0	111.2	V256 L269 F271 I282 F299 Y314 L316	V256-P322 HydrophobicContact CG1-CG 4.24Å; V256-P322 HydrophobicContact CG2-CG 4.17Å; L269-P322 HydrophobicContact CD1-CB 4.49Å; F271-P322 HydrophobicContact CB-CG 3.98Å; F271-P322 HydrophobicContact CD1-CG 3.85Å; F271-P322 VanDerWaalsContact CD2-CD 3.46Å; F271-P322 HydrophobicContact CD2-CG 4.27Å; F271-P322 HydrophobicContact CE1-CG 4.49Å; F271-P322 VanDerWaalsContact CG-CD 3.41Å; F271-P322 HydrophobicContact CG-CG 3.74Å; I282-P322 HydrophobicContact CD1-CB 4.33Å; I282-P322 HydrophobicContact CD1-CG 4.4Å; I282-P322 WeakPolarHBondContact CD1-O 3.25Å; F299-P322 HydrophobicContact CE1-CB 4.23Å; F299-P322 HydrophobicContact CZ-CB 3.99Å; Y314-P322 HydrophobicContact CD1-CB 3.97Å; L316-P322 HydrophobicContact CD2-CB 4.16Å; L316-P322 HydrophobicContact CD2-CG 3.74Å
323	V	90.8	Very high	87.8	Confident	70 Å²	70	44.2 Å²	44.2	42%	0.424	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.8	175.1	-177	0	0	0	0	109	Y314 H315 D317 I321 K325	Y314-V323 WeakPolarHBondContact CA-O 3Å; H315-V323 PolarHBondContact N-O 2.94Å; H315-V323 PolarHBondContact O-N 2.84Å; D317-V323 HydrophobicContact CB-CG2 4.25Å; I321-V323 PolarHBondContact O-N 3.37Å; I321-V323 VanDerWaalsContact O-N 3.17Å; V323-K325 PolarHBondContact O-N 3.43Å
324	L	90.6	Very high	87.7	Confident	69 Å²	69	44.4 Å²	44.4	36%	0.361	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	120	174.3	175.1	68.3	0	0	0	109.2	A312 Y314 F327	A312-L324 HydrophobicContact CB-CD1 3.88Å; Y314-L324 HydrophobicContact CD1-CB 4.28Å; Y314-L324 HydrophobicContact CD2-CD1 4.3Å; Y314-L324 HydrophobicContact CE1-CB 3.81Å; Y314-L324 HydrophobicContact CE1-CD1 4.48Å; Y314-L324 HydrophobicContact CE2-CD1 3.83Å; L324-F327 HydrophobicContact CD1-CE1 4.37Å; L324-F327 HydrophobicContact CD1-CE2 4.47Å; L324-F327 HydrophobicContact CD1-CZ 4.23Å; L324-F327 HydrophobicContact CD2-CD2 4.41Å; L324-F327 HydrophobicContact CD2-CE2 3.56Å; L324-F327 HydrophobicContact CD2-CZ 3.62Å
325	K	90.7	Very high	87.8	Confident	78 Å²	78	44.5 Å²	44.5	34%	0.339	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-54.2	179.7	-158.1	-178.8	-179.3	-179.6	0	110.8	V313 H315 V323 L366 E367	V313-K325 HydrophobicContact CG1-CB 4.48Å; V313-K325 WeakPolarHBondContact O-CB 3.29Å; V313-K325 PolarHBondContact O-N 3.47Å; H315-K325 HydrophobicContact CB-CB 4.45Å; H315-K325 HydrophobicContact CB-CD 4.3Å; V323-K325 PolarHBondContact O-N 3.43Å; K325-L366 PolarHBondContact NZ-O 2.62Å; K325-E367 VanDerWaalsContact CE-O 3.27Å; K325-E367 WeakPolarHBondContact CE-O 3.5Å; K325-E367 PolarHBondContact NZ-O 3.48Å
326	Y	93.2	Very high	87.9	Confident	32 Å²	32	43.5 Å²	43.5	13%	0.125	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	167.1	176.8	48.4	-99.8	0	0	0	111.3	V313 V328 L366	V313-Y326 HydrophobicContact CB-CD2 4.08Å; V313-Y326 HydrophobicContact CB-CE2 3.69Å; V313-Y326 HydrophobicContact CG1-CE2 4.27Å; V313-Y326 HydrophobicContact CG2-CD2 4.1Å; V313-Y326 HydrophobicContact CG2-CE2 3.47Å; V313-Y326 VanDerWaalsContact CG2-CE2 3.47Å; V313-Y326 PolarHBondContact N-O 2.86Å; V313-Y326 PolarHBondContact O-N 3.29Å; Y326-V328 HydrophobicContact CD2-CG1 3.8Å; Y326-V328 HydrophobicContact CE2-CG1 3.7Å; Y326-L366 WeakPolarHBondContact OH-CA 3.44Å; Y326-L366 PolarHBondContact OH-O 3.26Å
327	F	90.8	Very high	88.1	Confident	119 Å²	119	43.5 Å²	43.5	52%	0.522	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	148.6	170.6	-68.6	-80.5	0	0	0	110.8	G311 A312 L324	G311-F327 CarbonylContact O-C 3.58Å; G311-F327 WeakPolarHBondContact O-CA 3.1Å; A312-F327 HydrophobicContact CB-CD1 3.89Å; A312-F327 HydrophobicContact CB-CE1 3.89Å; L324-F327 HydrophobicContact CD1-CE1 4.37Å; L324-F327 HydrophobicContact CD1-CE2 4.47Å; L324-F327 HydrophobicContact CD1-CZ 4.23Å; L324-F327 HydrophobicContact CD2-CD2 4.41Å; L324-F327 HydrophobicContact CD2-CE2 3.56Å; L324-F327 HydrophobicContact CD2-CZ 3.62Å
328	V	91.6	Very high	88.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	155.9	175.8	-67.8	0	0	0	0	109.8	L300 T310 G311 V313 Y326 A331 L345 T347 Y364	L300-V328 HydrophobicContact CD1-CG2 3.68Å; T310-V328 CarbonylContact C-O 3.49Å; T310-V328 WeakPolarHBondContact CA-O 2.81Å; G311-V328 PolarHBondContact N-O 3.49Å; G311-V328 PolarHBondContact O-N 2.88Å; V313-V328 HydrophobicContact CG2-CG1 4.2Å; Y326-V328 HydrophobicContact CD2-CG1 3.8Å; Y326-V328 HydrophobicContact CE2-CG1 3.7Å; V328-A331 HydrophobicContact CG2-CB 3.87Å; V328-L345 HydrophobicContact CG1-CD2 4.18Å; V328-T347 HydrophobicContact CB-CG2 4.26Å; V328-T347 HydrophobicContact CG2-CG2 3.97Å; V328-Y364 HydrophobicContact CB-CD2 4.3Å; V328-Y364 HydrophobicContact CB-CE2 3.82Å; V328-Y364 HydrophobicContact CG1-CD1 4.18Å; V328-Y364 HydrophobicContact CG1-CD2 3.89Å; V328-Y364 HydrophobicContact CG1-CE1 4.16Å; V328-Y364 HydrophobicContact CG1-CE2 3.88Å; V328-Y364 HydrophobicContact CG1-CG 4.05Å
329	N	89.8	Confident	88.9	Confident	90 Å²	90	40.3 Å²	40.3	48%	0.481	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	163.5	177.8	-64.4	-25.5	0	0	0	110.4	T309 A331 T347 N362 Y364	T309-N329 CarbonylContact O-C 3.58Å; N329-A331 VanDerWaalsContact C-N 3.31Å; N329-A331 PolarHBondContact O-N 2.85Å; N329-T347 PolarHBondContact O-OG1 2.96Å; N329-N362 PolarHBondContact O-ND2 3.1Å; N329-Y364 PolarHBondContact N-OH 2.94Å
330	N	88	Confident	89.3	Confident	36 Å²	36	43 Å²	43	19%	0.193	23%	0.226	C	C	.	.	S	Bend	trans	55.1	43.6	-179.1	-60.1	-28	0	0	0	112.4	T309 T347 L348 H349 A360 N362	T309-N330 WeakPolarHBondContact O-CA 3.16Å; T309-N330 PolarHBondContact O-N 3.01Å; T309-N330 VanDerWaalsContact OG1-CA 3.31Å; T309-N330 WeakPolarHBondContact OG1-CA 3.5Å; N330-T347 CarbonylContact O-C 3.58Å; N330-T347 WeakPolarHBondContact O-CB 3.24Å; N330-L348 CarbonylContact O-C 3.59Å; N330-L348 VanDerWaalsContact O-CA 3.28Å; N330-L348 WeakPolarHBondContact O-CA 3.46Å; N330-L348 PolarHBondContact O-N 3.31Å; N330-H349 HydrophobicContact CB-CB 3.75Å; N330-H349 PolarHBondContact O-N 3.48Å; N330-A360 HydrophobicContact CB-CB 4.41Å; N330-N362 PolarHBondContact ND2-ND2 2.99Å; N330-N362 VanDerWaalsContact ND2-ND2 3.15Å; N330-N362 PolarHBondContact ND2-OD1 3.41Å
331	A	88.9	Confident	89.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.26	C	S	.	.			trans	-108.7	55.4	-172.5	0	0	0	0	0	113	T302 S303 T309 V328 N329 T347	T302-A331 VanDerWaalsContact CA-O 3.26Å; T302-A331 WeakPolarHBondContact CA-O 3.49Å; T302-A331 VanDerWaalsContact CB-O 3.28Å; T302-A331 WeakPolarHBondContact CB-O 3.25Å; S303-A331 PolarHBondContact N-O 3.42Å; T309-A331 PolarHBondContact O-N 2.76Å; T309-A331 VanDerWaalsContact O-N 3.14Å; V328-A331 HydrophobicContact CG2-CB 3.87Å; N329-A331 VanDerWaalsContact C-N 3.31Å; N329-A331 PolarHBondContact O-N 2.85Å; A331-T347 HydrophobicContact CB-CG2 4.07Å
332	M	89.2	Confident	89.7	Confident	21 Å²	21	49.6 Å²	49.6	10%	0.103	27%	0.268	C	S	.	.	S	Bend	trans	-70.1	-41.4	166.1	178.1	-171.4	159.7	0	0	110.1	T302 P305 T309 L348	T302-M332 WeakPolarHBondContact CB-O 3.46Å; P305-M332 HydrophobicContact CB-CE 4.06Å; P305-M332 HydrophobicContact CB-CG 4.46Å; P305-M332 HydrophobicContact CB-SD 4.07Å; P305-M332 HydrophobicContact CG-CE 3.88Å; P305-M332 HydrophobicContact CG-CG 4.39Å; P305-M332 HydrophobicContact CG-SD 4.36Å; T309-M332 HydrophobicContact CG2-CB 4.26Å; M332-L348 WeakPolarHBondContact CB-O 3.35Å; M332-L348 PolarHBondContact N-O 3.09Å; M332-L348 VanDerWaalsContact N-O 3.12Å
333	I	89.8	Confident	89.9	Confident	23 Å²	23	50.5 Å²	50.5	12%	0.118	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146.1	175.7	-51.5	176.6	0	0	0	107.3	T347 L348 I389 I392	I333-T347 WeakPolarHBondContact O-CA 3.44Å; I333-L348 PolarHBondContact N-O 2.75Å; I333-L348 PolarHBondContact O-N 3.47Å; I333-I389 HydrophobicContact CD1-CB 3.93Å; I333-I389 HydrophobicContact CD1-CG2 3.68Å; I333-I389 WeakPolarHBondContact CD1-O 3.4Å; I333-I392 HydrophobicContact CG2-CD1 4.21Å; I333-I392 HydrophobicContact CG2-CG1 3.85Å; I333-I392 HydrophobicContact CG2-CG2 4.34Å
334	G	91	Very high	90	Very high	5 Å²	5	47.6 Å²	47.6	5%	0.052	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157	170.7	0	0	0	0	0	112.9	F346	G334-F346 CarbonylContact C-O 3.52Å; G334-F346 WeakPolarHBondContact CA-O 3.39Å
335	C	93.9	Very high	90.3	Very high	15 Å²	15	44.3 Å²	44.3	10%	0.101	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	161.7	174.1	71.7	0	0	0	0	110.9	F346 I392	C335-F346 PolarHBondContact N-O 2.75Å; C335-F346 PolarHBondContact O-N 3.15Å; C335-I392 HydrophobicContact CB-CD1 4.33Å; C335-I392 HydrophobicContact CB-CG1 3.93Å
336	L	93.5	Very high	90.5	Very high	47 Å²	47	40.6 Å²	40.6	25%	0.246	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	136.9	174.8	-170.8	71.9	0	0	0	110.2	L294 T295 T338 L366	L294-L336 HydrophobicContact CD2-CB 4.35Å; L294-L336 WeakPolarHBondContact O-CD2 3.39Å; T295-L336 HydrophobicContact CG2-CD2 4.13Å; L336-T338 HydrophobicContact CD2-CG2 3.9Å; L336-T338 HydrophobicContact CG-CG2 4.13Å; L336-L366 HydrophobicContact CD1-CD2 3.91Å
337	G	91	Very high	90.5	Very high	2 Å²	2	39 Å²	39	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.6	162.7	0	0	0	0	0	109.8	Y344 M396	G337-Y344 PolarHBondContact N-O 3.16Å; G337-Y344 PolarHBondContact O-N 3.36Å; G337-M396 VanDerWaalsContact C-SD 3.54Å
338	T	89	Confident	90.6	Very high	82 Å²	82	33.4 Å²	33.4	50%	0.503	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.6	179.7	55.7	0	0	0	0	110.7	L336 R342	L336-T338 HydrophobicContact CD2-CG2 3.9Å; L336-T338 HydrophobicContact CG-CG2 4.13Å; T338-R342 WeakPolarHBondContact CA-O 3.41Å
339	L	88.4	Confident	90.5	Very high	13 Å²	13	35.3 Å²	35.3	7%	0.068	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	123	177.4	-176.3	64.8	0	0	0	109.7	T46 G341 R342 Y344 M396 T398 P404	T46-L339 HydrophobicContact CG2-CD1 4.11Å; L339-G341 PolarHBondContact O-N 3.17Å; L339-R342 PolarHBondContact N-O 3.13Å; L339-R342 WeakPolarHBondContact O-CB 3.47Å; L339-R342 PolarHBondContact O-N 2.5Å; L339-Y344 HydrophobicContact CB-CE2 4.28Å; L339-M396 HydrophobicContact CB-CB 4.02Å; L339-M396 HydrophobicContact CB-CE 4.17Å; L339-M396 HydrophobicContact CB-SD 4.36Å; L339-M396 HydrophobicContact CD2-CE 4.31Å; L339-T398 HydrophobicContact CD1-CG2 4.33Å; L339-T398 HydrophobicContact CD2-CG2 4.44Å; L339-P404 HydrophobicContact CD2-CB 3.62Å
340	N	83.9	Confident	90.5	Very high	121 Å²	121	31.3 Å²	31.3	65%	0.647	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	38.6	178.9	-63.1	-24.2	0	0	0	113.9	T46 R342	T46-N340 WeakPolarHBondContact CG2-OD1 3.1Å; N340-R342 PolarHBondContact O-N 3.23Å
341	G	82.7	Confident	90.4	Very high	73 Å²	73	32.4 Å²	32.4	75%	0.753	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.9	-12.5	-177.8	0	0	0	0	0	115.1	L339	L339-G341 PolarHBondContact O-N 3.17Å
342	R	88.8	Confident	90	Very high	140 Å²	140	33.7 Å²	33.7	53%	0.528	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	139.2	171.2	-67.2	-174.3	178.5	171.6	-1.3	110.7	T338 L339 N340 Y344	T338-R342 WeakPolarHBondContact CA-O 3.41Å; L339-R342 PolarHBondContact N-O 3.13Å; L339-R342 WeakPolarHBondContact O-CB 3.47Å; L339-R342 PolarHBondContact O-N 2.5Å; N340-R342 PolarHBondContact O-N 3.23Å; R342-Y344 HydrophobicContact CB-CD2 4.45Å; R342-Y344 HydrophobicContact CB-CE2 3.74Å
343	S	92.4	Very high	89.6	Confident	24 Å²	24	39.3 Å²	39.3	17%	0.168	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.4	-177.9	-73.6	0	0	0	0	109.9	L366	S343-L366 VanDerWaalsContact O-CB 3.23Å; S343-L366 WeakPolarHBondContact O-CB 3.47Å; S343-L366 PolarHBondContact O-N 2.77Å
344	Y	94.1	Very high	89.3	Confident	8 Å²	8	42.2 Å²	42.2	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.2	179.7	-62.8	-91.7	0	0	0	109.9	G337 L339 R342 I363 Y364 E374 M396	G337-Y344 PolarHBondContact N-O 3.16Å; G337-Y344 PolarHBondContact O-N 3.36Å; L339-Y344 HydrophobicContact CB-CE2 4.28Å; R342-Y344 HydrophobicContact CB-CD2 4.45Å; R342-Y344 HydrophobicContact CB-CE2 3.74Å; Y344-I363 HydrophobicContact CD1-CG2 4.1Å; Y344-I363 HydrophobicContact CG-CG2 4.5Å; Y344-Y364 CarbonylContact C-O 3.57Å; Y344-Y364 VanDerWaalsContact CA-O 3.28Å; Y344-Y364 WeakPolarHBondContact CA-O 3.48Å; Y344-E374 PolarHBondContact OH-OE2 3.13Å; Y344-M396 HydrophobicContact CD1-CE 4.46Å; Y344-M396 HydrophobicContact CD2-CE 3.36Å; Y344-M396 HydrophobicContact CD2-SD 3.47Å; Y344-M396 WeakPolarHBondContact CD2-SD 3.45Å; Y344-M396 HydrophobicContact CE2-CE 3.69Å; Y344-M396 HydrophobicContact CE2-SD 4.3Å; Y344-M396 HydrophobicContact CG-CE 3.77Å; Y344-M396 HydrophobicContact CG-SD 3.89Å
345	L	95.4	Very high	88.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.4	175.5	176.4	60.8	0	0	0	109.6	L294 L300 V313 V328 T347 I363 Y364 L366	L294-L345 HydrophobicContact CD1-CD1 3.74Å; L294-L345 HydrophobicContact CD1-CD2 4.26Å; L294-L345 HydrophobicContact CD2-CD1 3.6Å; L294-L345 HydrophobicContact CG-CD1 4.33Å; L300-L345 HydrophobicContact CD1-CD2 4.5Å; L300-L345 HydrophobicContact CD2-CD1 4.24Å; V313-L345 HydrophobicContact CG2-CD2 3.49Å; V313-L345 VanDerWaalsContact CG2-CD2 3.49Å; V328-L345 HydrophobicContact CG1-CD2 4.18Å; L345-T347 HydrophobicContact CD2-CG2 4.31Å; L345-T347 HydrophobicContact CG-CG2 4.07Å; L345-I363 WeakPolarHBondContact O-CA 3.47Å; L345-Y364 PolarHBondContact N-O 3.11Å; L345-Y364 PolarHBondContact O-N 3.07Å; L345-L366 HydrophobicContact CB-CD1 4.33Å
346	F	95.1	Very high	88.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.8	172.8	-69.6	-107.2	0	0	0	108.3	G334 C335 L361 I363 A394 M396 F406 L408	G334-F346 CarbonylContact C-O 3.52Å; G334-F346 WeakPolarHBondContact CA-O 3.39Å; C335-F346 PolarHBondContact N-O 2.75Å; C335-F346 PolarHBondContact O-N 3.15Å; F346-L361 HydrophobicContact CD1-CD1 4.18Å; F346-I363 HydrophobicContact CD1-CD1 3.92Å; F346-I363 HydrophobicContact CD1-CG1 3.67Å; F346-I363 HydrophobicContact CE1-CD1 3.41Å; F346-I363 VanDerWaalsContact CE1-CD1 3.41Å; F346-I363 HydrophobicContact CE1-CG1 3.64Å; F346-I363 HydrophobicContact CE1-CG2 4.44Å; F346-I363 HydrophobicContact CE2-CG2 4.39Å; F346-I363 HydrophobicContact CG-CG1 4.32Å; F346-I363 HydrophobicContact CZ-CD1 4.06Å; F346-I363 HydrophobicContact CZ-CG1 4.28Å; F346-I363 HydrophobicContact CZ-CG2 4.24Å; F346-A394 HydrophobicContact CD1-CB 4.34Å; F346-A394 HydrophobicContact CD2-CB 3.72Å; F346-A394 HydrophobicContact CE1-CB 4.36Å; F346-A394 HydrophobicContact CE2-CB 3.75Å; F346-A394 HydrophobicContact CG-CB 4.05Å; F346-A394 HydrophobicContact CZ-CB 4.09Å; F346-M396 HydrophobicContact CE2-CG 4.11Å; F346-M396 HydrophobicContact CE2-SD 3.69Å; F346-M396 HydrophobicContact CZ-CE 4.37Å; F346-M396 HydrophobicContact CZ-CG 4.05Å; F346-M396 HydrophobicContact CZ-SD 3.95Å; F346-F406 HydrophobicContact CE1-CB 4.24Å; F346-F406 HydrophobicContact CE1-CD1 4.09Å; F346-F406 AromaticContact CE1-CD2 3.76Å; F346-F406 HydrophobicContact CE1-CD2 3.76Å; F346-F406 HydrophobicContact CE1-CE1 4.41Å; F346-F406 HydrophobicContact CE1-CE2 4.12Å; F346-F406 AromaticContact CE1-CG 3.76Å; F346-F406 HydrophobicContact CE1-CG 3.76Å; F346-F406 HydrophobicContact CE1-CZ 4.43Å; F346-F406 HydrophobicContact CZ-CB 4.12Å; F346-F406 HydrophobicContact CZ-CD1 4.42Å; F346-F406 HydrophobicContact CZ-CD2 4.47Å; F346-F406 HydrophobicContact CZ-CG 4.09Å; F346-L408 HydrophobicContact CD1-CD2 4.04Å; F346-L408 HydrophobicContact CE1-CD2 4.44Å
347	T	93.7	Very high	87.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.2	170.1	65.7	0	0	0	0	110	L300 V328 N329 N330 A331 I333 L345 L361 N362 Y364	L300-T347 HydrophobicContact CD2-CG2 4.29Å; V328-T347 HydrophobicContact CB-CG2 4.26Å; V328-T347 HydrophobicContact CG2-CG2 3.97Å; N329-T347 PolarHBondContact O-OG1 2.96Å; N330-T347 CarbonylContact O-C 3.58Å; N330-T347 WeakPolarHBondContact O-CB 3.24Å; A331-T347 HydrophobicContact CB-CG2 4.07Å; I333-T347 WeakPolarHBondContact O-CA 3.44Å; L345-T347 HydrophobicContact CD2-CG2 4.31Å; L345-T347 HydrophobicContact CG-CG2 4.07Å; T347-L361 WeakPolarHBondContact O-CA 3.41Å; T347-N362 PolarHBondContact N-O 3.02Å; T347-N362 PolarHBondContact O-N 2.84Å; T347-N362 WeakPolarHBondContact OG1-CB 3.49Å; T347-Y364 HydrophobicContact CG2-CD2 4.38Å; T347-Y364 HydrophobicContact CG2-CE2 4.32Å; T347-Y364 WeakPolarHBondContact OG1-CE2 3.1Å
348	L	91.8	Very high	87.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	136.6	-173.3	-178.7	142.7	0	0	0	111.1	N330 M332 I333 H350 L359 A360 L361 I389 I392	N330-L348 CarbonylContact O-C 3.59Å; N330-L348 VanDerWaalsContact O-CA 3.28Å; N330-L348 WeakPolarHBondContact O-CA 3.46Å; N330-L348 PolarHBondContact O-N 3.31Å; M332-L348 WeakPolarHBondContact CB-O 3.35Å; M332-L348 PolarHBondContact N-O 3.09Å; M332-L348 VanDerWaalsContact N-O 3.12Å; I333-L348 PolarHBondContact N-O 2.75Å; I333-L348 PolarHBondContact O-N 3.47Å; L348-H350 HydrophobicContact CD2-CB 4.19Å; L348-L359 HydrophobicContact CD1-CD1 3.68Å; L348-L359 HydrophobicContact CD1-CD2 4.05Å; L348-L359 HydrophobicContact CD1-CG 3.97Å; L348-L359 HydrophobicContact CD2-CD1 3.62Å; L348-L359 HydrophobicContact CG-CD1 3.66Å; L348-L359 HydrophobicContact CG-CG 4.25Å; L348-A360 WeakPolarHBondContact CA-O 3.34Å; L348-L361 HydrophobicContact CB-CD1 4.27Å; L348-L361 HydrophobicContact CD1-CD1 4.19Å; L348-I389 HydrophobicContact CD2-CD1 3.78Å; L348-I392 HydrophobicContact CB-CD1 4.21Å
349	H	90.6	Very high	87.7	Confident	41 Å²	41	55.2 Å²	55.2	19%	0.19	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126	169.7	173.4	-122.6	0	0	0	109	T309 N330 A360	T309-H349 WeakPolarHBondContact CG2-CD2 3.47Å; N330-H349 HydrophobicContact CB-CB 3.75Å; N330-H349 PolarHBondContact O-N 3.48Å; H349-A360 HydrophobicContact CB-CB 4.49Å; H349-A360 PolarHBondContact N-O 2.81Å; H349-A360 PolarHBondContact O-N 3.01Å
350	H	88.8	Confident	87.8	Confident	7 Å²	7	54.9 Å²	54.9	3%	0.032	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	115.6	179.7	-176.7	-149.1	0	0	0	110.3	L348 N358 L359 G387 I389	L348-H350 HydrophobicContact CD2-CB 4.19Å; H350-N358 WeakPolarHBondContact CA-O 3.45Å; H350-L359 HydrophobicContact CB-CD1 3.69Å; H350-G387 PolarHBondContact CE1-O 2.85Å; H350-I389 HydrophobicContact CB-CD1 3.98Å
351	N	87	Confident	88.3	Confident	58 Å²	58	49.2 Å²	49.2	31%	0.31	25%	0.247	S	C	.	.			trans	-104.7	94.6	175.3	-176.1	-4.5	0	0	0	110.3	D353 Q354 N358	N351-D353 PolarHBondContact O-N 2.96Å; N351-D353 PolarHBondContact OD1-N 2.84Å; N351-Q354 HydrophobicContact CB-CB 4.14Å; N351-Q354 WeakPolarHBondContact O-CB 3.05Å; N351-Q354 PolarHBondContact O-N 3.29Å; N351-N358 PolarHBondContact N-O 2.68Å; N351-N358 WeakPolarHBondContact O-CB 3.28Å
352	V	80.9	Confident	88.8	Confident	28 Å²	28	46.2 Å²	46.2	17%	0.17	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.4	-175.3	-178.6	0	0	0	0	112.8	Q354 S384 T388	V352-Q354 PolarHBondContact O-N 3.41Å; V352-S384 WeakPolarHBondContact O-CB 3.48Å; V352-T388 HydrophobicContact CG2-CG2 3.65Å
353	D	80.2	Confident	89.1	Confident	138 Å²	138	39.6 Å²	39.6	74%	0.738	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-16.3	-178.3	-61.6	-36.6	0	0	0	112.6	N351	N351-D353 PolarHBondContact O-N 2.96Å; N351-D353 PolarHBondContact OD1-N 2.84Å
354	Q	82.9	Confident	89.2	Confident	85 Å²	85	39.1 Å²	39.1	40%	0.397	18%	0.183	S	C	.	.			trans	-84	132.2	177.9	-171.7	175.8	-14	0	0	111	N351 V352 F356 N358	N351-Q354 HydrophobicContact CB-CB 4.14Å; N351-Q354 WeakPolarHBondContact O-CB 3.05Å; N351-Q354 PolarHBondContact O-N 3.29Å; V352-Q354 PolarHBondContact O-N 3.41Å; Q354-F356 WeakPolarHBondContact CG-O 3.21Å; Q354-F356 PolarHBondContact NE2-O 2.93Å; Q354-N358 HydrophobicContact CB-CB 3.95Å; Q354-N358 HydrophobicContact CG-CB 4.42Å; Q354-N358 VanDerWaalsContact O-CB 3.27Å; Q354-N358 WeakPolarHBondContact O-CB 3.25Å; Q354-N358 PolarHBondContact O-ND2 3.09Å
355	Y	77.9	Confident	89.2	Confident	123 Å²	123	40.3 Å²	40.3	48%	0.482	19%	0.19	S	C	.	.	S	Bend	trans	-78.3	-39.3	-176.1	-67.8	-92.2	0	0	0	114.4	T381 S551 H553	Y355-T381 WeakPolarHBondContact O-CG2 3.38Å; Y355-S551 WeakPolarHBondContact CD1-OG 3.28Å; Y355-S551 WeakPolarHBondContact CE1-OG 3.39Å; Y355-H553 PolarHBondContact OH-CE1 2.85Å
356	F	85.3	Confident	89	Confident	161 Å²	161	40.5 Å²	40.5	71%	0.706	19%	0.191	S	C	*	.	S	Bend	trans	-126.2	143.5	-177.6	-66.9	-74.7	0	0	0	110.5	Q354 N358	Q354-F356 WeakPolarHBondContact CG-O 3.21Å; Q354-F356 PolarHBondContact NE2-O 2.93Å; F356-N358 PolarHBondContact O-N 3.17Å
357	K	84.8	Confident	88.8	Confident	132 Å²	132	47.6 Å²	47.6	57%	0.574	22%	0.224	S	C	*	.	S	Bend	trans	53.6	36.3	-178.7	-65	-176.5	178.4	179.8	0	112.7	L359 H379 F380 T381	K357-L359 PolarHBondContact O-N 2.65Å; K357-H379 HydrophobicContact CB-CB 4.14Å; K357-H379 HydrophobicContact CD-CB 4.13Å; K357-H379 HydrophobicContact CG-CB 4.15Å; K357-F380 CarbonylContact C-O 3.56Å; K357-F380 VanDerWaalsContact CA-O 3.24Å; K357-F380 WeakPolarHBondContact CA-O 3.47Å; K357-T381 PolarHBondContact N-OG1 2.9Å
358	N	86.7	Confident	88.6	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.016	25%	0.246	C	C	.	.			trans	-71.7	-12.9	180	58.4	-5.9	0	0	0	114.1	H350 N351 Q354 F356 F380 T381 L382	H350-N358 WeakPolarHBondContact CA-O 3.45Å; N351-N358 PolarHBondContact N-O 2.68Å; N351-N358 WeakPolarHBondContact O-CB 3.28Å; Q354-N358 HydrophobicContact CB-CB 3.95Å; Q354-N358 HydrophobicContact CG-CB 4.42Å; Q354-N358 VanDerWaalsContact O-CB 3.27Å; Q354-N358 WeakPolarHBondContact O-CB 3.25Å; Q354-N358 PolarHBondContact O-ND2 3.09Å; F356-N358 PolarHBondContact O-N 3.17Å; N358-F380 PolarHBondContact N-O 2.89Å; N358-F380 PolarHBondContact OD1-O 3.12Å; N358-T381 WeakPolarHBondContact OD1-CA 3.47Å; N358-L382 PolarHBondContact ND2-O 2.77Å; N358-L382 PolarHBondContact OD1-N 2.91Å; N358-L382 PolarHBondContact OD1-O 3.36Å
359	L	90.3	Very high	88.5	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	115.2	177.6	-162.8	68.9	0	0	0	110	L348 H350 K357 H379 F380 L382 I389	L348-L359 HydrophobicContact CD1-CD1 3.68Å; L348-L359 HydrophobicContact CD1-CD2 4.05Å; L348-L359 HydrophobicContact CD1-CG 3.97Å; L348-L359 HydrophobicContact CD2-CD1 3.62Å; L348-L359 HydrophobicContact CG-CD1 3.66Å; L348-L359 HydrophobicContact CG-CG 4.25Å; H350-L359 HydrophobicContact CB-CD1 3.69Å; K357-L359 PolarHBondContact O-N 2.65Å; L359-H379 CarbonylContact O-C 3.53Å; L359-H379 VanDerWaalsContact O-CA 3.3Å; L359-H379 WeakPolarHBondContact O-CA 3.18Å; L359-F380 WeakPolarHBondContact CB-O 3.2Å; L359-F380 HydrophobicContact CD2-CD2 4.35Å; L359-F380 PolarHBondContact N-O 2.85Å; L359-F380 PolarHBondContact O-N 3.32Å; L359-L382 HydrophobicContact CB-CB 4.49Å; L359-L382 HydrophobicContact CD2-CB 4.5Å; L359-I389 HydrophobicContact CD1-CD1 3.65Å
360	A	91.2	Very high	88.7	Confident	7 Å²	7	55.3 Å²	55.3	6%	0.058	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.4	173.5	0	0	0	0	0	109.8	N330 L348 H349 H379	N330-A360 HydrophobicContact CB-CB 4.41Å; L348-A360 WeakPolarHBondContact CA-O 3.34Å; H349-A360 HydrophobicContact CB-CB 4.49Å; H349-A360 PolarHBondContact N-O 2.81Å; H349-A360 PolarHBondContact O-N 3.01Å; A360-H379 VanDerWaalsContact CB-CE1 3.41Å; A360-H379 WeakPolarHBondContact CB-CE1 3.04Å
361	L	93.7	Very high	88.8	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.6	-178.6	-179.8	75	0	0	0	110.2	F346 T347 L348 I363 P377 R378 F380 F406 L408	F346-L361 HydrophobicContact CD1-CD1 4.18Å; T347-L361 WeakPolarHBondContact O-CA 3.41Å; L348-L361 HydrophobicContact CB-CD1 4.27Å; L348-L361 HydrophobicContact CD1-CD1 4.19Å; L361-I363 HydrophobicContact CD2-CD1 4.2Å; L361-I363 HydrophobicContact CD2-CG1 4.46Å; L361-I363 HydrophobicContact CG-CG1 4.38Å; L361-P377 WeakPolarHBondContact O-CA 3.47Å; L361-R378 PolarHBondContact N-O 3.36Å; L361-R378 PolarHBondContact O-N 3.12Å; L361-F380 HydrophobicContact CB-CE2 4.24Å; L361-F380 HydrophobicContact CD2-CE2 4.04Å; L361-F406 HydrophobicContact CD2-CE2 3.68Å; L361-F406 HydrophobicContact CD2-CZ 3.5Å; L361-L408 HydrophobicContact CD1-CD1 4.02Å; L361-L408 HydrophobicContact CD2-CD1 3.78Å
362	N	94	Very high	88.9	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.059	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.3	170.5	-63.2	-18.6	0	0	0	110	N329 N330 T347 Y364 L371	N329-N362 PolarHBondContact O-ND2 3.1Å; N330-N362 PolarHBondContact ND2-ND2 2.99Å; N330-N362 VanDerWaalsContact ND2-ND2 3.15Å; N330-N362 PolarHBondContact ND2-OD1 3.41Å; T347-N362 PolarHBondContact N-O 3.02Å; T347-N362 PolarHBondContact O-N 2.84Å; T347-N362 WeakPolarHBondContact OG1-CB 3.49Å; N362-Y364 HydrophobicContact CB-CD2 4.24Å; N362-Y364 HydrophobicContact CB-CE2 3.46Å; N362-Y364 VanDerWaalsContact CB-CE2 3.46Å; N362-Y364 PolarHBondContact ND2-OH 3.44Å; N362-L371 HydrophobicContact CB-CD2 3.99Å
363	I	95	Very high	89.2	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	116.9	179.7	-58.2	168.4	0	0	0	107.1	Y344 L345 F346 L361 S372 L375 F406	Y344-I363 HydrophobicContact CD1-CG2 4.1Å; Y344-I363 HydrophobicContact CG-CG2 4.5Å; L345-I363 WeakPolarHBondContact O-CA 3.47Å; F346-I363 HydrophobicContact CD1-CD1 3.92Å; F346-I363 HydrophobicContact CD1-CG1 3.67Å; F346-I363 HydrophobicContact CE1-CD1 3.41Å; F346-I363 VanDerWaalsContact CE1-CD1 3.41Å; F346-I363 HydrophobicContact CE1-CG1 3.64Å; F346-I363 HydrophobicContact CE1-CG2 4.44Å; F346-I363 HydrophobicContact CE2-CG2 4.39Å; F346-I363 HydrophobicContact CG-CG1 4.32Å; F346-I363 HydrophobicContact CZ-CD1 4.06Å; F346-I363 HydrophobicContact CZ-CG1 4.28Å; F346-I363 HydrophobicContact CZ-CG2 4.24Å; L361-I363 HydrophobicContact CD2-CD1 4.2Å; L361-I363 HydrophobicContact CD2-CG1 4.46Å; L361-I363 HydrophobicContact CG-CG1 4.38Å; I363-S372 PolarHBondContact O-N 3.37Å; I363-L375 HydrophobicContact CB-CB 4.25Å; I363-L375 HydrophobicContact CD1-CB 3.8Å; I363-L375 HydrophobicContact CD1-CD1 4.27Å; I363-L375 HydrophobicContact CG2-CB 4.15Å; I363-L375 HydrophobicContact CG2-CD1 4.14Å; I363-F406 HydrophobicContact CD1-CD1 3.95Å; I363-F406 HydrophobicContact CD1-CE1 3.43Å; I363-F406 VanDerWaalsContact CD1-CE1 3.43Å; I363-F406 HydrophobicContact CD1-CZ 3.82Å
364	Y	94.4	Very high	89.5	Confident	13 Å²	13	62.1 Å²	62.1	5%	0.051	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	147.3	-179.8	-61	-93.7	0	0	0	109.8	V328 N329 Y344 L345 T347 N362 G369 E370 L371	V328-Y364 HydrophobicContact CB-CD2 4.3Å; V328-Y364 HydrophobicContact CB-CE2 3.82Å; V328-Y364 HydrophobicContact CG1-CD1 4.18Å; V328-Y364 HydrophobicContact CG1-CD2 3.89Å; V328-Y364 HydrophobicContact CG1-CE1 4.16Å; V328-Y364 HydrophobicContact CG1-CE2 3.88Å; V328-Y364 HydrophobicContact CG1-CG 4.05Å; N329-Y364 PolarHBondContact N-OH 2.94Å; Y344-Y364 CarbonylContact C-O 3.57Å; Y344-Y364 VanDerWaalsContact CA-O 3.28Å; Y344-Y364 WeakPolarHBondContact CA-O 3.48Å; L345-Y364 PolarHBondContact N-O 3.11Å; L345-Y364 PolarHBondContact O-N 3.07Å; T347-Y364 HydrophobicContact CG2-CD2 4.38Å; T347-Y364 HydrophobicContact CG2-CE2 4.32Å; T347-Y364 WeakPolarHBondContact OG1-CE2 3.1Å; N362-Y364 HydrophobicContact CB-CD2 4.24Å; N362-Y364 HydrophobicContact CB-CE2 3.46Å; N362-Y364 VanDerWaalsContact CB-CE2 3.46Å; N362-Y364 PolarHBondContact ND2-OH 3.44Å; Y364-G369 WeakPolarHBondContact CD1-O 3.38Å; Y364-E370 CarbonylContact C-O 3.44Å; Y364-E370 WeakPolarHBondContact CA-O 3.5Å; Y364-L371 HydrophobicContact CD1-CD2 3.75Å; Y364-L371 HydrophobicContact CD1-CG 4.02Å; Y364-L371 HydrophobicContact CD2-CD2 4.29Å; Y364-L371 HydrophobicContact CE1-CD2 3.39Å; Y364-L371 HydrophobicContact CE1-CG 3.63Å; Y364-L371 HydrophobicContact CE2-CD2 3.98Å; Y364-L371 HydrophobicContact CG-CD2 4.18Å
365	D	93.1	Very high	89.8	Confident	34 Å²	34	58.1 Å²	58.1	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123.7	162.3	174.6	-96.7	0	0	0	108.6	E367 S368 G369 E370	D365-E367 VanDerWaalsContact C-N 3.27Å; D365-E367 PolarHBondContact O-N 3.1Å; D365-E367 PolarHBondContact OD1-N 3.18Å; D365-S368 WeakPolarHBondContact CB-OG 3.42Å; D365-S368 WeakPolarHBondContact OD1-CB 3.3Å; D365-S368 PolarHBondContact OD1-N 3.46Å; D365-S368 PolarHBondContact OD1-OG 2.8Å; D365-G369 VanDerWaalsContact O-CA 3.32Å; D365-G369 WeakPolarHBondContact O-CA 3.35Å; D365-G369 PolarHBondContact O-N 3.29Å; D365-E370 PolarHBondContact N-O 3.06Å
366	L	92.1	Very high	90.4	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-32.9	-170.5	-177.4	69.4	0	0	0	112.2	L294 T295 V313 K325 Y326 L336 S343 L345	L294-L366 HydrophobicContact CD1-CD1 3.71Å; T295-L366 HydrophobicContact CG2-CD2 3.62Å; V313-L366 HydrophobicContact CG1-CD1 4.5Å; K325-L366 PolarHBondContact NZ-O 2.62Å; Y326-L366 WeakPolarHBondContact OH-CA 3.44Å; Y326-L366 PolarHBondContact OH-O 3.26Å; L336-L366 HydrophobicContact CD1-CD2 3.91Å; S343-L366 VanDerWaalsContact O-CB 3.23Å; S343-L366 WeakPolarHBondContact O-CB 3.47Å; S343-L366 PolarHBondContact O-N 2.77Å; L345-L366 HydrophobicContact CB-CD1 4.33Å
367	E	90.4	Very high	90.7	Very high	149 Å²	149	50.4 Å²	50.4	70%	0.696	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-54.1	-177.5	-68.5	-172.1	177.6	0	0	111.4	K325 D365	K325-E367 VanDerWaalsContact CE-O 3.27Å; K325-E367 WeakPolarHBondContact CE-O 3.5Å; K325-E367 PolarHBondContact NZ-O 3.48Å; D365-E367 VanDerWaalsContact C-N 3.27Å; D365-E367 PolarHBondContact O-N 3.1Å; D365-E367 PolarHBondContact OD1-N 3.18Å
368	S	89.8	Confident	91	Very high	65 Å²	65	47 Å²	47	46%	0.455	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-27.3	-177.6	60.4	0	0	0	0	114.1	D365 E370	D365-S368 WeakPolarHBondContact CB-OG 3.42Å; D365-S368 WeakPolarHBondContact OD1-CB 3.3Å; D365-S368 PolarHBondContact OD1-N 3.46Å; D365-S368 PolarHBondContact OD1-OG 2.8Å; S368-E370 PolarHBondContact O-N 3.17Å; S368-E370 PolarHBondContact OG-N 2.61Å
369	G	89.8	Confident	91.2	Very high	14 Å²	14	51.7 Å²	51.7	14%	0.144	26%	0.263	C	S	.	.			trans	72.7	5.1	-171.1	0	0	0	0	0	114.1	Y364 D365	Y364-G369 WeakPolarHBondContact CD1-O 3.38Å; D365-G369 VanDerWaalsContact O-CA 3.32Å; D365-G369 WeakPolarHBondContact O-CA 3.35Å; D365-G369 PolarHBondContact O-N 3.29Å
370	E	93.2	Very high	91.1	Very high	123 Å²	123	52.7 Å²	52.7	58%	0.575	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-81.8	150.2	176.3	-65.1	-170.5	175.7	0	0	110.9	Y364 D365 S368 S372	Y364-E370 CarbonylContact C-O 3.44Å; Y364-E370 WeakPolarHBondContact CA-O 3.5Å; D365-E370 PolarHBondContact N-O 3.06Å; S368-E370 PolarHBondContact O-N 3.17Å; S368-E370 PolarHBondContact OG-N 2.61Å; E370-S372 PolarHBondContact O-N 3.09Å
371	L	91.6	Very high	90.9	Very high	73 Å²	73	55.9 Å²	55.9	38%	0.382	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-61.8	131.9	170.1	-77.5	170	0	0	0	109.7	N362 Y364 K373 P377	N362-L371 HydrophobicContact CB-CD2 3.99Å; Y364-L371 HydrophobicContact CD1-CD2 3.75Å; Y364-L371 HydrophobicContact CD1-CG 4.02Å; Y364-L371 HydrophobicContact CD2-CD2 4.29Å; Y364-L371 HydrophobicContact CE1-CD2 3.39Å; Y364-L371 HydrophobicContact CE1-CG 3.63Å; Y364-L371 HydrophobicContact CE2-CD2 3.98Å; Y364-L371 HydrophobicContact CG-CD2 4.18Å; L371-K373 PolarHBondContact O-N 2.85Å; L371-P377 HydrophobicContact CD1-CG 3.87Å; L371-P377 HydrophobicContact CD2-CG 4.05Å
372	S	88.8	Confident	90.5	Very high	12 Å²	12	56.4 Å²	56.4	8%	0.084	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-62.2	123	179.3	178.9	0	0	0	0	110.7	I363 E370 E374 L375	I363-S372 PolarHBondContact O-N 3.37Å; E370-S372 PolarHBondContact O-N 3.09Å; S372-E374 VanDerWaalsContact C-N 3.3Å; S372-E374 PolarHBondContact OG-N 2.89Å; S372-L375 CarbonylContact O-C 3.55Å; S372-L375 VanDerWaalsContact O-C 3.27Å; S372-L375 PolarHBondContact O-N 2.97Å; S372-L375 PolarHBondContact OG-N 3.08Å
373	K	87.2	Confident	89.9	Confident	187 Å²	187	57 Å²	57	81%	0.813	30%	0.295	S	S	*	.	S	Bend	trans	-69.1	-31.8	175.6	-65.6	177.5	-176.5	168.9	0	111.9	L371	L371-K373 PolarHBondContact O-N 2.85Å
374	E	86.1	Confident	88.9	Confident	102 Å²	102	57.7 Å²	57.7	48%	0.477	30%	0.3	S	S	.	.	S	Bend	trans	-75.7	-31	179.2	-62.6	170.1	165.8	0	0	111.4	Y344 S372 P376 P404	Y344-E374 PolarHBondContact OH-OE2 3.13Å; S372-E374 VanDerWaalsContact C-N 3.3Å; S372-E374 PolarHBondContact OG-N 2.89Å; E374-P376 WeakPolarHBondContact O-CD 3.2Å; E374-P404 HydrophobicContact CB-CG 3.69Å; E374-P404 HydrophobicContact CG-CG 4.31Å; E374-P404 WeakPolarHBondContact OE2-CG 3.5Å
375	L	90.8	Very high	88.2	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	30%	0.3	C	S	.	.	S	Bend	trans	-123.4	74.8	-178.2	-65.6	174.4	0	0	0	110	I363 S372 M396 P404 F406	I363-L375 HydrophobicContact CB-CB 4.25Å; I363-L375 HydrophobicContact CD1-CB 3.8Å; I363-L375 HydrophobicContact CD1-CD1 4.27Å; I363-L375 HydrophobicContact CG2-CB 4.15Å; I363-L375 HydrophobicContact CG2-CD1 4.14Å; S372-L375 CarbonylContact O-C 3.55Å; S372-L375 VanDerWaalsContact O-C 3.27Å; S372-L375 PolarHBondContact O-N 2.97Å; S372-L375 PolarHBondContact OG-N 3.08Å; L375-M396 HydrophobicContact CD1-CE 3.67Å; L375-P404 HydrophobicContact CD1-CB 4.49Å; L375-P404 WeakPolarHBondContact CD2-O 3.37Å; L375-P404 HydrophobicContact CG-CG 4.46Å; L375-F406 HydrophobicContact CD1-CD1 4.34Å; L375-F406 HydrophobicContact CD2-CD1 3.88Å; L375-F406 HydrophobicContact CD2-CE1 4.1Å
376	P	90.7	Very high	87.9	Confident	61 Å²	61	56 Å²	56	40%	0.396	29%	0.292	S	S	.	.			trans	-64	157.3	-175.1	27.1	-36	0	0	0	111.7	E374 R378	E374-P376 WeakPolarHBondContact O-CD 3.2Å; P376-R378 VanDerWaalsContact O-CG 3.25Å; P376-R378 WeakPolarHBondContact O-CG 3.37Å
377	P	91	Very high	87.6	Confident	61 Å²	61	56.1 Å²	56.1	40%	0.396	29%	0.294	S	S	.	.			trans	-50	140.6	173.6	-28.6	35.4	0	0	0	112.8	L361 L371	L361-P377 WeakPolarHBondContact O-CA 3.47Å; L371-P377 HydrophobicContact CD1-CG 3.87Å; L371-P377 HydrophobicContact CD2-CG 4.05Å
378	R	91.1	Very high	87.5	Confident	61 Å²	61	51.7 Å²	51.7	23%	0.23	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146	-178.2	-56.2	-171	179	-161.4	3.6	111.3	L361 P376 F380 Q422	L361-R378 PolarHBondContact N-O 3.36Å; L361-R378 PolarHBondContact O-N 3.12Å; P376-R378 VanDerWaalsContact O-CG 3.25Å; P376-R378 WeakPolarHBondContact O-CG 3.37Å; R378-F380 HydrophobicContact CB-CD1 4.46Å; R378-F380 HydrophobicContact CB-CD2 4.49Å; R378-F380 HydrophobicContact CB-CE1 3.63Å; R378-F380 HydrophobicContact CB-CE2 3.67Å; R378-F380 HydrophobicContact CB-CZ 3.2Å; R378-F380 HydrophobicContact CG-CE1 4.3Å; R378-F380 HydrophobicContact CG-CZ 3.87Å; R378-Q422 WeakPolarHBondContact CD-O 3.02Å; R378-Q422 PolarHBondContact NH1-O 2.95Å
379	H	90.4	Very high	87.6	Confident	101 Å²	101	48.8 Å²	48.8	47%	0.468	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.5	171.4	-69.5	-93.8	0	0	0	109	K357 L359 A360	K357-H379 HydrophobicContact CB-CB 4.14Å; K357-H379 HydrophobicContact CD-CB 4.13Å; K357-H379 HydrophobicContact CG-CB 4.15Å; L359-H379 CarbonylContact O-C 3.53Å; L359-H379 VanDerWaalsContact O-CA 3.3Å; L359-H379 WeakPolarHBondContact O-CA 3.18Å; A360-H379 VanDerWaalsContact CB-CE1 3.41Å; A360-H379 WeakPolarHBondContact CB-CE1 3.04Å
380	F	88.8	Confident	87.6	Confident	25 Å²	25	52.6 Å²	52.6	11%	0.11	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	163.2	178.8	-43	-68.6	0	0	0	110.2	K357 N358 L359 L361 R378 Q422 N423	K357-F380 CarbonylContact C-O 3.56Å; K357-F380 VanDerWaalsContact CA-O 3.24Å; K357-F380 WeakPolarHBondContact CA-O 3.47Å; N358-F380 PolarHBondContact N-O 2.89Å; N358-F380 PolarHBondContact OD1-O 3.12Å; L359-F380 WeakPolarHBondContact CB-O 3.2Å; L359-F380 HydrophobicContact CD2-CD2 4.35Å; L359-F380 PolarHBondContact N-O 2.85Å; L359-F380 PolarHBondContact O-N 3.32Å; L361-F380 HydrophobicContact CB-CE2 4.24Å; L361-F380 HydrophobicContact CD2-CE2 4.04Å; R378-F380 HydrophobicContact CB-CD1 4.46Å; R378-F380 HydrophobicContact CB-CD2 4.49Å; R378-F380 HydrophobicContact CB-CE1 3.63Å; R378-F380 HydrophobicContact CB-CE2 3.67Å; R378-F380 HydrophobicContact CB-CZ 3.2Å; R378-F380 HydrophobicContact CG-CE1 4.3Å; R378-F380 HydrophobicContact CG-CZ 3.87Å; F380-Q422 WeakPolarHBondContact CE1-O 3.47Å; F380-Q422 WeakPolarHBondContact CZ-O 3.49Å; F380-N423 VanDerWaalsContact CE1-C 3.5Å
381	T	87.1	Confident	87.5	Confident	74 Å²	74	49.2 Å²	49.2	45%	0.454	26%	0.26	S	S	.	.			trans	-104.1	113.4	171.6	-51.8	0	0	0	0	107.6	Y355 K357 N358	Y355-T381 WeakPolarHBondContact O-CG2 3.38Å; K357-T381 PolarHBondContact N-OG1 2.9Å; N358-T381 WeakPolarHBondContact OD1-CA 3.47Å
382	L	85.5	Confident	87.5	Confident	12 Å²	12	46.2 Å²	46.2	6%	0.063	24%	0.244	C	C	.	.			trans	-94.3	147.6	169.3	-170.4	64	0	0	0	109	N358 L359 S384 I389 L410 I420	N358-L382 PolarHBondContact ND2-O 2.77Å; N358-L382 PolarHBondContact OD1-N 2.91Å; N358-L382 PolarHBondContact OD1-O 3.36Å; L359-L382 HydrophobicContact CB-CB 4.49Å; L359-L382 HydrophobicContact CD2-CB 4.5Å; L382-S384 PolarHBondContact O-N 2.8Å; L382-I389 HydrophobicContact CD2-CD1 3.75Å; L382-I389 HydrophobicContact CD2-CG1 4.06Å; L382-L410 HydrophobicContact CD1-CD1 4.14Å; L382-L410 HydrophobicContact CD2-CD1 3.87Å; L382-I420 HydrophobicContact CD1-CD1 3.57Å
383	A	80.8	Confident	87.7	Confident	22 Å²	22	47 Å²	47	18%	0.182	25%	0.25	C	S	.	.			trans	-73.2	122.5	179.7	0	0	0	0	0	110.8	H385	A383-H385 VanDerWaalsContact C-N 3.27Å; A383-H385 WeakPolarHBondContact CB-CE1 3.11Å; A383-H385 WeakPolarHBondContact CB-ND1 3.35Å; A383-H385 PolarHBondContact O-N 3.3Å
384	S	74.7	Confident	88	Confident	16 Å²	16	38.8 Å²	38.8	11%	0.112	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-72	-15.5	-171.9	55.9	0	0	0	0	114.6	V352 L382 H386 G387	V352-S384 WeakPolarHBondContact O-CB 3.48Å; L382-S384 PolarHBondContact O-N 2.8Å; S384-H386 PolarHBondContact O-N 2.52Å; S384-G387 PolarHBondContact O-N 2.84Å; S384-G387 VanDerWaalsContact O-N 3.17Å
385	H	79.1	Confident	88.3	Confident	11 Å²	11	34 Å²	34	5%	0.051	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-72.5	-3.5	180	62.1	-88.1	0	0	0	114.7	A383 G387 D629 F631	A383-H385 VanDerWaalsContact C-N 3.27Å; A383-H385 WeakPolarHBondContact CB-CE1 3.11Å; A383-H385 WeakPolarHBondContact CB-ND1 3.35Å; A383-H385 PolarHBondContact O-N 3.3Å; H385-G387 VanDerWaalsContact C-N 3.32Å; H385-D629 IonicContact CD2-OD1 3.27Å; H385-D629 PolarHBondContact CD2-OD1 2.81Å; H385-D629 IonicContact CG-OD1 2.67Å; H385-D629 IonicContact NE2-OD1 3.17Å; H385-F631 WeakPolarHBondContact O-CB 3.31Å
386	H	87	Confident	88.3	Confident	2 Å²	2	34 Å²	34	1%	0.009	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-88.7	-1.6	170.9	-67.8	-66.8	0	0	0	113.2	S384 T412 D414 Q418 I429 E431 K615	S384-H386 PolarHBondContact O-N 2.52Å; H386-T412 HydrophobicContact CB-CG2 4.03Å; H386-D414 IonicContact CE1-OD2 3.89Å; H386-D414 IonicContact CG-OD2 2.59Å; H386-D414 IonicContact ND1-OD1 2.85Å; H386-D414 IonicContact ND1-OD2 2.89Å; H386-D414 PolarHBondContact ND1-OD2 2.92Å; H386-Q418 PolarHBondContact CD2-NE2 2.92Å; H386-I429 WeakPolarHBondContact CE1-CD1 3.46Å; H386-I429 VanDerWaalsContact NE2-CD1 3.3Å; H386-I429 WeakPolarHBondContact NE2-CD1 2.96Å; H386-E431 IonicContact CE1-OE1 2.68Å; H386-E431 PolarHBondContact CE1-OE1 3.23Å; H386-K615 PolarHBondContact CE1-NZ 2.98Å; H386-K615 PolarHBondContact ND1-NZ 2.69Å
387	G	86.3	Confident	88.3	Confident	6 Å²	6	32.4 Å²	32.4	6%	0.062	18%	0.181	C	C	.	.			trans	74.9	-154.3	-175.2	0	0	0	0	0	112.4	H350 S384 H385	H350-G387 PolarHBondContact CE1-O 2.85Å; S384-G387 PolarHBondContact O-N 2.84Å; S384-G387 VanDerWaalsContact O-N 3.17Å; H385-G387 VanDerWaalsContact C-N 3.32Å
388	T	88.4	Confident	88.2	Confident	55 Å²	55	31.7 Å²	31.7	34%	0.337	18%	0.176	S	C	.	.	S	Bend	trans	-79.1	157.2	-177.4	56.8	0	0	0	0	111.6	V352 T412 E413	V352-T388 HydrophobicContact CG2-CG2 3.65Å; T388-T412 CarbonylContact O-C 3.59Å; T388-T412 WeakPolarHBondContact O-CA 3.49Å; T388-E413 PolarHBondContact N-OE2 3.35Å; T388-E413 PolarHBondContact O-N 2.77Å; T388-E413 PolarHBondContact OG1-OE2 2.97Å
389	I	91.1	Very high	87.9	Confident	5 Å²	5	31 Å²	31	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	127	173.2	-65.2	164.4	0	0	0	106.8	I333 L348 H350 L359 L382 S391 I392 L410 T412	I333-I389 HydrophobicContact CD1-CB 3.93Å; I333-I389 HydrophobicContact CD1-CG2 3.68Å; I333-I389 WeakPolarHBondContact CD1-O 3.4Å; L348-I389 HydrophobicContact CD2-CD1 3.78Å; H350-I389 HydrophobicContact CB-CD1 3.98Å; L359-I389 HydrophobicContact CD1-CD1 3.65Å; L382-I389 HydrophobicContact CD2-CD1 3.75Å; L382-I389 HydrophobicContact CD2-CG1 4.06Å; I389-S391 WeakPolarHBondContact CG2-O 3.27Å; I389-I392 HydrophobicContact CG2-CG2 3.67Å; I389-L410 HydrophobicContact CD1-CD1 4.03Å; I389-L410 HydrophobicContact CD1-CD2 4.46Å; I389-T412 HydrophobicContact CG1-CG2 4.27Å
390	E	89.5	Confident	87.6	Confident	93 Å²	93	31.7 Å²	31.7	44%	0.435	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-43.7	176.5	-67.3	-169.6	158.6	0	0	111	K35 Y411	K35-E390 WeakPolarHBondContact CE-OE2 3.35Å; K35-E390 IonicContact NZ-OE1 3.74Å; K35-E390 PolarHBondContact NZ-OE1 2.86Å; K35-E390 VanDerWaalsContact NZ-OE1 3.16Å; K35-E390 IonicContact NZ-OE2 3.89Å; K35-E390 PolarHBondContact NZ-OE2 2.67Å; E390-Y411 PolarHBondContact N-O 3.12Å
391	S	90.8	Very high	87.5	Confident	52 Å²	52	36.2 Å²	36.2	36%	0.364	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	164.4	-179.7	65.6	0	0	0	0	112.6	I389 Y411	I389-S391 WeakPolarHBondContact CG2-O 3.27Å; S391-Y411 PolarHBondContact N-O 3.31Å; S391-Y411 PolarHBondContact O-N 3.09Å; S391-Y411 WeakPolarHBondContact OG-CD2 3.05Å
392	I	93.3	Very high	87.4	Confident	11 Å²	11	35.3 Å²	35.3	6%	0.056	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.9	-179.2	66.7	172.7	0	0	0	111.7	I333 C335 L348 I389 L409 L410	I333-I392 HydrophobicContact CG2-CD1 4.21Å; I333-I392 HydrophobicContact CG2-CG1 3.85Å; I333-I392 HydrophobicContact CG2-CG2 4.34Å; C335-I392 HydrophobicContact CB-CD1 4.33Å; C335-I392 HydrophobicContact CB-CG1 3.93Å; L348-I392 HydrophobicContact CB-CD1 4.21Å; I389-I392 HydrophobicContact CG2-CG2 3.67Å; I392-L409 CarbonylContact C-O 3.57Å; I392-L409 VanDerWaalsContact CA-O 3.27Å; I392-L409 WeakPolarHBondContact CA-O 3.47Å; I392-L410 HydrophobicContact CB-CD2 4.22Å; I392-L410 HydrophobicContact CG2-CD2 3.47Å; I392-L410 VanDerWaalsContact CG2-CD2 3.47Å
393	S	92.4	Very high	87.5	Confident	29 Å²	29	36.5 Å²	36.5	20%	0.203	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	129.7	169.5	-54.2	0	0	0	0	110.9	L409	S393-L409 PolarHBondContact N-O 2.64Å; S393-L409 PolarHBondContact O-N 3.27Å
394	A	92.8	Very high	87.9	Confident	13 Å²	13	36.5 Å²	36.5	11%	0.107	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	132.8	-179	0	0	0	0	0	111.5	F346 L408	F346-A394 HydrophobicContact CD1-CB 4.34Å; F346-A394 HydrophobicContact CD2-CB 3.72Å; F346-A394 HydrophobicContact CE1-CB 4.36Å; F346-A394 HydrophobicContact CE2-CB 3.75Å; F346-A394 HydrophobicContact CG-CB 4.05Å; F346-A394 HydrophobicContact CZ-CB 4.09Å; A394-L408 HydrophobicContact CB-CD2 4.13Å
395	I	92.4	Very high	88.7	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	101.2	173.5	-49.6	-177	0	0	0	107.4	L41 F43 P48 L65 F406 R407 L409 L419	L41-I395 HydrophobicContact CD1-CD1 4.04Å; L41-I395 HydrophobicContact CD1-CG1 3.66Å; L41-I395 HydrophobicContact CD2-CD1 3.87Å; L41-I395 HydrophobicContact CD2-CG1 4.37Å; F43-I395 HydrophobicContact CE1-CG2 3.91Å; F43-I395 HydrophobicContact CZ-CG2 4.11Å; P48-I395 HydrophobicContact CB-CG2 3.52Å; P48-I395 HydrophobicContact CG-CG2 3.67Å; L65-I395 HydrophobicContact CD2-CD1 3.78Å; I395-F406 CarbonylContact O-C 3.6Å; I395-F406 WeakPolarHBondContact O-CA 3.38Å; I395-R407 HydrophobicContact CB-CB 4.33Å; I395-R407 PolarHBondContact N-O 2.84Å; I395-R407 PolarHBondContact O-N 3.34Å; I395-L409 HydrophobicContact CD1-CD1 4Å; I395-L409 HydrophobicContact CD1-CG 4.18Å; I395-L419 HydrophobicContact CD1-CD1 4.01Å
396	M	91.8	Very high	89.3	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	142.6	177.2	-60.9	-165.3	71	0	0	111.2	G337 L339 Y344 F346 L375 S405 F406	G337-M396 VanDerWaalsContact C-SD 3.54Å; L339-M396 HydrophobicContact CB-CB 4.02Å; L339-M396 HydrophobicContact CB-CE 4.17Å; L339-M396 HydrophobicContact CB-SD 4.36Å; L339-M396 HydrophobicContact CD2-CE 4.31Å; Y344-M396 HydrophobicContact CD1-CE 4.46Å; Y344-M396 HydrophobicContact CD2-CE 3.36Å; Y344-M396 HydrophobicContact CD2-SD 3.47Å; Y344-M396 WeakPolarHBondContact CD2-SD 3.45Å; Y344-M396 HydrophobicContact CE2-CE 3.69Å; Y344-M396 HydrophobicContact CE2-SD 4.3Å; Y344-M396 HydrophobicContact CG-CE 3.77Å; Y344-M396 HydrophobicContact CG-SD 3.89Å; F346-M396 HydrophobicContact CE2-CG 4.11Å; F346-M396 HydrophobicContact CE2-SD 3.69Å; F346-M396 HydrophobicContact CZ-CE 4.37Å; F346-M396 HydrophobicContact CZ-CG 4.05Å; F346-M396 HydrophobicContact CZ-SD 3.95Å; L375-M396 HydrophobicContact CD1-CE 3.67Å; M396-S405 WeakPolarHBondContact CA-O 3.19Å; M396-F406 HydrophobicContact CG-CB 4.35Å
397	F	90.2	Very high	89.7	Confident	28 Å²	28	37.9 Å²	37.9	12%	0.123	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	162.3	177.9	58.1	-84.5	0	0	0	110.5	T46 S405 R407	T46-F397 WeakPolarHBondContact O-CA 3.41Å; T46-F397 WeakPolarHBondContact O-CB 3.42Å; F397-S405 PolarHBondContact N-O 2.82Å; F397-S405 PolarHBondContact O-N 3.18Å; F397-R407 HydrophobicContact CE1-CG 3.91Å; F397-R407 HydrophobicContact CZ-CG 4.37Å
398	T	88.7	Confident	90	Very high	46 Å²	46	37.8 Å²	37.8	28%	0.282	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.2	169.6	47.8	0	0	0	0	109.6	T46 L339	T46-T398 HydrophobicContact CG2-CG2 4.48Å; T46-T398 PolarHBondContact OG1-OG1 3.27Å; L339-T398 HydrophobicContact CD1-CG2 4.33Å; L339-T398 HydrophobicContact CD2-CG2 4.44Å
399	D	84.8	Confident	90.3	Very high	45 Å²	45	35.1 Å²	35.1	24%	0.241	23%	0.229	C	C	.	.			trans	-76.9	-179.9	175	69.7	21.7	0	0	0	112.5	T401 G402 A403 S405	D399-T401 PolarHBondContact O-N 2.87Å; D399-T401 VanDerWaalsContact OD1-CA 3.31Å; D399-T401 WeakPolarHBondContact OD1-CA 3.48Å; D399-T401 WeakPolarHBondContact OD1-CB 3.49Å; D399-T401 PolarHBondContact OD1-N 3.05Å; D399-T401 PolarHBondContact OD1-OG1 3.37Å; D399-T401 PolarHBondContact OD2-OG1 3.08Å; D399-G402 PolarHBondContact O-N 3.45Å; D399-G402 PolarHBondContact OD1-N 3.01Å; D399-G402 VanDerWaalsContact OD1-N 3.12Å; D399-A403 PolarHBondContact N-O 3.15Å; D399-A403 PolarHBondContact OD1-N 3.41Å; D399-S405 PolarHBondContact OD2-OG 2.92Å; D399-S405 VanDerWaalsContact OD2-OG 3.12Å
400	A	84.7	Confident	90.5	Very high	117 Å²	117	34.9 Å²	34.9	97%	0.967	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.7	179.6	0	0	0	0	0	113.7	G402	A400-G402 VanDerWaalsContact C-N 3.31Å
401	T	86.6	Confident	90.8	Very high	120 Å²	120	31.2 Å²	31.2	74%	0.736	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-5.8	175.2	71.7	0	0	0	0	112.4	D399 A403	D399-T401 PolarHBondContact O-N 2.87Å; D399-T401 VanDerWaalsContact OD1-CA 3.31Å; D399-T401 WeakPolarHBondContact OD1-CA 3.48Å; D399-T401 WeakPolarHBondContact OD1-CB 3.49Å; D399-T401 PolarHBondContact OD1-N 3.05Å; D399-T401 PolarHBondContact OD1-OG1 3.37Å; D399-T401 PolarHBondContact OD2-OG1 3.08Å; T401-A403 VanDerWaalsContact C-N 3.26Å; T401-A403 WeakPolarHBondContact OG1-CB 2.92Å
402	G	83.7	Confident	90.9	Very high	55 Å²	55	28.8 Å²	28.8	57%	0.567	19%	0.193	S	C	*	.	S	Bend	trans	82.2	0.2	-173.9	0	0	0	0	0	113.6	D399 A400	D399-G402 PolarHBondContact O-N 3.45Å; D399-G402 PolarHBondContact OD1-N 3.01Å; D399-G402 VanDerWaalsContact OD1-N 3.12Å; A400-G402 VanDerWaalsContact C-N 3.31Å
403	A	87.9	Confident	90.8	Very high	37 Å²	37	30.6 Å²	30.6	31%	0.306	20%	0.202	S	C	.	.			trans	-77.7	148.8	178.4	0	0	0	0	0	111	D399 T401 S405	D399-A403 PolarHBondContact N-O 3.15Å; D399-A403 PolarHBondContact OD1-N 3.41Å; T401-A403 VanDerWaalsContact C-N 3.26Å; T401-A403 WeakPolarHBondContact OG1-CB 2.92Å; A403-S405 PolarHBondContact O-N 3.02Å
404	P	89.8	Confident	90.8	Very high	21 Å²	21	29.2 Å²	29.2	14%	0.136	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	130	171.8	30.4	-36.3	0	0	0	109.5	L339 E374 L375	L339-P404 HydrophobicContact CD2-CB 3.62Å; E374-P404 HydrophobicContact CB-CG 3.69Å; E374-P404 HydrophobicContact CG-CG 4.31Å; E374-P404 WeakPolarHBondContact OE2-CG 3.5Å; L375-P404 HydrophobicContact CD1-CB 4.49Å; L375-P404 WeakPolarHBondContact CD2-O 3.37Å; L375-P404 HydrophobicContact CG-CG 4.46Å
405	S	91	Very high	90.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	159.2	178.2	-85	0	0	0	0	109.6	M396 F397 D399 A403 Q422	M396-S405 WeakPolarHBondContact CA-O 3.19Å; F397-S405 PolarHBondContact N-O 2.82Å; F397-S405 PolarHBondContact O-N 3.18Å; D399-S405 PolarHBondContact OD2-OG 2.92Å; D399-S405 VanDerWaalsContact OD2-OG 3.12Å; A403-S405 PolarHBondContact O-N 3.02Å; S405-Q422 PolarHBondContact OG-NE2 2.83Å; S405-Q422 PolarHBondContact OG-OE1 3.35Å
406	F	93	Very high	91	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.009	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.6	178.8	71.3	-88.4	0	0	0	113.8	F346 L361 I363 L375 I395 M396 L408 Q422	F346-F406 HydrophobicContact CE1-CB 4.24Å; F346-F406 HydrophobicContact CE1-CD1 4.09Å; F346-F406 AromaticContact CE1-CD2 3.76Å; F346-F406 HydrophobicContact CE1-CD2 3.76Å; F346-F406 HydrophobicContact CE1-CE1 4.41Å; F346-F406 HydrophobicContact CE1-CE2 4.12Å; F346-F406 AromaticContact CE1-CG 3.76Å; F346-F406 HydrophobicContact CE1-CG 3.76Å; F346-F406 HydrophobicContact CE1-CZ 4.43Å; F346-F406 HydrophobicContact CZ-CB 4.12Å; F346-F406 HydrophobicContact CZ-CD1 4.42Å; F346-F406 HydrophobicContact CZ-CD2 4.47Å; F346-F406 HydrophobicContact CZ-CG 4.09Å; L361-F406 HydrophobicContact CD2-CE2 3.68Å; L361-F406 HydrophobicContact CD2-CZ 3.5Å; I363-F406 HydrophobicContact CD1-CD1 3.95Å; I363-F406 HydrophobicContact CD1-CE1 3.43Å; I363-F406 VanDerWaalsContact CD1-CE1 3.43Å; I363-F406 HydrophobicContact CD1-CZ 3.82Å; L375-F406 HydrophobicContact CD1-CD1 4.34Å; L375-F406 HydrophobicContact CD2-CD1 3.88Å; L375-F406 HydrophobicContact CD2-CE1 4.1Å; I395-F406 CarbonylContact O-C 3.6Å; I395-F406 WeakPolarHBondContact O-CA 3.38Å; M396-F406 HydrophobicContact CG-CB 4.35Å; F406-L408 HydrophobicContact CD2-CD1 4.44Å; F406-L408 HydrophobicContact CD2-CD2 4.42Å; F406-L408 HydrophobicContact CD2-CG 3.93Å; F406-L408 HydrophobicContact CE2-CD1 3.88Å; F406-L408 HydrophobicContact CE2-CG 3.87Å; F406-Q422 HydrophobicContact CD1-CB 4Å; F406-Q422 HydrophobicContact CD2-CB 4.43Å; F406-Q422 HydrophobicContact CE1-CB 3.75Å; F406-Q422 HydrophobicContact CE2-CB 4.2Å; F406-Q422 HydrophobicContact CG-CB 4.34Å; F406-Q422 HydrophobicContact CZ-CB 3.85Å; F406-Q422 WeakPolarHBondContact O-CB 3.42Å; F406-Q422 PolarHBondContact O-N 2.81Å
407	R	93.8	Very high	91.2	Very high	54 Å²	54	29.4 Å²	29.4	20%	0.204	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	151.8	162.8	-67.9	167.3	-167.7	152.7	5.7	108.7	I395 F397 L419 I420	I395-R407 HydrophobicContact CB-CB 4.33Å; I395-R407 PolarHBondContact N-O 2.84Å; I395-R407 PolarHBondContact O-N 3.34Å; F397-R407 HydrophobicContact CE1-CG 3.91Å; F397-R407 HydrophobicContact CZ-CG 4.37Å; R407-L419 HydrophobicContact CB-CD1 3.86Å; R407-L419 HydrophobicContact CB-CG 4.46Å; R407-I420 CarbonylContact C-O 3.56Å; R407-I420 VanDerWaalsContact CA-O 3.26Å; R407-I420 WeakPolarHBondContact CA-O 3.42Å
408	L	93.8	Very high	91.4	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125.2	178.5	-71	171.1	0	0	0	109.6	F346 L361 A394 F406 L410 L419 I420	F346-L408 HydrophobicContact CD1-CD2 4.04Å; F346-L408 HydrophobicContact CE1-CD2 4.44Å; L361-L408 HydrophobicContact CD1-CD1 4.02Å; L361-L408 HydrophobicContact CD2-CD1 3.78Å; A394-L408 HydrophobicContact CB-CD2 4.13Å; F406-L408 HydrophobicContact CD2-CD1 4.44Å; F406-L408 HydrophobicContact CD2-CD2 4.42Å; F406-L408 HydrophobicContact CD2-CG 3.93Å; F406-L408 HydrophobicContact CE2-CD1 3.88Å; F406-L408 HydrophobicContact CE2-CG 3.87Å; L408-L410 HydrophobicContact CB-CD2 4.21Å; L408-L419 CarbonylContact O-C 3.49Å; L408-L419 WeakPolarHBondContact O-CA 3.23Å; L408-I420 PolarHBondContact N-O 3.46Å; L408-I420 PolarHBondContact O-N 3.06Å
409	L	94.8	Very high	91.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	125.5	161.4	-75.4	166.4	0	0	0	108.1	L41 Y51 I392 S393 I395 Y411 V417 Q418 L419 W428	L41-L409 HydrophobicContact CD1-CD1 4.31Å; L41-L409 HydrophobicContact CD2-CD1 4.39Å; Y51-L409 HydrophobicContact CD2-CD1 3.88Å; Y51-L409 HydrophobicContact CE1-CD1 4.35Å; Y51-L409 HydrophobicContact CE1-CD2 4.28Å; Y51-L409 HydrophobicContact CE2-CD1 3.44Å; Y51-L409 VanDerWaalsContact CE2-CD1 3.44Å; Y51-L409 HydrophobicContact CG-CD1 4.47Å; I392-L409 CarbonylContact C-O 3.57Å; I392-L409 VanDerWaalsContact CA-O 3.27Å; I392-L409 WeakPolarHBondContact CA-O 3.47Å; S393-L409 PolarHBondContact N-O 2.64Å; S393-L409 PolarHBondContact O-N 3.27Å; I395-L409 HydrophobicContact CD1-CD1 4Å; I395-L409 HydrophobicContact CD1-CG 4.18Å; L409-Y411 HydrophobicContact CB-CE2 4.41Å; L409-V417 HydrophobicContact CD2-CG1 4.39Å; L409-Q418 CarbonylContact C-O 3.53Å; L409-Q418 WeakPolarHBondContact CA-O 3.45Å; L409-L419 HydrophobicContact CD2-CB 4.11Å; L409-L419 HydrophobicContact CD2-CD1 3.68Å; L409-L419 HydrophobicContact CD2-CG 4.48Å; L409-L419 HydrophobicContact CG-CD1 3.8Å; L409-W428 HydrophobicContact CD2-CH2 3.73Å; L409-W428 HydrophobicContact CD2-CZ2 3.98Å
410	L	94.6	Very high	92	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136	173.8	-51.6	-174.7	0	0	0	109.2	L382 I389 I392 L408 Q418 I420	L382-L410 HydrophobicContact CD1-CD1 4.14Å; L382-L410 HydrophobicContact CD2-CD1 3.87Å; I389-L410 HydrophobicContact CD1-CD1 4.03Å; I389-L410 HydrophobicContact CD1-CD2 4.46Å; I392-L410 HydrophobicContact CB-CD2 4.22Å; I392-L410 HydrophobicContact CG2-CD2 3.47Å; I392-L410 VanDerWaalsContact CG2-CD2 3.47Å; L408-L410 HydrophobicContact CB-CD2 4.21Å; L410-Q418 HydrophobicContact CB-CB 4.33Å; L410-Q418 PolarHBondContact N-O 2.93Å; L410-Q418 PolarHBondContact O-N 3.26Å; L410-I420 HydrophobicContact CD1-CD1 3.36Å; L410-I420 HydrophobicContact CD1-CG1 4.19Å; L410-I420 HydrophobicContact CG-CD1 4.13Å; L410-I420 HydrophobicContact CG-CG1 4.48Å
411	Y	95	Very high	92.4	Very high	15 Å²	15	24.1 Å²	24.1	6%	0.059	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.2	170.6	-54.9	-86.1	0	0	0	107.6	V36 S39 Y51 E390 S391 L409 V417	V36-Y411 HydrophobicContact CB-CD1 4.2Å; V36-Y411 HydrophobicContact CB-CE1 3.95Å; V36-Y411 HydrophobicContact CG1-CD1 4.44Å; V36-Y411 HydrophobicContact CG1-CE1 3.78Å; V36-Y411 HydrophobicContact CG2-CE1 4.38Å; S39-Y411 WeakPolarHBondContact CB-OH 3.35Å; S39-Y411 PolarHBondContact OG-OH 3.37Å; Y51-Y411 WeakPolarHBondContact OH-CE1 3.41Å; Y51-Y411 PolarHBondContact OH-OH 3.38Å; E390-Y411 PolarHBondContact N-O 3.12Å; S391-Y411 PolarHBondContact N-O 3.31Å; S391-Y411 PolarHBondContact O-N 3.09Å; S391-Y411 WeakPolarHBondContact OG-CD2 3.05Å; L409-Y411 HydrophobicContact CB-CE2 4.41Å; Y411-V417 HydrophobicContact CD1-CG1 4.16Å; Y411-V417 HydrophobicContact CD1-CG2 3.97Å; Y411-V417 HydrophobicContact CE1-CG1 3.88Å; Y411-V417 HydrophobicContact CE1-CG2 4.15Å
412	T	93.2	Very high	92.6	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.012	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	162.3	-174.2	46.5	0	0	0	0	112.4	H386 T388 I389 D414 D415 A416	H386-T412 HydrophobicContact CB-CG2 4.03Å; T388-T412 CarbonylContact O-C 3.59Å; T388-T412 WeakPolarHBondContact O-CA 3.49Å; I389-T412 HydrophobicContact CG1-CG2 4.27Å; T412-D414 VanDerWaalsContact CB-OD1 3.32Å; T412-D414 WeakPolarHBondContact CB-OD1 3.33Å; T412-D414 PolarHBondContact O-N 3.15Å; T412-D414 VanDerWaalsContact O-N 3.17Å; T412-D414 PolarHBondContact OG1-OD1 3.37Å; T412-D415 PolarHBondContact O-N 2.81Å; T412-A416 PolarHBondContact N-O 3.42Å; T412-A416 VanDerWaalsContact N-O 3.13Å; T412-A416 WeakPolarHBondContact OG1-CB 3.43Å; T412-A416 PolarHBondContact OG1-O 3.41Å
413	E	90.9	Very high	92.7	Very high	49 Å²	49	22.2 Å²	22.2	23%	0.229	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.2	-177.3	-173.1	-175.1	164.5	0	0	113.4	T388 D415 F631	T388-E413 PolarHBondContact N-OE2 3.35Å; T388-E413 PolarHBondContact O-N 2.77Å; T388-E413 PolarHBondContact OG1-OE2 2.97Å; E413-D415 PolarHBondContact O-N 3.28Å; E413-F631 HydrophobicContact CB-CZ 4.46Å; E413-F631 HydrophobicContact CG-CE1 4.39Å; E413-F631 HydrophobicContact CG-CZ 4.02Å
414	D	92.6	Very high	92.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	16.7	176.4	74.2	-24.8	0	0	0	114	H386 T412 A416 A433 K615 F631	H386-D414 IonicContact CE1-OD2 3.89Å; H386-D414 IonicContact CG-OD2 2.59Å; H386-D414 IonicContact ND1-OD1 2.85Å; H386-D414 IonicContact ND1-OD2 2.89Å; H386-D414 PolarHBondContact ND1-OD2 2.92Å; T412-D414 VanDerWaalsContact CB-OD1 3.32Å; T412-D414 WeakPolarHBondContact CB-OD1 3.33Å; T412-D414 PolarHBondContact O-N 3.15Å; T412-D414 VanDerWaalsContact O-N 3.17Å; T412-D414 PolarHBondContact OG1-OD1 3.37Å; D414-A416 PolarHBondContact O-N 2.8Å; D414-A416 VanDerWaalsContact OD1-CB 3.26Å; D414-A416 WeakPolarHBondContact OD1-CB 3.4Å; D414-A416 PolarHBondContact OD1-N 3.23Å; D414-A416 VanDerWaalsContact OD1-N 3.12Å; D414-A433 WeakPolarHBondContact O-CB 3.44Å; D414-K615 HydrophobicContact CB-CD 3.98Å; D414-K615 WeakPolarHBondContact OD2-CD 3.38Å; D414-K615 IonicContact OD2-NZ 3.27Å; D414-K615 PolarHBondContact OD2-NZ 3.28Å; D414-F631 HydrophobicContact CB-CD2 3.85Å; D414-F631 HydrophobicContact CB-CE2 3.98Å; D414-F631 HydrophobicContact CB-CG 4.19Å; D414-F631 HydrophobicContact CB-CZ 4.43Å
415	D	94.9	Very high	92.7	Very high	16 Å²	16	27.2 Å²	27.2	9%	0.086	13%	0.126	C	C	.	.	S	Bend	trans	62.6	11.4	-175.2	-58.2	-19.2	0	0	0	114.9	K35 T412 E413 E432 A433 V613	K35-D415 HydrophobicContact CB-CB 4.26Å; K35-D415 WeakPolarHBondContact CD-OD1 3.38Å; K35-D415 VanDerWaalsContact CE-OD1 3.25Å; K35-D415 WeakPolarHBondContact CE-OD1 3.31Å; K35-D415 HydrophobicContact CG-CB 4.3Å; K35-D415 WeakPolarHBondContact CG-OD1 3.46Å; K35-D415 IonicContact NZ-OD1 3.62Å; K35-D415 PolarHBondContact NZ-OD1 3.33Å; T412-D415 PolarHBondContact O-N 2.81Å; E413-D415 PolarHBondContact O-N 3.28Å; D415-E432 WeakPolarHBondContact O-CB 3.15Å; D415-A433 HydrophobicContact CB-CB 4.46Å; D415-V613 VanDerWaalsContact OD2-CG1 3.24Å; D415-V613 WeakPolarHBondContact OD2-CG1 3.27Å
