A0A077Z5Q9_TRITR Loading...

histone acetyltransferase

AlphaFold DB , UniProt , Accession A0A077Z5Q9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,042 aa.

						>A0A077Z5Q9_TRITR|A0A077Z5Q9
MNAHGSAQAGRSEDNGVDSDAPPDMEIVSQLLTVIASIKYHRQQVSLERLKSKSRVLGLNSSVIEKQLELAVKHGLILKLLGVNGLWSYADPNNVNIGRFRTLQVDEKTDLARIVQRVVRDIDNCNGSNLSEIEVYVRDYYDMRVKGDLTLCQLLRDAVTKAVDQGLLVPVNGDRYQLPYKGAASSSSNGAKHSSSMSKKKSGTTLTRCYLCKGSKRWNQDGLSEGLLTCCSCRKRAHPSCLHLTPELADRLFATSSWHCSTCKVCTLCRKPVHATSLRCDGCDKGYHKACLSSLTKEKADSNKAGACKADRDKVREKKIIREAARNVKSRYKKSRGRPFAGKREEAEQPSAMTPTSFDDLDRDEGRGALSPIDCLDSNLPQICAPTNKCGTFVQPDVSGCPQPFVDEKGVSVAPKICADLNVTKDNWSEPTVQPFGDTAKLSSPAKWSARLRPRLPPENGLDAHSSVGNDRCRSRTCKSLISQLRAATRGRYVRRSHRQPKLVSFEDLVTKEDEVLFKECQRKASHNFSLCKLDVKLPYPRAIVIGKWVIDSWFSAPYPQEYARLNKLYVCEFCLKYMKSNDVLTRHIVLKKCKLFHPPGDEIYRKDSLSFFEVDGCKAKIYCQNLCLLAKVYLDHKTLYYDVEPFLFYVLTMNDAYGCHLVGYFSKEKYSSQKFNVSCIVTLPPYQNKGFGRLQIAFSYLLSRKEGEVGTPEKPLSELGRFSYTSYWKSAIFEFFDKNRDMKACNIKQISETTGMTPVDIVETMQSLNMILLQGNSLKFVIDWDAIDSYMKRARNDPKRSLLACSLPKEEEVAASADSSSQLLRQEDHSNASIDASAADRLVPPCSSESATLNGPPSLREQDEEEQANQTYATPTTPTTKKGGGRRRKRRKGKIRSEVQSRDLTLESFDSDSDSSHVRTRARKRQSCHEAVRHRSFGGSSPDSSDSSKQMGPSKKVDGTGKLSGAQTSASANSASKSTNKARGGSTQCRVAKAPQEQGSRTVMFLVGKGLLLPVVASFLVVFVCLDSTTLIPQGADAWKR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure 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	38.4	Very low	35.4	Very low	237 Å²	237	147.9 Å²	147.9	100%	1.167	89%	0.885	S	S	*	*				0	150	0	-74	172.8	165.5	0	0	108.6
2	N	35.8	Very low	35.2	Very low	160 Å²	160	145.2 Å²	145.2	86%	0.856	88%	0.878	S	S	*	*			trans	15.5	139.7	153.6	-57.6	10.7	0	0	0	119.9
3	A	35.3	Very low	35.3	Very low	94 Å²	94	147.6 Å²	147.6	78%	0.777	87%	0.874	S	S	*	*			cis	-164.7	171.6	-7.7	0	0	0	0	0	111
4	H	35	Very low	35.2	Very low	193 Å²	193	148.9 Å²	148.9	89%	0.894	88%	0.875	S	S	*	*			trans	-61.5	147.4	174.5	-71	-108.7	0	0	0	113.9
5	G	34.3	Very low	35.5	Very low	70 Å²	70	148 Å²	148	72%	0.722	87%	0.865	S	S	*	*				101.6	118.4	109.2	0	0	0	0	0	118.9
6	S	36.2	Very low	35.6	Very low	133 Å²	133	143.2 Å²	143.2	93%	0.93	86%	0.857	S	S	*	*				-158.3	141.2	119.2	-81.7	0	0	0	0	109.2
7	A	35.4	Very low	35.9	Very low	99 Å²	99	142.5 Å²	142.5	82%	0.818	85%	0.853	S	S	*	*			trans	-123.3	146.2	-177.6	0	0	0	0	0	110.8
8	Q	36.9	Very low	36.6	Very low	201 Å²	201	141.4 Å²	141.4	94%	0.939	84%	0.842	S	S	*	*			trans	-132.5	131.3	153.6	-79.4	-171.1	-22.7	0	0	108.4
9	A	34.5	Very low	37.5	Very low	109 Å²	109	138.4 Å²	138.4	90%	0.901	83%	0.829	S	S	*	*			trans	-97.6	143	-179	0	0	0	0	0	110.4
10	G	33.9	Very low	38.6	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	82%	0.819	S	S	*	*			trans	-151.3	45.3	-166.5	0	0	0	0	0	116.1