416	A	95	Very high	92.7	Very high	1 Å²	1	31 Å²	31	1%	0.008	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	146.1	176.1	0	0	0	0	0	112.1	T412 D414 I429 R430	T412-A416 PolarHBondContact N-O 3.42Å; T412-A416 VanDerWaalsContact N-O 3.13Å; T412-A416 WeakPolarHBondContact OG1-CB 3.43Å; T412-A416 PolarHBondContact OG1-O 3.41Å; D414-A416 PolarHBondContact O-N 2.8Å; D414-A416 VanDerWaalsContact OD1-CB 3.26Å; D414-A416 WeakPolarHBondContact OD1-CB 3.4Å; D414-A416 PolarHBondContact OD1-N 3.23Å; D414-A416 VanDerWaalsContact OD1-N 3.12Å; A416-I429 HydrophobicContact CB-CD1 4.27Å; A416-I429 HydrophobicContact CB-CG1 4.41Å; A416-R430 WeakPolarHBondContact CA-O 3.4Å
417	V	95.5	Very high	92.6	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.024	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123	175.3	-172.4	0	0	0	0	108.9	V36 L409 Y411 W428 I429 R430 E432	V36-V417 HydrophobicContact CG2-CG2 3.79Å; L409-V417 HydrophobicContact CD2-CG1 4.39Å; Y411-V417 HydrophobicContact CD1-CG1 4.16Å; Y411-V417 HydrophobicContact CD1-CG2 3.97Å; Y411-V417 HydrophobicContact CE1-CG1 3.88Å; Y411-V417 HydrophobicContact CE1-CG2 4.15Å; V417-W428 HydrophobicContact CB-CZ3 4.34Å; V417-W428 HydrophobicContact CG1-CH2 4.05Å; V417-W428 HydrophobicContact CG1-CZ3 3.95Å; V417-W428 WeakPolarHBondContact O-CZ3 3.28Å; V417-I429 CarbonylContact O-C 3.59Å; V417-I429 WeakPolarHBondContact O-CA 3.38Å; V417-R430 HydrophobicContact CB-CB 4.49Å; V417-R430 PolarHBondContact N-O 3.05Å; V417-R430 PolarHBondContact O-N 2.97Å; V417-E432 HydrophobicContact CG2-CG 4.23Å
418	Q	94.2	Very high	92.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134	-175.4	-56.3	-179.1	37.9	0	0	110.7	H386 L409 L410 I429	H386-Q418 PolarHBondContact CD2-NE2 2.92Å; L409-Q418 CarbonylContact C-O 3.53Å; L409-Q418 WeakPolarHBondContact CA-O 3.45Å; L410-Q418 HydrophobicContact CB-CB 4.33Å; L410-Q418 PolarHBondContact N-O 2.93Å; L410-Q418 PolarHBondContact O-N 3.26Å; Q418-I429 HydrophobicContact CG-CB 4.31Å; Q418-I429 HydrophobicContact CG-CD1 3.71Å; Q418-I429 HydrophobicContact CG-CG1 3.81Å
419	L	94.1	Very high	92.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.3	167.8	-175.4	70.6	0	0	0	109.6	L65 I395 R407 L408 L409 Q427 W428	L65-L419 WeakPolarHBondContact O-CD2 3.33Å; I395-L419 HydrophobicContact CD1-CD1 4.01Å; R407-L419 HydrophobicContact CB-CD1 3.86Å; R407-L419 HydrophobicContact CB-CG 4.46Å; L408-L419 CarbonylContact O-C 3.49Å; L408-L419 WeakPolarHBondContact O-CA 3.23Å; L409-L419 HydrophobicContact CD2-CB 4.11Å; L409-L419 HydrophobicContact CD2-CD1 3.68Å; L409-L419 HydrophobicContact CD2-CG 4.48Å; L409-L419 HydrophobicContact CG-CD1 3.8Å; L419-Q427 HydrophobicContact CB-CB 4.47Å; L419-Q427 HydrophobicContact CD2-CB 4.37Å; L419-Q427 HydrophobicContact CD2-CG 4.43Å; L419-Q427 HydrophobicContact CG-CB 4.41Å; L419-Q427 WeakPolarHBondContact O-CB 3.25Å; L419-Q427 PolarHBondContact O-N 3.02Å; L419-W428 HydrophobicContact CB-CD2 3.76Å; L419-W428 HydrophobicContact CB-CE3 4.29Å; L419-W428 HydrophobicContact CB-CG 4.24Å; L419-W428 HydrophobicContact CB-CH2 4.08Å; L419-W428 HydrophobicContact CB-CZ2 3.54Å; L419-W428 HydrophobicContact CB-CZ3 4.43Å; L419-W428 HydrophobicContact CD2-CZ2 4.03Å; L419-W428 HydrophobicContact CG-CZ2 4.3Å; L419-W428 PolarHBondContact N-O 2.69Å; L419-W428 VanDerWaalsContact N-O 3.07Å
420	I	93.1	Very high	92.6	Very high	11 Å²	11	33.9 Å²	33.9	6%	0.056	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.3	-178.8	-55.6	-169.5	0	0	0	109.8	L382 R407 L408 L410	L382-I420 HydrophobicContact CD1-CD1 3.57Å; R407-I420 CarbonylContact C-O 3.56Å; R407-I420 VanDerWaalsContact CA-O 3.26Å; R407-I420 WeakPolarHBondContact CA-O 3.42Å; L408-I420 PolarHBondContact N-O 3.46Å; L408-I420 PolarHBondContact O-N 3.06Å; L410-I420 HydrophobicContact CD1-CD1 3.36Å; L410-I420 HydrophobicContact CD1-CG1 4.19Å; L410-I420 HydrophobicContact CG-CD1 4.13Å; L410-I420 HydrophobicContact CG-CG1 4.48Å
421	R	92.5	Very high	92.6	Very high	114 Å²	114	34.2 Å²	34.2	43%	0.43	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	159.1	174	-65	-176.2	177.1	-134.2	1.5	110.6	N423 G424 K425 Q427	R421-N423 WeakPolarHBondContact CB-OD1 3.12Å; R421-N423 PolarHBondContact O-N 2.86Å; R421-G424 PolarHBondContact O-N 2.81Å; R421-K425 PolarHBondContact N-O 3.02Å; R421-Q427 HydrophobicContact CG-CB 4.21Å
422	Q	90.2	Very high	92.6	Very high	50 Å²	50	33.6 Å²	33.6	23%	0.234	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-26	176.2	62.5	-177.9	-2.7	0	0	115.5	R378 F380 S405 F406 G424	R378-Q422 WeakPolarHBondContact CD-O 3.02Å; R378-Q422 PolarHBondContact NH1-O 2.95Å; F380-Q422 WeakPolarHBondContact CE1-O 3.47Å; F380-Q422 WeakPolarHBondContact CZ-O 3.49Å; S405-Q422 PolarHBondContact OG-NE2 2.83Å; S405-Q422 PolarHBondContact OG-OE1 3.35Å; F406-Q422 HydrophobicContact CD1-CB 4Å; F406-Q422 HydrophobicContact CD2-CB 4.43Å; F406-Q422 HydrophobicContact CE1-CB 3.75Å; F406-Q422 HydrophobicContact CE2-CB 4.2Å; F406-Q422 HydrophobicContact CG-CB 4.34Å; F406-Q422 HydrophobicContact CZ-CB 3.85Å; F406-Q422 WeakPolarHBondContact O-CB 3.42Å; F406-Q422 PolarHBondContact O-N 2.81Å; Q422-G424 VanDerWaalsContact C-N 3.25Å; Q422-G424 PolarHBondContact O-N 2.91Å
423	N	87.7	Confident	92.7	Very high	85 Å²	85	33.6 Å²	33.6	46%	0.455	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	6.2	177.5	66	-4	0	0	0	114	F380 R421 K425	F380-N423 VanDerWaalsContact CE1-C 3.5Å; R421-N423 WeakPolarHBondContact CB-OD1 3.12Å; R421-N423 PolarHBondContact O-N 2.86Å; N423-K425 VanDerWaalsContact C-N 3.27Å; N423-K425 PolarHBondContact O-N 3.47Å; N423-K425 WeakPolarHBondContact OD1-CB 3.31Å; N423-K425 PolarHBondContact OD1-N 2.84Å; N423-K425 VanDerWaalsContact OD1-N 3.09Å
424	G	86.2	Confident	93	Very high	18 Å²	18	31.3 Å²	31.3	19%	0.186	15%	0.147	C	C	.	.	S	Bend	trans	82.3	-3.6	-178.1	0	0	0	0	0	114.5	R421 Q422 Q426	R421-G424 PolarHBondContact O-N 2.81Å; Q422-G424 VanDerWaalsContact C-N 3.25Å; Q422-G424 PolarHBondContact O-N 2.91Å; G424-Q426 PolarHBondContact O-N 2.82Å
425	K	90.7	Very high	93.1	Very high	144 Å²	144	31.3 Å²	31.3	63%	0.626	15%	0.147	S	C	*	.			trans	-76.6	127.1	176.8	-64.3	-171	179.1	-174.7	0	110.1	R421 N423 Q427	R421-K425 PolarHBondContact N-O 3.02Å; N423-K425 VanDerWaalsContact C-N 3.27Å; N423-K425 PolarHBondContact O-N 3.47Å; N423-K425 WeakPolarHBondContact OD1-CB 3.31Å; N423-K425 PolarHBondContact OD1-N 2.84Å; N423-K425 VanDerWaalsContact OD1-N 3.09Å; K425-Q427 PolarHBondContact O-N 2.8Å
426	Q	90	Very high	93.1	Very high	81 Å²	81	32.7 Å²	32.7	38%	0.379	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	124.6	169.4	-173	-179.1	-62.5	0	0	109.6	G424 I429	G424-Q426 PolarHBondContact O-N 2.82Å; Q426-I429 VanDerWaalsContact NE2-CB 3.35Å
427	Q	90.8	Very high	93.1	Very high	39 Å²	39	32.9 Å²	32.9	18%	0.182	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-46.7	176.7	-175.3	170.9	-30.1	0	0	111.1	L65 K66 L419 R421 K425	L65-Q427 PolarHBondContact O-NE2 2.78Å; L65-Q427 VanDerWaalsContact O-NE2 3.12Å; K66-Q427 PolarHBondContact O-NE2 2.85Å; L419-Q427 HydrophobicContact CB-CB 4.47Å; L419-Q427 HydrophobicContact CD2-CB 4.37Å; L419-Q427 HydrophobicContact CD2-CG 4.43Å; L419-Q427 HydrophobicContact CG-CB 4.41Å; L419-Q427 WeakPolarHBondContact O-CB 3.25Å; L419-Q427 PolarHBondContact O-N 3.02Å; R421-Q427 HydrophobicContact CG-CB 4.21Å; K425-Q427 PolarHBondContact O-N 2.8Å
428	W	94.6	Very high	92.9	Very high	15 Å²	15	33.8 Å²	33.8	6%	0.057	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	162	173.2	53	-106.7	0	0	0	109.7	Y51 L65 D67 L409 V417 L419 R430	Y51-W428 HydrophobicContact CE1-CH2 4.23Å; L65-W428 PolarHBondContact O-NE1 2.79Å; D67-W428 VanDerWaalsContact C-CD1 3.47Å; D67-W428 WeakPolarHBondContact O-CB 3.41Å; L409-W428 HydrophobicContact CD2-CH2 3.73Å; L409-W428 HydrophobicContact CD2-CZ2 3.98Å; V417-W428 HydrophobicContact CB-CZ3 4.34Å; V417-W428 HydrophobicContact CG1-CH2 4.05Å; V417-W428 HydrophobicContact CG1-CZ3 3.95Å; V417-W428 WeakPolarHBondContact O-CZ3 3.28Å; L419-W428 HydrophobicContact CB-CD2 3.76Å; L419-W428 HydrophobicContact CB-CE3 4.29Å; L419-W428 HydrophobicContact CB-CG 4.24Å; L419-W428 HydrophobicContact CB-CH2 4.08Å; L419-W428 HydrophobicContact CB-CZ2 3.54Å; L419-W428 HydrophobicContact CB-CZ3 4.43Å; L419-W428 HydrophobicContact CD2-CZ2 4.03Å; L419-W428 HydrophobicContact CG-CZ2 4.3Å; L419-W428 PolarHBondContact N-O 2.69Å; L419-W428 VanDerWaalsContact N-O 3.07Å; W428-R430 HydrophobicContact CE3-CG 4Å; W428-R430 HydrophobicContact CZ3-CG 3.96Å
429	I	94	Very high	92.9	Very high	35 Å²	35	34.4 Å²	34.4	18%	0.179	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	141.6	173.6	-178.2	162	0	0	0	109.2	H386 A416 V417 Q418 Q426 E431	H386-I429 WeakPolarHBondContact CE1-CD1 3.46Å; H386-I429 VanDerWaalsContact NE2-CD1 3.3Å; H386-I429 WeakPolarHBondContact NE2-CD1 2.96Å; A416-I429 HydrophobicContact CB-CD1 4.27Å; A416-I429 HydrophobicContact CB-CG1 4.41Å; V417-I429 CarbonylContact O-C 3.59Å; V417-I429 WeakPolarHBondContact O-CA 3.38Å; Q418-I429 HydrophobicContact CG-CB 4.31Å; Q418-I429 HydrophobicContact CG-CD1 3.71Å; Q418-I429 HydrophobicContact CG-CG1 3.81Å; Q426-I429 VanDerWaalsContact NE2-CB 3.35Å; I429-E431 WeakPolarHBondContact CD1-OE1 3.26Å
430	R	94.3	Very high	92.9	Very high	32 Å²	32	34.9 Å²	34.9	12%	0.121	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.3	171.6	-64.2	-176	63.2	69.3	14.6	109.7	K31 G68 A416 V417 W428 E432	K31-R430 PolarHBondContact O-NH2 3.42Å; G68-R430 VanDerWaalsContact O-CD 3.23Å; G68-R430 WeakPolarHBondContact O-CD 3.4Å; G68-R430 PolarHBondContact O-NH1 3.22Å; A416-R430 WeakPolarHBondContact CA-O 3.4Å; V417-R430 HydrophobicContact CB-CB 4.49Å; V417-R430 PolarHBondContact N-O 3.05Å; V417-R430 PolarHBondContact O-N 2.97Å; W428-R430 HydrophobicContact CE3-CG 4Å; W428-R430 HydrophobicContact CZ3-CG 3.96Å; R430-E432 HydrophobicContact CB-CG 4.3Å; R430-E432 IonicContact CZ-OE1 2.65Å; R430-E432 IonicContact NE-OE1 3.34Å; R430-E432 PolarHBondContact NE-OE1 2.81Å; R430-E432 IonicContact NH2-OE1 3.4Å; R430-E432 PolarHBondContact NH2-OE1 3.37Å; R430-E432 PolarHBondContact O-N 2.78Å
431	E	94.9	Very high	93	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.037	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	70.3	-179.6	-61.8	-65	169.3	0	0	110.4	H386 I429 A433 L434 R547 K615 F617 I626	H386-E431 IonicContact CE1-OE1 2.68Å; H386-E431 PolarHBondContact CE1-OE1 3.23Å; I429-E431 WeakPolarHBondContact CD1-OE1 3.26Å; E431-A433 PolarHBondContact O-N 3.43Å; E431-A433 VanDerWaalsContact O-N 3.15Å; E431-L434 HydrophobicContact CB-CD1 4.06Å; E431-L434 HydrophobicContact CB-CG 4.39Å; E431-L434 WeakPolarHBondContact O-CB 3.46Å; E431-L434 PolarHBondContact O-N 2.87Å; E431-L434 VanDerWaalsContact O-N 3.12Å; E431-R547 IonicContact OE1-CZ 3.75Å; E431-R547 IonicContact OE1-NH1 3.75Å; E431-R547 PolarHBondContact OE1-NH1 3.43Å; E431-R547 IonicContact OE1-NH2 3.93Å; E431-R547 PolarHBondContact OE1-NH2 2.93Å; E431-K615 IonicContact OE1-NZ 3.09Å; E431-K615 IonicContact OE2-NZ 3.66Å; E431-K615 PolarHBondContact OE2-NZ 3.25Å; E431-F617 HydrophobicContact CB-CE1 4.21Å; E431-F617 HydrophobicContact CB-CZ 4.17Å; E431-F617 HydrophobicContact CG-CE1 4.06Å; E431-F617 HydrophobicContact CG-CZ 4.42Å; E431-I626 HydrophobicContact CB-CD1 4.32Å; E431-I626 HydrophobicContact CG-CD1 3.71Å
432	E	95.8	Very high	93	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.009	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-68.1	-13.1	-174.5	-62.2	-65.1	162.1	0	0	113.4	F32 V33 G34 D415 V417 R430 L434 A435	F32-E432 WeakPolarHBondContact CB-OE2 3.34Å; V33-E432 PolarHBondContact N-OE2 2.84Å; G34-E432 PolarHBondContact N-OE2 2.78Å; D415-E432 WeakPolarHBondContact O-CB 3.15Å; V417-E432 HydrophobicContact CG2-CG 4.23Å; R430-E432 HydrophobicContact CB-CG 4.3Å; R430-E432 IonicContact CZ-OE1 2.65Å; R430-E432 IonicContact NE-OE1 3.34Å; R430-E432 PolarHBondContact NE-OE1 2.81Å; R430-E432 IonicContact NH2-OE1 3.4Å; R430-E432 PolarHBondContact NH2-OE1 3.37Å; R430-E432 PolarHBondContact O-N 2.78Å; E432-L434 PolarHBondContact O-N 2.84Å; E432-A435 VanDerWaalsContact O-CB 3.25Å; E432-A435 WeakPolarHBondContact O-CB 3.38Å; E432-A435 PolarHBondContact O-N 2.89Å; E432-A435 VanDerWaalsContact O-N 3.11Å
433	A	95.2	Very high	93.1	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.008	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-58.7	-26	169.3	0	0	0	0	0	113.6	D414 D415 E431 A435 N436 T611 V613 F617	D414-A433 WeakPolarHBondContact O-CB 3.44Å; D415-A433 HydrophobicContact CB-CB 4.46Å; E431-A433 PolarHBondContact O-N 3.43Å; E431-A433 VanDerWaalsContact O-N 3.15Å; A433-A435 PolarHBondContact O-N 3.01Å; A433-N436 PolarHBondContact O-N 3.36Å; A433-T611 HydrophobicContact CB-CG2 4.03Å; A433-T611 WeakPolarHBondContact O-CB 3.37Å; A433-T611 WeakPolarHBondContact O-CG2 2.98Å; A433-V613 HydrophobicContact CB-CG2 3.97Å; A433-F617 HydrophobicContact CB-CE2 4.44Å
434	L	96	Very high	93.3	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-66.3	-15.9	176.6	-72.5	172.6	0	0	0	113.2	F32 E431 E432 N436 I437 I609 F617 I626 L1086	F32-L434 HydrophobicContact CD1-CB 4.39Å; F32-L434 HydrophobicContact CD2-CB 4.34Å; F32-L434 HydrophobicContact CE1-CB 3.97Å; F32-L434 HydrophobicContact CE1-CD1 4.05Å; F32-L434 HydrophobicContact CE2-CB 3.93Å; F32-L434 HydrophobicContact CE2-CD1 4.47Å; F32-L434 HydrophobicContact CZ-CB 3.73Å; F32-L434 HydrophobicContact CZ-CD1 3.65Å; F32-L434 HydrophobicContact CZ-CG 4.35Å; E431-L434 HydrophobicContact CB-CD1 4.06Å; E431-L434 HydrophobicContact CB-CG 4.39Å; E431-L434 WeakPolarHBondContact O-CB 3.46Å; E431-L434 PolarHBondContact O-N 2.87Å; E431-L434 VanDerWaalsContact O-N 3.12Å; E432-L434 PolarHBondContact O-N 2.84Å; L434-N436 PolarHBondContact O-N 3.48Å; L434-I437 HydrophobicContact CD2-CD1 4.26Å; L434-I437 WeakPolarHBondContact O-CD1 3.02Å; L434-I437 WeakPolarHBondContact O-CG1 3.31Å; L434-I609 HydrophobicContact CD2-CG2 4.26Å; L434-F617 HydrophobicContact CD2-CB 4.5Å; L434-F617 HydrophobicContact CD2-CD2 3.67Å; L434-F617 HydrophobicContact CD2-CE2 3.89Å; L434-F617 HydrophobicContact CD2-CG 3.99Å; L434-F617 HydrophobicContact CD2-CZ 4.38Å; L434-F617 HydrophobicContact CG-CD2 4.37Å; L434-F617 HydrophobicContact CG-CE2 4.12Å; L434-F617 HydrophobicContact CG-CZ 4.21Å; L434-I626 HydrophobicContact CD1-CD1 4.26Å; L434-L1086 HydrophobicContact CB-CD1 4.35Å; L434-L1086 HydrophobicContact CD1-CD1 4.5Å; L434-L1086 HydrophobicContact CD2-CD1 4.48Å
435	A	95.3	Very high	93.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-69.8	-13.8	169.4	0	0	0	0	0	113.4	F32 L57 E432 A433 G1083 L1084	F32-A435 HydrophobicContact CB-CB 3.87Å; L57-A435 HydrophobicContact CD1-CB 3.99Å; E432-A435 VanDerWaalsContact O-CB 3.25Å; E432-A435 WeakPolarHBondContact O-CB 3.38Å; E432-A435 PolarHBondContact O-N 2.89Å; E432-A435 VanDerWaalsContact O-N 3.11Å; A433-A435 PolarHBondContact O-N 3.01Å; A435-G1083 CarbonylContact C-O 3.55Å; A435-L1084 HydrophobicContact CB-CD1 3.8Å
436	N	94.3	Very high	93.1	Very high	46 Å²	46	23.7 Å²	23.7	25%	0.246	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-129.8	57.6	-174.8	-158	-2.7	0	0	0	111.9	A433 L434 T611 S612 R1064	A433-N436 PolarHBondContact O-N 3.36Å; L434-N436 PolarHBondContact O-N 3.48Å; N436-T611 CarbonylContact O-C 3.58Å; N436-T611 WeakPolarHBondContact O-CA 3.44Å; N436-S612 PolarHBondContact ND2-OG 2.88Å; N436-S612 PolarHBondContact O-N 2.86Å; N436-R1064 PolarHBondContact OD1-NH1 3.37Å
437	I	95.1	Very high	92.6	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.021	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	138.3	175.8	-64.7	170	0	0	0	110.9	L434 V440 I609 T611 Y1082 L1086	L434-I437 HydrophobicContact CD2-CD1 4.26Å; L434-I437 WeakPolarHBondContact O-CD1 3.02Å; L434-I437 WeakPolarHBondContact O-CG1 3.31Å; I437-V440 HydrophobicContact CG2-CG2 3.47Å; I437-V440 VanDerWaalsContact CG2-CG2 3.47Å; I437-I609 HydrophobicContact CB-CG2 4.2Å; I437-I609 HydrophobicContact CD1-CD1 4.14Å; I437-I609 HydrophobicContact CD1-CG2 3.53Å; I437-I609 HydrophobicContact CG1-CG2 3.49Å; I437-I609 VanDerWaalsContact CG1-CG2 3.49Å; I437-I609 HydrophobicContact CG2-CG2 3.7Å; I437-T611 HydrophobicContact CG1-CG2 4.39Å; I437-Y1082 HydrophobicContact CB-CD2 3.73Å; I437-Y1082 HydrophobicContact CB-CE2 4.21Å; I437-Y1082 HydrophobicContact CB-CG 4.45Å; I437-Y1082 HydrophobicContact CG2-CD2 3.55Å; I437-Y1082 HydrophobicContact CG2-CE2 3.68Å; I437-Y1082 HydrophobicContact CG2-CG 4.16Å; I437-L1086 HydrophobicContact CD1-CD1 4.31Å; I437-L1086 HydrophobicContact CD1-CD2 3.38Å; I437-L1086 HydrophobicContact CD1-CG 4.48Å
438	V	92.5	Very high	91.7	Very high	24 Å²	24	20.9 Å²	20.9	15%	0.145	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-35.6	-176.1	177.9	0	0	0	0	112.2	A610 L637 K642 F643	V438-A610 PolarHBondContact N-O 3.42Å; V438-L637 HydrophobicContact CB-CD2 4.41Å; V438-L637 HydrophobicContact CG1-CD2 3.87Å; V438-L637 HydrophobicContact CG2-CD2 4.03Å; V438-K642 VanDerWaalsContact CG1-CA 3.47Å; V438-K642 HydrophobicContact CG1-CB 4.13Å; V438-K642 HydrophobicContact CG1-CG 4.28Å; V438-F643 HydrophobicContact CB-CD2 4.4Å; V438-F643 HydrophobicContact CG1-CB 4.41Å; V438-F643 HydrophobicContact CG1-CD2 4.44Å; V438-F643 VanDerWaalsContact CG1-N 3.28Å
439	A	93.1	Very high	90.4	Very high	13 Å²	13	26.6 Å²	26.6	11%	0.107	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.3	177.1	0	0	0	0	0	111.2	A610 L645	A439-A610 HydrophobicContact CB-CB 4.31Å; A439-A610 PolarHBondContact N-O 2.86Å; A439-A610 PolarHBondContact O-N 2.99Å; A439-L645 HydrophobicContact CB-CD1 3.94Å; A439-L645 HydrophobicContact CB-CG 4.23Å
440	V	94.9	Very high	89.2	Confident	10 Å²	10	30 Å²	30	6%	0.061	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	133.2	178.8	-176.8	0	0	0	0	109.8	I437 V608 I609 F1080 Y1082	I437-V440 HydrophobicContact CG2-CG2 3.47Å; I437-V440 VanDerWaalsContact CG2-CG2 3.47Å; V440-V608 CarbonylContact C-O 3.53Å; V440-V608 WeakPolarHBondContact CA-O 3.23Å; V440-I609 HydrophobicContact CG1-CG1 4.21Å; V440-I609 HydrophobicContact CG2-CG1 4.21Å; V440-F1080 HydrophobicContact CG1-CD1 3.85Å; V440-F1080 HydrophobicContact CG1-CE1 3.91Å; V440-F1080 HydrophobicContact CG2-CE1 4.04Å; V440-Y1082 HydrophobicContact CB-CE1 4.06Å; V440-Y1082 HydrophobicContact CG2-CD1 3.74Å; V440-Y1082 HydrophobicContact CG2-CD2 4.43Å; V440-Y1082 HydrophobicContact CG2-CE1 3.52Å; V440-Y1082 HydrophobicContact CG2-CE2 4.24Å; V440-Y1082 HydrophobicContact CG2-CG 4.18Å
441	E	94	Very high	88	Confident	47 Å²	47	30.9 Å²	30.9	22%	0.22	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.1	169.1	-75.1	-60.6	163.4	0	0	111.1	V608 L645 M660 R1067	E441-V608 PolarHBondContact N-O 2.93Å; E441-V608 PolarHBondContact O-N 2.84Å; E441-L645 HydrophobicContact CG-CB 3.93Å; E441-L645 HydrophobicContact CG-CD1 4.29Å; E441-M660 HydrophobicContact CB-CE 3.89Å; E441-M660 HydrophobicContact CG-CE 4.24Å; E441-R1067 IonicContact OE1-CZ 2.69Å; E441-R1067 IonicContact OE1-NH2 2.65Å; E441-R1067 PolarHBondContact OE1-NH2 3.47Å; E441-R1067 IonicContact OE2-CZ 2.95Å; E441-R1067 IonicContact OE2-NE 3.34Å; E441-R1067 IonicContact OE2-NH2 3.7Å; E441-R1067 PolarHBondContact OE2-NH2 3.38Å
442	V	94.1	Very high	86.8	Confident	26 Å²	26	31 Å²	31	16%	0.158	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.9	179.2	-173.3	0	0	0	0	108.3	K605 L607 R1067 A1069	V442-K605 HydrophobicContact CG1-CB 3.95Å; V442-K605 HydrophobicContact CG1-CD 3.69Å; V442-K605 HydrophobicContact CG1-CG 4.46Å; V442-L607 HydrophobicContact CB-CD2 4.28Å; V442-L607 HydrophobicContact CG1-CD2 4.01Å; V442-L607 HydrophobicContact CG2-CD2 3.66Å; V442-R1067 HydrophobicContact CG2-CG 3.82Å; V442-A1069 HydrophobicContact CB-CB 3.88Å; V442-A1069 HydrophobicContact CG1-CB 3.68Å; V442-A1069 HydrophobicContact CG2-CB 4.08Å
443	I	92.4	Very high	85.5	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134	-170	-53.3	171.8	0	0	0	108.4	K605 M606 V608 L651 M660 P679 I680	I443-K605 WeakPolarHBondContact O-CB 3.47Å; I443-M606 HydrophobicContact CB-CB 4.47Å; I443-M606 PolarHBondContact N-O 3.06Å; I443-M606 PolarHBondContact O-N 3.36Å; I443-V608 HydrophobicContact CD1-CB 4.08Å; I443-V608 HydrophobicContact CD1-CG2 3.37Å; I443-V608 HydrophobicContact CG1-CG2 4.37Å; I443-L651 HydrophobicContact CG2-CD1 4.25Å; I443-M660 HydrophobicContact CD1-CE 3.36Å; I443-M660 HydrophobicContact CG1-CE 4.07Å; I443-P679 HydrophobicContact CD1-CB 3.23Å; I443-P679 HydrophobicContact CD1-CG 3.9Å; I443-I680 HydrophobicContact CG2-CD1 4.3Å
444	D	91	Very high	84.2	Confident	66 Å²	66	35.9 Å²	35.9	35%	0.353	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	154.3	173.1	-60.8	-38.3	0	0	0	110.5	N602 K605 L651	D444-N602 PolarHBondContact OD1-ND2 2.95Å; D444-N602 PolarHBondContact OD1-OD1 2.82Å; D444-K605 VanDerWaalsContact OD1-CE 3.25Å; D444-K605 WeakPolarHBondContact OD1-CE 3.36Å; D444-K605 IonicContact OD1-NZ 3.81Å; D444-K605 PolarHBondContact OD1-NZ 3.36Å; D444-L651 WeakPolarHBondContact O-CD1 3.4Å
445	L	89.7	Confident	83	Confident	5 Å²	5	39.4 Å²	39.4	3%	0.026	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-86.8	158.1	172.5	-73.5	177.9	0	0	0	111.3	R598 H604 M606 I680	L445-R598 HydrophobicContact CB-CB 4.3Å; L445-H604 HydrophobicContact CD1-CB 4.19Å; L445-H604 VanDerWaalsContact CD1-CD2 3.41Å; L445-H604 WeakPolarHBondContact CD1-CD2 3.46Å; L445-H604 VanDerWaalsContact CD1-CG 3.48Å; L445-H604 WeakPolarHBondContact CD1-NE2 3.36Å; L445-H604 WeakPolarHBondContact CD1-O 3.3Å; L445-M606 HydrophobicContact CD2-CB 4.06Å; L445-I680 HydrophobicContact CD2-CD1 4.02Å
446	P	83.8	Confident	81.7	Confident	41 Å²	41	44 Å²	44	27%	0.266	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-60.7	143.9	173.7	24.3	-33.7	0	0	0	111.1	L596 T597 R598 L651	P446-L596 WeakPolarHBondContact CD-O 3.49Å; P446-L596 VanDerWaalsContact CG-O 3.27Å; P446-L596 WeakPolarHBondContact CG-O 3.17Å; P446-T597 CarbonylContact O-C 3.23Å; P446-T597 VanDerWaalsContact O-CA 3.23Å; P446-T597 WeakPolarHBondContact O-CA 3.33Å; P446-R598 PolarHBondContact O-N 3.21Å; P446-L651 HydrophobicContact CB-CD2 4Å
447	V	78.7	Confident	80.3	Confident	29 Å²	29	43 Å²	43	18%	0.176	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-64.9	147.8	171.7	-75.9	0	0	0	0	111.3	Q451 A452	V447-Q451 HydrophobicContact CB-CB 4.23Å; V447-Q451 HydrophobicContact CB-CG 4.31Å; V447-Q451 HydrophobicContact CG1-CG 4.13Å; V447-A452 HydrophobicContact CG2-CB 3.76Å
448	S	72.7	Confident	78.8	Confident	33 Å²	33	49.5 Å²	49.5	23%	0.231	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-60.6	153.7	171.6	66.7	0	0	0	0	110.8	F450 Q451 A452	S448-F450 PolarHBondContact O-N 3.45Å; S448-F450 VanDerWaalsContact O-N 3.08Å; S448-Q451 PolarHBondContact O-N 3.38Å; S448-Q451 PolarHBondContact OG-N 3.32Å; S448-A452 WeakPolarHBondContact O-CB 3.42Å; S448-A452 PolarHBondContact O-N 3.09Å
449	E	67	Low	77.2	Confident	135 Å²	135	54.4 Å²	54.4	63%	0.631	27%	0.273	S	S	*	.	H	α-helix	trans	-56.5	-30.2	178.4	-158.7	-163.8	153.1	0	0	112	K453	E449-K453 WeakPolarHBondContact O-CG 3.33Å; E449-K453 PolarHBondContact O-N 3.01Å; E449-K453 WeakPolarHBondContact OE1-CE 3.24Å; E449-K453 IonicContact OE1-NZ 2.81Å; E449-K453 PolarHBondContact OE1-NZ 3.37Å
450	F	67.7	Low	75.5	Confident	105 Å²	105	58 Å²	58	46%	0.461	29%	0.287	S	S	.	.	H	α-helix	trans	-64.6	-50.7	173.1	173.3	-94.9	0	0	0	112	S448 I454 Q479	S448-F450 PolarHBondContact O-N 3.45Å; S448-F450 VanDerWaalsContact O-N 3.08Å; F450-I454 HydrophobicContact CD1-CD1 3.9Å; F450-I454 HydrophobicContact CE1-CD1 3.37Å; F450-I454 HydrophobicContact CE2-CD1 4.31Å; F450-I454 HydrophobicContact CZ-CD1 3.61Å; F450-I454 WeakPolarHBondContact O-CG1 3.4Å; F450-I454 PolarHBondContact O-N 3.48Å; F450-Q479 HydrophobicContact CD2-CG 3.76Å; F450-Q479 HydrophobicContact CE2-CB 4.2Å; F450-Q479 VanDerWaalsContact CE2-CD 3.48Å; F450-Q479 HydrophobicContact CE2-CG 3.5Å
451	Q	70.5	Confident	73.6	Confident	52 Å²	52	63 Å²	63	24%	0.243	33%	0.329	C	S	.	.	H	α-helix	trans	-72.1	-36.6	-177.7	-175.3	165.9	6.2	0	0	112	V447 S448 K453 I454 E455	V447-Q451 HydrophobicContact CB-CB 4.23Å; V447-Q451 HydrophobicContact CB-CG 4.31Å; V447-Q451 HydrophobicContact CG1-CG 4.13Å; S448-Q451 PolarHBondContact O-N 3.38Å; S448-Q451 PolarHBondContact OG-N 3.32Å; Q451-K453 VanDerWaalsContact C-N 3.33Å; Q451-K453 PolarHBondContact O-N 2.85Å; Q451-I454 WeakPolarHBondContact O-CB 3.21Å; Q451-I454 PolarHBondContact O-N 2.82Å; Q451-I454 VanDerWaalsContact O-N 3.08Å; Q451-E455 PolarHBondContact O-N 2.92Å
452	A	68.6	Low	71.7	Confident	10 Å²	10	65.9 Å²	65.9	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-56.8	-45.6	174.1	0	0	0	0	0	111.9	V447 S448 I454 E455 E456	V447-A452 HydrophobicContact CG2-CB 3.76Å; S448-A452 WeakPolarHBondContact O-CB 3.42Å; S448-A452 PolarHBondContact O-N 3.09Å; A452-I454 VanDerWaalsContact C-N 3.25Å; A452-I454 PolarHBondContact O-N 2.81Å; A452-E455 PolarHBondContact O-N 2.85Å; A452-E456 PolarHBondContact O-N 3.31Å
453	K	68.4	Low	69.9	Low	58 Å²	58	66.3 Å²	66.3	25%	0.252	36%	0.356	S	S	.	.	H	α-helix	trans	-64.8	-27.6	176.7	-74.6	173.7	-174.8	166	0	113.4	E449 Q451 E457 S478	E449-K453 WeakPolarHBondContact O-CG 3.33Å; E449-K453 PolarHBondContact O-N 3.01Å; E449-K453 WeakPolarHBondContact OE1-CE 3.24Å; E449-K453 IonicContact OE1-NZ 2.81Å; E449-K453 PolarHBondContact OE1-NZ 3.37Å; Q451-K453 VanDerWaalsContact C-N 3.33Å; Q451-K453 PolarHBondContact O-N 2.85Å; K453-E457 PolarHBondContact O-N 3.38Å; K453-S478 PolarHBondContact NZ-OG 2.59Å
454	I	68.6	Low	68.7	Low	48 Å²	48	72.1 Å²	72.1	25%	0.246	39%	0.387	C	S	.	.	H	α-helix	trans	-75.1	-43.4	173.7	-65.3	169.4	0	0	0	109.9	F450 Q451 A452 E456 E457 F458	F450-I454 HydrophobicContact CD1-CD1 3.9Å; F450-I454 HydrophobicContact CE1-CD1 3.37Å; F450-I454 HydrophobicContact CE2-CD1 4.31Å; F450-I454 HydrophobicContact CZ-CD1 3.61Å; F450-I454 WeakPolarHBondContact O-CG1 3.4Å; F450-I454 PolarHBondContact O-N 3.48Å; Q451-I454 WeakPolarHBondContact O-CB 3.21Å; Q451-I454 PolarHBondContact O-N 2.82Å; Q451-I454 VanDerWaalsContact O-N 3.08Å; A452-I454 VanDerWaalsContact C-N 3.25Å; A452-I454 PolarHBondContact O-N 2.81Å; I454-E456 VanDerWaalsContact C-N 3.33Å; I454-E456 PolarHBondContact O-N 2.69Å; I454-E457 VanDerWaalsContact O-CB 3.23Å; I454-E457 WeakPolarHBondContact O-CB 3.42Å; I454-E457 PolarHBondContact O-N 3.04Å; I454-E457 VanDerWaalsContact O-N 3.11Å; I454-F458 HydrophobicContact CG2-CD2 4.22Å; I454-F458 HydrophobicContact CG2-CE2 3.84Å; I454-F458 WeakPolarHBondContact O-CD2 3.21Å
455	E	70.1	Confident	68	Low	74 Å²	74	75.9 Å²	75.9	35%	0.346	41%	0.406	S	S	.	.	H	α-helix	trans	-63.4	-38.1	176.7	-70.3	180	-179	0	0	111.7	Q451 A452 E457 F458 N459 R598	Q451-E455 PolarHBondContact O-N 2.92Å; A452-E455 PolarHBondContact O-N 2.85Å; E455-E457 VanDerWaalsContact C-N 3.28Å; E455-E457 PolarHBondContact O-N 3.08Å; E455-F458 PolarHBondContact O-N 3.49Å; E455-N459 PolarHBondContact O-N 3.41Å; E455-R598 IonicContact OE1-NH2 3.09Å; E455-R598 PolarHBondContact OE1-NH2 2.82Å
456	E	67.5	Low	67.3	Low	98 Å²	98	81.6 Å²	81.6	46%	0.458	44%	0.436	S	S	.	.	H	α-helix	trans	-60.2	-32.9	171.5	-77.1	-178.3	178.4	0	0	113.2	A452 I454 F458	A452-E456 PolarHBondContact O-N 3.31Å; I454-E456 VanDerWaalsContact C-N 3.33Å; I454-E456 PolarHBondContact O-N 2.69Å; E456-F458 VanDerWaalsContact C-N 3.26Å; E456-F458 PolarHBondContact O-N 3.03Å
457	E	65.3	Low	66.8	Low	23 Å²	23	84 Å²	84	11%	0.107	44%	0.444	C	S	.	.	H	α-helix	trans	-62	-33.8	176.8	-169.5	179.4	145.3	0	0	111.9	K453 I454 E455 R472 S475	K453-E457 PolarHBondContact O-N 3.38Å; I454-E457 VanDerWaalsContact O-CB 3.23Å; I454-E457 WeakPolarHBondContact O-CB 3.42Å; I454-E457 PolarHBondContact O-N 3.04Å; I454-E457 VanDerWaalsContact O-N 3.11Å; E455-E457 VanDerWaalsContact C-N 3.28Å; E455-E457 PolarHBondContact O-N 3.08Å; E457-R472 WeakPolarHBondContact OE1-CB 3.28Å; E457-R472 WeakPolarHBondContact OE1-CD 3.48Å; E457-R472 VanDerWaalsContact OE1-CG 3.24Å; E457-R472 WeakPolarHBondContact OE1-CG 3.34Å; E457-R472 IonicContact OE1-NE 3.55Å; E457-S475 PolarHBondContact OE2-OG 2.85Å
458	F	63.3	Low	66.4	Low	142 Å²	142	86.3 Å²	86.3	62%	0.623	45%	0.453	S	S	*	.	H	α-helix	trans	-98.4	-14.9	-173.7	-67.8	-73.2	0	0	0	114.8	I454 E455 E456 H460	I454-F458 HydrophobicContact CG2-CD2 4.22Å; I454-F458 HydrophobicContact CG2-CE2 3.84Å; I454-F458 WeakPolarHBondContact O-CD2 3.21Å; E455-F458 PolarHBondContact O-N 3.49Å; E456-F458 VanDerWaalsContact C-N 3.26Å; E456-F458 PolarHBondContact O-N 3.03Å; F458-H460 PolarHBondContact O-N 2.71Å; F458-H460 VanDerWaalsContact O-N 3.16Å
459	N	60	Low	66.6	Low	127 Å²	127	90.4 Å²	90.4	68%	0.679	47%	0.467	S	S	*	.	S	Bend	trans	-73.2	-2.6	-174.8	-85.8	-21.2	0	0	0	114.9	E455	E455-N459 PolarHBondContact O-N 3.41Å
460	H	57.7	Low	67.2	Low	89 Å²	89	88.9 Å²	88.9	41%	0.412	46%	0.462	S	S	.	.			trans	-104.3	83.4	-179.3	-61.1	-61.9	0	0	0	112.5	F458 S462 N463	F458-H460 PolarHBondContact O-N 2.71Å; F458-H460 VanDerWaalsContact O-N 3.16Å; H460-S462 PolarHBondContact O-N 3.32Å; H460-N463 HydrophobicContact CB-CB 4.22Å; H460-N463 WeakPolarHBondContact CB-ND2 3.19Å; H460-N463 PolarHBondContact O-N 3.23Å
461	A	54.5	Low	67.4	Low	114 Å²	114	86.5 Å²	86.5	94%	0.942	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-11.9	178.1	0	0	0	0	0	114.8
462	S	54.5	Low	67.6	Low	108 Å²	108	90.6 Å²	90.6	76%	0.755	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	6.1	-174.8	60.7	0	0	0	0	115.1	H460	H460-S462 PolarHBondContact O-N 3.32Å
463	N	55.4	Low	68.1	Low	35 Å²	35	94.9 Å²	94.9	19%	0.187	49%	0.487	C	S	.	.			trans	-86.4	142.3	-173.6	-73.1	3	0	0	0	112.7	H460 M468	H460-N463 HydrophobicContact CB-CB 4.22Å; H460-N463 WeakPolarHBondContact CB-ND2 3.19Å; H460-N463 PolarHBondContact O-N 3.23Å; N463-M468 HydrophobicContact CB-CG 4.06Å
464	N	68	Low	68.7	Low	123 Å²	123	99.9 Å²	99.9	66%	0.658	51%	0.509	S	S	*	.			trans	-60.5	146.4	172.6	-75.6	-40.7	0	0	0	110.6	L466 E467 M468	N464-L466 PolarHBondContact O-N 3.16Å; N464-L466 VanDerWaalsContact O-N 3.08Å; N464-E467 WeakPolarHBondContact O-CB 3.46Å; N464-E467 PolarHBondContact O-N 3.08Å; N464-M468 PolarHBondContact O-N 2.89Å; N464-M468 VanDerWaalsContact O-N 3.09Å
465	I	76.6	Confident	68.9	Low	145 Å²	145	98.2 Å²	98.2	74%	0.744	50%	0.501	S	S	*	.	H	α-helix	trans	-50	-39.4	179.7	-63.6	168.7	0	0	0	112.3	F469	I465-F469 PolarHBondContact O-N 2.67Å
466	L	75	Confident	69.4	Low	124 Å²	124	99.1 Å²	99.1	65%	0.649	51%	0.505	S	S	*	.	H	α-helix	trans	-67.6	-37.4	-180	-121.2	169.8	0	0	0	112.5	N464 F469 I470	N464-L466 PolarHBondContact O-N 3.16Å; N464-L466 VanDerWaalsContact O-N 3.08Å; L466-F469 PolarHBondContact O-N 3.39Å; L466-I470 HydrophobicContact CD2-CD1 4.3Å; L466-I470 WeakPolarHBondContact O-CG1 3.44Å; L466-I470 PolarHBondContact O-N 2.9Å
467	E	73.1	Confident	69.9	Low	93 Å²	93	100.3 Å²	100.3	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-70.9	-41.7	178	-172	166.5	-165.3	0	0	110.8	N464 F469 I470 Q471	N464-E467 WeakPolarHBondContact O-CB 3.46Å; N464-E467 PolarHBondContact O-N 3.08Å; E467-F469 VanDerWaalsContact C-N 3.28Å; E467-F469 PolarHBondContact O-N 2.81Å; E467-I470 PolarHBondContact O-N 2.91Å; E467-Q471 WeakPolarHBondContact O-CB 3.3Å; E467-Q471 VanDerWaalsContact O-CG 3.3Å; E467-Q471 WeakPolarHBondContact O-CG 3.26Å; E467-Q471 PolarHBondContact O-N 3.45Å
468	M	69.4	Low	70.3	Confident	77 Å²	77	100.9 Å²	100.9	38%	0.379	52%	0.519	S	S	.	.	H	α-helix	trans	-58.9	-39.9	170	-69.5	-156.2	-70.2	0	0	111.7	N463 N464 Q471 R472	N463-M468 HydrophobicContact CB-CG 4.06Å; N464-M468 PolarHBondContact O-N 2.89Å; N464-M468 VanDerWaalsContact O-N 3.09Å; M468-Q471 PolarHBondContact O-N 2.87Å; M468-R472 VanDerWaalsContact O-CB 3.25Å; M468-R472 WeakPolarHBondContact O-CB 3.3Å; M468-R472 PolarHBondContact O-N 2.81Å
469	F	77.4	Confident	70.6	Confident	119 Å²	119	95.6 Å²	95.6	52%	0.522	50%	0.496	S	S	.	.	H	α-helix	trans	-66	-41.4	176.3	-176.6	-99.4	0	0	0	113	I465 L466 E467 R472 L473	I465-F469 PolarHBondContact O-N 2.67Å; L466-F469 PolarHBondContact O-N 3.39Å; E467-F469 VanDerWaalsContact C-N 3.28Å; E467-F469 PolarHBondContact O-N 2.81Å; F469-R472 WeakPolarHBondContact O-CB 3.43Å; F469-R472 PolarHBondContact O-N 3.28Å; F469-L473 HydrophobicContact CD1-CD1 4.05Å; F469-L473 HydrophobicContact CE1-CD1 3.37Å; F469-L473 HydrophobicContact CE1-CG 4.3Å; F469-L473 HydrophobicContact CZ-CD1 3.82Å; F469-L473 HydrophobicContact CZ-CG 4.41Å; F469-L473 PolarHBondContact O-N 3.06Å
470	I	78.8	Confident	71.4	Confident	103 Å²	103	93.9 Å²	93.9	53%	0.528	49%	0.486	S	S	.	.	H	α-helix	trans	-66.8	-43	176.3	-69.1	165.9	0	0	0	110.6	L466 E467 R472 L473 K474	L466-I470 HydrophobicContact CD2-CD1 4.3Å; L466-I470 WeakPolarHBondContact O-CG1 3.44Å; L466-I470 PolarHBondContact O-N 2.9Å; E467-I470 PolarHBondContact O-N 2.91Å; I470-R472 VanDerWaalsContact C-N 3.28Å; I470-R472 PolarHBondContact O-N 3.11Å; I470-L473 PolarHBondContact O-N 2.82Å; I470-K474 WeakPolarHBondContact O-CB 3.49Å; I470-K474 PolarHBondContact O-N 2.84Å
471	Q	71.9	Confident	72.5	Confident	54 Å²	54	93 Å²	93	25%	0.252	49%	0.487	S	S	.	.	H	α-helix	trans	-59.9	-41.6	174.1	-74	-179.4	-5.7	0	0	110.8	E467 M468 K474 S475	E467-Q471 WeakPolarHBondContact O-CB 3.3Å; E467-Q471 VanDerWaalsContact O-CG 3.3Å; E467-Q471 WeakPolarHBondContact O-CG 3.26Å; E467-Q471 PolarHBondContact O-N 3.45Å; M468-Q471 PolarHBondContact O-N 2.87Å; Q471-K474 PolarHBondContact O-N 2.93Å; Q471-S475 WeakPolarHBondContact O-CB 3.21Å; Q471-S475 PolarHBondContact O-N 2.93Å
472	R	76.3	Confident	73.2	Confident	138 Å²	138	90.9 Å²	90.9	52%	0.521	46%	0.462	S	S	.	.	H	α-helix	trans	-62	-46.7	173.4	-172.6	170.6	-153.6	-170.5	3.8	112.7	E457 M468 F469 I470 K474 S475 Q476	E457-R472 WeakPolarHBondContact OE1-CB 3.28Å; E457-R472 WeakPolarHBondContact OE1-CD 3.48Å; E457-R472 VanDerWaalsContact OE1-CG 3.24Å; E457-R472 WeakPolarHBondContact OE1-CG 3.34Å; E457-R472 IonicContact OE1-NE 3.55Å; M468-R472 VanDerWaalsContact O-CB 3.25Å; M468-R472 WeakPolarHBondContact O-CB 3.3Å; M468-R472 PolarHBondContact O-N 2.81Å; F469-R472 WeakPolarHBondContact O-CB 3.43Å; F469-R472 PolarHBondContact O-N 3.28Å; I470-R472 VanDerWaalsContact C-N 3.28Å; I470-R472 PolarHBondContact O-N 3.11Å; R472-K474 VanDerWaalsContact C-N 3.29Å; R472-K474 PolarHBondContact O-N 2.75Å; R472-S475 PolarHBondContact O-N 2.89Å; R472-S475 PolarHBondContact O-OG 2.83Å; R472-S475 VanDerWaalsContact O-OG 3.09Å; R472-Q476 HydrophobicContact CG-CG 4.29Å; R472-Q476 WeakPolarHBondContact O-CB 3.17Å; R472-Q476 WeakPolarHBondContact O-CG 3.45Å; R472-Q476 PolarHBondContact O-N 2.87Å
473	L	79.2	Confident	74.1	Confident	100 Å²	100	92.7 Å²	92.7	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-61.1	-39.9	175.7	-102.7	166	0	0	0	111.7	F469 I470 M477	F469-L473 HydrophobicContact CD1-CD1 4.05Å; F469-L473 HydrophobicContact CE1-CD1 3.37Å; F469-L473 HydrophobicContact CE1-CG 4.3Å; F469-L473 HydrophobicContact CZ-CD1 3.82Å; F469-L473 HydrophobicContact CZ-CG 4.41Å; F469-L473 PolarHBondContact O-N 3.06Å; I470-L473 PolarHBondContact O-N 2.82Å; L473-M477 VanDerWaalsContact O-CB 3.24Å; L473-M477 WeakPolarHBondContact O-CB 3.38Å; L473-M477 PolarHBondContact O-N 3.35Å
474	K	79.7	Confident	75.1	Confident	164 Å²	164	93.5 Å²	93.5	71%	0.713	46%	0.459	S	S	*	.	H	α-helix	trans	-65.9	-41.2	175.7	-170.8	-177.7	177	-171.8	0	111.5	I470 Q471 R472 M477 S478	I470-K474 WeakPolarHBondContact O-CB 3.49Å; I470-K474 PolarHBondContact O-N 2.84Å; Q471-K474 PolarHBondContact O-N 2.93Å; R472-K474 VanDerWaalsContact C-N 3.29Å; R472-K474 PolarHBondContact O-N 2.75Å; K474-M477 PolarHBondContact O-N 3.45Å; K474-S478 WeakPolarHBondContact O-CB 3.37Å; K474-S478 PolarHBondContact O-N 3.02Å
475	S	72.7	Confident	75.2	Confident	13 Å²	13	96.1 Å²	96.1	9%	0.091	46%	0.46	C	S	.	.	H	α-helix	trans	-63.6	-51	175.6	92.7	0	0	0	0	109.7	E457 Q471 R472 M477 S478 Q479	E457-S475 PolarHBondContact OE2-OG 2.85Å; Q471-S475 WeakPolarHBondContact O-CB 3.21Å; Q471-S475 PolarHBondContact O-N 2.93Å; R472-S475 PolarHBondContact O-N 2.89Å; R472-S475 PolarHBondContact O-OG 2.83Å; R472-S475 VanDerWaalsContact O-OG 3.09Å; S475-M477 PolarHBondContact O-N 2.94Å; S475-S478 CarbonylContact O-C 3.54Å; S475-S478 WeakPolarHBondContact O-CA 3.37Å; S475-S478 WeakPolarHBondContact O-CB 3.1Å; S475-S478 PolarHBondContact O-N 3.35Å; S475-S478 VanDerWaalsContact O-N 3.12Å; S475-Q479 WeakPolarHBondContact O-CG 3.35Å; S475-Q479 PolarHBondContact O-N 3.13Å
476	Q	80.3	Confident	74.7	Confident	93 Å²	93	94.4 Å²	94.4	44%	0.435	45%	0.448	S	S	.	.	H	α-helix	trans	-59.3	-40.4	176.8	-68.4	-68.6	-40.9	0	0	112.8	R472 Q479 L480	R472-Q476 HydrophobicContact CG-CG 4.29Å; R472-Q476 WeakPolarHBondContact O-CB 3.17Å; R472-Q476 WeakPolarHBondContact O-CG 3.45Å; R472-Q476 PolarHBondContact O-N 2.87Å; Q476-Q479 VanDerWaalsContact NE2-OE1 3.15Å; Q476-Q479 WeakPolarHBondContact O-CB 3.45Å; Q476-Q479 PolarHBondContact O-N 3.03Å; Q476-L480 PolarHBondContact O-N 3.32Å
477	M	79.2	Confident	74.3	Confident	123 Å²	123	94.2 Å²	94.2	61%	0.606	44%	0.439	S	S	*	.	H	α-helix	trans	-67.6	-41.2	175.8	-168.1	63.5	156	0	0	111.2	L473 K474 S475 Q479 L480 V481	L473-M477 VanDerWaalsContact O-CB 3.24Å; L473-M477 WeakPolarHBondContact O-CB 3.38Å; L473-M477 PolarHBondContact O-N 3.35Å; K474-M477 PolarHBondContact O-N 3.45Å; S475-M477 PolarHBondContact O-N 2.94Å; M477-Q479 VanDerWaalsContact C-N 3.28Å; M477-Q479 PolarHBondContact O-N 2.73Å; M477-L480 WeakPolarHBondContact O-CB 3.23Å; M477-L480 PolarHBondContact O-N 2.68Å; M477-L480 HydrophobicContact SD-CD2 4.04Å; M477-V481 VanDerWaalsContact O-CG2 3.31Å; M477-V481 WeakPolarHBondContact O-CG2 3.24Å; M477-V481 PolarHBondContact O-N 3.1Å
478	S	72.5	Confident	74.3	Confident	35 Å²	35	95.4 Å²	95.4	25%	0.245	45%	0.447	C	S	.	.	H	α-helix	trans	-62	-37.3	171.1	-176.7	0	0	0	0	111.6	K453 K474 S475 V481 V482	K453-S478 PolarHBondContact NZ-OG 2.59Å; K474-S478 WeakPolarHBondContact O-CB 3.37Å; K474-S478 PolarHBondContact O-N 3.02Å; S475-S478 CarbonylContact O-C 3.54Å; S475-S478 WeakPolarHBondContact O-CA 3.37Å; S475-S478 WeakPolarHBondContact O-CB 3.1Å; S475-S478 PolarHBondContact O-N 3.35Å; S475-S478 VanDerWaalsContact O-N 3.12Å; S478-V481 PolarHBondContact O-N 3.42Å; S478-V482 WeakPolarHBondContact O-CG2 3.43Å; S478-V482 PolarHBondContact O-N 3.34Å
479	Q	70.3	Confident	73.7	Confident	30 Å²	30	100.9 Å²	100.9	14%	0.14	47%	0.465	C	S	.	.	H	α-helix	trans	-65.5	-43.3	176.6	-68.7	171.4	13	0	0	111	F450 S475 Q476 M477 V481 V482 W483	F450-Q479 HydrophobicContact CD2-CG 3.76Å; F450-Q479 HydrophobicContact CE2-CB 4.2Å; F450-Q479 VanDerWaalsContact CE2-CD 3.48Å; F450-Q479 HydrophobicContact CE2-CG 3.5Å; S475-Q479 WeakPolarHBondContact O-CG 3.35Å; S475-Q479 PolarHBondContact O-N 3.13Å; Q476-Q479 VanDerWaalsContact NE2-OE1 3.15Å; Q476-Q479 WeakPolarHBondContact O-CB 3.45Å; Q476-Q479 PolarHBondContact O-N 3.03Å; M477-Q479 VanDerWaalsContact C-N 3.28Å; M477-Q479 PolarHBondContact O-N 2.73Å; Q479-V481 VanDerWaalsContact C-N 3.28Å; Q479-V481 PolarHBondContact O-N 2.64Å; Q479-V482 PolarHBondContact O-N 2.85Å; Q479-W483 VanDerWaalsContact O-CB 3.28Å; Q479-W483 WeakPolarHBondContact O-CB 3.1Å; Q479-W483 PolarHBondContact O-N 3.49Å
480	L	77.5	Confident	73	Confident	91 Å²	91	98.2 Å²	98.2	48%	0.476	46%	0.456	S	S	.	.	H	α-helix	trans	-58.9	-40.7	172.6	-170.4	85.7	0	0	0	111	Q476 M477 T484	Q476-L480 PolarHBondContact O-N 3.32Å; M477-L480 WeakPolarHBondContact O-CB 3.23Å; M477-L480 PolarHBondContact O-N 2.68Å; M477-L480 HydrophobicContact SD-CD2 4.04Å; L480-T484 HydrophobicContact CG-CG2 4.48Å; L480-T484 WeakPolarHBondContact O-CB 3.44Å; L480-T484 VanDerWaalsContact O-CG2 3.22Å; L480-T484 WeakPolarHBondContact O-CG2 3.24Å; L480-T484 PolarHBondContact O-N 2.86Å; L480-T484 PolarHBondContact O-OG1 2.79Å
481	V	79.5	Confident	72.3	Confident	71 Å²	71	97 Å²	97	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-65.5	-42.5	176.7	172.1	0	0	0	0	112	M477 S478 Q479 T484 R485	M477-V481 VanDerWaalsContact O-CG2 3.31Å; M477-V481 WeakPolarHBondContact O-CG2 3.24Å; M477-V481 PolarHBondContact O-N 3.1Å; S478-V481 PolarHBondContact O-N 3.42Å; Q479-V481 VanDerWaalsContact C-N 3.28Å; Q479-V481 PolarHBondContact O-N 2.64Å; V481-T484 VanDerWaalsContact CA-OG1 3.31Å; V481-T484 WeakPolarHBondContact CA-OG1 3.16Å; V481-T484 PolarHBondContact O-OG1 2.87Å; V481-R485 WeakPolarHBondContact O-CB 3.34Å; V481-R485 PolarHBondContact O-N 3.04Å
482	V	68.9	Low	71.7	Confident	69 Å²	69	98 Å²	98	42%	0.418	46%	0.461	S	S	.	.	H	α-helix	trans	-66.4	-45.6	176.2	172.9	0	0	0	0	110.7	S478 Q479 T484 R485 H486	S478-V482 WeakPolarHBondContact O-CG2 3.43Å; S478-V482 PolarHBondContact O-N 3.34Å; Q479-V482 PolarHBondContact O-N 2.85Å; V482-T484 PolarHBondContact O-N 3.37Å; V482-R485 PolarHBondContact O-N 2.69Å; V482-H486 WeakPolarHBondContact O-CB 3.41Å; V482-H486 PolarHBondContact O-N 2.92Å
483	W	75.1	Confident	70.5	Confident	146 Å²	146	96.6 Å²	96.6	55%	0.553	46%	0.464	S	S	*	.	H	α-helix	trans	-61.6	-44.4	177.7	-179.1	81.7	0	0	0	111.8	Q479 H486 W487	Q479-W483 VanDerWaalsContact O-CB 3.28Å; Q479-W483 WeakPolarHBondContact O-CB 3.1Å; Q479-W483 PolarHBondContact O-N 3.49Å; W483-H486 PolarHBondContact O-N 2.96Å; W483-W487 AromaticContact CD1-CD1 3.8Å; W483-W487 AromaticContact CD1-NE1 3.92Å; W483-W487 AromaticContact CD2-CD1 3.67Å; W483-W487 AromaticContact CE2-CD1 3.24Å; W483-W487 AromaticContact CE2-NE1 3.17Å; W483-W487 AromaticContact CZ2-CD1 3.58Å; W483-W487 AromaticContact CZ2-CE2 3.99Å; W483-W487 HydrophobicContact CZ2-CG 4.39Å; W483-W487 AromaticContact CZ2-NE1 3.29Å; W483-W487 VanDerWaalsContact CZ2-NE1 3.29Å; W483-W487 AromaticContact NE1-CD1 3.37Å; W483-W487 AromaticContact NE1-NE1 3.1Å; W483-W487 WeakPolarHBondContact O-CB 3.45Å; W483-W487 PolarHBondContact O-N 3.12Å
484	T	75.6	Confident	69.2	Low	52 Å²	52	96.5 Å²	96.5	32%	0.319	46%	0.463	S	S	.	.	H	α-helix	trans	-64.7	-41.4	175.3	49.6	0	0	0	0	111.8	L480 V481 V482 W487 I488	L480-T484 HydrophobicContact CG-CG2 4.48Å; L480-T484 WeakPolarHBondContact O-CB 3.44Å; L480-T484 VanDerWaalsContact O-CG2 3.22Å; L480-T484 WeakPolarHBondContact O-CG2 3.24Å; L480-T484 PolarHBondContact O-N 2.86Å; L480-T484 PolarHBondContact O-OG1 2.79Å; V481-T484 VanDerWaalsContact CA-OG1 3.31Å; V481-T484 WeakPolarHBondContact CA-OG1 3.16Å; V481-T484 PolarHBondContact O-OG1 2.87Å; V482-T484 PolarHBondContact O-N 3.37Å; T484-W487 PolarHBondContact O-N 3.28Å; T484-I488 WeakPolarHBondContact O-CB 3.34Å; T484-I488 WeakPolarHBondContact O-CD1 3.41Å; T484-I488 WeakPolarHBondContact O-CG1 3.34Å; T484-I488 PolarHBondContact O-N 2.96Å
485	R	70.7	Confident	68	Low	179 Å²	179	95.2 Å²	95.2	68%	0.675	46%	0.458	S	S	*	.	H	α-helix	trans	-58.6	-47.7	171.5	-93.5	-176.6	171.8	170.3	-1.8	112.3	V481 V482 W487 I488 Y489	V481-R485 WeakPolarHBondContact O-CB 3.34Å; V481-R485 PolarHBondContact O-N 3.04Å; V482-R485 PolarHBondContact O-N 2.69Å; R485-W487 PolarHBondContact O-N 3.39Å; R485-I488 PolarHBondContact O-N 3.23Å; R485-Y489 PolarHBondContact O-N 3.37Å
486	H	66.2	Low	66.7	Low	109 Å²	109	101.1 Å²	101.1	51%	0.505	49%	0.486	S	S	.	.	H	α-helix	trans	-60.4	-44.8	178.8	-177.5	85.9	0	0	0	111.3	V482 W483 Y489 N490	V482-H486 WeakPolarHBondContact O-CB 3.41Å; V482-H486 PolarHBondContact O-N 2.92Å; W483-H486 PolarHBondContact O-N 2.96Å; H486-Y489 PolarHBondContact O-N 3.17Å; H486-N490 PolarHBondContact CE1-ND2 2.83Å; H486-N490 PolarHBondContact ND1-ND2 3.16Å; H486-N490 PolarHBondContact NE2-ND2 3.29Å; H486-N490 VanDerWaalsContact O-CB 3.31Å; H486-N490 WeakPolarHBondContact O-CB 3.09Å; H486-N490 PolarHBondContact O-N 3.32Å; H486-N490 PolarHBondContact O-ND2 2.91Å
487	W	66.9	Low	65	Low	120 Å²	120	99.7 Å²	99.7	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-64.7	-43.8	174.4	-90.6	91.2	0	0	0	112.9	W483 T484 R485 Y489 N490 I491	W483-W487 AromaticContact CD1-CD1 3.8Å; W483-W487 AromaticContact CD1-NE1 3.92Å; W483-W487 AromaticContact CD2-CD1 3.67Å; W483-W487 AromaticContact CE2-CD1 3.24Å; W483-W487 AromaticContact CE2-NE1 3.17Å; W483-W487 AromaticContact CZ2-CD1 3.58Å; W483-W487 AromaticContact CZ2-CE2 3.99Å; W483-W487 HydrophobicContact CZ2-CG 4.39Å; W483-W487 AromaticContact CZ2-NE1 3.29Å; W483-W487 VanDerWaalsContact CZ2-NE1 3.29Å; W483-W487 AromaticContact NE1-CD1 3.37Å; W483-W487 AromaticContact NE1-NE1 3.1Å; W483-W487 WeakPolarHBondContact O-CB 3.45Å; W483-W487 PolarHBondContact O-N 3.12Å; T484-W487 PolarHBondContact O-N 3.28Å; R485-W487 PolarHBondContact O-N 3.39Å; W487-Y489 VanDerWaalsContact C-N 3.29Å; W487-Y489 PolarHBondContact O-N 3.27Å; W487-N490 PolarHBondContact O-N 3.1Å; W487-I491 HydrophobicContact CE3-CD1 3.98Å; W487-I491 HydrophobicContact CE3-CG1 3.76Å; W487-I491 HydrophobicContact CZ3-CG1 4.31Å; W487-I491 WeakPolarHBondContact O-CB 3.47Å; W487-I491 WeakPolarHBondContact O-CD1 3.41Å; W487-I491 WeakPolarHBondContact O-CG1 3.41Å; W487-I491 PolarHBondContact O-N 3.16Å
488	I	71.5	Confident	63.5	Low	118 Å²	118	98.5 Å²	98.5	61%	0.605	49%	0.485	S	S	*	.	H	α-helix	trans	-60.6	-39.7	177.4	-71.3	162.7	0	0	0	111	T484 R485 P492	T484-I488 WeakPolarHBondContact O-CB 3.34Å; T484-I488 WeakPolarHBondContact O-CD1 3.41Å; T484-I488 WeakPolarHBondContact O-CG1 3.34Å; T484-I488 PolarHBondContact O-N 2.96Å; R485-I488 PolarHBondContact O-N 3.23Å; I488-P492 VanDerWaalsContact O-CD 3.31Å; I488-P492 WeakPolarHBondContact O-CD 3.42Å
489	Y	58	Low	62.6	Low	191 Å²	191	101.5 Å²	101.5	75%	0.749	50%	0.501	S	S	*	.	H	α-helix	trans	-73.3	-35	176.9	-103.9	-87.3	0	0	0	113.5	R485 H486 W487 P492	R485-Y489 PolarHBondContact O-N 3.37Å; H486-Y489 PolarHBondContact O-N 3.17Å; W487-Y489 VanDerWaalsContact C-N 3.29Å; W487-Y489 PolarHBondContact O-N 3.27Å; Y489-P492 WeakPolarHBondContact O-CD 3.43Å
490	N	62.4	Low	61.2	Low	63 Å²	63	104.4 Å²	104.4	34%	0.337	53%	0.525	S	S	.	.	H	α-helix	trans	-92.2	-20.4	-174.9	-77.9	-36.1	0	0	0	115	H486 W487 N493 L494	H486-N490 PolarHBondContact CE1-ND2 2.83Å; H486-N490 PolarHBondContact ND1-ND2 3.16Å; H486-N490 PolarHBondContact NE2-ND2 3.29Å; H486-N490 VanDerWaalsContact O-CB 3.31Å; H486-N490 WeakPolarHBondContact O-CB 3.09Å; H486-N490 PolarHBondContact O-N 3.32Å; H486-N490 PolarHBondContact O-ND2 2.91Å; W487-N490 PolarHBondContact O-N 3.1Å; N490-N493 PolarHBondContact O-N 2.83Å; N490-N493 VanDerWaalsContact O-N 3.12Å; N490-L494 PolarHBondContact O-N 2.77Å
491	I	64.3	Low	59.2	Low	79 Å²	79	103.9 Å²	103.9	41%	0.405	53%	0.529	S	S	.	.	H	α-helix	trans	-54.9	-46.4	175.5	-77.8	162.9	0	0	0	112.1	W487 N493 L494 F495	W487-I491 HydrophobicContact CE3-CD1 3.98Å; W487-I491 HydrophobicContact CE3-CG1 3.76Å; W487-I491 HydrophobicContact CZ3-CG1 4.31Å; W487-I491 WeakPolarHBondContact O-CB 3.47Å; W487-I491 WeakPolarHBondContact O-CD1 3.41Å; W487-I491 WeakPolarHBondContact O-CG1 3.41Å; W487-I491 PolarHBondContact O-N 3.16Å; I491-N493 VanDerWaalsContact C-N 3.28Å; I491-N493 PolarHBondContact O-N 2.84Å; I491-L494 PolarHBondContact O-N 3.03Å; I491-F495 WeakPolarHBondContact O-CB 3.45Å; I491-F495 PolarHBondContact O-N 2.91Å
492	P	58.6	Low	57	Low	73 Å²	73	108.9 Å²	108.9	47%	0.474	55%	0.545	S	S	.	.	H	α-helix	trans	-58.3	-40.2	176.8	-22.9	32.2	0	0	0	112.7	I488 Y489 M496	I488-P492 VanDerWaalsContact O-CD 3.31Å; I488-P492 WeakPolarHBondContact O-CD 3.42Å; Y489-P492 WeakPolarHBondContact O-CD 3.43Å; P492-M496 WeakPolarHBondContact O-CB 3.42Å; P492-M496 WeakPolarHBondContact O-CG 3.32Å; P492-M496 PolarHBondContact O-N 2.86Å
493	N	51.9	Low	55.2	Low	109 Å²	109	110.9 Å²	110.9	58%	0.583	56%	0.559	S	S	*	*	H	α-helix	trans	-69.4	-41.5	178.7	-72.1	-16.5	0	0	0	111.9	N490 I491 M496 A497	N490-N493 PolarHBondContact O-N 2.83Å; N490-N493 VanDerWaalsContact O-N 3.12Å; I491-N493 VanDerWaalsContact C-N 3.28Å; I491-N493 PolarHBondContact O-N 2.84Å; N493-M496 PolarHBondContact O-N 3.05Å; N493-A497 PolarHBondContact O-N 2.71Å
494	L	51.7	Low	53	Low	99 Å²	99	113.2 Å²	113.2	52%	0.518	57%	0.574	S	S	.	*	H	α-helix	trans	-66.1	-40.6	176.3	-157.1	100.7	0	0	0	111.1	N490 I491 A497 I498	N490-L494 PolarHBondContact O-N 2.77Å; I491-L494 PolarHBondContact O-N 3.03Å; L494-A497 PolarHBondContact O-N 3.37Å; L494-I498 HydrophobicContact CD2-CD1 3.92Å; L494-I498 HydrophobicContact CG-CD1 4.25Å; L494-I498 VanDerWaalsContact O-CG1 3.3Å; L494-I498 WeakPolarHBondContact O-CG1 3.32Å; L494-I498 PolarHBondContact O-N 2.81Å
495	F	54.6	Low	50.6	Low	137 Å²	137	119.9 Å²	119.9	60%	0.601	60%	0.599	S	S	*	*	H	α-helix	trans	-65	-40	176	-127.9	-90.4	0	0	0	111.4	I491 I498 V499	I491-F495 WeakPolarHBondContact O-CB 3.45Å; I491-F495 PolarHBondContact O-N 2.91Å; F495-I498 PolarHBondContact O-N 2.83Å; F495-V499 HydrophobicContact CD1-CG2 3.76Å; F495-V499 HydrophobicContact CE1-CG2 4.15Å; F495-V499 VanDerWaalsContact O-CB 3.28Å; F495-V499 WeakPolarHBondContact O-CB 3.39Å; F495-V499 WeakPolarHBondContact O-CG2 3.33Å; F495-V499 PolarHBondContact O-N 2.78Å
496	M	46.1	Very low	48.5	Very low	137 Å²	137	120.3 Å²	120.3	68%	0.675	61%	0.606	S	S	*	*	H	α-helix	trans	-65.5	-38	173.9	-76.1	-70.4	-91.2	0	0	112.3	P492 N493 S500	P492-M496 WeakPolarHBondContact O-CB 3.42Å; P492-M496 WeakPolarHBondContact O-CG 3.32Å; P492-M496 PolarHBondContact O-N 2.86Å; N493-M496 PolarHBondContact O-N 3.05Å; M496-S500 VanDerWaalsContact O-CB 3.28Å; M496-S500 WeakPolarHBondContact O-CB 3.44Å; M496-S500 PolarHBondContact O-N 2.73Å; M496-S500 PolarHBondContact O-OG 2.7Å
497	A	43.3	Very low	46.5	Very low	62 Å²	62	124 Å²	124	51%	0.512	62%	0.623	S	S	.	*	H	α-helix	trans	-64.2	-40.9	173.8	0	0	0	0	0	112	N493 L494 S500	N493-A497 PolarHBondContact O-N 2.71Å; L494-A497 PolarHBondContact O-N 3.37Å; A497-S500 PolarHBondContact O-OG 3.25Å
498	I	48.6	Very low	44.6	Very low	98 Å²	98	123.4 Å²	123.4	50%	0.503	64%	0.637	S	S	.	*	H	α-helix	trans	-72.4	-44.6	177.9	-65.8	165.5	0	0	0	111.1	L494 F495 S500 S501	L494-I498 HydrophobicContact CD2-CD1 3.92Å; L494-I498 HydrophobicContact CG-CD1 4.25Å; L494-I498 VanDerWaalsContact O-CG1 3.3Å; L494-I498 WeakPolarHBondContact O-CG1 3.32Å; L494-I498 PolarHBondContact O-N 2.81Å; F495-I498 PolarHBondContact O-N 2.83Å; I498-S500 VanDerWaalsContact C-N 3.32Å; I498-S500 PolarHBondContact O-N 2.78Å; I498-S501 WeakPolarHBondContact O-CB 3.44Å; I498-S501 PolarHBondContact O-N 2.86Å; I498-S501 VanDerWaalsContact O-N 3.1Å; I498-S501 PolarHBondContact O-OG 2.85Å
499	V	52.8	Low	42.4	Very low	98 Å²	98	122.8 Å²	122.8	59%	0.594	64%	0.643	S	S	*	*	H	α-helix	trans	-70.4	-27.6	-178.3	173.5	0	0	0	0	112.2	F495 S501	F495-V499 HydrophobicContact CD1-CG2 3.76Å; F495-V499 HydrophobicContact CE1-CG2 4.15Å; F495-V499 VanDerWaalsContact O-CB 3.28Å; F495-V499 WeakPolarHBondContact O-CB 3.39Å; F495-V499 WeakPolarHBondContact O-CG2 3.33Å; F495-V499 PolarHBondContact O-N 2.78Å; V499-S501 VanDerWaalsContact C-N 3.26Å; V499-S501 PolarHBondContact O-N 3.2Å
500	S	41.4	Very low	41	Very low	92 Å²	92	120.9 Å²	120.9	64%	0.643	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-11.4	172.3	58.5	0	0	0	0	113.7	M496 A497 I498 K502	M496-S500 VanDerWaalsContact O-CB 3.28Å; M496-S500 WeakPolarHBondContact O-CB 3.44Å; M496-S500 PolarHBondContact O-N 2.73Å; M496-S500 PolarHBondContact O-OG 2.7Å; A497-S500 PolarHBondContact O-OG 3.25Å; I498-S500 VanDerWaalsContact C-N 3.32Å; I498-S500 PolarHBondContact O-N 2.78Å; S500-K502 PolarHBondContact O-N 2.86Å
501	S	35.9	Very low	39.1	Very low	79 Å²	79	121.2 Å²	121.2	55%	0.552	66%	0.664	S	S	*	*	S	Bend	trans	-79.4	84.6	169.2	75.5	0	0	0	0	110.4	I498 V499 P503	I498-S501 WeakPolarHBondContact O-CB 3.44Å; I498-S501 PolarHBondContact O-N 2.86Å; I498-S501 VanDerWaalsContact O-N 3.1Å; I498-S501 PolarHBondContact O-OG 2.85Å; V499-S501 VanDerWaalsContact C-N 3.26Å; V499-S501 PolarHBondContact O-N 3.2Å; S501-P503 WeakPolarHBondContact O-CD 3.39Å
502	K	32	Very low	37.3	Very low	177 Å²	177	125 Å²	125	77%	0.77	69%	0.685	S	S	*	*			trans	-62.1	123.9	173.4	-83	-175.7	177.9	175.7	0	110.1	S500 F504	S500-K502 PolarHBondContact O-N 2.86Å; K502-F504 PolarHBondContact O-N 2.88Å
503	P	31.8	Very low	35.6	Very low	111 Å²	111	130.2 Å²	130.2	72%	0.721	71%	0.708	S	S	*	*			trans	-75.1	109.2	177.5	29.6	-30.7	0	0	0	109.1	S501 F505	S501-P503 WeakPolarHBondContact O-CD 3.39Å; P503-F505 PolarHBondContact O-N 3.14Å
504	F	29.1	Very low	34.5	Very low	195 Å²	195	129.6 Å²	129.6	86%	0.855	71%	0.712	S	S	*	*			trans	-76.2	68.4	179.9	-117.1	-91.1	0	0	0	111	K502	K502-F504 PolarHBondContact O-N 2.88Å
505	F	25.4	Very low	33.4	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.842	73%	0.727	S	S	*	*			trans	-97.2	82.4	162.5	-86.5	-82.5	0	0	0	108.7	P503	P503-F505 PolarHBondContact O-N 3.14Å
506	K	25.6	Very low	31.8	Very low	188 Å²	188	139.8 Å²	139.8	82%	0.817	75%	0.745	S	S	*	*			trans	-112.2	98.9	165.5	-125.3	178.6	-175.9	-178.7	0	108.3	S508	K506-S508 PolarHBondContact O-N 3.02Å
507	H	24.8	Very low	30.8	Very low	186 Å²	186	144.3 Å²	144.3	86%	0.861	76%	0.755	S	S	*	*			trans	-51.5	109.4	161.8	-87.8	-80.4	0	0	0	108.8
508	S	26.5	Very low	29.8	Very low	108 Å²	108	147.4 Å²	147.4	76%	0.755	77%	0.767	S	S	*	*			trans	-120.6	87.4	159.7	177	0	0	0	0	106.8	K506 N510	K506-S508 PolarHBondContact O-N 3.02Å; S508-N510 PolarHBondContact O-N 2.8Å
509	S	24.9	Very low	28.8	Very low	104 Å²	104	150 Å²	150	73%	0.727	78%	0.781	S	S	*	*			trans	-60.3	108.4	158.5	50	0	0	0	0	108.4
510	N	28.9	Very low	27.4	Very low	152 Å²	152	151 Å²	151	81%	0.813	79%	0.789	S	S	*	*			trans	-165.1	118.5	144.4	-94	-15.2	0	0	0	107.3	S508	S508-N510 PolarHBondContact O-N 2.8Å
511	G	23.2	Very low	26.6	Very low	70 Å²	70	151.3 Å²	151.3	72%	0.722	79%	0.792	S	S	*	*			trans	-63.9	139.7	173.1	0	0	0	0	0	110.4
512	D	26.8	Very low	26.3	Very low	159 Å²	159	152.8 Å²	152.8	85%	0.85	80%	0.802	S	S	*	*				-168.9	107.8	115.1	-100.2	-21.9	0	0	0	109.2	S514	D512-S514 PolarHBondContact O-N 2.85Å
513	L	23.1	Very low	25.9	Very low	181 Å²	181	149.6 Å²	149.6	95%	0.948	80%	0.802	S	S	*	*			trans	-66.3	101.2	158	-88.6	107.6	0	0	0	107.9
514	S	27.2	Very low	25.7	Very low	96 Å²	96	150.4 Å²	150.4	67%	0.671	81%	0.807	S	S	*	*			trans	-166.9	143.6	143.7	61.6	0	0	0	0	112.8	D512	D512-S514 PolarHBondContact O-N 2.85Å
515	K	29.2	Very low	25.5	Very low	194 Å²	194	145.9 Å²	145.9	84%	0.843	80%	0.8	S	S	*	*			trans	84.2	70.5	164.9	-59	177.1	-177.6	172.7	0	117.6	R517	K515-R517 PolarHBondContact O-N 2.99Å
516	R	20.3	Very low	25.3	Very low	256 Å²	256	145.1 Å²	145.1	97%	0.966	80%	0.803	S	S	*	*				-56.8	112	128	-109.2	179.5	-177.4	172	1.1	108.4
517	R	26	Very low	25.3	Very low	233 Å²	233	144.3 Å²	144.3	88%	0.879	80%	0.802	S	S	*	*			trans	-149.4	117.1	151.2	-156.6	174.9	-81.7	173.7	-6.2	109.8	K515	K515-R517 PolarHBondContact O-N 2.99Å
518	V	23	Very low	25.2	Very low	127 Å²	127	143.1 Å²	143.1	77%	0.77	80%	0.803	S	S	*	*			trans	-59.2	133.4	174.9	174.9	0	0	0	0	110.2
519	L	27.3	Very low	25.1	Very low	153 Å²	153	148.8 Å²	148.8	80%	0.801	81%	0.809	S	S	*	*			trans	-159.8	112.6	151.9	-104.3	150.3	0	0	0	108.4
520	P	23.7	Very low	25	Very low	118 Å²	118	148.6 Å²	148.6	77%	0.766	81%	0.808	S	S	*	*			trans	-91.4	113	175.2	32.8	-25	0	0	0	108.9
521	S	25.2	Very low	24.7	Very low	99 Å²	99	147.4 Å²	147.4	69%	0.692	81%	0.811	S	S	*	*			trans	-159.5	149.3	168.3	59	0	0	0	0	111.1
522	S	28.3	Very low	24.8	Very low	110 Å²	110	149 Å²	149	77%	0.769	81%	0.811	S	S	*	*			trans	83.9	97	174.3	75.8	0	0	0	0	117.3
523	S	22.9	Very low	24.6	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	81%	0.809	S	S	*	*			trans	-25.6	124.8	149.4	48.7	0	0	0	0	114.6	S525	S523-S525 PolarHBondContact O-N 2.84Å
524	P	28.2	Very low	24.6	Very low	129 Å²	129	145.3 Å²	145.3	84%	0.838	80%	0.799	S	S	*	*			trans	-78.3	115.6	172.7	30.7	-28.9	0	0	0	109.4
525	S	24.9	Very low	24.4	Very low	100 Å²	100	146.2 Å²	146.2	70%	0.699	81%	0.805	S	S	*	*			trans	-57.6	136.1	164.4	48.9	0	0	0	0	111	S523 Q527	S523-S525 PolarHBondContact O-N 2.84Å; S525-Q527 PolarHBondContact O-N 2.85Å
526	L	22.5	Very low	24.1	Very low	175 Å²	175	142 Å²	142	92%	0.916	80%	0.799	S	S	*	*			trans	-34	111.7	166.6	-67.8	149.1	0	0	0	111.7
527	Q	25	Very low	24.1	Very low	171 Å²	171	138 Å²	138	80%	0.799	79%	0.789	S	S	*	*			trans	-106.6	122.7	163.7	-89.5	-178.6	-7.5	0	0	108.9	S525 Y529	S525-Q527 PolarHBondContact O-N 2.85Å; Q527-Y529 PolarHBondContact O-N 2.8Å
528	D	22.5	Very low	23.8	Very low	162 Å²	162	132 Å²	132	87%	0.866	78%	0.783	S	S	*	*			trans	-55.2	110.4	177.3	-62.6	-50.8	0	0	0	111.3	S530	D528-S530 PolarHBondContact O-N 2.93Å
529	Y	23.9	Very low	23.7	Very low	227 Å²	227	130.1 Å²	130.1	89%	0.89	78%	0.776	S	S	*	*			trans	-83.1	99.7	166.3	-87.7	-87.6	0	0	0	109	Q527	Q527-Y529 PolarHBondContact O-N 2.8Å
530	S	22.2	Very low	23.4	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	78%	0.78	S	S	*	*			trans	-56.7	137.9	167.6	55.2	0	0	0	0	111.9	D528 S532	D528-S530 PolarHBondContact O-N 2.93Å; S530-S532 PolarHBondContact O-N 2.96Å
531	S	23.6	Very low	23.3	Very low	126 Å²	126	131.7 Å²	131.7	88%	0.881	77%	0.769	S	S	*	*			trans	-42.2	112.3	171.4	52.6	0	0	0	0	114.6
532	S	24.5	Very low	23.2	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	77%	0.774	S	S	*	*			trans	-132.1	123.8	157.6	61.4	0	0	0	0	108.6	S530 P534	S530-S532 PolarHBondContact O-N 2.96Å; S532-P534 WeakPolarHBondContact O-CD 3.45Å
533	D	22.3	Very low	23	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	76%	0.76	S	S	*	*			trans	-41.4	115.7	179.1	-75.4	-47.5	0	0	0	113.7	S535	D533-S535 VanDerWaalsContact C-N 3.28Å; D533-S535 PolarHBondContact O-N 2.72Å; D533-S535 VanDerWaalsContact O-N 3.14Å
534	P	23.5	Very low	23.1	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	76%	0.76	S	S	*	*			trans	-87.9	70.4	169	34.2	-28.9	0	0	0	109	S532	S532-P534 WeakPolarHBondContact O-CD 3.45Å
535	S	23.7	Very low	23.3	Very low	115 Å²	115	131.6 Å²	131.6	80%	0.804	73%	0.73	S	S	*	*	S	Bend	trans	-92.6	4.1	169.6	58.9	0	0	0	0	113.4	D533	D533-S535 VanDerWaalsContact C-N 3.28Å; D533-S535 PolarHBondContact O-N 2.72Å; D533-S535 VanDerWaalsContact O-N 3.14Å
536	S	22.1	Very low	23.7	Very low	104 Å²	104	131.8 Å²	131.8	73%	0.727	73%	0.729	S	S	*	*	S	Bend	trans	-138.8	17.3	-178	69.2	0	0	0	0	116.1	S538	S536-S538 PolarHBondContact O-N 2.91Å
537	F	20.5	Very low	24.5	Very low	172 Å²	172	125.9 Å²	125.9	75%	0.754	70%	0.695	S	S	*	*			trans	-84.1	98.3	163.9	-100.8	-92.9	0	0	0	108.6	S539	F537-S539 PolarHBondContact O-N 2.85Å
538	S	20.6	Very low	25	Very low	108 Å²	108	122.8 Å²	122.8	76%	0.755	68%	0.676	S	S	*	*			trans	-60	74.5	154.2	58.1	0	0	0	0	107.6	S536 Y540	S536-S538 PolarHBondContact O-N 2.91Å; S538-Y540 PolarHBondContact O-N 3.43Å
539	S	21.2	Very low	25.7	Very low	87 Å²	87	120.8 Å²	120.8	61%	0.608	66%	0.661	S	S	*	*			trans	-58.7	126.7	165.7	42	0	0	0	0	105.2	F537 S541	F537-S539 PolarHBondContact O-N 2.85Å; S539-S541 PolarHBondContact O-N 3Å
540	Y	20.8	Very low	26.5	Very low	228 Å²	228	111.9 Å²	111.9	89%	0.894	63%	0.627	S	S	*	*			trans	-56.6	70	151.9	-66.5	-89.9	0	0	0	106.6	S538 H542	S538-Y540 PolarHBondContact O-N 3.43Å; Y540-H542 PolarHBondContact O-N 3.02Å; Y540-H542 VanDerWaalsContact O-N 3.15Å
541	S	21.6	Very low	27.2	Very low	76 Å²	76	109.1 Å²	109.1	53%	0.531	61%	0.608	S	S	.	*			trans	-55.7	124	157.4	62.6	0	0	0	0	102.7	S539 S543	S539-S541 PolarHBondContact O-N 3Å; S541-S543 PolarHBondContact O-N 2.87Å
542	H	23.3	Very low	27.5	Very low	171 Å²	171	104.7 Å²	104.7	79%	0.792	58%	0.577	S	S	*	*			trans	-56	73.5	151.5	-71	-92.5	0	0	0	105.8	Y540 F544	Y540-H542 PolarHBondContact O-N 3.02Å; Y540-H542 VanDerWaalsContact O-N 3.15Å; H542-F544 WeakPolarHBondContact O-CD2 3.43Å; H542-F544 PolarHBondContact O-N 2.74Å
543	S	22.8	Very low	28	Very low	69 Å²	69	106.1 Å²	106.1	48%	0.483	57%	0.572	S	S	.	*			trans	-73.5	89.3	172.9	62.7	0	0	0	0	102.3	S541 P545	S541-S543 PolarHBondContact O-N 2.87Å; S543-P545 VanDerWaalsContact O-N 3.12Å
544	F	26.3	Very low	28.4	Very low	174 Å²	174	103.7 Å²	103.7	76%	0.763	56%	0.558	S	S	*	*			trans	-41	122.7	166	-61.2	-81.2	0	0	0	106.3	H542	H542-F544 WeakPolarHBondContact O-CD2 3.43Å; H542-F544 PolarHBondContact O-N 2.74Å
545	P	30.5	Very low	28.5	Very low	31 Å²	31	102.7 Å²	102.7	20%	0.201	55%	0.551	C	S	.	*			trans	-54.9	153.4	175.6	24.6	-32.7	0	0	0	108.4	S543 R547 W592	S543-P545 VanDerWaalsContact O-N 3.12Å; P545-R547 PolarHBondContact O-N 3.48Å; P545-W592 HydrophobicContact CB-CD2 4.13Å; P545-W592 HydrophobicContact CB-CE3 4.47Å; P545-W592 HydrophobicContact CB-CH2 4.11Å; P545-W592 HydrophobicContact CB-CZ2 3.73Å; P545-W592 HydrophobicContact CB-CZ3 4.46Å; P545-W592 HydrophobicContact CG-CD2 4.21Å; P545-W592 HydrophobicContact CG-CE3 4.04Å; P545-W592 HydrophobicContact CG-CH2 3.68Å; P545-W592 HydrophobicContact CG-CZ2 3.86Å; P545-W592 HydrophobicContact CG-CZ3 3.77Å
546	P	34.1	Very low	28.7	Very low	105 Å²	105	102.1 Å²	102.1	68%	0.682	55%	0.547	S	S	*	.			trans	-53.8	117.6	174.1	23.3	-31.1	0	0	0	107.5	W548	P546-W548 PolarHBondContact O-N 2.84Å
547	R	38.9	Very low	28.8	Very low	51 Å²	51	104.7 Å²	104.7	19%	0.192	55%	0.552	C	S	.	*			trans	-44.5	137.2	162.6	-169.7	-179.3	-63.2	176.8	-5.1	106.8	E431 P545 Q549 D629	E431-R547 IonicContact OE1-CZ 3.75Å; E431-R547 IonicContact OE1-NH1 3.75Å; E431-R547 PolarHBondContact OE1-NH1 3.43Å; E431-R547 IonicContact OE1-NH2 3.93Å; E431-R547 PolarHBondContact OE1-NH2 2.93Å; P545-R547 PolarHBondContact O-N 3.48Å; R547-Q549 VanDerWaalsContact C-N 3.26Å; R547-Q549 HydrophobicContact CB-CG 4.31Å; R547-Q549 WeakPolarHBondContact O-CG 3.16Å; R547-Q549 PolarHBondContact O-N 2.95Å; R547-D629 WeakPolarHBondContact CD-OD2 3.37Å; R547-D629 IonicContact CZ-OD2 3.87Å; R547-D629 IonicContact NE-OD2 3.79Å; R547-D629 IonicContact NH1-OD2 2.61Å; R547-D629 PolarHBondContact NH1-OD2 2.79Å
548	W	36	Very low	29	Very low	106 Å²	106	102.6 Å²	102.6	40%	0.402	55%	0.549	S	S	.	.	B	Isolated β-bridge	trans	-63.1	97.5	171.3	-72.4	91.8	0	0	0	107.3	P546 F550 L589 W628	P546-W548 PolarHBondContact O-N 2.84Å; W548-F550 HydrophobicContact CB-CE2 4.11Å; W548-F550 HydrophobicContact CB-CZ 3.96Å; W548-L589 HydrophobicContact CH2-CD2 4.05Å; W548-W628 HydrophobicContact CB-CB 4.3Å
549	Q	36.9	Very low	29.2	Very low	120 Å²	120	102.4 Å²	102.4	56%	0.561	54%	0.543	S	S	*	.			trans	-90.5	109.6	-176	-72.7	-178.1	-15.4	0	0	107.8	R547	R547-Q549 VanDerWaalsContact C-N 3.26Å; R547-Q549 HydrophobicContact CB-CG 4.31Å; R547-Q549 WeakPolarHBondContact O-CG 3.16Å; R547-Q549 PolarHBondContact O-N 2.95Å
550	F	42	Very low	29.5	Very low	39 Å²	39	103.7 Å²	103.7	17%	0.171	54%	0.543	C	S	.	.			trans	-87.2	137.7	173.7	-59.8	-67.1	0	0	0	110.3	W548 W628 Y630 T681 V683	W548-F550 HydrophobicContact CB-CE2 4.11Å; W548-F550 HydrophobicContact CB-CZ 3.96Å; F550-W628 HydrophobicContact CE2-CB 4.35Å; F550-Y630 HydrophobicContact CB-CD2 4.22Å; F550-Y630 HydrophobicContact CB-CE2 4.42Å; F550-Y630 HydrophobicContact CD2-CD2 4.31Å; F550-T681 WeakPolarHBondContact CE2-O 3.47Å; F550-T681 WeakPolarHBondContact CZ-O 3.41Å; F550-V683 HydrophobicContact CD1-CG2 4.23Å; F550-V683 HydrophobicContact CE1-CG2 3.34Å; F550-V683 HydrophobicContact CE2-CG2 4.42Å; F550-V683 HydrophobicContact CZ-CG2 3.45Å; F550-V683 VanDerWaalsContact CZ-CG2 3.45Å
551	S	35.3	Very low	29.7	Very low	42 Å²	42	100 Å²	100	29%	0.294	54%	0.538	S	S	.	.			trans	-80.8	132.9	158	172.3	0	0	0	0	107.8	Y355 H553	Y355-S551 WeakPolarHBondContact CD1-OG 3.28Å; Y355-S551 WeakPolarHBondContact CE1-OG 3.39Å; S551-H553 PolarHBondContact O-N 2.84Å
552	S	31.3	Very low	30	Very low	34 Å²	34	101 Å²	101	24%	0.238	55%	0.545	C	S	.	.			trans	-60.9	89.9	175.2	52.6	0	0	0	0	111	I554	S552-I554 PolarHBondContact O-N 2.85Å
553	H	33.6	Very low	30.4	Very low	133 Å²	133	98.9 Å²	98.9	62%	0.616	55%	0.545	S	S	*	.			trans	-78.2	100.5	160.4	-91.1	-71.4	0	0	0	108.5	Y355 S551	Y355-H553 PolarHBondContact OH-CE1 2.85Å; S551-H553 PolarHBondContact O-N 2.84Å
554	I	30.9	Very low	30.6	Very low	101 Å²	101	103.1 Å²	103.1	52%	0.518	56%	0.562	S	S	.	*			trans	-103.7	109.3	153.3	-59.6	172.1	0	0	0	104.8	S552 S556	S552-I554 PolarHBondContact O-N 2.85Å; I554-S556 PolarHBondContact O-N 2.87Å
555	P	26.9	Very low	30.8	Very low	91 Å²	91	101.9 Å²	101.9	59%	0.591	56%	0.563	S	S	*	*			trans	-58.7	112.7	166.2	-14.6	27.7	0	0	0	106.6	L557	P555-L557 PolarHBondContact O-N 2.85Å
556	S	26.9	Very low	30.8	Very low	102 Å²	102	106.7 Å²	106.7	71%	0.713	59%	0.587	S	S	*	*			trans	-51	114.5	165.3	52.4	0	0	0	0	106.5	I554 N558	I554-S556 PolarHBondContact O-N 2.87Å; S556-N558 PolarHBondContact O-N 2.92Å
557	L	25	Very low	30.5	Very low	159 Å²	159	108.8 Å²	108.8	83%	0.832	59%	0.593	S	S	*	*			trans	-62	86.4	175.6	-165.1	87.3	0	0	0	106.9	P555 V559	P555-L557 PolarHBondContact O-N 2.85Å; L557-V559 VanDerWaalsContact C-N 3.3Å; L557-V559 HydrophobicContact CD2-CG2 4.26Å; L557-V559 PolarHBondContact O-N 2.8Å
558	N	23.7	Very low	30.1	Very low	128 Å²	128	112.9 Å²	112.9	68%	0.684	62%	0.624	S	S	*	*			trans	-73.2	96.4	176.7	-145.9	8.1	0	0	0	105.2	S556 N560	S556-N558 PolarHBondContact O-N 2.92Å; N558-N560 PolarHBondContact ND2-OD1 3.49Å; N558-N560 PolarHBondContact O-N 2.79Å
559	V	26.5	Very low	29.7	Very low	104 Å²	104	115.3 Å²	115.3	63%	0.63	64%	0.643	S	S	*	*			trans	-66.3	84.7	169	178.9	0	0	0	0	105.5	L557 N561	L557-V559 VanDerWaalsContact C-N 3.3Å; L557-V559 HydrophobicContact CD2-CG2 4.26Å; L557-V559 PolarHBondContact O-N 2.8Å; V559-N561 PolarHBondContact O-N 3.08Å
560	N	25.8	Very low	29.5	Very low	114 Å²	114	116.7 Å²	116.7	61%	0.61	65%	0.654	S	S	*	*			trans	-68.6	90.6	172.4	-75	-4.2	0	0	0	107.3	N558 S562	N558-N560 PolarHBondContact ND2-OD1 3.49Å; N558-N560 PolarHBondContact O-N 2.79Å; N560-S562 PolarHBondContact O-N 3.05Å
561	N	26	Very low	28.7	Very low	149 Å²	149	122.5 Å²	122.5	80%	0.797	69%	0.687	S	S	*	*			trans	-67.4	70.1	150.1	-84.6	-13.1	0	0	0	107.6	V559 T563	V559-N561 PolarHBondContact O-N 3.08Å; N561-T563 PolarHBondContact O-N 3.41Å
562	S	28.5	Very low	28.5	Very low	97 Å²	97	126.9 Å²	126.9	68%	0.678	71%	0.712	S	S	*	*			trans	-90.2	88.5	167.9	63.7	0	0	0	0	108.1	N560 N564	N560-S562 PolarHBondContact O-N 3.05Å; S562-N564 PolarHBondContact O-N 2.81Å
563	T	30.5	Very low	28.4	Very low	128 Å²	128	132.6 Å²	132.6	79%	0.785	74%	0.739	S	S	*	*			trans	-60.2	124.4	153.7	43.8	0	0	0	0	108.3	N561 N565	N561-T563 PolarHBondContact O-N 3.41Å; T563-N565 PolarHBondContact O-N 3.18Å
564	N	26.3	Very low	28	Very low	157 Å²	157	129.7 Å²	129.7	84%	0.84	75%	0.745	S	S	*	*			trans	-32.2	123.4	165.4	-83.1	-23.5	0	0	0	112.1	S562	S562-N564 PolarHBondContact O-N 2.81Å
565	N	31.5	Very low	27.9	Very low	148 Å²	148	132.4 Å²	132.4	79%	0.791	76%	0.761	S	S	*	*			trans	-155.5	105.8	147.2	-95.7	-12.7	0	0	0	108.7	T563	T563-N565 PolarHBondContact O-N 3.18Å
566	D	30.5	Very low	27.9	Very low	132 Å²	132	136.7 Å²	136.7	71%	0.706	77%	0.771	S	S	*	*			trans	46.9	107.9	137	-63.8	-20.9	0	0	0	120.6
567	N	27.4	Very low	27.7	Very low	150 Å²	150	139.6 Å²	139.6	80%	0.802	78%	0.777	S	S	*	*				38.9	91.2	118.7	-60.8	-24.2	0	0	0	117.3
568	T	31.6	Very low	27.6	Very low	137 Å²	137	138.6 Å²	138.6	84%	0.84	77%	0.773	S	S	*	*			trans	-140.4	116.9	140.8	32.2	0	0	0	0	109.3
569	I	26.1	Very low	27.6	Very low	157 Å²	157	138.4 Å²	138.4	81%	0.805	78%	0.776	S	S	*	*			trans	-77.4	113.4	171.7	-66.4	161.5	0	0	0	105.6
570	D	32.5	Very low	27.3	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	79%	0.785	S	S	*	*			trans	-143.2	114.4	155.9	-91.7	-33.3	0	0	0	109.3	V572	D570-V572 PolarHBondContact O-N 3.28Å; D570-V572 VanDerWaalsContact O-N 3.16Å
571	N	25.5	Very low	27	Very low	160 Å²	160	147 Å²	147	86%	0.856	80%	0.795	S	S	*	*			trans	-59.3	108	170.7	-77.3	-46.4	0	0	0	109
572	V	31.3	Very low	27	Very low	134 Å²	134	144.3 Å²	144.3	81%	0.812	79%	0.788	S	S	*	*			trans	-110.9	117.8	158.8	-178.2	0	0	0	0	106.8	D570 G574	D570-V572 PolarHBondContact O-N 3.28Å; D570-V572 VanDerWaalsContact O-N 3.16Å; V572-G574 PolarHBondContact O-N 2.65Å
573	D	29.1	Very low	27	Very low	154 Å²	154	145 Å²	145	82%	0.824	79%	0.793	S	S	*	*			trans	-40.2	127.2	-176.7	-76.3	-53.3	0	0	0	112.5	D575	D573-D575 PolarHBondContact O-N 3.23Å
574	G	26.4	Very low	26.9	Very low	72 Å²	72	147.4 Å²	147.4	74%	0.742	80%	0.795	S	S	*	*			trans	-57.3	100.1	172.8	0	0	0	0	0	109.6	V572 K576	V572-G574 PolarHBondContact O-N 2.65Å; G574-K576 PolarHBondContact O-N 3.4Å
575	D	28.4	Very low	26.9	Very low	159 Å²	159	145.3 Å²	145.3	85%	0.85	78%	0.782	S	S	*	*			trans	-60.4	108.9	174.2	-143.6	1.3	0	0	0	106.8	D573 L577	D573-D575 PolarHBondContact O-N 3.23Å; D575-L577 VanDerWaalsContact C-N 3.31Å; D575-L577 PolarHBondContact O-N 3.35Å
576	K	26	Very low	26.9	Very low	181 Å²	181	144 Å²	144	79%	0.787	78%	0.775	S	S	*	*			trans	-60.9	97.9	-179.9	-76.7	173.9	177.6	169.3	0	106.9	G574 N578	G574-K576 PolarHBondContact O-N 3.4Å; K576-N578 VanDerWaalsContact C-N 3.3Å; K576-N578 PolarHBondContact O-N 2.92Å
577	L	23.2	Very low	27	Very low	162 Å²	162	142.3 Å²	142.3	85%	0.848	77%	0.774	S	S	*	*			trans	-54.4	101.4	166.9	-166.3	74.7	0	0	0	106.5	D575 V579	D575-L577 VanDerWaalsContact C-N 3.31Å; D575-L577 PolarHBondContact O-N 3.35Å; L577-V579 PolarHBondContact O-N 2.89Å
578	N	22.4	Very low	27.1	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	77%	0.765	S	S	*	*			trans	-62.3	93.6	176.9	-84.7	-38.9	0	0	0	106.9	K576 Y580	K576-N578 VanDerWaalsContact C-N 3.3Å; K576-N578 PolarHBondContact O-N 2.92Å; N578-Y580 VanDerWaalsContact C-N 3.27Å; N578-Y580 PolarHBondContact O-N 3.46Å
579	V	23.5	Very low	27.1	Very low	124 Å²	124	138.9 Å²	138.9	75%	0.752	74%	0.744	S	S	*	*			trans	-55.7	101.2	163.7	177.4	0	0	0	0	105.1	L577 K581	L577-V579 PolarHBondContact O-N 2.89Å; V579-K581 VanDerWaalsContact C-N 3.29Å; V579-K581 PolarHBondContact O-N 3.06Å
580	Y	21	Very low	27.6	Very low	213 Å²	213	134.6 Å²	134.6	84%	0.835	73%	0.725	S	S	*	*			trans	-53.7	101.8	167.3	-91.1	-95.1	0	0	0	106.4	N578 S582	N578-Y580 VanDerWaalsContact C-N 3.27Å; N578-Y580 PolarHBondContact O-N 3.46Å; Y580-S582 VanDerWaalsContact C-N 3.27Å; Y580-S582 PolarHBondContact O-N 2.97Å
581	K	20.1	Very low	28	Very low	187 Å²	187	129.7 Å²	129.7	81%	0.813	70%	0.702	S	S	*	*			trans	-61.6	97.9	162	-79.3	-179.5	174.9	178	0	105.5	V579 S583	V579-K581 VanDerWaalsContact C-N 3.29Å; V579-K581 PolarHBondContact O-N 3.06Å; K581-S583 PolarHBondContact O-N 2.74Å
582	S	24.8	Very low	28.9	Very low	92 Å²	92	125.3 Å²	125.3	64%	0.643	67%	0.674	S	S	*	*			trans	-67	73.1	167	49.2	0	0	0	0	108.8	Y580 Q584	Y580-S582 VanDerWaalsContact C-N 3.27Å; Y580-S582 PolarHBondContact O-N 2.97Å; S582-Q584 PolarHBondContact O-N 3.17Å
583	S	28.6	Very low	29.5	Very low	112 Å²	112	123.3 Å²	123.3	78%	0.783	66%	0.659	S	S	*	*			trans	-82.5	8.6	175.9	58.4	0	0	0	0	113.2	K581	K581-S583 PolarHBondContact O-N 2.74Å
584	Q	28.6	Very low	30.5	Very low	177 Å²	177	123.1 Å²	123.1	83%	0.827	65%	0.653	S	S	*	*			trans	-129.1	78.3	165.3	-83.1	178.2	-27.2	0	0	107.5	S582 D586	S582-Q584 PolarHBondContact O-N 3.17Å; Q584-D586 PolarHBondContact O-N 3.35Å; Q584-D586 VanDerWaalsContact O-N 3.16Å
585	I	26.5	Very low	32.2	Very low	113 Å²	113	124.5 Å²	124.5	58%	0.579	64%	0.638	S	S	*	*			trans	-64	113.1	161.9	-61.4	168.3	0	0	0	104.9	S587 T590	I585-S587 PolarHBondContact O-N 3.39Å; I585-T590 HydrophobicContact CG2-CG2 3.56Å
586	D	31.1	Very low	34.5	Very low	120 Å²	120	118.1 Å²	118.1	64%	0.642	60%	0.604	S	S	*	*			trans	-50.6	117.9	173.2	-101	-20.7	0	0	0	107.7	Q584 K588 L589	Q584-D586 PolarHBondContact O-N 3.35Å; Q584-D586 VanDerWaalsContact O-N 3.16Å; D586-K588 CarbonylContact O-C 3.53Å; D586-K588 PolarHBondContact O-N 3.05Å; D586-L589 PolarHBondContact O-N 2.9Å
587	S	32.4	Very low	37.1	Very low	97 Å²	97	111.3 Å²	111.3	68%	0.678	58%	0.578	S	S	*	*	H	α-helix	trans	-56.3	-16.8	178.7	60.6	0	0	0	0	112.8	I585 T590	I585-S587 PolarHBondContact O-N 3.39Å; S587-T590 PolarHBondContact O-OG1 3.24Å
588	K	30	Very low	40	Very low	139 Å²	139	106.6 Å²	106.6	60%	0.604	55%	0.548	S	S	*	.	H	α-helix	trans	-63.2	-49.9	168.8	-79.1	-173.5	-179.3	-175.6	0	111.4	D586 T590 S591 W592	D586-K588 CarbonylContact O-C 3.53Å; D586-K588 PolarHBondContact O-N 3.05Å; K588-T590 VanDerWaalsContact C-N 3.33Å; K588-T590 PolarHBondContact O-N 3.33Å; K588-S591 WeakPolarHBondContact O-CB 3.49Å; K588-S591 PolarHBondContact O-N 3.31Å; K588-S591 VanDerWaalsContact O-N 3.12Å; K588-S591 PolarHBondContact O-OG 2.84Å; K588-W592 PolarHBondContact O-NE1 3.38Å; K588-W592 VanDerWaalsContact O-NE1 3.16Å
589	L	31.9	Very low	43	Very low	77 Å²	77	102.3 Å²	102.3	40%	0.403	53%	0.525	S	S	.	.	H	α-helix	trans	-61.7	-42.2	-173.6	-139.3	86.6	0	0	0	111.4	W548 D586 S591 W592 D593	W548-L589 HydrophobicContact CH2-CD2 4.05Å; D586-L589 PolarHBondContact O-N 2.9Å; L589-S591 VanDerWaalsContact C-N 3.26Å; L589-S591 PolarHBondContact O-N 2.7Å; L589-W592 PolarHBondContact O-N 3.08Å; L589-W592 VanDerWaalsContact O-N 3.1Å; L589-D593 PolarHBondContact O-N 3.37Å
590	T	35.6	Very low	45.7	Very low	67 Å²	67	103.5 Å²	103.5	41%	0.411	53%	0.528	S	S	.	.	H	α-helix	trans	-61.6	-33.4	177.8	53.4	0	0	0	0	112.6	I585 S587 K588 W592	I585-T590 HydrophobicContact CG2-CG2 3.56Å; S587-T590 PolarHBondContact O-OG1 3.24Å; K588-T590 VanDerWaalsContact C-N 3.33Å; K588-T590 PolarHBondContact O-N 3.33Å; T590-W592 PolarHBondContact O-N 3.5Å
591	S	41.7	Very low	48.8	Very low	45 Å²	45	97.8 Å²	97.8	32%	0.315	51%	0.508	S	S	.	.	H	α-helix	trans	-68.1	-15.5	178.4	77.9	0	0	0	0	114.2	K588 L589	K588-S591 WeakPolarHBondContact O-CB 3.49Å; K588-S591 PolarHBondContact O-N 3.31Å; K588-S591 VanDerWaalsContact O-N 3.12Å; K588-S591 PolarHBondContact O-OG 2.84Å; L589-S591 VanDerWaalsContact C-N 3.26Å; L589-S591 PolarHBondContact O-N 2.7Å
592	W	44.5	Very low	52	Low	69 Å²	69	89.9 Å²	89.9	26%	0.261	47%	0.474	S	S	.	.	H	α-helix	trans	-103.4	-31.9	-176.5	-56.5	98.6	0	0	0	114.3	P545 K588 L589 T590 E594 K595 L596	P545-W592 HydrophobicContact CB-CD2 4.13Å; P545-W592 HydrophobicContact CB-CE3 4.47Å; P545-W592 HydrophobicContact CB-CH2 4.11Å; P545-W592 HydrophobicContact CB-CZ2 3.73Å; P545-W592 HydrophobicContact CB-CZ3 4.46Å; P545-W592 HydrophobicContact CG-CD2 4.21Å; P545-W592 HydrophobicContact CG-CE3 4.04Å; P545-W592 HydrophobicContact CG-CH2 3.68Å; P545-W592 HydrophobicContact CG-CZ2 3.86Å; P545-W592 HydrophobicContact CG-CZ3 3.77Å; K588-W592 PolarHBondContact O-NE1 3.38Å; K588-W592 VanDerWaalsContact O-NE1 3.16Å; L589-W592 PolarHBondContact O-N 3.08Å; L589-W592 VanDerWaalsContact O-N 3.1Å; T590-W592 PolarHBondContact O-N 3.5Å; W592-E594 PolarHBondContact O-N 3.17Å; W592-K595 HydrophobicContact CD2-CD 4.38Å; W592-K595 HydrophobicContact CE3-CD 3.63Å; W592-K595 HydrophobicContact CZ3-CD 4Å; W592-K595 WeakPolarHBondContact O-CA 3.03Å; W592-K595 WeakPolarHBondContact O-CB 3.46Å; W592-K595 PolarHBondContact O-N 3.21Å; W592-L596 PolarHBondContact O-N 3.38Å
593	D	44.8	Very low	55	Low	92 Å²	92	85.8 Å²	85.8	49%	0.492	45%	0.445	S	S	.	.	H	α-helix	trans	-59.1	-32.5	166.5	-75.1	-21.2	0	0	0	109.9	L589 K595	L589-D593 PolarHBondContact O-N 3.37Å; D593-K595 PolarHBondContact O-N 3.5Å
594	E	48.8	Very low	58	Low	150 Å²	150	81.1 Å²	81.1	70%	0.701	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-15.4	169	-72.7	-175.9	170.8	0	0	114.1	W592 T597	W592-E594 PolarHBondContact O-N 3.17Å; E594-T597 PolarHBondContact O-OG1 2.91Å
595	K	62.3	Low	61.1	Low	101 Å²	101	73 Å²	73	44%	0.439	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-27.9	-179.8	-73.1	179.3	-178.5	179.9	0	114.4	W592 D593 T597 H604	W592-K595 HydrophobicContact CD2-CD 4.38Å; W592-K595 HydrophobicContact CE3-CD 3.63Å; W592-K595 HydrophobicContact CZ3-CD 4Å; W592-K595 WeakPolarHBondContact O-CA 3.03Å; W592-K595 WeakPolarHBondContact O-CB 3.46Å; W592-K595 PolarHBondContact O-N 3.21Å; D593-K595 PolarHBondContact O-N 3.5Å; K595-T597 PolarHBondContact O-N 3.44Å; K595-H604 PolarHBondContact O-CE1 2.86Å; K595-H604 VanDerWaalsContact O-CE1 3.26Å
596	L	77.7	Confident	64.3	Low	24 Å²	24	67.7 Å²	67.7	13%	0.126	35%	0.346	C	S	.	.	S	Bend	trans	-83.7	37.6	178.3	-66.6	174.7	0	0	0	112.1	P446 W592 V627	P446-L596 WeakPolarHBondContact CD-O 3.49Å; P446-L596 VanDerWaalsContact CG-O 3.27Å; P446-L596 WeakPolarHBondContact CG-O 3.17Å; W592-L596 PolarHBondContact O-N 3.38Å; L596-V627 HydrophobicContact CD1-CG1 3.67Å; L596-V627 HydrophobicContact CD2-CG1 3.93Å; L596-V627 HydrophobicContact CD2-CG2 4.06Å; L596-V627 HydrophobicContact CG-CG1 4.45Å
597	T	80.5	Confident	67.4	Low	39 Å²	39	62 Å²	62	24%	0.239	32%	0.315	C	S	.	.	S	Bend	trans	-108.2	149.7	175.8	58.9	0	0	0	0	110.3	P446 E594 K595 D599	P446-T597 CarbonylContact O-C 3.23Å; P446-T597 VanDerWaalsContact O-CA 3.23Å; P446-T597 WeakPolarHBondContact O-CA 3.33Å; E594-T597 PolarHBondContact O-OG1 2.91Å; K595-T597 PolarHBondContact O-N 3.44Å; T597-D599 PolarHBondContact O-N 2.78Å
598	R	83.9	Confident	70.5	Confident	62 Å²	62	57.4 Å²	57.4	23%	0.234	28%	0.283	C	S	.	.			trans	-54.1	129.4	173.2	-166.1	172.3	71.9	-177.7	-2.2	110.3	L445 P446 E455 N602	L445-R598 HydrophobicContact CB-CB 4.3Å; P446-R598 PolarHBondContact O-N 3.21Å; E455-R598 IonicContact OE1-NH2 3.09Å; E455-R598 PolarHBondContact OE1-NH2 2.82Å; R598-N602 HydrophobicContact CG-CB 4.16Å; R598-N602 WeakPolarHBondContact CG-OD1 3.21Å
599	D	84	Confident	73.6	Confident	48 Å²	48	50.8 Å²	50.8	26%	0.257	25%	0.254	S	S	.	.			trans	-77.1	167.9	171.1	67.1	-49.1	0	0	0	111.2	T597 F601 N602 V603 H604	T597-D599 PolarHBondContact O-N 2.78Å; D599-F601 PolarHBondContact O-N 3.08Å; D599-N602 PolarHBondContact O-N 3.39Å; D599-N602 VanDerWaalsContact O-N 3.13Å; D599-N602 VanDerWaalsContact OD1-C 3.28Å; D599-N602 WeakPolarHBondContact OD1-CA 3.41Å; D599-N602 PolarHBondContact OD1-N 2.83Å; D599-N602 VanDerWaalsContact OD1-N 3.16Å; D599-N602 PolarHBondContact OD2-N 3.48Å; D599-V603 VanDerWaalsContact CG-N 3.33Å; D599-V603 PolarHBondContact OD1-N 2.97Å; D599-V603 PolarHBondContact OD2-N 3.22Å; D599-H604 HydrophobicContact CB-CB 4.18Å; D599-H604 WeakPolarHBondContact OD1-CB 3.31Å; D599-H604 PolarHBondContact OD1-N 2.77Å
600	N	81.8	Confident	76.6	Confident	150 Å²	150	47.2 Å²	47.2	80%	0.802	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.5	-176.4	-68.8	-27.2	0	0	0	113.3
601	F	84.6	Confident	79.4	Confident	93 Å²	93	44 Å²	44	41%	0.408	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	8.3	-177.6	-60.8	-56	0	0	0	113	D599 V603 G1072 L1073 L1099	D599-F601 PolarHBondContact O-N 3.08Å; F601-V603 HydrophobicContact CB-CG2 3.91Å; F601-V603 PolarHBondContact O-N 2.78Å; F601-V603 VanDerWaalsContact O-N 3.15Å; F601-G1072 WeakPolarHBondContact O-CA 3.15Å; F601-G1072 PolarHBondContact O-N 2.89Å; F601-L1073 HydrophobicContact CB-CD1 4.04Å; F601-L1073 HydrophobicContact CB-CG 4.02Å; F601-L1073 HydrophobicContact CD1-CD1 3.95Å; F601-L1073 HydrophobicContact CD1-CD2 3.46Å; F601-L1073 VanDerWaalsContact CD1-CD2 3.46Å; F601-L1073 HydrophobicContact CD1-CG 3.65Å; F601-L1073 HydrophobicContact CE1-CD2 3.75Å; F601-L1073 HydrophobicContact CE1-CG 4.38Å; F601-L1073 HydrophobicContact CG-CD1 3.92Å; F601-L1073 HydrophobicContact CG-CD2 4.28Å; F601-L1073 HydrophobicContact CG-CG 4.01Å; F601-L1099 HydrophobicContact CE2-CD1 4.23Å; F601-L1099 HydrophobicContact CZ-CD1 4.08Å
602	N	88.8	Confident	81.9	Confident	20 Å²	20	42.9 Å²	42.9	11%	0.107	21%	0.208	C	C	.	.	S	Bend	trans	47.4	41.6	-178	-167.5	33.4	0	0	0	113.2	D444 R598 D599 K605	D444-N602 PolarHBondContact OD1-ND2 2.95Å; D444-N602 PolarHBondContact OD1-OD1 2.82Å; R598-N602 HydrophobicContact CG-CB 4.16Å; R598-N602 WeakPolarHBondContact CG-OD1 3.21Å; D599-N602 PolarHBondContact O-N 3.39Å; D599-N602 VanDerWaalsContact O-N 3.13Å; D599-N602 VanDerWaalsContact OD1-C 3.28Å; D599-N602 WeakPolarHBondContact OD1-CA 3.41Å; D599-N602 PolarHBondContact OD1-N 2.83Å; D599-N602 VanDerWaalsContact OD1-N 3.16Å; D599-N602 PolarHBondContact OD2-N 3.48Å; N602-K605 WeakPolarHBondContact ND2-CE 3.29Å; N602-K605 PolarHBondContact ND2-NZ 3.05Å; N602-K605 VanDerWaalsContact ND2-NZ 3.17Å; N602-K605 WeakPolarHBondContact O-CE 3.43Å
603	V	88.1	Confident	84.1	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.042	20%	0.203	C	C	.	.			trans	-89.8	-31.9	174.2	179.3	0	0	0	0	110.5	D599 F601 K605 S621 T1071 L1078	D599-V603 VanDerWaalsContact CG-N 3.33Å; D599-V603 PolarHBondContact OD1-N 2.97Å; D599-V603 PolarHBondContact OD2-N 3.22Å; F601-V603 HydrophobicContact CB-CG2 3.91Å; F601-V603 PolarHBondContact O-N 2.78Å; F601-V603 VanDerWaalsContact O-N 3.15Å; V603-K605 PolarHBondContact O-N 2.95Å; V603-S621 PolarHBondContact O-OG 3.29Å; V603-T1071 HydrophobicContact CG2-CG2 3.99Å; V603-L1078 HydrophobicContact CG1-CD2 3.97Å
604	H	90.9	Very high	86.2	Confident	14 Å²	14	36.4 Å²	36.4	7%	0.065	18%	0.18	C	C	.	.			trans	-80.3	109.6	176	-171.6	-171.6	0	0	0	109.7	L445 K595 D599 E620 S621	L445-H604 HydrophobicContact CD1-CB 4.19Å; L445-H604 VanDerWaalsContact CD1-CD2 3.41Å; L445-H604 WeakPolarHBondContact CD1-CD2 3.46Å; L445-H604 VanDerWaalsContact CD1-CG 3.48Å; L445-H604 WeakPolarHBondContact CD1-NE2 3.36Å; L445-H604 WeakPolarHBondContact CD1-O 3.3Å; K595-H604 PolarHBondContact O-CE1 2.86Å; K595-H604 VanDerWaalsContact O-CE1 3.26Å; D599-H604 HydrophobicContact CB-CB 4.18Å; D599-H604 WeakPolarHBondContact OD1-CB 3.31Å; D599-H604 PolarHBondContact OD1-N 2.77Å; H604-E620 IonicContact CE1-OE1 2.71Å; H604-E620 PolarHBondContact CE1-OE1 3.06Å; H604-E620 VanDerWaalsContact CE1-OE1 3.27Å; H604-E620 WeakPolarHBondContact NE2-CG 3.39Å; H604-E620 IonicContact NE2-OE1 2.81Å; H604-E620 PolarHBondContact NE2-OE1 2.99Å; H604-S621 WeakPolarHBondContact CA-OG 3.18Å
605	K	93.4	Very high	88.4	Confident	7 Å²	7	29.3 Å²	29.3	3%	0.03	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	159.8	-174.5	-62.4	-160.6	-177.7	-151	0	110.7	V442 I443 D444 N602 V603 S621 P1070 L1078	V442-K605 HydrophobicContact CG1-CB 3.95Å; V442-K605 HydrophobicContact CG1-CD 3.69Å; V442-K605 HydrophobicContact CG1-CG 4.46Å; I443-K605 WeakPolarHBondContact O-CB 3.47Å; D444-K605 VanDerWaalsContact OD1-CE 3.25Å; D444-K605 WeakPolarHBondContact OD1-CE 3.36Å; D444-K605 IonicContact OD1-NZ 3.81Å; D444-K605 PolarHBondContact OD1-NZ 3.36Å; N602-K605 WeakPolarHBondContact ND2-CE 3.29Å; N602-K605 PolarHBondContact ND2-NZ 3.05Å; N602-K605 VanDerWaalsContact ND2-NZ 3.17Å; N602-K605 WeakPolarHBondContact O-CE 3.43Å; V603-K605 PolarHBondContact O-N 2.95Å; K605-S621 PolarHBondContact N-OG 2.94Å; K605-S621 WeakPolarHBondContact O-CB 3.46Å; K605-S621 PolarHBondContact O-N 3.28Å; K605-S621 PolarHBondContact O-OG 2.94Å; K605-P1070 VanDerWaalsContact CE-O 3.23Å; K605-P1070 WeakPolarHBondContact CE-O 3.44Å; K605-P1070 PolarHBondContact NZ-O 2.91Å; K605-L1078 HydrophobicContact CD-CD1 3.98Å; K605-L1078 HydrophobicContact CG-CD1 4.27Å
606	M	94.4	Very high	89.9	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.5	171.2	-177.3	67.9	89.2	0	0	109.9	I443 L445 V608 G618 V627 W628 I680	I443-M606 HydrophobicContact CB-CB 4.47Å; I443-M606 PolarHBondContact N-O 3.06Å; I443-M606 PolarHBondContact O-N 3.36Å; L445-M606 HydrophobicContact CD2-CB 4.06Å; M606-V608 HydrophobicContact CG-CG2 3.93Å; M606-G618 WeakPolarHBondContact SD-CA 3.49Å; M606-V627 HydrophobicContact CE-CB 4.02Å; M606-V627 HydrophobicContact CE-CG1 4.01Å; M606-V627 HydrophobicContact CE-CG2 4.22Å; M606-V627 HydrophobicContact SD-CB 4.49Å; M606-V627 HydrophobicContact SD-CG2 4.39Å; M606-W628 VanDerWaalsContact CE-NE1 3.33Å; M606-I680 HydrophobicContact CB-CD1 3.9Å; M606-I680 WeakPolarHBondContact CE-O 3.49Å; M606-I680 HydrophobicContact CG-CD1 4.3Å
607	L	95.7	Very high	90.7	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	108.4	169.1	-54.8	173.9	0	0	0	108.3	W28 V442 I609 G618 L619 F1080 F1088	W28-L607 HydrophobicContact CH2-CD1 4.44Å; W28-L607 HydrophobicContact CZ2-CD1 4.04Å; V442-L607 HydrophobicContact CB-CD2 4.28Å; V442-L607 HydrophobicContact CG1-CD2 4.01Å; V442-L607 HydrophobicContact CG2-CD2 3.66Å; L607-I609 HydrophobicContact CB-CD1 4.49Å; L607-I609 HydrophobicContact CB-CG1 4.45Å; L607-G618 CarbonylContact O-C 3.43Å; L607-G618 WeakPolarHBondContact O-CA 3.49Å; L607-L619 HydrophobicContact CB-CB 4.13Å; L607-L619 HydrophobicContact CD1-CB 4.39Å; L607-L619 PolarHBondContact N-O 3.33Å; L607-L619 PolarHBondContact O-N 3.16Å; L607-F1080 HydrophobicContact CD1-CD2 4.02Å; L607-F1080 HydrophobicContact CD1-CE2 4.16Å; L607-F1080 HydrophobicContact CD1-CG 4.2Å; L607-F1080 HydrophobicContact CD1-CZ 4.44Å; L607-F1088 HydrophobicContact CD1-CD2 4.4Å
608	V	96.5	Very high	91.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	117.7	174.9	178.2	0	0	0	0	109.1	V440 E441 I443 M606 F617 W628 L645 F677 P679	V440-V608 CarbonylContact C-O 3.53Å; V440-V608 WeakPolarHBondContact CA-O 3.23Å; E441-V608 PolarHBondContact N-O 2.93Å; E441-V608 PolarHBondContact O-N 2.84Å; I443-V608 HydrophobicContact CD1-CB 4.08Å; I443-V608 HydrophobicContact CD1-CG2 3.37Å; I443-V608 HydrophobicContact CG1-CG2 4.37Å; M606-V608 HydrophobicContact CG-CG2 3.93Å; V608-F617 WeakPolarHBondContact CA-O 3.38Å; V608-W628 HydrophobicContact CG1-CH2 4.25Å; V608-W628 HydrophobicContact CG1-CZ2 4.45Å; V608-W628 HydrophobicContact CG2-CZ2 4.12Å; V608-L645 HydrophobicContact CG1-CD1 4.39Å; V608-F677 HydrophobicContact CG1-CE2 4.03Å; V608-F677 HydrophobicContact CG1-CZ 3.94Å; V608-P679 HydrophobicContact CG2-CB 3.9Å
609	I	95.9	Very high	91.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.7	-169.8	-62.5	-179.4	0	0	0	109.3	L434 I437 V440 L607 L616 F617 L619 F1080	L434-I609 HydrophobicContact CD2-CG2 4.26Å; I437-I609 HydrophobicContact CB-CG2 4.2Å; I437-I609 HydrophobicContact CD1-CD1 4.14Å; I437-I609 HydrophobicContact CD1-CG2 3.53Å; I437-I609 HydrophobicContact CG1-CG2 3.49Å; I437-I609 VanDerWaalsContact CG1-CG2 3.49Å; I437-I609 HydrophobicContact CG2-CG2 3.7Å; V440-I609 HydrophobicContact CG1-CG1 4.21Å; V440-I609 HydrophobicContact CG2-CG1 4.21Å; L607-I609 HydrophobicContact CB-CD1 4.49Å; L607-I609 HydrophobicContact CB-CG1 4.45Å; I609-L616 CarbonylContact O-C 3.57Å; I609-L616 VanDerWaalsContact O-CA 3.27Å; I609-L616 WeakPolarHBondContact O-CA 3.49Å; I609-F617 HydrophobicContact CB-CB 4.31Å; I609-F617 PolarHBondContact N-O 3.24Å; I609-F617 PolarHBondContact O-N 2.86Å; I609-L619 HydrophobicContact CD1-CD1 3.36Å; I609-L619 HydrophobicContact CD1-CG 3.75Å; I609-F1080 HydrophobicContact CD1-CE1 4.04Å; I609-F1080 HydrophobicContact CD1-CZ 3.92Å
610	A	95.2	Very high	92.3	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.008	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.4	171	0	0	0	0	0	110.8	V438 A439 L616 F643 L645 L662	V438-A610 PolarHBondContact N-O 3.42Å; A439-A610 HydrophobicContact CB-CB 4.31Å; A439-A610 PolarHBondContact N-O 2.86Å; A439-A610 PolarHBondContact O-N 2.99Å; A610-L616 HydrophobicContact CB-CD2 3.62Å; A610-F643 HydrophobicContact CB-CB 4.49Å; A610-F643 HydrophobicContact CB-CD2 4.24Å; A610-L645 HydrophobicContact CB-CD1 4.34Å; A610-L662 HydrophobicContact CB-CD1 4.11Å
611	T	95.1	Very high	92.7	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	158.3	178.6	69.4	0	0	0	0	111.5	A433 N436 I437 V613 G614 K615 F617 F643	A433-T611 HydrophobicContact CB-CG2 4.03Å; A433-T611 WeakPolarHBondContact O-CB 3.37Å; A433-T611 WeakPolarHBondContact O-CG2 2.98Å; N436-T611 CarbonylContact O-C 3.58Å; N436-T611 WeakPolarHBondContact O-CA 3.44Å; I437-T611 HydrophobicContact CG1-CG2 4.39Å; T611-V613 PolarHBondContact O-N 2.88Å; T611-V613 WeakPolarHBondContact OG1-CG2 3.5Å; T611-G614 PolarHBondContact O-N 3.46Å; T611-K615 PolarHBondContact N-O 3.05Å; T611-K615 WeakPolarHBondContact OG1-CB 3.46Å; T611-K615 PolarHBondContact OG1-N 2.8Å; T611-K615 PolarHBondContact OG1-O 3.39Å; T611-F617 HydrophobicContact CG2-CD2 3.94Å; T611-F617 HydrophobicContact CG2-CE2 3.64Å; T611-F643 WeakPolarHBondContact O-CE2 3.35Å
612	S	92.2	Very high	92.7	Very high	22 Å²	22	8.4 Å²	8.4	15%	0.154	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.7	-175	61.6	0	0	0	0	115.4	N436 G614	N436-S612 PolarHBondContact ND2-OG 2.88Å; N436-S612 PolarHBondContact O-N 2.86Å; S612-G614 PolarHBondContact O-N 3Å
613	V	91	Very high	92.5	Very high	23 Å²	23	15.5 Å²	15.5	14%	0.139	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.8	176.4	-65.5	0	0	0	0	113.5	D415 A433 T611 K615	D415-V613 VanDerWaalsContact OD2-CG1 3.24Å; D415-V613 WeakPolarHBondContact OD2-CG1 3.27Å; A433-V613 HydrophobicContact CB-CG2 3.97Å; T611-V613 PolarHBondContact O-N 2.88Å; T611-V613 WeakPolarHBondContact OG1-CG2 3.5Å; V613-K615 HydrophobicContact CG2-CB 4.16Å
614	G	90.6	Very high	92.5	Very high	2 Å²	2	15.2 Å²	15.2	2%	0.021	7%	0.068	C	C	.	.	S	Bend	trans	95.4	21.2	-177	0	0	0	0	0	114.3	T611 S612 V632	T611-G614 PolarHBondContact O-N 3.46Å; S612-G614 PolarHBondContact O-N 3Å; G614-V632 PolarHBondContact O-N 2.81Å
615	K	93.4	Very high	92.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.4	173.2	-166.8	165.3	177.6	176.8	0	110.5	H386 D414 E431 T611 V613 F617 D629 F631	H386-K615 PolarHBondContact CE1-NZ 2.98Å; H386-K615 PolarHBondContact ND1-NZ 2.69Å; D414-K615 HydrophobicContact CB-CD 3.98Å; D414-K615 WeakPolarHBondContact OD2-CD 3.38Å; D414-K615 IonicContact OD2-NZ 3.27Å; D414-K615 PolarHBondContact OD2-NZ 3.28Å; E431-K615 IonicContact OE1-NZ 3.09Å; E431-K615 IonicContact OE2-NZ 3.66Å; E431-K615 PolarHBondContact OE2-NZ 3.25Å; T611-K615 PolarHBondContact N-O 3.05Å; T611-K615 WeakPolarHBondContact OG1-CB 3.46Å; T611-K615 PolarHBondContact OG1-N 2.8Å; T611-K615 PolarHBondContact OG1-O 3.39Å; V613-K615 HydrophobicContact CG2-CB 4.16Å; K615-F617 HydrophobicContact CB-CE2 3.98Å; K615-F617 HydrophobicContact CB-CZ 4.47Å; K615-F617 HydrophobicContact CD-CE1 4.13Å; K615-F617 HydrophobicContact CD-CE2 3.77Å; K615-F617 HydrophobicContact CD-CZ 3.39Å; K615-F617 HydrophobicContact CG-CD2 4.25Å; K615-F617 HydrophobicContact CG-CE1 4.43Å; K615-F617 HydrophobicContact CG-CE2 3.58Å; K615-F617 HydrophobicContact CG-CZ 3.71Å; K615-D629 IonicContact NZ-OD2 3.28Å; K615-F631 HydrophobicContact CB-CD2 4.12Å; K615-F631 HydrophobicContact CG-CB 4.46Å
616	L	94.5	Very high	92.2	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	142.6	174.8	-64.9	173.6	0	0	0	109.8	I609 A610 W628 D629 Y630 V632 L662 F675 F677	I609-L616 CarbonylContact O-C 3.57Å; I609-L616 VanDerWaalsContact O-CA 3.27Å; I609-L616 WeakPolarHBondContact O-CA 3.49Å; A610-L616 HydrophobicContact CB-CD2 3.62Å; L616-W628 HydrophobicContact CB-CH2 4.23Å; L616-W628 HydrophobicContact CB-CZ3 3.8Å; L616-D629 CarbonylContact O-C 3.53Å; L616-D629 VanDerWaalsContact O-CA 3.23Å; L616-D629 WeakPolarHBondContact O-CA 3.34Å; L616-Y630 PolarHBondContact N-O 3.45Å; L616-Y630 PolarHBondContact O-N 3.29Å; L616-V632 HydrophobicContact CD1-CG2 4.3Å; L616-L662 HydrophobicContact CD1-CD2 4.24Å; L616-L662 HydrophobicContact CD2-CD1 4.27Å; L616-L662 HydrophobicContact CD2-CD2 4.08Å; L616-L662 HydrophobicContact CG-CD2 4.35Å; L616-F675 HydrophobicContact CD1-CD1 4.09Å; L616-F675 HydrophobicContact CD1-CE1 3.88Å; L616-F677 HydrophobicContact CD1-CD1 4.12Å; L616-F677 HydrophobicContact CD1-CE1 3.74Å; L616-F677 HydrophobicContact CD1-CE2 4.4Å; L616-F677 HydrophobicContact CD1-CZ 3.89Å
617	F	95.3	Very high	91.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	142.6	174.7	-63.5	-91	0	0	0	110	E431 A433 L434 V608 I609 T611 K615 L619 I626 D629	E431-F617 HydrophobicContact CB-CE1 4.21Å; E431-F617 HydrophobicContact CB-CZ 4.17Å; E431-F617 HydrophobicContact CG-CE1 4.06Å; E431-F617 HydrophobicContact CG-CZ 4.42Å; A433-F617 HydrophobicContact CB-CE2 4.44Å; L434-F617 HydrophobicContact CD2-CB 4.5Å; L434-F617 HydrophobicContact CD2-CD2 3.67Å; L434-F617 HydrophobicContact CD2-CE2 3.89Å; L434-F617 HydrophobicContact CD2-CG 3.99Å; L434-F617 HydrophobicContact CD2-CZ 4.38Å; L434-F617 HydrophobicContact CG-CD2 4.37Å; L434-F617 HydrophobicContact CG-CE2 4.12Å; L434-F617 HydrophobicContact CG-CZ 4.21Å; V608-F617 WeakPolarHBondContact CA-O 3.38Å; I609-F617 HydrophobicContact CB-CB 4.31Å; I609-F617 PolarHBondContact N-O 3.24Å; I609-F617 PolarHBondContact O-N 2.86Å; T611-F617 HydrophobicContact CG2-CD2 3.94Å; T611-F617 HydrophobicContact CG2-CE2 3.64Å; K615-F617 HydrophobicContact CB-CE2 3.98Å; K615-F617 HydrophobicContact CB-CZ 4.47Å; K615-F617 HydrophobicContact CD-CE1 4.13Å; K615-F617 HydrophobicContact CD-CE2 3.77Å; K615-F617 HydrophobicContact CD-CZ 3.39Å; K615-F617 HydrophobicContact CG-CD2 4.25Å; K615-F617 HydrophobicContact CG-CE1 4.43Å; K615-F617 HydrophobicContact CG-CE2 3.58Å; K615-F617 HydrophobicContact CG-CZ 3.71Å; F617-L619 HydrophobicContact CB-CD2 4.29Å; F617-I626 HydrophobicContact CD1-CD1 4.21Å; F617-I626 HydrophobicContact CD1-CG1 4.31Å; F617-I626 HydrophobicContact CD1-CG2 3.98Å; F617-I626 HydrophobicContact CE1-CD1 4.19Å; F617-D629 HydrophobicContact CD1-CB 3.58Å; F617-D629 HydrophobicContact CE1-CB 3.77Å; F617-D629 HydrophobicContact CG-CB 4.39Å
618	G	94.9	Very high	91.7	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	111.1	160.7	0	0	0	0	0	109.3	M606 L607 V627 W628	M606-G618 WeakPolarHBondContact SD-CA 3.49Å; L607-G618 CarbonylContact O-C 3.43Å; L607-G618 WeakPolarHBondContact O-CA 3.49Å; G618-V627 WeakPolarHBondContact O-CB 3.13Å; G618-V627 PolarHBondContact O-N 3.47Å; G618-W628 VanDerWaalsContact CA-CE2 3.47Å; G618-W628 PolarHBondContact N-O 3.05Å; G618-W628 PolarHBondContact O-N 2.97Å
619	L	94.1	Very high	91.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	143.3	174	-48.6	-175.9	0	0	0	111.5	W28 L607 I609 F617 R625 I626 L1086	W28-L619 HydrophobicContact CH2-CD1 4.46Å; L607-L619 HydrophobicContact CB-CB 4.13Å; L607-L619 HydrophobicContact CD1-CB 4.39Å; L607-L619 PolarHBondContact N-O 3.33Å; L607-L619 PolarHBondContact O-N 3.16Å; I609-L619 HydrophobicContact CD1-CD1 3.36Å; I609-L619 HydrophobicContact CD1-CG 3.75Å; F617-L619 HydrophobicContact CB-CD2 4.29Å; L619-R625 CarbonylContact C-O 3.56Å; L619-R625 VanDerWaalsContact CA-O 3.29Å; L619-R625 WeakPolarHBondContact CA-O 3.31Å; L619-I626 HydrophobicContact CD2-CB 3.96Å; L619-I626 HydrophobicContact CD2-CG1 3.32Å; L619-I626 HydrophobicContact CD2-CG2 4.48Å; L619-L1086 HydrophobicContact CD1-CD1 4.31Å
620	E	91.3	Very high	91.2	Very high	12 Å²	12	19.8 Å²	19.8	6%	0.056	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	125.7	168.9	165.8	166.7	-146.7	0	0	110.3	H604 E622 G624 R625 V627	H604-E620 IonicContact CE1-OE1 2.71Å; H604-E620 PolarHBondContact CE1-OE1 3.06Å; H604-E620 VanDerWaalsContact CE1-OE1 3.27Å; H604-E620 WeakPolarHBondContact NE2-CG 3.39Å; H604-E620 IonicContact NE2-OE1 2.81Å; H604-E620 PolarHBondContact NE2-OE1 2.99Å; E620-E622 VanDerWaalsContact C-N 3.31Å; E620-E622 HydrophobicContact CG-CB 4.2Å; E620-E622 PolarHBondContact O-N 3.29Å; E620-G624 WeakPolarHBondContact O-CA 3.5Å; E620-G624 PolarHBondContact O-N 2.79Å; E620-R625 HydrophobicContact CB-CB 4.45Å; E620-R625 PolarHBondContact N-O 3.5Å; E620-R625 IonicContact OE2-CZ 2.84Å; E620-R625 IonicContact OE2-NE 2.8Å; E620-R625 PolarHBondContact OE2-NE 3.18Å; E620-R625 IonicContact OE2-NH2 3.64Å; E620-R625 PolarHBondContact OE2-NH2 3.12Å; E620-V627 HydrophobicContact CB-CG2 4.01Å
621	S	91.3	Very high	91	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-33.1	-178.3	65.8	0	0	0	0	113.3	W28 V603 H604 K605 F1088	W28-S621 PolarHBondContact NE1-O 2.96Å; V603-S621 PolarHBondContact O-OG 3.29Å; H604-S621 WeakPolarHBondContact CA-OG 3.18Å; K605-S621 PolarHBondContact N-OG 2.94Å; K605-S621 WeakPolarHBondContact O-CB 3.46Å; K605-S621 PolarHBondContact O-N 3.28Å; K605-S621 PolarHBondContact O-OG 2.94Å; S621-F1088 WeakPolarHBondContact O-CD1 3.4Å; S621-F1088 WeakPolarHBondContact O-CE1 3.49Å; S621-F1088 WeakPolarHBondContact O-CZ 3.42Å
622	E	84.4	Confident	90.7	Very high	65 Å²	65	20.6 Å²	20.6	30%	0.304	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-42.1	-176.1	-172.8	-169.3	127.2	0	0	112.2	W28 E620	W28-E622 VanDerWaalsContact CD1-O 3.27Å; E620-E622 VanDerWaalsContact C-N 3.31Å; E620-E622 HydrophobicContact CG-CB 4.2Å; E620-E622 PolarHBondContact O-N 3.29Å
623	R	84.4	Confident	90.1	Very high	170 Å²	170	21.7 Å²	21.7	64%	0.642	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126	-3.1	-169.7	-58.4	-178.9	-175	-143.8	-5.6	114.4	R625	R623-R625 PolarHBondContact O-N 3.22Å
624	G	87.9	Confident	89.6	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.099	C	C	.	.			trans	66.2	15.9	-173.9	0	0	0	0	0	114	W28 Q30 E620	W28-G624 VanDerWaalsContact CE2-N 3.26Å; W28-G624 VanDerWaalsContact NE1-N 3.18Å; Q30-G624 PolarHBondContact NE2-O 2.92Å; E620-G624 WeakPolarHBondContact O-CA 3.5Å; E620-G624 PolarHBondContact O-N 2.79Å
625	R	87.9	Confident	89.5	Confident	62 Å²	62	21.4 Å²	21.4	23%	0.234	10%	0.098	C	C	.	.			trans	-72.3	136.9	-176.4	-179.7	178.8	62.2	124.7	0.5	110.6	L619 E620 R623 V627	L619-R625 CarbonylContact C-O 3.56Å; L619-R625 VanDerWaalsContact CA-O 3.29Å; L619-R625 WeakPolarHBondContact CA-O 3.31Å; E620-R625 HydrophobicContact CB-CB 4.45Å; E620-R625 PolarHBondContact N-O 3.5Å; E620-R625 IonicContact OE2-CZ 2.84Å; E620-R625 IonicContact OE2-NE 2.8Å; E620-R625 PolarHBondContact OE2-NE 3.18Å; E620-R625 IonicContact OE2-NH2 3.64Å; E620-R625 PolarHBondContact OE2-NH2 3.12Å; R623-R625 PolarHBondContact O-N 3.22Å; R625-V627 PolarHBondContact O-N 3.13Å
626	I	90.5	Very high	89.3	Confident	33 Å²	33	26.4 Å²	26.4	17%	0.169	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	112	170.6	-56.9	165.2	0	0	0	109.4	E431 L434 F617 L619 W628 D629	E431-I626 HydrophobicContact CB-CD1 4.32Å; E431-I626 HydrophobicContact CG-CD1 3.71Å; L434-I626 HydrophobicContact CD1-CD1 4.26Å; F617-I626 HydrophobicContact CD1-CD1 4.21Å; F617-I626 HydrophobicContact CD1-CG1 4.31Å; F617-I626 HydrophobicContact CD1-CG2 3.98Å; F617-I626 HydrophobicContact CE1-CD1 4.19Å; L619-I626 HydrophobicContact CD2-CB 3.96Å; L619-I626 HydrophobicContact CD2-CG1 3.32Å; L619-I626 HydrophobicContact CD2-CG2 4.48Å; I626-W628 WeakPolarHBondContact CG2-O 3.24Å; I626-D629 HydrophobicContact CG2-CB 4.42Å
627	V	88.6	Confident	89	Confident	9 Å²	9	28.6 Å²	28.6	6%	0.055	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-47.8	175.3	-179.4	0	0	0	0	110.2	L596 M606 G618 E620 R625	L596-V627 HydrophobicContact CD1-CG1 3.67Å; L596-V627 HydrophobicContact CD2-CG1 3.93Å; L596-V627 HydrophobicContact CD2-CG2 4.06Å; L596-V627 HydrophobicContact CG-CG1 4.45Å; M606-V627 HydrophobicContact CE-CB 4.02Å; M606-V627 HydrophobicContact CE-CG1 4.01Å; M606-V627 HydrophobicContact CE-CG2 4.22Å; M606-V627 HydrophobicContact SD-CB 4.49Å; M606-V627 HydrophobicContact SD-CG2 4.39Å; G618-V627 WeakPolarHBondContact O-CB 3.13Å; G618-V627 PolarHBondContact O-N 3.47Å; E620-V627 HydrophobicContact CB-CG2 4.01Å; R625-V627 PolarHBondContact O-N 3.13Å
628	W	91.6	Very high	88.5	Confident	1 Å²	1	29.6 Å²	29.6	0%	0.004	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	157.2	176.6	58.9	-101.1	0	0	0	110	W548 F550 M606 V608 L616 G618 I626 F677 P679 I680	W548-W628 HydrophobicContact CB-CB 4.3Å; F550-W628 HydrophobicContact CE2-CB 4.35Å; M606-W628 VanDerWaalsContact CE-NE1 3.33Å; V608-W628 HydrophobicContact CG1-CH2 4.25Å; V608-W628 HydrophobicContact CG1-CZ2 4.45Å; V608-W628 HydrophobicContact CG2-CZ2 4.12Å; L616-W628 HydrophobicContact CB-CH2 4.23Å; L616-W628 HydrophobicContact CB-CZ3 3.8Å; G618-W628 VanDerWaalsContact CA-CE2 3.47Å; G618-W628 PolarHBondContact N-O 3.05Å; G618-W628 PolarHBondContact O-N 2.97Å; I626-W628 WeakPolarHBondContact CG2-O 3.24Å; W628-F677 HydrophobicContact CH2-CD2 4.26Å; W628-F677 AromaticContact CH2-CE2 3.76Å; W628-F677 HydrophobicContact CH2-CE2 3.76Å; W628-F677 HydrophobicContact CZ2-CE2 4.23Å; W628-P679 VanDerWaalsContact CZ2-O 3.24Å; W628-P679 WeakPolarHBondContact CZ2-O 3.37Å; W628-P679 PolarHBondContact NE1-O 3.41Å; W628-I680 PolarHBondContact NE1-O 2.69Å
629	D	91.5	Very high	87.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	157.4	166.9	65.4	38	0	0	0	110.2	H385 R547 K615 L616 F617 I626	H385-D629 IonicContact CD2-OD1 3.27Å; H385-D629 PolarHBondContact CD2-OD1 2.81Å; H385-D629 IonicContact CG-OD1 2.67Å; H385-D629 IonicContact NE2-OD1 3.17Å; R547-D629 WeakPolarHBondContact CD-OD2 3.37Å; R547-D629 IonicContact CZ-OD2 3.87Å; R547-D629 IonicContact NE-OD2 3.79Å; R547-D629 IonicContact NH1-OD2 2.61Å; R547-D629 PolarHBondContact NH1-OD2 2.79Å; K615-D629 IonicContact NZ-OD2 3.28Å; L616-D629 CarbonylContact O-C 3.53Å; L616-D629 VanDerWaalsContact O-CA 3.23Å; L616-D629 WeakPolarHBondContact O-CA 3.34Å; F617-D629 HydrophobicContact CD1-CB 3.58Å; F617-D629 HydrophobicContact CE1-CB 3.77Å; F617-D629 HydrophobicContact CG-CB 4.39Å; I626-D629 HydrophobicContact CG2-CB 4.42Å
630	Y	90.3	Very high	86.7	Confident	14 Å²	14	39.1 Å²	39.1	6%	0.055	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	115.8	177.3	-170.9	-89.8	0	0	0	109.6	F550 L616 V632 F675 P684	F550-Y630 HydrophobicContact CB-CD2 4.22Å; F550-Y630 HydrophobicContact CB-CE2 4.42Å; F550-Y630 HydrophobicContact CD2-CD2 4.31Å; L616-Y630 PolarHBondContact N-O 3.45Å; L616-Y630 PolarHBondContact O-N 3.29Å; Y630-V632 HydrophobicContact CD1-CG2 3.82Å; Y630-V632 HydrophobicContact CE1-CG2 3.88Å; Y630-F675 AromaticContact CD1-CE1 3.89Å; Y630-F675 HydrophobicContact CD1-CE1 3.89Å; Y630-F675 AromaticContact CD1-CZ 3.81Å; Y630-F675 HydrophobicContact CD1-CZ 3.81Å; Y630-F675 AromaticContact CE1-CE1 3.82Å; Y630-F675 HydrophobicContact CE1-CE1 3.82Å; Y630-F675 HydrophobicContact CE1-CE2 4.01Å; Y630-F675 AromaticContact CE1-CZ 3.34Å; Y630-F675 HydrophobicContact CE1-CZ 3.34Å; Y630-F675 AromaticContact CZ-CZ 3.81Å; Y630-P684 HydrophobicContact CE2-CG 4.22Å
631	F	90.8	Very high	86.1	Confident	9 Å²	9	45.9 Å²	45.9	4%	0.039	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.8	173.8	-179	-126.5	0	0	0	110	H385 E413 D414 K615 P633	H385-F631 WeakPolarHBondContact O-CB 3.31Å; E413-F631 HydrophobicContact CB-CZ 4.46Å; E413-F631 HydrophobicContact CG-CE1 4.39Å; E413-F631 HydrophobicContact CG-CZ 4.02Å; D414-F631 HydrophobicContact CB-CD2 3.85Å; D414-F631 HydrophobicContact CB-CE2 3.98Å; D414-F631 HydrophobicContact CB-CG 4.19Å; D414-F631 HydrophobicContact CB-CZ 4.43Å; K615-F631 HydrophobicContact CB-CD2 4.12Å; K615-F631 HydrophobicContact CG-CB 4.46Å; F631-P633 HydrophobicContact CD1-CG 4.32Å; F631-P633 HydrophobicContact CE1-CB 4.39Å; F631-P633 HydrophobicContact CE1-CG 4.47Å; F631-P633 VanDerWaalsContact O-CD 3.27Å; F631-P633 WeakPolarHBondContact O-CD 3.29Å
632	V	88.5	Confident	85.7	Confident	9 Å²	9	51.9 Å²	51.9	6%	0.055	26%	0.258	C	S	.	.			trans	-93.9	103	173	-174.7	0	0	0	0	108.1	G614 L616 Y630 A635 L662 F664 F675	G614-V632 PolarHBondContact O-N 2.81Å; L616-V632 HydrophobicContact CD1-CG2 4.3Å; Y630-V632 HydrophobicContact CD1-CG2 3.82Å; Y630-V632 HydrophobicContact CE1-CG2 3.88Å; V632-A635 HydrophobicContact CB-CB 4.09Å; V632-A635 HydrophobicContact CG1-CB 4.07Å; V632-A635 WeakPolarHBondContact O-CB 3.41Å; V632-A635 PolarHBondContact O-N 2.92Å; V632-L662 HydrophobicContact CG2-CD2 4.45Å; V632-F664 HydrophobicContact CG1-CE1 4.08Å; V632-F664 HydrophobicContact CG1-CE2 4.14Å; V632-F664 HydrophobicContact CG1-CZ 3.59Å; V632-F675 HydrophobicContact CG2-CD1 4.03Å; V632-F675 HydrophobicContact CG2-CE1 4.15Å
633	P	80.3	Confident	85.8	Confident	46 Å²	46	49.1 Å²	49.1	30%	0.299	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	145.4	-176.5	-19.8	33.7	0	0	0	110.4	F631 A635	F631-P633 HydrophobicContact CD1-CG 4.32Å; F631-P633 HydrophobicContact CE1-CB 4.39Å; F631-P633 HydrophobicContact CE1-CG 4.47Å; F631-P633 VanDerWaalsContact O-CD 3.27Å; F631-P633 WeakPolarHBondContact O-CD 3.29Å; P633-A635 PolarHBondContact O-N 3.1Å
634	S	80.5	Confident	86	Confident	19 Å²	19	42.3 Å²	42.3	13%	0.133	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	15.9	-179.9	-48.8	0	0	0	0	115.6	S666 K667 K668	S634-S666 CarbonylContact O-C 3.57Å; S634-S666 WeakPolarHBondContact O-CA 3.32Å; S634-K667 WeakPolarHBondContact O-CG 3.33Å; S634-K667 PolarHBondContact O-N 3.22Å; S634-K668 WeakPolarHBondContact OG-CE 3.44Å
635	A	87.4	Confident	86.3	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	131.9	171.4	0	0	0	0	0	111.2	V632 P633 F643 F664 K667	V632-A635 HydrophobicContact CB-CB 4.09Å; V632-A635 HydrophobicContact CG1-CB 4.07Å; V632-A635 WeakPolarHBondContact O-CB 3.41Å; V632-A635 PolarHBondContact O-N 2.92Å; P633-A635 PolarHBondContact O-N 3.1Å; A635-F643 HydrophobicContact CB-CZ 4.47Å; A635-F664 HydrophobicContact CB-CD2 3.58Å; A635-F664 HydrophobicContact CB-CE2 3.8Å; A635-F664 HydrophobicContact CB-CG 4.12Å; A635-K667 WeakPolarHBondContact O-CE 3.38Å
636	K	89.3	Confident	86.6	Confident	105 Å²	105	41.5 Å²	41.5	46%	0.457	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.8	176.8	-174.7	177.6	178.9	174.6	0	109.4	F643 R665 K667	K636-F643 WeakPolarHBondContact O-CE1 3.49Å; K636-R665 WeakPolarHBondContact CA-O 3.29Å; K636-R665 HydrophobicContact CB-CB 4.48Å; K636-R665 VanDerWaalsContact CB-O 3.29Å; K636-R665 WeakPolarHBondContact CB-O 3.4Å; K636-R665 PolarHBondContact N-O 2.76Å; K636-R665 PolarHBondContact O-N 3.01Å; K636-R665 VanDerWaalsContact O-O 3.1Å; K636-K667 HydrophobicContact CB-CG 3.74Å; K636-K667 HydrophobicContact CD-CG 4.44Å; K636-K667 HydrophobicContact CG-CG 4.49Å
637	L	88.5	Confident	86.7	Confident	47 Å²	47	42.6 Å²	42.6	25%	0.246	23%	0.228	C	C	.	.			trans	-52.2	147.7	174.7	-63.9	172.7	0	0	0	112.2	V438 F643	V438-L637 HydrophobicContact CB-CD2 4.41Å; V438-L637 HydrophobicContact CG1-CD2 3.87Å; V438-L637 HydrophobicContact CG2-CD2 4.03Å; L637-F643 HydrophobicContact CD2-CD1 4.14Å; L637-F643 HydrophobicContact CD2-CD2 3.77Å; L637-F643 HydrophobicContact CD2-CE1 3.93Å; L637-F643 HydrophobicContact CD2-CE2 3.56Å; L637-F643 HydrophobicContact CD2-CG 4.05Å; L637-F643 HydrophobicContact CD2-CZ 3.66Å; L637-F643 HydrophobicContact CG-CE2 4.48Å; L637-F643 HydrophobicContact CG-CZ 4.23Å
638	L	85.4	Confident	86.8	Confident	20 Å²	20	42.2 Å²	42.2	11%	0.105	23%	0.226	C	C	.	.			trans	-69.5	172.6	172.2	-61	168.9	0	0	0	110.2	N640 E641 K642 L663 R665 R672	L638-N640 WeakPolarHBondContact CB-OD1 3.35Å; L638-N640 PolarHBondContact O-N 3.32Å; L638-N640 VanDerWaalsContact O-N 3.1Å; L638-E641 PolarHBondContact O-N 2.87Å; L638-K642 VanDerWaalsContact CB-O 3.29Å; L638-K642 WeakPolarHBondContact CB-O 3.4Å; L638-K642 WeakPolarHBondContact CG-O 2.96Å; L638-K642 PolarHBondContact N-O 2.83Å; L638-L663 HydrophobicContact CD1-CD2 4.16Å; L638-L663 HydrophobicContact CD1-CG 4.14Å; L638-L663 HydrophobicContact CD2-CG 4.46Å; L638-R665 HydrophobicContact CD2-CB 4.46Å; L638-R672 HydrophobicContact CD2-CG 4.44Å
639	A	74.5	Confident	86.8	Confident	99 Å²	99	42.2 Å²	42.2	82%	0.818	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.3	-178.3	0	0	0	0	0	114.2	E641	A639-E641 VanDerWaalsContact C-N 3.26Å
640	N	75.6	Confident	86.6	Confident	101 Å²	101	45.4 Å²	45.4	54%	0.54	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	14.6	174.3	66.4	-11.5	0	0	0	113.1	L638 K642	L638-N640 WeakPolarHBondContact CB-OD1 3.35Å; L638-N640 PolarHBondContact O-N 3.32Å; L638-N640 VanDerWaalsContact O-N 3.1Å; N640-K642 PolarHBondContact O-N 3.07Å; N640-K642 VanDerWaalsContact O-N 3.12Å; N640-K642 PolarHBondContact OD1-N 3.03Å; N640-K642 PolarHBondContact OD1-O 3.06Å
641	E	79.7	Confident	86.1	Confident	155 Å²	155	46.7 Å²	46.7	72%	0.724	25%	0.251	S	S	*	.	S	Bend	trans	57.9	22.6	-177.6	-58.1	-178.6	165.5	0	0	114.1	L638 A639	L638-E641 PolarHBondContact O-N 2.87Å; A639-E641 VanDerWaalsContact C-N 3.26Å
642	K	82.6	Confident	85.5	Confident	125 Å²	125	49.7 Å²	49.7	54%	0.543	28%	0.277	S	S	.	.			trans	-123.4	155.1	179.6	-67	-177.6	-178.9	-175	0	112.3	V438 L638 N640	V438-K642 VanDerWaalsContact CG1-CA 3.47Å; V438-K642 HydrophobicContact CG1-CB 4.13Å; V438-K642 HydrophobicContact CG1-CG 4.28Å; L638-K642 VanDerWaalsContact CB-O 3.29Å; L638-K642 WeakPolarHBondContact CB-O 3.4Å; L638-K642 WeakPolarHBondContact CG-O 2.96Å; L638-K642 PolarHBondContact N-O 2.83Å; N640-K642 PolarHBondContact O-N 3.07Å; N640-K642 VanDerWaalsContact O-N 3.12Å; N640-K642 PolarHBondContact OD1-N 3.03Å; N640-K642 PolarHBondContact OD1-O 3.06Å
643	F	86.2	Confident	84.8	Confident	8 Å²	8	52 Å²	52	4%	0.035	29%	0.287	C	S	.	.			trans	-92.9	151	155.7	-69.7	-45.7	0	0	0	109.2	V438 A610 T611 A635 K636 L637 L662 F664	V438-F643 HydrophobicContact CB-CD2 4.4Å; V438-F643 HydrophobicContact CG1-CB 4.41Å; V438-F643 HydrophobicContact CG1-CD2 4.44Å; V438-F643 VanDerWaalsContact CG1-N 3.28Å; A610-F643 HydrophobicContact CB-CB 4.49Å; A610-F643 HydrophobicContact CB-CD2 4.24Å; T611-F643 WeakPolarHBondContact O-CE2 3.35Å; A635-F643 HydrophobicContact CB-CZ 4.47Å; K636-F643 WeakPolarHBondContact O-CE1 3.49Å; L637-F643 HydrophobicContact CD2-CD1 4.14Å; L637-F643 HydrophobicContact CD2-CD2 3.77Å; L637-F643 HydrophobicContact CD2-CE1 3.93Å; L637-F643 HydrophobicContact CD2-CE2 3.56Å; L637-F643 HydrophobicContact CD2-CG 4.05Å; L637-F643 HydrophobicContact CD2-CZ 3.66Å; L637-F643 HydrophobicContact CG-CE2 4.48Å; L637-F643 HydrophobicContact CG-CZ 4.23Å; F643-L662 HydrophobicContact CB-CD1 3.79Å; F643-L662 HydrophobicContact CG-CD1 4.16Å; F643-F664 HydrophobicContact CD1-CB 3.57Å; F643-F664 HydrophobicContact CE1-CB 3.36Å; F643-F664 HydrophobicContact CZ-CB 4.43Å
644	A	89.4	Confident	84.2	Confident	26 Å²	26	56.7 Å²	56.7	22%	0.215	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.7	172.7	0	0	0	0	0	109.4	F646 L663	A644-F646 HydrophobicContact CB-CD2 4.43Å; A644-F646 HydrophobicContact CB-CE2 3.57Å; A644-F646 HydrophobicContact CB-CZ 3.67Å; A644-L663 HydrophobicContact CB-CB 4.26Å; A644-L663 PolarHBondContact N-O 2.92Å; A644-L663 PolarHBondContact O-N 2.94Å
645	L	93.4	Very high	83.8	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.084	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.3	172	-73.8	169.5	0	0	0	108.5	A439 E441 V608 A610 M660 S661 L662 F677	A439-L645 HydrophobicContact CB-CD1 3.94Å; A439-L645 HydrophobicContact CB-CG 4.23Å; E441-L645 HydrophobicContact CG-CB 3.93Å; E441-L645 HydrophobicContact CG-CD1 4.29Å; V608-L645 HydrophobicContact CG1-CD1 4.39Å; A610-L645 HydrophobicContact CB-CD1 4.34Å; L645-M660 HydrophobicContact CB-SD 4.12Å; L645-M660 HydrophobicContact CD2-CG 4.11Å; L645-S661 WeakPolarHBondContact CA-O 3.28Å; L645-L662 HydrophobicContact CD2-CB 4.2Å; L645-L662 HydrophobicContact CD2-CD1 3.69Å; L645-L662 HydrophobicContact CG-CD1 4.19Å; L645-F677 HydrophobicContact CD2-CE1 4.39Å; L645-F677 HydrophobicContact CD2-CZ 4.21Å
646	F	93.6	Very high	83.6	Confident	29 Å²	29	63.1 Å²	63.1	13%	0.127	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	116.6	178.6	-59.8	-77.7	0	0	0	111.1	A644 Q648 M660 S661 L663 T702 L704 L719	A644-F646 HydrophobicContact CB-CD2 4.43Å; A644-F646 HydrophobicContact CB-CE2 3.57Å; A644-F646 HydrophobicContact CB-CZ 3.67Å; F646-Q648 PolarHBondContact O-N 3.17Å; F646-Q648 VanDerWaalsContact O-N 3.13Å; F646-M660 WeakPolarHBondContact O-CA 2.81Å; F646-S661 PolarHBondContact N-O 3.28Å; F646-S661 PolarHBondContact O-N 3.34Å; F646-L663 HydrophobicContact CE2-CB 4.01Å; F646-L663 HydrophobicContact CE2-CD2 4.22Å; F646-T702 HydrophobicContact CD2-CG2 4.38Å; F646-T702 HydrophobicContact CE1-CG2 4.17Å; F646-T702 HydrophobicContact CE2-CG2 3.67Å; F646-T702 HydrophobicContact CZ-CG2 3.55Å; F646-L704 HydrophobicContact CD1-CB 4.06Å; F646-L719 HydrophobicContact CB-CD1 4.23Å; F646-L719 HydrophobicContact CB-CD2 3.72Å; F646-L719 HydrophobicContact CD1-CD2 3.8Å; F646-L719 HydrophobicContact CD2-CD1 3.92Å; F646-L719 HydrophobicContact CD2-CD2 4.05Å; F646-L719 HydrophobicContact CE1-CD2 4.41Å; F646-L719 HydrophobicContact CG-CD1 4.19Å; F646-L719 HydrophobicContact CG-CD2 3.59Å
647	Q	92.6	Very high	83.4	Confident	56 Å²	56	61.2 Å²	61.2	26%	0.262	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	95.6	174	-169.5	-179.9	21.2	0	0	109.4	M660 L704	Q647-M660 VanDerWaalsContact CA-SD 3.6Å; Q647-M660 HydrophobicContact CB-CE 3.82Å; Q647-M660 HydrophobicContact CB-SD 4.03Å; Q647-M660 HydrophobicContact CG-CE 4.19Å; Q647-M660 PolarHBondContact N-SD 2.86Å; Q647-L704 WeakPolarHBondContact O-CD2 3.4Å
648	Q	91.8	Very high	83.5	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-38.5	179.8	-62.3	-162.8	-84.9	0	0	111.8	F646 I659 S661 L704 I716 R717 L719 Y731	F646-Q648 PolarHBondContact O-N 3.17Å; F646-Q648 VanDerWaalsContact O-N 3.13Å; Q648-I659 HydrophobicContact CB-CB 4.41Å; Q648-I659 HydrophobicContact CB-CG2 4.26Å; Q648-I659 PolarHBondContact N-O 3.43Å; Q648-S661 PolarHBondContact OE1-OG 3.39Å; Q648-L704 HydrophobicContact CG-CD1 4.33Å; Q648-I716 HydrophobicContact CB-CG2 4.09Å; Q648-R717 PolarHBondContact NE2-O 2.89Å; Q648-R717 VanDerWaalsContact NE2-O 3.14Å; Q648-R717 WeakPolarHBondContact O-CB 3.19Å; Q648-R717 PolarHBondContact O-N 2.76Å; Q648-L719 HydrophobicContact CG-CG 4.33Å; Q648-Y731 PolarHBondContact NE2-O 3.04Å
649	R	90.9	Very high	83.8	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.008	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	130.6	176.1	-170.6	163.9	65.8	-154.5	-3.2	110.5	P657 P658 I659 E687 E714	R649-P657 PolarHBondContact NE-O 2.86Å; R649-P657 VanDerWaalsContact NH2-CD 3.32Å; R649-P657 PolarHBondContact NH2-O 2.95Å; R649-P658 WeakPolarHBondContact O-CA 3.35Å; R649-I659 HydrophobicContact CB-CB 4.22Å; R649-I659 HydrophobicContact CB-CG1 4.43Å; R649-I659 PolarHBondContact N-O 2.76Å; R649-I659 VanDerWaalsContact N-O 3.11Å; R649-I659 PolarHBondContact O-N 3.02Å; R649-E687 IonicContact CZ-OE1 2.78Å; R649-E687 VanDerWaalsContact CZ-OE1 3.26Å; R649-E687 IonicContact NH1-OE1 3.63Å; R649-E687 PolarHBondContact NH1-OE1 2.98Å; R649-E687 IonicContact NH2-OE1 3.33Å; R649-E687 PolarHBondContact NH2-OE1 3.09Å; R649-E714 PolarHBondContact NH1-O 2.78Å
650	N	86.7	Confident	84.8	Confident	66 Å²	66	53.8 Å²	53.8	35%	0.353	29%	0.287	S	S	.	.			trans	-90.4	-174.2	176	66.8	3	0	0	0	110.9	A652 H653	N650-A652 PolarHBondContact OD1-N 2.86Å; N650-H653 PolarHBondContact OD1-CD2 2.99Å
651	L	81.3	Confident	85.7	Confident	42 Å²	42	49 Å²	49	22%	0.22	26%	0.261	C	S	.	.	S	Bend	trans	-90.9	2.7	-178.4	-77	150.8	0	0	0	114.3	I443 D444 P446 H653 P658 I680	I443-L651 HydrophobicContact CG2-CD1 4.25Å; D444-L651 WeakPolarHBondContact O-CD1 3.4Å; P446-L651 HydrophobicContact CB-CD2 4Å; L651-H653 PolarHBondContact O-N 2.86Å; L651-P658 HydrophobicContact CD2-CB 4.26Å; L651-P658 HydrophobicContact CD2-CG 3.74Å; L651-P658 HydrophobicContact CG-CB 4.05Å; L651-P658 HydrophobicContact CG-CG 4.01Å; L651-I680 HydrophobicContact CD1-CD1 4.01Å; L651-I680 HydrophobicContact CD1-CG1 4.02Å; L651-I680 HydrophobicContact CD2-CG1 4.47Å
652	A	76.4	Confident	86.3	Confident	71 Å²	71	41.7 Å²	41.7	59%	0.587	23%	0.227	S	C	*	.	S	Bend	trans	-70.5	-15.8	-176.7	0	0	0	0	0	113.3	N650	N650-A652 PolarHBondContact OD1-N 2.86Å
653	H	74.3	Confident	86.8	Confident	59 Å²	59	36 Å²	36	27%	0.273	20%	0.203	S	C	.	.	S	Bend	trans	-114	63	-170.7	-55.7	-66.1	0	0	0	111.9	N650 L651 L656 F715	N650-H653 PolarHBondContact OD1-CD2 2.99Å; L651-H653 PolarHBondContact O-N 2.86Å; H653-L656 HydrophobicContact CB-CD1 4.48Å; H653-L656 VanDerWaalsContact O-CB 3.28Å; H653-L656 WeakPolarHBondContact O-CB 3.14Å; H653-L656 PolarHBondContact O-N 3.2Å; H653-F715 HydrophobicContact CB-CB 4.16Å; H653-F715 HydrophobicContact CB-CD2 4.05Å; H653-F715 HydrophobicContact CB-CG 4.05Å; H653-F715 VanDerWaalsContact CD2-CB 3.46Å; H653-F715 WeakPolarHBondContact CD2-CB 3.14Å; H653-F715 AromaticContact CD2-CD1 3.79Å; H653-F715 AromaticContact CD2-CG 3.68Å; H653-F715 AromaticContact CE1-CD1 3.3Å; H653-F715 WeakPolarHBondContact CE1-CD1 2.86Å; H653-F715 AromaticContact CE1-CE1 3.6Å; H653-F715 AromaticContact CE1-CG 3.91Å; H653-F715 AromaticContact CG-CD1 3.76Å; H653-F715 AromaticContact CG-CD2 3.96Å; H653-F715 AromaticContact CG-CG 3.53Å; H653-F715 AromaticContact ND1-CD1 3.46Å; H653-F715 WeakPolarHBondContact ND1-CD1 3.4Å; H653-F715 AromaticContact ND1-CE1 3.65Å; H653-F715 AromaticContact ND1-CG 3.7Å; H653-F715 AromaticContact NE2-CD1 3.51Å; H653-F715 AromaticContact NE2-CG 3.92Å