11	R	33.9	Very low	40.3	Very low	257 Å²	257	132.4 Å²	132.4	97%	0.97	79%	0.793	S	S	*	*			trans	55	146.8	166.7	-75.1	-177.9	171.6	163.6	-2	119.3
12	S	32.5	Very low	42.4	Very low	115 Å²	115	126 Å²	126	80%	0.804	77%	0.77	S	S	*	*			trans	-94.7	138.7	175.8	51.2	0	0	0	0	111.9
13	E	36.9	Very low	44.7	Very low	177 Å²	177	119 Å²	119	83%	0.827	73%	0.732	S	S	*	*			trans	-131.4	135.3	157.4	-71.4	-169.1	133.2	0	0	110.1	N15	E13-N15 PolarHBondContact O-ND2 3.08Å
14	D	34.4	Very low	47.3	Very low	165 Å²	165	117.6 Å²	117.6	88%	0.882	71%	0.712	S	S	*	*			trans	-73.9	136.4	177.9	-173.9	18.6	0	0	0	110.2
15	N	38.9	Very low	49.8	Very low	136 Å²	136	114.1 Å²	114.1	73%	0.727	70%	0.697	S	S	*	*			trans	-136.2	115.4	-173.9	-88.1	-83.9	0	0	0	111	E13	E13-N15 PolarHBondContact O-ND2 3.08Å
16	G	37.1	Very low	52.3	Low	71 Å²	71	117.4 Å²	117.4	73%	0.732	69%	0.694	S	S	*	*			trans	-68.7	165.6	-167.9	0	0	0	0	0	115.4	D18	G16-D18 PolarHBondContact O-N 2.72Å
17	V	40.8	Very low	54.9	Low	132 Å²	132	111.9 Å²	111.9	80%	0.8	65%	0.654	S	S	*	*			trans	-70.8	96.4	178	-178.5	0	0	0	0	109.8	S19	V17-S19 PolarHBondContact O-N 3.43Å; V17-S19 PolarHBondContact O-OG 2.6Å
18	D	49	Very low	57.5	Low	122 Å²	122	107.3 Å²	107.3	65%	0.652	62%	0.616	S	S	*	*			trans	-56.9	103.4	178.5	-166.5	-4.3	0	0	0	110.8	G16	G16-D18 PolarHBondContact O-N 2.72Å
19	S	53.1	Low	60	Low	85 Å²	85	101.1 Å²	101.1	59%	0.594	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-11.5	-164.4	-60.9	0	0	0	0	112.8	V17 K73	V17-S19 PolarHBondContact O-N 3.43Å; V17-S19 PolarHBondContact O-OG 2.6Å; S19-K73 PolarHBondContact O-NZ 3.21Å
20	D	60	Low	62.7	Low	118 Å²	118	98.4 Å²	98.4	63%	0.631	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	10.3	-177.8	-73	-40.3	0	0	0	113.3	K73	D20-K73 IonicContact OD1-NZ 2.67Å; D20-K73 PolarHBondContact OD1-NZ 3.49Å
21	A	73.9	Confident	65.5	Low	33 Å²	33	94.9 Å²	94.9	27%	0.273	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-54.4	125.1	171.8	0	0	0	0	0	111.3
22	P	81.6	Confident	68.2	Low	103 Å²	103	84.8 Å²	84.8	67%	0.669	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-68.4	150.8	-175.2	27.7	-35.1	0	0	0	112
23	P	85.3	Confident	71	Confident	11 Å²	11	83.8 Å²	83.8	7%	0.071	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-63.6	146.2	176.1	25.1	-33.2	0	0	0	112.1	M25 V28 L70 H74 L76	P23-M25 PolarHBondContact O-N 3.32Å; P23-M25 VanDerWaalsContact O-N 3.14Å; P23-V28 HydrophobicContact CB-CG2 3.95Å; P23-L70 HydrophobicContact CB-CB 3.82Å; P23-H74 HydrophobicContact CG-CB 4.2Å; P23-L76 HydrophobicContact CG-CD1 3.63Å