654	F	68.2	Low	87.1	Confident	143 Å²	143	36 Å²	36	63%	0.627	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	138.9	172.7	-175	-97.1	0	0	0	110.7
655	P	72.6	Confident	87.2	Confident	101 Å²	101	38.2 Å²	38.2	66%	0.656	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	cis	-93.2	15.9	7.3	37.7	-36.8	0	0	0	115.4
656	L	82.8	Confident	87	Confident	54 Å²	54	38.2 Å²	38.2	28%	0.283	21%	0.207	S	C	.	.	S	Bend	trans	-72.6	132.4	-175.3	-58.5	172.1	0	0	0	111.4	H653 E714 F715	H653-L656 HydrophobicContact CB-CD1 4.48Å; H653-L656 VanDerWaalsContact O-CB 3.28Å; H653-L656 WeakPolarHBondContact O-CB 3.14Å; H653-L656 PolarHBondContact O-N 3.2Å; L656-E714 WeakPolarHBondContact CD1-O 3.47Å; L656-F715 HydrophobicContact CD1-CD2 3.8Å
657	P	84.9	Confident	86.5	Confident	65 Å²	65	42.3 Å²	42.3	42%	0.422	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-70.9	143.4	-177.4	25.7	-32.1	0	0	0	111.6	R649	R649-P657 PolarHBondContact NE-O 2.86Å; R649-P657 VanDerWaalsContact NH2-CD 3.32Å; R649-P657 PolarHBondContact NH2-O 2.95Å
658	P	90.6	Very high	86.1	Confident	9 Å²	9	47.9 Å²	47.9	6%	0.058	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-66.1	151	176.2	29.1	-35.4	0	0	0	111.5	R649 L651 P679 I680	R649-P658 WeakPolarHBondContact O-CA 3.35Å; L651-P658 HydrophobicContact CD2-CB 4.26Å; L651-P658 HydrophobicContact CD2-CG 3.74Å; L651-P658 HydrophobicContact CG-CB 4.05Å; L651-P658 HydrophobicContact CG-CG 4.01Å; P658-P679 HydrophobicContact CB-CG 3.76Å; P658-P679 HydrophobicContact CG-CG 3.99Å; P658-P679 WeakPolarHBondContact O-CD 3.29Å; P658-I680 HydrophobicContact CG-CG1 4.06Å
659	I	92.2	Very high	85.7	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.3	-178.8	-58.9	174.4	0	0	0	109.4	Q648 R649 E687 M690 I716	Q648-I659 HydrophobicContact CB-CB 4.41Å; Q648-I659 HydrophobicContact CB-CG2 4.26Å; Q648-I659 PolarHBondContact N-O 3.43Å; R649-I659 HydrophobicContact CB-CB 4.22Å; R649-I659 HydrophobicContact CB-CG1 4.43Å; R649-I659 PolarHBondContact N-O 2.76Å; R649-I659 VanDerWaalsContact N-O 3.11Å; R649-I659 PolarHBondContact O-N 3.02Å; I659-E687 VanDerWaalsContact CD1-CD 3.44Å; I659-E687 HydrophobicContact CD1-CG 4.19Å; I659-E687 VanDerWaalsContact CD1-OE2 3.24Å; I659-E687 WeakPolarHBondContact CD1-OE2 3.37Å; I659-M690 HydrophobicContact CD1-CE 4.39Å; I659-M690 HydrophobicContact CD1-SD 4.41Å; I659-M690 HydrophobicContact CG2-CE 3.95Å; I659-I716 HydrophobicContact CD1-CD1 4.29Å; I659-I716 HydrophobicContact CD1-CG1 4.45Å
660	M	94.6	Very high	85.3	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.1	172	-176.5	71.3	76	0	0	108.6	E441 I443 L645 F646 Q647 S676 F677 P679	E441-M660 HydrophobicContact CB-CE 3.89Å; E441-M660 HydrophobicContact CG-CE 4.24Å; I443-M660 HydrophobicContact CD1-CE 3.36Å; I443-M660 HydrophobicContact CG1-CE 4.07Å; L645-M660 HydrophobicContact CB-SD 4.12Å; L645-M660 HydrophobicContact CD2-CG 4.11Å; F646-M660 WeakPolarHBondContact O-CA 2.81Å; Q647-M660 VanDerWaalsContact CA-SD 3.6Å; Q647-M660 HydrophobicContact CB-CE 3.82Å; Q647-M660 HydrophobicContact CB-SD 4.03Å; Q647-M660 HydrophobicContact CG-CE 4.19Å; Q647-M660 PolarHBondContact N-SD 2.86Å; M660-S676 CarbonylContact O-C 3.59Å; M660-S676 VanDerWaalsContact O-CA 3.3Å; M660-S676 WeakPolarHBondContact O-CA 3.43Å; M660-F677 HydrophobicContact CB-CE1 4.21Å; M660-F677 HydrophobicContact CB-CE2 4.16Å; M660-F677 HydrophobicContact CB-CZ 3.94Å; M660-F677 HydrophobicContact CG-CE1 4.01Å; M660-F677 HydrophobicContact CG-CE2 4.28Å; M660-F677 HydrophobicContact CG-CZ 3.65Å; M660-F677 PolarHBondContact N-O 3.26Å; M660-F677 WeakPolarHBondContact O-CD1 3.44Å; M660-F677 PolarHBondContact O-N 3.14Å; M660-P679 HydrophobicContact CB-CB 4.01Å; M660-P679 HydrophobicContact CB-CG 4.14Å
661	S	94.1	Very high	85.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.1	176.6	-58.7	0	0	0	0	111.5	L645 F646 Q648 F675 S676	L645-S661 WeakPolarHBondContact CA-O 3.28Å; F646-S661 PolarHBondContact N-O 3.28Å; F646-S661 PolarHBondContact O-N 3.34Å; Q648-S661 PolarHBondContact OE1-OG 3.39Å; S661-F675 CarbonylContact C-O 3.58Å; S661-F675 WeakPolarHBondContact CA-O 3.33Å; S661-S676 WeakPolarHBondContact OG-CB 3.45Å; S661-S676 PolarHBondContact OG-OG 2.79Å
662	L	93.5	Very high	85.6	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122.1	171.1	-178.9	74.3	0	0	0	109.5	A610 L616 V632 F643 L645 F664 L674 F675 F677	A610-L662 HydrophobicContact CB-CD1 4.11Å; L616-L662 HydrophobicContact CD1-CD2 4.24Å; L616-L662 HydrophobicContact CD2-CD1 4.27Å; L616-L662 HydrophobicContact CD2-CD2 4.08Å; L616-L662 HydrophobicContact CG-CD2 4.35Å; V632-L662 HydrophobicContact CG2-CD2 4.45Å; F643-L662 HydrophobicContact CB-CD1 3.79Å; F643-L662 HydrophobicContact CG-CD1 4.16Å; L645-L662 HydrophobicContact CD2-CB 4.2Å; L645-L662 HydrophobicContact CD2-CD1 3.69Å; L645-L662 HydrophobicContact CG-CD1 4.19Å; L662-F664 HydrophobicContact CD2-CD1 3.89Å; L662-F664 HydrophobicContact CD2-CE1 4.39Å; L662-F664 HydrophobicContact CG-CD1 4.04Å; L662-L674 WeakPolarHBondContact O-CA 3.44Å; L662-F675 PolarHBondContact N-O 2.79Å; L662-F675 PolarHBondContact O-N 2.88Å; L662-F677 HydrophobicContact CB-CE1 4.21Å
663	L	93.4	Very high	86.3	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	124	171	179.4	68.3	0	0	0	110.6	L638 A644 F646 R672 L674 I699 T702	L638-L663 HydrophobicContact CD1-CD2 4.16Å; L638-L663 HydrophobicContact CD1-CG 4.14Å; L638-L663 HydrophobicContact CD2-CG 4.46Å; A644-L663 HydrophobicContact CB-CB 4.26Å; A644-L663 PolarHBondContact N-O 2.92Å; A644-L663 PolarHBondContact O-N 2.94Å; F646-L663 HydrophobicContact CE2-CB 4.01Å; F646-L663 HydrophobicContact CE2-CD2 4.22Å; L663-R672 HydrophobicContact CD1-CB 4.46Å; L663-L674 HydrophobicContact CB-CD2 3.8Å; L663-L674 HydrophobicContact CD1-CD2 3.85Å; L663-L674 HydrophobicContact CD1-CG 3.87Å; L663-L674 HydrophobicContact CG-CD2 4.39Å; L663-I699 HydrophobicContact CD1-CD1 4.48Å; L663-I699 HydrophobicContact CD2-CD1 4.22Å; L663-T702 WeakPolarHBondContact CD2-OG1 3.27Å
664	F	91.9	Very high	87.1	Confident	7 Å²	7	53.3 Å²	53.3	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	175.9	179.9	64.2	-84	0	0	0	112.5	V632 A635 F643 L662 R672 V673 F675	V632-F664 HydrophobicContact CG1-CE1 4.08Å; V632-F664 HydrophobicContact CG1-CE2 4.14Å; V632-F664 HydrophobicContact CG1-CZ 3.59Å; A635-F664 HydrophobicContact CB-CD2 3.58Å; A635-F664 HydrophobicContact CB-CE2 3.8Å; A635-F664 HydrophobicContact CB-CG 4.12Å; F643-F664 HydrophobicContact CD1-CB 3.57Å; F643-F664 HydrophobicContact CE1-CB 3.36Å; F643-F664 HydrophobicContact CZ-CB 4.43Å; L662-F664 HydrophobicContact CD2-CD1 3.89Å; L662-F664 HydrophobicContact CD2-CE1 4.39Å; L662-F664 HydrophobicContact CG-CD1 4.04Å; F664-R672 CarbonylContact O-C 3.59Å; F664-R672 WeakPolarHBondContact O-CA 3.37Å; F664-V673 HydrophobicContact CD2-CB 4.45Å; F664-V673 HydrophobicContact CE1-CB 4.09Å; F664-V673 HydrophobicContact CE1-CG1 4.04Å; F664-V673 HydrophobicContact CE2-CB 3.97Å; F664-V673 HydrophobicContact CE2-CG1 4.36Å; F664-V673 HydrophobicContact CE2-CG2 4.48Å; F664-V673 HydrophobicContact CZ-CB 3.77Å; F664-V673 HydrophobicContact CZ-CG1 3.71Å; F664-V673 PolarHBondContact N-O 2.93Å; F664-V673 PolarHBondContact O-N 3.3Å; F664-F675 HydrophobicContact CE1-CB 3.71Å
665	R	90.7	Very high	88.2	Confident	74 Å²	74	46.9 Å²	46.9	28%	0.279	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.5	172.2	-166.8	176	-163.8	-177.6	-0.6	110.1	K636 L638 N670 R671	K636-R665 WeakPolarHBondContact CA-O 3.29Å; K636-R665 HydrophobicContact CB-CB 4.48Å; K636-R665 VanDerWaalsContact CB-O 3.29Å; K636-R665 WeakPolarHBondContact CB-O 3.4Å; K636-R665 PolarHBondContact N-O 2.76Å; K636-R665 PolarHBondContact O-N 3.01Å; K636-R665 VanDerWaalsContact O-O 3.1Å; L638-R665 HydrophobicContact CD2-CB 4.46Å; R665-N670 VanDerWaalsContact CZ-CG 3.47Å; R665-N670 PolarHBondContact NE-O 3.2Å; R665-N670 PolarHBondContact NE-OD1 3.05Å; R665-N670 PolarHBondContact NH2-ND2 3.07Å; R665-N670 PolarHBondContact NH2-O 2.93Å; R665-N670 PolarHBondContact NH2-OD1 3.19Å; R665-N670 VanDerWaalsContact NH2-OD1 3.07Å; R665-R671 CarbonylContact C-O 3.43Å; R665-R671 WeakPolarHBondContact CA-O 3.46Å
666	S	89.2	Confident	89.2	Confident	15 Å²	15	42 Å²	42	11%	0.105	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.6	175.4	178.8	0	0	0	0	111.1	S634 K668 T669 N670 R671	S634-S666 CarbonylContact O-C 3.57Å; S634-S666 WeakPolarHBondContact O-CA 3.32Å; S666-K668 VanDerWaalsContact C-N 3.26Å; S666-K668 PolarHBondContact O-N 3.22Å; S666-K668 PolarHBondContact OG-N 3.26Å; S666-T669 WeakPolarHBondContact CB-OG1 3.46Å; S666-T669 PolarHBondContact OG-N 3.13Å; S666-N670 WeakPolarHBondContact O-CA 3.07Å; S666-N670 PolarHBondContact O-N 3.46Å; S666-R671 PolarHBondContact N-O 3.02Å
667	K	84.4	Confident	89.6	Confident	116 Å²	116	39.5 Å²	39.5	50%	0.504	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-32.7	170.9	-65.8	-179.3	-171.4	169.3	0	111.8	S634 A635 K636	S634-K667 WeakPolarHBondContact O-CG 3.33Å; S634-K667 PolarHBondContact O-N 3.22Å; A635-K667 WeakPolarHBondContact O-CE 3.38Å; K636-K667 HydrophobicContact CB-CG 3.74Å; K636-K667 HydrophobicContact CD-CG 4.44Å; K636-K667 HydrophobicContact CG-CG 4.49Å
668	K	82.9	Confident	89.8	Confident	172 Å²	172	37.8 Å²	37.8	75%	0.748	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-50	-174.9	-70	178.4	174.3	176.6	0	112.9	S634 S666	S634-K668 WeakPolarHBondContact OG-CE 3.44Å; S666-K668 VanDerWaalsContact C-N 3.26Å; S666-K668 PolarHBondContact O-N 3.22Å; S666-K668 PolarHBondContact OG-N 3.26Å
669	T	83.9	Confident	89.9	Confident	77 Å²	77	37.4 Å²	37.4	47%	0.472	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-8.7	-175.4	61.7	0	0	0	0	113	S666 R671	S666-T669 WeakPolarHBondContact CB-OG1 3.46Å; S666-T669 PolarHBondContact OG-N 3.13Å; T669-R671 PolarHBondContact O-N 3.42Å
670	N	83.3	Confident	89.8	Confident	76 Å²	76	38 Å²	38	41%	0.406	17%	0.173	S	C	.	.			trans	57.5	13	-173.5	-150.4	25.6	0	0	0	114.2	R665 S666	R665-N670 VanDerWaalsContact CZ-CG 3.47Å; R665-N670 PolarHBondContact NE-O 3.2Å; R665-N670 PolarHBondContact NE-OD1 3.05Å; R665-N670 PolarHBondContact NH2-ND2 3.07Å; R665-N670 PolarHBondContact NH2-O 2.93Å; R665-N670 PolarHBondContact NH2-OD1 3.19Å; R665-N670 VanDerWaalsContact NH2-OD1 3.07Å; S666-N670 WeakPolarHBondContact O-CA 3.07Å; S666-N670 PolarHBondContact O-N 3.46Å
671	R	86	Confident	89.4	Confident	140 Å²	140	40.6 Å²	40.6	53%	0.528	19%	0.189	S	C	.	.			trans	-94.5	160.7	178.5	-66.4	-175.6	-178.2	171.1	0.6	111.5	R665 S666 T669 T694	R665-R671 CarbonylContact C-O 3.43Å; R665-R671 WeakPolarHBondContact CA-O 3.46Å; S666-R671 PolarHBondContact N-O 3.02Å; T669-R671 PolarHBondContact O-N 3.42Å; R671-T694 HydrophobicContact CB-CG2 4.15Å
672	R	88.7	Confident	89	Confident	57 Å²	57	40.6 Å²	40.6	22%	0.215	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	139.8	174.6	-62.6	175.3	-165	-150.3	10.1	110.3	L638 L663 F664 L695 D698 I699	L638-R672 HydrophobicContact CD2-CG 4.44Å; L663-R672 HydrophobicContact CD1-CB 4.46Å; F664-R672 CarbonylContact O-C 3.59Å; F664-R672 WeakPolarHBondContact O-CA 3.37Å; R672-L695 HydrophobicContact CB-CB 4.45Å; R672-L695 HydrophobicContact CB-CD1 4.5Å; R672-L695 HydrophobicContact CB-CD2 4.22Å; R672-L695 PolarHBondContact O-N 2.92Å; R672-D698 IonicContact NE-OD1 3.07Å; R672-I699 PolarHBondContact NH1-O 3.26Å; R672-I699 PolarHBondContact NH2-O 3.34Å
673	V	90.2	Very high	88.6	Confident	6 Å²	6	42.6 Å²	42.6	4%	0.036	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135.2	-175.1	-176.1	0	0	0	0	108.6	F664 L692 Y693 T694	F664-V673 HydrophobicContact CD2-CB 4.45Å; F664-V673 HydrophobicContact CE1-CB 4.09Å; F664-V673 HydrophobicContact CE1-CG1 4.04Å; F664-V673 HydrophobicContact CE2-CB 3.97Å; F664-V673 HydrophobicContact CE2-CG1 4.36Å; F664-V673 HydrophobicContact CE2-CG2 4.48Å; F664-V673 HydrophobicContact CZ-CB 3.77Å; F664-V673 HydrophobicContact CZ-CG1 3.71Å; F664-V673 PolarHBondContact N-O 2.93Å; F664-V673 PolarHBondContact O-N 3.3Å; V673-L692 HydrophobicContact CG1-CD1 3.36Å; V673-L692 HydrophobicContact CG1-CG 3.83Å; V673-Y693 WeakPolarHBondContact CA-O 3.37Å; V673-T694 HydrophobicContact CG2-CG2 4.34Å
674	L	91.5	Very high	88.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.7	168.5	-80.9	165.7	0	0	0	108.3	L662 L663 Y693 L695 L719 L721 Y731	L662-L674 WeakPolarHBondContact O-CA 3.44Å; L663-L674 HydrophobicContact CB-CD2 3.8Å; L663-L674 HydrophobicContact CD1-CD2 3.85Å; L663-L674 HydrophobicContact CD1-CG 3.87Å; L663-L674 HydrophobicContact CG-CD2 4.39Å; L674-Y693 HydrophobicContact CD1-CD1 4.41Å; L674-Y693 PolarHBondContact N-O 3.01Å; L674-Y693 PolarHBondContact O-N 3.2Å; L674-L695 HydrophobicContact CD1-CD1 4.17Å; L674-L695 HydrophobicContact CG-CD1 4.22Å; L674-L719 HydrophobicContact CD1-CD1 4.25Å; L674-L719 HydrophobicContact CD2-CD1 3.86Å; L674-L721 HydrophobicContact CD1-CD1 4.12Å; L674-L721 HydrophobicContact CD1-CD2 4.21Å; L674-Y731 HydrophobicContact CD1-CD1 3.82Å; L674-Y731 HydrophobicContact CD1-CD2 4.26Å; L674-Y731 HydrophobicContact CD1-CE1 4.11Å; L674-Y731 HydrophobicContact CD1-CG 3.89Å
675	F	91.2	Very high	87.7	Confident	7 Å²	7	43.9 Å²	43.9	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.3	172.1	170.5	-110.2	0	0	0	108.4	L616 Y630 V632 S661 L662 F664 F677 P684 D691 L692	L616-F675 HydrophobicContact CD1-CD1 4.09Å; L616-F675 HydrophobicContact CD1-CE1 3.88Å; Y630-F675 AromaticContact CD1-CE1 3.89Å; Y630-F675 HydrophobicContact CD1-CE1 3.89Å; Y630-F675 AromaticContact CD1-CZ 3.81Å; Y630-F675 HydrophobicContact CD1-CZ 3.81Å; Y630-F675 AromaticContact CE1-CE1 3.82Å; Y630-F675 HydrophobicContact CE1-CE1 3.82Å; Y630-F675 HydrophobicContact CE1-CE2 4.01Å; Y630-F675 AromaticContact CE1-CZ 3.34Å; Y630-F675 HydrophobicContact CE1-CZ 3.34Å; Y630-F675 AromaticContact CZ-CZ 3.81Å; V632-F675 HydrophobicContact CG2-CD1 4.03Å; V632-F675 HydrophobicContact CG2-CE1 4.15Å; S661-F675 CarbonylContact C-O 3.58Å; S661-F675 WeakPolarHBondContact CA-O 3.33Å; L662-F675 PolarHBondContact N-O 2.79Å; L662-F675 PolarHBondContact O-N 2.88Å; F664-F675 HydrophobicContact CE1-CB 3.71Å; F675-F677 AromaticContact CD1-CD1 3.75Å; F675-F677 HydrophobicContact CD1-CD1 3.75Å; F675-F677 HydrophobicContact CD1-CE1 4.42Å; F675-F677 HydrophobicContact CD1-CG 4.49Å; F675-F677 HydrophobicContact CE1-CB 3.89Å; F675-F677 AromaticContact CE1-CD1 3.7Å; F675-F677 HydrophobicContact CE1-CD1 3.7Å; F675-F677 HydrophobicContact CE1-CG 4Å; F675-F677 HydrophobicContact CZ-CB 4.12Å; F675-P684 HydrophobicContact CE2-CB 3.91Å; F675-P684 HydrophobicContact CE2-CG 3.9Å; F675-P684 HydrophobicContact CZ-CB 4.2Å; F675-P684 HydrophobicContact CZ-CG 3.9Å; F675-D691 WeakPolarHBondContact CD2-O 3.47Å; F675-L692 HydrophobicContact CB-CD1 4.07Å; F675-L692 HydrophobicContact CD2-CD1 4.12Å
676	S	92.8	Very high	86.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.1	179.2	-34.4	0	0	0	0	110.7	M660 S661 S685 M690 D691 Y731	M660-S676 CarbonylContact O-C 3.59Å; M660-S676 VanDerWaalsContact O-CA 3.3Å; M660-S676 WeakPolarHBondContact O-CA 3.43Å; S661-S676 WeakPolarHBondContact OG-CB 3.45Å; S661-S676 PolarHBondContact OG-OG 2.79Å; S676-S685 PolarHBondContact O-N 3.2Å; S676-M690 WeakPolarHBondContact CB-O 3.32Å; S676-M690 PolarHBondContact N-O 2.84Å; S676-M690 PolarHBondContact OG-O 3.46Å; S676-D691 PolarHBondContact N-O 2.93Å; S676-Y731 PolarHBondContact OG-OH 3.2Å
677	F	91.5	Very high	85.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	162.5	-174.4	62.6	-81.3	0	0	0	110.3	V608 L616 W628 L645 M660 L662 F675 P679 V683	V608-F677 HydrophobicContact CG1-CE2 4.03Å; V608-F677 HydrophobicContact CG1-CZ 3.94Å; L616-F677 HydrophobicContact CD1-CD1 4.12Å; L616-F677 HydrophobicContact CD1-CE1 3.74Å; L616-F677 HydrophobicContact CD1-CE2 4.4Å; L616-F677 HydrophobicContact CD1-CZ 3.89Å; W628-F677 HydrophobicContact CH2-CD2 4.26Å; W628-F677 AromaticContact CH2-CE2 3.76Å; W628-F677 HydrophobicContact CH2-CE2 3.76Å; W628-F677 HydrophobicContact CZ2-CE2 4.23Å; L645-F677 HydrophobicContact CD2-CE1 4.39Å; L645-F677 HydrophobicContact CD2-CZ 4.21Å; M660-F677 HydrophobicContact CB-CE1 4.21Å; M660-F677 HydrophobicContact CB-CE2 4.16Å; M660-F677 HydrophobicContact CB-CZ 3.94Å; M660-F677 HydrophobicContact CG-CE1 4.01Å; M660-F677 HydrophobicContact CG-CE2 4.28Å; M660-F677 HydrophobicContact CG-CZ 3.65Å; M660-F677 PolarHBondContact N-O 3.26Å; M660-F677 WeakPolarHBondContact O-CD1 3.44Å; M660-F677 PolarHBondContact O-N 3.14Å; L662-F677 HydrophobicContact CB-CE1 4.21Å; F675-F677 AromaticContact CD1-CD1 3.75Å; F675-F677 HydrophobicContact CD1-CD1 3.75Å; F675-F677 HydrophobicContact CD1-CE1 4.42Å; F675-F677 HydrophobicContact CD1-CG 4.49Å; F675-F677 HydrophobicContact CE1-CB 3.89Å; F675-F677 AromaticContact CE1-CD1 3.7Å; F675-F677 HydrophobicContact CE1-CD1 3.7Å; F675-F677 HydrophobicContact CE1-CG 4Å; F675-F677 HydrophobicContact CZ-CB 4.12Å; F677-P679 WeakPolarHBondContact O-CD 3.2Å; F677-V683 CarbonylContact C-O 3.58Å; F677-V683 VanDerWaalsContact CA-O 3.28Å; F677-V683 WeakPolarHBondContact CA-O 3.48Å; F677-V683 WeakPolarHBondContact CB-O 2.96Å
678	N	90.5	Very high	85	Confident	30 Å²	30	53.1 Å²	53.1	16%	0.16	25%	0.253	C	S	.	.			trans	-77.9	117.5	170.5	-179.6	-33.8	0	0	0	108.7	I680 T681 G682 V683	N678-I680 PolarHBondContact O-N 3.28Å; N678-I680 PolarHBondContact OD1-N 3.27Å; N678-T681 WeakPolarHBondContact CB-OG1 3.49Å; N678-T681 PolarHBondContact O-N 2.71Å; N678-T681 PolarHBondContact OD1-N 2.75Å; N678-G682 VanDerWaalsContact O-CA 3.31Å; N678-G682 WeakPolarHBondContact O-CA 3.46Å; N678-G682 PolarHBondContact O-N 3.2Å; N678-V683 PolarHBondContact N-O 2.92Å
679	P	92.7	Very high	84.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.5	-177.1	23.6	-32.9	0	0	0	115.2	I443 V608 W628 P658 M660 F677	I443-P679 HydrophobicContact CD1-CB 3.23Å; I443-P679 HydrophobicContact CD1-CG 3.9Å; V608-P679 HydrophobicContact CG2-CB 3.9Å; W628-P679 VanDerWaalsContact CZ2-O 3.24Å; W628-P679 WeakPolarHBondContact CZ2-O 3.37Å; W628-P679 PolarHBondContact NE1-O 3.41Å; P658-P679 HydrophobicContact CB-CG 3.76Å; P658-P679 HydrophobicContact CG-CG 3.99Å; P658-P679 WeakPolarHBondContact O-CD 3.29Å; M660-P679 HydrophobicContact CB-CB 4.01Å; M660-P679 HydrophobicContact CB-CG 4.14Å; F677-P679 WeakPolarHBondContact O-CD 3.2Å
680	I	89.1	Confident	83.6	Confident	15 Å²	15	43.8 Å²	43.8	8%	0.077	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-37.3	-179.6	-59	-52.7	0	0	0	111.2	I443 L445 M606 W628 L651 P658 N678	I443-I680 HydrophobicContact CG2-CD1 4.3Å; L445-I680 HydrophobicContact CD2-CD1 4.02Å; M606-I680 HydrophobicContact CB-CD1 3.9Å; M606-I680 WeakPolarHBondContact CE-O 3.49Å; M606-I680 HydrophobicContact CG-CD1 4.3Å; W628-I680 PolarHBondContact NE1-O 2.69Å; L651-I680 HydrophobicContact CD1-CD1 4.01Å; L651-I680 HydrophobicContact CD1-CG1 4.02Å; L651-I680 HydrophobicContact CD2-CG1 4.47Å; P658-I680 HydrophobicContact CG-CG1 4.06Å; N678-I680 PolarHBondContact O-N 3.28Å; N678-I680 PolarHBondContact OD1-N 3.27Å
681	T	85.9	Confident	83	Confident	54 Å²	54	43.1 Å²	43.1	33%	0.331	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-19	-177.1	63.1	0	0	0	0	113.7	F550 N678 V683	F550-T681 WeakPolarHBondContact CE2-O 3.47Å; F550-T681 WeakPolarHBondContact CZ-O 3.41Å; N678-T681 WeakPolarHBondContact CB-OG1 3.49Å; N678-T681 PolarHBondContact O-N 2.71Å; N678-T681 PolarHBondContact OD1-N 2.75Å; T681-V683 PolarHBondContact O-N 3.38Å; T681-V683 WeakPolarHBondContact OG1-CG2 3.2Å; T681-V683 PolarHBondContact OG1-N 2.91Å
682	G	85.4	Confident	82.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.			trans	77.9	-4	-172.5	0	0	0	0	0	114.5	N678	N678-G682 VanDerWaalsContact O-CA 3.31Å; N678-G682 WeakPolarHBondContact O-CA 3.46Å; N678-G682 PolarHBondContact O-N 3.2Å
683	V	85.4	Confident	82.4	Confident	43 Å²	43	40 Å²	40	26%	0.261	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-71.3	134	-176.1	-178.9	0	0	0	0	110.4	F550 F677 N678 T681 S685	F550-V683 HydrophobicContact CD1-CG2 4.23Å; F550-V683 HydrophobicContact CE1-CG2 3.34Å; F550-V683 HydrophobicContact CE2-CG2 4.42Å; F550-V683 HydrophobicContact CZ-CG2 3.45Å; F550-V683 VanDerWaalsContact CZ-CG2 3.45Å; F677-V683 CarbonylContact C-O 3.58Å; F677-V683 VanDerWaalsContact CA-O 3.28Å; F677-V683 WeakPolarHBondContact CA-O 3.48Å; F677-V683 WeakPolarHBondContact CB-O 2.96Å; N678-V683 PolarHBondContact N-O 2.92Å; T681-V683 PolarHBondContact O-N 3.38Å; T681-V683 WeakPolarHBondContact OG1-CG2 3.2Å; T681-V683 PolarHBondContact OG1-N 2.91Å; V683-S685 PolarHBondContact O-N 3.05Å
684	P	84.9	Confident	82.2	Confident	26 Å²	26	42.5 Å²	42.5	17%	0.169	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-50.8	138.8	171.2	-24.4	31.6	0	0	0	112	Y630 F675 H686	Y630-P684 HydrophobicContact CE2-CG 4.22Å; F675-P684 HydrophobicContact CE2-CB 3.91Å; F675-P684 HydrophobicContact CE2-CG 3.9Å; F675-P684 HydrophobicContact CZ-CB 4.2Å; F675-P684 HydrophobicContact CZ-CG 3.9Å; P684-H686 PolarHBondContact O-N 3.35Å
685	S	82.2	Confident	81.8	Confident	13 Å²	13	42.5 Å²	42.5	9%	0.091	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-71.2	125.6	179.9	-176.1	0	0	0	0	109.9	S676 V683 E687 D691	S676-S685 PolarHBondContact O-N 3.2Å; V683-S685 PolarHBondContact O-N 3.05Å; S685-E687 VanDerWaalsContact C-N 3.3Å; S685-E687 PolarHBondContact OG-N 3.44Å; S685-D691 VanDerWaalsContact O-CA 3.31Å; S685-D691 WeakPolarHBondContact O-CA 3.19Å; S685-D691 WeakPolarHBondContact O-CB 3.44Å; S685-D691 PolarHBondContact O-N 3.17Å
686	H	69.4	Low	81.1	Confident	165 Å²	165	50 Å²	50	76%	0.764	26%	0.26	S	S	*	.			trans	-90.8	11.4	173.1	-64.4	-63.1	0	0	0	113	P684	P684-H686 PolarHBondContact O-N 3.35Å
687	E	71.3	Confident	80.5	Confident	44 Å²	44	52 Å²	52	21%	0.206	27%	0.274	C	S	.	.	S	Bend	trans	-60.9	148	170	-73.5	-155.3	172.9	0	0	110.9	R649 I659 S685 G689 M690 I716	R649-E687 IonicContact CZ-OE1 2.78Å; R649-E687 VanDerWaalsContact CZ-OE1 3.26Å; R649-E687 IonicContact NH1-OE1 3.63Å; R649-E687 PolarHBondContact NH1-OE1 2.98Å; R649-E687 IonicContact NH2-OE1 3.33Å; R649-E687 PolarHBondContact NH2-OE1 3.09Å; I659-E687 VanDerWaalsContact CD1-CD 3.44Å; I659-E687 HydrophobicContact CD1-CG 4.19Å; I659-E687 VanDerWaalsContact CD1-OE2 3.24Å; I659-E687 WeakPolarHBondContact CD1-OE2 3.37Å; S685-E687 VanDerWaalsContact C-N 3.3Å; S685-E687 PolarHBondContact OG-N 3.44Å; E687-G689 PolarHBondContact O-N 2.69Å; E687-M690 HydrophobicContact CB-CB 4.26Å; E687-M690 HydrophobicContact CB-CG 4.29Å; E687-M690 HydrophobicContact CB-SD 3.95Å; E687-M690 PolarHBondContact O-N 2.65Å; E687-I716 WeakPolarHBondContact OE2-CD1 3.43Å
688	K	67	Low	80	Confident	190 Å²	190	56.5 Å²	56.5	83%	0.826	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	102.9	-168	-69.1	179.9	-178.7	173.3	0	111.7
689	G	66	Low	79.8	Confident	52 Å²	52	55.2 Å²	55.2	54%	0.536	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	19.5	176.1	0	0	0	0	0	115.8	E687	E687-G689 PolarHBondContact O-N 2.69Å
690	M	71.2	Confident	79.5	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	31%	0.309	C	S	.	.			trans	-105.3	-6.1	-176.9	-68.2	-169.8	72	0	0	115.5	I659 S676 E687 Y731 P732	I659-M690 HydrophobicContact CD1-CE 4.39Å; I659-M690 HydrophobicContact CD1-SD 4.41Å; I659-M690 HydrophobicContact CG2-CE 3.95Å; S676-M690 WeakPolarHBondContact CB-O 3.32Å; S676-M690 PolarHBondContact N-O 2.84Å; S676-M690 PolarHBondContact OG-O 3.46Å; E687-M690 HydrophobicContact CB-CB 4.26Å; E687-M690 HydrophobicContact CB-CG 4.29Å; E687-M690 HydrophobicContact CB-SD 3.95Å; E687-M690 PolarHBondContact O-N 2.65Å; M690-Y731 VanDerWaalsContact CA-OH 3.25Å; M690-Y731 WeakPolarHBondContact CA-OH 3.42Å; M690-Y731 HydrophobicContact CE-CE1 3.91Å; M690-Y731 PolarHBondContact O-OH 3.29Å; M690-Y731 VanDerWaalsContact O-OH 3.08Å; M690-P732 HydrophobicContact CE-CB 4.39Å; M690-P732 HydrophobicContact CE-CG 4.19Å; M690-P732 HydrophobicContact CG-CB 3.89Å; M690-P732 HydrophobicContact SD-CB 3.82Å; M690-P732 HydrophobicContact SD-CG 3.77Å
691	D	70	Confident	79.5	Confident	62 Å²	62	60.6 Å²	60.6	33%	0.332	32%	0.317	S	S	.	.	S	Bend	trans	-60.2	-58.8	-178.8	54.9	-14.6	0	0	0	111.8	F675 S676 S685	F675-D691 WeakPolarHBondContact CD2-O 3.47Å; S676-D691 PolarHBondContact N-O 2.93Å; S685-D691 VanDerWaalsContact O-CA 3.31Å; S685-D691 WeakPolarHBondContact O-CA 3.19Å; S685-D691 WeakPolarHBondContact O-CB 3.44Å; S685-D691 PolarHBondContact O-N 3.17Å
692	L	80.6	Confident	79.8	Confident	78 Å²	78	58.8 Å²	58.8	41%	0.408	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	101.5	179.3	-167.9	73.5	0	0	0	110.8	V673 F675	V673-L692 HydrophobicContact CG1-CD1 3.36Å; V673-L692 HydrophobicContact CG1-CG 3.83Å; F675-L692 HydrophobicContact CB-CD1 4.07Å; F675-L692 HydrophobicContact CD2-CD1 4.12Å
693	Y	82.2	Confident	80.1	Confident	53 Å²	53	60.2 Å²	60.2	21%	0.208	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	107.6	179.6	-170.4	-106.7	0	0	0	111.1	V673 L674 L695 E729 Y731	V673-Y693 WeakPolarHBondContact CA-O 3.37Å; L674-Y693 HydrophobicContact CD1-CD1 4.41Å; L674-Y693 PolarHBondContact N-O 3.01Å; L674-Y693 PolarHBondContact O-N 3.2Å; Y693-L695 HydrophobicContact CD1-CD1 3.94Å; Y693-L695 HydrophobicContact CD1-CG 4.44Å; Y693-L695 HydrophobicContact CE1-CD1 4.33Å; Y693-L695 HydrophobicContact CE1-CG 4.33Å; Y693-E729 PolarHBondContact OH-OE1 3.16Å; Y693-Y731 AromaticContact CD1-CD2 3.84Å; Y693-Y731 HydrophobicContact CD1-CD2 3.84Å; Y693-Y731 HydrophobicContact CD1-CE2 4.08Å; Y693-Y731 HydrophobicContact CD2-CD2 4.48Å; Y693-Y731 HydrophobicContact CD2-CE2 4.31Å; Y693-Y731 HydrophobicContact CE1-CD2 4.36Å; Y693-Y731 AromaticContact CG-CD2 3.91Å; Y693-Y731 HydrophobicContact CG-CD2 3.91Å; Y693-Y731 AromaticContact CG-CE2 3.72Å; Y693-Y731 HydrophobicContact CG-CE2 3.72Å
694	T	84.7	Confident	80.4	Confident	59 Å²	59	59.9 Å²	59.9	36%	0.362	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	121.1	172.5	-60.4	0	0	0	0	109.8	R671 V673	R671-T694 HydrophobicContact CB-CG2 4.15Å; V673-T694 HydrophobicContact CG2-CG2 4.34Å
695	L	83.1	Confident	80.6	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.306	C	S	.	.			trans	-69.1	138.3	-179.7	-77.6	69.8	0	0	0	110.4	R672 L674 Y693 I699 L721	R672-L695 HydrophobicContact CB-CB 4.45Å; R672-L695 HydrophobicContact CB-CD1 4.5Å; R672-L695 HydrophobicContact CB-CD2 4.22Å; R672-L695 PolarHBondContact O-N 2.92Å; L674-L695 HydrophobicContact CD1-CD1 4.17Å; L674-L695 HydrophobicContact CG-CD1 4.22Å; Y693-L695 HydrophobicContact CD1-CD1 3.94Å; Y693-L695 HydrophobicContact CD1-CG 4.44Å; Y693-L695 HydrophobicContact CE1-CD1 4.33Å; Y693-L695 HydrophobicContact CE1-CG 4.33Å; L695-I699 HydrophobicContact CD2-CB 4.31Å; L695-I699 HydrophobicContact CD2-CD1 3.71Å; L695-I699 HydrophobicContact CD2-CG1 3.67Å; L695-I699 HydrophobicContact CD2-CG2 3.61Å; L695-L721 HydrophobicContact CD2-CD1 4.03Å; L695-L721 HydrophobicContact CG-CD1 4.19Å
696	K	77.9	Confident	80.6	Confident	164 Å²	164	61.9 Å²	61.9	71%	0.713	32%	0.323	S	S	*	.	S	Bend	trans	-74	-28	-178.9	-65.2	179.9	-179.1	176.1	0	113
697	S	79.4	Confident	81	Confident	42 Å²	42	56.8 Å²	56.8	29%	0.294	32%	0.316	S	S	.	.	S	Bend	trans	-135.6	163.1	-177.3	61.6	0	0	0	0	110.4	R723	S697-R723 WeakPolarHBondContact OG-CD 3.32Å; S697-R723 WeakPolarHBondContact OG-CG 3.4Å; S697-R723 PolarHBondContact OG-NE 3.01Å; S697-R723 VanDerWaalsContact OG-NE 3.15Å
698	D	81.9	Confident	81.3	Confident	94 Å²	94	58 Å²	58	50%	0.503	33%	0.328	S	S	.	.			trans	-66.2	145.1	168.4	-83.4	-41	0	0	0	111.4	R672	R672-D698 IonicContact NE-OD1 3.07Å
699	I	85.7	Confident	81.8	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	148.6	177.1	48.1	152.2	0	0	0	110.3	L663 R672 L695 T702 L721 L722 R723	L663-I699 HydrophobicContact CD1-CD1 4.48Å; L663-I699 HydrophobicContact CD2-CD1 4.22Å; R672-I699 PolarHBondContact NH1-O 3.26Å; R672-I699 PolarHBondContact NH2-O 3.34Å; L695-I699 HydrophobicContact CD2-CB 4.31Å; L695-I699 HydrophobicContact CD2-CD1 3.71Å; L695-I699 HydrophobicContact CD2-CG1 3.67Å; L695-I699 HydrophobicContact CD2-CG2 3.61Å; I699-T702 WeakPolarHBondContact CD1-OG1 3.19Å; I699-L721 HydrophobicContact CD1-CD2 4.32Å; I699-L721 HydrophobicContact CG2-CB 4.06Å; I699-L722 CarbonylContact C-O 3.59Å; I699-L722 VanDerWaalsContact CA-O 3.26Å; I699-L722 WeakPolarHBondContact CA-O 3.25Å; I699-L722 VanDerWaalsContact CB-O 3.3Å; I699-L722 WeakPolarHBondContact CB-O 3.19Å; I699-R723 HydrophobicContact CG2-CG 3.95Å
700	I	86.6	Confident	82.5	Confident	72 Å²	72	48 Å²	48	37%	0.369	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-50.5	172.6	-59.2	175	0	0	0	108.8	L722 L726 T751	I700-L722 HydrophobicContact CB-CD2 4.23Å; I700-L722 HydrophobicContact CB-CG 4.33Å; I700-L722 HydrophobicContact CD1-CD2 4.39Å; I700-L722 HydrophobicContact CD1-CG 4.44Å; I700-L722 HydrophobicContact CG2-CD2 4.49Å; I700-L722 PolarHBondContact N-O 3.3Å; I700-L726 HydrophobicContact CD1-CD2 4.44Å; I700-T751 HydrophobicContact CG2-CG2 3.91Å
701	Q	89.7	Confident	83	Confident	55 Å²	55	54.2 Å²	54.2	26%	0.257	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	152.6	-172.8	-177.8	169.9	-21.5	0	0	111.2	V703 L722 F750 T751	Q701-V703 HydrophobicContact CG-CG2 4.19Å; Q701-L722 PolarHBondContact O-N 3.36Å; Q701-F750 PolarHBondContact NE2-O 2.87Å; Q701-F750 VanDerWaalsContact NE2-O 3.13Å; Q701-F750 PolarHBondContact OE1-O 3.25Å; Q701-T751 HydrophobicContact CB-CG2 4.41Å
702	T	92	Very high	83.6	Confident	17 Å²	17	56.6 Å²	56.6	10%	0.104	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.9	170.7	-61.2	0	0	0	0	108.7	F646 L663 I699 L719 L720 L721	F646-T702 HydrophobicContact CD2-CG2 4.38Å; F646-T702 HydrophobicContact CE1-CG2 4.17Å; F646-T702 HydrophobicContact CE2-CG2 3.67Å; F646-T702 HydrophobicContact CZ-CG2 3.55Å; L663-T702 WeakPolarHBondContact CD2-OG1 3.27Å; I699-T702 WeakPolarHBondContact CD1-OG1 3.19Å; T702-L719 HydrophobicContact CG2-CB 4.09Å; T702-L719 HydrophobicContact CG2-CD1 4.2Å; T702-L719 HydrophobicContact CG2-CD2 3.99Å; T702-L719 HydrophobicContact CG2-CG 4.33Å; T702-L720 WeakPolarHBondContact CA-O 3.27Å; T702-L721 HydrophobicContact CG2-CD2 3.58Å; T702-L721 VanDerWaalsContact OG1-CD2 3.24Å; T702-L721 WeakPolarHBondContact OG1-CD2 3.5Å
703	V	91.4	Very high	83.8	Confident	30 Å²	30	53.4 Å²	53.4	18%	0.182	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.5	178.5	179.8	0	0	0	0	108.7	Q701 L719 L720 I749	Q701-V703 HydrophobicContact CG-CG2 4.19Å; V703-L719 CarbonylContact O-C 3.49Å; V703-L719 WeakPolarHBondContact O-CA 3.32Å; V703-L720 PolarHBondContact N-O 3.35Å; V703-L720 PolarHBondContact O-N 2.81Å; V703-I749 HydrophobicContact CG1-CG2 4.42Å; V703-I749 HydrophobicContact CG2-CG2 4.18Å
704	L	92.1	Very high	83.9	Confident	35 Å²	35	57.1 Å²	57.1	18%	0.183	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	118.6	170.7	-179.5	68.1	0	0	0	109.1	F646 Q647 Q648 P706 R717 L719	F646-L704 HydrophobicContact CD1-CB 4.06Å; Q647-L704 WeakPolarHBondContact O-CD2 3.4Å; Q648-L704 HydrophobicContact CG-CD1 4.33Å; L704-P706 WeakPolarHBondContact O-CD 3.21Å; L704-R717 HydrophobicContact CD1-CB 3.68Å; L704-R717 WeakPolarHBondContact CD1-O 3.1Å; L704-R717 HydrophobicContact CG-CB 4.28Å; L704-L719 HydrophobicContact CB-CD2 3.94Å; L704-L719 HydrophobicContact CD1-CD2 3.61Å; L704-L719 HydrophobicContact CG-CD2 4.4Å
705	E	88.4	Confident	84	Confident	11 Å²	11	57.7 Å²	57.7	5%	0.051	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-60.3	128.3	-172.9	-173.7	72.3	152.8	0	0	111.8	V709 R717 P718 L720 Y739 L747	E705-V709 HydrophobicContact CG-CB 4.14Å; E705-V709 HydrophobicContact CG-CG1 4.37Å; E705-V709 HydrophobicContact CG-CG2 4.16Å; E705-R717 PolarHBondContact O-NE 2.87Å; E705-R717 PolarHBondContact O-NH2 2.76Å; E705-R717 VanDerWaalsContact O-NH2 3.09Å; E705-P718 HydrophobicContact CB-CG 3.79Å; E705-P718 VanDerWaalsContact CB-O 3.29Å; E705-P718 WeakPolarHBondContact CB-O 3.4Å; E705-P718 HydrophobicContact CG-CG 4.23Å; E705-P718 PolarHBondContact N-O 2.88Å; E705-L720 VanDerWaalsContact OE2-CD1 3.22Å; E705-L720 WeakPolarHBondContact OE2-CD1 3.35Å; E705-Y739 VanDerWaalsContact CD-OH 3.24Å; E705-Y739 WeakPolarHBondContact CG-OH 3.12Å; E705-Y739 VanDerWaalsContact OE1-CE1 3.31Å; E705-Y739 WeakPolarHBondContact OE1-CE1 3.34Å; E705-Y739 PolarHBondContact OE1-OH 2.93Å; E705-Y739 VanDerWaalsContact OE1-OH 3.12Å; E705-L747 WeakPolarHBondContact OE2-CD2 3.43Å
706	P	83	Confident	84.3	Confident	70 Å²	70	57.8 Å²	57.8	46%	0.455	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-87.3	156.1	170	34.5	-32.2	0	0	0	111.9	L704 L747	L704-P706 WeakPolarHBondContact O-CD 3.21Å; P706-L747 HydrophobicContact CG-CD1 4.13Å
707	G	77.9	Confident	85	Confident	59 Å²	59	53.9 Å²	53.9	61%	0.608	29%	0.29	S	S	*	.	S	Bend	trans	98.7	-167.5	170.7	0	0	0	0	0	115.1	V709	G707-V709 PolarHBondContact O-N 3.3Å
708	S	75.9	Confident	85.6	Confident	68 Å²	68	51.9 Å²	51.9	48%	0.476	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-79.8	5.7	-171.9	56	0	0	0	0	114.8	S710 E711	S708-S710 PolarHBondContact O-N 3.43Å; S708-E711 PolarHBondContact O-N 2.92Å; S708-E711 VanDerWaalsContact O-N 3.15Å
709	V	77.6	Confident	86.1	Confident	14 Å²	14	47.4 Å²	47.4	9%	0.085	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-57.3	-32.6	176.1	177	0	0	0	0	111	E705 G707 E711 R712 C713 P718 T738 Y739	E705-V709 HydrophobicContact CG-CB 4.14Å; E705-V709 HydrophobicContact CG-CG1 4.37Å; E705-V709 HydrophobicContact CG-CG2 4.16Å; G707-V709 PolarHBondContact O-N 3.3Å; V709-E711 VanDerWaalsContact C-N 3.35Å; V709-E711 PolarHBondContact O-N 2.97Å; V709-R712 PolarHBondContact O-N 2.98Å; V709-C713 PolarHBondContact O-N 3.18Å; V709-P718 HydrophobicContact CG1-CG 3.99Å; V709-T738 HydrophobicContact CG1-CG2 3.72Å; V709-Y739 HydrophobicContact CG1-CE2 4.45Å
710	S	81.4	Confident	86.4	Confident	19 Å²	19	47.5 Å²	47.5	13%	0.133	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-61.4	-38.2	178	55.6	0	0	0	0	113.1	S708 R712 C713 F715 I716	S708-S710 PolarHBondContact O-N 3.43Å; S710-R712 PolarHBondContact O-N 3.42Å; S710-C713 CarbonylContact O-C 3.54Å; S710-C713 VanDerWaalsContact O-C 3.23Å; S710-C713 WeakPolarHBondContact O-CA 3.47Å; S710-C713 PolarHBondContact O-N 2.9Å; S710-F715 WeakPolarHBondContact O-CA 3.46Å; S710-F715 PolarHBondContact O-N 3.21Å; S710-I716 WeakPolarHBondContact CA-O 3.43Å
711	E	81.9	Confident	86.7	Confident	131 Å²	131	44.1 Å²	44.1	61%	0.612	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-59.9	-32.7	-179.4	-61.3	177	-174.2	0	0	112.1	S708 V709 F715	S708-E711 PolarHBondContact O-N 2.92Å; S708-E711 VanDerWaalsContact O-N 3.15Å; V709-E711 VanDerWaalsContact C-N 3.35Å; V709-E711 PolarHBondContact O-N 2.97Å; E711-F715 HydrophobicContact CB-CE1 4.32Å; E711-F715 HydrophobicContact CG-CD1 4.35Å; E711-F715 HydrophobicContact CG-CE1 4.05Å
712	R	81.7	Confident	86.8	Confident	112 Å²	112	41.6 Å²	41.6	42%	0.423	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-84.9	-9.6	176.7	-63.7	-171.5	-65.2	-134.6	6.1	113.5	V709 S710 T738	V709-R712 PolarHBondContact O-N 2.98Å; S710-R712 PolarHBondContact O-N 3.42Å; R712-T738 HydrophobicContact CB-CG2 3.54Å; R712-T738 HydrophobicContact CG-CG2 4.41Å
713	C	85.6	Confident	86.7	Confident	11 Å²	11	43 Å²	43	7%	0.074	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	54.2	175.9	-162	0	0	0	0	111.6	V709 S710 F715 I716 C735	V709-C713 PolarHBondContact O-N 3.18Å; S710-C713 CarbonylContact O-C 3.54Å; S710-C713 VanDerWaalsContact O-C 3.23Å; S710-C713 WeakPolarHBondContact O-CA 3.47Å; S710-C713 PolarHBondContact O-N 2.9Å; C713-F715 PolarHBondContact O-N 2.76Å; C713-I716 VanDerWaalsContact O-CB 3.3Å; C713-I716 WeakPolarHBondContact O-CB 3.2Å; C713-I716 PolarHBondContact O-N 2.87Å; C713-C735 HydrophobicContact CB-CB 3.86Å; C713-C735 WeakPolarHBondContact CB-SG 3.38Å; C713-C735 WeakPolarHBondContact SG-CA 3.3Å; C713-C735 WeakPolarHBondContact SG-CB 3.47Å; C713-C735 CovalentContact SG-SG 2.03Å; C713-C735 PolarHBondContact SG-SG 2.76Å
714	E	83.1	Confident	86.4	Confident	131 Å²	131	45.2 Å²	45.2	61%	0.612	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	37	174.6	-59	-178.8	-179.9	0	0	113.4	R649 L656 I716	R649-E714 PolarHBondContact NH1-O 2.78Å; L656-E714 WeakPolarHBondContact CD1-O 3.47Å; E714-I716 PolarHBondContact O-N 3.22Å; E714-I716 VanDerWaalsContact O-N 3.17Å
715	F	87.2	Confident	86.2	Confident	72 Å²	72	47.6 Å²	47.6	32%	0.316	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	17.1	-176	-54.6	-80.2	0	0	0	115.3	H653 L656 S710 E711 C713	H653-F715 HydrophobicContact CB-CB 4.16Å; H653-F715 HydrophobicContact CB-CD2 4.05Å; H653-F715 HydrophobicContact CB-CG 4.05Å; H653-F715 VanDerWaalsContact CD2-CB 3.46Å; H653-F715 WeakPolarHBondContact CD2-CB 3.14Å; H653-F715 AromaticContact CD2-CD1 3.79Å; H653-F715 AromaticContact CD2-CG 3.68Å; H653-F715 AromaticContact CE1-CD1 3.3Å; H653-F715 WeakPolarHBondContact CE1-CD1 2.86Å; H653-F715 AromaticContact CE1-CE1 3.6Å; H653-F715 AromaticContact CE1-CG 3.91Å; H653-F715 AromaticContact CG-CD1 3.76Å; H653-F715 AromaticContact CG-CD2 3.96Å; H653-F715 AromaticContact CG-CG 3.53Å; H653-F715 AromaticContact ND1-CD1 3.46Å; H653-F715 WeakPolarHBondContact ND1-CD1 3.4Å; H653-F715 AromaticContact ND1-CE1 3.65Å; H653-F715 AromaticContact ND1-CG 3.7Å; H653-F715 AromaticContact NE2-CD1 3.51Å; H653-F715 AromaticContact NE2-CG 3.92Å; L656-F715 HydrophobicContact CD1-CD2 3.8Å; S710-F715 WeakPolarHBondContact O-CA 3.46Å; S710-F715 PolarHBondContact O-N 3.21Å; E711-F715 HydrophobicContact CB-CE1 4.32Å; E711-F715 HydrophobicContact CG-CD1 4.35Å; E711-F715 HydrophobicContact CG-CE1 4.05Å; C713-F715 PolarHBondContact O-N 2.76Å
716	I	90.1	Very high	86.3	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	27%	0.27	C	S	.	.			trans	-85.8	123.5	172.1	-55.7	173.6	0	0	0	108.5	Q648 I659 E687 S710 C713 E714 P718 P732	Q648-I716 HydrophobicContact CB-CG2 4.09Å; I659-I716 HydrophobicContact CD1-CD1 4.29Å; I659-I716 HydrophobicContact CD1-CG1 4.45Å; E687-I716 WeakPolarHBondContact OE2-CD1 3.43Å; S710-I716 WeakPolarHBondContact CA-O 3.43Å; C713-I716 VanDerWaalsContact O-CB 3.3Å; C713-I716 WeakPolarHBondContact O-CB 3.2Å; C713-I716 PolarHBondContact O-N 2.87Å; E714-I716 PolarHBondContact O-N 3.22Å; E714-I716 VanDerWaalsContact O-N 3.17Å; I716-P718 WeakPolarHBondContact O-CD 3.21Å; I716-P732 HydrophobicContact CG2-CG 4.32Å
717	R	92.1	Very high	86.7	Confident	83 Å²	83	48.9 Å²	48.9	31%	0.313	26%	0.264	S	S	.	.			trans	-79.4	110.5	168.6	-65.1	175.9	64.7	-168.6	-1	108.7	Q648 L704 E705	Q648-R717 PolarHBondContact NE2-O 2.89Å; Q648-R717 VanDerWaalsContact NE2-O 3.14Å; Q648-R717 WeakPolarHBondContact O-CB 3.19Å; Q648-R717 PolarHBondContact O-N 2.76Å; L704-R717 HydrophobicContact CD1-CB 3.68Å; L704-R717 WeakPolarHBondContact CD1-O 3.1Å; L704-R717 HydrophobicContact CG-CB 4.28Å; E705-R717 PolarHBondContact O-NE 2.87Å; E705-R717 PolarHBondContact O-NH2 2.76Å; E705-R717 VanDerWaalsContact O-NH2 3.09Å
718	P	91.8	Very high	87.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-67	148	-178.2	26	-33.1	0	0	0	111.5	E705 V709 I716 V730 Y731 C735 Y739	E705-P718 HydrophobicContact CB-CG 3.79Å; E705-P718 VanDerWaalsContact CB-O 3.29Å; E705-P718 WeakPolarHBondContact CB-O 3.4Å; E705-P718 HydrophobicContact CG-CG 4.23Å; E705-P718 PolarHBondContact N-O 2.88Å; V709-P718 HydrophobicContact CG1-CG 3.99Å; I716-P718 WeakPolarHBondContact O-CD 3.21Å; P718-V730 HydrophobicContact CB-CG1 3.76Å; P718-Y731 CarbonylContact C-O 3.54Å; P718-Y731 VanDerWaalsContact CA-O 3.32Å; P718-Y731 WeakPolarHBondContact CA-O 3.32Å; P718-C735 HydrophobicContact CB-CB 3.92Å; P718-C735 HydrophobicContact CG-CB 4.33Å; P718-Y739 HydrophobicContact CG-CE2 4.26Å; P718-Y739 VanDerWaalsContact CG-OH 3.31Å; P718-Y739 WeakPolarHBondContact CG-OH 3.2Å
719	L	93.3	Very high	87.9	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.1	166.8	-65.6	-180	0	0	0	109.3	F646 Q648 L674 T702 V703 L704 L721 Y731	F646-L719 HydrophobicContact CB-CD1 4.23Å; F646-L719 HydrophobicContact CB-CD2 3.72Å; F646-L719 HydrophobicContact CD1-CD2 3.8Å; F646-L719 HydrophobicContact CD2-CD1 3.92Å; F646-L719 HydrophobicContact CD2-CD2 4.05Å; F646-L719 HydrophobicContact CE1-CD2 4.41Å; F646-L719 HydrophobicContact CG-CD1 4.19Å; F646-L719 HydrophobicContact CG-CD2 3.59Å; Q648-L719 HydrophobicContact CG-CG 4.33Å; L674-L719 HydrophobicContact CD1-CD1 4.25Å; L674-L719 HydrophobicContact CD2-CD1 3.86Å; T702-L719 HydrophobicContact CG2-CB 4.09Å; T702-L719 HydrophobicContact CG2-CD1 4.2Å; T702-L719 HydrophobicContact CG2-CD2 3.99Å; T702-L719 HydrophobicContact CG2-CG 4.33Å; V703-L719 CarbonylContact O-C 3.49Å; V703-L719 WeakPolarHBondContact O-CA 3.32Å; L704-L719 HydrophobicContact CB-CD2 3.94Å; L704-L719 HydrophobicContact CD1-CD2 3.61Å; L704-L719 HydrophobicContact CG-CD2 4.4Å; L719-L721 HydrophobicContact CB-CD2 4.46Å; L719-Y731 HydrophobicContact CB-CD1 4.25Å; L719-Y731 HydrophobicContact CD1-CD1 3.97Å; L719-Y731 HydrophobicContact CD1-CE1 4.49Å; L719-Y731 HydrophobicContact CG-CD1 4.34Å; L719-Y731 PolarHBondContact N-O 3.21Å; L719-Y731 PolarHBondContact O-N 3.08Å
720	L	92.1	Very high	88.4	Confident	6 Å²	6	44.7 Å²	44.7	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.1	171.1	-61.7	-176.5	0	0	0	109.2	T702 V703 E705 V728 V730 Y739 L747 L774	T702-L720 WeakPolarHBondContact CA-O 3.27Å; V703-L720 PolarHBondContact N-O 3.35Å; V703-L720 PolarHBondContact O-N 2.81Å; E705-L720 VanDerWaalsContact OE2-CD1 3.22Å; E705-L720 WeakPolarHBondContact OE2-CD1 3.35Å; L720-V728 HydrophobicContact CB-CG1 3.92Å; L720-V728 HydrophobicContact CD2-CG1 4.03Å; L720-V728 HydrophobicContact CG-CG1 4.42Å; L720-V730 HydrophobicContact CD2-CB 4.42Å; L720-V730 HydrophobicContact CD2-CG1 4.41Å; L720-V730 HydrophobicContact CD2-CG2 3.79Å; L720-Y739 HydrophobicContact CD2-CE2 4.27Å; L720-L747 HydrophobicContact CD1-CD2 3.18Å; L720-L774 HydrophobicContact CD2-CD1 4.24Å
721	L	91.7	Very high	88.8	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	100.4	-177.7	-55.6	177.7	0	0	0	108.5	L674 L695 I699 T702 L719 R723 E729	L674-L721 HydrophobicContact CD1-CD1 4.12Å; L674-L721 HydrophobicContact CD1-CD2 4.21Å; L695-L721 HydrophobicContact CD2-CD1 4.03Å; L695-L721 HydrophobicContact CG-CD1 4.19Å; I699-L721 HydrophobicContact CD1-CD2 4.32Å; I699-L721 HydrophobicContact CG2-CB 4.06Å; T702-L721 HydrophobicContact CG2-CD2 3.58Å; T702-L721 VanDerWaalsContact OG1-CD2 3.24Å; T702-L721 WeakPolarHBondContact OG1-CD2 3.5Å; L719-L721 HydrophobicContact CB-CD2 4.46Å; L721-R723 PolarHBondContact O-N 3.45Å; L721-E729 HydrophobicContact CB-CB 4.17Å; L721-E729 WeakPolarHBondContact CB-O 3.4Å; L721-E729 HydrophobicContact CD1-CG 4.31Å; L721-E729 PolarHBondContact N-O 3.39Å; L721-E729 PolarHBondContact O-N 2.81Å
722	L	91.9	Very high	89.2	Confident	2 Å²	2	38 Å²	38	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	116.2	177.3	177.4	64.7	0	0	0	109.5	I699 I700 Q701 L726 V728 I749 T751 Y762 A776	I699-L722 CarbonylContact C-O 3.59Å; I699-L722 VanDerWaalsContact CA-O 3.26Å; I699-L722 WeakPolarHBondContact CA-O 3.25Å; I699-L722 VanDerWaalsContact CB-O 3.3Å; I699-L722 WeakPolarHBondContact CB-O 3.19Å; I700-L722 HydrophobicContact CB-CD2 4.23Å; I700-L722 HydrophobicContact CB-CG 4.33Å; I700-L722 HydrophobicContact CD1-CD2 4.39Å; I700-L722 HydrophobicContact CD1-CG 4.44Å; I700-L722 HydrophobicContact CG2-CD2 4.49Å; I700-L722 PolarHBondContact N-O 3.3Å; Q701-L722 PolarHBondContact O-N 3.36Å; L722-L726 HydrophobicContact CD1-CD2 4.39Å; L722-V728 HydrophobicContact CD1-CG2 3.87Å; L722-I749 HydrophobicContact CB-CD1 4.47Å; L722-I749 HydrophobicContact CD1-CD1 4.49Å; L722-I749 HydrophobicContact CD2-CD1 3.97Å; L722-T751 HydrophobicContact CD2-CG2 3.68Å; L722-Y762 HydrophobicContact CD2-CD2 4.49Å; L722-Y762 HydrophobicContact CD2-CE2 4.46Å; L722-A776 HydrophobicContact CD1-CB 3.48Å; L722-A776 VanDerWaalsContact CD1-CB 3.48Å
723	R	90.2	Very high	89.3	Confident	47 Å²	47	37 Å²	37	18%	0.177	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	167.6	178.4	-67.4	176.6	173.3	-168.9	-1.7	112.4	S697 I699 L721 D725 L726 D727 E729	S697-R723 WeakPolarHBondContact OG-CD 3.32Å; S697-R723 WeakPolarHBondContact OG-CG 3.4Å; S697-R723 PolarHBondContact OG-NE 3.01Å; S697-R723 VanDerWaalsContact OG-NE 3.15Å; I699-R723 HydrophobicContact CG2-CG 3.95Å; L721-R723 PolarHBondContact O-N 3.45Å; R723-D725 VanDerWaalsContact C-N 3.25Å; R723-D725 WeakPolarHBondContact CB-OD1 3.37Å; R723-D725 PolarHBondContact O-N 3.49Å; R723-L726 PolarHBondContact O-N 3.5Å; R723-L726 VanDerWaalsContact O-N 3.08Å; R723-D727 WeakPolarHBondContact CB-O 3.29Å; R723-D727 PolarHBondContact N-O 2.92Å; R723-E729 IonicContact CZ-OE2 3.63Å; R723-E729 VanDerWaalsContact CZ-OE2 3.27Å; R723-E729 IonicContact NE-OE2 3.64Å; R723-E729 PolarHBondContact NE-OE2 3.2Å; R723-E729 VanDerWaalsContact NE-OE2 3.09Å; R723-E729 IonicContact NH2-OE1 3.16Å; R723-E729 PolarHBondContact NH2-OE1 2.71Å; R723-E729 IonicContact NH2-OE2 2.72Å; R723-E729 PolarHBondContact NH2-OE2 3.01Å
724	A	86	Confident	89.3	Confident	76 Å²	76	40.2 Å²	40.2	63%	0.628	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-27.3	-179.4	0	0	0	0	0	114	L726	A724-L726 PolarHBondContact O-N 3.22Å
725	D	88.1	Confident	89.4	Confident	85 Å²	85	34 Å²	34	46%	0.455	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	3.2	174.4	55.8	3.9	0	0	0	113.6	R723 D727	R723-D725 VanDerWaalsContact C-N 3.25Å; R723-D725 WeakPolarHBondContact CB-OD1 3.37Å; R723-D725 PolarHBondContact O-N 3.49Å; D725-D727 PolarHBondContact O-N 2.88Å; D725-D727 WeakPolarHBondContact OD1-CB 3.39Å; D725-D727 PolarHBondContact OD1-N 3.41Å
726	L	89.5	Confident	89.3	Confident	48 Å²	48	31.7 Å²	31.7	25%	0.251	18%	0.18	S	C	.	.	S	Bend	trans	67	11	-173.9	-52.4	176.2	0	0	0	114.6	I700 L722 R723 A724 Y762 A776	I700-L726 HydrophobicContact CD1-CD2 4.44Å; L722-L726 HydrophobicContact CD1-CD2 4.39Å; R723-L726 PolarHBondContact O-N 3.5Å; R723-L726 VanDerWaalsContact O-N 3.08Å; A724-L726 PolarHBondContact O-N 3.22Å; L726-Y762 HydrophobicContact CD1-CE1 4.2Å; L726-Y762 HydrophobicContact CD2-CD1 4.23Å; L726-Y762 HydrophobicContact CD2-CE1 3.56Å; L726-A776 HydrophobicContact CB-CB 4.32Å; L726-A776 WeakPolarHBondContact O-CB 3.25Å; L726-A776 PolarHBondContact O-N 3.3Å
727	D	90.8	Very high	88.8	Confident	61 Å²	61	35.8 Å²	35.8	33%	0.326	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	144.2	167.9	-70.3	-10	0	0	0	109.4	R723 D725 K775	R723-D727 WeakPolarHBondContact CB-O 3.29Å; R723-D727 PolarHBondContact N-O 2.92Å; D725-D727 PolarHBondContact O-N 2.88Å; D725-D727 WeakPolarHBondContact OD1-CB 3.39Å; D725-D727 PolarHBondContact OD1-N 3.41Å; D727-K775 IonicContact OD1-NZ 3.5Å
728	V	89.9	Confident	88.2	Confident	12 Å²	12	32.6 Å²	32.6	7%	0.073	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.5	-177.2	178.7	0	0	0	0	109.1	L720 L722 I764 L774 A776	L720-V728 HydrophobicContact CB-CG1 3.92Å; L720-V728 HydrophobicContact CD2-CG1 4.03Å; L720-V728 HydrophobicContact CG-CG1 4.42Å; L722-V728 HydrophobicContact CD1-CG2 3.87Å; V728-I764 HydrophobicContact CG2-CD1 3.78Å; V728-L774 HydrophobicContact CB-CB 3.79Å; V728-L774 HydrophobicContact CG1-CB 4.26Å; V728-L774 HydrophobicContact CG1-CD1 4.41Å; V728-L774 PolarHBondContact N-O 3Å; V728-A776 HydrophobicContact CG2-CB 4Å
729	E	89.2	Confident	87.5	Confident	32 Å²	32	33.3 Å²	33.3	15%	0.15	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.3	175.9	173.4	175.6	-149.8	0	0	110	Y693 L721 R723	Y693-E729 PolarHBondContact OH-OE1 3.16Å; L721-E729 HydrophobicContact CB-CB 4.17Å; L721-E729 WeakPolarHBondContact CB-O 3.4Å; L721-E729 HydrophobicContact CD1-CG 4.31Å; L721-E729 PolarHBondContact N-O 3.39Å; L721-E729 PolarHBondContact O-N 2.81Å; R723-E729 IonicContact CZ-OE2 3.63Å; R723-E729 VanDerWaalsContact CZ-OE2 3.27Å; R723-E729 IonicContact NE-OE2 3.64Å; R723-E729 PolarHBondContact NE-OE2 3.2Å; R723-E729 VanDerWaalsContact NE-OE2 3.09Å; R723-E729 IonicContact NH2-OE1 3.16Å; R723-E729 PolarHBondContact NH2-OE1 2.71Å; R723-E729 IonicContact NH2-OE2 2.72Å; R723-E729 PolarHBondContact NH2-OE2 3.01Å
730	V	89.4	Confident	86.4	Confident	9 Å²	9	36 Å²	36	6%	0.055	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.1	179.7	-175.4	0	0	0	0	109.2	P718 L720 P732 C735 T736 Y739 L774	P718-V730 HydrophobicContact CB-CG1 3.76Å; L720-V730 HydrophobicContact CD2-CB 4.42Å; L720-V730 HydrophobicContact CD2-CG1 4.41Å; L720-V730 HydrophobicContact CD2-CG2 3.79Å; V730-P732 CarbonylContact O-C 3.54Å; V730-C735 HydrophobicContact CG1-CB 4.04Å; V730-T736 HydrophobicContact CG2-CG2 4.47Å; V730-Y739 HydrophobicContact CG1-CD2 4.46Å; V730-Y739 HydrophobicContact CG1-CE2 3.84Å; V730-Y739 HydrophobicContact CG2-CD2 4.03Å; V730-Y739 HydrophobicContact CG2-CE2 3.89Å; V730-L774 HydrophobicContact CG2-CD1 3.55Å; V730-L774 HydrophobicContact CG2-CG 4.5Å
731	Y	89.8	Confident	85.1	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.016	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.6	176.6	175.6	-93.4	0	0	0	111.6	Q648 L674 S676 M690 Y693 P718 L719	Q648-Y731 PolarHBondContact NE2-O 3.04Å; L674-Y731 HydrophobicContact CD1-CD1 3.82Å; L674-Y731 HydrophobicContact CD1-CD2 4.26Å; L674-Y731 HydrophobicContact CD1-CE1 4.11Å; L674-Y731 HydrophobicContact CD1-CG 3.89Å; S676-Y731 PolarHBondContact OG-OH 3.2Å; M690-Y731 VanDerWaalsContact CA-OH 3.25Å; M690-Y731 WeakPolarHBondContact CA-OH 3.42Å; M690-Y731 HydrophobicContact CE-CE1 3.91Å; M690-Y731 PolarHBondContact O-OH 3.29Å; M690-Y731 VanDerWaalsContact O-OH 3.08Å; Y693-Y731 AromaticContact CD1-CD2 3.84Å; Y693-Y731 HydrophobicContact CD1-CD2 3.84Å; Y693-Y731 HydrophobicContact CD1-CE2 4.08Å; Y693-Y731 HydrophobicContact CD2-CD2 4.48Å; Y693-Y731 HydrophobicContact CD2-CE2 4.31Å; Y693-Y731 HydrophobicContact CE1-CD2 4.36Å; Y693-Y731 AromaticContact CG-CD2 3.91Å; Y693-Y731 HydrophobicContact CG-CD2 3.91Å; Y693-Y731 AromaticContact CG-CE2 3.72Å; Y693-Y731 HydrophobicContact CG-CE2 3.72Å; P718-Y731 CarbonylContact C-O 3.54Å; P718-Y731 VanDerWaalsContact CA-O 3.32Å; P718-Y731 WeakPolarHBondContact CA-O 3.32Å; L719-Y731 HydrophobicContact CB-CD1 4.25Å; L719-Y731 HydrophobicContact CD1-CD1 3.97Å; L719-Y731 HydrophobicContact CD1-CE1 4.49Å; L719-Y731 HydrophobicContact CG-CD1 4.34Å; L719-Y731 PolarHBondContact N-O 3.21Å; L719-Y731 PolarHBondContact O-N 3.08Å
732	P	89.2	Confident	83.4	Confident	4 Å²	4	44.1 Å²	44.1	3%	0.026	28%	0.276	C	S	.	.	S	Bend	cis	-68.3	155.9	-4.8	30.5	-36.4	0	0	0	112.2	M690 I716 V730 T734 C735	M690-P732 HydrophobicContact CE-CB 4.39Å; M690-P732 HydrophobicContact CE-CG 4.19Å; M690-P732 HydrophobicContact CG-CB 3.89Å; M690-P732 HydrophobicContact SD-CB 3.82Å; M690-P732 HydrophobicContact SD-CG 3.77Å; I716-P732 HydrophobicContact CG2-CG 4.32Å; V730-P732 CarbonylContact O-C 3.54Å; P732-T734 WeakPolarHBondContact CB-OG1 3.33Å; P732-T734 VanDerWaalsContact CG-OG1 3.31Å; P732-T734 WeakPolarHBondContact CG-OG1 3.35Å; P732-T734 PolarHBondContact O-N 3.22Å; P732-T734 VanDerWaalsContact O-N 3.09Å; P732-C735 PolarHBondContact O-N 2.65Å
733	S	84.5	Confident	81.9	Confident	91 Å²	91	50.4 Å²	50.4	64%	0.636	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-62.5	-18.9	-179.6	56.4	0	0	0	0	113.1	C735 T736	S733-C735 VanDerWaalsContact C-N 3.26Å; S733-C735 PolarHBondContact O-N 2.74Å; S733-T736 WeakPolarHBondContact O-CB 3.23Å; S733-T736 PolarHBondContact O-N 2.63Å; S733-T736 PolarHBondContact O-OG1 2.98Å
734	T	84.7	Confident	80.7	Confident	79 Å²	79	50.3 Å²	50.3	49%	0.485	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-62.1	-28.4	173.5	50.7	0	0	0	0	113.1	P732 T736 P737	P732-T734 WeakPolarHBondContact CB-OG1 3.33Å; P732-T734 VanDerWaalsContact CG-OG1 3.31Å; P732-T734 WeakPolarHBondContact CG-OG1 3.35Å; P732-T734 PolarHBondContact O-N 3.22Å; P732-T734 VanDerWaalsContact O-N 3.09Å; T734-T736 VanDerWaalsContact C-N 3.34Å; T734-P737 VanDerWaalsContact O-CD 3.3Å; T734-P737 WeakPolarHBondContact O-CD 3.38Å
735	C	86.6	Confident	80.1	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-83.5	-5.3	178.4	-59.3	0	0	0	0	113.9	C713 P718 V730 P732 S733 P737 T738	C713-C735 HydrophobicContact CB-CB 3.86Å; C713-C735 WeakPolarHBondContact CB-SG 3.38Å; C713-C735 WeakPolarHBondContact SG-CA 3.3Å; C713-C735 WeakPolarHBondContact SG-CB 3.47Å; C713-C735 CovalentContact SG-SG 2.03Å; C713-C735 PolarHBondContact SG-SG 2.76Å; P718-C735 HydrophobicContact CB-CB 3.92Å; P718-C735 HydrophobicContact CG-CB 4.33Å; V730-C735 HydrophobicContact CG1-CB 4.04Å; P732-C735 PolarHBondContact O-N 2.65Å; S733-C735 VanDerWaalsContact C-N 3.26Å; S733-C735 PolarHBondContact O-N 2.74Å; C735-P737 VanDerWaalsContact C-CD 3.45Å; C735-T738 VanDerWaalsContact O-CB 3.3Å; C735-T738 WeakPolarHBondContact O-CB 3.4Å; C735-T738 PolarHBondContact O-N 3.15Å; C735-T738 PolarHBondContact O-OG1 2.83Å
736	T	84.4	Confident	79.8	Confident	24 Å²	24	54.7 Å²	54.7	15%	0.147	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-56.7	-43.5	-177.7	-47.9	0	0	0	0	114	V730 S733 T734 T738 Y739 K772	V730-T736 HydrophobicContact CG2-CG2 4.47Å; S733-T736 WeakPolarHBondContact O-CB 3.23Å; S733-T736 PolarHBondContact O-N 2.63Å; S733-T736 PolarHBondContact O-OG1 2.98Å; T734-T736 VanDerWaalsContact C-N 3.34Å; T736-T738 PolarHBondContact O-N 2.85Å; T736-T738 VanDerWaalsContact O-N 3.11Å; T736-Y739 PolarHBondContact O-N 2.88Å; T736-K772 WeakPolarHBondContact CG2-O 3.43Å
737	P	79.8	Confident	79.7	Confident	89 Å²	89	53.7 Å²	53.7	58%	0.578	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-61.3	-21.7	-179.1	-23.4	35.5	0	0	0	114.2	T734 C735 Y739 S740	T734-P737 VanDerWaalsContact O-CD 3.3Å; T734-P737 WeakPolarHBondContact O-CD 3.38Å; C735-P737 VanDerWaalsContact C-CD 3.45Å; P737-Y739 PolarHBondContact O-N 3.33Å; P737-Y739 VanDerWaalsContact O-N 3.16Å; P737-S740 WeakPolarHBondContact O-CB 3.26Å; P737-S740 PolarHBondContact O-N 2.97Å; P737-S740 PolarHBondContact O-OG 3.25Å
738	T	78.5	Confident	79.6	Confident	16 Å²	16	53.5 Å²	53.5	10%	0.098	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-64.2	-19.5	179.9	-48.5	0	0	0	0	113	V709 R712 C735 T736 S741	V709-T738 HydrophobicContact CG1-CG2 3.72Å; R712-T738 HydrophobicContact CB-CG2 3.54Å; R712-T738 HydrophobicContact CG-CG2 4.41Å; C735-T738 VanDerWaalsContact O-CB 3.3Å; C735-T738 WeakPolarHBondContact O-CB 3.4Å; C735-T738 PolarHBondContact O-N 3.15Å; C735-T738 PolarHBondContact O-OG1 2.83Å; T736-T738 PolarHBondContact O-N 2.85Å; T736-T738 VanDerWaalsContact O-N 3.11Å; T738-S741 PolarHBondContact O-OG 3.45Å
739	Y	78.8	Confident	79.8	Confident	14 Å²	14	53.4 Å²	53.4	6%	0.055	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-90.7	-7.8	176.9	-65.7	-84.5	0	0	0	114	E705 V709 P718 L720 V730 T736 P737 S741 L774	E705-Y739 VanDerWaalsContact CD-OH 3.24Å; E705-Y739 WeakPolarHBondContact CG-OH 3.12Å; E705-Y739 VanDerWaalsContact OE1-CE1 3.31Å; E705-Y739 WeakPolarHBondContact OE1-CE1 3.34Å; E705-Y739 PolarHBondContact OE1-OH 2.93Å; E705-Y739 VanDerWaalsContact OE1-OH 3.12Å; V709-Y739 HydrophobicContact CG1-CE2 4.45Å; P718-Y739 HydrophobicContact CG-CE2 4.26Å; P718-Y739 VanDerWaalsContact CG-OH 3.31Å; P718-Y739 WeakPolarHBondContact CG-OH 3.2Å; L720-Y739 HydrophobicContact CD2-CE2 4.27Å; V730-Y739 HydrophobicContact CG1-CD2 4.46Å; V730-Y739 HydrophobicContact CG1-CE2 3.84Å; V730-Y739 HydrophobicContact CG2-CD2 4.03Å; V730-Y739 HydrophobicContact CG2-CE2 3.89Å; T736-Y739 PolarHBondContact O-N 2.88Å; P737-Y739 PolarHBondContact O-N 3.33Å; P737-Y739 VanDerWaalsContact O-N 3.16Å; Y739-S741 VanDerWaalsContact C-N 3.32Å; Y739-L774 HydrophobicContact CD1-CD1 3.97Å; Y739-L774 HydrophobicContact CD1-CD2 4.47Å; Y739-L774 HydrophobicContact CD2-CD1 4.01Å; Y739-L774 HydrophobicContact CE1-CD1 4.33Å; Y739-L774 HydrophobicContact CE2-CD1 4.37Å; Y739-L774 HydrophobicContact CG-CD1 3.8Å; Y739-L774 HydrophobicContact CG-CD2 4.3Å
740	S	69.4	Low	80	Confident	58 Å²	58	54.2 Å²	54.2	41%	0.406	32%	0.319	S	S	.	.	S	Bend	trans	-76.6	-20.5	178.7	-50.3	0	0	0	0	112.6	P737 G771	P737-S740 WeakPolarHBondContact O-CB 3.26Å; P737-S740 PolarHBondContact O-N 2.97Å; P737-S740 PolarHBondContact O-OG 3.25Å; S740-G771 VanDerWaalsContact OG-C 3.22Å; S740-G771 VanDerWaalsContact OG-CA 3.23Å; S740-G771 WeakPolarHBondContact OG-CA 3.46Å; S740-G771 PolarHBondContact OG-O 3.43Å
741	S	64.3	Low	80.2	Confident	44 Å²	44	53.9 Å²	53.9	31%	0.308	32%	0.317	S	S	.	.	S	Bend	trans	-73	132.2	-179	60	0	0	0	0	111.8	T738 Y739 D743 S744	T738-S741 PolarHBondContact O-OG 3.45Å; Y739-S741 VanDerWaalsContact C-N 3.32Å; S741-D743 PolarHBondContact O-N 3.34Å; S741-S744 PolarHBondContact O-N 2.79Å
742	S	57	Low	80.3	Confident	132 Å²	132	56.4 Å²	56.4	92%	0.923	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-12.4	178.8	61.3	0	0	0	0	115	S744	S742-S744 VanDerWaalsContact C-N 3.33Å
743	D	60.9	Low	80.4	Confident	133 Å²	133	59 Å²	59	71%	0.711	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	4.7	-175.2	-154.1	28.7	0	0	0	113.4	S741 Q745	S741-D743 PolarHBondContact O-N 3.34Å; D743-Q745 PolarHBondContact O-N 2.82Å
744	S	63.7	Low	80.7	Confident	46 Å²	46	60.9 Å²	60.9	32%	0.322	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-73.5	127.3	177.4	63.9	0	0	0	0	111.4	S741 S742	S741-S744 PolarHBondContact O-N 2.79Å; S742-S744 VanDerWaalsContact C-N 3.33Å
745	Q	73.7	Confident	80.9	Confident	179 Å²	179	62.2 Å²	62.2	84%	0.836	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-60.3	144.6	169.7	-66.7	-177.1	-6	0	0	110.6	D743 L747	D743-Q745 PolarHBondContact O-N 2.82Å; Q745-L747 PolarHBondContact O-N 3.36Å
746	P	81.1	Confident	80.9	Confident	74 Å²	74	66.9 Å²	66.9	48%	0.481	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-66	122.5	-180	27.3	-33.9	0	0	0	110.5	Y748	P746-Y748 HydrophobicContact CB-CE2 3.93Å; P746-Y748 HydrophobicContact CG-CE2 4.1Å
747	L	87.7	Confident	81.3	Confident	27 Å²	27	65.7 Å²	65.7	14%	0.141	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-89.4	127.4	175.2	-176.6	73.7	0	0	0	111	E705 P706 L720 Q745 I749 I764	E705-L747 WeakPolarHBondContact OE2-CD2 3.43Å; P706-L747 HydrophobicContact CG-CD1 4.13Å; L720-L747 HydrophobicContact CD1-CD2 3.18Å; Q745-L747 PolarHBondContact O-N 3.36Å; L747-I749 HydrophobicContact CD2-CG2 4.06Å; L747-I749 HydrophobicContact CG-CG2 4.13Å; L747-I764 HydrophobicContact CB-CB 4.36Å; L747-I764 HydrophobicContact CB-CG1 4.47Å; L747-I764 HydrophobicContact CD2-CB 4.44Å; L747-I764 HydrophobicContact CD2-CG1 3.92Å; L747-I764 HydrophobicContact CG-CG1 4.39Å; L747-I764 PolarHBondContact O-N 3.3Å
748	Y	90.4	Very high	81.9	Confident	57 Å²	57	63.3 Å²	63.3	22%	0.224	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.7	171.9	-64.8	-92.9	0	0	0	109.4	P746 Y762 R763 V779 V854	P746-Y748 HydrophobicContact CB-CE2 3.93Å; P746-Y748 HydrophobicContact CG-CE2 4.1Å; Y748-Y762 WeakPolarHBondContact CA-O 3.49Å; Y748-R763 HydrophobicContact CD1-CB 4.08Å; Y748-R763 HydrophobicContact CD1-CG 4.43Å; Y748-R763 HydrophobicContact CE1-CB 3.97Å; Y748-R763 HydrophobicContact CE1-CG 4.08Å; Y748-V779 HydrophobicContact CE1-CG2 4.39Å; Y748-V854 HydrophobicContact CD1-CG1 4.19Å; Y748-V854 HydrophobicContact CD2-CG1 3.99Å; Y748-V854 HydrophobicContact CD2-CG2 4.14Å; Y748-V854 HydrophobicContact CE1-CG1 4.14Å; Y748-V854 HydrophobicContact CE2-CG1 3.95Å; Y748-V854 HydrophobicContact CG-CG1 4.11Å; Y748-V854 HydrophobicContact CG-CG2 4.1Å
749	I	92.6	Very high	82.7	Confident	10 Å²	10	62.5 Å²	62.5	5%	0.051	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	159.8	174.8	66.2	169	0	0	0	109.1	V703 L722 L747 G761 Y762 I764	V703-I749 HydrophobicContact CG1-CG2 4.42Å; V703-I749 HydrophobicContact CG2-CG2 4.18Å; L722-I749 HydrophobicContact CB-CD1 4.47Å; L722-I749 HydrophobicContact CD1-CD1 4.49Å; L722-I749 HydrophobicContact CD2-CD1 3.97Å; L747-I749 HydrophobicContact CD2-CG2 4.06Å; L747-I749 HydrophobicContact CG-CG2 4.13Å; I749-G761 CarbonylContact O-C 3.48Å; I749-G761 WeakPolarHBondContact O-CA 3.45Å; I749-Y762 HydrophobicContact CG1-CD2 4.41Å; I749-Y762 PolarHBondContact N-O 3.17Å; I749-Y762 PolarHBondContact O-N 3.38Å; I749-Y762 VanDerWaalsContact O-O 3.08Å; I749-I764 HydrophobicContact CD1-CD1 3.64Å; I749-I764 HydrophobicContact CD1-CG1 4.4Å; I749-I764 HydrophobicContact CG1-CD1 3.93Å; I749-I764 HydrophobicContact CG1-CG1 4.43Å; I749-I764 HydrophobicContact CG2-CG1 4.39Å
750	F	93.3	Very high	83.5	Confident	48 Å²	48	61.9 Å²	61.9	21%	0.211	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152.5	173.7	67	-75.6	0	0	0	110.2	Q701 I752 T760 W780 I830 V853	Q701-F750 PolarHBondContact NE2-O 2.87Å; Q701-F750 VanDerWaalsContact NE2-O 3.13Å; Q701-F750 PolarHBondContact OE1-O 3.25Å; F750-I752 HydrophobicContact CD2-CD1 4.34Å; F750-I752 HydrophobicContact CD2-CG1 3.95Å; F750-I752 HydrophobicContact CE2-CD1 3.81Å; F750-I752 HydrophobicContact CE2-CG1 3.89Å; F750-T760 CarbonylContact C-O 3.53Å; F750-T760 WeakPolarHBondContact CA-O 3.21Å; F750-W780 HydrophobicContact CB-CZ2 4.39Å; F750-I830 HydrophobicContact CD2-CD1 4.31Å; F750-I830 HydrophobicContact CE2-CD1 3.35Å; F750-I830 HydrophobicContact CZ-CD1 3.56Å; F750-V853 HydrophobicContact CB-CG1 3.8Å; F750-V853 HydrophobicContact CD1-CB 4.26Å; F750-V853 HydrophobicContact CD1-CG1 3.26Å; F750-V853 HydrophobicContact CD1-CG2 3.94Å; F750-V853 HydrophobicContact CE1-CG1 4.07Å; F750-V853 HydrophobicContact CE1-CG2 4.11Å; F750-V853 HydrophobicContact CG-CG1 3.72Å; F750-V853 HydrophobicContact CG-CG2 4.22Å
751	T	93.7	Very high	84.7	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.2	176.2	69.4	0	0	0	0	109.6	I700 Q701 L722 L759 T760 Y762	I700-T751 HydrophobicContact CG2-CG2 3.91Å; Q701-T751 HydrophobicContact CB-CG2 4.41Å; L722-T751 HydrophobicContact CD2-CG2 3.68Å; T751-L759 WeakPolarHBondContact O-CA 3.35Å; T751-T760 PolarHBondContact N-O 3.45Å; T751-T760 PolarHBondContact O-N 3.5Å; T751-T760 PolarHBondContact OG1-OG1 2.77Å; T751-Y762 HydrophobicContact CG2-CD2 4.19Å; T751-Y762 HydrophobicContact CG2-CE2 3.69Å
752	I	92.7	Very high	86.1	Confident	57 Å²	57	57.7 Å²	57.7	29%	0.292	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.1	178	-59.3	-177.3	0	0	0	109	F750 L759 I796 A799 I830	F750-I752 HydrophobicContact CD2-CD1 4.34Å; F750-I752 HydrophobicContact CD2-CG1 3.95Å; F750-I752 HydrophobicContact CE2-CD1 3.81Å; F750-I752 HydrophobicContact CE2-CG1 3.89Å; I752-L759 HydrophobicContact CD1-CD2 4.35Å; I752-L759 HydrophobicContact CG1-CD2 4.06Å; I752-L759 HydrophobicContact CG1-CG 4.11Å; I752-I796 HydrophobicContact CG2-CD1 3.48Å; I752-I796 VanDerWaalsContact CG2-CD1 3.48Å; I752-I796 HydrophobicContact CG2-CG2 4.34Å; I752-A799 HydrophobicContact CD1-CB 3.72Å; I752-I830 HydrophobicContact CD1-CD1 3.81Å
753	E	91.4	Very high	87.8	Confident	58 Å²	58	56.3 Å²	56.3	27%	0.271	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	105.3	172.3	-75.7	171	-133.7	0	0	110.1	Q756 A757 R758	E753-Q756 PolarHBondContact O-N 3.15Å; E753-Q756 PolarHBondContact OE2-OE1 3.4Å; E753-A757 WeakPolarHBondContact O-CA 3.32Å; E753-A757 PolarHBondContact O-N 3.12Å; E753-R758 HydrophobicContact CB-CB 4.29Å; E753-R758 PolarHBondContact N-O 3.23Å; E753-R758 PolarHBondContact O-N 2.64Å; E753-R758 VanDerWaalsContact O-N 3.08Å; E753-R758 IonicContact OE1-CZ 2.68Å; E753-R758 IonicContact OE1-NE 3.09Å; E753-R758 IonicContact OE1-NH1 3.2Å; E753-R758 PolarHBondContact OE1-NH1 3.37Å; E753-R758 IonicContact OE1-NH2 2.69Å; E753-R758 PolarHBondContact OE1-NH2 3.27Å; E753-R758 IonicContact OE2-CZ 2.81Å; E753-R758 IonicContact OE2-NE 3.16Å; E753-R758 PolarHBondContact OE2-NE 3.01Å; E753-R758 IonicContact OE2-NH1 3.23Å; E753-R758 IonicContact OE2-NH2 3.07Å; E753-R758 PolarHBondContact OE2-NH2 2.72Å
754	R	90.4	Very high	89.2	Confident	132 Å²	132	50.6 Å²	50.6	50%	0.498	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-55.5	-171.4	-165.8	-167.1	-180	-175.8	-3.5	112.8	Q756 A757 I796	R754-Q756 VanDerWaalsContact C-N 3.33Å; R754-Q756 PolarHBondContact O-N 3.27Å; R754-A757 PolarHBondContact O-N 3.29Å; R754-I796 HydrophobicContact CG-CB 4.5Å; R754-I796 WeakPolarHBondContact CG-O 3.37Å; R754-I796 PolarHBondContact NE-O 3.39Å; R754-I796 PolarHBondContact O-N 3.35Å
755	E	88.5	Confident	90.2	Very high	106 Å²	106	50.3 Å²	50.3	50%	0.495	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-29	-172.7	-64	-53.2	138.9	0	0	113.4	K793	E755-K793 WeakPolarHBondContact O-CE 3.45Å; E755-K793 PolarHBondContact O-NZ 2.96Å
756	Q	87.8	Confident	90.6	Very high	98 Å²	98	45.1 Å²	45.1	46%	0.458	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-3.1	177.8	-65.1	-173	-13	0	0	112.3	E753 R754 R758 L783	E753-Q756 PolarHBondContact O-N 3.15Å; E753-Q756 PolarHBondContact OE2-OE1 3.4Å; R754-Q756 VanDerWaalsContact C-N 3.33Å; R754-Q756 PolarHBondContact O-N 3.27Å; Q756-R758 HydrophobicContact CB-CB 4.06Å; Q756-R758 PolarHBondContact O-N 3Å; Q756-L783 WeakPolarHBondContact O-CD1 3.24Å
757	A	91.5	Very high	90.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	45	45.6	-167.5	0	0	0	0	0	112.8	E753 R754 L784 H794 I796 T834	E753-A757 WeakPolarHBondContact O-CA 3.32Å; E753-A757 PolarHBondContact O-N 3.12Å; R754-A757 PolarHBondContact O-N 3.29Å; A757-L784 HydrophobicContact CB-CB 4.19Å; A757-L784 WeakPolarHBondContact O-CB 3.27Å; A757-L784 PolarHBondContact O-N 3.18Å; A757-H794 WeakPolarHBondContact CB-O 3.47Å; A757-I796 HydrophobicContact CB-CD1 4.31Å; A757-I796 HydrophobicContact CB-CG1 3.95Å; A757-T834 HydrophobicContact CB-CG2 4.45Å
758	R	93	Very high	89	Confident	38 Å²	38	47.1 Å²	47.1	14%	0.143	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.9	-174.5	-175.8	171.7	61.7	78.3	-24.3	110.9	E753 Q756 T760 R781 M782 L783	E753-R758 HydrophobicContact CB-CB 4.29Å; E753-R758 PolarHBondContact N-O 3.23Å; E753-R758 PolarHBondContact O-N 2.64Å; E753-R758 VanDerWaalsContact O-N 3.08Å; E753-R758 IonicContact OE1-CZ 2.68Å; E753-R758 IonicContact OE1-NE 3.09Å; E753-R758 IonicContact OE1-NH1 3.2Å; E753-R758 PolarHBondContact OE1-NH1 3.37Å; E753-R758 IonicContact OE1-NH2 2.69Å; E753-R758 PolarHBondContact OE1-NH2 3.27Å; E753-R758 IonicContact OE2-CZ 2.81Å; E753-R758 IonicContact OE2-NE 3.16Å; E753-R758 PolarHBondContact OE2-NE 3.01Å; E753-R758 IonicContact OE2-NH1 3.23Å; E753-R758 IonicContact OE2-NH2 3.07Å; E753-R758 PolarHBondContact OE2-NH2 2.72Å; Q756-R758 HydrophobicContact CB-CB 4.06Å; Q756-R758 PolarHBondContact O-N 3Å; R758-T760 PolarHBondContact NH1-OG1 3.04Å; R758-R781 HydrophobicContact CG-CG 4.45Å; R758-M782 WeakPolarHBondContact CA-O 3.38Å; R758-L783 HydrophobicContact CB-CD1 4.03Å; R758-L783 HydrophobicContact CG-CD1 4.45Å
759	L	95	Very high	87.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.3	172.7	-71.5	88.2	0	0	0	110	T751 I752 W780 R781 M782 L784 I796 V832 I851	T751-L759 WeakPolarHBondContact O-CA 3.35Å; I752-L759 HydrophobicContact CD1-CD2 4.35Å; I752-L759 HydrophobicContact CG1-CD2 4.06Å; I752-L759 HydrophobicContact CG1-CG 4.11Å; L759-W780 HydrophobicContact CB-CH2 3.93Å; L759-W780 HydrophobicContact CB-CZ3 3.72Å; L759-R781 WeakPolarHBondContact O-CA 3.24Å; L759-M782 PolarHBondContact N-O 2.88Å; L759-M782 PolarHBondContact O-N 3.42Å; L759-L784 HydrophobicContact CD1-CD1 3.6Å; L759-L784 HydrophobicContact CD1-CG 4.12Å; L759-I796 HydrophobicContact CD1-CD1 3.66Å; L759-V832 HydrophobicContact CD2-CG2 3.97Å; L759-I851 HydrophobicContact CD2-CD1 4.09Å
760	T	95	Very high	85.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.6	175.4	33.6	0	0	0	0	110.4	F750 T751 R758 Y762 R781	F750-T760 CarbonylContact C-O 3.53Å; F750-T760 WeakPolarHBondContact CA-O 3.21Å; T751-T760 PolarHBondContact N-O 3.45Å; T751-T760 PolarHBondContact O-N 3.5Å; T751-T760 PolarHBondContact OG1-OG1 2.77Å; R758-T760 PolarHBondContact NH1-OG1 3.04Å; T760-Y762 PolarHBondContact OG1-OH 3.46Å; T760-R781 HydrophobicContact CG2-CB 3.79Å; T760-R781 HydrophobicContact CG2-CG 3.59Å
761	G	94.8	Very high	84.2	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	138.4	173.4	0	0	0	0	0	111.5	I749 V779 W780	I749-G761 CarbonylContact O-C 3.48Å; I749-G761 WeakPolarHBondContact O-CA 3.45Å; G761-V779 PolarHBondContact O-N 2.68Å; G761-W780 VanDerWaalsContact CA-CE2 3.46Å; G761-W780 PolarHBondContact N-O 3.26Å; G761-W780 PolarHBondContact O-N 3.25Å
762	Y	94.5	Very high	82.8	Confident	13 Å²	13	59.8 Å²	59.8	5%	0.051	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148.6	178	-53.2	-92.9	0	0	0	110.6	L722 L726 Y748 I749 T751 T760 A776 T777 R778	L722-Y762 HydrophobicContact CD2-CD2 4.49Å; L722-Y762 HydrophobicContact CD2-CE2 4.46Å; L726-Y762 HydrophobicContact CD1-CE1 4.2Å; L726-Y762 HydrophobicContact CD2-CD1 4.23Å; L726-Y762 HydrophobicContact CD2-CE1 3.56Å; Y748-Y762 WeakPolarHBondContact CA-O 3.49Å; I749-Y762 HydrophobicContact CG1-CD2 4.41Å; I749-Y762 PolarHBondContact N-O 3.17Å; I749-Y762 PolarHBondContact O-N 3.38Å; I749-Y762 VanDerWaalsContact O-O 3.08Å; T751-Y762 HydrophobicContact CG2-CD2 4.19Å; T751-Y762 HydrophobicContact CG2-CE2 3.69Å; T760-Y762 PolarHBondContact OG1-OH 3.46Å; Y762-A776 HydrophobicContact CD1-CB 4.11Å; Y762-A776 HydrophobicContact CG-CB 4.21Å; Y762-T777 CarbonylContact C-O 3.54Å; Y762-T777 WeakPolarHBondContact CA-O 3.32Å; Y762-R778 HydrophobicContact CD1-CB 3.97Å; Y762-R778 HydrophobicContact CD1-CG 4.48Å; Y762-R778 HydrophobicContact CE1-CB 3.94Å; Y762-R778 HydrophobicContact CE1-CG 4.23Å
763	R	92.2	Very high	82.2	Confident	103 Å²	103	59.5 Å²	59.5	39%	0.389	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128	168	178.2	-177.6	174.9	-158	-1.3	108.4	Y748 N765 T777 V779	Y748-R763 HydrophobicContact CD1-CB 4.08Å; Y748-R763 HydrophobicContact CD1-CG 4.43Å; Y748-R763 HydrophobicContact CE1-CB 3.97Å; Y748-R763 HydrophobicContact CE1-CG 4.08Å; R763-N765 PolarHBondContact NE-OD1 2.56Å; R763-T777 PolarHBondContact N-O 3.12Å; R763-T777 PolarHBondContact O-N 3.34Å; R763-T777 PolarHBondContact O-OG1 2.85Å; R763-V779 HydrophobicContact CB-CG2 3.54Å
764	I	89.6	Confident	82	Confident	14 Å²	14	57.1 Å²	57.1	7%	0.072	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	123.6	177.2	-54.9	-45	0	0	0	109	V728 L747 I749 L774 A776	V728-I764 HydrophobicContact CG2-CD1 3.78Å; L747-I764 HydrophobicContact CB-CB 4.36Å; L747-I764 HydrophobicContact CB-CG1 4.47Å; L747-I764 HydrophobicContact CD2-CB 4.44Å; L747-I764 HydrophobicContact CD2-CG1 3.92Å; L747-I764 HydrophobicContact CG-CG1 4.39Å; L747-I764 PolarHBondContact O-N 3.3Å; I749-I764 HydrophobicContact CD1-CD1 3.64Å; I749-I764 HydrophobicContact CD1-CG1 4.4Å; I749-I764 HydrophobicContact CG1-CD1 3.93Å; I749-I764 HydrophobicContact CG1-CG1 4.43Å; I749-I764 HydrophobicContact CG2-CG1 4.39Å; I764-L774 HydrophobicContact CG2-CB 4.06Å; I764-L774 HydrophobicContact CG2-CD1 4.24Å; I764-L774 HydrophobicContact CG2-CD2 4.21Å; I764-L774 HydrophobicContact CG2-CG 4.41Å; I764-A776 HydrophobicContact CD1-CB 3.63Å
765	N	86.3	Confident	81.9	Confident	40 Å²	40	54.9 Å²	54.9	21%	0.214	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143	176.3	-61.4	-44	0	0	0	110	R763 K775 T777	R763-N765 PolarHBondContact NE-OD1 2.56Å; N765-K775 PolarHBondContact N-O 3.03Å; N765-K775 PolarHBondContact O-N 3.41Å; N765-T777 VanDerWaalsContact ND2-CG2 3.27Å; N765-T777 WeakPolarHBondContact ND2-CG2 3.4Å; N765-T777 PolarHBondContact ND2-OG1 2.73Å
766	P	81.2	Confident	82.1	Confident	70 Å²	70	50 Å²	50	46%	0.455	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	131.1	165.4	28.7	-32	0	0	0	109.9	L774	P766-L774 HydrophobicContact CB-CD2 4.27Å
767	V	72.1	Confident	82.4	Confident	87 Å²	87	48 Å²	48	53%	0.527	26%	0.264	S	S	.	.			trans	-82.9	-39.9	-176.1	-179.2	0	0	0	0	112	S773 K775	V767-S773 PolarHBondContact N-O 3.09Å; V767-K775 HydrophobicContact CG2-CB 3.19Å; V767-K775 HydrophobicContact CG2-CD 4.15Å; V767-K775 HydrophobicContact CG2-CG 4.3Å
768	S	63.7	Low	82.5	Confident	56 Å²	56	54.6 Å²	54.6	39%	0.392	29%	0.288	S	S	.	.	S	Bend	trans	-112.3	150.5	-173.1	-175.9	0	0	0	0	111	D770 G771	S768-D770 PolarHBondContact O-N 3.21Å; S768-D770 PolarHBondContact OG-N 2.99Å; S768-D770 VanDerWaalsContact OG-N 3.16Å; S768-G771 WeakPolarHBondContact O-CA 3.39Å; S768-G771 PolarHBondContact O-N 3.11Å
769	S	59.1	Low	82.4	Confident	136 Å²	136	56.1 Å²	56.1	95%	0.951	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.4	165.6	-43.8	0	0	0	0	112.2	G771	S769-G771 PolarHBondContact O-N 3.22Å
770	D	55.8	Low	82.4	Confident	102 Å²	102	57.3 Å²	57.3	55%	0.545	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-11.3	174.5	-118.7	36.2	0	0	0	112.9	S768 K772	S768-D770 PolarHBondContact O-N 3.21Å; S768-D770 PolarHBondContact OG-N 2.99Å; S768-D770 VanDerWaalsContact OG-N 3.16Å; D770-K772 PolarHBondContact O-N 3.24Å; D770-K772 IonicContact OD2-NZ 3.93Å; D770-K772 PolarHBondContact OD2-NZ 2.69Å
771	G	59	Low	82.4	Confident	3 Å²	3	64 Å²	64	3%	0.031	33%	0.332	C	S	.	.			trans	62.2	7.3	174.4	0	0	0	0	0	116.4	S740 S768 S769	S740-G771 VanDerWaalsContact OG-C 3.22Å; S740-G771 VanDerWaalsContact OG-CA 3.23Å; S740-G771 WeakPolarHBondContact OG-CA 3.46Å; S740-G771 PolarHBondContact OG-O 3.43Å; S768-G771 WeakPolarHBondContact O-CA 3.39Å; S768-G771 PolarHBondContact O-N 3.11Å; S769-G771 PolarHBondContact O-N 3.22Å
772	K	66	Low	82.2	Confident	141 Å²	141	65.3 Å²	65.3	61%	0.613	34%	0.338	S	S	*	.			trans	-81.3	-23	-178	-71.8	171.6	-171.9	148.6	0	114.7	T736 D770	T736-K772 WeakPolarHBondContact CG2-O 3.43Å; D770-K772 PolarHBondContact O-N 3.24Å; D770-K772 IonicContact OD2-NZ 3.93Å; D770-K772 PolarHBondContact OD2-NZ 2.69Å
773	S	79	Confident	82.1	Confident	52 Å²	52	69 Å²	69	36%	0.364	36%	0.358	S	S	.	.			trans	-117.5	128.2	-176.6	50.9	0	0	0	0	111.1	V767	V767-S773 PolarHBondContact N-O 3.09Å
774	L	87	Confident	82	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.037	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	142	175.5	-64.3	177.6	0	0	0	109.4	L720 V728 V730 Y739 I764 P766	L720-L774 HydrophobicContact CD2-CD1 4.24Å; V728-L774 HydrophobicContact CB-CB 3.79Å; V728-L774 HydrophobicContact CG1-CB 4.26Å; V728-L774 HydrophobicContact CG1-CD1 4.41Å; V728-L774 PolarHBondContact N-O 3Å; V730-L774 HydrophobicContact CG2-CD1 3.55Å; V730-L774 HydrophobicContact CG2-CG 4.5Å; Y739-L774 HydrophobicContact CD1-CD1 3.97Å; Y739-L774 HydrophobicContact CD1-CD2 4.47Å; Y739-L774 HydrophobicContact CD2-CD1 4.01Å; Y739-L774 HydrophobicContact CE1-CD1 4.33Å; Y739-L774 HydrophobicContact CE2-CD1 4.37Å; Y739-L774 HydrophobicContact CG-CD1 3.8Å; Y739-L774 HydrophobicContact CG-CD2 4.3Å; I764-L774 HydrophobicContact CG2-CB 4.06Å; I764-L774 HydrophobicContact CG2-CD1 4.24Å; I764-L774 HydrophobicContact CG2-CD2 4.21Å; I764-L774 HydrophobicContact CG2-CG 4.41Å; P766-L774 HydrophobicContact CB-CD2 4.27Å
775	K	89.8	Confident	81.6	Confident	86 Å²	86	64.7 Å²	64.7	37%	0.374	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	137.2	175.2	-171.7	166.3	-166.7	152.7	0	111.3	D727 N765 V767 T777	D727-K775 IonicContact OD1-NZ 3.5Å; N765-K775 PolarHBondContact N-O 3.03Å; N765-K775 PolarHBondContact O-N 3.41Å; V767-K775 HydrophobicContact CG2-CB 3.19Å; V767-K775 HydrophobicContact CG2-CD 4.15Å; V767-K775 HydrophobicContact CG2-CG 4.3Å; K775-T777 PolarHBondContact O-N 3.09Å
776	A	91.9	Very high	80.7	Confident	2 Å²	2	67.9 Å²	67.9	2%	0.017	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112.5	175.1	0	0	0	0	0	109.6	L722 L726 V728 Y762 I764	L722-A776 HydrophobicContact CD1-CB 3.48Å; L722-A776 VanDerWaalsContact CD1-CB 3.48Å; L726-A776 HydrophobicContact CB-CB 4.32Å; L726-A776 WeakPolarHBondContact O-CB 3.25Å; L726-A776 PolarHBondContact O-N 3.3Å; V728-A776 HydrophobicContact CG2-CB 4Å; Y762-A776 HydrophobicContact CD1-CB 4.11Å; Y762-A776 HydrophobicContact CG-CB 4.21Å; I764-A776 HydrophobicContact CD1-CB 3.63Å
777	T	93.1	Very high	80.2	Confident	58 Å²	58	67.2 Å²	67.2	36%	0.356	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	127.4	171.6	58.3	0	0	0	0	109.6	Y762 R763 N765 K775 V779	Y762-T777 CarbonylContact C-O 3.54Å; Y762-T777 WeakPolarHBondContact CA-O 3.32Å; R763-T777 PolarHBondContact N-O 3.12Å; R763-T777 PolarHBondContact O-N 3.34Å; R763-T777 PolarHBondContact O-OG1 2.85Å; N765-T777 VanDerWaalsContact ND2-CG2 3.27Å; N765-T777 WeakPolarHBondContact ND2-CG2 3.4Å; N765-T777 PolarHBondContact ND2-OG1 2.73Å; K775-T777 PolarHBondContact O-N 3.09Å; T777-V779 PolarHBondContact O-N 2.93Å
778	R	93.7	Very high	79.9	Confident	137 Å²	137	68.1 Å²	68.1	52%	0.517	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	121.6	179.3	-175	-177.3	64.2	78.1	1	110.1	Y762	Y762-R778 HydrophobicContact CD1-CB 3.97Å; Y762-R778 HydrophobicContact CD1-CG 4.48Å; Y762-R778 HydrophobicContact CE1-CB 3.94Å; Y762-R778 HydrophobicContact CE1-CG 4.23Å
779	V	92	Very high	80.3	Confident	71 Å²	71	69.7 Å²	69.7	43%	0.43	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-48.6	178.2	-178.9	0	0	0	0	110.4	Y748 G761 R763 T777	Y748-V779 HydrophobicContact CE1-CG2 4.39Å; G761-V779 PolarHBondContact O-N 2.68Å; R763-V779 HydrophobicContact CB-CG2 3.54Å; T777-V779 PolarHBondContact O-N 2.93Å
780	W	94.7	Very high	80.8	Confident	24 Å²	24	68.5 Å²	68.5	9%	0.091	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	160.9	-178.2	59.1	-99.1	0	0	0	111.1	F750 L759 G761 M782 V853 G856	F750-W780 HydrophobicContact CB-CZ2 4.39Å; L759-W780 HydrophobicContact CB-CH2 3.93Å; L759-W780 HydrophobicContact CB-CZ3 3.72Å; G761-W780 VanDerWaalsContact CA-CE2 3.46Å; G761-W780 PolarHBondContact N-O 3.26Å; G761-W780 PolarHBondContact O-N 3.25Å; W780-M782 HydrophobicContact CE3-CB 4.22Å; W780-M782 HydrophobicContact CZ3-CB 4.01Å; W780-V853 WeakPolarHBondContact CZ2-O 3.49Å; W780-V853 PolarHBondContact NE1-O 3.48Å; W780-G856 VanDerWaalsContact CD1-CA 3.43Å
781	R	94.6	Very high	81.4	Confident	142 Å²	142	68 Å²	68	54%	0.536	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	133	175.4	175.9	176.8	-76.5	-177.3	-3	108.1	R758 L759 T760	R758-R781 HydrophobicContact CG-CG 4.45Å; L759-R781 WeakPolarHBondContact O-CA 3.24Å; T760-R781 HydrophobicContact CG2-CB 3.79Å; T760-R781 HydrophobicContact CG2-CG 3.59Å
782	M	91.9	Very high	82.1	Confident	28 Å²	28	71.3 Å²	71.3	14%	0.138	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.9	-179.4	-171.9	178.4	-69	0	0	109.6	R758 L759 W780 L784 I851 I858	R758-M782 WeakPolarHBondContact CA-O 3.38Å; L759-M782 PolarHBondContact N-O 2.88Å; L759-M782 PolarHBondContact O-N 3.42Å; W780-M782 HydrophobicContact CE3-CB 4.22Å; W780-M782 HydrophobicContact CZ3-CB 4.01Å; M782-L784 HydrophobicContact CG-CD2 3.91Å; M782-L784 HydrophobicContact SD-CD2 3.65Å; M782-I851 HydrophobicContact CE-CG2 4.4Å; M782-I851 HydrophobicContact SD-CD1 3.77Å; M782-I851 HydrophobicContact SD-CG1 4.33Å; M782-I858 HydrophobicContact CE-CD1 4Å; M782-I858 HydrophobicContact CE-CG1 3.51Å; M782-I858 HydrophobicContact SD-CD1 3.8Å; M782-I858 HydrophobicContact SD-CG1 3.74Å
783	L	91.9	Very high	82.9	Confident	90 Å²	90	68.3 Å²	68.3	47%	0.471	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	111.5	174.9	-176.9	65.5	0	0	0	107.9	Q756 R758 P786	Q756-L783 WeakPolarHBondContact O-CD1 3.24Å; R758-L783 HydrophobicContact CB-CD1 4.03Å; R758-L783 HydrophobicContact CG-CD1 4.45Å; L783-P786 HydrophobicContact CD2-CB 4.32Å
784	L	88.9	Confident	83.4	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.073	35%	0.354	C	S	.	.	S	Bend	trans	-84.3	-18.8	-177.6	-59.5	177.5	0	0	0	112.4	A757 L759 M782 V832 T834 Y849	A757-L784 HydrophobicContact CB-CB 4.19Å; A757-L784 WeakPolarHBondContact O-CB 3.27Å; A757-L784 PolarHBondContact O-N 3.18Å; L759-L784 HydrophobicContact CD1-CD1 3.6Å; L759-L784 HydrophobicContact CD1-CG 4.12Å; M782-L784 HydrophobicContact CG-CD2 3.91Å; M782-L784 HydrophobicContact SD-CD2 3.65Å; L784-V832 HydrophobicContact CD1-CG1 3.91Å; L784-T834 HydrophobicContact CB-CG2 4.26Å; L784-T834 HydrophobicContact CD1-CG2 3.92Å; L784-Y849 HydrophobicContact CB-CE2 4.3Å; L784-Y849 HydrophobicContact CD1-CD2 3.8Å; L784-Y849 HydrophobicContact CD1-CE2 4.16Å; L784-Y849 HydrophobicContact CD1-CG 4.32Å; L784-Y849 HydrophobicContact CD2-CD1 4.03Å; L784-Y849 HydrophobicContact CD2-CD2 4.04Å; L784-Y849 HydrophobicContact CD2-CE1 4.11Å; L784-Y849 HydrophobicContact CD2-CE2 4.12Å; L784-Y849 HydrophobicContact CD2-CG 3.99Å; L784-Y849 HydrophobicContact CG-CD2 4.42Å; L784-Y849 HydrophobicContact CG-CE2 4.43Å
785	S	81.9	Confident	83.7	Confident	12 Å²	12	68.7 Å²	68.7	8%	0.084	36%	0.364	C	S	.	.			trans	-121.8	84.6	174.6	-172.6	0	0	0	0	110.8	D787 H794	S785-D787 VanDerWaalsContact C-N 3.33Å; S785-H794 WeakPolarHBondContact CB-O 3.45Å; S785-H794 PolarHBondContact OG-N 3.18Å
786	P	66.5	Low	83.9	Confident	107 Å²	107	64.9 Å²	64.9	70%	0.695	35%	0.347	S	S	*	.			trans	-75.1	-20.9	179.3	29.9	-34	0	0	0	113.4	L783 S788	L783-P786 HydrophobicContact CD2-CB 4.32Å; P786-S788 PolarHBondContact O-N 3.44Å
787	D	70.7	Confident	83.8	Confident	56 Å²	56	66.1 Å²	66.1	30%	0.299	36%	0.355	S	S	.	.			trans	-69.4	123.5	-178.3	-163.1	-14.9	0	0	0	110.7	S785 N789 N792	S785-D787 VanDerWaalsContact C-N 3.33Å; D787-N789 VanDerWaalsContact C-N 3.32Å; D787-N789 WeakPolarHBondContact OD1-CB 3.32Å; D787-N789 PolarHBondContact OD1-N 3.48Å; D787-N789 PolarHBondContact OD1-ND2 2.77Å; D787-N792 HydrophobicContact CB-CB 4.27Å; D787-N792 WeakPolarHBondContact OD2-CB 3.43Å; D787-N792 PolarHBondContact OD2-ND2 3.49Å
788	S	67.5	Low	83.8	Confident	107 Å²	107	64.5 Å²	64.5	75%	0.748	35%	0.347	S	S	*	.			trans	-79	-16.2	177.7	56.8	0	0	0	0	112.8	P786	P786-S788 PolarHBondContact O-N 3.44Å
789	N	72.4	Confident	83.9	Confident	89 Å²	89	60.2 Å²	60.2	48%	0.476	34%	0.341	S	S	.	.			trans	-67.6	122.5	179.4	-71.1	-52.7	0	0	0	109.9	D787 V791 N792 K793	D787-N789 VanDerWaalsContact C-N 3.32Å; D787-N789 WeakPolarHBondContact OD1-CB 3.32Å; D787-N789 PolarHBondContact OD1-N 3.48Å; D787-N789 PolarHBondContact OD1-ND2 2.77Å; N789-V791 PolarHBondContact O-N 3.35Å; N789-V791 VanDerWaalsContact O-N 3.08Å; N789-N792 PolarHBondContact O-N 3.1Å; N789-K793 WeakPolarHBondContact O-CB 3.36Å; N789-K793 PolarHBondContact O-N 3.29Å
790	P	68.5	Low	84	Confident	111 Å²	111	57.6 Å²	57.6	72%	0.721	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-27	-176.3	23.4	-33.2	0	0	0	112.8
791	V	69.6	Low	83.9	Confident	91 Å²	91	59.3 Å²	59.3	55%	0.552	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-37.2	178.2	-177.5	0	0	0	0	112.2	N789 G837	N789-V791 PolarHBondContact O-N 3.35Å; N789-V791 VanDerWaalsContact O-N 3.08Å; V791-G837 WeakPolarHBondContact O-CA 3.48Å
792	N	72.4	Confident	83.8	Confident	72 Å²	72	54.6 Å²	54.6	39%	0.385	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	1.1	-178.4	-66.1	-18.2	0	0	0	112.5	D787 N789 H794	D787-N792 HydrophobicContact CB-CB 4.27Å; D787-N792 WeakPolarHBondContact OD2-CB 3.43Å; D787-N792 PolarHBondContact OD2-ND2 3.49Å; N789-N792 PolarHBondContact O-N 3.1Å; N792-H794 PolarHBondContact O-CD2 3.11Å; N792-H794 VanDerWaalsContact O-CD2 3.28Å; N792-H794 PolarHBondContact O-N 2.92Å
793	K	83.5	Confident	83.7	Confident	78 Å²	78	55.9 Å²	55.9	34%	0.339	34%	0.335	S	S	.	.			trans	-68.9	125.6	-176	-173.2	-176.4	177	-153.4	0	109.4	E755 N789	E755-K793 WeakPolarHBondContact O-CE 3.45Å; E755-K793 PolarHBondContact O-NZ 2.96Å; N789-K793 WeakPolarHBondContact O-CB 3.36Å; N789-K793 PolarHBondContact O-N 3.29Å
794	H	89.2	Confident	83.3	Confident	20 Å²	20	57.7 Å²	57.7	9%	0.093	35%	0.352	C	S	.	.			trans	-89.4	144	171.2	-75.8	-119	0	0	0	111	A757 S785 N792 T834 I835 G836 T845	A757-H794 WeakPolarHBondContact CB-O 3.47Å; S785-H794 WeakPolarHBondContact CB-O 3.45Å; S785-H794 PolarHBondContact OG-N 3.18Å; N792-H794 PolarHBondContact O-CD2 3.11Å; N792-H794 VanDerWaalsContact O-CD2 3.28Å; N792-H794 PolarHBondContact O-N 2.92Å; H794-T834 PolarHBondContact ND1-OG1 3.13Å; H794-I835 CarbonylContact C-O 3.6Å; H794-I835 WeakPolarHBondContact CA-O 3.31Å; H794-G836 PolarHBondContact ND1-N 3.1Å; H794-T845 PolarHBondContact CE1-OG1 2.97Å; H794-T845 PolarHBondContact NE2-OG1 3.25Å
795	I	92.6	Very high	83	Confident	47 Å²	47	61.3 Å²	61.3	24%	0.241	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	152.5	169.8	63.8	171.5	0	0	0	109.7	V797 T834 I835	I795-V797 HydrophobicContact CG1-CG2 4.48Å; I795-T834 CarbonylContact O-C 3.59Å; I795-T834 WeakPolarHBondContact O-CA 3.44Å; I795-T834 WeakPolarHBondContact O-CB 3.49Å; I795-I835 HydrophobicContact CD1-CG2 4.32Å; I795-I835 HydrophobicContact CG1-CG2 3.8Å; I795-I835 PolarHBondContact N-O 3.14Å; I795-I835 PolarHBondContact O-N 3.17Å
796	I	93.7	Very high	83.4	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.036	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	126	171.2	-66.4	163.3	0	0	0	108.5	I752 R754 A757 L759 V832 L833 T834	I752-I796 HydrophobicContact CG2-CD1 3.48Å; I752-I796 VanDerWaalsContact CG2-CD1 3.48Å; I752-I796 HydrophobicContact CG2-CG2 4.34Å; R754-I796 HydrophobicContact CG-CB 4.5Å; R754-I796 WeakPolarHBondContact CG-O 3.37Å; R754-I796 PolarHBondContact NE-O 3.39Å; R754-I796 PolarHBondContact O-N 3.35Å; A757-I796 HydrophobicContact CB-CD1 4.31Å; A757-I796 HydrophobicContact CB-CG1 3.95Å; L759-I796 HydrophobicContact CD1-CD1 3.66Å; I796-V832 HydrophobicContact CB-CG1 4.48Å; I796-V832 HydrophobicContact CD1-CG1 4.05Å; I796-V832 HydrophobicContact CG1-CG1 3.85Å; I796-V832 HydrophobicContact CG2-CG1 3.84Å; I796-L833 WeakPolarHBondContact CA-O 3.26Å; I796-T834 HydrophobicContact CG1-CG2 3.83Å
797	V	91.3	Very high	84.4	Confident	28 Å²	28	61.8 Å²	61.8	17%	0.17	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-43.8	179.2	-178.3	0	0	0	0	110.9	I795 L833 I835 E869 I871	I795-V797 HydrophobicContact CG1-CG2 4.48Å; V797-L833 PolarHBondContact N-O 2.89Å; V797-I835 HydrophobicContact CG2-CB 3.63Å; V797-I835 HydrophobicContact CG2-CG2 3.17Å; V797-E869 WeakPolarHBondContact CG1-OE1 3.23Å; V797-I871 HydrophobicContact CB-CD1 4.37Å; V797-I871 HydrophobicContact CG1-CB 4.22Å; V797-I871 HydrophobicContact CG1-CD1 4.02Å; V797-I871 HydrophobicContact CG1-CG2 4.33Å; V797-I871 HydrophobicContact CG2-CD1 4.41Å
798	A	93.1	Very high	85.2	Confident	23 Å²	23	61.1 Å²	61.1	19%	0.19	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147.8	-178.3	0	0	0	0	0	110.5	L833 I871 L873	A798-L833 HydrophobicContact CB-CB 4.46Å; A798-L833 HydrophobicContact CB-CD1 4.45Å; A798-L833 PolarHBondContact O-N 3.36Å; A798-I871 HydrophobicContact CB-CG2 4.35Å; A798-L873 HydrophobicContact CB-CB 3.88Å; A798-L873 HydrophobicContact CB-CD2 4.2Å
799	A	94.6	Very high	86	Confident	47 Å²	47	63.4 Å²	63.4	39%	0.388	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	137.3	168.9	0	0	0	0	0	108.6	I752 I830 A831 V832	I752-A799 HydrophobicContact CD1-CB 3.72Å; A799-I830 HydrophobicContact CB-CD1 4.16Å; A799-A831 CarbonylContact C-O 3.53Å; A799-A831 WeakPolarHBondContact CA-O 3.09Å; A799-V832 HydrophobicContact CB-CG2 4.35Å
800	A	94.5	Very high	86.6	Confident	17 Å²	17	61.6 Å²	61.6	14%	0.14	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	141.1	179.3	0	0	0	0	0	109.9	A831 L873 H875	A800-A831 PolarHBondContact N-O 3.35Å; A800-A831 PolarHBondContact O-N 3.26Å; A800-L873 HydrophobicContact CB-CD2 3.89Å; A800-L873 HydrophobicContact CB-CG 3.75Å; A800-H875 HydrophobicContact CB-CB 4.18Å
801	S	93.7	Very high	87.3	Confident	60 Å²	60	60.1 Å²	60.1	42%	0.42	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	158.7	168.7	61.3	0	0	0	0	108.4
802	R	91.9	Very high	88	Confident	43 Å²	43	56.5 Å²	56.5	16%	0.162	32%	0.324	C	S	.	.			trans	-55.2	130.4	172.1	-166.8	-177.7	73.4	-158.4	6.7	109.8	E806 H875	R802-E806 WeakPolarHBondContact CG-OE2 3.24Å; R802-H875 PolarHBondContact N-ND1 2.85Å
803	P	89.5	Confident	88.7	Confident	54 Å²	54	56 Å²	56	35%	0.351	32%	0.317	S	S	.	.			trans	-56.9	133.9	175.2	-23.4	32.8	0	0	0	110.7	S805 E806	P803-S805 PolarHBondContact O-N 2.96Å; P803-E806 HydrophobicContact CB-CB 4.17Å; P803-E806 WeakPolarHBondContact O-CB 3.42Å; P803-E806 PolarHBondContact O-N 2.95Å; P803-E806 VanDerWaalsContact O-N 3.1Å
804	P	83.8	Confident	88.9	Confident	129 Å²	129	57 Å²	57	84%	0.838	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-23.8	-177.1	26.3	-34.5	0	0	0	113
805	S	82.8	Confident	88.7	Confident	90 Å²	90	57.7 Å²	57.7	63%	0.629	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	1.2	175.3	55.4	0	0	0	0	113.8	P803 H807	P803-S805 PolarHBondContact O-N 2.96Å; S805-H807 PolarHBondContact O-CD2 3.09Å; S805-H807 PolarHBondContact O-N 3.27Å
806	E	88.9	Confident	88.2	Confident	16 Å²	16	56.2 Å²	56.2	8%	0.075	33%	0.33	C	S	.	.			trans	-74	123.3	177.6	-179.3	172.4	-142.8	0	0	111	R802 P803 S876 E877 K1003	R802-E806 WeakPolarHBondContact CG-OE2 3.24Å; P803-E806 HydrophobicContact CB-CB 4.17Å; P803-E806 WeakPolarHBondContact O-CB 3.42Å; P803-E806 PolarHBondContact O-N 2.95Å; P803-E806 VanDerWaalsContact O-N 3.1Å; E806-S876 PolarHBondContact OE1-OG 3.2Å; E806-S876 WeakPolarHBondContact OE2-CA 3.45Å; E806-S876 PolarHBondContact OE2-OG 3.41Å; E806-E877 PolarHBondContact OE2-N 3.18Å; E806-K1003 IonicContact OE1-NZ 2.95Å; E806-K1003 PolarHBondContact OE1-NZ 2.92Å
807	H	89.3	Confident	87.7	Confident	112 Å²	112	60.8 Å²	60.8	52%	0.519	35%	0.354	S	S	.	.			trans	-86.5	141	173.1	-66.4	-85.2	0	0	0	111.3	S805 E997	S805-H807 PolarHBondContact O-CD2 3.09Å; S805-H807 PolarHBondContact O-N 3.27Å; H807-E997 PolarHBondContact CD2-O 3.29Å
808	I	87	Confident	87.2	Confident	43 Å²	43	70.1 Å²	70.1	22%	0.221	39%	0.387	C	S	.	.			trans	-123.2	112.6	179.8	-52.1	-180	0	0	0	108.2	L825 E877	I808-L825 HydrophobicContact CD1-CD1 3.95Å; I808-L825 HydrophobicContact CD1-CD2 3.7Å; I808-L825 HydrophobicContact CD1-CG 4.33Å; I808-L825 HydrophobicContact CG2-CD1 3.93Å; I808-E877 HydrophobicContact CD1-CG 4.45Å; I808-E877 HydrophobicContact CG1-CG 4.28Å
809	Y	82.8	Confident	86.8	Confident	154 Å²	154	71.4 Å²	71.4	60%	0.604	39%	0.394	S	S	*	.			trans	-83.7	-40.9	-179.2	-177.6	-108.4	0	0	0	112.9	G999 I1000	Y809-G999 VanDerWaalsContact CB-O 3.25Å; Y809-G999 WeakPolarHBondContact CB-O 3.39Å; Y809-I1000 HydrophobicContact CD1-CB 4.34Å; Y809-I1000 HydrophobicContact CD1-CG1 3.97Å; Y809-I1000 HydrophobicContact CD1-CG2 4.27Å; Y809-I1000 HydrophobicContact CD2-CD1 4.18Å; Y809-I1000 HydrophobicContact CD2-CG1 3.51Å; Y809-I1000 HydrophobicContact CE1-CG1 4.28Å; Y809-I1000 HydrophobicContact CE1-CG2 4.29Å; Y809-I1000 HydrophobicContact CE2-CD1 4.1Å; Y809-I1000 HydrophobicContact CE2-CG1 3.84Å; Y809-I1000 HydrophobicContact CG-CB 4.29Å; Y809-I1000 HydrophobicContact CG-CG1 3.57Å
810	S	85.4	Confident	86.2	Confident	52 Å²	52	71.7 Å²	71.7	36%	0.364	39%	0.391	S	S	.	.			trans	-111.2	120.5	-175.9	178.5	0	0	0	0	112.5	G812 K823	S810-G812 PolarHBondContact OG-O 3.43Å; S810-K823 WeakPolarHBondContact O-CD 3.34Å; S810-K823 PolarHBondContact O-NZ 2.93Å
811	V	83.4	Confident	85.7	Confident	79 Å²	79	71.9 Å²	71.9	48%	0.479	39%	0.389	S	S	.	.	S	Bend	trans	-85.2	-20.6	-179.3	-176.3	0	0	0	0	112.5	K823	V811-K823 WeakPolarHBondContact O-CB 3.3Å; V811-K823 PolarHBondContact O-N 3.36Å
812	G	85.6	Confident	85.4	Confident	16 Å²	16	71.7 Å²	71.7	17%	0.165	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	153.9	-177.2	0	0	0	0	0	112.2	S810 L821	S810-G812 PolarHBondContact OG-O 3.43Å; G812-L821 CarbonylContact C-O 3.02Å; G812-L821 WeakPolarHBondContact CA-O 3.35Å
813	R	86.3	Confident	85.3	Confident	60 Å²	60	71 Å²	71	23%	0.226	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127.5	176.7	178.3	-179.4	-82.3	178.1	-27.8	109	V820 L821 E898 Y900 D1023 R1025	R813-V820 CarbonylContact O-C 3.59Å; R813-V820 WeakPolarHBondContact O-CA 3.45Å; R813-L821 PolarHBondContact N-O 3.03Å; R813-L821 PolarHBondContact O-N 3.36Å; R813-E898 IonicContact NH1-OE2 3.41Å; R813-Y900 PolarHBondContact NH1-OH 2.88Å; R813-D1023 IonicContact CZ-OD2 3.25Å; R813-D1023 VanDerWaalsContact CZ-OD2 3.23Å; R813-D1023 IonicContact NH1-OD1 3.26Å; R813-D1023 IonicContact NH1-OD2 2.77Å; R813-D1023 PolarHBondContact NH1-OD2 2.86Å; R813-D1023 IonicContact NH2-OD2 2.7Å; R813-D1023 PolarHBondContact NH2-OD2 2.76Å; R813-R1025 VanDerWaalsContact CD-NH2 3.31Å; R813-R1025 VanDerWaalsContact NH1-NE 3.18Å
814	V	86.6	Confident	85.3	Confident	100 Å²	100	68.5 Å²	68.5	61%	0.606	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	129.3	174.3	-175.1	0	0	0	0	108.7	V820	V814-V820 HydrophobicContact CG2-CG2 4.34Å
815	L	86.4	Confident	85.5	Confident	34 Å²	34	63.9 Å²	63.9	18%	0.178	33%	0.33	C	S	.	.			trans	-92.8	164.3	178	-59.6	-169.7	0	0	0	111.3	D817 R818 S819 L821 E1037	L815-D817 VanDerWaalsContact CB-OD1 3.23Å; L815-D817 WeakPolarHBondContact CB-OD1 3.48Å; L815-D817 PolarHBondContact O-N 2.93Å; L815-R818 WeakPolarHBondContact O-CA 3.4Å; L815-R818 PolarHBondContact O-N 3.48Å; L815-S819 WeakPolarHBondContact CD1-OG 3.3Å; L815-S819 PolarHBondContact N-O 2.81Å; L815-L821 HydrophobicContact CD1-CB 4.18Å; L815-L821 HydrophobicContact CD2-CB 4.01Å; L815-L821 HydrophobicContact CD2-CD2 4.44Å; L815-L821 HydrophobicContact CG-CB 4.11Å; L815-E1037 WeakPolarHBondContact CA-OE1 3.47Å; L815-E1037 WeakPolarHBondContact CB-OE1 3.39Å; L815-E1037 WeakPolarHBondContact CD2-OE1 3.23Å
816	G	81.3	Confident	85.8	Confident	16 Å²	16	59.7 Å²	59.7	17%	0.165	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.4	-180	0	0	0	0	0	113.5	R818 E1037	G816-R818 PolarHBondContact O-N 3.07Å; G816-E1037 PolarHBondContact N-OE1 2.99Å
817	D	83.5	Confident	85.7	Confident	103 Å²	103	61.9 Å²	61.9	55%	0.551	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	5.2	172.2	73.1	-13.5	0	0	0	113.7	L815 S819	L815-D817 VanDerWaalsContact CB-OD1 3.23Å; L815-D817 WeakPolarHBondContact CB-OD1 3.48Å; L815-D817 PolarHBondContact O-N 2.93Å; D817-S819 VanDerWaalsContact CG-OG 3.27Å; D817-S819 PolarHBondContact O-N 2.85Å; D817-S819 VanDerWaalsContact OD1-CB 3.22Å; D817-S819 WeakPolarHBondContact OD1-CB 3.15Å; D817-S819 PolarHBondContact OD1-N 2.75Å; D817-S819 PolarHBondContact OD1-OG 3.39Å; D817-S819 PolarHBondContact OD2-OG 2.71Å
818	R	81.4	Confident	85.8	Confident	225 Å²	225	59.4 Å²	59.4	85%	0.849	31%	0.306	S	S	*	.	S	Bend	trans	67.7	6.9	-176	-48.5	174.1	-178.7	174.1	-0	114.6	L815 G816	L815-R818 WeakPolarHBondContact O-CA 3.4Å; L815-R818 PolarHBondContact O-N 3.48Å; G816-R818 PolarHBondContact O-N 3.07Å
819	S	83.8	Confident	86.1	Confident	49 Å²	49	57.5 Å²	57.5	34%	0.343	30%	0.296	S	S	.	.			trans	-73.9	167.1	167.4	75.3	0	0	0	0	110.2	L815 D817	L815-S819 WeakPolarHBondContact CD1-OG 3.3Å; L815-S819 PolarHBondContact N-O 2.81Å; D817-S819 VanDerWaalsContact CG-OG 3.27Å; D817-S819 PolarHBondContact O-N 2.85Å; D817-S819 VanDerWaalsContact OD1-CB 3.22Å; D817-S819 WeakPolarHBondContact OD1-CB 3.15Å; D817-S819 PolarHBondContact OD1-N 2.75Å; D817-S819 PolarHBondContact OD1-OG 3.39Å; D817-S819 PolarHBondContact OD2-OG 2.71Å
820	V	81.8	Confident	86.7	Confident	53 Å²	53	50.4 Å²	50.4	32%	0.321	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.4	-179.9	-178	0	0	0	0	108.9	R813 V814 Y822	R813-V820 CarbonylContact O-C 3.59Å; R813-V820 WeakPolarHBondContact O-CA 3.45Å; V814-V820 HydrophobicContact CG2-CG2 4.34Å; V820-Y822 HydrophobicContact CB-CD2 4.25Å; V820-Y822 HydrophobicContact CB-CE2 3.64Å; V820-Y822 HydrophobicContact CG1-CD1 4.39Å; V820-Y822 HydrophobicContact CG1-CD2 3.99Å; V820-Y822 HydrophobicContact CG1-CE1 4.1Å; V820-Y822 HydrophobicContact CG1-CE2 3.64Å; V820-Y822 HydrophobicContact CG1-CG 4.37Å; V820-Y822 VanDerWaalsContact O-CD2 3.23Å; V820-Y822 WeakPolarHBondContact O-CD2 3.07Å; V820-Y822 WeakPolarHBondContact O-CE2 3.41Å; V820-Y822 PolarHBondContact O-N 3.34Å
821	L	85.4	Confident	87.2	Confident	21 Å²	21	48 Å²	48	11%	0.11	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	104.2	173.4	-165.5	68.5	0	0	0	109	G812 R813 L815 Y900	G812-L821 CarbonylContact C-O 3.02Å; G812-L821 WeakPolarHBondContact CA-O 3.35Å; R813-L821 PolarHBondContact N-O 3.03Å; R813-L821 PolarHBondContact O-N 3.36Å; L815-L821 HydrophobicContact CD1-CB 4.18Å; L815-L821 HydrophobicContact CD2-CB 4.01Å; L815-L821 HydrophobicContact CD2-CD2 4.44Å; L815-L821 HydrophobicContact CG-CB 4.11Å; L821-Y900 HydrophobicContact CB-CD1 4.34Å; L821-Y900 HydrophobicContact CB-CE1 4.35Å; L821-Y900 HydrophobicContact CD1-CD1 4.26Å; L821-Y900 HydrophobicContact CD1-CG 4.15Å; L821-Y900 HydrophobicContact CD2-CD1 3.58Å; L821-Y900 HydrophobicContact CD2-CD2 3.82Å; L821-Y900 HydrophobicContact CD2-CE1 3.38Å; L821-Y900 HydrophobicContact CD2-CE2 3.68Å; L821-Y900 HydrophobicContact CD2-CG 3.76Å; L821-Y900 VanDerWaalsContact CD2-CZ 3.42Å; L821-Y900 HydrophobicContact CG-CD1 3.37Å; L821-Y900 HydrophobicContact CG-CD2 4.27Å; L821-Y900 HydrophobicContact CG-CE1 3.61Å; L821-Y900 HydrophobicContact CG-CG 3.69Å
822	Y	86.8	Confident	87.9	Confident	56 Å²	56	44.2 Å²	44.2	22%	0.22	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	128.8	-175.5	-71.7	-91.1	0	0	0	111.3	V820 Y900 E901 L909 I915	V820-Y822 HydrophobicContact CB-CD2 4.25Å; V820-Y822 HydrophobicContact CB-CE2 3.64Å; V820-Y822 HydrophobicContact CG1-CD1 4.39Å; V820-Y822 HydrophobicContact CG1-CD2 3.99Å; V820-Y822 HydrophobicContact CG1-CE1 4.1Å; V820-Y822 HydrophobicContact CG1-CE2 3.64Å; V820-Y822 HydrophobicContact CG1-CG 4.37Å; V820-Y822 VanDerWaalsContact O-CD2 3.23Å; V820-Y822 WeakPolarHBondContact O-CD2 3.07Å; V820-Y822 WeakPolarHBondContact O-CE2 3.41Å; V820-Y822 PolarHBondContact O-N 3.34Å; Y822-Y900 CarbonylContact O-C 3.56Å; Y822-Y900 WeakPolarHBondContact O-CA 3.41Å; Y822-Y900 WeakPolarHBondContact O-CD1 3.25Å; Y822-E901 PolarHBondContact O-N 3.36Å; Y822-L909 HydrophobicContact CD2-CD1 3.4Å; Y822-L909 VanDerWaalsContact CD2-CD1 3.4Å; Y822-L909 HydrophobicContact CD2-CD2 3.55Å; Y822-L909 HydrophobicContact CD2-CG 4.03Å; Y822-L909 HydrophobicContact CE2-CD1 3.21Å; Y822-L909 HydrophobicContact CE2-CD2 4.27Å; Y822-L909 HydrophobicContact CE2-CG 4.26Å; Y822-L909 HydrophobicContact CG-CD1 4.3Å; Y822-L909 HydrophobicContact CG-CD2 4.13Å; Y822-I915 HydrophobicContact CD1-CD1 3.72Å; Y822-I915 HydrophobicContact CD1-CG2 4.13Å; Y822-I915 HydrophobicContact CE1-CD1 4.3Å; Y822-I915 HydrophobicContact CE1-CG2 3.73Å; Y822-I915 HydrophobicContact CG-CD1 3.88Å
823	K	90	Very high	88.4	Confident	28 Å²	28	43.4 Å²	43.4	12%	0.122	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-71	136.3	-178.2	-66.2	-179.2	-177.6	173.3	0	110.6	S810 V811 L825 E877 N878 Y900	S810-K823 WeakPolarHBondContact O-CD 3.34Å; S810-K823 PolarHBondContact O-NZ 2.93Å; V811-K823 WeakPolarHBondContact O-CB 3.3Å; V811-K823 PolarHBondContact O-N 3.36Å; K823-L825 HydrophobicContact CB-CD1 4.3Å; K823-L825 HydrophobicContact CB-CD2 4.16Å; K823-L825 HydrophobicContact CB-CG 3.92Å; K823-L825 PolarHBondContact O-N 2.91Å; K823-E877 IonicContact NZ-OE2 2.9Å; K823-E877 PolarHBondContact NZ-OE2 3Å; K823-N878 HydrophobicContact CB-CB 3.86Å; K823-N878 HydrophobicContact CG-CB 4.33Å; K823-Y900 HydrophobicContact CG-CE1 4.31Å
824	Y	88.6	Confident	88.8	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.012	21%	0.21	C	C	.	.			trans	-83.3	103	171.3	-179.4	-107.6	0	0	0	110.4	N826 L859 N878 L899 E901 F950 R955 P973	Y824-N826 HydrophobicContact CE1-CB 3.82Å; Y824-L859 HydrophobicContact CE1-CD1 3.73Å; Y824-L859 WeakPolarHBondContact OH-CD1 3.46Å; Y824-N878 WeakPolarHBondContact O-CB 3.39Å; Y824-L899 HydrophobicContact CD1-CB 3.92Å; Y824-L899 HydrophobicContact CD1-CD1 3.96Å; Y824-L899 HydrophobicContact CG-CB 4.3Å; Y824-L899 PolarHBondContact N-O 2.98Å; Y824-E901 WeakPolarHBondContact CD2-OE1 3.47Å; Y824-F950 HydrophobicContact CE2-CE2 4.36Å; Y824-R955 VanDerWaalsContact CE2-NE 3.25Å; Y824-P973 HydrophobicContact CD1-CB 3.82Å; Y824-P973 HydrophobicContact CD1-CG 4.09Å; Y824-P973 HydrophobicContact CD2-CB 4.16Å; Y824-P973 HydrophobicContact CE1-CB 4.23Å; Y824-P973 HydrophobicContact CE1-CG 4.07Å; Y824-P973 HydrophobicContact CG-CB 3.74Å; Y824-P973 HydrophobicContact CG-CG 4.47Å
825	L	87.8	Confident	89.1	Confident	32 Å²	32	37.3 Å²	37.3	17%	0.168	19%	0.189	C	C	.	.			trans	-111.3	75.4	-170.7	-65.7	177	0	0	0	112.5	I808 K823 P827 E877 N878	I808-L825 HydrophobicContact CD1-CD1 3.95Å; I808-L825 HydrophobicContact CD1-CD2 3.7Å; I808-L825 HydrophobicContact CD1-CG 4.33Å; I808-L825 HydrophobicContact CG2-CD1 3.93Å; K823-L825 HydrophobicContact CB-CD1 4.3Å; K823-L825 HydrophobicContact CB-CD2 4.16Å; K823-L825 HydrophobicContact CB-CG 3.92Å; K823-L825 PolarHBondContact O-N 2.91Å; L825-P827 WeakPolarHBondContact O-CD 3.3Å; L825-E877 HydrophobicContact CD2-CB 4.25Å; L825-N878 HydrophobicContact CD2-CB 3.84Å
826	N	88.9	Confident	89.2	Confident	2 Å²	2	36 Å²	36	1%	0.011	18%	0.184	C	C	.	.			trans	-91.1	112.9	176.7	-175.7	-1.2	0	0	0	111.7	Y824 N828 L829 D852 F950	Y824-N826 HydrophobicContact CE1-CB 3.82Å; N826-N828 PolarHBondContact O-N 2.74Å; N826-N828 WeakPolarHBondContact OD1-CA 3.21Å; N826-N828 WeakPolarHBondContact OD1-CB 3.33Å; N826-N828 PolarHBondContact OD1-N 2.83Å; N826-L829 HydrophobicContact CB-CB 3.96Å; N826-L829 WeakPolarHBondContact O-CB 3.35Å; N826-L829 PolarHBondContact O-N 2.7Å; N826-D852 PolarHBondContact ND2-OD2 2.84Å; N826-F950 HydrophobicContact CB-CE1 4.29Å; N826-F950 HydrophobicContact CB-CE2 4.28Å; N826-F950 HydrophobicContact CB-CZ 3.6Å; N826-F950 VanDerWaalsContact CG-CZ 3.41Å; N826-F950 WeakPolarHBondContact OD1-CE1 3.48Å; N826-F950 WeakPolarHBondContact OD1-CZ 3.42Å
827	P	87.3	Confident	89.5	Confident	61 Å²	61	36.6 Å²	36.6	40%	0.396	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-21.9	175.6	27.4	-34.2	0	0	0	113.4	L825 L829	L825-P827 WeakPolarHBondContact O-CD 3.3Å; P827-L829 VanDerWaalsContact C-N 3.34Å
828	N	91	Very high	89.5	Confident	61 Å²	61	34.7 Å²	34.7	33%	0.326	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	12.5	-177.7	-50.8	-42.8	0	0	0	112.5	N826 V853 V854 S952	N826-N828 PolarHBondContact O-N 2.74Å; N826-N828 WeakPolarHBondContact OD1-CA 3.21Å; N826-N828 WeakPolarHBondContact OD1-CB 3.33Å; N826-N828 PolarHBondContact OD1-N 2.83Å; N828-V853 WeakPolarHBondContact O-CB 3.25Å; N828-V853 WeakPolarHBondContact O-CG2 3.28Å; N828-V853 PolarHBondContact O-N 2.86Å; N828-V854 HydrophobicContact CB-CG2 3.87Å; N828-S952 PolarHBondContact ND2-OG 2.59Å
829	L	93.4	Very high	89.5	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.7	176.7	-179.8	64.7	0	0	0	110.4	N826 P827 L850 I851 L859 L899	N826-L829 HydrophobicContact CB-CB 3.96Å; N826-L829 WeakPolarHBondContact O-CB 3.35Å; N826-L829 PolarHBondContact O-N 2.7Å; P827-L829 VanDerWaalsContact C-N 3.34Å; L829-L850 HydrophobicContact CD1-CB 3.99Å; L829-I851 WeakPolarHBondContact CA-O 3.46Å; L829-I851 WeakPolarHBondContact CD1-O 3.32Å; L829-L859 HydrophobicContact CD1-CD1 3.89Å; L829-L899 HydrophobicContact CD2-CD1 3.42Å; L829-L899 VanDerWaalsContact CD2-CD1 3.42Å
830	I	95.6	Very high	89.5	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.031	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.4	170.2	-169.6	169.6	0	0	0	110.5	F750 I752 A799 V832 L850 I851 V853	F750-I830 HydrophobicContact CD2-CD1 4.31Å; F750-I830 HydrophobicContact CE2-CD1 3.35Å; F750-I830 HydrophobicContact CZ-CD1 3.56Å; I752-I830 HydrophobicContact CD1-CD1 3.81Å; A799-I830 HydrophobicContact CB-CD1 4.16Å; I830-V832 HydrophobicContact CD1-CG2 4.35Å; I830-V832 HydrophobicContact CG1-CG2 4.15Å; I830-V832 HydrophobicContact CG2-CG2 4.29Å; I830-L850 WeakPolarHBondContact O-CA 3.45Å; I830-I851 HydrophobicContact CG2-CB 3.87Å; I830-I851 PolarHBondContact N-O 3.47Å; I830-I851 PolarHBondContact O-N 2.84Å; I830-V853 HydrophobicContact CB-CG2 4.01Å; I830-V853 HydrophobicContact CG2-CG2 3.53Å
831	A	96.8	Very high	89.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.8	167.2	0	0	0	0	0	109.3	A799 A800 Y849 L850 L873 I880	A799-A831 CarbonylContact C-O 3.53Å; A799-A831 WeakPolarHBondContact CA-O 3.09Å; A800-A831 PolarHBondContact N-O 3.35Å; A800-A831 PolarHBondContact O-N 3.26Å; A831-Y849 CarbonylContact C-O 3.6Å; A831-Y849 WeakPolarHBondContact CA-O 3.28Å; A831-L850 HydrophobicContact CB-CD2 3.56Å; A831-L873 HydrophobicContact CB-CD1 4.1Å; A831-L873 HydrophobicContact CB-CD2 4.04Å; A831-L873 HydrophobicContact CB-CG 4.46Å; A831-L873 WeakPolarHBondContact O-CD2 3.21Å; A831-I880 HydrophobicContact CB-CG1 4.22Å; A831-I880 HydrophobicContact CB-CG2 4.02Å
832	V	96.9	Very high	89.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.6	-179.6	-177.8	0	0	0	0	109.2	L759 L784 I796 A799 I830 T834 I848 Y849 I851	L759-V832 HydrophobicContact CD2-CG2 3.97Å; L784-V832 HydrophobicContact CD1-CG1 3.91Å; I796-V832 HydrophobicContact CB-CG1 4.48Å; I796-V832 HydrophobicContact CD1-CG1 4.05Å; I796-V832 HydrophobicContact CG1-CG1 3.85Å; I796-V832 HydrophobicContact CG2-CG1 3.84Å; A799-V832 HydrophobicContact CB-CG2 4.35Å; I830-V832 HydrophobicContact CD1-CG2 4.35Å; I830-V832 HydrophobicContact CG1-CG2 4.15Å; I830-V832 HydrophobicContact CG2-CG2 4.29Å; V832-T834 HydrophobicContact CG1-CG2 4.44Å; V832-I848 CarbonylContact O-C 3.59Å; V832-I848 WeakPolarHBondContact O-CA 3.36Å; V832-Y849 PolarHBondContact N-O 3.02Å; V832-Y849 PolarHBondContact O-N 2.79Å; V832-I851 HydrophobicContact CG2-CD1 4.18Å
833	L	95.8	Very high	89.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	130.4	173.3	-75.2	173.9	0	0	0	110.9	I796 V797 A798 L846 M847 I848 I871 L873 Y882	I796-L833 WeakPolarHBondContact CA-O 3.26Å; V797-L833 PolarHBondContact N-O 2.89Å; A798-L833 HydrophobicContact CB-CB 4.46Å; A798-L833 HydrophobicContact CB-CD1 4.45Å; A798-L833 PolarHBondContact O-N 3.36Å; L833-L846 HydrophobicContact CB-CD1 4.42Å; L833-L846 HydrophobicContact CD2-CD1 4.09Å; L833-L846 HydrophobicContact CD2-CG 4.36Å; L833-M847 CarbonylContact C-O 3.56Å; L833-M847 VanDerWaalsContact CA-O 3.32Å; L833-M847 WeakPolarHBondContact CA-O 3.34Å; L833-I848 HydrophobicContact CD2-CB 3.58Å; L833-I848 HydrophobicContact CD2-CD1 4.06Å; L833-I848 HydrophobicContact CD2-CG1 3.88Å; L833-I871 HydrophobicContact CD1-CG2 3.51Å; L833-L873 HydrophobicContact CD1-CB 3.84Å; L833-L873 HydrophobicContact CD1-CD1 4.08Å; L833-L873 HydrophobicContact CD1-CD2 4.21Å; L833-L873 HydrophobicContact CD1-CG 4.26Å; L833-L873 HydrophobicContact CG-CD1 4.32Å; L833-L873 HydrophobicContact CG-CD2 4.12Å; L833-Y882 HydrophobicContact CD1-CD2 4.26Å; L833-Y882 HydrophobicContact CD1-CG 4.31Å; L833-Y882 HydrophobicContact CD2-CD2 3.98Å; L833-Y882 HydrophobicContact CD2-CE2 4.27Å; L833-Y882 HydrophobicContact CD2-CG 4.38Å
834	T	95.1	Very high	89.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	141.3	172.4	71	0	0	0	0	111.6	A757 L784 H794 I795 I796 V832 L846 M847 Y849	A757-T834 HydrophobicContact CB-CG2 4.45Å; L784-T834 HydrophobicContact CB-CG2 4.26Å; L784-T834 HydrophobicContact CD1-CG2 3.92Å; H794-T834 PolarHBondContact ND1-OG1 3.13Å; I795-T834 CarbonylContact O-C 3.59Å; I795-T834 WeakPolarHBondContact O-CA 3.44Å; I795-T834 WeakPolarHBondContact O-CB 3.49Å; I796-T834 HydrophobicContact CG1-CG2 3.83Å; V832-T834 HydrophobicContact CG1-CG2 4.44Å; T834-L846 CarbonylContact O-C 3.45Å; T834-L846 WeakPolarHBondContact O-CA 3.41Å; T834-L846 WeakPolarHBondContact O-CD1 3.47Å; T834-M847 PolarHBondContact N-O 3.15Å; T834-M847 PolarHBondContact O-N 2.81Å; T834-Y849 HydrophobicContact CG2-CD2 4.42Å; T834-Y849 HydrophobicContact CG2-CE2 4.19Å
835	I	92.3	Very high	89.8	Confident	32 Å²	32	36.4 Å²	36.4	16%	0.164	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.1	171.9	-160.4	173	0	0	0	109.1	H794 I795 V797 T845 I871	H794-I835 CarbonylContact C-O 3.6Å; H794-I835 WeakPolarHBondContact CA-O 3.31Å; I795-I835 HydrophobicContact CD1-CG2 4.32Å; I795-I835 HydrophobicContact CG1-CG2 3.8Å; I795-I835 PolarHBondContact N-O 3.14Å; I795-I835 PolarHBondContact O-N 3.17Å; V797-I835 HydrophobicContact CG2-CB 3.63Å; V797-I835 HydrophobicContact CG2-CG2 3.17Å; I835-T845 WeakPolarHBondContact CA-O 3.38Å; I835-I871 HydrophobicContact CD1-CD1 4.38Å
836	G	89.7	Confident	90.1	Very high	6 Å²	6	34.9 Å²	34.9	6%	0.062	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	173.8	174.6	0	0	0	0	0	111.2	H794 N844 T845	H794-G836 PolarHBondContact ND1-N 3.1Å; G836-N844 CarbonylContact O-C 3.57Å; G836-N844 VanDerWaalsContact O-CA 3.27Å; G836-N844 WeakPolarHBondContact O-CA 3.32Å; G836-T845 PolarHBondContact N-O 3.14Å; G836-T845 PolarHBondContact O-N 3.39Å
837	G	86.5	Confident	90.4	Very high	28 Å²	28	36.5 Å²	36.5	29%	0.289	21%	0.209	S	C	.	.	S	Bend	trans	77.9	173.4	-174.4	0	0	0	0	0	113.2	V791	V791-G837 WeakPolarHBondContact O-CA 3.48Å
838	D	83.7	Confident	90.8	Very high	64 Å²	64	33.6 Å²	33.6	34%	0.342	19%	0.19	S	C	.	.			trans	-112.7	141.1	-175.9	161.6	48.5	0	0	0	111.7	N840 S841 H842 T843 N844	D838-N840 PolarHBondContact OD1-N 3.07Å; D838-N840 VanDerWaalsContact OD1-N 3.1Å; D838-S841 WeakPolarHBondContact CB-OG 3.27Å; D838-S841 PolarHBondContact O-OG 3.12Å; D838-S841 WeakPolarHBondContact OD2-CB 3.41Å; D838-S841 PolarHBondContact OD2-N 2.88Å; D838-S841 PolarHBondContact OD2-OG 3.07Å; D838-H842 PolarHBondContact O-N 2.8Å; D838-T843 PolarHBondContact N-OG1 3.32Å; D838-T843 PolarHBondContact O-N 3.19Å; D838-T843 PolarHBondContact O-OG1 3.15Å; D838-N844 PolarHBondContact O-N 2.95Å
839	I	82.8	Confident	91	Very high	75 Å²	75	32.2 Å²	32.2	39%	0.385	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-40	-177.6	-62.3	170.6	0	0	0	110	H842 N844	I839-H842 PolarHBondContact O-N 3.16Å; I839-H842 VanDerWaalsContact O-N 3.1Å; I839-H842 PolarHBondContact O-ND1 3.35Å; I839-N844 HydrophobicContact CG1-CB 4.25Å
840	N	84	Confident	91.1	Very high	138 Å²	138	32.1 Å²	32.1	74%	0.738	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-42.6	-176.6	-63.7	-40.7	0	0	0	111.6	D838 H842	D838-N840 PolarHBondContact OD1-N 3.07Å; D838-N840 VanDerWaalsContact OD1-N 3.1Å; N840-H842 PolarHBondContact O-N 3.28Å
841	S	84.5	Confident	91	Very high	59 Å²	59	31.9 Å²	31.9	41%	0.413	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-2.4	171.6	58.5	0	0	0	0	114.2	D838 T843	D838-S841 WeakPolarHBondContact CB-OG 3.27Å; D838-S841 PolarHBondContact O-OG 3.12Å; D838-S841 WeakPolarHBondContact OD2-CB 3.41Å; D838-S841 PolarHBondContact OD2-N 2.88Å; D838-S841 PolarHBondContact OD2-OG 3.07Å; S841-T843 PolarHBondContact O-N 2.97Å; S841-T843 PolarHBondContact OG-OG1 3.08Å
842	H	84.6	Confident	90.8	Very high	110 Å²	110	32 Å²	32	51%	0.509	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	27.4	-178.1	-56.5	-34.1	0	0	0	114.1	D838 I839 N840 R866	D838-H842 PolarHBondContact O-N 2.8Å; I839-H842 PolarHBondContact O-N 3.16Å; I839-H842 VanDerWaalsContact O-N 3.1Å; I839-H842 PolarHBondContact O-ND1 3.35Å; N840-H842 PolarHBondContact O-N 3.28Å; H842-R866 PolarHBondContact CD2-NH2 2.77Å; H842-R866 PolarHBondContact CE1-NH2 2.9Å; H842-R866 VanDerWaalsContact CE1-NH2 3.26Å; H842-R866 PolarHBondContact ND1-NH2 2.68Å; H842-R866 VanDerWaalsContact ND1-NH2 3.11Å; H842-R866 PolarHBondContact NE2-NH2 3.44Å
843	T	87.3	Confident	90.5	Very high	62 Å²	62	32.6 Å²	32.6	38%	0.38	18%	0.183	S	C	.	.			trans	-97.6	-1.3	178.4	56.7	0	0	0	0	112.6	D838 S841 T845	D838-T843 PolarHBondContact N-OG1 3.32Å; D838-T843 PolarHBondContact O-N 3.19Å; D838-T843 PolarHBondContact O-OG1 3.15Å; S841-T843 PolarHBondContact O-N 2.97Å; S841-T843 PolarHBondContact OG-OG1 3.08Å; T843-T845 PolarHBondContact O-N 3.39Å
844	N	89.3	Confident	90.3	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.011	19%	0.187	C	C	.	.			trans	-57.7	129.8	-179.3	60.8	-48.4	0	0	0	112.5	G836 D838 I839 R866 C867 H887	G836-N844 CarbonylContact O-C 3.57Å; G836-N844 VanDerWaalsContact O-CA 3.27Å; G836-N844 WeakPolarHBondContact O-CA 3.32Å; D838-N844 PolarHBondContact O-N 2.95Å; I839-N844 HydrophobicContact CG1-CB 4.25Å; N844-R866 WeakPolarHBondContact O-CA 3.44Å; N844-R866 PolarHBondContact O-N 2.91Å; N844-R866 WeakPolarHBondContact OD1-CA 3.46Å; N844-C867 PolarHBondContact ND2-N 3.15Å; N844-C867 PolarHBondContact ND2-O 2.89Å; N844-H887 PolarHBondContact ND2-CD2 2.62Å
845	T	92	Very high	89.8	Confident	25 Å²	25	34.4 Å²	34.4	15%	0.153	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	142.1	-179.9	54.4	0	0	0	0	111	H794 I835 G836 T843 H864 R865	H794-T845 PolarHBondContact CE1-OG1 2.97Å; H794-T845 PolarHBondContact NE2-OG1 3.25Å; I835-T845 WeakPolarHBondContact CA-O 3.38Å; G836-T845 PolarHBondContact N-O 3.14Å; G836-T845 PolarHBondContact O-N 3.39Å; T843-T845 PolarHBondContact O-N 3.39Å; T845-H864 WeakPolarHBondContact CA-O 3.31Å; T845-R865 HydrophobicContact CG2-CG 4.33Å
846	L	94	Very high	89.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129	176	174.7	71.6	0	0	0	108.2	L833 T834 H864 C867 I871 Y882 Y884	L833-L846 HydrophobicContact CB-CD1 4.42Å; L833-L846 HydrophobicContact CD2-CD1 4.09Å; L833-L846 HydrophobicContact CD2-CG 4.36Å; T834-L846 CarbonylContact O-C 3.45Å; T834-L846 WeakPolarHBondContact O-CA 3.41Å; T834-L846 WeakPolarHBondContact O-CD1 3.47Å; L846-H864 HydrophobicContact CB-CB 4.2Å; L846-H864 PolarHBondContact N-O 2.91Å; L846-H864 PolarHBondContact O-N 3.03Å; L846-C867 HydrophobicContact CB-CB 3.97Å; L846-C867 HydrophobicContact CD2-CB 4.4Å; L846-I871 HydrophobicContact CD1-CD1 3.69Å; L846-Y882 HydrophobicContact CD2-CE2 4.46Å; L846-Y884 HydrophobicContact CD2-CD1 3.69Å; L846-Y884 HydrophobicContact CD2-CD2 4.31Å; L846-Y884 HydrophobicContact CD2-CE1 4.5Å; L846-Y884 HydrophobicContact CD2-CG 3.59Å
847	M	95.3	Very high	89.5	Confident	36 Å²	36	38.5 Å²	38.5	18%	0.177	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	139.2	179.4	-52.4	-178.5	173.5	0	0	110.3	L833 T834 Y849 A862 V863	L833-M847 CarbonylContact C-O 3.56Å; L833-M847 VanDerWaalsContact CA-O 3.32Å; L833-M847 WeakPolarHBondContact CA-O 3.34Å; T834-M847 PolarHBondContact N-O 3.15Å; T834-M847 PolarHBondContact O-N 2.81Å; M847-Y849 HydrophobicContact CB-CD2 4.48Å; M847-Y849 HydrophobicContact CB-CE2 3.64Å; M847-Y849 PolarHBondContact SD-OH 3.2Å; M847-A862 WeakPolarHBondContact CA-O 3.25Å; M847-V863 HydrophobicContact CE-CG1 4.03Å; M847-V863 HydrophobicContact CE-CG2 4.28Å; M847-V863 HydrophobicContact CG-CB 4.44Å; M847-V863 HydrophobicContact CG-CG1 4.13Å; M847-V863 HydrophobicContact CG-CG2 3.99Å; M847-V863 HydrophobicContact SD-CG2 4.28Å
848	I	95.7	Very high	89.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.3	172.4	-171.5	163.8	0	0	0	109.9	V832 L833 L850 S861 A862 L873 I880 Y882 I897	V832-I848 CarbonylContact O-C 3.59Å; V832-I848 WeakPolarHBondContact O-CA 3.36Å; L833-I848 HydrophobicContact CD2-CB 3.58Å; L833-I848 HydrophobicContact CD2-CD1 4.06Å; L833-I848 HydrophobicContact CD2-CG1 3.88Å; I848-L850 HydrophobicContact CD1-CD2 4.42Å; I848-L850 HydrophobicContact CG1-CD2 4.39Å; I848-S861 CarbonylContact O-C 3.58Å; I848-S861 WeakPolarHBondContact O-CA 3.35Å; I848-A862 HydrophobicContact CG2-CB 3.7Å; I848-A862 PolarHBondContact N-O 3.12Å; I848-A862 PolarHBondContact O-N 2.86Å; I848-L873 HydrophobicContact CD1-CD1 4.34Å; I848-I880 HydrophobicContact CD1-CG2 4.24Å; I848-Y882 HydrophobicContact CD1-CD1 3.58Å; I848-Y882 HydrophobicContact CD1-CE1 3.5Å; I848-Y882 VanDerWaalsContact CD1-CE1 3.5Å; I848-Y882 HydrophobicContact CD1-CG 4.2Å; I848-Y882 HydrophobicContact CG2-CE1 4.5Å; I848-I897 HydrophobicContact CD1-CD1 3.91Å; I848-I897 HydrophobicContact CG2-CD1 4.3Å
849	Y	96.1	Very high	89.8	Confident	31 Å²	31	39.2 Å²	39.2	12%	0.122	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.8	175.9	-59.4	-86.1	0	0	0	109.5	L784 A831 V832 T834 M847 I858	L784-Y849 HydrophobicContact CB-CE2 4.3Å; L784-Y849 HydrophobicContact CD1-CD2 3.8Å; L784-Y849 HydrophobicContact CD1-CE2 4.16Å; L784-Y849 HydrophobicContact CD1-CG 4.32Å; L784-Y849 HydrophobicContact CD2-CD1 4.03Å; L784-Y849 HydrophobicContact CD2-CD2 4.04Å; L784-Y849 HydrophobicContact CD2-CE1 4.11Å; L784-Y849 HydrophobicContact CD2-CE2 4.12Å; L784-Y849 HydrophobicContact CD2-CG 3.99Å; L784-Y849 HydrophobicContact CG-CD2 4.42Å; L784-Y849 HydrophobicContact CG-CE2 4.43Å; A831-Y849 CarbonylContact C-O 3.6Å; A831-Y849 WeakPolarHBondContact CA-O 3.28Å; V832-Y849 PolarHBondContact N-O 3.02Å; V832-Y849 PolarHBondContact O-N 2.79Å; T834-Y849 HydrophobicContact CG2-CD2 4.42Å; T834-Y849 HydrophobicContact CG2-CE2 4.19Å; M847-Y849 HydrophobicContact CB-CD2 4.48Å; M847-Y849 HydrophobicContact CB-CE2 3.64Å; M847-Y849 PolarHBondContact SD-OH 3.2Å; Y849-I858 HydrophobicContact CD1-CD1 4.11Å; Y849-I858 HydrophobicContact CD1-CG2 4.32Å