24	D	88.6	Confident	73.6	Confident	66 Å²	66	75.9 Å²	75.9	35%	0.353	45%	0.445	S	S	.	.			trans	-67.4	109.5	172.8	-179.3	-34.1	0	0	0	109.5	E26 I27 V28 Q67	D24-E26 VanDerWaalsContact C-N 3.26Å; D24-E26 PolarHBondContact O-N 3.19Å; D24-E26 WeakPolarHBondContact OD1-CA 3.35Å; D24-E26 WeakPolarHBondContact OD1-CB 3.21Å; D24-E26 PolarHBondContact OD1-N 2.9Å; D24-I27 HydrophobicContact CB-CB 4.1Å; D24-I27 HydrophobicContact CB-CD1 4.01Å; D24-I27 HydrophobicContact CB-CG1 4.13Å; D24-I27 PolarHBondContact O-N 3.4Å; D24-I27 PolarHBondContact OD1-N 3.41Å; D24-I27 WeakPolarHBondContact OD2-CD1 3.39Å; D24-V28 WeakPolarHBondContact O-CG2 3.3Å; D24-V28 PolarHBondContact O-N 3.07Å; D24-Q67 HydrophobicContact CB-CG 4.47Å
25	M	87.8	Confident	76.3	Confident	119 Å²	119	68 Å²	68	59%	0.586	40%	0.403	S	S	*	.	H	α-helix	trans	-66.5	-24	-175.2	-68.1	-59.4	-57.8	0	0	113.7	P23 S29 L76	P23-M25 PolarHBondContact O-N 3.32Å; P23-M25 VanDerWaalsContact O-N 3.14Å; M25-S29 WeakPolarHBondContact O-CB 3.39Å; M25-S29 PolarHBondContact O-N 3.45Å; M25-L76 HydrophobicContact CE-CD1 4.26Å; M25-L76 HydrophobicContact SD-CD1 3.63Å
26	E	88.4	Confident	78.6	Confident	140 Å²	140	64 Å²	64	65%	0.654	39%	0.388	S	S	*	.	H	α-helix	trans	-74.4	-45.6	174.2	-172.5	167.8	172.6	0	0	110.1	D24 V28 S29 Q30	D24-E26 VanDerWaalsContact C-N 3.26Å; D24-E26 PolarHBondContact O-N 3.19Å; D24-E26 WeakPolarHBondContact OD1-CA 3.35Å; D24-E26 WeakPolarHBondContact OD1-CB 3.21Å; D24-E26 PolarHBondContact OD1-N 2.9Å; E26-V28 VanDerWaalsContact C-N 3.34Å; E26-V28 PolarHBondContact O-N 3.41Å; E26-S29 WeakPolarHBondContact O-CB 3.45Å; E26-S29 PolarHBondContact O-N 3.28Å; E26-Q30 WeakPolarHBondContact O-CG 3.14Å; E26-Q30 PolarHBondContact O-N 3.09Å
27	I	88.9	Confident	81	Confident	17 Å²	17	62.6 Å²	62.6	9%	0.087	37%	0.367	C	S	.	.	H	α-helix	trans	-64.2	-38.4	175.1	-60.8	176	0	0	0	111	D24 Q30 L31 L59 V63 Q67	D24-I27 HydrophobicContact CB-CB 4.1Å; D24-I27 HydrophobicContact CB-CD1 4.01Å; D24-I27 HydrophobicContact CB-CG1 4.13Å; D24-I27 PolarHBondContact O-N 3.4Å; D24-I27 PolarHBondContact OD1-N 3.41Å; D24-I27 WeakPolarHBondContact OD2-CD1 3.39Å; I27-Q30 PolarHBondContact O-N 3.16Å; I27-L31 HydrophobicContact CG2-CD1 4.15Å; I27-L31 HydrophobicContact CG2-CG 4.39Å; I27-L31 WeakPolarHBondContact O-CB 3.47Å; I27-L31 VanDerWaalsContact O-CG 3.31Å; I27-L31 WeakPolarHBondContact O-CG 3.48Å; I27-L31 PolarHBondContact O-N 2.59Å; I27-L59 HydrophobicContact CD1-CD2 4.38Å; I27-L59 HydrophobicContact CG1-CD2 4.22Å; I27-L59 HydrophobicContact CG2-CD1 4.12Å; I27-V63 HydrophobicContact CD1-CG1 3.71Å; I27-Q67 HydrophobicContact CB-CG 4.35Å; I27-Q67 HydrophobicContact CD1-CG 4.07Å; I27-Q67 HydrophobicContact CG2-CB 3.81Å; I27-Q67 HydrophobicContact CG2-CG 3.98Å