850	L	95.6	Very high	90.3	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.2	170.6	-56.4	-171.1	0	0	0	108.2	L829 I830 A831 I848 I858 L859 Y860 I880 I897 L899	L829-L850 HydrophobicContact CD1-CB 3.99Å; I830-L850 WeakPolarHBondContact O-CA 3.45Å; A831-L850 HydrophobicContact CB-CD2 3.56Å; I848-L850 HydrophobicContact CD1-CD2 4.42Å; I848-L850 HydrophobicContact CG1-CD2 4.39Å; L850-I858 CarbonylContact O-C 3.52Å; L850-I858 WeakPolarHBondContact O-CA 3.17Å; L850-L859 PolarHBondContact O-N 2.91Å; L850-Y860 HydrophobicContact CD1-CD1 4.03Å; L850-Y860 HydrophobicContact CD1-CG 4.38Å; L850-Y860 HydrophobicContact CG-CD1 4.17Å; L850-Y860 PolarHBondContact N-O 2.82Å; L850-I880 HydrophobicContact CD1-CD1 3.93Å; L850-I880 HydrophobicContact CD2-CD1 3.96Å; L850-I880 HydrophobicContact CD2-CG1 4.25Å; L850-I897 HydrophobicContact CD1-CG2 4.18Å; L850-L899 HydrophobicContact CD1-CD1 4.02Å; L850-L899 HydrophobicContact CD1-CD2 3.87Å; L850-L899 HydrophobicContact CD1-CG 4.41Å
851	I	93.8	Very high	90.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.3	-169.4	-57.2	167.8	0	0	0	109.6	L759 M782 L829 I830 V832 V853 R857 I858	L759-I851 HydrophobicContact CD2-CD1 4.09Å; M782-I851 HydrophobicContact CE-CG2 4.4Å; M782-I851 HydrophobicContact SD-CD1 3.77Å; M782-I851 HydrophobicContact SD-CG1 4.33Å; L829-I851 WeakPolarHBondContact CA-O 3.46Å; L829-I851 WeakPolarHBondContact CD1-O 3.32Å; I830-I851 HydrophobicContact CG2-CB 3.87Å; I830-I851 PolarHBondContact N-O 3.47Å; I830-I851 PolarHBondContact O-N 2.84Å; V832-I851 HydrophobicContact CG2-CD1 4.18Å; I851-V853 PolarHBondContact O-N 2.81Å; I851-R857 CarbonylContact C-O 3.45Å; I851-R857 VanDerWaalsContact CA-O 3.3Å; I851-R857 WeakPolarHBondContact CA-O 3.33Å; I851-I858 HydrophobicContact CG1-CG1 4.3Å
852	D	91.6	Very high	91.3	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	115	163.9	-173.3	-53.8	0	0	0	108.9	N826 V854 A855 G856 R857 L859 S952	N826-D852 PolarHBondContact ND2-OD2 2.84Å; D852-V854 VanDerWaalsContact C-N 3.32Å; D852-V854 PolarHBondContact O-N 2.75Å; D852-V854 WeakPolarHBondContact OD1-CA 3.11Å; D852-V854 PolarHBondContact OD1-N 2.96Å; D852-A855 HydrophobicContact CB-CB 4.31Å; D852-A855 PolarHBondContact OD1-N 3.43Å; D852-G856 VanDerWaalsContact O-CA 3.27Å; D852-G856 WeakPolarHBondContact O-CA 3.35Å; D852-G856 PolarHBondContact O-N 2.83Å; D852-R857 PolarHBondContact N-O 3.43Å; D852-R857 PolarHBondContact O-N 2.81Å; D852-L859 HydrophobicContact CB-CD1 4.48Å; D852-S952 WeakPolarHBondContact OD1-CB 3.43Å; D852-S952 PolarHBondContact OD1-OG 3.12Å; D852-S952 WeakPolarHBondContact OD2-CB 3.19Å; D852-S952 PolarHBondContact OD2-OG 3.03Å
853	V	91.3	Very high	91.7	Very high	11 Å²	11	31 Å²	31	7%	0.067	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-28.5	-174.9	169.4	0	0	0	0	113	F750 W780 N828 I830 I851	F750-V853 HydrophobicContact CB-CG1 3.8Å; F750-V853 HydrophobicContact CD1-CB 4.26Å; F750-V853 HydrophobicContact CD1-CG1 3.26Å; F750-V853 HydrophobicContact CD1-CG2 3.94Å; F750-V853 HydrophobicContact CE1-CG1 4.07Å; F750-V853 HydrophobicContact CE1-CG2 4.11Å; F750-V853 HydrophobicContact CG-CG1 3.72Å; F750-V853 HydrophobicContact CG-CG2 4.22Å; W780-V853 WeakPolarHBondContact CZ2-O 3.49Å; W780-V853 PolarHBondContact NE1-O 3.48Å; N828-V853 WeakPolarHBondContact O-CB 3.25Å; N828-V853 WeakPolarHBondContact O-CG2 3.28Å; N828-V853 PolarHBondContact O-N 2.86Å; I830-V853 HydrophobicContact CB-CG2 4.01Å; I830-V853 HydrophobicContact CG2-CG2 3.53Å; I851-V853 PolarHBondContact O-N 2.81Å
854	V	90.5	Very high	92	Very high	14 Å²	14	29.5 Å²	29.5	9%	0.085	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-49	-178.4	175.1	0	0	0	0	109.8	Y748 N828 D852 L953	Y748-V854 HydrophobicContact CD1-CG1 4.19Å; Y748-V854 HydrophobicContact CD2-CG1 3.99Å; Y748-V854 HydrophobicContact CD2-CG2 4.14Å; Y748-V854 HydrophobicContact CE1-CG1 4.14Å; Y748-V854 HydrophobicContact CE2-CG1 3.95Å; Y748-V854 HydrophobicContact CG-CG1 4.11Å; Y748-V854 HydrophobicContact CG-CG2 4.1Å; N828-V854 HydrophobicContact CB-CG2 3.87Å; D852-V854 VanDerWaalsContact C-N 3.32Å; D852-V854 PolarHBondContact O-N 2.75Å; D852-V854 WeakPolarHBondContact OD1-CA 3.11Å; D852-V854 PolarHBondContact OD1-N 2.96Å; V854-L953 HydrophobicContact CG1-CD2 4.09Å; V854-L953 HydrophobicContact CG1-CG 4.05Å
855	A	85.2	Confident	92.2	Very high	25 Å²	25	39 Å²	39	21%	0.207	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-20.6	-179.6	0	0	0	0	0	113.3	D852 R857 A956	D852-A855 HydrophobicContact CB-CB 4.31Å; D852-A855 PolarHBondContact OD1-N 3.43Å; A855-R857 HydrophobicContact CB-CG 4.29Å; A855-A956 HydrophobicContact CB-CB 3.79Å
856	G	87.9	Confident	92.3	Very high	15 Å²	15	41.7 Å²	41.7	16%	0.155	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	31.6	-177.4	0	0	0	0	0	113.8	W780 D852	W780-G856 VanDerWaalsContact CD1-CA 3.43Å; D852-G856 VanDerWaalsContact O-CA 3.27Å; D852-G856 WeakPolarHBondContact O-CA 3.35Å; D852-G856 PolarHBondContact O-N 2.83Å
857	R	86.8	Confident	92.2	Very high	109 Å²	109	41.8 Å²	41.8	41%	0.411	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	144.9	-173.4	-67.6	-169.7	-176.2	168.1	6.8	112.6	I851 D852 A855 A956	I851-R857 CarbonylContact C-O 3.45Å; I851-R857 VanDerWaalsContact CA-O 3.3Å; I851-R857 WeakPolarHBondContact CA-O 3.33Å; D852-R857 PolarHBondContact N-O 3.43Å; D852-R857 PolarHBondContact O-N 2.81Å; A855-R857 HydrophobicContact CB-CG 4.29Å; R857-A956 VanDerWaalsContact NH1-C 3.27Å; R857-A956 PolarHBondContact NH1-O 2.92Å; R857-A956 PolarHBondContact NH2-O 2.85Å
858	I	89.7	Confident	92.1	Very high	76 Å²	76	40.7 Å²	40.7	39%	0.39	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	114.8	171.3	-54.5	174.3	0	0	0	107.3	M782 Y849 L850 I851 Y860	M782-I858 HydrophobicContact CE-CD1 4Å; M782-I858 HydrophobicContact CE-CG1 3.51Å; M782-I858 HydrophobicContact SD-CD1 3.8Å; M782-I858 HydrophobicContact SD-CG1 3.74Å; Y849-I858 HydrophobicContact CD1-CD1 4.11Å; Y849-I858 HydrophobicContact CD1-CG2 4.32Å; L850-I858 CarbonylContact O-C 3.52Å; L850-I858 WeakPolarHBondContact O-CA 3.17Å; I851-I858 HydrophobicContact CG1-CG1 4.3Å; I858-Y860 WeakPolarHBondContact CG2-O 3.3Å
859	L	88	Confident	91.8	Very high	30 Å²	30	45.2 Å²	45.2	16%	0.157	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-31.9	176	-60.4	-177.7	0	0	0	111.7	Y824 L829 L850 D852 P973	Y824-L859 HydrophobicContact CE1-CD1 3.73Å; Y824-L859 WeakPolarHBondContact OH-CD1 3.46Å; L829-L859 HydrophobicContact CD1-CD1 3.89Å; L850-L859 PolarHBondContact O-N 2.91Å; D852-L859 HydrophobicContact CB-CD1 4.48Å; L859-P973 HydrophobicContact CB-CG 4.4Å
860	Y	92.3	Very high	91.5	Very high	48 Å²	48	44.8 Å²	44.8	19%	0.188	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	148.4	-179.2	177.3	-97.1	0	0	0	110.5	L850 I858 A862 I897 V975 Q977	L850-Y860 HydrophobicContact CD1-CD1 4.03Å; L850-Y860 HydrophobicContact CD1-CG 4.38Å; L850-Y860 HydrophobicContact CG-CD1 4.17Å; L850-Y860 PolarHBondContact N-O 2.82Å; I858-Y860 WeakPolarHBondContact CG2-O 3.3Å; Y860-A862 HydrophobicContact CE1-CB 3.86Å; Y860-I897 HydrophobicContact CD1-CD1 4.24Å; Y860-I897 HydrophobicContact CE1-CD1 3.76Å; Y860-V975 HydrophobicContact CD1-CG1 4.44Å; Y860-V975 HydrophobicContact CD2-CB 4Å; Y860-V975 HydrophobicContact CD2-CG1 3.8Å; Y860-V975 HydrophobicContact CD2-CG2 3.76Å; Y860-V975 HydrophobicContact CE1-CG1 4.42Å; Y860-V975 HydrophobicContact CE2-CB 4.16Å; Y860-V975 HydrophobicContact CE2-CG1 3.77Å; Y860-V975 HydrophobicContact CE2-CG2 4.43Å; Y860-V975 HydrophobicContact CG-CG1 4.14Å; Y860-V975 HydrophobicContact CG-CG2 4.15Å; Y860-Q977 PolarHBondContact OH-OE1 2.84Å
861	S	94.4	Very high	91.3	Very high	67 Å²	67	45 Å²	45	47%	0.469	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	142.2	173.1	61.5	0	0	0	0	111.7	I848	I848-S861 CarbonylContact O-C 3.58Å; I848-S861 WeakPolarHBondContact O-CA 3.35Å
862	A	94.9	Very high	91.3	Very high	15 Å²	15	45.1 Å²	45.1	12%	0.124	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.8	172.7	0	0	0	0	0	112	M847 I848 Y860	M847-A862 WeakPolarHBondContact CA-O 3.25Å; I848-A862 HydrophobicContact CG2-CB 3.7Å; I848-A862 PolarHBondContact N-O 3.12Å; I848-A862 PolarHBondContact O-N 2.86Å; Y860-A862 HydrophobicContact CE1-CB 3.86Å
863	V	93.8	Very high	91.5	Very high	81 Å²	81	46 Å²	46	49%	0.491	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	123.6	-176.2	-178.6	0	0	0	0	110.5	M847	M847-V863 HydrophobicContact CE-CG1 4.03Å; M847-V863 HydrophobicContact CE-CG2 4.28Å; M847-V863 HydrophobicContact CG-CB 4.44Å; M847-V863 HydrophobicContact CG-CG1 4.13Å; M847-V863 HydrophobicContact CG-CG2 3.99Å; M847-V863 HydrophobicContact SD-CG2 4.28Å
864	H	94.1	Very high	91.7	Very high	29 Å²	29	46.2 Å²	46.2	13%	0.134	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.2	176.4	-69.4	-64.9	0	0	0	110.1	T845 L846 C867 Y882 Y884	T845-H864 WeakPolarHBondContact CA-O 3.31Å; L846-H864 HydrophobicContact CB-CB 4.2Å; L846-H864 PolarHBondContact N-O 2.91Å; L846-H864 PolarHBondContact O-N 3.03Å; H864-C867 HydrophobicContact CB-CB 4.2Å; H864-Y882 AromaticContact CD2-CE2 3.83Å; H864-Y882 PolarHBondContact CD2-OH 3.07Å; H864-Y882 AromaticContact NE2-CE2 3.75Å; H864-Y882 AromaticContact NE2-CZ 3.68Å; H864-Y882 PolarHBondContact NE2-OH 3.12Å; H864-Y884 PolarHBondContact CE1-OH 3.16Å; H864-Y884 AromaticContact NE2-CE1 3.96Å
865	R	93.2	Very high	92	Very high	203 Å²	203	45.9 Å²	45.9	77%	0.766	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	144.9	179	-62	-178.1	-178.7	172.8	0.5	110.8	T845 C867	T845-R865 HydrophobicContact CG2-CG 4.33Å; R865-C867 VanDerWaalsContact C-N 3.34Å; R865-C867 PolarHBondContact O-N 2.94Å; R865-C867 PolarHBondContact O-SG 3.37Å
866	R	93.1	Very high	92.4	Very high	81 Å²	81	44.8 Å²	44.8	31%	0.306	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	41.9	-179.4	-57.9	-175	70.5	177.9	4.2	113.7	H842 N844 H887	H842-R866 PolarHBondContact CD2-NH2 2.77Å; H842-R866 PolarHBondContact CE1-NH2 2.9Å; H842-R866 VanDerWaalsContact CE1-NH2 3.26Å; H842-R866 PolarHBondContact ND1-NH2 2.68Å; H842-R866 VanDerWaalsContact ND1-NH2 3.11Å; H842-R866 PolarHBondContact NE2-NH2 3.44Å; N844-R866 WeakPolarHBondContact O-CA 3.44Å; N844-R866 PolarHBondContact O-N 2.91Å; N844-R866 WeakPolarHBondContact OD1-CA 3.46Å; R866-H887 HydrophobicContact CB-CB 4.4Å; R866-H887 WeakPolarHBondContact O-CB 3.34Å; R866-H887 PolarHBondContact O-N 2.69Å
867	C	93.3	Very high	92.6	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.014	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	151	178.5	-66	0	0	0	0	111.4	N844 L846 H864 R865 Y884 Y885	N844-C867 PolarHBondContact ND2-N 3.15Å; N844-C867 PolarHBondContact ND2-O 2.89Å; L846-C867 HydrophobicContact CB-CB 3.97Å; L846-C867 HydrophobicContact CD2-CB 4.4Å; H864-C867 HydrophobicContact CB-CB 4.2Å; R865-C867 VanDerWaalsContact C-N 3.34Å; R865-C867 PolarHBondContact O-N 2.94Å; R865-C867 PolarHBondContact O-SG 3.37Å; C867-Y884 HydrophobicContact CB-CD2 3.82Å; C867-Y884 HydrophobicContact CB-CE2 4.36Å; C867-Y884 VanDerWaalsContact SG-CE2 3.6Å; C867-Y885 CarbonylContact C-O 3.58Å; C867-Y885 WeakPolarHBondContact CA-O 3.42Å
868	S	92	Very high	92.9	Very high	12 Å²	12	39.9 Å²	39.9	8%	0.084	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	-176.7	178.8	71.5	0	0	0	0	112.7	Y885 H887	S868-Y885 PolarHBondContact N-O 3.35Å; S868-Y885 PolarHBondContact O-N 2.92Å; S868-H887 PolarHBondContact OG-CD2 3.01Å; S868-H887 PolarHBondContact OG-NE2 3.11Å
869	E	89.5	Confident	93.2	Very high	96 Å²	96	36.4 Å²	36.4	45%	0.449	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	156.3	168.9	-70.1	-173.2	143.6	0	0	113	V797 I871 Y885	V797-E869 WeakPolarHBondContact CG1-OE1 3.23Å; E869-I871 HydrophobicContact CG-CB 4.42Å; E869-I871 HydrophobicContact CG-CD1 3.82Å; E869-I871 HydrophobicContact CG-CG1 4.11Å; E869-Y885 WeakPolarHBondContact O-CB 3.41Å
870	P	90.2	Very high	93.7	Very high	22 Å²	22	35 Å²	35	14%	0.143	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-75.2	132.3	9	30	-35.4	0	0	0	114	Y884 P985	P870-Y884 WeakPolarHBondContact O-CA 3.31Å; P870-P985 HydrophobicContact CG-CB 4.13Å
871	I	92	Very high	93.9	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.4	-179.4	-71	159.7	0	0	0	110.4	V797 A798 L833 I835 L846 E869 T883 S988 G989	V797-I871 HydrophobicContact CB-CD1 4.37Å; V797-I871 HydrophobicContact CG1-CB 4.22Å; V797-I871 HydrophobicContact CG1-CD1 4.02Å; V797-I871 HydrophobicContact CG1-CG2 4.33Å; V797-I871 HydrophobicContact CG2-CD1 4.41Å; A798-I871 HydrophobicContact CB-CG2 4.35Å; L833-I871 HydrophobicContact CD1-CG2 3.51Å; I835-I871 HydrophobicContact CD1-CD1 4.38Å; L846-I871 HydrophobicContact CD1-CD1 3.69Å; E869-I871 HydrophobicContact CG-CB 4.42Å; E869-I871 HydrophobicContact CG-CD1 3.82Å; E869-I871 HydrophobicContact CG-CG1 4.11Å; I871-T883 WeakPolarHBondContact CA-O 3.35Å; I871-S988 PolarHBondContact O-OG 3.4Å; I871-S988 VanDerWaalsContact O-OG 3.13Å; I871-G989 PolarHBondContact O-N 3.17Å
872	S	94.2	Very high	94	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.028	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.5	165.5	-64.2	0	0	0	0	108.4	Y882 T883 R987 G989 V991	S872-Y882 CarbonylContact O-C 3.58Å; S872-Y882 WeakPolarHBondContact O-CA 3.44Å; S872-Y882 VanDerWaalsContact O-CB 3.31Å; S872-Y882 WeakPolarHBondContact O-CB 3.27Å; S872-T883 PolarHBondContact N-O 2.79Å; S872-T883 PolarHBondContact N-OG1 3.06Å; S872-T883 PolarHBondContact O-N 2.83Å; S872-R987 PolarHBondContact OG-O 2.8Å; S872-G989 PolarHBondContact OG-N 2.87Å; S872-V991 VanDerWaalsContact CB-CG2 3.47Å; S872-V991 WeakPolarHBondContact OG-CG2 3.25Å
873	L	95.7	Very high	94	Very high	22 Å²	22	29.3 Å²	29.3	12%	0.115	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	125.3	-179.3	176.4	66.4	0	0	0	108.6	A798 A800 A831 L833 I848 I880	A798-L873 HydrophobicContact CB-CB 3.88Å; A798-L873 HydrophobicContact CB-CD2 4.2Å; A800-L873 HydrophobicContact CB-CD2 3.89Å; A800-L873 HydrophobicContact CB-CG 3.75Å; A831-L873 HydrophobicContact CB-CD1 4.1Å; A831-L873 HydrophobicContact CB-CD2 4.04Å; A831-L873 HydrophobicContact CB-CG 4.46Å; A831-L873 WeakPolarHBondContact O-CD2 3.21Å; L833-L873 HydrophobicContact CD1-CB 3.84Å; L833-L873 HydrophobicContact CD1-CD1 4.08Å; L833-L873 HydrophobicContact CD1-CD2 4.21Å; L833-L873 HydrophobicContact CD1-CG 4.26Å; L833-L873 HydrophobicContact CG-CD1 4.32Å; L833-L873 HydrophobicContact CG-CD2 4.12Å; I848-L873 HydrophobicContact CD1-CD1 4.34Å; L873-I880 HydrophobicContact CD1-CG2 3.46Å; L873-I880 VanDerWaalsContact CD1-CG2 3.46Å
874	V	95.2	Very high	94.1	Very high	15 Å²	15	25.6 Å²	25.6	9%	0.091	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132.7	-178.7	176.4	0	0	0	0	109.1	W879 I880 I881 V991 V993	V874-W879 HydrophobicContact CG1-CZ3 4.37Å; V874-I880 CarbonylContact O-C 3.54Å; V874-I880 WeakPolarHBondContact O-CA 3.36Å; V874-I881 PolarHBondContact N-O 3.45Å; V874-I881 PolarHBondContact O-N 2.9Å; V874-V991 HydrophobicContact CG2-CB 4Å; V874-V991 HydrophobicContact CG2-CG1 3.78Å; V874-V991 VanDerWaalsContact CG2-O 3.24Å; V874-V991 WeakPolarHBondContact CG2-O 3.32Å; V874-V993 HydrophobicContact CG1-CG2 3.23Å
875	H	95.8	Very high	94.1	Very high	8 Å²	8	26.9 Å²	26.9	4%	0.037	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.9	174.4	178.7	-167.8	0	0	0	108.3	A800 R802 E877 W879 I880	A800-H875 HydrophobicContact CB-CB 4.18Å; R802-H875 PolarHBondContact N-ND1 2.85Å; H875-E877 PolarHBondContact NE2-O 3.46Å; H875-W879 PolarHBondContact CD2-O 3.36Å; H875-I880 HydrophobicContact CB-CG1 4.14Å
876	S	94.4	Very high	94.1	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	142.8	173.5	163	0	0	0	0	108.6	E806 N878 W879	E806-S876 PolarHBondContact OE1-OG 3.2Å; E806-S876 WeakPolarHBondContact OE2-CA 3.45Å; E806-S876 PolarHBondContact OE2-OG 3.41Å; S876-N878 PolarHBondContact O-N 2.94Å; S876-N878 VanDerWaalsContact O-N 3.12Å; S876-W879 VanDerWaalsContact CB-CZ2 3.5Å; S876-W879 PolarHBondContact N-O 3.45Å; S876-W879 VanDerWaalsContact N-O 3.11Å; S876-W879 PolarHBondContact O-N 2.86Å; S876-W879 PolarHBondContact O-NE1 3.33Å; S876-W879 WeakPolarHBondContact OG-CZ2 3.15Å
877	E	92.4	Very high	94.2	Very high	18 Å²	18	16.4 Å²	16.4	8%	0.084	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	-117	-176.1	-56.6	-172.6	-179.7	0	0	113.6	E806 I808 K823 L825 H875	E806-E877 PolarHBondContact OE2-N 3.18Å; I808-E877 HydrophobicContact CD1-CG 4.45Å; I808-E877 HydrophobicContact CG1-CG 4.28Å; K823-E877 IonicContact NZ-OE2 2.9Å; K823-E877 PolarHBondContact NZ-OE2 3Å; L825-E877 HydrophobicContact CD2-CB 4.25Å; H875-E877 PolarHBondContact NE2-O 3.46Å
878	N	93.7	Very high	94.1	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.016	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	10.4	179.3	71.8	-53.6	0	0	0	113.4	K823 Y824 L825 S876 L899	K823-N878 HydrophobicContact CB-CB 3.86Å; K823-N878 HydrophobicContact CG-CB 4.33Å; Y824-N878 WeakPolarHBondContact O-CB 3.39Å; L825-N878 HydrophobicContact CD2-CB 3.84Å; S876-N878 PolarHBondContact O-N 2.94Å; S876-N878 VanDerWaalsContact O-N 3.12Å; N878-L899 WeakPolarHBondContact CB-O 3.43Å; N878-L899 PolarHBondContact ND2-O 2.87Å; N878-L899 PolarHBondContact O-N 2.88Å
879	W	95.6	Very high	94	Very high	3 Å²	3	25.9 Å²	25.9	1%	0.011	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.8	-171.4	59.3	-99.5	0	0	0	112.6	V874 H875 S876 I881 I897 E898 V993 K1003 I1005 K1019	V874-W879 HydrophobicContact CG1-CZ3 4.37Å; H875-W879 PolarHBondContact CD2-O 3.36Å; S876-W879 VanDerWaalsContact CB-CZ2 3.5Å; S876-W879 PolarHBondContact N-O 3.45Å; S876-W879 VanDerWaalsContact N-O 3.11Å; S876-W879 PolarHBondContact O-N 2.86Å; S876-W879 PolarHBondContact O-NE1 3.33Å; S876-W879 WeakPolarHBondContact OG-CZ2 3.15Å; W879-I881 HydrophobicContact CE3-CD1 3.75Å; W879-I881 HydrophobicContact CE3-CG1 3.66Å; W879-I881 HydrophobicContact CH2-CD1 4.24Å; W879-I881 HydrophobicContact CZ3-CB 4.32Å; W879-I881 HydrophobicContact CZ3-CD1 3.46Å; W879-I881 VanDerWaalsContact CZ3-CD1 3.46Å; W879-I881 HydrophobicContact CZ3-CG1 3.69Å; W879-I897 CarbonylContact C-O 3.53Å; W879-I897 WeakPolarHBondContact CA-O 3.15Å; W879-E898 HydrophobicContact CB-CG 3.84Å; W879-V993 HydrophobicContact CH2-CB 4.33Å; W879-V993 HydrophobicContact CH2-CG1 3.83Å; W879-V993 HydrophobicContact CH2-CG2 3.46Å; W879-V993 VanDerWaalsContact CH2-CG2 3.46Å; W879-V993 HydrophobicContact CZ2-CG1 3.88Å; W879-V993 HydrophobicContact CZ2-CG2 4.22Å; W879-V993 HydrophobicContact CZ3-CG2 4.19Å; W879-K1003 HydrophobicContact CZ2-CB 4.23Å; W879-I1005 HydrophobicContact CH2-CG1 4.11Å; W879-K1019 HydrophobicContact CZ2-CG 4.31Å
880	I	97.4	Very high	94.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.8	178.8	-60.5	98.5	0	0	0	108	A831 I848 L850 L873 V874 H875 V896 I897 L899	A831-I880 HydrophobicContact CB-CG1 4.22Å; A831-I880 HydrophobicContact CB-CG2 4.02Å; I848-I880 HydrophobicContact CD1-CG2 4.24Å; L850-I880 HydrophobicContact CD1-CD1 3.93Å; L850-I880 HydrophobicContact CD2-CD1 3.96Å; L850-I880 HydrophobicContact CD2-CG1 4.25Å; L873-I880 HydrophobicContact CD1-CG2 3.46Å; L873-I880 VanDerWaalsContact CD1-CG2 3.46Å; V874-I880 CarbonylContact O-C 3.54Å; V874-I880 WeakPolarHBondContact O-CA 3.36Å; H875-I880 HydrophobicContact CB-CG1 4.14Å; I880-V896 CarbonylContact O-C 3.53Å; I880-V896 WeakPolarHBondContact O-CA 3.28Å; I880-I897 HydrophobicContact CB-CB 4.48Å; I880-I897 PolarHBondContact N-O 2.9Å; I880-I897 PolarHBondContact O-N 3.16Å; I880-L899 HydrophobicContact CD1-CD1 4.02Å; I880-L899 HydrophobicContact CD1-CG 4.46Å
881	I	96.2	Very high	94.4	Very high	5 Å²	5	31.3 Å²	31.3	3%	0.026	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.4	174.6	-61.4	178.7	0	0	0	108	V874 W879 T895 V896 I1005 F1022	V874-I881 PolarHBondContact N-O 3.45Å; V874-I881 PolarHBondContact O-N 2.9Å; W879-I881 HydrophobicContact CE3-CD1 3.75Å; W879-I881 HydrophobicContact CE3-CG1 3.66Å; W879-I881 HydrophobicContact CH2-CD1 4.24Å; W879-I881 HydrophobicContact CZ3-CB 4.32Å; W879-I881 HydrophobicContact CZ3-CD1 3.46Å; W879-I881 VanDerWaalsContact CZ3-CD1 3.46Å; W879-I881 HydrophobicContact CZ3-CG1 3.69Å; I881-T895 WeakPolarHBondContact CA-O 3.42Å; I881-V896 HydrophobicContact CD1-CG1 4.35Å; I881-V896 HydrophobicContact CD1-CG2 4.29Å; I881-V896 HydrophobicContact CG1-CB 4.31Å; I881-V896 HydrophobicContact CG1-CG1 3.87Å; I881-V896 HydrophobicContact CG1-CG2 4.02Å; I881-I1005 HydrophobicContact CD1-CD1 3.19Å; I881-I1005 HydrophobicContact CD1-CG1 3.95Å; I881-F1022 HydrophobicContact CD1-CB 4.03Å; I881-F1022 HydrophobicContact CD1-CD1 4.28Å; I881-F1022 HydrophobicContact CD1-CG 4.13Å
882	Y	96.3	Very high	94.5	Very high	1 Å²	1	32.1 Å²	32.1	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.5	173.2	62	-76	0	0	0	111.9	L833 L846 I848 H864 S872 Y884 A894 T895 I897	L833-Y882 HydrophobicContact CD1-CD2 4.26Å; L833-Y882 HydrophobicContact CD1-CG 4.31Å; L833-Y882 HydrophobicContact CD2-CD2 3.98Å; L833-Y882 HydrophobicContact CD2-CE2 4.27Å; L833-Y882 HydrophobicContact CD2-CG 4.38Å; L846-Y882 HydrophobicContact CD2-CE2 4.46Å; I848-Y882 HydrophobicContact CD1-CD1 3.58Å; I848-Y882 HydrophobicContact CD1-CE1 3.5Å; I848-Y882 VanDerWaalsContact CD1-CE1 3.5Å; I848-Y882 HydrophobicContact CD1-CG 4.2Å; I848-Y882 HydrophobicContact CG2-CE1 4.5Å; H864-Y882 AromaticContact CD2-CE2 3.83Å; H864-Y882 PolarHBondContact CD2-OH 3.07Å; H864-Y882 AromaticContact NE2-CE2 3.75Å; H864-Y882 AromaticContact NE2-CZ 3.68Å; H864-Y882 PolarHBondContact NE2-OH 3.12Å; S872-Y882 CarbonylContact O-C 3.58Å; S872-Y882 WeakPolarHBondContact O-CA 3.44Å; S872-Y882 VanDerWaalsContact O-CB 3.31Å; S872-Y882 WeakPolarHBondContact O-CB 3.27Å; Y882-Y884 AromaticContact CD2-CD1 3.7Å; Y882-Y884 HydrophobicContact CD2-CD1 3.7Å; Y882-Y884 AromaticContact CD2-CE1 3.94Å; Y882-Y884 HydrophobicContact CD2-CE1 3.94Å; Y882-Y884 AromaticContact CE2-CD1 3.76Å; Y882-Y884 HydrophobicContact CE2-CD1 3.76Å; Y882-Y884 AromaticContact CE2-CE1 3.59Å; Y882-Y884 HydrophobicContact CE2-CE1 3.59Å; Y882-A894 CarbonylContact O-C 3.56Å; Y882-A894 WeakPolarHBondContact O-CA 3.26Å; Y882-T895 WeakPolarHBondContact CD1-O 3.33Å; Y882-T895 HydrophobicContact CE1-CG2 3.67Å; Y882-T895 PolarHBondContact N-O 2.87Å; Y882-T895 PolarHBondContact O-N 3.06Å; Y882-T895 WeakPolarHBondContact OH-CG2 3.32Å; Y882-I897 HydrophobicContact CE1-CD1 3.75Å; Y882-I897 HydrophobicContact CE1-CG1 4.22Å
883	T	95.8	Very high	94.5	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.031	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	147.9	-178.9	66.7	0	0	0	0	110.2	I871 S872 E893 A894 L982 P986	I871-T883 WeakPolarHBondContact CA-O 3.35Å; S872-T883 PolarHBondContact N-O 2.79Å; S872-T883 PolarHBondContact N-OG1 3.06Å; S872-T883 PolarHBondContact O-N 2.83Å; T883-E893 CarbonylContact C-O 3.59Å; T883-E893 VanDerWaalsContact CA-O 3.24Å; T883-E893 WeakPolarHBondContact CA-O 3.1Å; T883-A894 HydrophobicContact CG2-CB 3.99Å; T883-L982 HydrophobicContact CG2-CD1 3.94Å; T883-P986 HydrophobicContact CG2-CG 4.02Å
884	Y	95.1	Very high	94.5	Very high	3 Å²	3	31.4 Å²	31.4	1%	0.012	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	163.1	176.4	55.5	-90.7	0	0	0	110.5	L846 H864 C867 P870 Y882 N886 E893 T895	L846-Y884 HydrophobicContact CD2-CD1 3.69Å; L846-Y884 HydrophobicContact CD2-CD2 4.31Å; L846-Y884 HydrophobicContact CD2-CE1 4.5Å; L846-Y884 HydrophobicContact CD2-CG 3.59Å; H864-Y884 PolarHBondContact CE1-OH 3.16Å; H864-Y884 AromaticContact NE2-CE1 3.96Å; C867-Y884 HydrophobicContact CB-CD2 3.82Å; C867-Y884 HydrophobicContact CB-CE2 4.36Å; C867-Y884 VanDerWaalsContact SG-CE2 3.6Å; P870-Y884 WeakPolarHBondContact O-CA 3.31Å; Y882-Y884 AromaticContact CD2-CD1 3.7Å; Y882-Y884 HydrophobicContact CD2-CD1 3.7Å; Y882-Y884 AromaticContact CD2-CE1 3.94Å; Y882-Y884 HydrophobicContact CD2-CE1 3.94Å; Y882-Y884 AromaticContact CE2-CD1 3.76Å; Y882-Y884 HydrophobicContact CE2-CD1 3.76Å; Y882-Y884 AromaticContact CE2-CE1 3.59Å; Y882-Y884 HydrophobicContact CE2-CE1 3.59Å; Y884-N886 HydrophobicContact CE2-CB 4.27Å; Y884-E893 HydrophobicContact CD2-CB 4.4Å; Y884-E893 HydrophobicContact CE1-CB 4.44Å; Y884-E893 HydrophobicContact CE2-CB 3.78Å; Y884-E893 HydrophobicContact CE2-CG 4.44Å; Y884-E893 WeakPolarHBondContact CE2-OE2 3.33Å; Y884-E893 PolarHBondContact N-O 3.19Å; Y884-E893 PolarHBondContact O-N 2.67Å; Y884-E893 PolarHBondContact OH-OE2 3.19Å; Y884-T895 WeakPolarHBondContact CE1-OG1 3.5Å; Y884-T895 PolarHBondContact OH-OG1 2.79Å
885	Y	94.8	Very high	94.5	Very high	56 Å²	56	30.7 Å²	30.7	22%	0.22	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128.2	170.9	-175.2	-105.6	0	0	0	110.6	C867 S868 E869 H887 L890 N892	C867-Y885 CarbonylContact C-O 3.58Å; C867-Y885 WeakPolarHBondContact CA-O 3.42Å; S868-Y885 PolarHBondContact N-O 3.35Å; S868-Y885 PolarHBondContact O-N 2.92Å; E869-Y885 WeakPolarHBondContact O-CB 3.41Å; Y885-H887 AromaticContact CD1-CD2 3.77Å; Y885-H887 AromaticContact CD1-CE1 3.8Å; Y885-H887 AromaticContact CD1-NE2 3.63Å; Y885-H887 AromaticContact CE1-CE1 3.74Å; Y885-H887 AromaticContact CE1-CG 3.93Å; Y885-H887 AromaticContact CE1-ND1 3.68Å; Y885-L890 WeakPolarHBondContact OH-CA 3.49Å; Y885-N892 WeakPolarHBondContact CD2-OD1 3.48Å
886	N	94.5	Very high	94.6	Very high	20 Å²	20	30.3 Å²	30.3	11%	0.107	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	108.2	177.7	-173.3	-21.3	0	0	0	109.9	Y884 K888 S889 L890 R891 E893	Y884-N886 HydrophobicContact CE2-CB 4.27Å; N886-K888 VanDerWaalsContact C-N 3.29Å; N886-K888 PolarHBondContact O-N 3.1Å; N886-K888 WeakPolarHBondContact OD1-CB 3.28Å; N886-K888 PolarHBondContact OD1-N 2.68Å; N886-S889 WeakPolarHBondContact CB-OG 3.25Å; N886-S889 PolarHBondContact ND2-OG 3.27Å; N886-S889 PolarHBondContact O-N 2.98Å; N886-S889 PolarHBondContact OD1-N 2.72Å; N886-L890 WeakPolarHBondContact O-CA 3.44Å; N886-L890 PolarHBondContact O-N 2.82Å; N886-R891 PolarHBondContact N-O 2.63Å; N886-R891 PolarHBondContact O-N 3.17Å; N886-E893 HydrophobicContact CB-CG 4.26Å; N886-E893 PolarHBondContact ND2-OE1 3Å; N886-E893 PolarHBondContact ND2-OE2 3.44Å
887	H	93.2	Very high	94.7	Very high	44 Å²	44	30.3 Å²	30.3	20%	0.204	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-25.3	-179.7	-72.6	-92	0	0	0	113	N844 R866 S868 Y885 S889 L890	N844-H887 PolarHBondContact ND2-CD2 2.62Å; R866-H887 HydrophobicContact CB-CB 4.4Å; R866-H887 WeakPolarHBondContact O-CB 3.34Å; R866-H887 PolarHBondContact O-N 2.69Å; S868-H887 PolarHBondContact OG-CD2 3.01Å; S868-H887 PolarHBondContact OG-NE2 3.11Å; Y885-H887 AromaticContact CD1-CD2 3.77Å; Y885-H887 AromaticContact CD1-CE1 3.8Å; Y885-H887 AromaticContact CD1-NE2 3.63Å; Y885-H887 AromaticContact CE1-CE1 3.74Å; Y885-H887 AromaticContact CE1-CG 3.93Å; Y885-H887 AromaticContact CE1-ND1 3.68Å; H887-S889 VanDerWaalsContact C-N 3.32Å; H887-L890 WeakPolarHBondContact O-CD2 3.23Å
888	K	91.5	Very high	94.8	Very high	169 Å²	169	29.5 Å²	29.5	74%	0.735	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-37	179.1	-173.6	-177.8	176.1	-174.8	0	111.2	N886	N886-K888 VanDerWaalsContact C-N 3.29Å; N886-K888 PolarHBondContact O-N 3.1Å; N886-K888 WeakPolarHBondContact OD1-CB 3.28Å; N886-K888 PolarHBondContact OD1-N 2.68Å
889	S	91.2	Very high	94.8	Very high	44 Å²	44	29.4 Å²	29.4	31%	0.308	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	4.5	-178.6	51.6	0	0	0	0	114	N886 H887 R891	N886-S889 WeakPolarHBondContact CB-OG 3.25Å; N886-S889 PolarHBondContact ND2-OG 3.27Å; N886-S889 PolarHBondContact O-N 2.98Å; N886-S889 PolarHBondContact OD1-N 2.72Å; H887-S889 VanDerWaalsContact C-N 3.32Å; S889-R891 VanDerWaalsContact C-N 3.29Å; S889-R891 PolarHBondContact O-N 2.92Å; S889-R891 WeakPolarHBondContact OG-CG 3.43Å; S889-R891 PolarHBondContact OG-NE 2.98Å
890	L	93.1	Very high	94.6	Very high	129 Å²	129	29.4 Å²	29.4	68%	0.675	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	45	179.4	-57.9	175.3	0	0	0	113.6	Y885 N886 H887	Y885-L890 WeakPolarHBondContact OH-CA 3.49Å; N886-L890 WeakPolarHBondContact O-CA 3.44Å; N886-L890 PolarHBondContact O-N 2.82Å; H887-L890 WeakPolarHBondContact O-CD2 3.23Å
891	R	94.1	Very high	94	Very high	103 Å²	103	29.9 Å²	29.9	39%	0.389	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	159.3	-174.7	73.3	-164.4	-179.4	-176.4	2.4	112.3	N886 S889 E893 I981	N886-R891 PolarHBondContact N-O 2.63Å; N886-R891 PolarHBondContact O-N 3.17Å; S889-R891 VanDerWaalsContact C-N 3.29Å; S889-R891 PolarHBondContact O-N 2.92Å; S889-R891 WeakPolarHBondContact OG-CG 3.43Å; S889-R891 PolarHBondContact OG-NE 2.98Å; R891-E893 HydrophobicContact CG-CG 4.03Å; R891-E893 IonicContact CZ-OE1 3.91Å; R891-E893 IonicContact NE-OE1 3.04Å; R891-E893 PolarHBondContact NE-OE1 2.91Å; R891-E893 IonicContact NH2-OE1 2.69Å; R891-E893 PolarHBondContact NH2-OE1 3.3Å; R891-I981 HydrophobicContact CB-CG2 4.3Å; R891-I981 HydrophobicContact CG-CG2 4.33Å
892	N	93.7	Very high	93.1	Very high	21 Å²	21	30.1 Å²	30.1	11%	0.112	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	130.8	172.9	-59.1	-69.3	0	0	0	109.8	Y885 I981 L982 P985	Y885-N892 WeakPolarHBondContact CD2-OD1 3.48Å; N892-I981 WeakPolarHBondContact O-CA 3.42Å; N892-L982 HydrophobicContact CB-CB 4.18Å; N892-L982 PolarHBondContact O-N 2.84Å; N892-P985 HydrophobicContact CB-CB 4.49Å; N892-P985 WeakPolarHBondContact ND2-CD 3.07Å
893	E	95.2	Very high	91.9	Very high	11 Å²	11	33 Å²	33	5%	0.051	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.2	179.2	-63.4	-177.1	163.8	0	0	110.6	T883 Y884 N886 R891 Y980	T883-E893 CarbonylContact C-O 3.59Å; T883-E893 VanDerWaalsContact CA-O 3.24Å; T883-E893 WeakPolarHBondContact CA-O 3.1Å; Y884-E893 HydrophobicContact CD2-CB 4.4Å; Y884-E893 HydrophobicContact CE1-CB 4.44Å; Y884-E893 HydrophobicContact CE2-CB 3.78Å; Y884-E893 HydrophobicContact CE2-CG 4.44Å; Y884-E893 WeakPolarHBondContact CE2-OE2 3.33Å; Y884-E893 PolarHBondContact N-O 3.19Å; Y884-E893 PolarHBondContact O-N 2.67Å; Y884-E893 PolarHBondContact OH-OE2 3.19Å; N886-E893 HydrophobicContact CB-CG 4.26Å; N886-E893 PolarHBondContact ND2-OE1 3Å; N886-E893 PolarHBondContact ND2-OE2 3.44Å; R891-E893 HydrophobicContact CG-CG 4.03Å; R891-E893 IonicContact CZ-OE1 3.91Å; R891-E893 IonicContact NE-OE1 3.04Å; R891-E893 PolarHBondContact NE-OE1 2.91Å; R891-E893 IonicContact NH2-OE1 2.69Å; R891-E893 PolarHBondContact NH2-OE1 3.3Å; E893-Y980 CarbonylContact C-O 3.58Å; E893-Y980 WeakPolarHBondContact CA-O 3.16Å
894	A	95.2	Very high	90.5	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	112.9	170.3	0	0	0	0	0	108	Y882 T883 Y980 L982 F1022	Y882-A894 CarbonylContact O-C 3.56Å; Y882-A894 WeakPolarHBondContact O-CA 3.26Å; T883-A894 HydrophobicContact CG2-CB 3.99Å; A894-Y980 PolarHBondContact N-O 2.82Å; A894-Y980 PolarHBondContact O-N 2.83Å; A894-L982 HydrophobicContact CB-CD1 3.99Å; A894-L982 HydrophobicContact CB-CD2 4.38Å; A894-L982 HydrophobicContact CB-CG 4.08Å; A894-F1022 HydrophobicContact CB-CE1 4.02Å
895	T	95.9	Very high	89	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.6	176.1	-64.4	0	0	0	0	109.9	I881 Y882 Y884 Q977 Q978 S979	I881-T895 WeakPolarHBondContact CA-O 3.42Å; Y882-T895 WeakPolarHBondContact CD1-O 3.33Å; Y882-T895 HydrophobicContact CE1-CG2 3.67Å; Y882-T895 PolarHBondContact N-O 2.87Å; Y882-T895 PolarHBondContact O-N 3.06Å; Y882-T895 WeakPolarHBondContact OH-CG2 3.32Å; Y884-T895 WeakPolarHBondContact CE1-OG1 3.5Å; Y884-T895 PolarHBondContact OH-OG1 2.79Å; T895-Q977 HydrophobicContact CG2-CG 3.84Å; T895-Q978 WeakPolarHBondContact CA-O 3.38Å; T895-S979 PolarHBondContact OG1-OG 2.9Å
896	V	96.6	Very high	87.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135	-179.8	-171.5	0	0	0	0	108.2	I880 I881 E898 Q977 Q978 Y980 F1022	I880-V896 CarbonylContact O-C 3.53Å; I880-V896 WeakPolarHBondContact O-CA 3.28Å; I881-V896 HydrophobicContact CD1-CG1 4.35Å; I881-V896 HydrophobicContact CD1-CG2 4.29Å; I881-V896 HydrophobicContact CG1-CB 4.31Å; I881-V896 HydrophobicContact CG1-CG1 3.87Å; I881-V896 HydrophobicContact CG1-CG2 4.02Å; V896-E898 HydrophobicContact CG1-CG 4.42Å; V896-Q977 WeakPolarHBondContact O-CA 3.47Å; V896-Q978 PolarHBondContact N-O 3.05Å; V896-Q978 PolarHBondContact O-N 2.81Å; V896-Y980 HydrophobicContact CG2-CD2 4.04Å; V896-Y980 HydrophobicContact CG2-CE2 3.95Å; V896-F1022 VanDerWaalsContact CG1-O 3.26Å; V896-F1022 WeakPolarHBondContact CG1-O 3.28Å; V896-F1022 HydrophobicContact CG2-CB 3.68Å; V896-F1022 HydrophobicContact CG2-CD1 3.74Å; V896-F1022 HydrophobicContact CG2-CG 4.19Å; V896-F1022 WeakPolarHBondContact CG2-O 3.48Å
897	I	97	Very high	85.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	125.5	174.5	-61.6	169.6	0	0	0	107.4	I848 L850 Y860 W879 I880 Y882 L899 V975 L976 Q977	I848-I897 HydrophobicContact CD1-CD1 3.91Å; I848-I897 HydrophobicContact CG2-CD1 4.3Å; L850-I897 HydrophobicContact CD1-CG2 4.18Å; Y860-I897 HydrophobicContact CD1-CD1 4.24Å; Y860-I897 HydrophobicContact CE1-CD1 3.76Å; W879-I897 CarbonylContact C-O 3.53Å; W879-I897 WeakPolarHBondContact CA-O 3.15Å; I880-I897 HydrophobicContact CB-CB 4.48Å; I880-I897 PolarHBondContact N-O 2.9Å; I880-I897 PolarHBondContact O-N 3.16Å; Y882-I897 HydrophobicContact CE1-CD1 3.75Å; Y882-I897 HydrophobicContact CE1-CG1 4.22Å; I897-L899 HydrophobicContact CG2-CD2 4.05Å; I897-V975 HydrophobicContact CG2-CG1 3.47Å; I897-V975 VanDerWaalsContact CG2-CG1 3.47Å; I897-L976 CarbonylContact C-O 3.55Å; I897-L976 WeakPolarHBondContact CA-O 3.45Å; I897-Q977 HydrophobicContact CG1-CG 4.25Å
898	E	95.7	Very high	84.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.9	171.4	-65.5	-170.9	173.9	0	0	110.4	R813 W879 V896 Y900 L976 K1019 P1024	R813-E898 IonicContact NH1-OE2 3.41Å; W879-E898 HydrophobicContact CB-CG 3.84Å; V896-E898 HydrophobicContact CG1-CG 4.42Å; E898-Y900 HydrophobicContact CB-CD2 4.34Å; E898-Y900 HydrophobicContact CB-CE2 3.61Å; E898-Y900 WeakPolarHBondContact OE2-CE2 3.49Å; E898-Y900 VanDerWaalsContact OE2-CZ 3.32Å; E898-Y900 PolarHBondContact OE2-OH 2.84Å; E898-L976 PolarHBondContact N-O 2.86Å; E898-L976 PolarHBondContact O-N 2.91Å; E898-K1019 WeakPolarHBondContact OE1-CE 3.01Å; E898-K1019 IonicContact OE1-NZ 3.27Å; E898-K1019 PolarHBondContact OE1-NZ 2.88Å; E898-P1024 HydrophobicContact CB-CG 3.96Å; E898-P1024 HydrophobicContact CG-CG 3.61Å; E898-P1024 WeakPolarHBondContact OE1-CD 3.39Å
899	L	93.6	Very high	83.3	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.9	-177.5	-53.4	173.2	0	0	0	110.1	Y824 L829 L850 N878 I880 I897 P973 V975	Y824-L899 HydrophobicContact CD1-CB 3.92Å; Y824-L899 HydrophobicContact CD1-CD1 3.96Å; Y824-L899 HydrophobicContact CG-CB 4.3Å; Y824-L899 PolarHBondContact N-O 2.98Å; L829-L899 HydrophobicContact CD2-CD1 3.42Å; L829-L899 VanDerWaalsContact CD2-CD1 3.42Å; L850-L899 HydrophobicContact CD1-CD1 4.02Å; L850-L899 HydrophobicContact CD1-CD2 3.87Å; L850-L899 HydrophobicContact CD1-CG 4.41Å; N878-L899 WeakPolarHBondContact CB-O 3.43Å; N878-L899 PolarHBondContact ND2-O 2.87Å; N878-L899 PolarHBondContact O-N 2.88Å; I880-L899 HydrophobicContact CD1-CD1 4.02Å; I880-L899 HydrophobicContact CD1-CG 4.46Å; I897-L899 HydrophobicContact CG2-CD2 4.05Å; L899-P973 HydrophobicContact CB-CB 4.4Å; L899-P973 HydrophobicContact CD2-CG 4.39Å; L899-V975 HydrophobicContact CD2-CB 4.29Å; L899-V975 HydrophobicContact CD2-CG1 4.01Å; L899-V975 HydrophobicContact CD2-CG2 3.65Å
900	Y	89.8	Confident	82.1	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154.9	179.4	-65.8	-77	0	0	0	111.3	R813 L821 Y822 K823 E898 P973 Q974 L976	R813-Y900 PolarHBondContact NH1-OH 2.88Å; L821-Y900 HydrophobicContact CB-CD1 4.34Å; L821-Y900 HydrophobicContact CB-CE1 4.35Å; L821-Y900 HydrophobicContact CD1-CD1 4.26Å; L821-Y900 HydrophobicContact CD1-CG 4.15Å; L821-Y900 HydrophobicContact CD2-CD1 3.58Å; L821-Y900 HydrophobicContact CD2-CD2 3.82Å; L821-Y900 HydrophobicContact CD2-CE1 3.38Å; L821-Y900 HydrophobicContact CD2-CE2 3.68Å; L821-Y900 HydrophobicContact CD2-CG 3.76Å; L821-Y900 VanDerWaalsContact CD2-CZ 3.42Å; L821-Y900 HydrophobicContact CG-CD1 3.37Å; L821-Y900 HydrophobicContact CG-CD2 4.27Å; L821-Y900 HydrophobicContact CG-CE1 3.61Å; L821-Y900 HydrophobicContact CG-CG 3.69Å; Y822-Y900 CarbonylContact O-C 3.56Å; Y822-Y900 WeakPolarHBondContact O-CA 3.41Å; Y822-Y900 WeakPolarHBondContact O-CD1 3.25Å; K823-Y900 HydrophobicContact CG-CE1 4.31Å; E898-Y900 HydrophobicContact CB-CD2 4.34Å; E898-Y900 HydrophobicContact CB-CE2 3.61Å; E898-Y900 WeakPolarHBondContact OE2-CE2 3.49Å; E898-Y900 VanDerWaalsContact OE2-CZ 3.32Å; E898-Y900 PolarHBondContact OE2-OH 2.84Å; Y900-P973 CarbonylContact O-C 2.91Å; Y900-P973 WeakPolarHBondContact O-CA 3.31Å; Y900-P973 WeakPolarHBondContact O-CB 3.38Å; Y900-Q974 PolarHBondContact N-O 2.9Å; Y900-Q974 PolarHBondContact O-N 3.39Å; Y900-L976 HydrophobicContact CD2-CD1 4.02Å; Y900-L976 HydrophobicContact CD2-CG 4.19Å; Y900-L976 HydrophobicContact CE2-CD1 3.75Å; Y900-L976 HydrophobicContact CE2-CG 4.27Å
901	E	85.1	Confident	80.5	Confident	10 Å²	10	36.3 Å²	36.3	5%	0.047	20%	0.203	C	C	.	.			trans	-64.2	135.7	174.8	-72.4	-67.8	167.5	0	0	110.1	Y822 Y824 L909 I915 R955	Y822-E901 PolarHBondContact O-N 3.36Å; Y824-E901 WeakPolarHBondContact CD2-OE1 3.47Å; E901-L909 HydrophobicContact CB-CD2 4.13Å; E901-I915 HydrophobicContact CG-CD1 4.36Å; E901-R955 VanDerWaalsContact CD-NH1 3.32Å; E901-R955 IonicContact OE1-CZ 3.16Å; E901-R955 IonicContact OE1-NH1 2.73Å; E901-R955 PolarHBondContact OE1-NH1 2.86Å; E901-R955 VanDerWaalsContact OE1-NH1 3.09Å; E901-R955 IonicContact OE1-NH2 2.7Å; E901-R955 IonicContact OE2-CZ 2.7Å; E901-R955 IonicContact OE2-NH1 3.89Å; E901-R955 PolarHBondContact OE2-NH1 3.42Å; E901-R955 IonicContact OE2-NH2 3.84Å; E901-R955 PolarHBondContact OE2-NH2 3.45Å
902	P	76.9	Confident	78.6	Confident	11 Å²	11	34.6 Å²	34.6	7%	0.071	21%	0.207	C	C	.	.			trans	-67.6	140.4	-179.2	25.4	-28.8	0	0	0	110.9	C910 L971 I972	P902-C910 HydrophobicContact CB-CB 4.35Å; P902-C910 HydrophobicContact CG-CB 3.88Å; P902-C910 WeakPolarHBondContact O-CB 3.34Å; P902-C910 PolarHBondContact O-N 2.87Å; P902-L971 HydrophobicContact CG-CB 4.45Å; P902-L971 HydrophobicContact CG-CD2 4.17Å; P902-I972 WeakPolarHBondContact CG-O 3.28Å
903	T	71.1	Confident	76.7	Confident	60 Å²	60	40.1 Å²	40.1	37%	0.368	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-108	140.3	172.8	53.9	0	0	0	0	109.6	E908 L909	T903-E908 CarbonylContact C-O 3.59Å; T903-L909 HydrophobicContact CG2-CD2 4.28Å
904	K	67.5	Low	74.7	Confident	54 Å²	54	41.6 Å²	41.6	24%	0.235	24%	0.244	C	C	.	.			trans	-64.1	163.4	170.9	-63.9	-177.8	-174.3	175.4	0	110.2	S906 G907 E908 F962	K904-S906 WeakPolarHBondContact CB-OG 3.45Å; K904-S906 PolarHBondContact O-N 3.19Å; K904-S906 VanDerWaalsContact O-N 3.15Å; K904-G907 WeakPolarHBondContact O-CA 3.44Å; K904-G907 PolarHBondContact O-N 2.87Å; K904-E908 WeakPolarHBondContact CB-O 3.35Å; K904-E908 HydrophobicContact CD-CB 4.29Å; K904-E908 PolarHBondContact N-O 2.79Å; K904-E908 IonicContact NZ-OE2 3.51Å; K904-F962 WeakPolarHBondContact CE-O 3.26Å
905	L	62.5	Low	72.9	Confident	175 Å²	175	43.3 Å²	43.3	92%	0.916	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.8	169.9	-79.2	146.9	0	0	0	112.9	G907	L905-G907 PolarHBondContact O-N 2.84Å
906	S	62.7	Low	71.1	Confident	85 Å²	85	45.5 Å²	45.5	59%	0.594	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-6.1	173.2	56.1	0	0	0	0	114.2	K904 E908	K904-S906 WeakPolarHBondContact CB-OG 3.45Å; K904-S906 PolarHBondContact O-N 3.19Å; K904-S906 VanDerWaalsContact O-N 3.15Å; S906-E908 VanDerWaalsContact C-N 3.26Å
907	G	63.4	Low	69.4	Low	56 Å²	56	47.8 Å²	47.8	58%	0.577	28%	0.283	S	S	*	.	S	Bend	trans	84.1	-8.7	-171.4	0	0	0	0	0	114.2	K904 L905	K904-G907 WeakPolarHBondContact O-CA 3.44Å; K904-G907 PolarHBondContact O-N 2.87Å; L905-G907 PolarHBondContact O-N 2.84Å
908	E	65.8	Low	67.8	Low	116 Å²	116	52.9 Å²	52.9	54%	0.542	32%	0.315	S	S	.	.			trans	-72.3	143.3	178.4	-68.6	178.6	174.9	0	0	112.2	T903 K904 S906 C910	T903-E908 CarbonylContact C-O 3.59Å; K904-E908 WeakPolarHBondContact CB-O 3.35Å; K904-E908 HydrophobicContact CD-CB 4.29Å; K904-E908 PolarHBondContact N-O 2.79Å; K904-E908 IonicContact NZ-OE2 3.51Å; S906-E908 VanDerWaalsContact C-N 3.26Å; E908-C910 PolarHBondContact O-N 2.97Å
909	L	64.4	Low	66.3	Low	33 Å²	33	60.7 Å²	60.7	17%	0.173	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-66.1	132.5	175.1	-74.1	147.3	0	0	0	111.3	Y822 E901 T903 A911 S912	Y822-L909 HydrophobicContact CD2-CD1 3.4Å; Y822-L909 VanDerWaalsContact CD2-CD1 3.4Å; Y822-L909 HydrophobicContact CD2-CD2 3.55Å; Y822-L909 HydrophobicContact CD2-CG 4.03Å; Y822-L909 HydrophobicContact CE2-CD1 3.21Å; Y822-L909 HydrophobicContact CE2-CD2 4.27Å; Y822-L909 HydrophobicContact CE2-CG 4.26Å; Y822-L909 HydrophobicContact CG-CD1 4.3Å; Y822-L909 HydrophobicContact CG-CD2 4.13Å; E901-L909 HydrophobicContact CB-CD2 4.13Å; T903-L909 HydrophobicContact CG2-CD2 4.28Å; L909-A911 VanDerWaalsContact C-N 3.31Å; L909-A911 PolarHBondContact O-N 3.43Å; L909-S912 WeakPolarHBondContact O-CB 3.46Å; L909-S912 PolarHBondContact O-N 2.84Å; L909-S912 PolarHBondContact O-OG 3.02Å
910	C	64.7	Low	64.9	Low	14 Å²	14	65.2 Å²	65.2	10%	0.095	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-42	172.4	-84.6	0	0	0	0	113	P902 E908 S912 C963 L971	P902-C910 HydrophobicContact CB-CB 4.35Å; P902-C910 HydrophobicContact CG-CB 3.88Å; P902-C910 WeakPolarHBondContact O-CB 3.34Å; P902-C910 PolarHBondContact O-N 2.87Å; E908-C910 PolarHBondContact O-N 2.97Å; C910-S912 PolarHBondContact O-N 3.14Å; C910-C963 WeakPolarHBondContact CA-SG 3.45Å; C910-C963 HydrophobicContact CB-CB 3.98Å; C910-C963 WeakPolarHBondContact CB-SG 3.33Å; C910-C963 WeakPolarHBondContact SG-CB 3.4Å; C910-C963 CovalentContact SG-SG 2Å; C910-C963 PolarHBondContact SG-SG 2.9Å; C910-L971 HydrophobicContact CB-CD2 3.5Å
911	A	59.1	Low	63.7	Low	8 Å²	8	69.1 Å²	69.1	7%	0.066	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	28.6	179.6	0	0	0	0	0	112.2	L909 Q913 S914 I915	L909-A911 VanDerWaalsContact C-N 3.31Å; L909-A911 PolarHBondContact O-N 3.43Å; A911-Q913 PolarHBondContact O-N 2.86Å; A911-S914 WeakPolarHBondContact CB-OG 3.43Å; A911-S914 PolarHBondContact O-N 3.45Å; A911-S914 PolarHBondContact O-OG 2.9Å; A911-I915 PolarHBondContact O-N 2.81Å
912	S	54.9	Low	62.9	Low	66 Å²	66	73.7 Å²	73.7	46%	0.462	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-23.7	-176.8	57.2	0	0	0	0	113.9	L909 C910	L909-S912 WeakPolarHBondContact O-CB 3.46Å; L909-S912 PolarHBondContact O-N 2.84Å; L909-S912 PolarHBondContact O-OG 3.02Å; C910-S912 PolarHBondContact O-N 3.14Å
913	Q	53.1	Low	62.2	Low	138 Å²	138	76.2 Å²	76.2	65%	0.645	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-24.7	173.6	-65.6	-177.1	1.1	0	0	113.5	A911 S948	A911-Q913 PolarHBondContact O-N 2.86Å; Q913-S948 WeakPolarHBondContact O-CB 3.44Å
914	S	54.6	Low	61.7	Low	42 Å²	42	76.2 Å²	76.2	29%	0.294	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-21.4	179.3	74.3	0	0	0	0	113.9	A911 P916 S948	A911-S914 WeakPolarHBondContact CB-OG 3.43Å; A911-S914 PolarHBondContact O-N 3.45Å; A911-S914 PolarHBondContact O-OG 2.9Å; S914-P916 WeakPolarHBondContact O-CD 3.37Å; S914-S948 WeakPolarHBondContact CA-OG 3.38Å; S914-S948 WeakPolarHBondContact CB-OG 3.41Å
915	I	56.3	Low	61.5	Low	36 Å²	36	80.5 Å²	80.5	19%	0.185	44%	0.442	C	S	.	.	S	Bend	trans	-107.6	103.5	179.7	-53.3	174.5	0	0	0	107.9	Y822 E901 A911 S917	Y822-I915 HydrophobicContact CD1-CD1 3.72Å; Y822-I915 HydrophobicContact CD1-CG2 4.13Å; Y822-I915 HydrophobicContact CE1-CD1 4.3Å; Y822-I915 HydrophobicContact CE1-CG2 3.73Å; Y822-I915 HydrophobicContact CG-CD1 3.88Å; E901-I915 HydrophobicContact CG-CD1 4.36Å; A911-I915 PolarHBondContact O-N 2.81Å; I915-S917 PolarHBondContact O-N 2.88Å
916	P	58.2	Low	61.6	Low	47 Å²	47	77.1 Å²	77.1	31%	0.305	43%	0.425	S	S	.	.			trans	-61.7	136.4	179.9	25.2	-33.3	0	0	0	110.5	S914 Q920 L921	S914-P916 WeakPolarHBondContact O-CD 3.37Å; P916-Q920 HydrophobicContact CB-CB 4.05Å; P916-L921 HydrophobicContact CB-CD2 4.19Å; P916-L921 HydrophobicContact CB-CG 4.05Å; P916-L921 HydrophobicContact CG-CD1 4.38Å; P916-L921 HydrophobicContact CG-CD2 3.6Å; P916-L921 HydrophobicContact CG-CG 3.83Å
917	S	62.1	Low	61.5	Low	48 Å²	48	76.1 Å²	76.1	34%	0.336	41%	0.412	S	S	.	.			trans	-61	156.1	174.2	63.8	0	0	0	0	111.1	I915 W919 Q920 L921	I915-S917 PolarHBondContact O-N 2.88Å; S917-W919 PolarHBondContact O-N 2.77Å; S917-W919 VanDerWaalsContact O-N 3.1Å; S917-Q920 WeakPolarHBondContact O-CB 3.15Å; S917-Q920 PolarHBondContact O-N 2.86Å; S917-Q920 WeakPolarHBondContact OG-CG 3.46Å; S917-Q920 PolarHBondContact OG-N 2.97Å; S917-Q920 PolarHBondContact OG-OE1 2.94Å; S917-L921 PolarHBondContact O-N 3.43Å
918	P	63.1	Low	61	Low	106 Å²	106	76.3 Å²	76.3	69%	0.688	40%	0.403	S	S	*	.	H	α-helix	trans	-51.7	-35.6	175.2	-28.6	35.3	0	0	0	113.6	L921 F922	P918-L921 PolarHBondContact O-N 2.81Å; P918-F922 WeakPolarHBondContact O-CB 3.26Å; P918-F922 PolarHBondContact O-N 2.89Å
919	W	64.3	Low	60.4	Low	166 Å²	166	75.6 Å²	75.6	63%	0.629	41%	0.411	S	S	*	.	H	α-helix	trans	-69.5	-39	176.1	-171.1	-109.4	0	0	0	113	S917 F922 L923	S917-W919 PolarHBondContact O-N 2.77Å; S917-W919 VanDerWaalsContact O-N 3.1Å; W919-F922 AromaticContact CE3-CD1 3.99Å; W919-F922 HydrophobicContact CE3-CD1 3.99Å; W919-F922 HydrophobicContact CE3-CE1 4.48Å; W919-F922 HydrophobicContact CH2-CD1 4.31Å; W919-F922 HydrophobicContact CH2-CE1 4.13Å; W919-F922 AromaticContact CZ3-CD1 3.84Å; W919-F922 HydrophobicContact CZ3-CD1 3.84Å; W919-F922 AromaticContact CZ3-CE1 3.87Å; W919-F922 HydrophobicContact CZ3-CE1 3.87Å; W919-F922 PolarHBondContact O-N 2.91Å; W919-L923 HydrophobicContact CG-CD1 4.48Å; W919-L923 WeakPolarHBondContact O-CB 3.38Å; W919-L923 WeakPolarHBondContact O-CG 3.49Å; W919-L923 PolarHBondContact O-N 3.49Å
920	Q	64.3	Low	59.9	Low	97 Å²	97	82.4 Å²	82.4	45%	0.453	43%	0.434	S	S	.	.	H	α-helix	trans	-65.5	-42.5	173.2	-79.5	165.6	-21.5	0	0	111.7	P916 S917 F922 L923 N924	P916-Q920 HydrophobicContact CB-CB 4.05Å; S917-Q920 WeakPolarHBondContact O-CB 3.15Å; S917-Q920 PolarHBondContact O-N 2.86Å; S917-Q920 WeakPolarHBondContact OG-CG 3.46Å; S917-Q920 PolarHBondContact OG-N 2.97Å; S917-Q920 PolarHBondContact OG-OE1 2.94Å; Q920-F922 VanDerWaalsContact C-N 3.33Å; Q920-F922 PolarHBondContact O-N 2.86Å; Q920-L923 PolarHBondContact O-N 3.03Å; Q920-N924 WeakPolarHBondContact O-CB 3.3Å; Q920-N924 VanDerWaalsContact O-CG 3.32Å; Q920-N924 PolarHBondContact O-N 2.78Å
921	L	63	Low	59.4	Low	83 Å²	83	86.6 Å²	86.6	44%	0.435	46%	0.455	S	S	.	.	H	α-helix	trans	-61	-43.2	174.2	-74.4	172.2	0	0	0	111.5	P916 S917 P918 N924 N925	P916-L921 HydrophobicContact CB-CD2 4.19Å; P916-L921 HydrophobicContact CB-CG 4.05Å; P916-L921 HydrophobicContact CG-CD1 4.38Å; P916-L921 HydrophobicContact CG-CD2 3.6Å; P916-L921 HydrophobicContact CG-CG 3.83Å; S917-L921 PolarHBondContact O-N 3.43Å; P918-L921 PolarHBondContact O-N 2.81Å; L921-N924 PolarHBondContact O-N 2.84Å; L921-N925 WeakPolarHBondContact O-CB 3.21Å; L921-N925 PolarHBondContact O-N 3.34Å
922	F	68.9	Low	59	Low	107 Å²	107	91 Å²	91	47%	0.469	48%	0.477	S	S	.	.	H	α-helix	trans	-60.8	-48.4	175.8	176.6	-104.8	0	0	0	112.2	P918 W919 Q920 N924 N925 L926	P918-F922 WeakPolarHBondContact O-CB 3.26Å; P918-F922 PolarHBondContact O-N 2.89Å; W919-F922 AromaticContact CE3-CD1 3.99Å; W919-F922 HydrophobicContact CE3-CD1 3.99Å; W919-F922 HydrophobicContact CE3-CE1 4.48Å; W919-F922 HydrophobicContact CH2-CD1 4.31Å; W919-F922 HydrophobicContact CH2-CE1 4.13Å; W919-F922 AromaticContact CZ3-CD1 3.84Å; W919-F922 HydrophobicContact CZ3-CD1 3.84Å; W919-F922 AromaticContact CZ3-CE1 3.87Å; W919-F922 HydrophobicContact CZ3-CE1 3.87Å; W919-F922 PolarHBondContact O-N 2.91Å; Q920-F922 VanDerWaalsContact C-N 3.33Å; Q920-F922 PolarHBondContact O-N 2.86Å; F922-N924 PolarHBondContact O-N 3.45Å; F922-N925 PolarHBondContact O-N 3.17Å; F922-L926 HydrophobicContact CD1-CD1 3.74Å; F922-L926 HydrophobicContact CD2-CD1 3.94Å; F922-L926 HydrophobicContact CE1-CD1 3.22Å; F922-L926 HydrophobicContact CE2-CD1 3.45Å; F922-L926 VanDerWaalsContact CE2-CD1 3.45Å; F922-L926 HydrophobicContact CE2-CG 4.39Å; F922-L926 HydrophobicContact CG-CD1 4.09Å; F922-L926 HydrophobicContact CZ-CD1 3.08Å; F922-L926 HydrophobicContact CZ-CG 4.38Å; F922-L926 WeakPolarHBondContact O-CB 3.28Å; F922-L926 PolarHBondContact O-N 2.97Å
923	L	62.5	Low	58.3	Low	64 Å²	64	91.5 Å²	91.5	34%	0.335	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-40.8	177.4	-74.3	173.2	0	0	0	112.4	W919 Q920 N925 L926 I927	W919-L923 HydrophobicContact CG-CD1 4.48Å; W919-L923 WeakPolarHBondContact O-CB 3.38Å; W919-L923 WeakPolarHBondContact O-CG 3.49Å; W919-L923 PolarHBondContact O-N 3.49Å; Q920-L923 PolarHBondContact O-N 3.03Å; L923-N925 VanDerWaalsContact C-N 3.31Å; L923-N925 PolarHBondContact O-N 3.29Å; L923-L926 PolarHBondContact O-N 2.78Å; L923-I927 HydrophobicContact CD2-CD1 4.41Å; L923-I927 PolarHBondContact O-N 3.49Å
924	N	60.4	Low	57.5	Low	59 Å²	59	90.3 Å²	90.3	32%	0.316	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-34.5	176.9	-82	0.9	0	0	0	113	Q920 L921 F922 F947	Q920-N924 WeakPolarHBondContact O-CB 3.3Å; Q920-N924 VanDerWaalsContact O-CG 3.32Å; Q920-N924 PolarHBondContact O-N 2.78Å; L921-N924 PolarHBondContact O-N 2.84Å; F922-N924 PolarHBondContact O-N 3.45Å; N924-F947 WeakPolarHBondContact ND2-CE1 3.45Å; N924-F947 WeakPolarHBondContact ND2-CZ 3.46Å; N924-F947 WeakPolarHBondContact OD1-CZ 3.48Å
925	N	63.6	Low	56.6	Low	145 Å²	145	94.1 Å²	94.1	78%	0.775	50%	0.502	S	S	*	.	H	α-helix	trans	-81.4	-25.1	178.4	-75.7	-18.9	0	0	0	112.9	L921 F922 L923	L921-N925 WeakPolarHBondContact O-CB 3.21Å; L921-N925 PolarHBondContact O-N 3.34Å; F922-N925 PolarHBondContact O-N 3.17Å; L923-N925 VanDerWaalsContact C-N 3.31Å; L923-N925 PolarHBondContact O-N 3.29Å
926	L	65.1	Low	55.7	Low	104 Å²	104	97 Å²	97	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-85.4	-33.4	178.9	-91.6	166	0	0	0	114	F922 L923 P928	F922-L926 HydrophobicContact CD1-CD1 3.74Å; F922-L926 HydrophobicContact CD2-CD1 3.94Å; F922-L926 HydrophobicContact CE1-CD1 3.22Å; F922-L926 HydrophobicContact CE2-CD1 3.45Å; F922-L926 VanDerWaalsContact CE2-CD1 3.45Å; F922-L926 HydrophobicContact CE2-CG 4.39Å; F922-L926 HydrophobicContact CG-CD1 4.09Å; F922-L926 HydrophobicContact CZ-CD1 3.08Å; F922-L926 HydrophobicContact CZ-CG 4.38Å; F922-L926 WeakPolarHBondContact O-CB 3.28Å; F922-L926 PolarHBondContact O-N 2.97Å; L923-L926 PolarHBondContact O-N 2.78Å; L926-P928 WeakPolarHBondContact O-CD 3.25Å
927	I	60.3	Low	54.8	Low	63 Å²	63	98.9 Å²	98.9	32%	0.323	54%	0.54	S	S	.	.	S	Bend	trans	-109.8	108.5	-175.3	-54.1	174.2	0	0	0	107.9	L923 S929 L931 L932	L923-I927 HydrophobicContact CD2-CD1 4.41Å; L923-I927 PolarHBondContact O-N 3.49Å; I927-S929 PolarHBondContact O-N 2.83Å; I927-L931 HydrophobicContact CG2-CB 3.85Å; I927-L932 HydrophobicContact CB-CD1 4.07Å; I927-L932 HydrophobicContact CB-CG 4.46Å; I927-L932 HydrophobicContact CG2-CD1 3.9Å; I927-L932 HydrophobicContact CG2-CG 3.79Å
928	P	52.2	Low	53.5	Low	61 Å²	61	102.2 Å²	102.2	40%	0.396	55%	0.553	S	S	.	*			trans	-47.9	133.5	172.2	-25.5	30.6	0	0	0	110.7	L926 W930 L931	L926-P928 WeakPolarHBondContact O-CD 3.25Å; P928-W930 VanDerWaalsContact CB-CD1 3.43Å; P928-W930 HydrophobicContact CB-CG 4.29Å; P928-W930 PolarHBondContact O-N 2.74Å; P928-L931 HydrophobicContact CG-CD1 4.26Å; P928-L931 WeakPolarHBondContact O-CB 3.3Å; P928-L931 PolarHBondContact O-N 3.41Å
929	S	52.7	Low	52.1	Low	100 Å²	100	106.7 Å²	106.7	70%	0.699	56%	0.562	S	S	*	*	H	α-helix	trans	-54.3	-27.8	-175.2	48.5	0	0	0	0	113.9	I927 L931 L932 S933	I927-S929 PolarHBondContact O-N 2.83Å; S929-L931 VanDerWaalsContact C-N 3.33Å; S929-L931 PolarHBondContact O-N 3.28Å; S929-L932 PolarHBondContact O-N 3Å; S929-S933 PolarHBondContact O-N 3.26Å; S929-S933 VanDerWaalsContact O-N 3.13Å
930	W	55.3	Low	50.6	Low	177 Å²	177	102.8 Å²	102.8	67%	0.67	57%	0.574	S	S	*	*	H	α-helix	trans	-71.6	-20.4	176.5	68.4	-95	0	0	0	114.4	P928 S933	P928-W930 VanDerWaalsContact CB-CD1 3.43Å; P928-W930 HydrophobicContact CB-CG 4.29Å; P928-W930 PolarHBondContact O-N 2.74Å; W930-S933 WeakPolarHBondContact CA-OG 3.37Å; W930-S933 PolarHBondContact O-OG 3.24Å
931	L	53	Low	49.1	Very low	101 Å²	101	100.5 Å²	100.5	53%	0.529	57%	0.568	S	S	.	*	H	α-helix	trans	-79	-26.2	170.7	-84.5	161.2	0	0	0	111.8	I927 P928 S929	I927-L931 HydrophobicContact CG2-CB 3.85Å; P928-L931 HydrophobicContact CG-CD1 4.26Å; P928-L931 WeakPolarHBondContact O-CB 3.3Å; P928-L931 PolarHBondContact O-N 3.41Å; S929-L931 VanDerWaalsContact C-N 3.33Å; S929-L931 PolarHBondContact O-N 3.28Å
932	L	51.1	Low	47.8	Very low	100 Å²	100	100.1 Å²	100.1	52%	0.524	58%	0.584	S	S	.	*	H	α-helix	trans	-82.8	-16.7	174.5	-74.6	156.4	0	0	0	112.5	I927 S929 N934	I927-L932 HydrophobicContact CB-CD1 4.07Å; I927-L932 HydrophobicContact CB-CG 4.46Å; I927-L932 HydrophobicContact CG2-CD1 3.9Å; I927-L932 HydrophobicContact CG2-CG 3.79Å; S929-L932 PolarHBondContact O-N 3Å; L932-N934 PolarHBondContact O-N 2.79Å
933	S	40.6	Very low	46.1	Very low	78 Å²	78	100.9 Å²	100.9	55%	0.545	59%	0.593	S	S	.	*			trans	-80.1	64.5	174	66.3	0	0	0	0	111.5	S929 W930 P935	S929-S933 PolarHBondContact O-N 3.26Å; S929-S933 VanDerWaalsContact O-N 3.13Å; W930-S933 WeakPolarHBondContact CA-OG 3.37Å; W930-S933 PolarHBondContact O-OG 3.24Å; S933-P935 VanDerWaalsContact O-CD 3.24Å; S933-P935 WeakPolarHBondContact O-CD 3.37Å
934	N	35.5	Very low	44.9	Very low	112 Å²	112	103.4 Å²	103.4	60%	0.599	61%	0.606	S	S	*	*			trans	-101.4	93.2	162.1	-130.4	-9.9	0	0	0	107.3	L932 S936	L932-N934 PolarHBondContact O-N 2.79Å; N934-S936 PolarHBondContact O-N 2.99Å
935	P	36.5	Very low	43.8	Very low	122 Å²	122	105.2 Å²	105.2	79%	0.792	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	3.3	-166.7	25.7	-33	0	0	0	115	S933	S933-P935 VanDerWaalsContact O-CD 3.24Å; S933-P935 WeakPolarHBondContact O-CD 3.37Å
936	S	37.6	Very low	42.7	Very low	96 Å²	96	102.5 Å²	102.5	67%	0.671	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-15.9	-170.1	56.8	0	0	0	0	116.5	N934	N934-S936 PolarHBondContact O-N 2.99Å
937	S	39.6	Very low	41.7	Very low	88 Å²	88	102.9 Å²	102.9	62%	0.615	61%	0.613	S	S	*	*	S	Bend	trans	-113.2	-3.7	-169.1	73.6	0	0	0	0	117.6
938	L	34.3	Very low	41.2	Very low	117 Å²	117	102 Å²	102	61%	0.613	61%	0.613	S	S	*	*			trans	-119.7	64	170.6	-78.1	99	0	0	0	111.4	G940 S941 L944	L938-G940 PolarHBondContact O-N 3.35Å; L938-S941 VanDerWaalsContact CD2-OG 3.25Å; L938-S941 WeakPolarHBondContact CD2-OG 3.31Å; L938-L944 HydrophobicContact CD2-CD1 4.48Å
939	K	32.6	Very low	41.6	Very low	201 Å²	201	109.5 Å²	109.5	87%	0.874	63%	0.633	S	S	*	*	S	Bend	trans	-79.2	0.8	166.6	-86.9	-174.2	174.7	-178.9	0	113.8
940	G	32.6	Very low	42.4	Very low	84 Å²	84	108.7 Å²	108.7	87%	0.866	62%	0.617	S	S	*	*	S	Bend	trans	-110.2	-11.4	-173.6	0	0	0	0	0	115.9	L938	L938-G940 PolarHBondContact O-N 3.35Å
941	S	34.7	Very low	43.2	Very low	49 Å²	49	102.7 Å²	102.7	34%	0.343	60%	0.602	S	S	.	*	S	Bend	trans	-116.5	121.8	173.8	58.4	0	0	0	0	107	L938 D943	L938-S941 VanDerWaalsContact CD2-OG 3.25Å; L938-S941 WeakPolarHBondContact CD2-OG 3.31Å; S941-D943 PolarHBondContact O-N 2.88Å
942	G	34.1	Very low	44.4	Very low	74 Å²	74	98.1 Å²	98.1	76%	0.763	58%	0.579	S	S	*	*			trans	-40.9	132.6	-177.2	0	0	0	0	0	112.3	L944	G942-L944 PolarHBondContact O-N 3.44Å
943	D	33.9	Very low	45.6	Very low	124 Å²	124	97.3 Å²	97.3	66%	0.663	58%	0.575	S	S	*	*			trans	-15.6	96.4	177.5	-77.9	-25.9	0	0	0	114.1	S941 S945 S946	S941-D943 PolarHBondContact O-N 2.88Å; D943-S945 PolarHBondContact O-N 2.75Å; D943-S946 WeakPolarHBondContact O-CB 3.47Å; D943-S946 PolarHBondContact O-N 3.16Å; D943-S946 PolarHBondContact O-OG 2.99Å; D943-S946 VanDerWaalsContact O-OG 3.14Å
944	L	36.9	Very low	46.9	Very low	117 Å²	117	99.3 Å²	99.3	61%	0.613	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-10.5	169	-102.5	118.5	0	0	0	112.3	L938 G942 S946	L938-L944 HydrophobicContact CD2-CD1 4.48Å; G942-L944 PolarHBondContact O-N 3.44Å; L944-S946 PolarHBondContact O-N 2.54Å
945	S	37.5	Very low	48.6	Very low	96 Å²	96	94.9 Å²	94.9	67%	0.671	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.6	168.4	54	0	0	0	0	113.5	D943 F947	D943-S945 PolarHBondContact O-N 2.75Å; S945-F947 PolarHBondContact O-N 3.26Å
946	S	40.5	Very low	49.8	Very low	88 Å²	88	89.7 Å²	89.7	62%	0.615	52%	0.516	S	S	*	.			trans	-79.2	55.2	168.8	79.8	0	0	0	0	111.2	D943 L944 S948	D943-S946 WeakPolarHBondContact O-CB 3.47Å; D943-S946 PolarHBondContact O-N 3.16Å; D943-S946 PolarHBondContact O-OG 2.99Å; D943-S946 VanDerWaalsContact O-OG 3.14Å; L944-S946 PolarHBondContact O-N 2.54Å; S946-S948 PolarHBondContact O-N 3.04Å
947	F	44	Very low	50.9	Low	113 Å²	113	87.9 Å²	87.9	50%	0.496	50%	0.503	S	S	.	.			trans	-59.1	102.2	152.1	-74	-69.4	0	0	0	105.6	N924 S945 R949	N924-F947 WeakPolarHBondContact ND2-CE1 3.45Å; N924-F947 WeakPolarHBondContact ND2-CZ 3.46Å; N924-F947 WeakPolarHBondContact OD1-CZ 3.48Å; S945-F947 PolarHBondContact O-N 3.26Å; F947-R949 VanDerWaalsContact C-N 3.29Å; F947-R949 PolarHBondContact O-N 3.24Å
948	S	50.6	Low	51.4	Low	44 Å²	44	84.3 Å²	84.3	31%	0.308	48%	0.477	S	S	.	.			trans	-65.3	89.8	-173.1	149.2	0	0	0	0	108.8	Q913 S914 S946	Q913-S948 WeakPolarHBondContact O-CB 3.44Å; S914-S948 WeakPolarHBondContact CA-OG 3.38Å; S914-S948 WeakPolarHBondContact CB-OG 3.41Å; S946-S948 PolarHBondContact O-N 3.04Å