28	V	90.7	Very high	83.2	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-40.3	173.7	173.2	0	0	0	0	111.9	P23 D24 E26 L31 L32 A71 L76	P23-V28 HydrophobicContact CB-CG2 3.95Å; D24-V28 WeakPolarHBondContact O-CG2 3.3Å; D24-V28 PolarHBondContact O-N 3.07Å; E26-V28 VanDerWaalsContact C-N 3.34Å; E26-V28 PolarHBondContact O-N 3.41Å; V28-L31 PolarHBondContact O-N 3.01Å; V28-L32 HydrophobicContact CG1-CD1 3.95Å; V28-L32 HydrophobicContact CG1-CG 4.33Å; V28-L32 WeakPolarHBondContact O-CB 3.36Å; V28-L32 VanDerWaalsContact O-CG 3.3Å; V28-L32 WeakPolarHBondContact O-CG 3.5Å; V28-L32 PolarHBondContact O-N 3.49Å; V28-A71 HydrophobicContact CG2-CB 3.77Å; V28-L76 HydrophobicContact CG1-CB 4.09Å; V28-L76 HydrophobicContact CG1-CD1 4.19Å; V28-L76 HydrophobicContact CG2-CD1 4.45Å
29	S	90	Very high	84.9	Confident	70 Å²	70	53.8 Å²	53.8	49%	0.49	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-42.2	174.5	-172.7	0	0	0	0	112.1	M25 E26 L32 T33	M25-S29 WeakPolarHBondContact O-CB 3.39Å; M25-S29 PolarHBondContact O-N 3.45Å; E26-S29 WeakPolarHBondContact O-CB 3.45Å; E26-S29 PolarHBondContact O-N 3.28Å; S29-L32 PolarHBondContact O-N 2.92Å; S29-T33 PolarHBondContact O-N 3.1Å; S29-T33 PolarHBondContact O-OG1 3.22Å
30	Q	90.7	Very high	86.2	Confident	52 Å²	52	58.8 Å²	58.8	24%	0.243	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-46.8	173.1	-69.1	-179.3	29.5	0	0	111.6	E26 I27 L32 T33 V34 L57	E26-Q30 WeakPolarHBondContact O-CG 3.14Å; E26-Q30 PolarHBondContact O-N 3.09Å; I27-Q30 PolarHBondContact O-N 3.16Å; Q30-L32 PolarHBondContact O-N 3.16Å; Q30-T33 WeakPolarHBondContact O-CB 3.38Å; Q30-T33 PolarHBondContact O-N 3.28Å; Q30-T33 VanDerWaalsContact O-N 3.17Å; Q30-V34 WeakPolarHBondContact O-CG2 3.44Å; Q30-V34 PolarHBondContact O-N 2.89Å; Q30-L57 HydrophobicContact CB-CD1 3.96Å; Q30-L57 HydrophobicContact CG-CD1 4.41Å
31	L	93.2	Very high	87.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-44.1	177	-72.5	171.6	0	0	0	112.4	I27 V28 T33 V34 I35 I64 L68 I77	I27-L31 HydrophobicContact CG2-CD1 4.15Å; I27-L31 HydrophobicContact CG2-CG 4.39Å; I27-L31 WeakPolarHBondContact O-CB 3.47Å; I27-L31 VanDerWaalsContact O-CG 3.31Å; I27-L31 WeakPolarHBondContact O-CG 3.48Å; I27-L31 PolarHBondContact O-N 2.59Å; V28-L31 PolarHBondContact O-N 3.01Å; L31-T33 VanDerWaalsContact C-N 3.28Å; L31-T33 PolarHBondContact O-N 3.3Å; L31-V34 PolarHBondContact O-N 3.2Å; L31-V34 VanDerWaalsContact O-N 3.15Å; L31-I35 VanDerWaalsContact O-CG1 3.26Å; L31-I35 WeakPolarHBondContact O-CG1 3.33Å; L31-I35 PolarHBondContact O-N 3.41Å; L31-I64 HydrophobicContact CD2-CG2 4.18Å; L31-L68 HydrophobicContact CD1-CB 4.3Å; L31-L68 HydrophobicContact CD1-CD1 4.45Å; L31-I77 HydrophobicContact CB-CD1 3.99Å; L31-I77 HydrophobicContact CD1-CD1 4.4Å