949	R	60.9	Low	52.1	Low	218 Å²	218	83.3 Å²	83.3	82%	0.823	48%	0.476	S	S	*	.			trans	-63.5	142.1	167.8	-66.6	-174.6	179.2	104	-2.7	108.3	F947 S951	F947-R949 VanDerWaalsContact C-N 3.29Å; F947-R949 PolarHBondContact O-N 3.24Å; R949-S951 PolarHBondContact O-N 3.19Å
950	F	68	Low	52.9	Low	83 Å²	83	80.2 Å²	80.2	36%	0.364	47%	0.469	S	S	.	.			trans	-52.6	124.7	173.7	179.4	-86.8	0	0	0	110.3	Y824 N826	Y824-F950 HydrophobicContact CE2-CE2 4.36Å; N826-F950 HydrophobicContact CB-CE1 4.29Å; N826-F950 HydrophobicContact CB-CE2 4.28Å; N826-F950 HydrophobicContact CB-CZ 3.6Å; N826-F950 VanDerWaalsContact CG-CZ 3.41Å; N826-F950 WeakPolarHBondContact OD1-CE1 3.48Å; N826-F950 WeakPolarHBondContact OD1-CZ 3.42Å
951	S	73	Confident	53.8	Low	52 Å²	52	77.4 Å²	77.4	36%	0.364	44%	0.44	S	S	.	.			trans	-135.7	115.8	175.9	173.6	0	0	0	0	109.9	R949 L953 F954 R955	R949-S951 PolarHBondContact O-N 3.19Å; S951-L953 PolarHBondContact O-N 3.33Å; S951-L953 PolarHBondContact OG-N 3.19Å; S951-F954 PolarHBondContact O-N 2.97Å; S951-F954 PolarHBondContact OG-N 2.83Å; S951-R955 WeakPolarHBondContact O-CB 3.16Å; S951-R955 PolarHBondContact O-N 3.37Å
952	S	77.3	Confident	54.6	Low	5 Å²	5	81 Å²	81	4%	0.035	45%	0.449	C	S	.	.	H	α-helix	trans	-55.2	-35.4	173	-71.1	0	0	0	0	112.3	N828 D852 A956	N828-S952 PolarHBondContact ND2-OG 2.59Å; D852-S952 WeakPolarHBondContact OD1-CB 3.43Å; D852-S952 PolarHBondContact OD1-OG 3.12Å; D852-S952 WeakPolarHBondContact OD2-CB 3.19Å; D852-S952 PolarHBondContact OD2-OG 3.03Å; S952-A956 WeakPolarHBondContact O-CB 3.36Å; S952-A956 PolarHBondContact O-N 3.37Å
953	L	77.2	Confident	55.5	Low	83 Å²	83	77.8 Å²	77.8	44%	0.435	42%	0.415	S	S	.	.	H	α-helix	trans	-72.2	-44.7	-179.2	-65.8	175	0	0	0	112.1	V854 S951 R955 A956 S957	V854-L953 HydrophobicContact CG1-CD2 4.09Å; V854-L953 HydrophobicContact CG1-CG 4.05Å; S951-L953 PolarHBondContact O-N 3.33Å; S951-L953 PolarHBondContact OG-N 3.19Å; L953-R955 VanDerWaalsContact C-N 3.32Å; L953-R955 PolarHBondContact O-N 3.35Å; L953-A956 CarbonylContact O-C 3.38Å; L953-A956 WeakPolarHBondContact O-CB 3.41Å; L953-A956 PolarHBondContact O-N 3.12Å; L953-S957 WeakPolarHBondContact O-CB 3.43Å; L953-S957 PolarHBondContact O-N 3.2Å; L953-S957 PolarHBondContact O-OG 2.85Å
954	F	68.7	Low	56.3	Low	119 Å²	119	76.7 Å²	76.7	52%	0.522	42%	0.418	S	S	.	.	H	α-helix	trans	-62.4	-43.4	176.9	-179.8	-100.5	0	0	0	110.9	S951 A956 S957 D958	S951-F954 PolarHBondContact O-N 2.97Å; S951-F954 PolarHBondContact OG-N 2.83Å; F954-A956 PolarHBondContact O-N 2.91Å; F954-S957 WeakPolarHBondContact CA-OG 3.41Å; F954-S957 CarbonylContact O-C 3.17Å; F954-S957 PolarHBondContact O-N 3.43Å; F954-S957 PolarHBondContact O-OG 3.41Å; F954-D958 PolarHBondContact O-N 2.83Å
955	R	69.6	Low	56.8	Low	20 Å²	20	73.2 Å²	73.2	8%	0.075	40%	0.403	C	S	.	.	H	α-helix	trans	-64.9	-31.5	178.5	-159.8	177.5	-177.5	107.9	-3.6	113.1	Y824 E901 S951 L953 S970 L971	Y824-R955 VanDerWaalsContact CE2-NE 3.25Å; E901-R955 VanDerWaalsContact CD-NH1 3.32Å; E901-R955 IonicContact OE1-CZ 3.16Å; E901-R955 IonicContact OE1-NH1 2.73Å; E901-R955 PolarHBondContact OE1-NH1 2.86Å; E901-R955 VanDerWaalsContact OE1-NH1 3.09Å; E901-R955 IonicContact OE1-NH2 2.7Å; E901-R955 IonicContact OE2-CZ 2.7Å; E901-R955 IonicContact OE2-NH1 3.89Å; E901-R955 PolarHBondContact OE2-NH1 3.42Å; E901-R955 IonicContact OE2-NH2 3.84Å; E901-R955 PolarHBondContact OE2-NH2 3.45Å; S951-R955 WeakPolarHBondContact O-CB 3.16Å; S951-R955 PolarHBondContact O-N 3.37Å; L953-R955 VanDerWaalsContact C-N 3.32Å; L953-R955 PolarHBondContact O-N 3.35Å; R955-S970 PolarHBondContact O-OG 2.85Å; R955-L971 HydrophobicContact CG-CB 3.62Å; R955-L971 HydrophobicContact CG-CD1 3.94Å; R955-L971 HydrophobicContact CG-CG 4.37Å; R955-L971 PolarHBondContact NE-O 3.46Å; R955-L971 PolarHBondContact NH2-O 3.23Å
956	A	62.1	Low	57.4	Low	12 Å²	12	72.7 Å²	72.7	10%	0.099	40%	0.396	C	S	.	.	H	α-helix	trans	-75.8	-22.9	172.2	0	0	0	0	0	112.6	A855 R857 S952 L953 F954	A855-A956 HydrophobicContact CB-CB 3.79Å; R857-A956 VanDerWaalsContact NH1-C 3.27Å; R857-A956 PolarHBondContact NH1-O 2.92Å; R857-A956 PolarHBondContact NH2-O 2.85Å; S952-A956 WeakPolarHBondContact O-CB 3.36Å; S952-A956 PolarHBondContact O-N 3.37Å; L953-A956 CarbonylContact O-C 3.38Å; L953-A956 WeakPolarHBondContact O-CB 3.41Å; L953-A956 PolarHBondContact O-N 3.12Å; F954-A956 PolarHBondContact O-N 2.91Å
957	S	60.1	Low	57.6	Low	59 Å²	59	72 Å²	72	41%	0.413	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	32.9	-176.3	72.9	0	0	0	0	112.4	L953 F954 V959	L953-S957 WeakPolarHBondContact O-CB 3.43Å; L953-S957 PolarHBondContact O-N 3.2Å; L953-S957 PolarHBondContact O-OG 2.85Å; F954-S957 WeakPolarHBondContact CA-OG 3.41Å; F954-S957 CarbonylContact O-C 3.17Å; F954-S957 PolarHBondContact O-N 3.43Å; F954-S957 PolarHBondContact O-OG 3.41Å; S957-V959 VanDerWaalsContact O-CG2 3.31Å; S957-V959 WeakPolarHBondContact O-CG2 3.01Å; S957-V959 PolarHBondContact O-N 2.84Å
958	D	52.1	Low	57.7	Low	13 Å²	13	72.5 Å²	72.5	7%	0.07	41%	0.407	C	S	.	.			trans	-71.5	65.5	176.1	-166.1	11.3	0	0	0	110.1	F954 D960 N969 L971	F954-D958 PolarHBondContact O-N 2.83Å; D958-D960 PolarHBondContact O-N 2.87Å; D958-N969 CarbonylContact C-O 3.59Å; D958-N969 PolarHBondContact N-O 2.65Å; D958-N969 CarbonylContact O-C 3.47Å; D958-N969 WeakPolarHBondContact O-CA 3.5Å; D958-N969 VanDerWaalsContact O-CB 3.25Å; D958-N969 WeakPolarHBondContact O-CB 3.21Å; D958-N969 VanDerWaalsContact O-O 3.11Å; D958-L971 HydrophobicContact CB-CG 4.27Å; D958-L971 WeakPolarHBondContact OD2-CG 3.37Å
959	V	48.3	Very low	57.6	Low	96 Å²	96	74.5 Å²	74.5	58%	0.582	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.2	-175.3	-174.7	0	0	0	0	111	S957 G961	S957-V959 VanDerWaalsContact O-CG2 3.31Å; S957-V959 WeakPolarHBondContact O-CG2 3.01Å; S957-V959 PolarHBondContact O-N 2.84Å; V959-G961 PolarHBondContact O-N 2.88Å
960	D	49.2	Very low	57.4	Low	136 Å²	136	65.3 Å²	65.3	73%	0.727	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-3.2	-175.2	-67.6	-19	0	0	0	113	D958 F962	D958-D960 PolarHBondContact O-N 2.87Å; D960-F962 HydrophobicContact CB-CD2 4.07Å; D960-F962 PolarHBondContact O-N 3.02Å; D960-F962 VanDerWaalsContact O-N 3.13Å
961	G	51	Low	57.3	Low	25 Å²	25	61.9 Å²	61.9	26%	0.258	37%	0.368	S	S	.	.			trans	57.4	29.6	-178.4	0	0	0	0	0	111.9	V959 C963 S964	V959-G961 PolarHBondContact O-N 2.88Å; G961-C963 CarbonylContact O-C 3.59Å; G961-C963 PolarHBondContact O-N 3.01Å; G961-S964 PolarHBondContact O-N 2.95Å
962	F	51.3	Low	57.4	Low	123 Å²	123	62.6 Å²	62.6	54%	0.539	37%	0.367	S	S	.	.	S	Bend	trans	-55.9	-28.5	-175.5	-129.5	-83.5	0	0	0	111.3	K904 D960	K904-F962 WeakPolarHBondContact CE-O 3.26Å; D960-F962 HydrophobicContact CB-CD2 4.07Å; D960-F962 PolarHBondContact O-N 3.02Å; D960-F962 VanDerWaalsContact O-N 3.13Å
963	C	53.1	Low	57.8	Low	7 Å²	7	62.6 Å²	62.6	5%	0.047	37%	0.367	C	S	.	.	S	Bend	trans	-100	101.7	157.9	-81	0	0	0	0	112.4	C910 G961 S965 L971	C910-C963 WeakPolarHBondContact CA-SG 3.45Å; C910-C963 HydrophobicContact CB-CB 3.98Å; C910-C963 WeakPolarHBondContact CB-SG 3.33Å; C910-C963 WeakPolarHBondContact SG-CB 3.4Å; C910-C963 CovalentContact SG-SG 2Å; C910-C963 PolarHBondContact SG-SG 2.9Å; G961-C963 CarbonylContact O-C 3.59Å; G961-C963 PolarHBondContact O-N 3.01Å; C963-S965 PolarHBondContact O-N 2.81Å; C963-L971 HydrophobicContact CB-CD2 4.08Å
964	S	50.8	Low	58.3	Low	102 Å²	102	62.4 Å²	62.4	71%	0.713	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	13.3	168.4	-37.8	0	0	0	0	113.3	G961 T966	G961-S964 PolarHBondContact O-N 2.95Å; S964-T966 VanDerWaalsContact C-N 3.3Å; S964-T966 PolarHBondContact O-N 2.98Å
965	S	48.6	Very low	59.4	Low	44 Å²	44	58.5 Å²	58.5	31%	0.308	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.8	-169.2	51.2	0	0	0	0	114	C963	C963-S965 PolarHBondContact O-N 2.81Å
966	T	48.5	Very low	60.5	Low	84 Å²	84	59.6 Å²	59.6	52%	0.515	36%	0.357	S	S	.	.	S	Bend	trans	-147.9	5.1	178	49.1	0	0	0	0	116.1	S964 E968	S964-T966 VanDerWaalsContact C-N 3.3Å; S964-T966 PolarHBondContact O-N 2.98Å; T966-E968 PolarHBondContact O-N 2.98Å
967	G	45.5	Very low	62.1	Low	74 Å²	74	62.6 Å²	62.6	76%	0.763	37%	0.369	S	S	*	.	S	Bend	trans	64.5	5.8	-175.7	0	0	0	0	0	114.2
968	E	46.1	Very low	63.8	Low	124 Å²	124	62.3 Å²	62.3	58%	0.579	36%	0.361	S	S	*	.	S	Bend	trans	-111.4	130.7	174	-66.4	-171.2	165.3	0	0	108.6	T966 S970	T966-E968 PolarHBondContact O-N 2.98Å; E968-S970 PolarHBondContact O-N 2.76Å
969	N	48.5	Very low	65.8	Low	86 Å²	86	63.2 Å²	63.2	46%	0.46	37%	0.368	S	S	.	.	S	Bend	trans	-67.5	51	-173.5	-69.3	-4.7	0	0	0	114.6	D958	D958-N969 CarbonylContact C-O 3.59Å; D958-N969 PolarHBondContact N-O 2.65Å; D958-N969 CarbonylContact O-C 3.47Å; D958-N969 WeakPolarHBondContact O-CA 3.5Å; D958-N969 VanDerWaalsContact O-CB 3.25Å; D958-N969 WeakPolarHBondContact O-CB 3.21Å; D958-N969 VanDerWaalsContact O-O 3.11Å
970	S	56	Low	68	Low	25 Å²	25	58.7 Å²	58.7	18%	0.175	34%	0.341	C	S	.	.	S	Bend	trans	-159.8	139.6	-176	-169.1	0	0	0	0	113	R955 E968 I972	R955-S970 PolarHBondContact O-OG 2.85Å; E968-S970 PolarHBondContact O-N 2.76Å; S970-I972 VanDerWaalsContact C-N 3.3Å; S970-I972 PolarHBondContact O-N 2.88Å
971	L	65.5	Low	70.2	Confident	11 Å²	11	53.2 Å²	53.2	6%	0.058	31%	0.312	C	S	.	.			trans	-80	73.6	174.9	-66	164	0	0	0	111.1	P902 C910 R955 D958 C963	P902-L971 HydrophobicContact CG-CB 4.45Å; P902-L971 HydrophobicContact CG-CD2 4.17Å; C910-L971 HydrophobicContact CB-CD2 3.5Å; R955-L971 HydrophobicContact CG-CB 3.62Å; R955-L971 HydrophobicContact CG-CD1 3.94Å; R955-L971 HydrophobicContact CG-CG 4.37Å; R955-L971 PolarHBondContact NE-O 3.46Å; R955-L971 PolarHBondContact NH2-O 3.23Å; D958-L971 HydrophobicContact CB-CG 4.27Å; D958-L971 WeakPolarHBondContact OD2-CG 3.37Å; C963-L971 HydrophobicContact CB-CD2 4.08Å
972	I	76.1	Confident	72.2	Confident	66 Å²	66	52.2 Å²	52.2	34%	0.338	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-66.7	130.2	174.9	-59.1	172.6	0	0	0	108.6	P902 S970	P902-I972 WeakPolarHBondContact CG-O 3.28Å; S970-I972 VanDerWaalsContact C-N 3.3Å; S970-I972 PolarHBondContact O-N 2.88Å
973	P	85.8	Confident	74	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.032	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-65.8	146.8	178.3	28.2	-34.5	0	0	0	111.2	Y824 L859 L899 Y900 V975	Y824-P973 HydrophobicContact CD1-CB 3.82Å; Y824-P973 HydrophobicContact CD1-CG 4.09Å; Y824-P973 HydrophobicContact CD2-CB 4.16Å; Y824-P973 HydrophobicContact CE1-CB 4.23Å; Y824-P973 HydrophobicContact CE1-CG 4.07Å; Y824-P973 HydrophobicContact CG-CB 3.74Å; Y824-P973 HydrophobicContact CG-CG 4.47Å; L859-P973 HydrophobicContact CB-CG 4.4Å; L899-P973 HydrophobicContact CB-CB 4.4Å; L899-P973 HydrophobicContact CD2-CG 4.39Å; Y900-P973 CarbonylContact O-C 2.91Å; Y900-P973 WeakPolarHBondContact O-CA 3.31Å; Y900-P973 WeakPolarHBondContact O-CB 3.38Å; P973-V975 WeakPolarHBondContact O-CG2 3.37Å; P973-V975 PolarHBondContact O-N 3.43Å
974	Q	86.7	Confident	75.6	Confident	79 Å²	79	53 Å²	53	37%	0.369	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.4	167.4	-177.5	179.3	2.7	0	0	108.6	Y900	Y900-Q974 PolarHBondContact N-O 2.9Å; Y900-Q974 PolarHBondContact O-N 3.39Å
975	V	91.8	Very high	77.4	Confident	38 Å²	38	49 Å²	49	23%	0.23	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.9	-175.9	-172.1	0	0	0	0	109.8	Y860 I897 L899 P973	Y860-V975 HydrophobicContact CD1-CG1 4.44Å; Y860-V975 HydrophobicContact CD2-CB 4Å; Y860-V975 HydrophobicContact CD2-CG1 3.8Å; Y860-V975 HydrophobicContact CD2-CG2 3.76Å; Y860-V975 HydrophobicContact CE1-CG1 4.42Å; Y860-V975 HydrophobicContact CE2-CB 4.16Å; Y860-V975 HydrophobicContact CE2-CG1 3.77Å; Y860-V975 HydrophobicContact CE2-CG2 4.43Å; Y860-V975 HydrophobicContact CG-CG1 4.14Å; Y860-V975 HydrophobicContact CG-CG2 4.15Å; I897-V975 HydrophobicContact CG2-CG1 3.47Å; I897-V975 VanDerWaalsContact CG2-CG1 3.47Å; L899-V975 HydrophobicContact CD2-CB 4.29Å; L899-V975 HydrophobicContact CD2-CG1 4.01Å; L899-V975 HydrophobicContact CD2-CG2 3.65Å; P973-V975 WeakPolarHBondContact O-CG2 3.37Å; P973-V975 PolarHBondContact O-N 3.43Å
976	L	94.4	Very high	79.5	Confident	42 Å²	42	47 Å²	47	22%	0.22	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.1	169	-57	-175.5	0	0	0	108.8	I897 E898 Y900 P1024 R1025	I897-L976 CarbonylContact C-O 3.55Å; I897-L976 WeakPolarHBondContact CA-O 3.45Å; E898-L976 PolarHBondContact N-O 2.86Å; E898-L976 PolarHBondContact O-N 2.91Å; Y900-L976 HydrophobicContact CD2-CD1 4.02Å; Y900-L976 HydrophobicContact CD2-CG 4.19Å; Y900-L976 HydrophobicContact CE2-CD1 3.75Å; Y900-L976 HydrophobicContact CE2-CG 4.27Å; L976-P1024 HydrophobicContact CB-CB 4.14Å; L976-P1024 HydrophobicContact CB-CG 3.79Å; L976-R1025 HydrophobicContact CD1-CG 3.59Å
977	Q	94.7	Very high	81.6	Confident	75 Å²	75	44.9 Å²	44.9	35%	0.35	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	137.4	-177.8	-178.3	-169.7	2.7	0	0	110.1	Y860 T895 V896 I897	Y860-Q977 PolarHBondContact OH-OE1 2.84Å; T895-Q977 HydrophobicContact CG2-CG 3.84Å; V896-Q977 WeakPolarHBondContact O-CA 3.47Å; I897-Q977 HydrophobicContact CG1-CG 4.25Å
978	Q	95.3	Very high	83.6	Confident	54 Å²	54	44.3 Å²	44.3	25%	0.252	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	149.2	170.4	-167.5	67.8	-61.6	0	0	110.7	T895 V896 Y980 P1024 R1026 Y1042	T895-Q978 WeakPolarHBondContact CA-O 3.38Å; V896-Q978 PolarHBondContact N-O 3.05Å; V896-Q978 PolarHBondContact O-N 2.81Å; Q978-Y980 HydrophobicContact CB-CE2 4.22Å; Q978-Y980 HydrophobicContact CG-CE1 4.41Å; Q978-Y980 HydrophobicContact CG-CE2 4.1Å; Q978-P1024 VanDerWaalsContact CB-CA 3.49Å; Q978-P1024 HydrophobicContact CB-CB 3.68Å; Q978-R1026 PolarHBondContact NE2-O 2.9Å; Q978-Y1042 HydrophobicContact CG-CD2 4.12Å; Q978-Y1042 HydrophobicContact CG-CE2 3.61Å
979	S	94.7	Very high	85.4	Confident	31 Å²	31	40.7 Å²	40.7	22%	0.217	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.9	178.7	-57.6	0	0	0	0	111.4	T895 Y1042	T895-S979 PolarHBondContact OG1-OG 2.9Å; S979-Y1042 PolarHBondContact O-OH 2.94Å
980	Y	95.3	Very high	87.5	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	162.8	177.6	-59.5	-82.4	0	0	0	110.8	E893 A894 V896 Q978 F1022 D1023 Y1042 P1044 L1046	E893-Y980 CarbonylContact C-O 3.58Å; E893-Y980 WeakPolarHBondContact CA-O 3.16Å; A894-Y980 PolarHBondContact N-O 2.82Å; A894-Y980 PolarHBondContact O-N 2.83Å; V896-Y980 HydrophobicContact CG2-CD2 4.04Å; V896-Y980 HydrophobicContact CG2-CE2 3.95Å; Q978-Y980 HydrophobicContact CB-CE2 4.22Å; Q978-Y980 HydrophobicContact CG-CE1 4.41Å; Q978-Y980 HydrophobicContact CG-CE2 4.1Å; Y980-F1022 HydrophobicContact CD2-CD1 4.28Å; Y980-D1023 PolarHBondContact OH-O 2.68Å; Y980-Y1042 HydrophobicContact CD1-CE2 4.1Å; Y980-Y1042 AromaticContact CE1-CD2 3.92Å; Y980-Y1042 HydrophobicContact CE1-CD2 3.92Å; Y980-Y1042 AromaticContact CE1-CE2 3.67Å; Y980-Y1042 HydrophobicContact CE1-CE2 3.67Å; Y980-P1044 CarbonylContact C-O 3.59Å; Y980-P1044 WeakPolarHBondContact CA-O 3.47Å; Y980-L1046 HydrophobicContact CD1-CD2 4.19Å; Y980-L1046 HydrophobicContact CD1-CG 4.4Å; Y980-L1046 HydrophobicContact CG-CD1 4.2Å; Y980-L1046 HydrophobicContact CG-CD2 4.28Å; Y980-L1046 HydrophobicContact CG-CG 4.23Å
981	I	95.4	Very high	89.3	Confident	22 Å²	22	36.2 Å²	36.2	11%	0.113	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	130	-178.9	-55	168.1	0	0	0	108.4	R891 N892 P1044 V1045 L1046	R891-I981 HydrophobicContact CB-CG2 4.3Å; R891-I981 HydrophobicContact CG-CG2 4.33Å; N892-I981 WeakPolarHBondContact O-CA 3.42Å; I981-P1044 WeakPolarHBondContact CB-O 3.35Å; I981-P1044 HydrophobicContact CD1-CB 3.92Å; I981-P1044 HydrophobicContact CG1-CB 4.47Å; I981-P1044 PolarHBondContact N-O 3Å; I981-V1045 HydrophobicContact CB-CG2 4.24Å; I981-V1045 HydrophobicContact CD1-CG2 4.17Å; I981-V1045 HydrophobicContact CG2-CG2 4.43Å; I981-L1046 PolarHBondContact O-N 3.09Å
982	L	92.5	Very high	90.7	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.4	173.5	-60.5	175.5	0	0	0	109.5	T883 N892 A894 T984 P986 L1007 L1046 F1048	T883-L982 HydrophobicContact CG2-CD1 3.94Å; N892-L982 HydrophobicContact CB-CB 4.18Å; N892-L982 PolarHBondContact O-N 2.84Å; A894-L982 HydrophobicContact CB-CD1 3.99Å; A894-L982 HydrophobicContact CB-CD2 4.38Å; A894-L982 HydrophobicContact CB-CG 4.08Å; L982-T984 VanDerWaalsContact C-N 3.29Å; L982-T984 PolarHBondContact O-N 3.31Å; L982-P986 HydrophobicContact CD1-CG 4.24Å; L982-L1007 HydrophobicContact CD2-CD1 4.34Å; L982-L1046 HydrophobicContact CD2-CB 4.45Å; L982-L1046 HydrophobicContact CD2-CD1 3.52Å; L982-F1048 HydrophobicContact CB-CZ 4.18Å; L982-F1048 HydrophobicContact CD2-CE1 3.86Å; L982-F1048 HydrophobicContact CD2-CZ 3.76Å
983	N	88.2	Confident	91.6	Very high	105 Å²	105	34.2 Å²	34.2	56%	0.561	20%	0.198	S	C	*	.	S	Bend	trans	-63.8	-36.6	177.8	-77.1	-13.8	0	0	0	112.3	V1045	N983-V1045 WeakPolarHBondContact OD1-CG1 3.46Å
984	T	88.3	Confident	92.1	Very high	40 Å²	40	34 Å²	34	25%	0.245	20%	0.197	C	C	.	.	S	Bend	trans	-120.4	127.5	175.1	-51.6	0	0	0	0	108.9	L982 L1009 R1011	L982-T984 VanDerWaalsContact C-N 3.29Å; L982-T984 PolarHBondContact O-N 3.31Å; T984-L1009 HydrophobicContact CG2-CB 3.99Å; T984-L1009 HydrophobicContact CG2-CD1 4.4Å; T984-L1009 HydrophobicContact CG2-CD2 4.44Å; T984-R1011 HydrophobicContact CG2-CB 4.33Å
985	P	88.2	Confident	92.4	Very high	19 Å²	19	31.7 Å²	31.7	12%	0.123	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-63.6	141.1	177.7	22.1	-30.3	0	0	0	111.3	P870 N892 Q1010	P870-P985 HydrophobicContact CG-CB 4.13Å; N892-P985 HydrophobicContact CB-CB 4.49Å; N892-P985 WeakPolarHBondContact ND2-CD 3.07Å; P985-Q1010 HydrophobicContact CB-CG 4.27Å; P985-Q1010 HydrophobicContact CG-CB 4.16Å; P985-Q1010 HydrophobicContact CG-CG 3.9Å; P985-Q1010 PolarHBondContact O-N 3.11Å
986	P	92.4	Very high	92.4	Very high	2 Å²	2	30 Å²	30	1%	0.013	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	155.7	162.4	32	-31.7	0	0	0	110	T883 L982 V991 L1007 A1008	T883-P986 HydrophobicContact CG2-CG 4.02Å; L982-P986 HydrophobicContact CD1-CG 4.24Å; P986-V991 HydrophobicContact CB-CG2 3.8Å; P986-V991 HydrophobicContact CG-CG2 4.18Å; P986-L1007 HydrophobicContact CB-CB 4.46Å; P986-L1007 HydrophobicContact CB-CD2 4.33Å; P986-A1008 CarbonylContact C-O 3.56Å; P986-A1008 WeakPolarHBondContact CA-O 3.09Å
987	R	92.1	Very high	92.2	Very high	40 Å²	40	31.7 Å²	31.7	15%	0.151	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	149.2	169	-61.4	-173.2	62.4	79.5	12.3	109.6	E78 S872 G989 A990 A1008 Q1010 I1063	E78-R987 VanDerWaalsContact CD-NH1 3.29Å; E78-R987 IonicContact OE1-CZ 3.06Å; E78-R987 IonicContact OE1-NH1 3.17Å; E78-R987 PolarHBondContact OE1-NH1 3.21Å; E78-R987 IonicContact OE1-NH2 2.65Å; E78-R987 PolarHBondContact OE1-NH2 3.27Å; E78-R987 IonicContact OE2-CZ 3.8Å; E78-R987 IonicContact OE2-NH1 3.27Å; E78-R987 PolarHBondContact OE2-NH1 2.89Å; E78-R987 VanDerWaalsContact OE2-NH1 3.09Å; E78-R987 IonicContact OE2-NH2 3.63Å; E78-R987 PolarHBondContact OE2-NH2 3.05Å; S872-R987 PolarHBondContact OG-O 2.8Å; R987-G989 PolarHBondContact O-N 3.49Å; R987-A990 HydrophobicContact CB-CB 3.93Å; R987-A990 PolarHBondContact O-N 2.88Å; R987-A990 VanDerWaalsContact O-N 3.16Å; R987-A1008 PolarHBondContact N-O 3.21Å; R987-Q1010 HydrophobicContact CG-CG 4.05Å; R987-I1063 WeakPolarHBondContact CD-O 3.3Å; R987-I1063 PolarHBondContact NE-O 3.31Å
988	S	87.3	Confident	91.9	Very high	61 Å²	61	35.6 Å²	35.6	43%	0.427	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	127.4	-178.1	-160.9	0	0	0	0	110.5	I871 A990	I871-S988 PolarHBondContact O-OG 3.4Å; I871-S988 VanDerWaalsContact O-OG 3.13Å; S988-A990 PolarHBondContact O-N 3.29Å
989	G	85.4	Confident	91.5	Very high	49 Å²	49	33.2 Å²	33.2	51%	0.505	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	70.3	2.8	-178.3	0	0	0	0	0	116.6	I871 S872 R987 V991	I871-G989 PolarHBondContact O-N 3.17Å; S872-G989 PolarHBondContact OG-N 2.87Å; R987-G989 PolarHBondContact O-N 3.49Å; G989-V991 PolarHBondContact O-N 2.78Å
990	A	91.2	Very high	91.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	50.2	-173.8	0	0	0	0	0	112.4	R987 S988 A1008 I1063	R987-A990 HydrophobicContact CB-CB 3.93Å; R987-A990 PolarHBondContact O-N 2.88Å; R987-A990 VanDerWaalsContact O-N 3.16Å; S988-A990 PolarHBondContact O-N 3.29Å; A990-A1008 HydrophobicContact CB-CB 3.66Å; A990-A1008 PolarHBondContact O-N 3.21Å; A990-I1063 HydrophobicContact CB-CG2 4.47Å
991	V	94.8	Very high	91.1	Very high	16 Å²	16	35.5 Å²	35.5	10%	0.097	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.7	175.2	-179.3	0	0	0	0	108.7	S872 V874 P986 G989 I1005 I1006 L1007	S872-V991 VanDerWaalsContact CB-CG2 3.47Å; S872-V991 WeakPolarHBondContact OG-CG2 3.25Å; V874-V991 HydrophobicContact CG2-CB 4Å; V874-V991 HydrophobicContact CG2-CG1 3.78Å; V874-V991 VanDerWaalsContact CG2-O 3.24Å; V874-V991 WeakPolarHBondContact CG2-O 3.32Å; P986-V991 HydrophobicContact CB-CG2 3.8Å; P986-V991 HydrophobicContact CG-CG2 4.18Å; G989-V991 PolarHBondContact O-N 2.78Å; V991-I1005 HydrophobicContact CG1-CG2 3.83Å; V991-I1006 WeakPolarHBondContact CA-O 3.48Å; V991-L1007 HydrophobicContact CB-CD2 4.06Å; V991-L1007 HydrophobicContact CG1-CD2 3.46Å; V991-L1007 VanDerWaalsContact CG1-CD2 3.46Å; V991-L1007 HydrophobicContact CG2-CD2 3.46Å; V991-L1007 VanDerWaalsContact CG2-CD2 3.46Å
992	T	94.9	Very high	90.8	Very high	26 Å²	26	37 Å²	37	16%	0.16	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	175.8	179.7	-166.3	0	0	0	0	111.4	I1006 I1066 T1068	T992-I1006 HydrophobicContact CG2-CB 4.01Å; T992-I1006 HydrophobicContact CG2-CD1 4.21Å; T992-I1006 HydrophobicContact CG2-CG1 4.48Å; T992-I1006 PolarHBondContact N-O 2.75Å; T992-I1006 PolarHBondContact O-N 2.79Å; T992-I1066 HydrophobicContact CG2-CB 3.63Å; T992-I1066 HydrophobicContact CG2-CD1 4.27Å; T992-I1066 HydrophobicContact CG2-CG2 3.53Å; T992-T1068 HydrophobicContact CG2-CG2 3.71Å
993	V	95.1	Very high	90.8	Very high	10 Å²	10	37.3 Å²	37.3	6%	0.061	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.1	178.3	-164.4	0	0	0	0	109.8	V874 W879 K1003 N1004 T1068	V874-V993 HydrophobicContact CG1-CG2 3.23Å; W879-V993 HydrophobicContact CH2-CB 4.33Å; W879-V993 HydrophobicContact CH2-CG1 3.83Å; W879-V993 HydrophobicContact CH2-CG2 3.46Å; W879-V993 VanDerWaalsContact CH2-CG2 3.46Å; W879-V993 HydrophobicContact CZ2-CG1 3.88Å; W879-V993 HydrophobicContact CZ2-CG2 4.22Å; W879-V993 HydrophobicContact CZ3-CG2 4.19Å; V993-K1003 HydrophobicContact CG1-CB 3.95Å; V993-K1003 HydrophobicContact CG1-CD 3.92Å; V993-K1003 HydrophobicContact CG1-CG 4.37Å; V993-N1004 CarbonylContact C-O 3.49Å; V993-N1004 WeakPolarHBondContact CA-O 3.34Å; V993-T1068 WeakPolarHBondContact O-CB 3.29Å; V993-T1068 WeakPolarHBondContact O-CG2 3.45Å; V993-T1068 PolarHBondContact O-OG1 3.43Å
994	S	94.9	Very high	91.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	19%	0.188	C	C	.	.			trans	-61.5	139.1	167.6	66.7	0	0	0	0	111.1	K1003 N1004 P1093	S994-K1003 WeakPolarHBondContact O-CD 3.36Å; S994-N1004 PolarHBondContact N-O 2.87Å; S994-N1004 PolarHBondContact OG-N 3.17Å; S994-N1004 PolarHBondContact OG-O 2.74Å; S994-P1093 WeakPolarHBondContact OG-CG 3.25Å
995	V	92.9	Very high	91.5	Very high	29 Å²	29	30.9 Å²	30.9	18%	0.176	18%	0.176	C	C	.	.			trans	-125.6	129	177.7	-178.5	0	0	0	0	108.1	P1070	V995-P1070 HydrophobicContact CG1-CB 4.31Å; V995-P1070 HydrophobicContact CG1-CG 4.31Å; V995-P1070 WeakPolarHBondContact O-CA 3.21Å
996	T	92.4	Very high	91.9	Very high	3 Å²	3	30 Å²	30	2%	0.018	17%	0.17	C	C	.	.			trans	-121.7	165.8	175.6	60.8	0	0	0	0	109.6	R998 G999 T1001 P1070 E1074	T996-R998 PolarHBondContact O-N 2.69Å; T996-G999 WeakPolarHBondContact OG1-CA 3.49Å; T996-G999 PolarHBondContact OG1-N 2.51Å; T996-T1001 HydrophobicContact CG2-CG2 4.37Å; T996-T1001 WeakPolarHBondContact CG2-OG1 3.46Å; T996-T1001 PolarHBondContact OG1-OG1 3.43Å; T996-T1001 VanDerWaalsContact OG1-OG1 3.12Å; T996-P1070 VanDerWaalsContact C-CB 3.48Å; T996-E1074 VanDerWaalsContact CB-O 3.29Å; T996-E1074 WeakPolarHBondContact CB-O 2.98Å; T996-E1074 WeakPolarHBondContact CB-OE1 2.98Å; T996-E1074 VanDerWaalsContact CG2-O 3.25Å; T996-E1074 WeakPolarHBondContact CG2-O 3.47Å; T996-E1074 PolarHBondContact OG1-OE1 3.49Å
997	E	89.5	Confident	92	Very high	78 Å²	78	30 Å²	30	36%	0.364	17%	0.17	S	C	.	.	S	Bend	trans	-55.1	-50.7	-168.4	-165.7	-169.3	139.4	0	0	112.9	H807 T1071 G1072 E1074	H807-E997 PolarHBondContact CD2-O 3.29Å; E997-T1071 WeakPolarHBondContact CB-O 3.16Å; E997-G1072 WeakPolarHBondContact OE2-CA 3.46Å; E997-E1074 PolarHBondContact N-OE2 2.88Å; E997-E1074 VanDerWaalsContact N-OE2 3.14Å
998	R	89.2	Confident	92.1	Very high	156 Å²	156	28.1 Å²	28.1	59%	0.589	16%	0.163	S	C	*	.	S	Bend	trans	-111.1	-10.8	-175.3	-60.2	-174.5	179	-168.9	-0.9	113.2	T996 I1000 E1074	T996-R998 PolarHBondContact O-N 2.69Å; R998-I1000 VanDerWaalsContact C-N 3.34Å; R998-I1000 HydrophobicContact CB-CD1 4Å; R998-I1000 HydrophobicContact CB-CG1 3.99Å; R998-E1074 WeakPolarHBondContact CA-OE2 2.85Å; R998-E1074 WeakPolarHBondContact CB-OE2 3.27Å; R998-E1074 PolarHBondContact N-OE2 2.78Å
999	G	87.8	Confident	92.4	Very high	5 Å²	5	25.5 Å²	25.5	5%	0.052	14%	0.144	C	C	.	.	S	Bend	trans	68.9	30.5	-179.3	0	0	0	0	0	113.8	Y809 T996 E1074	Y809-G999 VanDerWaalsContact CB-O 3.25Å; Y809-G999 WeakPolarHBondContact CB-O 3.39Å; T996-G999 WeakPolarHBondContact OG1-CA 3.49Å; T996-G999 PolarHBondContact OG1-N 2.51Å; G999-E1074 PolarHBondContact N-OE1 2.79Å; G999-E1074 VanDerWaalsContact N-OE1 3.17Å
1000	I	89.7	Confident	92.7	Very high	71 Å²	71	27.7 Å²	27.7	36%	0.364	14%	0.141	S	C	.	.			trans	-77	-39.8	173.3	-62	169.7	0	0	0	110.1	Y809 R998 E1074	Y809-I1000 HydrophobicContact CD1-CB 4.34Å; Y809-I1000 HydrophobicContact CD1-CG1 3.97Å; Y809-I1000 HydrophobicContact CD1-CG2 4.27Å; Y809-I1000 HydrophobicContact CD2-CD1 4.18Å; Y809-I1000 HydrophobicContact CD2-CG1 3.51Å; Y809-I1000 HydrophobicContact CE1-CG1 4.28Å; Y809-I1000 HydrophobicContact CE1-CG2 4.29Å; Y809-I1000 HydrophobicContact CE2-CD1 4.1Å; Y809-I1000 HydrophobicContact CE2-CG1 3.84Å; Y809-I1000 HydrophobicContact CG-CB 4.29Å; Y809-I1000 HydrophobicContact CG-CG1 3.57Å; R998-I1000 VanDerWaalsContact C-N 3.34Å; R998-I1000 HydrophobicContact CB-CD1 4Å; R998-I1000 HydrophobicContact CB-CG1 3.99Å; I1000-E1074 WeakPolarHBondContact CA-OE1 3.02Å; I1000-E1074 HydrophobicContact CB-CG 3.89Å; I1000-E1074 HydrophobicContact CD1-CG 4.24Å; I1000-E1074 HydrophobicContact CG1-CG 4.38Å; I1000-E1074 PolarHBondContact N-OE1 3.23Å
1001	T	90	Very high	92.5	Very high	8 Å²	8	36.9 Å²	36.9	5%	0.049	18%	0.176	C	C	.	.	S	Bend	trans	-64.7	154.7	178.6	58.8	0	0	0	0	112.7	T996 E1074 Y1097	T996-T1001 HydrophobicContact CG2-CG2 4.37Å; T996-T1001 WeakPolarHBondContact CG2-OG1 3.46Å; T996-T1001 PolarHBondContact OG1-OG1 3.43Å; T996-T1001 VanDerWaalsContact OG1-OG1 3.12Å; T1001-E1074 HydrophobicContact CG2-CG 4.16Å; T1001-E1074 WeakPolarHBondContact CG2-O 3.16Å; T1001-E1074 PolarHBondContact N-OE1 3.03Å; T1001-E1074 VanDerWaalsContact N-OE1 3.09Å; T1001-Y1097 HydrophobicContact CG2-CE1 3.89Å
1002	A	89.9	Confident	92.5	Very high	53 Å²	53	37.7 Å²	37.7	44%	0.438	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-57.7	143.1	169	0	0	0	0	0	111.2	P1093 S1094	A1002-P1093 WeakPolarHBondContact O-CB 3.37Å; A1002-S1094 WeakPolarHBondContact CB-OG 3.27Å; A1002-S1094 PolarHBondContact N-OG 2.87Å
1003	K	92.9	Very high	92.4	Very high	12 Å²	12	37.2 Å²	37.2	5%	0.052	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-83.1	133.5	176.4	-62.3	-76	177.5	156	0	109.9	E806 W879 V993 S994 K1019	E806-K1003 IonicContact OE1-NZ 2.95Å; E806-K1003 PolarHBondContact OE1-NZ 2.92Å; W879-K1003 HydrophobicContact CZ2-CB 4.23Å; V993-K1003 HydrophobicContact CG1-CB 3.95Å; V993-K1003 HydrophobicContact CG1-CD 3.92Å; V993-K1003 HydrophobicContact CG1-CG 4.37Å; S994-K1003 WeakPolarHBondContact O-CD 3.36Å; K1003-K1019 HydrophobicContact CB-CB 4.43Å; K1003-K1019 WeakPolarHBondContact O-CB 3.49Å; K1003-K1019 PolarHBondContact O-N 2.77Å
1004	N	95	Very high	92.3	Very high	9 Å²	9	36.7 Å²	36.7	5%	0.048	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.3	172.1	-69.6	-0.4	0	0	0	109.3	V993 S994 E1016 L1017 P1018 P1093	V993-N1004 CarbonylContact C-O 3.49Å; V993-N1004 WeakPolarHBondContact CA-O 3.34Å; S994-N1004 PolarHBondContact N-O 2.87Å; S994-N1004 PolarHBondContact OG-N 3.17Å; S994-N1004 PolarHBondContact OG-O 2.74Å; N1004-E1016 HydrophobicContact CB-CG 3.68Å; N1004-E1016 WeakPolarHBondContact CB-OE1 3.32Å; N1004-E1016 PolarHBondContact ND2-OE1 3.02Å; N1004-L1017 CarbonylContact C-O 3.2Å; N1004-L1017 WeakPolarHBondContact CA-O 3.34Å; N1004-P1018 WeakPolarHBondContact OD1-CA 3.43Å; N1004-P1093 HydrophobicContact CB-CB 4.33Å; N1004-P1093 VanDerWaalsContact ND2-CA 3.35Å; N1004-P1093 WeakPolarHBondContact ND2-CA 3.44Å
1005	I	95.4	Very high	92.3	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.8	178.6	-61.6	144.3	0	0	0	107.2	W879 I881 V991 L1007 L1017 K1019 F1022	W879-I1005 HydrophobicContact CH2-CG1 4.11Å; I881-I1005 HydrophobicContact CD1-CD1 3.19Å; I881-I1005 HydrophobicContact CD1-CG1 3.95Å; V991-I1005 HydrophobicContact CG1-CG2 3.83Å; I1005-L1007 HydrophobicContact CG2-CD2 4.03Å; I1005-L1007 HydrophobicContact CG2-CG 4.27Å; I1005-L1017 PolarHBondContact N-O 2.04Å; I1005-L1017 PolarHBondContact O-N 2.97Å; I1005-K1019 HydrophobicContact CD1-CB 4.35Å; I1005-F1022 HydrophobicContact CB-CE2 4.49Å; I1005-F1022 HydrophobicContact CD1-CB 4.14Å; I1005-F1022 HydrophobicContact CD1-CD1 4.41Å; I1005-F1022 HydrophobicContact CD1-CD2 3.23Å; I1005-F1022 HydrophobicContact CD1-CE2 3.58Å; I1005-F1022 HydrophobicContact CD1-CG 3.69Å; I1005-F1022 HydrophobicContact CD1-CZ 4.3Å
1006	I	96.1	Very high	92.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.5	-178.4	-48.1	173.4	0	0	0	107.6	V991 T992 L1014 I1015 I1054 I1066 T1068 V1079 I1091	V991-I1006 WeakPolarHBondContact CA-O 3.48Å; T992-I1006 HydrophobicContact CG2-CB 4.01Å; T992-I1006 HydrophobicContact CG2-CD1 4.21Å; T992-I1006 HydrophobicContact CG2-CG1 4.48Å; T992-I1006 PolarHBondContact N-O 2.75Å; T992-I1006 PolarHBondContact O-N 2.79Å; I1006-L1014 HydrophobicContact CG2-CD2 4.36Å; I1006-I1015 WeakPolarHBondContact CA-O 3.37Å; I1006-I1054 HydrophobicContact CG2-CD1 4.09Å; I1006-I1066 HydrophobicContact CB-CD1 4.47Å; I1006-I1066 HydrophobicContact CG2-CD1 3.97Å; I1006-T1068 HydrophobicContact CD1-CG2 3.74Å; I1006-V1079 HydrophobicContact CD1-CG1 4.07Å; I1006-V1079 HydrophobicContact CD1-CG2 3.57Å; I1006-I1091 HydrophobicContact CD1-CD1 3.66Å; I1006-I1091 HydrophobicContact CG1-CD1 4.48Å
1007	L	95	Very high	92.5	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124	-178.4	-55.7	166.2	0	0	0	109.1	L982 P986 V991 I1005 L1009 L1014 I1015 L1017	L982-L1007 HydrophobicContact CD2-CD1 4.34Å; P986-L1007 HydrophobicContact CB-CB 4.46Å; P986-L1007 HydrophobicContact CB-CD2 4.33Å; V991-L1007 HydrophobicContact CB-CD2 4.06Å; V991-L1007 HydrophobicContact CG1-CD2 3.46Å; V991-L1007 VanDerWaalsContact CG1-CD2 3.46Å; V991-L1007 HydrophobicContact CG2-CD2 3.46Å; V991-L1007 VanDerWaalsContact CG2-CD2 3.46Å; I1005-L1007 HydrophobicContact CG2-CD2 4.03Å; I1005-L1007 HydrophobicContact CG2-CG 4.27Å; L1007-L1009 HydrophobicContact CB-CD2 4.24Å; L1007-L1009 PolarHBondContact O-N 3.15Å; L1007-L1014 WeakPolarHBondContact O-CA 3.41Å; L1007-I1015 HydrophobicContact CB-CG2 3.76Å; L1007-I1015 HydrophobicContact CD1-CG2 4.18Å; L1007-I1015 HydrophobicContact CG-CG2 4.41Å; L1007-I1015 PolarHBondContact N-O 2.98Å; L1007-I1015 PolarHBondContact O-N 2.87Å; L1007-L1017 HydrophobicContact CD1-CD1 3.88Å
1008	A	95.3	Very high	92.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	110.1	164.3	0	0	0	0	0	109.3	P986 R987 A990 L1014 I1063 I1066	P986-A1008 CarbonylContact C-O 3.56Å; P986-A1008 WeakPolarHBondContact CA-O 3.09Å; R987-A1008 PolarHBondContact N-O 3.21Å; A990-A1008 HydrophobicContact CB-CB 3.66Å; A990-A1008 PolarHBondContact O-N 3.21Å; A1008-L1014 HydrophobicContact CB-CD2 3.78Å; A1008-I1063 HydrophobicContact CB-CB 3.97Å; A1008-I1063 HydrophobicContact CB-CD1 3.87Å; A1008-I1063 HydrophobicContact CB-CG2 3.73Å; A1008-I1066 HydrophobicContact CB-CD1 4.02Å; A1008-I1066 HydrophobicContact CB-CG1 4.49Å
1009	L	93.3	Very high	92.9	Very high	6 Å²	6	28.8 Å²	28.8	3%	0.031	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	150.2	-178.4	-58.1	-178.4	0	0	0	111	T984 L1007 R1011 N1012 S1013 I1015 F1048	T984-L1009 HydrophobicContact CG2-CB 3.99Å; T984-L1009 HydrophobicContact CG2-CD1 4.4Å; T984-L1009 HydrophobicContact CG2-CD2 4.44Å; L1007-L1009 HydrophobicContact CB-CD2 4.24Å; L1007-L1009 PolarHBondContact O-N 3.15Å; L1009-R1011 PolarHBondContact O-N 3.03Å; L1009-R1011 VanDerWaalsContact O-N 3.09Å; L1009-N1012 PolarHBondContact O-N 2.98Å; L1009-S1013 PolarHBondContact N-O 2.86Å; L1009-I1015 HydrophobicContact CD1-CB 4.35Å; L1009-I1015 HydrophobicContact CD1-CG2 3.97Å; L1009-I1015 HydrophobicContact CD2-CG2 3.97Å; L1009-I1015 HydrophobicContact CG-CG2 3.95Å; L1009-F1048 HydrophobicContact CD1-CD2 4.19Å; L1009-F1048 HydrophobicContact CD1-CE2 4.05Å; L1009-F1048 HydrophobicContact CD2-CE2 3.83Å; L1009-F1048 HydrophobicContact CD2-CZ 4.33Å
1010	Q	90.5	Very high	93.1	Very high	94 Å²	94	31.5 Å²	31.5	44%	0.439	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.9	172	-73.2	-174.4	-8.7	0	0	113.3	P985 R987 N1012	P985-Q1010 HydrophobicContact CB-CG 4.27Å; P985-Q1010 HydrophobicContact CG-CB 4.16Å; P985-Q1010 HydrophobicContact CG-CG 3.9Å; P985-Q1010 PolarHBondContact O-N 3.11Å; R987-Q1010 HydrophobicContact CG-CG 4.05Å; Q1010-N1012 PolarHBondContact O-N 3.06Å
1011	R	88.6	Confident	93.2	Very high	194 Å²	194	30.5 Å²	30.5	73%	0.732	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	11.7	171.8	-156.5	-174.6	173.2	-167.8	-2.9	113.4	T984 L1009	T984-R1011 HydrophobicContact CG2-CB 4.33Å; L1009-R1011 PolarHBondContact O-N 3.03Å; L1009-R1011 VanDerWaalsContact O-N 3.09Å
1012	N	93.1	Very high	93.3	Very high	33 Å²	33	30.2 Å²	30.2	18%	0.176	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	38.3	178.2	-58.9	-46.7	0	0	0	113.6	L1009 Q1010 S1059 I1060 M1061 R1062	L1009-N1012 PolarHBondContact O-N 2.98Å; Q1010-N1012 PolarHBondContact O-N 3.06Å; N1012-S1059 CarbonylContact O-C 3.51Å; N1012-S1059 WeakPolarHBondContact O-CA 3.32Å; N1012-I1060 WeakPolarHBondContact CA-O 3.17Å; N1012-I1060 VanDerWaalsContact CB-O 3.24Å; N1012-I1060 WeakPolarHBondContact CB-O 3.33Å; N1012-I1060 PolarHBondContact O-N 2.68Å; N1012-M1061 HydrophobicContact CB-CE 3.5Å; N1012-M1061 HydrophobicContact CB-SD 4.38Å; N1012-M1061 WeakPolarHBondContact ND2-CE 3.34Å; N1012-M1061 PolarHBondContact ND2-SD 3.43Å; N1012-R1062 PolarHBondContact OD1-N 3.45Å
1013	S	93	Very high	93.5	Very high	15 Å²	15	28 Å²	28	11%	0.105	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	157.7	175	62.2	0	0	0	0	111	L1009 T1055	L1009-S1013 PolarHBondContact N-O 2.86Å; S1013-T1055 WeakPolarHBondContact CA-OG1 3.49Å; S1013-T1055 WeakPolarHBondContact CB-OG1 3.29Å
1014	L	94.8	Very high	93.5	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.9	174.2	-67.5	162.5	0	0	0	109.5	I1006 L1007 A1008 I1053 I1054 T1055 I1063 I1066 A1081 F1087	I1006-L1014 HydrophobicContact CG2-CD2 4.36Å; L1007-L1014 WeakPolarHBondContact O-CA 3.41Å; A1008-L1014 HydrophobicContact CB-CD2 3.78Å; L1014-I1053 CarbonylContact O-C 3.58Å; L1014-I1053 VanDerWaalsContact O-CA 3.29Å; L1014-I1053 WeakPolarHBondContact O-CA 3.3Å; L1014-I1054 HydrophobicContact CB-CD1 3.69Å; L1014-I1054 HydrophobicContact CB-CG1 3.39Å; L1014-I1054 HydrophobicContact CD1-CD1 4.14Å; L1014-I1054 HydrophobicContact CD1-CG1 4.33Å; L1014-I1054 HydrophobicContact CG-CD1 4.49Å; L1014-I1054 HydrophobicContact CG-CG1 4.49Å; L1014-I1054 PolarHBondContact O-N 2.81Å; L1014-T1055 HydrophobicContact CB-CG2 3.79Å; L1014-T1055 HydrophobicContact CD1-CG2 3.67Å; L1014-T1055 HydrophobicContact CG-CG2 3.88Å; L1014-T1055 PolarHBondContact N-OG1 3.17Å; L1014-I1063 HydrophobicContact CD1-CD1 4.42Å; L1014-I1063 HydrophobicContact CD2-CD1 3.85Å; L1014-I1063 HydrophobicContact CG-CD1 3.86Å; L1014-I1066 HydrophobicContact CD2-CD1 3.49Å; L1014-I1066 VanDerWaalsContact CD2-CD1 3.49Å; L1014-I1066 HydrophobicContact CD2-CG1 3.96Å; L1014-A1081 HydrophobicContact CD1-CB 3.54Å; L1014-A1081 HydrophobicContact CD2-CB 4.18Å; L1014-A1081 HydrophobicContact CG-CB 4.42Å; L1014-F1087 HydrophobicContact CD1-CD1 3.75Å; L1014-F1087 HydrophobicContact CD1-CE1 4.33Å
1015	I	94.3	Very high	93.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.7	175.5	-169.5	173.3	0	0	0	110.3	I1006 L1007 L1009 L1017 F1048 A1052	I1006-I1015 WeakPolarHBondContact CA-O 3.37Å; L1007-I1015 HydrophobicContact CB-CG2 3.76Å; L1007-I1015 HydrophobicContact CD1-CG2 4.18Å; L1007-I1015 HydrophobicContact CG-CG2 4.41Å; L1007-I1015 PolarHBondContact N-O 2.98Å; L1007-I1015 PolarHBondContact O-N 2.87Å; L1009-I1015 HydrophobicContact CD1-CB 4.35Å; L1009-I1015 HydrophobicContact CD1-CG2 3.97Å; L1009-I1015 HydrophobicContact CD2-CG2 3.97Å; L1009-I1015 HydrophobicContact CG-CG2 3.95Å; I1015-L1017 HydrophobicContact CD1-CD2 3.97Å; I1015-L1017 HydrophobicContact CD1-CG 4.33Å; I1015-L1017 HydrophobicContact CG1-CD2 4.17Å; I1015-L1017 HydrophobicContact CG1-CG 4.26Å; I1015-F1048 HydrophobicContact CD1-CB 3.92Å; I1015-F1048 HydrophobicContact CD1-CD1 4.04Å; I1015-F1048 HydrophobicContact CD1-CD2 4.19Å; I1015-F1048 HydrophobicContact CD1-CG 3.8Å; I1015-A1052 WeakPolarHBondContact CA-O 3.37Å; I1015-A1052 HydrophobicContact CD1-CB 4.16Å; I1015-A1052 HydrophobicContact CG1-CB 3.8Å; I1015-A1052 WeakPolarHBondContact CG1-O 3.48Å
1016	E	94.2	Very high	93.2	Very high	30 Å²	30	29.7 Å²	29.7	14%	0.14	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.3	174.7	-177.8	-179	-173.2	0	0	109.7	N1004 A1052 I1054	N1004-E1016 HydrophobicContact CB-CG 3.68Å; N1004-E1016 WeakPolarHBondContact CB-OE1 3.32Å; N1004-E1016 PolarHBondContact ND2-OE1 3.02Å; E1016-A1052 PolarHBondContact N-O 2.86Å; E1016-A1052 WeakPolarHBondContact O-CB 3.36Å; E1016-I1054 HydrophobicContact CB-CG2 3.75Å
1017	L	94	Very high	92.9	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.016	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.2	179.4	-67	179.2	0	0	0	111.4	N1004 I1005 L1007 I1015 F1021 F1022 F1048	N1004-L1017 CarbonylContact C-O 3.2Å; N1004-L1017 WeakPolarHBondContact CA-O 3.34Å; I1005-L1017 PolarHBondContact N-O 2.04Å; I1005-L1017 PolarHBondContact O-N 2.97Å; L1007-L1017 HydrophobicContact CD1-CD1 3.88Å; I1015-L1017 HydrophobicContact CD1-CD2 3.97Å; I1015-L1017 HydrophobicContact CD1-CG 4.33Å; I1015-L1017 HydrophobicContact CG1-CD2 4.17Å; I1015-L1017 HydrophobicContact CG1-CG 4.26Å; L1017-F1021 HydrophobicContact CD2-CD2 4.48Å; L1017-F1022 HydrophobicContact CB-CE2 3.85Å; L1017-F1022 HydrophobicContact CD1-CE2 4.02Å; L1017-F1022 HydrophobicContact CD1-CZ 4.03Å; L1017-F1048 HydrophobicContact CD1-CD1 4.27Å; L1017-F1048 HydrophobicContact CD1-CE1 3.86Å
1018	P	94.4	Very high	92.6	Very high	44 Å²	44	38 Å²	38	29%	0.286	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	137.5	172.7	-27.2	34.5	0	0	0	113.7	N1004 T1020 F1021	N1004-P1018 WeakPolarHBondContact OD1-CA 3.43Å; P1018-T1020 WeakPolarHBondContact CB-OG1 3.46Å; P1018-T1020 PolarHBondContact O-N 3.25Å; P1018-T1020 VanDerWaalsContact O-N 3.09Å; P1018-F1021 HydrophobicContact CB-CD2 4.37Å; P1018-F1021 HydrophobicContact CG-CD2 4.35Å; P1018-F1021 HydrophobicContact CG-CE2 4.17Å; P1018-F1021 PolarHBondContact O-N 3.36Å
1019	K	93.5	Very high	92.3	Very high	22 Å²	22	44.5 Å²	44.5	10%	0.096	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-60.4	-20	175.6	177	-95.2	164.3	-91.6	0	113.2	W879 E898 K1003 I1005 F1021 F1022 D1023	W879-K1019 HydrophobicContact CZ2-CG 4.31Å; E898-K1019 WeakPolarHBondContact OE1-CE 3.01Å; E898-K1019 IonicContact OE1-NZ 3.27Å; E898-K1019 PolarHBondContact OE1-NZ 2.88Å; K1003-K1019 HydrophobicContact CB-CB 4.43Å; K1003-K1019 WeakPolarHBondContact O-CB 3.49Å; K1003-K1019 PolarHBondContact O-N 2.77Å; I1005-K1019 HydrophobicContact CD1-CB 4.35Å; K1019-F1021 PolarHBondContact O-N 2.93Å; K1019-F1022 CarbonylContact O-C 3.56Å; K1019-F1022 WeakPolarHBondContact O-CA 3.49Å; K1019-F1022 PolarHBondContact O-N 2.85Å; K1019-D1023 IonicContact NZ-OD2 3.83Å; K1019-D1023 PolarHBondContact O-N 3.08Å
1020	T	91.3	Very high	91.9	Very high	63 Å²	63	47.1 Å²	47.1	39%	0.387	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-62.5	-29.4	174.5	54.7	0	0	0	0	112.6	P1018 F1022 D1023	P1018-T1020 WeakPolarHBondContact CB-OG1 3.46Å; P1018-T1020 PolarHBondContact O-N 3.25Å; P1018-T1020 VanDerWaalsContact O-N 3.09Å; T1020-F1022 PolarHBondContact O-N 3.48Å; T1020-D1023 WeakPolarHBondContact O-CB 3.41Å; T1020-D1023 PolarHBondContact O-N 3.23Å
1021	F	92	Very high	91.8	Very high	49 Å²	49	45.7 Å²	45.7	22%	0.215	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-68.5	-22.9	172.6	-68.9	-42.4	0	0	0	112.9	L1017 P1018 K1019 R1026 H1040 L1046 P1047	L1017-F1021 HydrophobicContact CD2-CD2 4.48Å; P1018-F1021 HydrophobicContact CB-CD2 4.37Å; P1018-F1021 HydrophobicContact CG-CD2 4.35Å; P1018-F1021 HydrophobicContact CG-CE2 4.17Å; P1018-F1021 PolarHBondContact O-N 3.36Å; K1019-F1021 PolarHBondContact O-N 2.93Å; F1021-R1026 PolarHBondContact O-NH1 2.73Å; F1021-H1040 AromaticContact CD1-CD2 3.98Å; F1021-L1046 HydrophobicContact CB-CD2 3.77Å; F1021-P1047 HydrophobicContact CE1-CG 4.21Å; F1021-P1047 HydrophobicContact CE2-CG 4.3Å; F1021-P1047 HydrophobicContact CZ-CG 4.08Å
1022	F	93.5	Very high	91.7	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.009	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-99	15.3	-179.9	-67.9	-88.5	0	0	0	112.2	I881 A894 V896 Y980 I1005 L1017 K1019 T1020 P1024 L1046	I881-F1022 HydrophobicContact CD1-CB 4.03Å; I881-F1022 HydrophobicContact CD1-CD1 4.28Å; I881-F1022 HydrophobicContact CD1-CG 4.13Å; A894-F1022 HydrophobicContact CB-CE1 4.02Å; V896-F1022 VanDerWaalsContact CG1-O 3.26Å; V896-F1022 WeakPolarHBondContact CG1-O 3.28Å; V896-F1022 HydrophobicContact CG2-CB 3.68Å; V896-F1022 HydrophobicContact CG2-CD1 3.74Å; V896-F1022 HydrophobicContact CG2-CG 4.19Å; V896-F1022 WeakPolarHBondContact CG2-O 3.48Å; Y980-F1022 HydrophobicContact CD2-CD1 4.28Å; I1005-F1022 HydrophobicContact CB-CE2 4.49Å; I1005-F1022 HydrophobicContact CD1-CB 4.14Å; I1005-F1022 HydrophobicContact CD1-CD1 4.41Å; I1005-F1022 HydrophobicContact CD1-CD2 3.23Å; I1005-F1022 HydrophobicContact CD1-CE2 3.58Å; I1005-F1022 HydrophobicContact CD1-CG 3.69Å; I1005-F1022 HydrophobicContact CD1-CZ 4.3Å; L1017-F1022 HydrophobicContact CB-CE2 3.85Å; L1017-F1022 HydrophobicContact CD1-CE2 4.02Å; L1017-F1022 HydrophobicContact CD1-CZ 4.03Å; K1019-F1022 CarbonylContact O-C 3.56Å; K1019-F1022 WeakPolarHBondContact O-CA 3.49Å; K1019-F1022 PolarHBondContact O-N 2.85Å; T1020-F1022 PolarHBondContact O-N 3.48Å; F1022-P1024 WeakPolarHBondContact O-CD 3.42Å; F1022-L1046 HydrophobicContact CD1-CD1 4.08Å; F1022-L1046 HydrophobicContact CE1-CD1 3.32Å; F1022-L1046 HydrophobicContact CE2-CD1 4.33Å; F1022-L1046 HydrophobicContact CZ-CD1 3.49Å; F1022-L1046 VanDerWaalsContact CZ-CD1 3.49Å
1023	D	93.3	Very high	91.5	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.032	23%	0.232	C	C	.	.			trans	-72.5	117.2	-178.9	-162.5	-53.5	0	0	0	111.9	R813 Y980 K1019 T1020 R1025 R1026	R813-D1023 IonicContact CZ-OD2 3.25Å; R813-D1023 VanDerWaalsContact CZ-OD2 3.23Å; R813-D1023 IonicContact NH1-OD1 3.26Å; R813-D1023 IonicContact NH1-OD2 2.77Å; R813-D1023 PolarHBondContact NH1-OD2 2.86Å; R813-D1023 IonicContact NH2-OD2 2.7Å; R813-D1023 PolarHBondContact NH2-OD2 2.76Å; Y980-D1023 PolarHBondContact OH-O 2.68Å; K1019-D1023 IonicContact NZ-OD2 3.83Å; K1019-D1023 PolarHBondContact O-N 3.08Å; T1020-D1023 WeakPolarHBondContact O-CB 3.41Å; T1020-D1023 PolarHBondContact O-N 3.23Å; D1023-R1025 PolarHBondContact O-N 3.38Å; D1023-R1025 VanDerWaalsContact OD1-CB 3.28Å; D1023-R1025 WeakPolarHBondContact OD1-CB 3.38Å; D1023-R1025 WeakPolarHBondContact OD1-CG 3.46Å; D1023-R1025 PolarHBondContact OD1-N 2.72Å; D1023-R1025 IonicContact OD1-NE 2.68Å; D1023-R1025 PolarHBondContact OD1-NE 2.8Å; D1023-R1025 VanDerWaalsContact OD1-NE 3.17Å; D1023-R1025 IonicContact OD2-NE 2.64Å; D1023-R1025 IonicContact OD2-NH2 4Å; D1023-R1026 HydrophobicContact CB-CG 4.17Å; D1023-R1026 WeakPolarHBondContact O-CB 3.47Å; D1023-R1026 WeakPolarHBondContact O-CG 3.39Å; D1023-R1026 PolarHBondContact O-N 2.85Å; D1023-R1026 VanDerWaalsContact O-N 3.08Å
1024	P	93.9	Very high	91.3	Very high	12 Å²	12	43.3 Å²	43.3	8%	0.078	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-12.1	-174.9	30.4	-36.5	0	0	0	113.7	E898 L976 Q978 F1022 R1026	E898-P1024 HydrophobicContact CB-CG 3.96Å; E898-P1024 HydrophobicContact CG-CG 3.61Å; E898-P1024 WeakPolarHBondContact OE1-CD 3.39Å; L976-P1024 HydrophobicContact CB-CB 4.14Å; L976-P1024 HydrophobicContact CB-CG 3.79Å; Q978-P1024 VanDerWaalsContact CB-CA 3.49Å; Q978-P1024 HydrophobicContact CB-CB 3.68Å; F1022-P1024 WeakPolarHBondContact O-CD 3.42Å; P1024-R1026 VanDerWaalsContact C-N 3.27Å; P1024-R1026 PolarHBondContact O-N 2.78Å
1025	R	92	Very high	90.9	Very high	34 Å²	34	49.2 Å²	49.2	13%	0.128	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-4	177.1	-56.1	176.5	-56.4	143.9	16.9	113.1	R813 L976 D1023 S1027 E1037	R813-R1025 VanDerWaalsContact CD-NH2 3.31Å; R813-R1025 VanDerWaalsContact NH1-NE 3.18Å; L976-R1025 HydrophobicContact CD1-CG 3.59Å; D1023-R1025 PolarHBondContact O-N 3.38Å; D1023-R1025 VanDerWaalsContact OD1-CB 3.28Å; D1023-R1025 WeakPolarHBondContact OD1-CB 3.38Å; D1023-R1025 WeakPolarHBondContact OD1-CG 3.46Å; D1023-R1025 PolarHBondContact OD1-N 2.72Å; D1023-R1025 IonicContact OD1-NE 2.68Å; D1023-R1025 PolarHBondContact OD1-NE 2.8Å; D1023-R1025 VanDerWaalsContact OD1-NE 3.17Å; D1023-R1025 IonicContact OD2-NE 2.64Å; D1023-R1025 IonicContact OD2-NH2 4Å; R1025-S1027 PolarHBondContact O-N 2.91Å; R1025-S1027 VanDerWaalsContact O-N 3.09Å; R1025-E1037 IonicContact CZ-OE2 2.65Å; R1025-E1037 VanDerWaalsContact CZ-OE2 3.25Å; R1025-E1037 IonicContact NH1-OE1 2.76Å; R1025-E1037 IonicContact NH1-OE2 3.21Å; R1025-E1037 PolarHBondContact NH1-OE2 2.75Å; R1025-E1037 IonicContact NH2-OE2 2.69Å; R1025-E1037 PolarHBondContact NH2-OE2 2.87Å
1026	R	92.2	Very high	90.6	Very high	12 Å²	12	55.7 Å²	55.7	5%	0.045	29%	0.294	C	S	.	.			trans	-60	114.5	172	-64.6	178.4	62.5	-172.3	3.7	108.8	Q978 F1021 D1023 P1024 V1039 H1040 P1041 Y1042	Q978-R1026 PolarHBondContact NE2-O 2.9Å; F1021-R1026 PolarHBondContact O-NH1 2.73Å; D1023-R1026 HydrophobicContact CB-CG 4.17Å; D1023-R1026 WeakPolarHBondContact O-CB 3.47Å; D1023-R1026 WeakPolarHBondContact O-CG 3.39Å; D1023-R1026 PolarHBondContact O-N 2.85Å; D1023-R1026 VanDerWaalsContact O-N 3.08Å; P1024-R1026 VanDerWaalsContact C-N 3.27Å; P1024-R1026 PolarHBondContact O-N 2.78Å; R1026-V1039 HydrophobicContact CB-CG1 4.46Å; R1026-V1039 HydrophobicContact CG-CG1 3.91Å; R1026-H1040 VanDerWaalsContact CB-O 3.31Å; R1026-H1040 WeakPolarHBondContact CB-O 3.39Å; R1026-H1040 WeakPolarHBondContact CG-O 3.34Å; R1026-H1040 PolarHBondContact NE-O 2.86Å; R1026-P1041 PolarHBondContact NE-O 2.87Å; R1026-P1041 PolarHBondContact NH2-O 3.05Å; R1026-Y1042 HydrophobicContact CB-CD2 4.35Å; R1026-Y1042 WeakPolarHBondContact O-CB 3.27Å
1027	S	88.7	Confident	90.2	Very high	44 Å²	44	56.8 Å²	56.8	31%	0.308	30%	0.3	S	S	.	.			trans	-111.4	157.2	178.9	-177.3	0	0	0	0	111.2	R1025 D1029 Y1042	R1025-S1027 PolarHBondContact O-N 2.91Å; R1025-S1027 VanDerWaalsContact O-N 3.09Å; S1027-D1029 PolarHBondContact OG-N 2.76Å; S1027-D1029 PolarHBondContact OG-O 3.35Å; S1027-Y1042 VanDerWaalsContact C-CB 3.43Å; S1027-Y1042 PolarHBondContact O-N 2.98Å
1028	L	88.6	Confident	89.8	Confident	134 Å²	134	59 Å²	59	70%	0.702	32%	0.323	S	S	*	.	S	Bend	trans	-69.6	-40.3	168.7	-72.3	170.2	0	0	0	110.6	M1030 Y1042	L1028-M1030 PolarHBondContact O-N 3.32Å; L1028-Y1042 HydrophobicContact CD2-CD1 4.03Å; L1028-Y1042 HydrophobicContact CG-CD1 4.08Å
1029	D	88.3	Confident	89.6	Confident	136 Å²	136	57.7 Å²	57.7	73%	0.727	31%	0.314	S	S	*	.	S	Bend	trans	-88.1	93.7	175.6	-61.8	-33	0	0	0	108.6	S1027 T1031	S1027-D1029 PolarHBondContact OG-N 2.76Å; S1027-D1029 PolarHBondContact OG-O 3.35Å; D1029-T1031 PolarHBondContact O-N 2.84Å
1030	M	85.1	Confident	89.4	Confident	62 Å²	62	60.1 Å²	60.1	31%	0.305	33%	0.326	S	S	.	.			trans	-77.9	114.7	179.2	-172	60.7	60.4	0	0	110.3	L1028 L1034 M1035 V1039 H1040 P1041	L1028-M1030 PolarHBondContact O-N 3.32Å; M1030-L1034 HydrophobicContact SD-CB 3.54Å; M1030-L1034 VanDerWaalsContact SD-CB 3.54Å; M1030-L1034 HydrophobicContact SD-CD1 4.45Å; M1030-M1035 HydrophobicContact CG-CB 4.28Å; M1030-V1039 VanDerWaalsContact CE-O 3.25Å; M1030-V1039 WeakPolarHBondContact CE-O 3.32Å; M1030-H1040 VanDerWaalsContact CE-C 3.41Å; M1030-P1041 HydrophobicContact CE-CB 3.94Å
1031	T	88.4	Confident	89.4	Confident	64 Å²	64	61 Å²	61	39%	0.393	33%	0.332	S	S	.	.			trans	-83.2	162.8	173.6	77.4	0	0	0	0	111.2	D1029 E1033 L1034 M1035	D1029-T1031 PolarHBondContact O-N 2.84Å; T1031-E1033 VanDerWaalsContact C-N 3.26Å; T1031-E1033 WeakPolarHBondContact CB-OE2 3.35Å; T1031-E1033 PolarHBondContact O-N 2.62Å; T1031-E1033 PolarHBondContact OG1-OE2 2.76Å; T1031-L1034 PolarHBondContact O-N 2.99Å; T1031-L1034 PolarHBondContact OG1-N 2.88Å; T1031-M1035 PolarHBondContact O-N 3.49Å; T1031-M1035 VanDerWaalsContact O-N 3.1Å
1032	S	88.1	Confident	89.4	Confident	65 Å²	65	61.2 Å²	61.2	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-61	-38.4	178.4	-167.1	0	0	0	0	111.4	M1035 E1036	S1032-M1035 WeakPolarHBondContact O-CB 3.34Å; S1032-M1035 PolarHBondContact O-N 2.76Å; S1032-E1036 WeakPolarHBondContact O-CG 3.28Å; S1032-E1036 PolarHBondContact O-N 2.97Å
1033	E	88	Confident	89.3	Confident	94 Å²	94	63 Å²	63	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-66.3	-43.1	-178.7	-55.2	75.9	-163.3	0	0	111.3	T1031 M1035 E1036 E1037	T1031-E1033 VanDerWaalsContact C-N 3.26Å; T1031-E1033 WeakPolarHBondContact CB-OE2 3.35Å; T1031-E1033 PolarHBondContact O-N 2.62Å; T1031-E1033 PolarHBondContact OG1-OE2 2.76Å; E1033-M1035 VanDerWaalsContact C-N 3.31Å; E1033-M1035 PolarHBondContact O-N 2.82Å; E1033-E1036 PolarHBondContact O-N 3.1Å; E1033-E1037 PolarHBondContact O-N 2.94Å; E1033-E1037 VanDerWaalsContact O-N 3.17Å
1034	L	88.2	Confident	89.2	Confident	32 Å²	32	65.4 Å²	65.4	17%	0.168	36%	0.363	C	S	.	.	H	α-helix	trans	-66.4	-34.5	175.9	-70.8	175.4	0	0	0	112.1	M1030 T1031 E1037 G1038 V1039	M1030-L1034 HydrophobicContact SD-CB 3.54Å; M1030-L1034 VanDerWaalsContact SD-CB 3.54Å; M1030-L1034 HydrophobicContact SD-CD1 4.45Å; T1031-L1034 PolarHBondContact O-N 2.99Å; T1031-L1034 PolarHBondContact OG1-N 2.88Å; L1034-E1037 PolarHBondContact O-N 2.93Å; L1034-G1038 PolarHBondContact O-N 2.99Å; L1034-V1039 HydrophobicContact CB-CB 4.35Å; L1034-V1039 HydrophobicContact CD2-CG2 4.23Å; L1034-V1039 WeakPolarHBondContact O-CB 3.35Å; L1034-V1039 PolarHBondContact O-N 3.12Å
1035	M	87	Confident	89.2	Confident	124 Å²	124	67.9 Å²	67.9	61%	0.611	38%	0.378	S	S	*	.	H	α-helix	trans	-68.1	-39.7	175.6	-172.7	178.1	68	0	0	111.6	M1030 T1031 S1032 E1033 E1037 G1038	M1030-M1035 HydrophobicContact CG-CB 4.28Å; T1031-M1035 PolarHBondContact O-N 3.49Å; T1031-M1035 VanDerWaalsContact O-N 3.1Å; S1032-M1035 WeakPolarHBondContact O-CB 3.34Å; S1032-M1035 PolarHBondContact O-N 2.76Å; E1033-M1035 VanDerWaalsContact C-N 3.31Å; E1033-M1035 PolarHBondContact O-N 2.82Å; M1035-E1037 VanDerWaalsContact C-N 3.27Å; M1035-E1037 PolarHBondContact O-N 2.85Å; M1035-G1038 PolarHBondContact O-N 3.01Å
1036	E	87.8	Confident	89.1	Confident	138 Å²	138	66.2 Å²	66.2	65%	0.645	37%	0.372	S	S	*	.	H	α-helix	trans	-62.8	-32.3	174	-75	179.2	-168.6	0	0	112.6	S1032 E1033 G1038	S1032-E1036 WeakPolarHBondContact O-CG 3.28Å; S1032-E1036 PolarHBondContact O-N 2.97Å; E1033-E1036 PolarHBondContact O-N 3.1Å; E1036-G1038 PolarHBondContact O-N 3.4Å
1037	E	86.1	Confident	88.8	Confident	53 Å²	53	68.8 Å²	68.8	25%	0.248	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-12.2	172.1	-70.9	179.1	-140.9	0	0	114	L815 G816 R1025 E1033 L1034 M1035 V1039	L815-E1037 WeakPolarHBondContact CA-OE1 3.47Å; L815-E1037 WeakPolarHBondContact CB-OE1 3.39Å; L815-E1037 WeakPolarHBondContact CD2-OE1 3.23Å; G816-E1037 PolarHBondContact N-OE1 2.99Å; R1025-E1037 IonicContact CZ-OE2 2.65Å; R1025-E1037 VanDerWaalsContact CZ-OE2 3.25Å; R1025-E1037 IonicContact NH1-OE1 2.76Å; R1025-E1037 IonicContact NH1-OE2 3.21Å; R1025-E1037 PolarHBondContact NH1-OE2 2.75Å; R1025-E1037 IonicContact NH2-OE2 2.69Å; R1025-E1037 PolarHBondContact NH2-OE2 2.87Å; E1033-E1037 PolarHBondContact O-N 2.94Å; E1033-E1037 VanDerWaalsContact O-N 3.17Å; L1034-E1037 PolarHBondContact O-N 2.93Å; M1035-E1037 VanDerWaalsContact C-N 3.27Å; M1035-E1037 PolarHBondContact O-N 2.85Å; E1037-V1039 HydrophobicContact CB-CG2 4.02Å
1038	G	86.2	Confident	88.6	Confident	50 Å²	50	68.9 Å²	68.9	52%	0.515	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	24.1	-174.3	0	0	0	0	0	114.1	L1034 M1035 E1036	L1034-G1038 PolarHBondContact O-N 2.99Å; M1035-G1038 PolarHBondContact O-N 3.01Å; E1036-G1038 PolarHBondContact O-N 3.4Å
1039	V	89.7	Confident	88.5	Confident	16 Å²	16	65 Å²	65	10%	0.097	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-72	129.4	176	-180	0	0	0	0	110	R1026 M1030 L1034 E1037	R1026-V1039 HydrophobicContact CB-CG1 4.46Å; R1026-V1039 HydrophobicContact CG-CG1 3.91Å; M1030-V1039 VanDerWaalsContact CE-O 3.25Å; M1030-V1039 WeakPolarHBondContact CE-O 3.32Å; L1034-V1039 HydrophobicContact CB-CB 4.35Å; L1034-V1039 HydrophobicContact CD2-CG2 4.23Å; L1034-V1039 WeakPolarHBondContact O-CB 3.35Å; L1034-V1039 PolarHBondContact O-N 3.12Å; E1037-V1039 HydrophobicContact CB-CG2 4.02Å
1040	H	88.4	Confident	88.4	Confident	73 Å²	73	64.7 Å²	64.7	34%	0.338	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-72.6	145.6	177.6	-62.8	-62.9	0	0	0	111.9	F1021 R1026 M1030	F1021-H1040 AromaticContact CD1-CD2 3.98Å; R1026-H1040 VanDerWaalsContact CB-O 3.31Å; R1026-H1040 WeakPolarHBondContact CB-O 3.39Å; R1026-H1040 WeakPolarHBondContact CG-O 3.34Å; R1026-H1040 PolarHBondContact NE-O 2.86Å; M1030-H1040 VanDerWaalsContact CE-C 3.41Å
1041	P	91.3	Very high	88.4	Confident	80 Å²	80	70.3 Å²	70.3	52%	0.519	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-59.5	148.2	171.9	25.8	-33.9	0	0	0	110.7	R1026 M1030 A1043	R1026-P1041 PolarHBondContact NE-O 2.87Å; R1026-P1041 PolarHBondContact NH2-O 3.05Å; M1030-P1041 HydrophobicContact CE-CB 3.94Å; P1041-A1043 PolarHBondContact O-N 2.87Å; P1041-A1043 VanDerWaalsContact O-N 3.14Å
1042	Y	93.1	Very high	88.4	Confident	55 Å²	55	68.3 Å²	68.3	22%	0.216	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-63.7	118.2	179.7	-176.9	-108.1	0	0	0	110.3	Q978 S979 Y980 R1026 S1027 L1028 P1044	Q978-Y1042 HydrophobicContact CG-CD2 4.12Å; Q978-Y1042 HydrophobicContact CG-CE2 3.61Å; S979-Y1042 PolarHBondContact O-OH 2.94Å; Y980-Y1042 HydrophobicContact CD1-CE2 4.1Å; Y980-Y1042 AromaticContact CE1-CD2 3.92Å; Y980-Y1042 HydrophobicContact CE1-CD2 3.92Å; Y980-Y1042 AromaticContact CE1-CE2 3.67Å; Y980-Y1042 HydrophobicContact CE1-CE2 3.67Å; R1026-Y1042 HydrophobicContact CB-CD2 4.35Å; R1026-Y1042 WeakPolarHBondContact O-CB 3.27Å; S1027-Y1042 VanDerWaalsContact C-CB 3.43Å; S1027-Y1042 PolarHBondContact O-N 2.98Å; L1028-Y1042 HydrophobicContact CD2-CD1 4.03Å; L1028-Y1042 HydrophobicContact CG-CD1 4.08Å; Y1042-P1044 HydrophobicContact CE1-CB 4.12Å
1043	A	91.5	Very high	88.6	Confident	39 Å²	39	66.4 Å²	66.4	32%	0.322	37%	0.367	S	S	.	.			trans	-123.4	119.9	168.9	0	0	0	0	0	106.6	P1041 V1045	P1041-A1043 PolarHBondContact O-N 2.87Å; P1041-A1043 VanDerWaalsContact O-N 3.14Å; A1043-V1045 VanDerWaalsContact C-N 3.28Å; A1043-V1045 PolarHBondContact O-N 2.86Å
1044	P	90.7	Very high	88.7	Confident	57 Å²	57	62.6 Å²	62.6	37%	0.37	35%	0.35	S	S	.	.	S	Bend	trans	-65.9	-34.4	-174.8	25.7	-34.2	0	0	0	111.4	Y980 I981 Y1042	Y980-P1044 CarbonylContact C-O 3.59Å; Y980-P1044 WeakPolarHBondContact CA-O 3.47Å; I981-P1044 WeakPolarHBondContact CB-O 3.35Å; I981-P1044 HydrophobicContact CD1-CB 3.92Å; I981-P1044 HydrophobicContact CG1-CB 4.47Å; I981-P1044 PolarHBondContact N-O 3Å; Y1042-P1044 HydrophobicContact CE1-CB 4.12Å
1045	V	93.5	Very high	88.8	Confident	63 Å²	63	61.1 Å²	61.1	38%	0.382	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-89.6	125.4	176.9	-178.8	0	0	0	0	109.9	I981 N983 A1043	I981-V1045 HydrophobicContact CB-CG2 4.24Å; I981-V1045 HydrophobicContact CD1-CG2 4.17Å; I981-V1045 HydrophobicContact CG2-CG2 4.43Å; N983-V1045 WeakPolarHBondContact OD1-CG1 3.46Å; A1043-V1045 VanDerWaalsContact C-N 3.28Å; A1043-V1045 PolarHBondContact O-N 2.86Å
1046	L	91.2	Very high	88.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-75.8	134	176.2	-72.5	163.8	0	0	0	110.8	Y980 I981 L982 F1021 F1022 F1048	Y980-L1046 HydrophobicContact CD1-CD2 4.19Å; Y980-L1046 HydrophobicContact CD1-CG 4.4Å; Y980-L1046 HydrophobicContact CG-CD1 4.2Å; Y980-L1046 HydrophobicContact CG-CD2 4.28Å; Y980-L1046 HydrophobicContact CG-CG 4.23Å; I981-L1046 PolarHBondContact O-N 3.09Å; L982-L1046 HydrophobicContact CD2-CB 4.45Å; L982-L1046 HydrophobicContact CD2-CD1 3.52Å; F1021-L1046 HydrophobicContact CB-CD2 3.77Å; F1022-L1046 HydrophobicContact CD1-CD1 4.08Å; F1022-L1046 HydrophobicContact CE1-CD1 3.32Å; F1022-L1046 HydrophobicContact CE2-CD1 4.33Å; F1022-L1046 HydrophobicContact CZ-CD1 3.49Å; F1022-L1046 VanDerWaalsContact CZ-CD1 3.49Å; L1046-F1048 HydrophobicContact CB-CE1 4.22Å; L1046-F1048 PolarHBondContact O-N 2.88Å
1047	P	84.4	Confident	88.8	Confident	66 Å²	66	60.1 Å²	60.1	43%	0.429	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-73	117.6	-179.4	29.5	-33.2	0	0	0	110.2	F1021	F1021-P1047 HydrophobicContact CE1-CG 4.21Å; F1021-P1047 HydrophobicContact CE2-CG 4.3Å; F1021-P1047 HydrophobicContact CZ-CG 4.08Å
1048	F	85.1	Confident	88.9	Confident	46 Å²	46	59.1 Å²	59.1	20%	0.202	33%	0.332	C	S	.	.			trans	-97.9	95.7	170.9	-74.5	16.4	0	0	0	107.3	L982 L1009 I1015 L1017 L1046	L982-F1048 HydrophobicContact CB-CZ 4.18Å; L982-F1048 HydrophobicContact CD2-CE1 3.86Å; L982-F1048 HydrophobicContact CD2-CZ 3.76Å; L1009-F1048 HydrophobicContact CD1-CD2 4.19Å; L1009-F1048 HydrophobicContact CD1-CE2 4.05Å; L1009-F1048 HydrophobicContact CD2-CE2 3.83Å; L1009-F1048 HydrophobicContact CD2-CZ 4.33Å; I1015-F1048 HydrophobicContact CD1-CB 3.92Å; I1015-F1048 HydrophobicContact CD1-CD1 4.04Å; I1015-F1048 HydrophobicContact CD1-CD2 4.19Å; I1015-F1048 HydrophobicContact CD1-CG 3.8Å; L1017-F1048 HydrophobicContact CD1-CD1 4.27Å; L1017-F1048 HydrophobicContact CD1-CE1 3.86Å; L1046-F1048 HydrophobicContact CB-CE1 4.22Å; L1046-F1048 PolarHBondContact O-N 2.88Å
1049	S	87	Confident	89.1	Confident	53 Å²	53	60 Å²	60	37%	0.371	33%	0.33	S	S	.	.			trans	-81	138	172.5	-178.9	0	0	0	0	109.3	Q1051 A1052	S1049-Q1051 PolarHBondContact O-N 2.85Å; S1049-Q1051 PolarHBondContact OG-N 2.75Å; S1049-A1052 WeakPolarHBondContact O-CB 3.44Å; S1049-A1052 PolarHBondContact O-N 2.87Å
1050	D	84.9	Confident	89.4	Confident	129 Å²	129	59.2 Å²	59.2	69%	0.69	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-61.1	-25	172.9	-65.6	-31.9	0	0	0	111.6	A1052 I1053	D1050-A1052 VanDerWaalsContact C-N 3.25Å; D1050-A1052 PolarHBondContact O-N 3.25Å; D1050-I1053 WeakPolarHBondContact O-CB 3.38Å; D1050-I1053 PolarHBondContact O-N 2.82Å
1051	Q	85.7	Confident	89.7	Confident	179 Å²	179	57.1 Å²	57.1	84%	0.836	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-70.1	-20.1	174.5	-64.3	177	-22.4	0	0	113.5	S1049 I1053	S1049-Q1051 PolarHBondContact O-N 2.85Å; S1049-Q1051 PolarHBondContact OG-N 2.75Å; Q1051-I1053 VanDerWaalsContact C-N 3.3Å
1052	A	89.3	Confident	89.7	Confident	23 Å²	23	54.3 Å²	54.3	19%	0.19	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-85.6	-5.8	177.3	0	0	0	0	0	112.4	I1015 E1016 S1049 D1050 I1054	I1015-A1052 WeakPolarHBondContact CA-O 3.37Å; I1015-A1052 HydrophobicContact CD1-CB 4.16Å; I1015-A1052 HydrophobicContact CG1-CB 3.8Å; I1015-A1052 WeakPolarHBondContact CG1-O 3.48Å; E1016-A1052 PolarHBondContact N-O 2.86Å; E1016-A1052 WeakPolarHBondContact O-CB 3.36Å; S1049-A1052 WeakPolarHBondContact O-CB 3.44Å; S1049-A1052 PolarHBondContact O-N 2.87Å; D1050-A1052 VanDerWaalsContact C-N 3.25Å; D1050-A1052 PolarHBondContact O-N 3.25Å; A1052-I1054 PolarHBondContact O-N 2.78Å
1053	I	91.8	Very high	89.8	Confident	25 Å²	25	51.7 Å²	51.7	13%	0.128	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-80.5	104.7	179	-62	171.9	0	0	0	108.9	L1014 D1050 Q1051 T1055 Y1056	L1014-I1053 CarbonylContact O-C 3.58Å; L1014-I1053 VanDerWaalsContact O-CA 3.29Å; L1014-I1053 WeakPolarHBondContact O-CA 3.3Å; D1050-I1053 WeakPolarHBondContact O-CB 3.38Å; D1050-I1053 PolarHBondContact O-N 2.82Å; Q1051-I1053 VanDerWaalsContact C-N 3.3Å; I1053-T1055 WeakPolarHBondContact CG2-OG1 3.47Å; I1053-T1055 PolarHBondContact O-N 3.15Å; I1053-Y1056 PolarHBondContact O-N 2.98Å; I1053-Y1056 VanDerWaalsContact O-N 3.14Å
1054	I	90.5	Very high	89.9	Confident	14 Å²	14	54.1 Å²	54.1	7%	0.072	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-11.9	-177.4	65.7	176.8	0	0	0	113.3	I1006 L1014 E1016 A1052 V1079 T1089 I1091	I1006-I1054 HydrophobicContact CG2-CD1 4.09Å; L1014-I1054 HydrophobicContact CB-CD1 3.69Å; L1014-I1054 HydrophobicContact CB-CG1 3.39Å; L1014-I1054 HydrophobicContact CD1-CD1 4.14Å; L1014-I1054 HydrophobicContact CD1-CG1 4.33Å; L1014-I1054 HydrophobicContact CG-CD1 4.49Å; L1014-I1054 HydrophobicContact CG-CG1 4.49Å; L1014-I1054 PolarHBondContact O-N 2.81Å; E1016-I1054 HydrophobicContact CB-CG2 3.75Å; A1052-I1054 PolarHBondContact O-N 2.78Å; I1054-V1079 HydrophobicContact CD1-CG1 4.27Å; I1054-T1089 HydrophobicContact CB-CG2 4.49Å; I1054-T1089 HydrophobicContact CD1-CG2 4.03Å; I1054-T1089 HydrophobicContact CG1-CG2 4.49Å; I1054-I1091 HydrophobicContact CD1-CG2 4.43Å; I1054-I1091 HydrophobicContact CG2-CG2 4.34Å
1055	T	90.6	Very high	90	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	3.2	173.3	54.1	0	0	0	0	113	S1013 L1014 I1053 N1057 Q1058 I1060 F1087	S1013-T1055 WeakPolarHBondContact CA-OG1 3.49Å; S1013-T1055 WeakPolarHBondContact CB-OG1 3.29Å; L1014-T1055 HydrophobicContact CB-CG2 3.79Å; L1014-T1055 HydrophobicContact CD1-CG2 3.67Å; L1014-T1055 HydrophobicContact CG-CG2 3.88Å; L1014-T1055 PolarHBondContact N-OG1 3.17Å; I1053-T1055 WeakPolarHBondContact CG2-OG1 3.47Å; I1053-T1055 PolarHBondContact O-N 3.15Å; T1055-N1057 PolarHBondContact O-N 3.26Å; T1055-Q1058 WeakPolarHBondContact CB-O 3.1Å; T1055-Q1058 WeakPolarHBondContact O-CA 3.25Å; T1055-Q1058 VanDerWaalsContact O-CB 3.28Å; T1055-Q1058 WeakPolarHBondContact O-CB 3.29Å; T1055-Q1058 PolarHBondContact O-N 2.94Å; T1055-I1060 HydrophobicContact CG2-CG1 3.72Å; T1055-F1087 HydrophobicContact CG2-CD1 3.75Å; T1055-F1087 HydrophobicContact CG2-CE1 3.62Å; T1055-F1087 HydrophobicContact CG2-CE2 4.46Å; T1055-F1087 HydrophobicContact CG2-CG 4.21Å; T1055-F1087 HydrophobicContact CG2-CZ 4.01Å
1056	Y	87.3	Confident	90.1	Very high	97 Å²	97	50.2 Å²	50.2	38%	0.38	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	-120.6	-179.9	-40.7	-68.9	0	0	0	112.9	I18 I1053	I18-Y1056 HydrophobicContact CD1-CE1 4.08Å; I18-Y1056 WeakPolarHBondContact CD1-OH 3.47Å; I1053-Y1056 PolarHBondContact O-N 2.98Å; I1053-Y1056 VanDerWaalsContact O-N 3.14Å
1057	N	86.3	Confident	90.3	Very high	144 Å²	144	55 Å²	55	77%	0.77	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	1.2	175.2	66.7	-0.9	0	0	0	113.6	T1055	T1055-N1057 PolarHBondContact O-N 3.26Å
1058	Q	88.7	Confident	90.8	Very high	33 Å²	33	52.8 Å²	52.8	15%	0.154	27%	0.266	C	S	.	.			trans	-86.3	119.9	-178.5	-54.1	-166.6	14.8	0	0	110.7	N29 T1055 I1060	N29-Q1058 VanDerWaalsContact CB-OE1 3.22Å; N29-Q1058 PolarHBondContact ND2-OE1 3.35Å; T1055-Q1058 WeakPolarHBondContact CB-O 3.1Å; T1055-Q1058 WeakPolarHBondContact O-CA 3.25Å; T1055-Q1058 VanDerWaalsContact O-CB 3.28Å; T1055-Q1058 WeakPolarHBondContact O-CB 3.29Å; T1055-Q1058 PolarHBondContact O-N 2.94Å; Q1058-I1060 HydrophobicContact CB-CD1 4.45Å
1059	S	91.2	Very high	91.2	Very high	67 Å²	67	50.9 Å²	50.9	47%	0.469	26%	0.259	S	S	.	.			trans	-89.3	117.6	177	-41.5	0	0	0	0	110.1	N1012	N1012-S1059 CarbonylContact O-C 3.51Å; N1012-S1059 WeakPolarHBondContact O-CA 3.32Å
1060	I	94.3	Very high	91.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.			trans	-101.4	108.2	-179.6	-50.8	-54.4	0	0	0	109	N29 N1012 T1055 Q1058 I1063 D1085 F1087	N29-I1060 VanDerWaalsContact ND2-CD1 3.29Å; N29-I1060 WeakPolarHBondContact ND2-CD1 3.43Å; N1012-I1060 WeakPolarHBondContact CA-O 3.17Å; N1012-I1060 VanDerWaalsContact CB-O 3.24Å; N1012-I1060 WeakPolarHBondContact CB-O 3.33Å; N1012-I1060 PolarHBondContact O-N 2.68Å; T1055-I1060 HydrophobicContact CG2-CG1 3.72Å; Q1058-I1060 HydrophobicContact CB-CD1 4.45Å; I1060-I1063 HydrophobicContact CB-CD1 3.97Å; I1060-I1063 HydrophobicContact CB-CG1 4.11Å; I1060-I1063 HydrophobicContact CG2-CD1 3.96Å; I1060-I1063 HydrophobicContact CG2-CG1 3.66Å; I1060-D1085 HydrophobicContact CG2-CB 3.87Å; I1060-F1087 HydrophobicContact CD1-CB 3.79Å; I1060-F1087 HydrophobicContact CD1-CD2 3.78Å; I1060-F1087 HydrophobicContact CD1-CG 3.97Å; I1060-F1087 HydrophobicContact CG1-CB 3.86Å; I1060-F1087 HydrophobicContact CG1-CD2 4.31Å; I1060-F1087 HydrophobicContact CG1-CG 4.07Å; I1060-F1087 HydrophobicContact CG2-CB 4.15Å
1061	M	94.6	Very high	91.9	Very high	30 Å²	30	44.4 Å²	44.4	15%	0.148	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	137.6	-168.1	-61.3	-66.8	112.9	0	0	112.5	V75 N1012 I1063 L1084 D1085	V75-M1061 HydrophobicContact CB-SD 4.41Å; V75-M1061 HydrophobicContact CG2-CB 4.4Å; V75-M1061 HydrophobicContact CG2-CG 3.95Å; V75-M1061 HydrophobicContact CG2-SD 4.42Å; N1012-M1061 HydrophobicContact CB-CE 3.5Å; N1012-M1061 HydrophobicContact CB-SD 4.38Å; N1012-M1061 WeakPolarHBondContact ND2-CE 3.34Å; N1012-M1061 PolarHBondContact ND2-SD 3.43Å; M1061-I1063 VanDerWaalsContact C-N 3.34Å; M1061-I1063 PolarHBondContact O-N 2.89Å; M1061-L1084 HydrophobicContact CB-CB 4.31Å; M1061-L1084 HydrophobicContact CB-CD2 3.93Å; M1061-L1084 HydrophobicContact CB-CG 4.45Å; M1061-L1084 PolarHBondContact O-N 3.39Å; M1061-D1085 WeakPolarHBondContact CB-OD2 3.48Å; M1061-D1085 WeakPolarHBondContact CG-OD2 3.48Å; M1061-D1085 PolarHBondContact N-OD2 2.5Å; M1061-D1085 PolarHBondContact O-N 2.89Å
1062	R	92.8	Very high	92	Very high	21 Å²	21	37.4 Å²	37.4	8%	0.079	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	43.2	168.2	-46.2	-165.1	170.8	176.9	-1.3	114.4	L57 V75 L76 D77 E78 N1012 R1064 G1083 L1084	L57-R1062 VanDerWaalsContact O-CZ 3.25Å; L57-R1062 PolarHBondContact O-NH1 2.02Å; L57-R1062 PolarHBondContact O-NH2 3.5Å; L57-R1062 VanDerWaalsContact O-NH2 3.15Å; V75-R1062 HydrophobicContact CG1-CG 4.37Å; L76-R1062 PolarHBondContact O-NH2 3.07Å; D77-R1062 PolarHBondContact O-NH2 3.41Å; E78-R1062 HydrophobicContact CG-CG 4.04Å; E78-R1062 VanDerWaalsContact OE1-CG 3.3Å; E78-R1062 WeakPolarHBondContact OE1-CG 3.3Å; N1012-R1062 PolarHBondContact OD1-N 3.45Å; R1062-R1064 PolarHBondContact O-N 3.33Å; R1062-G1083 VanDerWaalsContact O-CA 3.25Å; R1062-G1083 WeakPolarHBondContact O-CA 3.05Å; R1062-L1084 HydrophobicContact CB-CB 3.95Å; R1062-L1084 HydrophobicContact CG-CB 4.16Å; R1062-L1084 HydrophobicContact CG-CD2 4.36Å
1063	I	94.5	Very high	92	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.			trans	-55.1	126.5	176.8	-57	171.2	0	0	0	109.5	R987 A990 A1008 L1014 I1060 M1061 I1066 A1081	R987-I1063 WeakPolarHBondContact CD-O 3.3Å; R987-I1063 PolarHBondContact NE-O 3.31Å; A990-I1063 HydrophobicContact CB-CG2 4.47Å; A1008-I1063 HydrophobicContact CB-CB 3.97Å; A1008-I1063 HydrophobicContact CB-CD1 3.87Å; A1008-I1063 HydrophobicContact CB-CG2 3.73Å; L1014-I1063 HydrophobicContact CD1-CD1 4.42Å; L1014-I1063 HydrophobicContact CD2-CD1 3.85Å; L1014-I1063 HydrophobicContact CG-CD1 3.86Å; I1060-I1063 HydrophobicContact CB-CD1 3.97Å; I1060-I1063 HydrophobicContact CB-CG1 4.11Å; I1060-I1063 HydrophobicContact CG2-CD1 3.96Å; I1060-I1063 HydrophobicContact CG2-CG1 3.66Å; M1061-I1063 VanDerWaalsContact C-N 3.34Å; M1061-I1063 PolarHBondContact O-N 2.89Å; I1063-I1066 HydrophobicContact CG2-CG1 4.35Å; I1063-A1081 HydrophobicContact CG2-CB 4.22Å
1064	R	92.9	Very high	91.9	Very high	90 Å²	90	36.5 Å²	36.5	34%	0.34	19%	0.191	S	C	.	.			trans	-101.3	-36.7	179.6	-64.7	179.8	-172.8	164.6	-1.8	112	N436 R1062 Y1082	N436-R1064 PolarHBondContact OD1-NH1 3.37Å; R1062-R1064 PolarHBondContact O-N 3.33Å; R1064-Y1082 PolarHBondContact N-O 2.84Å
1065	A	93.6	Very high	91.8	Very high	22 Å²	22	35.9 Å²	35.9	18%	0.182	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	164	179.3	0	0	0	0	0	111.5	Y1082	A1065-Y1082 HydrophobicContact CB-CE1 3.9Å; A1065-Y1082 HydrophobicContact CB-CE2 4.06Å; A1065-Y1082 WeakPolarHBondContact CB-OH 3.34Å; A1065-Y1082 PolarHBondContact N-O 2.96Å; A1065-Y1082 PolarHBondContact O-N 2.78Å; A1065-Y1082 VanDerWaalsContact O-N 3.09Å
1066	I	95.6	Very high	91.9	Very high	16 Å²	16	36.3 Å²	36.3	8%	0.082	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.3	179.1	-50	165.6	0	0	0	107.6	T992 I1006 A1008 L1014 I1063 V1079 F1080 A1081	T992-I1066 HydrophobicContact CG2-CB 3.63Å; T992-I1066 HydrophobicContact CG2-CD1 4.27Å; T992-I1066 HydrophobicContact CG2-CG2 3.53Å; I1006-I1066 HydrophobicContact CB-CD1 4.47Å; I1006-I1066 HydrophobicContact CG2-CD1 3.97Å; A1008-I1066 HydrophobicContact CB-CD1 4.02Å; A1008-I1066 HydrophobicContact CB-CG1 4.49Å; L1014-I1066 HydrophobicContact CD2-CD1 3.49Å; L1014-I1066 VanDerWaalsContact CD2-CD1 3.49Å; L1014-I1066 HydrophobicContact CD2-CG1 3.96Å; I1063-I1066 HydrophobicContact CG2-CG1 4.35Å; I1066-V1079 HydrophobicContact CG2-CG1 3.56Å; I1066-F1080 CarbonylContact C-O 3.49Å; I1066-F1080 WeakPolarHBondContact CA-O 3.25Å; I1066-A1081 HydrophobicContact CG1-CB 4.29Å
1067	R	94.4	Very high	92.1	Very high	100 Å²	100	31.8 Å²	31.8	38%	0.377	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.1	173.1	-170.4	60.5	166.3	-171.1	-7.1	109.2	E441 V442 F1080	E441-R1067 IonicContact OE1-CZ 2.69Å; E441-R1067 IonicContact OE1-NH2 2.65Å; E441-R1067 PolarHBondContact OE1-NH2 3.47Å; E441-R1067 IonicContact OE2-CZ 2.95Å; E441-R1067 IonicContact OE2-NE 3.34Å; E441-R1067 IonicContact OE2-NH2 3.7Å; E441-R1067 PolarHBondContact OE2-NH2 3.38Å; V442-R1067 HydrophobicContact CG2-CG 3.82Å; R1067-F1080 PolarHBondContact N-O 2.9Å; R1067-F1080 PolarHBondContact O-N 2.88Å
1068	T	95	Very high	92.5	Very high	19 Å²	19	25.1 Å²	25.1	12%	0.117	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	146.5	173.9	48.7	0	0	0	0	110.2	T992 V993 I1006 L1078 V1079	T992-T1068 HydrophobicContact CG2-CG2 3.71Å; V993-T1068 WeakPolarHBondContact O-CB 3.29Å; V993-T1068 WeakPolarHBondContact O-CG2 3.45Å; V993-T1068 PolarHBondContact O-OG1 3.43Å; I1006-T1068 HydrophobicContact CD1-CG2 3.74Å; T1068-L1078 VanDerWaalsContact CA-O 3.23Å; T1068-L1078 WeakPolarHBondContact CA-O 3.49Å; T1068-V1079 HydrophobicContact CG2-CG2 4.25Å
1069	A	94.2	Very high	92.9	Very high	7 Å²	7	23.5 Å²	23.5	6%	0.058	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	144	176.9	0	0	0	0	0	110.6	V442 L1078	V442-A1069 HydrophobicContact CB-CB 3.88Å; V442-A1069 HydrophobicContact CG1-CB 3.68Å; V442-A1069 HydrophobicContact CG2-CB 4.08Å; A1069-L1078 HydrophobicContact CB-CB 4.46Å; A1069-L1078 PolarHBondContact N-O 2.86Å; A1069-L1078 PolarHBondContact O-N 3.21Å
1070	P	94.3	Very high	93.1	Very high	42 Å²	42	20.5 Å²	20.5	27%	0.273	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	156.3	176	31.2	-35	0	0	0	111.2	K605 V995 T996	K605-P1070 VanDerWaalsContact CE-O 3.23Å; K605-P1070 WeakPolarHBondContact CE-O 3.44Å; K605-P1070 PolarHBondContact NZ-O 2.91Å; V995-P1070 HydrophobicContact CG1-CB 4.31Å; V995-P1070 HydrophobicContact CG1-CG 4.31Å; V995-P1070 WeakPolarHBondContact O-CA 3.21Å; T996-P1070 VanDerWaalsContact C-CB 3.48Å
1071	T	92.2	Very high	93.2	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.018	11%	0.108	C	C	.	.			trans	-102.1	-175.3	164.4	70.7	0	0	0	0	109.8	V603 E997 L1073 T1076 L1078	V603-T1071 HydrophobicContact CG2-CG2 3.99Å; E997-T1071 WeakPolarHBondContact CB-O 3.16Å; T1071-L1073 PolarHBondContact OG1-N 2.72Å; T1071-L1073 VanDerWaalsContact OG1-N 3.09Å; T1071-L1073 PolarHBondContact OG1-O 2.9Å; T1071-T1076 HydrophobicContact CG2-CG2 4.16Å; T1071-T1076 PolarHBondContact N-O 2.74Å; T1071-T1076 PolarHBondContact OG1-O 3Å; T1071-L1078 HydrophobicContact CG2-CD1 4.15Å; T1071-L1078 HydrophobicContact CG2-CD2 3.48Å; T1071-L1078 VanDerWaalsContact CG2-CD2 3.48Å; T1071-L1078 HydrophobicContact CG2-CG 3.55Å
1072	G	87.6	Confident	93.3	Very high	33 Å²	33	20.4 Å²	20.4	34%	0.34	11%	0.106	S	C	.	.	S	Bend	trans	-83.6	2.6	167.8	0	0	0	0	0	113.4	F601 E997	F601-G1072 WeakPolarHBondContact O-CA 3.15Å; F601-G1072 PolarHBondContact O-N 2.89Å; E997-G1072 WeakPolarHBondContact OE2-CA 3.46Å
1073	L	89.2	Confident	93.3	Very high	14 Å²	14	19.5 Å²	19.5	7%	0.073	10%	0.103	C	C	.	.	S	Bend	trans	-101.1	129.9	165.7	-66.9	169.9	0	0	0	107.6	F601 T1071 S1075 T1076 D1098 L1099	F601-L1073 HydrophobicContact CB-CD1 4.04Å; F601-L1073 HydrophobicContact CB-CG 4.02Å; F601-L1073 HydrophobicContact CD1-CD1 3.95Å; F601-L1073 HydrophobicContact CD1-CD2 3.46Å; F601-L1073 VanDerWaalsContact CD1-CD2 3.46Å; F601-L1073 HydrophobicContact CD1-CG 3.65Å; F601-L1073 HydrophobicContact CE1-CD2 3.75Å; F601-L1073 HydrophobicContact CE1-CG 4.38Å; F601-L1073 HydrophobicContact CG-CD1 3.92Å; F601-L1073 HydrophobicContact CG-CD2 4.28Å; F601-L1073 HydrophobicContact CG-CG 4.01Å; T1071-L1073 PolarHBondContact OG1-N 2.72Å; T1071-L1073 VanDerWaalsContact OG1-N 3.09Å; T1071-L1073 PolarHBondContact OG1-O 2.9Å; L1073-S1075 VanDerWaalsContact C-N 3.28Å; L1073-S1075 PolarHBondContact O-N 3.33Å; L1073-T1076 PolarHBondContact O-N 3.32Å; L1073-T1076 VanDerWaalsContact O-O 3.06Å; L1073-D1098 HydrophobicContact CD2-CB 4.4Å; L1073-L1099 HydrophobicContact CD1-CD1 4.35Å
1074	E	89.6	Confident	93.4	Very high	15 Å²	15	19.5 Å²	19.5	7%	0.07	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-31.5	178.7	176.5	54.7	-156	0	0	110.8	T996 E997 R998 G999 I1000 T1001 T1076 Y1097 D1098	T996-E1074 VanDerWaalsContact CB-O 3.29Å; T996-E1074 WeakPolarHBondContact CB-O 2.98Å; T996-E1074 WeakPolarHBondContact CB-OE1 2.98Å; T996-E1074 VanDerWaalsContact CG2-O 3.25Å; T996-E1074 WeakPolarHBondContact CG2-O 3.47Å; T996-E1074 PolarHBondContact OG1-OE1 3.49Å; E997-E1074 PolarHBondContact N-OE2 2.88Å; E997-E1074 VanDerWaalsContact N-OE2 3.14Å; R998-E1074 WeakPolarHBondContact CA-OE2 2.85Å; R998-E1074 WeakPolarHBondContact CB-OE2 3.27Å; R998-E1074 PolarHBondContact N-OE2 2.78Å; G999-E1074 PolarHBondContact N-OE1 2.79Å; G999-E1074 VanDerWaalsContact N-OE1 3.17Å; I1000-E1074 WeakPolarHBondContact CA-OE1 3.02Å; I1000-E1074 HydrophobicContact CB-CG 3.89Å; I1000-E1074 HydrophobicContact CD1-CG 4.24Å; I1000-E1074 HydrophobicContact CG1-CG 4.38Å; I1000-E1074 PolarHBondContact N-OE1 3.23Å; T1001-E1074 HydrophobicContact CG2-CG 4.16Å; T1001-E1074 WeakPolarHBondContact CG2-O 3.16Å; T1001-E1074 PolarHBondContact N-OE1 3.03Å; T1001-E1074 VanDerWaalsContact N-OE1 3.09Å; E1074-T1076 PolarHBondContact O-N 2.86Å; E1074-Y1097 WeakPolarHBondContact CB-OH 2.98Å; E1074-Y1097 WeakPolarHBondContact CG-OH 3.38Å; E1074-D1098 PolarHBondContact N-OD2 2.89Å
1075	S	89.6	Confident	93.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.5	177	70.1	0	0	0	0	114	L1073 S1092 Q1095 D1098	L1073-S1075 VanDerWaalsContact C-N 3.28Å; L1073-S1075 PolarHBondContact O-N 3.33Å; S1075-S1092 WeakPolarHBondContact O-CA 3.39Å; S1075-S1092 WeakPolarHBondContact O-CB 3.41Å; S1075-Q1095 VanDerWaalsContact CB-O 3.27Å; S1075-Q1095 WeakPolarHBondContact CB-O 3.47Å; S1075-D1098 WeakPolarHBondContact CB-OD1 3.33Å; S1075-D1098 PolarHBondContact N-OD2 3.44Å; S1075-D1098 PolarHBondContact OG-OD1 3.11Å; S1075-D1098 PolarHBondContact OG-OD2 3.36Å
1076	T	91.1	Very high	93.6	Very high	10 Å²	10	14.2 Å²	14.2	6%	0.061	8%	0.078	C	C	.	.			trans	-122.6	132.2	-162.5	-57.6	0	0	0	0	112.3	T1071 L1073 E1074 R1090 I1091	T1071-T1076 HydrophobicContact CG2-CG2 4.16Å; T1071-T1076 PolarHBondContact N-O 2.74Å; T1071-T1076 PolarHBondContact OG1-O 3Å; L1073-T1076 PolarHBondContact O-N 3.32Å; L1073-T1076 VanDerWaalsContact O-O 3.06Å; E1074-T1076 PolarHBondContact O-N 2.86Å; T1076-R1090 HydrophobicContact CG2-CB 4.19Å; T1076-I1091 CarbonylContact C-O 3.47Å; T1076-I1091 WeakPolarHBondContact CA-O 3.46Å
1077	G	93.1	Very high	93.6	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.01	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	161	172.5	0	0	0	0	0	111.7	R1090 I1091	G1077-R1090 CarbonylContact O-C 3.57Å; G1077-R1090 WeakPolarHBondContact O-CA 3.44Å; G1077-I1091 PolarHBondContact N-O 3.04Å; G1077-I1091 PolarHBondContact O-N 2.89Å
1078	L	95.1	Very high	93.6	Very high	4 Å²	4	8.8 Å²	8.8	2%	0.021	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	143	175.8	-52.4	179.5	0	0	0	110	V603 K605 T1068 A1069 T1071 F1088 R1090	V603-L1078 HydrophobicContact CG1-CD2 3.97Å; K605-L1078 HydrophobicContact CD-CD1 3.98Å; K605-L1078 HydrophobicContact CG-CD1 4.27Å; T1068-L1078 VanDerWaalsContact CA-O 3.23Å; T1068-L1078 WeakPolarHBondContact CA-O 3.49Å; A1069-L1078 HydrophobicContact CB-CB 4.46Å; A1069-L1078 PolarHBondContact N-O 2.86Å; A1069-L1078 PolarHBondContact O-N 3.21Å; T1071-L1078 HydrophobicContact CG2-CD1 4.15Å; T1071-L1078 HydrophobicContact CG2-CD2 3.48Å; T1071-L1078 VanDerWaalsContact CG2-CD2 3.48Å; T1071-L1078 HydrophobicContact CG2-CG 3.55Å; L1078-F1088 HydrophobicContact CB-CE2 4.05Å; L1078-F1088 HydrophobicContact CB-CZ 4.03Å; L1078-F1088 HydrophobicContact CD1-CE2 4.39Å; L1078-F1088 HydrophobicContact CD1-CZ 4.03Å; L1078-F1088 HydrophobicContact CD2-CE1 4.49Å; L1078-F1088 HydrophobicContact CD2-CZ 3.83Å; L1078-F1088 HydrophobicContact CG-CZ 4.16Å; L1078-R1090 HydrophobicContact CD2-CG 3.87Å
1079	V	95.7	Very high	93.6	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.5	177.4	-175	0	0	0	0	108.4	I1006 I1054 I1066 T1068 F1088 T1089 I1091	I1006-V1079 HydrophobicContact CD1-CG1 4.07Å; I1006-V1079 HydrophobicContact CD1-CG2 3.57Å; I1054-V1079 HydrophobicContact CD1-CG1 4.27Å; I1066-V1079 HydrophobicContact CG2-CG1 3.56Å; T1068-V1079 HydrophobicContact CG2-CG2 4.25Å; V1079-F1088 VanDerWaalsContact O-CA 3.31Å; V1079-F1088 WeakPolarHBondContact O-CA 3.37Å; V1079-T1089 HydrophobicContact CB-CG2 4.08Å; V1079-T1089 PolarHBondContact N-O 2.89Å; V1079-T1089 PolarHBondContact O-N 2.92Å; V1079-I1091 HydrophobicContact CG2-CB 4.22Å; V1079-I1091 HydrophobicContact CG2-CD1 3.56Å; V1079-I1091 HydrophobicContact CG2-CG1 3.68Å; V1079-I1091 HydrophobicContact CG2-CG2 3.57Å
1080	F	96.6	Very high	93.4	Very high	3 Å²	3	11.3 Å²	11.3	1%	0.013	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.2	173	-179	-118.6	0	0	0	109.7	W28 V440 L607 I609 I1066 R1067 Y1082 L1086 F1087 F1088	W28-F1080 HydrophobicContact CH2-CD2 4.09Å; W28-F1080 AromaticContact CH2-CE2 3.49Å; W28-F1080 HydrophobicContact CH2-CE2 3.49Å; W28-F1080 VanDerWaalsContact CH2-CE2 3.49Å; W28-F1080 HydrophobicContact CH2-CZ 4.43Å; W28-F1080 HydrophobicContact CZ2-CD2 4.39Å; W28-F1080 HydrophobicContact CZ2-CE2 4.2Å; W28-F1080 HydrophobicContact CZ3-CE2 4.2Å; V440-F1080 HydrophobicContact CG1-CD1 3.85Å; V440-F1080 HydrophobicContact CG1-CE1 3.91Å; V440-F1080 HydrophobicContact CG2-CE1 4.04Å; L607-F1080 HydrophobicContact CD1-CD2 4.02Å; L607-F1080 HydrophobicContact CD1-CE2 4.16Å; L607-F1080 HydrophobicContact CD1-CG 4.2Å; L607-F1080 HydrophobicContact CD1-CZ 4.44Å; I609-F1080 HydrophobicContact CD1-CE1 4.04Å; I609-F1080 HydrophobicContact CD1-CZ 3.92Å; I1066-F1080 CarbonylContact C-O 3.49Å; I1066-F1080 WeakPolarHBondContact CA-O 3.25Å; R1067-F1080 PolarHBondContact N-O 2.9Å; R1067-F1080 PolarHBondContact O-N 2.88Å; F1080-Y1082 HydrophobicContact CD1-CD1 4.03Å; F1080-Y1082 AromaticContact CE1-CD1 3.95Å; F1080-Y1082 HydrophobicContact CE1-CD1 3.95Å; F1080-Y1082 HydrophobicContact CE1-CG 4.31Å; F1080-L1086 HydrophobicContact CE2-CB 4.13Å; F1080-L1086 HydrophobicContact CZ-CB 4.4Å; F1080-L1086 HydrophobicContact CZ-CD1 4.42Å; F1080-L1086 HydrophobicContact CZ-CD2 4.12Å; F1080-F1087 CarbonylContact C-O 3.58Å; F1080-F1087 WeakPolarHBondContact CA-O 3.31Å; F1080-F1087 WeakPolarHBondContact CD2-O 3.27Å; F1080-F1088 HydrophobicContact CB-CD2 4.1Å; F1080-F1088 HydrophobicContact CD2-CB 4.18Å; F1080-F1088 HydrophobicContact CD2-CD2 4.21Å
1081	A	96.1	Very high	93.3	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.9	175.1	0	0	0	0	0	110.1	L1014 I1063 I1066 F1087	L1014-A1081 HydrophobicContact CD1-CB 3.54Å; L1014-A1081 HydrophobicContact CD2-CB 4.18Å; L1014-A1081 HydrophobicContact CG-CB 4.42Å; I1063-A1081 HydrophobicContact CG2-CB 4.22Å; I1066-A1081 HydrophobicContact CG1-CB 4.29Å; A1081-F1087 PolarHBondContact N-O 2.95Å; A1081-F1087 PolarHBondContact O-N 3.17Å
1082	Y	95.6	Very high	93.2	Very high	29 Å²	29	11.4 Å²	11.4	11%	0.114	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.3	-178.2	63.7	-90.5	0	0	0	112.4	I437 V440 R1064 A1065 F1080	I437-Y1082 HydrophobicContact CB-CD2 3.73Å; I437-Y1082 HydrophobicContact CB-CE2 4.21Å; I437-Y1082 HydrophobicContact CB-CG 4.45Å; I437-Y1082 HydrophobicContact CG2-CD2 3.55Å; I437-Y1082 HydrophobicContact CG2-CE2 3.68Å; I437-Y1082 HydrophobicContact CG2-CG 4.16Å; V440-Y1082 HydrophobicContact CB-CE1 4.06Å; V440-Y1082 HydrophobicContact CG2-CD1 3.74Å; V440-Y1082 HydrophobicContact CG2-CD2 4.43Å; V440-Y1082 HydrophobicContact CG2-CE1 3.52Å; V440-Y1082 HydrophobicContact CG2-CE2 4.24Å; V440-Y1082 HydrophobicContact CG2-CG 4.18Å; R1064-Y1082 PolarHBondContact N-O 2.84Å; A1065-Y1082 HydrophobicContact CB-CE1 3.9Å; A1065-Y1082 HydrophobicContact CB-CE2 4.06Å; A1065-Y1082 WeakPolarHBondContact CB-OH 3.34Å; A1065-Y1082 PolarHBondContact N-O 2.96Å; A1065-Y1082 PolarHBondContact O-N 2.78Å; A1065-Y1082 VanDerWaalsContact O-N 3.09Å; F1080-Y1082 HydrophobicContact CD1-CD1 4.03Å; F1080-Y1082 AromaticContact CE1-CD1 3.95Å; F1080-Y1082 HydrophobicContact CE1-CD1 3.95Å; F1080-Y1082 HydrophobicContact CE1-CG 4.31Å
1083	G	93.7	Very high	93.3	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.01	5%	0.054	C	C	.	.	S	Bend	trans	-170.7	-128.9	-176.9	0	0	0	0	0	110.1	A435 R1062 D1085	A435-G1083 CarbonylContact C-O 3.55Å; R1062-G1083 VanDerWaalsContact O-CA 3.25Å; R1062-G1083 WeakPolarHBondContact O-CA 3.05Å; G1083-D1085 VanDerWaalsContact C-N 3.29Å; G1083-D1085 PolarHBondContact N-O 2.86Å
1084	L	95.5	Very high	93.2	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	7%	0.066	C	C	.	.	S	Bend	trans	-67.1	-37.6	164	174.7	62.4	0	0	0	110.5	F32 L57 V59 V75 A435 M1061 R1062	F32-L1084 WeakPolarHBondContact CB-O 3.41Å; L57-L1084 HydrophobicContact CD1-CD1 4.05Å; V59-L1084 HydrophobicContact CG2-CD1 4.32Å; V59-L1084 HydrophobicContact CG2-CD2 3.75Å; V75-L1084 HydrophobicContact CB-CD2 4.45Å; V75-L1084 HydrophobicContact CG1-CD2 3.86Å; V75-L1084 HydrophobicContact CG2-CD2 3.67Å; A435-L1084 HydrophobicContact CB-CD1 3.8Å; M1061-L1084 HydrophobicContact CB-CB 4.31Å; M1061-L1084 HydrophobicContact CB-CD2 3.93Å; M1061-L1084 HydrophobicContact CB-CG 4.45Å; M1061-L1084 PolarHBondContact O-N 3.39Å; R1062-L1084 HydrophobicContact CB-CB 3.95Å; R1062-L1084 HydrophobicContact CG-CB 4.16Å; R1062-L1084 HydrophobicContact CG-CD2 4.36Å
1085	D	95.8	Very high	93.1	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	-109.2	161	174.9	-64.2	-25.8	0	0	0	111.1	Q30 K31 F32 R73 I1060 M1061 G1083	Q30-D1085 WeakPolarHBondContact O-CA 3.5Å; K31-D1085 WeakPolarHBondContact CA-OD1 3.43Å; F32-D1085 PolarHBondContact N-OD1 2.86Å; R73-D1085 IonicContact CZ-OD1 2.63Å; R73-D1085 IonicContact CZ-OD2 3.24Å; R73-D1085 IonicContact NH1-OD1 3.67Å; R73-D1085 PolarHBondContact NH1-OD1 2.94Å; R73-D1085 IonicContact NH1-OD2 2.97Å; R73-D1085 IonicContact NH2-OD1 3.99Å; R73-D1085 PolarHBondContact NH2-OD1 2.67Å; R73-D1085 IonicContact NH2-OD2 2.97Å; R73-D1085 PolarHBondContact NH2-OD2 3.45Å; I1060-D1085 HydrophobicContact CG2-CB 3.87Å; M1061-D1085 WeakPolarHBondContact CB-OD2 3.48Å; M1061-D1085 WeakPolarHBondContact CG-OD2 3.48Å; M1061-D1085 PolarHBondContact N-OD2 2.5Å; M1061-D1085 PolarHBondContact O-N 2.89Å; G1083-D1085 VanDerWaalsContact C-N 3.29Å; G1083-D1085 PolarHBondContact N-O 2.86Å
1086	L	95.7	Very high	92.7	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.8	175.3	-50.6	-178.6	0	0	0	109.6	W28 N29 Q30 F32 L434 I437 L619 F1080	W28-L1086 HydrophobicContact CH2-CB 4.45Å; W28-L1086 HydrophobicContact CZ3-CB 3.82Å; N29-L1086 WeakPolarHBondContact CA-O 3.42Å; N29-L1086 PolarHBondContact OD1-O 3.04Å; Q30-L1086 HydrophobicContact CB-CB 4.28Å; Q30-L1086 PolarHBondContact N-O 2.96Å; Q30-L1086 PolarHBondContact O-N 3.32Å; F32-L1086 HydrophobicContact CD2-CG 4.46Å; F32-L1086 HydrophobicContact CE2-CD1 3.82Å; F32-L1086 HydrophobicContact CE2-CG 3.85Å; F32-L1086 HydrophobicContact CZ-CD1 4.39Å; L434-L1086 HydrophobicContact CB-CD1 4.35Å; L434-L1086 HydrophobicContact CD1-CD1 4.5Å; L434-L1086 HydrophobicContact CD2-CD1 4.48Å; I437-L1086 HydrophobicContact CD1-CD1 4.31Å; I437-L1086 HydrophobicContact CD1-CD2 3.38Å; I437-L1086 HydrophobicContact CD1-CG 4.48Å; L619-L1086 HydrophobicContact CD1-CD1 4.31Å; F1080-L1086 HydrophobicContact CE2-CB 4.13Å; F1080-L1086 HydrophobicContact CZ-CB 4.4Å; F1080-L1086 HydrophobicContact CZ-CD1 4.42Å; F1080-L1086 HydrophobicContact CZ-CD2 4.12Å
1087	F	95.6	Very high	92.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	134	175.2	-175.4	-104.9	0	0	0	110.2	D27 W28 N29 L1014 T1055 I1060 F1080 A1081 T1089	D27-F1087 HydrophobicContact CB-CE2 4.32Å; D27-F1087 HydrophobicContact CB-CZ 4.2Å; W28-F1087 WeakPolarHBondContact O-CA 3.49Å; W28-F1087 WeakPolarHBondContact O-CD2 3.41Å; N29-F1087 HydrophobicContact CB-CD2 4.14Å; L1014-F1087 HydrophobicContact CD1-CD1 3.75Å; L1014-F1087 HydrophobicContact CD1-CE1 4.33Å; T1055-F1087 HydrophobicContact CG2-CD1 3.75Å; T1055-F1087 HydrophobicContact CG2-CE1 3.62Å; T1055-F1087 HydrophobicContact CG2-CE2 4.46Å; T1055-F1087 HydrophobicContact CG2-CG 4.21Å; T1055-F1087 HydrophobicContact CG2-CZ 4.01Å; I1060-F1087 HydrophobicContact CD1-CB 3.79Å; I1060-F1087 HydrophobicContact CD1-CD2 3.78Å; I1060-F1087 HydrophobicContact CD1-CG 3.97Å; I1060-F1087 HydrophobicContact CG1-CB 3.86Å; I1060-F1087 HydrophobicContact CG1-CD2 4.31Å; I1060-F1087 HydrophobicContact CG1-CG 4.07Å; I1060-F1087 HydrophobicContact CG2-CB 4.15Å; F1080-F1087 CarbonylContact C-O 3.58Å; F1080-F1087 WeakPolarHBondContact CA-O 3.31Å; F1080-F1087 WeakPolarHBondContact CD2-O 3.27Å; A1081-F1087 PolarHBondContact N-O 2.95Å; A1081-F1087 PolarHBondContact O-N 3.17Å; F1087-T1089 HydrophobicContact CD1-CG2 4.37Å; F1087-T1089 HydrophobicContact CE1-CG2 3.62Å; F1087-T1089 HydrophobicContact CZ-CG2 4.35Å
1088	F	95.2	Very high	91.9	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.009	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	139.4	175.2	-180	-89.7	0	0	0	109.5	D27 W28 L607 S621 L1078 V1079 F1080	D27-F1088 WeakPolarHBondContact CA-O 3.25Å; D27-F1088 WeakPolarHBondContact CB-O 3.16Å; W28-F1088 AromaticContact CD1-CD1 3.99Å; W28-F1088 HydrophobicContact CD2-CB 3.72Å; W28-F1088 AromaticContact CE2-CG 3.79Å; W28-F1088 HydrophobicContact CE3-CB 4.31Å; W28-F1088 HydrophobicContact CG-CB 4.21Å; W28-F1088 HydrophobicContact CH2-CB 4.06Å; W28-F1088 HydrophobicContact CZ2-CB 3.37Å; W28-F1088 HydrophobicContact CZ2-CD2 4.35Å; W28-F1088 AromaticContact CZ2-CG 3.95Å; W28-F1088 HydrophobicContact CZ2-CG 3.95Å; W28-F1088 HydrophobicContact CZ3-CB 4.46Å; W28-F1088 PolarHBondContact N-O 2.8Å; W28-F1088 VanDerWaalsContact N-O 3.08Å; W28-F1088 VanDerWaalsContact NE1-CB 3.34Å; W28-F1088 AromaticContact NE1-CD1 3.48Å; W28-F1088 AromaticContact NE1-CG 3.53Å; W28-F1088 PolarHBondContact O-N 2.95Å; L607-F1088 HydrophobicContact CD1-CD2 4.4Å; S621-F1088 WeakPolarHBondContact O-CD1 3.4Å; S621-F1088 WeakPolarHBondContact O-CE1 3.49Å; S621-F1088 WeakPolarHBondContact O-CZ 3.42Å; L1078-F1088 HydrophobicContact CB-CE2 4.05Å; L1078-F1088 HydrophobicContact CB-CZ 4.03Å; L1078-F1088 HydrophobicContact CD1-CE2 4.39Å; L1078-F1088 HydrophobicContact CD1-CZ 4.03Å; L1078-F1088 HydrophobicContact CD2-CE1 4.49Å; L1078-F1088 HydrophobicContact CD2-CZ 3.83Å; L1078-F1088 HydrophobicContact CG-CZ 4.16Å; V1079-F1088 VanDerWaalsContact O-CA 3.31Å; V1079-F1088 WeakPolarHBondContact O-CA 3.37Å; F1080-F1088 HydrophobicContact CB-CD2 4.1Å; F1080-F1088 HydrophobicContact CD2-CB 4.18Å; F1080-F1088 HydrophobicContact CD2-CD2 4.21Å
1089	T	93.2	Very high	91.3	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	169.4	174.2	-170.1	0	0	0	0	110.9	I1054 V1079 F1087 I1091	I1054-T1089 HydrophobicContact CB-CG2 4.49Å; I1054-T1089 HydrophobicContact CD1-CG2 4.03Å; I1054-T1089 HydrophobicContact CG1-CG2 4.49Å; V1079-T1089 HydrophobicContact CB-CG2 4.08Å; V1079-T1089 PolarHBondContact N-O 2.89Å; V1079-T1089 PolarHBondContact O-N 2.92Å; F1087-T1089 HydrophobicContact CD1-CG2 4.37Å; F1087-T1089 HydrophobicContact CE1-CG2 3.62Å; F1087-T1089 HydrophobicContact CZ-CG2 4.35Å; T1089-I1091 HydrophobicContact CG2-CG2 4.43Å
1090	R	91.5	Very high	90.6	Very high	74 Å²	74	38 Å²	38	28%	0.279	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.6	174	-50.6	178.3	-165.6	-177.4	-0.2	108.4	T1076 G1077 L1078	T1076-R1090 HydrophobicContact CG2-CB 4.19Å; G1077-R1090 CarbonylContact O-C 3.57Å; G1077-R1090 WeakPolarHBondContact O-CA 3.44Å; L1078-R1090 HydrophobicContact CD2-CG 3.87Å
1091	I	91.8	Very high	89.6	Confident	6 Å²	6	44.8 Å²	44.8	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.7	176.6	61.5	169.5	0	0	0	110.2	I1006 I1054 T1076 G1077 V1079 T1089 P1093	I1006-I1091 HydrophobicContact CD1-CD1 3.66Å; I1006-I1091 HydrophobicContact CG1-CD1 4.48Å; I1054-I1091 HydrophobicContact CD1-CG2 4.43Å; I1054-I1091 HydrophobicContact CG2-CG2 4.34Å; T1076-I1091 CarbonylContact C-O 3.47Å; T1076-I1091 WeakPolarHBondContact CA-O 3.46Å; G1077-I1091 PolarHBondContact N-O 3.04Å; G1077-I1091 PolarHBondContact O-N 2.89Å; V1079-I1091 HydrophobicContact CG2-CB 4.22Å; V1079-I1091 HydrophobicContact CG2-CD1 3.56Å; V1079-I1091 HydrophobicContact CG2-CG1 3.68Å; V1079-I1091 HydrophobicContact CG2-CG2 3.57Å; T1089-I1091 HydrophobicContact CG2-CG2 4.43Å; I1091-P1093 HydrophobicContact CD1-CG 4.37Å
1092	S	90.8	Very high	88.5	Confident	42 Å²	42	52.5 Å²	52.5	29%	0.294	26%	0.257	S	S	.	.			trans	-131.6	81.8	179	-57.5	0	0	0	0	111	S1075 S1094 Q1095	S1075-S1092 WeakPolarHBondContact O-CA 3.39Å; S1075-S1092 WeakPolarHBondContact O-CB 3.41Å; S1092-S1094 PolarHBondContact O-N 2.87Å; S1092-Q1095 PolarHBondContact O-N 2.92Å
1093	P	89	Confident	87.6	Confident	18 Å²	18	57.3 Å²	57.3	12%	0.117	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.5	-168.6	-30	37	0	0	0	115.6	S994 A1002 N1004 I1091	S994-P1093 WeakPolarHBondContact OG-CG 3.25Å; A1002-P1093 WeakPolarHBondContact O-CB 3.37Å; N1004-P1093 HydrophobicContact CB-CB 4.33Å; N1004-P1093 VanDerWaalsContact ND2-CA 3.35Å; N1004-P1093 WeakPolarHBondContact ND2-CA 3.44Å; I1091-P1093 HydrophobicContact CD1-CG 4.37Å
1094	S	87.7	Confident	87.1	Confident	45 Å²	45	60.7 Å²	60.7	32%	0.315	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	30.8	178.9	-59.3	0	0	0	0	112.8	A1002 S1092	A1002-S1094 WeakPolarHBondContact CB-OG 3.27Å; A1002-S1094 PolarHBondContact N-OG 2.87Å; S1092-S1094 PolarHBondContact O-N 2.87Å
1095	Q	85.9	Confident	86.8	Confident	159 Å²	159	64.7 Å²	64.7	74%	0.743	32%	0.32	S	S	*	.			trans	59.4	167.1	-172	-53.9	177.7	-0.1	0	0	112.9	S1075 S1092 Y1097	S1075-Q1095 VanDerWaalsContact CB-O 3.27Å; S1075-Q1095 WeakPolarHBondContact CB-O 3.47Å; S1092-Q1095 PolarHBondContact O-N 2.92Å; Q1095-Y1097 PolarHBondContact O-N 2.88Å
1096	T	83	Confident	86.4	Confident	62 Å²	62	70.9 Å²	70.9	38%	0.38	35%	0.345	S	S	.	.			trans	-84.8	91.5	-177.9	48.3	0	0	0	0	111.1
1097	Y	84.5	Confident	86.2	Confident	127 Å²	127	75.8 Å²	75.8	50%	0.498	38%	0.375	S	S	.	.	S	Bend	trans	-97.6	-16.7	179.4	65.4	-93.9	0	0	0	114.1	T1001 E1074 Q1095	T1001-Y1097 HydrophobicContact CG2-CE1 3.89Å; E1074-Y1097 WeakPolarHBondContact CB-OH 2.98Å; E1074-Y1097 WeakPolarHBondContact CG-OH 3.38Å; Q1095-Y1097 PolarHBondContact O-N 2.88Å
1098	D	82.4	Confident	86.1	Confident	60 Å²	60	77.6 Å²	77.6	32%	0.321	39%	0.39	S	S	.	.	S	Bend	trans	-99.3	-4	176.7	55.5	5	0	0	0	112.8	L1073 E1074 S1075	L1073-D1098 HydrophobicContact CD2-CB 4.4Å; E1074-D1098 PolarHBondContact N-OD2 2.89Å; S1075-D1098 WeakPolarHBondContact CB-OD1 3.33Å; S1075-D1098 PolarHBondContact N-OD2 3.44Å; S1075-D1098 PolarHBondContact OG-OD1 3.11Å; S1075-D1098 PolarHBondContact OG-OD2 3.36Å
1099	L	81.1	Confident	85.9	Confident	72 Å²	72	81.3 Å²	81.3	38%	0.377	41%	0.409	S	S	.	.	S	Bend	trans	-117.4	128.1	177.2	-169.3	73	0	0	0	110.1	F601 L1073	F601-L1099 HydrophobicContact CE2-CD1 4.23Å; F601-L1099 HydrophobicContact CZ-CD1 4.08Å; L1073-L1099 HydrophobicContact CD1-CD1 4.35Å
1100	L	80.9	Confident	85.9	Confident	93 Å²	93	83.6 Å²	83.6	49%	0.487	43%	0.428	S	S	.	.			trans	-70.6	143.5	168.3	-69.8	170.3	0	0	0	109.5	F1104 Y1106	L1100-F1104 HydrophobicContact CB-CG 4.5Å; L1100-F1104 HydrophobicContact CD1-CD1 4.08Å; L1100-F1104 HydrophobicContact CD1-CE1 3.93Å; L1100-F1104 HydrophobicContact CD1-CZ 4.28Å; L1100-F1104 HydrophobicContact CD2-CD2 4.08Å; L1100-F1104 HydrophobicContact CD2-CE1 4.46Å; L1100-F1104 HydrophobicContact CD2-CE2 3.92Å; L1100-F1104 HydrophobicContact CD2-CG 4.4Å; L1100-F1104 HydrophobicContact CD2-CZ 4.08Å; L1100-Y1106 HydrophobicContact CD1-CE1 3.98Å
1101	K	77	Confident	86.1	Confident	144 Å²	144	84.4 Å²	84.4	63%	0.626	44%	0.442	S	S	*	.			trans	-64.8	153.4	176.6	-60.2	-174.9	175.6	-173.4	0	111.4	D1103 F1104	K1101-D1103 VanDerWaalsContact C-N 3.25Å; K1101-D1103 WeakPolarHBondContact CB-OD1 3.46Å; K1101-D1103 PolarHBondContact O-N 2.96Å; K1101-F1104 WeakPolarHBondContact O-CB 3.05Å; K1101-F1104 PolarHBondContact O-N 3.04Å; K1101-F1104 VanDerWaalsContact O-N 3.15Å
1102	E	72.6	Confident	86.3	Confident	162 Å²	162	88.7 Å²	88.7	76%	0.757	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-29.3	-179.9	-64.3	-177.5	164.2	0	0	113	F1104	E1102-F1104 PolarHBondContact O-N 2.73Å
1103	D	77.5	Confident	86.5	Confident	130 Å²	130	90.2 Å²	90.2	70%	0.695	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	4.3	177	66	-26.6	0	0	0	113.7	K1101 D1105	K1101-D1103 VanDerWaalsContact C-N 3.25Å; K1101-D1103 WeakPolarHBondContact CB-OD1 3.46Å; K1101-D1103 PolarHBondContact O-N 2.96Å; D1103-D1105 PolarHBondContact O-N 3.5Å
1104	F	83.3	Confident	86.9	Confident	72 Å²	72	94.2 Å²	94.2	32%	0.316	50%	0.495	S	S	.	.			trans	-65	122.7	178.5	-173.1	-99.9	0	0	0	111.2	L1100 K1101 E1102 Y1106 I1109	L1100-F1104 HydrophobicContact CB-CG 4.5Å; L1100-F1104 HydrophobicContact CD1-CD1 4.08Å; L1100-F1104 HydrophobicContact CD1-CE1 3.93Å; L1100-F1104 HydrophobicContact CD1-CZ 4.28Å; L1100-F1104 HydrophobicContact CD2-CD2 4.08Å; L1100-F1104 HydrophobicContact CD2-CE1 4.46Å; L1100-F1104 HydrophobicContact CD2-CE2 3.92Å; L1100-F1104 HydrophobicContact CD2-CG 4.4Å; L1100-F1104 HydrophobicContact CD2-CZ 4.08Å; K1101-F1104 WeakPolarHBondContact O-CB 3.05Å; K1101-F1104 PolarHBondContact O-N 3.04Å; K1101-F1104 VanDerWaalsContact O-N 3.15Å; E1102-F1104 PolarHBondContact O-N 2.73Å; F1104-Y1106 VanDerWaalsContact C-N 3.31Å; F1104-Y1106 HydrophobicContact CB-CE2 4.14Å; F1104-Y1106 AromaticContact CD1-CD1 3.73Å; F1104-Y1106 HydrophobicContact CD1-CD1 3.73Å; F1104-Y1106 HydrophobicContact CD1-CD2 4.25Å; F1104-Y1106 AromaticContact CD1-CE1 3.63Å; F1104-Y1106 HydrophobicContact CD1-CE1 3.63Å; F1104-Y1106 HydrophobicContact CD1-CE2 4.14Å; F1104-Y1106 HydrophobicContact CD1-CG 4.04Å; F1104-Y1106 AromaticContact CD1-CZ 3.83Å; F1104-Y1106 HydrophobicContact CE1-CD1 4.08Å; F1104-Y1106 HydrophobicContact CE1-CE1 4.13Å; F1104-Y1106 WeakPolarHBondContact O-CD2 3.41Å; F1104-Y1106 WeakPolarHBondContact O-CE2 3.41Å; F1104-Y1106 PolarHBondContact O-N 3.19Å; F1104-I1109 HydrophobicContact CD1-CD1 4.46Å; F1104-I1109 HydrophobicContact CE1-CD1 3.48Å; F1104-I1109 VanDerWaalsContact CE1-CD1 3.48Å; F1104-I1109 HydrophobicContact CE2-CD1 3.75Å; F1104-I1109 HydrophobicContact CZ-CD1 3.07Å
1105	D	89.1	Confident	87.3	Confident	85 Å²	85	93.8 Å²	93.8	46%	0.455	50%	0.498	S	S	.	.			trans	-77.4	80.5	-177.9	-168.3	-11.6	0	0	0	111.9	D1103 T1107 A1108 I1109	D1103-D1105 PolarHBondContact O-N 3.5Å; D1105-T1107 PolarHBondContact O-N 3.37Å; D1105-T1107 WeakPolarHBondContact OD1-CA 3.45Å; D1105-T1107 WeakPolarHBondContact OD1-CB 3.31Å; D1105-T1107 PolarHBondContact OD1-N 3.42Å; D1105-T1107 PolarHBondContact OD1-OG1 3.09Å; D1105-A1108 HydrophobicContact CB-CB 4.11Å; D1105-A1108 VanDerWaalsContact CG-CB 3.42Å; D1105-A1108 PolarHBondContact O-N 3.08Å; D1105-A1108 PolarHBondContact OD1-N 3.39Å; D1105-A1108 VanDerWaalsContact OD2-CB 3.25Å; D1105-A1108 WeakPolarHBondContact OD2-CB 3.33Å; D1105-I1109 PolarHBondContact O-N 3.45Å
1106	Y	87.5	Confident	87.8	Confident	131 Å²	131	92.4 Å²	92.4	51%	0.514	49%	0.493	S	S	.	.	H	α-helix	trans	-55.7	-32	173.9	-62.9	-81.3	0	0	0	111.9	L1100 F1104 A1110	L1100-Y1106 HydrophobicContact CD1-CE1 3.98Å; F1104-Y1106 VanDerWaalsContact C-N 3.31Å; F1104-Y1106 HydrophobicContact CB-CE2 4.14Å; F1104-Y1106 AromaticContact CD1-CD1 3.73Å; F1104-Y1106 HydrophobicContact CD1-CD1 3.73Å; F1104-Y1106 HydrophobicContact CD1-CD2 4.25Å; F1104-Y1106 AromaticContact CD1-CE1 3.63Å; F1104-Y1106 HydrophobicContact CD1-CE1 3.63Å; F1104-Y1106 HydrophobicContact CD1-CE2 4.14Å; F1104-Y1106 HydrophobicContact CD1-CG 4.04Å; F1104-Y1106 AromaticContact CD1-CZ 3.83Å; F1104-Y1106 HydrophobicContact CE1-CD1 4.08Å; F1104-Y1106 HydrophobicContact CE1-CE1 4.13Å; F1104-Y1106 WeakPolarHBondContact O-CD2 3.41Å; F1104-Y1106 WeakPolarHBondContact O-CE2 3.41Å; F1104-Y1106 PolarHBondContact O-N 3.19Å; Y1106-A1110 WeakPolarHBondContact O-CB 3.24Å; Y1106-A1110 PolarHBondContact O-N 2.93Å
1107	T	90.2	Very high	88.5	Confident	102 Å²	102	94.1 Å²	94.1	63%	0.626	50%	0.499	S	S	*	.	H	α-helix	trans	-74.7	-42	-175.4	70.5	0	0	0	0	112.1	D1105 A1110 T1111	D1105-T1107 PolarHBondContact O-N 3.37Å; D1105-T1107 WeakPolarHBondContact OD1-CA 3.45Å; D1105-T1107 WeakPolarHBondContact OD1-CB 3.31Å; D1105-T1107 PolarHBondContact OD1-N 3.42Å; D1105-T1107 PolarHBondContact OD1-OG1 3.09Å; T1107-A1110 PolarHBondContact O-N 3.34Å; T1107-T1111 WeakPolarHBondContact O-CB 3.5Å; T1107-T1111 VanDerWaalsContact O-CG2 3.23Å; T1107-T1111 WeakPolarHBondContact O-CG2 3.41Å; T1107-T1111 PolarHBondContact O-N 2.87Å; T1107-T1111 PolarHBondContact O-OG1 3.01Å
1108	A	92.9	Very high	89	Confident	38 Å²	38	92.5 Å²	92.5	31%	0.314	50%	0.498	S	S	.	.	H	α-helix	trans	-62.4	-45.7	174.9	0	0	0	0	0	111	D1105 T1111 V1112	D1105-A1108 HydrophobicContact CB-CB 4.11Å; D1105-A1108 VanDerWaalsContact CG-CB 3.42Å; D1105-A1108 PolarHBondContact O-N 3.08Å; D1105-A1108 PolarHBondContact OD1-N 3.39Å; D1105-A1108 VanDerWaalsContact OD2-CB 3.25Å; D1105-A1108 WeakPolarHBondContact OD2-CB 3.33Å; A1108-T1111 WeakPolarHBondContact CA-OG1 3.26Å; A1108-T1111 PolarHBondContact O-N 2.82Å; A1108-T1111 PolarHBondContact O-OG1 2.85Å; A1108-V1112 WeakPolarHBondContact O-CB 3.39Å; A1108-V1112 VanDerWaalsContact O-CG2 3.23Å; A1108-V1112 WeakPolarHBondContact O-CG2 3.26Å; A1108-V1112 PolarHBondContact O-N 3.37Å
1109	I	92.1	Very high	89.7	Confident	81 Å²	81	92.1 Å²	92.1	42%	0.415	50%	0.503	S	S	.	.	H	α-helix	trans	-68.6	-40.7	-179.8	-69.1	167.3	0	0	0	111.1	F1104 D1105 T1113	F1104-I1109 HydrophobicContact CD1-CD1 4.46Å; F1104-I1109 HydrophobicContact CE1-CD1 3.48Å; F1104-I1109 VanDerWaalsContact CE1-CD1 3.48Å; F1104-I1109 HydrophobicContact CE2-CD1 3.75Å; F1104-I1109 HydrophobicContact CZ-CD1 3.07Å; D1105-I1109 PolarHBondContact O-N 3.45Å; I1109-T1113 HydrophobicContact CG2-CG2 4.34Å; I1109-T1113 WeakPolarHBondContact O-CB 3.39Å; I1109-T1113 VanDerWaalsContact O-CG2 3.26Å; I1109-T1113 WeakPolarHBondContact O-CG2 3.46Å; I1109-T1113 PolarHBondContact O-N 2.76Å; I1109-T1113 PolarHBondContact O-OG1 3.4Å
1110	A	94	Very high	90.4	Very high	53 Å²	53	92.3 Å²	92.3	44%	0.438	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-41.3	175	0	0	0	0	0	112.3	Y1106 T1107 T1113 L1114	Y1106-A1110 WeakPolarHBondContact O-CB 3.24Å; Y1106-A1110 PolarHBondContact O-N 2.93Å; T1107-A1110 PolarHBondContact O-N 3.34Å; A1110-T1113 WeakPolarHBondContact CA-OG1 3.42Å; A1110-T1113 PolarHBondContact O-OG1 3.05Å; A1110-L1114 VanDerWaalsContact O-CB 3.25Å; A1110-L1114 WeakPolarHBondContact O-CB 3.35Å; A1110-L1114 PolarHBondContact O-N 2.96Å
1111	T	94.8	Very high	91	Very high	91 Å²	91	92.1 Å²	92.1	56%	0.558	51%	0.509	S	S	*	.	H	α-helix	trans	-70.7	-39.8	178.8	51.3	0	0	0	0	112.3	T1107 A1108 G1115	T1107-T1111 WeakPolarHBondContact O-CB 3.5Å; T1107-T1111 VanDerWaalsContact O-CG2 3.23Å; T1107-T1111 WeakPolarHBondContact O-CG2 3.41Å; T1107-T1111 PolarHBondContact O-N 2.87Å; T1107-T1111 PolarHBondContact O-OG1 3.01Å; A1108-T1111 WeakPolarHBondContact CA-OG1 3.26Å; A1108-T1111 PolarHBondContact O-N 2.82Å; A1108-T1111 PolarHBondContact O-OG1 2.85Å; T1111-G1115 PolarHBondContact O-N 3.14Å
1112	V	96.3	Very high	91.9	Very high	96 Å²	96	88.7 Å²	88.7	58%	0.582	50%	0.5	S	S	*	.	H	α-helix	trans	-65.2	-45.3	174.5	171.1	0	0	0	0	110.9	A1108 G1115 M1116	A1108-V1112 WeakPolarHBondContact O-CB 3.39Å; A1108-V1112 VanDerWaalsContact O-CG2 3.23Å; A1108-V1112 WeakPolarHBondContact O-CG2 3.26Å; A1108-V1112 PolarHBondContact O-N 3.37Å; V1112-G1115 PolarHBondContact O-N 3.43Å; V1112-M1116 HydrophobicContact CG1-CG 4.45Å; V1112-M1116 WeakPolarHBondContact O-CB 3.04Å; V1112-M1116 VanDerWaalsContact O-CG 3.29Å; V1112-M1116 WeakPolarHBondContact O-CG 3.49Å; V1112-M1116 PolarHBondContact O-N 2.84Å
1113	T	95.8	Very high	92.9	Very high	74 Å²	74	84.1 Å²	84.1	45%	0.454	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-43.8	177.4	49.9	0	0	0	0	111.7	I1109 A1110 M1116 I1117	I1109-T1113 HydrophobicContact CG2-CG2 4.34Å; I1109-T1113 WeakPolarHBondContact O-CB 3.39Å; I1109-T1113 VanDerWaalsContact O-CG2 3.26Å; I1109-T1113 WeakPolarHBondContact O-CG2 3.46Å; I1109-T1113 PolarHBondContact O-N 2.76Å; I1109-T1113 PolarHBondContact O-OG1 3.4Å; A1110-T1113 WeakPolarHBondContact CA-OG1 3.42Å; A1110-T1113 PolarHBondContact O-OG1 3.05Å; T1113-M1116 PolarHBondContact O-N 2.76Å; T1113-I1117 VanDerWaalsContact O-CG1 3.3Å; T1113-I1117 WeakPolarHBondContact O-CG1 3.43Å; T1113-I1117 PolarHBondContact O-N 2.8Å
1114	L	95.9	Very high	93.7	Very high	101 Å²	101	81.6 Å²	81.6	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-62.6	-43.2	173.9	-175.1	65.9	0	0	0	111.9	A1110 M1116 I1117 I1118	A1110-L1114 VanDerWaalsContact O-CB 3.25Å; A1110-L1114 WeakPolarHBondContact O-CB 3.35Å; A1110-L1114 PolarHBondContact O-N 2.96Å; L1114-M1116 VanDerWaalsContact C-N 3.33Å; L1114-M1116 PolarHBondContact O-N 3.11Å; L1114-I1117 PolarHBondContact O-N 2.84Å; L1114-I1118 HydrophobicContact CD1-CD1 4.44Å; L1114-I1118 HydrophobicContact CG-CD1 4.05Å; L1114-I1118 WeakPolarHBondContact O-CG1 3.39Å; L1114-I1118 PolarHBondContact O-N 3.24Å
1115	G	96.7	Very high	94.1	Very high	36 Å²	36	87.1 Å²	87.1	37%	0.371	50%	0.496	S	S	.	.	H	α-helix	trans	-60	-42.1	175.8	0	0	0	0	0	112.3	T1111 V1112 I1118 A1119	T1111-G1115 PolarHBondContact O-N 3.14Å; V1112-G1115 PolarHBondContact O-N 3.43Å; G1115-I1118 PolarHBondContact O-N 3.12Å; G1115-A1119 VanDerWaalsContact O-CB 3.23Å; G1115-A1119 WeakPolarHBondContact O-CB 3.31Å; G1115-A1119 PolarHBondContact O-N 2.63Å
1116	M	96.6	Very high	94.2	Very high	131 Å²	131	87.4 Å²	87.4	65%	0.645	50%	0.497	S	S	*	.	H	α-helix	trans	-66	-39.4	174.8	-73.6	-64.4	-69.7	0	0	112.3	V1112 T1113 L1114 A1119 S1120	V1112-M1116 HydrophobicContact CG1-CG 4.45Å; V1112-M1116 WeakPolarHBondContact O-CB 3.04Å; V1112-M1116 VanDerWaalsContact O-CG 3.29Å; V1112-M1116 WeakPolarHBondContact O-CG 3.49Å; V1112-M1116 PolarHBondContact O-N 2.84Å; T1113-M1116 PolarHBondContact O-N 2.76Å; L1114-M1116 VanDerWaalsContact C-N 3.33Å; L1114-M1116 PolarHBondContact O-N 3.11Å; M1116-A1119 PolarHBondContact O-N 2.87Å; M1116-S1120 VanDerWaalsContact O-CB 3.23Å; M1116-S1120 WeakPolarHBondContact O-CB 3.48Å; M1116-S1120 PolarHBondContact O-N 2.85Å
1117	I	96.6	Very high	94.3	Very high	98 Å²	98	84 Å²	84	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-48	174.1	-69.7	165.2	0	0	0	110.2	T1113 L1114 S1120 I1121	T1113-I1117 VanDerWaalsContact O-CG1 3.3Å; T1113-I1117 WeakPolarHBondContact O-CG1 3.43Å; T1113-I1117 PolarHBondContact O-N 2.8Å; L1114-I1117 PolarHBondContact O-N 2.84Å; I1117-S1120 WeakPolarHBondContact O-CB 3.2Å; I1117-S1120 PolarHBondContact O-N 3.46Å; I1117-I1121 HydrophobicContact CG2-CD1 3.9Å; I1117-I1121 VanDerWaalsContact O-CG1 3.32Å; I1117-I1121 WeakPolarHBondContact O-CG1 3.47Å; I1117-I1121 PolarHBondContact O-N 3.45Å
1118	I	95.9	Very high	94.4	Very high	93 Å²	93	82.7 Å²	82.7	48%	0.477	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-45.9	178.1	-66.4	167	0	0	0	110.5	L1114 G1115 S1120 I1121 V1122	L1114-I1118 HydrophobicContact CD1-CD1 4.44Å; L1114-I1118 HydrophobicContact CG-CD1 4.05Å; L1114-I1118 WeakPolarHBondContact O-CG1 3.39Å; L1114-I1118 PolarHBondContact O-N 3.24Å; G1115-I1118 PolarHBondContact O-N 3.12Å; I1118-S1120 VanDerWaalsContact C-N 3.29Å; I1118-S1120 PolarHBondContact O-N 2.89Å; I1118-I1121 PolarHBondContact O-N 2.88Å; I1118-V1122 HydrophobicContact CG2-CG2 4.21Å; I1118-V1122 WeakPolarHBondContact O-CB 3.34Å; I1118-V1122 VanDerWaalsContact O-CG2 3.3Å; I1118-V1122 WeakPolarHBondContact O-CG2 3.37Å; I1118-V1122 PolarHBondContact O-N 2.75Å
1119	A	96	Very high	94.1	Very high	52 Å²	52	88.8 Å²	88.8	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-38.3	177.2	0	0	0	0	0	111.9	G1115 M1116 S1123	G1115-A1119 VanDerWaalsContact O-CB 3.23Å; G1115-A1119 WeakPolarHBondContact O-CB 3.31Å; G1115-A1119 PolarHBondContact O-N 2.63Å; M1116-A1119 PolarHBondContact O-N 2.87Å; A1119-S1123 WeakPolarHBondContact O-CB 3.31Å; A1119-S1123 PolarHBondContact O-N 3.41Å; A1119-S1123 PolarHBondContact O-OG 3.39Å
1120	S	95.8	Very high	93.8	Very high	75 Å²	75	93 Å²	93	52%	0.524	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-45.7	174.1	-173.8	0	0	0	0	111.7	M1116 I1117 I1118 V1122 S1123 C1124	M1116-S1120 VanDerWaalsContact O-CB 3.23Å; M1116-S1120 WeakPolarHBondContact O-CB 3.48Å; M1116-S1120 PolarHBondContact O-N 2.85Å; I1117-S1120 WeakPolarHBondContact O-CB 3.2Å; I1117-S1120 PolarHBondContact O-N 3.46Å; I1118-S1120 VanDerWaalsContact C-N 3.29Å; I1118-S1120 PolarHBondContact O-N 2.89Å; S1120-V1122 PolarHBondContact O-N 2.87Å; S1120-S1123 WeakPolarHBondContact CA-OG 3.15Å; S1120-S1123 PolarHBondContact O-OG 3.11Å; S1120-C1124 VanDerWaalsContact O-CB 3.24Å; S1120-C1124 WeakPolarHBondContact O-CB 3.34Å; S1120-C1124 PolarHBondContact O-N 3.47Å
1121	I	95.2	Very high	93.6	Very high	89 Å²	89	93.2 Å²	93.2	46%	0.456	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-44.1	176.3	-65.8	166.1	0	0	0	111.3	I1117 I1118 C1124 R1125	I1117-I1121 HydrophobicContact CG2-CD1 3.9Å; I1117-I1121 VanDerWaalsContact O-CG1 3.32Å; I1117-I1121 WeakPolarHBondContact O-CG1 3.47Å; I1117-I1121 PolarHBondContact O-N 3.45Å; I1118-I1121 PolarHBondContact O-N 2.88Å; I1121-C1124 PolarHBondContact O-N 2.99Å; I1121-R1125 PolarHBondContact O-N 2.85Å
1122	V	94.9	Very high	93.2	Very high	73 Å²	73	93.5 Å²	93.5	44%	0.442	51%	0.512	S	S	.	.	H	α-helix	trans	-67.3	-44.9	180	171.3	0	0	0	0	111.2	I1118 S1120 C1124 R1125 L1126	I1118-V1122 HydrophobicContact CG2-CG2 4.21Å; I1118-V1122 WeakPolarHBondContact O-CB 3.34Å; I1118-V1122 VanDerWaalsContact O-CG2 3.3Å; I1118-V1122 WeakPolarHBondContact O-CG2 3.37Å; I1118-V1122 PolarHBondContact O-N 2.75Å; S1120-V1122 PolarHBondContact O-N 2.87Å; V1122-C1124 VanDerWaalsContact C-N 3.34Å; V1122-C1124 PolarHBondContact O-N 2.7Å; V1122-R1125 PolarHBondContact O-N 2.85Å; V1122-L1126 HydrophobicContact CG1-CD1 3.9Å; V1122-L1126 HydrophobicContact CG1-CG 4.32Å; V1122-L1126 WeakPolarHBondContact O-CB 3.26Å; V1122-L1126 WeakPolarHBondContact O-CG 3.44Å; V1122-L1126 PolarHBondContact O-N 3Å
1123	S	93.7	Very high	92.8	Very high	66 Å²	66	93.7 Å²	93.7	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-39.4	177.1	58.8	0	0	0	0	111.6	A1119 S1120 L1126 A1127	A1119-S1123 WeakPolarHBondContact O-CB 3.31Å; A1119-S1123 PolarHBondContact O-N 3.41Å; A1119-S1123 PolarHBondContact O-OG 3.39Å; S1120-S1123 WeakPolarHBondContact CA-OG 3.15Å; S1120-S1123 PolarHBondContact O-OG 3.11Å; S1123-L1126 PolarHBondContact O-N 3.27Å; S1123-A1127 WeakPolarHBondContact O-CB 3.49Å; S1123-A1127 PolarHBondContact O-N 3.38Å
1124	C	93.9	Very high	92.2	Very high	76 Å²	76	99.3 Å²	99.3	51%	0.514	52%	0.522	S	S	.	.	H	α-helix	trans	-60.4	-44.9	171.9	-173.7	0	0	0	0	112	S1120 I1121 V1122 A1127 T1128	S1120-C1124 VanDerWaalsContact O-CB 3.24Å; S1120-C1124 WeakPolarHBondContact O-CB 3.34Å; S1120-C1124 PolarHBondContact O-N 3.47Å; I1121-C1124 PolarHBondContact O-N 2.99Å; V1122-C1124 VanDerWaalsContact C-N 3.34Å; V1122-C1124 PolarHBondContact O-N 2.7Å; C1124-A1127 PolarHBondContact O-N 3.38Å; C1124-T1128 WeakPolarHBondContact O-CG2 3.28Å; C1124-T1128 PolarHBondContact O-N 3Å; C1124-T1128 PolarHBondContact O-OG1 3.05Å
1125	R	91.7	Very high	91.7	Very high	188 Å²	188	98.5 Å²	98.5	71%	0.709	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-38.6	175.2	-77.1	-171	175.1	174.5	0.6	113.6	I1121 V1122 T1128 R1129	I1121-R1125 PolarHBondContact O-N 2.85Å; V1122-R1125 PolarHBondContact O-N 2.85Å; R1125-T1128 VanDerWaalsContact CA-OG1 3.31Å; R1125-T1128 WeakPolarHBondContact CA-OG1 3.44Å; R1125-T1128 PolarHBondContact O-OG1 2.73Å; R1125-R1129 WeakPolarHBondContact O-CB 3.33Å; R1125-R1129 PolarHBondContact O-N 2.89Å
1126	L	91.1	Very high	91.2	Very high	92 Å²	92	107.3 Å²	107.3	48%	0.482	55%	0.553	S	S	.	*	H	α-helix	trans	-70.9	-38.2	176.7	-73.5	173.3	0	0	0	111.9	V1122 S1123 R1129 R1130	V1122-L1126 HydrophobicContact CG1-CD1 3.9Å; V1122-L1126 HydrophobicContact CG1-CG 4.32Å; V1122-L1126 WeakPolarHBondContact O-CB 3.26Å; V1122-L1126 WeakPolarHBondContact O-CG 3.44Å; V1122-L1126 PolarHBondContact O-N 3Å; S1123-L1126 PolarHBondContact O-N 3.27Å; L1126-R1129 PolarHBondContact O-N 2.98Å; L1126-R1130 WeakPolarHBondContact O-CB 3.47Å; L1126-R1130 WeakPolarHBondContact O-CG 3.48Å; L1126-R1130 PolarHBondContact O-N 3.36Å
1127	A	90.7	Very high	90.3	Very high	59 Å²	59	107.4 Å²	107.4	49%	0.488	58%	0.575	S	S	.	*	H	α-helix	trans	-63.7	-47.2	175.7	0	0	0	0	0	111.1	S1123 C1124 R1129 R1130 A1131	S1123-A1127 WeakPolarHBondContact O-CB 3.49Å; S1123-A1127 PolarHBondContact O-N 3.38Å; C1124-A1127 PolarHBondContact O-N 3.38Å; A1127-R1129 PolarHBondContact O-N 2.86Å; A1127-R1130 PolarHBondContact O-N 2.99Å; A1127-A1131 WeakPolarHBondContact O-CB 3.24Å; A1127-A1131 PolarHBondContact O-N 2.82Å
1128	T	91.4	Very high	90	Very high	74 Å²	74	107.9 Å²	107.9	45%	0.454	58%	0.578	S	S	.	*	H	α-helix	trans	-61.8	-42.4	175.1	48.4	0	0	0	0	112	C1124 R1125 A1131 I1132	C1124-T1128 WeakPolarHBondContact O-CG2 3.28Å; C1124-T1128 PolarHBondContact O-N 3Å; C1124-T1128 PolarHBondContact O-OG1 3.05Å; R1125-T1128 VanDerWaalsContact CA-OG1 3.31Å; R1125-T1128 WeakPolarHBondContact CA-OG1 3.44Å; R1125-T1128 PolarHBondContact O-OG1 2.73Å; T1128-A1131 PolarHBondContact O-N 3.18Å; T1128-I1132 WeakPolarHBondContact O-CG1 3.32Å; T1128-I1132 PolarHBondContact O-N 2.81Å
1129	R	87.1	Confident	89.6	Confident	166 Å²	166	108.7 Å²	108.7	63%	0.626	58%	0.584	S	S	*	*	H	α-helix	trans	-63.1	-43.1	174.3	-174	179.5	177	-172.4	-0.1	112.8	R1125 L1126 A1127 A1131 I1132 L1133	R1125-R1129 WeakPolarHBondContact O-CB 3.33Å; R1125-R1129 PolarHBondContact O-N 2.89Å; L1126-R1129 PolarHBondContact O-N 2.98Å; A1127-R1129 PolarHBondContact O-N 2.86Å; R1129-A1131 VanDerWaalsContact C-N 3.33Å; R1129-I1132 PolarHBondContact O-N 3.24Å; R1129-L1133 HydrophobicContact CG-CD1 4.32Å; R1129-L1133 WeakPolarHBondContact O-CG 3.33Å; R1129-L1133 PolarHBondContact O-N 2.96Å
1130	R	86.5	Confident	89.3	Confident	171 Å²	171	111.8 Å²	111.8	65%	0.645	59%	0.592	S	S	*	*	H	α-helix	trans	-64.2	-38.7	175.9	-80.7	-178.1	175.2	177.6	-0.4	111.7	L1126 A1127 L1133 R1134	L1126-R1130 WeakPolarHBondContact O-CB 3.47Å; L1126-R1130 WeakPolarHBondContact O-CG 3.48Å; L1126-R1130 PolarHBondContact O-N 3.36Å; A1127-R1130 PolarHBondContact O-N 2.99Å; R1130-L1133 PolarHBondContact O-N 2.8Å; R1130-R1134 WeakPolarHBondContact O-CG 3.39Å; R1130-R1134 PolarHBondContact O-N 3.21Å
1131	A	88.3	Confident	88.9	Confident	57 Å²	57	114 Å²	114	47%	0.471	60%	0.596	S	S	.	*	H	α-helix	trans	-62.5	-43.8	174.3	0	0	0	0	0	111.3	A1127 T1128 R1129 R1134 A1135	A1127-A1131 WeakPolarHBondContact O-CB 3.24Å; A1127-A1131 PolarHBondContact O-N 2.82Å; T1128-A1131 PolarHBondContact O-N 3.18Å; R1129-A1131 VanDerWaalsContact C-N 3.33Å; A1131-R1134 PolarHBondContact O-N 3.49Å; A1131-A1135 PolarHBondContact O-N 3Å; A1131-A1135 VanDerWaalsContact O-N 3.08Å
1132	I	86.9	Confident	88.5	Confident	97 Å²	97	115.6 Å²	115.6	50%	0.497	61%	0.605	S	S	.	*	H	α-helix	trans	-62.2	-48	174.7	-69.2	167.3	0	0	0	111	T1128 R1129 R1134 A1135 W1136	T1128-I1132 WeakPolarHBondContact O-CG1 3.32Å; T1128-I1132 PolarHBondContact O-N 2.81Å; R1129-I1132 PolarHBondContact O-N 3.24Å; I1132-R1134 VanDerWaalsContact C-N 3.3Å; I1132-R1134 PolarHBondContact O-N 3.5Å; I1132-A1135 WeakPolarHBondContact O-CA 3.36Å; I1132-A1135 WeakPolarHBondContact O-CB 3.4Å; I1132-A1135 PolarHBondContact O-N 3.12Å; I1132-W1136 VanDerWaalsContact O-CD1 3.25Å; I1132-W1136 PolarHBondContact O-N 3.05Å
1133	L	88.1	Confident	88.1	Confident	100 Å²	100	118.4 Å²	118.4	52%	0.524	62%	0.616	S	S	.	*	H	α-helix	trans	-60	-38.2	178.9	-77.6	167.9	0	0	0	112.8	R1129 R1130 A1135 W1136 A1137	R1129-L1133 HydrophobicContact CG-CD1 4.32Å; R1129-L1133 WeakPolarHBondContact O-CG 3.33Å; R1129-L1133 PolarHBondContact O-N 2.96Å; R1130-L1133 PolarHBondContact O-N 2.8Å; L1133-A1135 VanDerWaalsContact C-N 3.27Å; L1133-A1135 PolarHBondContact O-N 2.82Å; L1133-W1136 PolarHBondContact O-N 3.2Å; L1133-A1137 PolarHBondContact O-N 2.86Å
1134	R	84.1	Confident	87.7	Confident	191 Å²	191	122.1 Å²	122.1	72%	0.721	63%	0.627	S	S	*	*	H	α-helix	trans	-71	-19.6	173.1	-74	-177	-167.7	145.8	-1.5	114.1	R1130 A1131 I1132 A1137	R1130-R1134 WeakPolarHBondContact O-CG 3.39Å; R1130-R1134 PolarHBondContact O-N 3.21Å; A1131-R1134 PolarHBondContact O-N 3.49Å; I1132-R1134 VanDerWaalsContact C-N 3.3Å; I1132-R1134 PolarHBondContact O-N 3.5Å; R1134-A1137 VanDerWaalsContact O-OXT 3.09Å
1135	A	84.7	Confident	87.2	Confident	85 Å²	85	125.7 Å²	125.7	70%	0.702	64%	0.635	S	S	*	*	H	α-helix	trans	-84.8	-23.6	173.6	0	0	0	0	0	111.9	A1131 I1132 L1133	A1131-A1135 PolarHBondContact O-N 3Å; A1131-A1135 VanDerWaalsContact O-N 3.08Å; I1132-A1135 WeakPolarHBondContact O-CA 3.36Å; I1132-A1135 WeakPolarHBondContact O-CB 3.4Å; I1132-A1135 PolarHBondContact O-N 3.12Å; L1133-A1135 VanDerWaalsContact C-N 3.27Å; L1133-A1135 PolarHBondContact O-N 2.82Å
1136	W	86	Confident	86.8	Confident	220 Å²	220	120.5 Å²	120.5	83%	0.833	63%	0.629	S	S	*	*	H	α-helix	trans	-85	-36.7	174.5	-82.4	99.8	0	0	0	113.6	I1132 L1133	I1132-W1136 VanDerWaalsContact O-CD1 3.25Å; I1132-W1136 PolarHBondContact O-N 3.05Å; L1133-W1136 PolarHBondContact O-N 3.2Å
1137	A	77.1	Confident	86.4	Confident	134 Å²	134	123.1 Å²	123.1	100%	1.107	64%	0.643	S	S	*	*			trans	-75.6	0	170.5	0	0	0	0	0	110.3	L1133 R1134	L1133-A1137 PolarHBondContact O-N 2.86Å; R1134-A1137 VanDerWaalsContact O-OXT 3.09Å

Retrieved 1,137 of 1,137 residues in 603.2 ms (Link to these results)

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