32	L	91.4	Very high	87.3	Confident	45 Å²	45	66 Å²	66	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-59.9	-38.3	174.8	-73.1	167.7	0	0	0	111.8	V28 S29 Q30 I35 A36 I77 D91	V28-L32 HydrophobicContact CG1-CD1 3.95Å; V28-L32 HydrophobicContact CG1-CG 4.33Å; V28-L32 WeakPolarHBondContact O-CB 3.36Å; V28-L32 VanDerWaalsContact O-CG 3.3Å; V28-L32 WeakPolarHBondContact O-CG 3.5Å; V28-L32 PolarHBondContact O-N 3.49Å; S29-L32 PolarHBondContact O-N 2.92Å; Q30-L32 PolarHBondContact O-N 3.16Å; L32-I35 HydrophobicContact CD2-CD1 4.48Å; L32-I35 PolarHBondContact O-N 3.15Å; L32-A36 WeakPolarHBondContact O-CB 3.06Å; L32-A36 PolarHBondContact O-N 2.99Å; L32-I77 HydrophobicContact CD2-CG1 3.98Å; L32-I77 HydrophobicContact CG-CG1 4.4Å; L32-D91 HydrophobicContact CD2-CB 3.65Å
33	T	89.9	Confident	87.3	Confident	94 Å²	94	65.3 Å²	65.3	58%	0.577	32%	0.323	S	S	*	.	H	α-helix	trans	-64.7	-41.5	174.5	-56.9	0	0	0	0	111.7	S29 Q30 L31 A36 S37	S29-T33 PolarHBondContact O-N 3.1Å; S29-T33 PolarHBondContact O-OG1 3.22Å; Q30-T33 WeakPolarHBondContact O-CB 3.38Å; Q30-T33 PolarHBondContact O-N 3.28Å; Q30-T33 VanDerWaalsContact O-N 3.17Å; L31-T33 VanDerWaalsContact C-N 3.28Å; L31-T33 PolarHBondContact O-N 3.3Å; T33-A36 PolarHBondContact O-N 3.33Å; T33-S37 PolarHBondContact O-N 3.44Å
34	V	91.9	Very high	87.1	Confident	11 Å²	11	67.1 Å²	67.1	7%	0.067	33%	0.331	C	S	.	.	H	α-helix	trans	-68.1	-40.9	174.9	180	0	0	0	0	111.5	Q30 L31 A36 S37 I38 L50 K53 L57	Q30-V34 WeakPolarHBondContact O-CG2 3.44Å; Q30-V34 PolarHBondContact O-N 2.89Å; L31-V34 PolarHBondContact O-N 3.2Å; L31-V34 VanDerWaalsContact O-N 3.15Å; V34-A36 VanDerWaalsContact C-N 3.33Å; V34-A36 PolarHBondContact O-N 3.04Å; V34-S37 WeakPolarHBondContact O-CB 3.27Å; V34-S37 PolarHBondContact O-N 2.94Å; V34-I38 HydrophobicContact CG1-CD1 3.84Å; V34-I38 HydrophobicContact CG1-CG1 4.35Å; V34-I38 WeakPolarHBondContact O-CG1 3.39Å; V34-I38 PolarHBondContact O-N 2.97Å; V34-L50 HydrophobicContact CB-CD2 4.36Å; V34-L50 HydrophobicContact CG1-CD2 3.91Å; V34-K53 HydrophobicContact CG1-CB 3.55Å; V34-K53 HydrophobicContact CG1-CD 4.12Å; V34-K53 HydrophobicContact CG1-CG 4.46Å; V34-L57 HydrophobicContact CG2-CD1 3.8Å
35	I	91.6	Very high	87.2	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-56.8	-46.9	173	-69.3	167.7	0	0	0	110.3	L31 L32 I38 K39 V45 L50 I77	L31-I35 VanDerWaalsContact O-CG1 3.26Å; L31-I35 WeakPolarHBondContact O-CG1 3.33Å; L31-I35 PolarHBondContact O-N 3.41Å; L32-I35 HydrophobicContact CD2-CD1 4.48Å; L32-I35 PolarHBondContact O-N 3.15Å; I35-I38 PolarHBondContact O-N 3.47Å; I35-K39 HydrophobicContact CG2-CD 4.41Å; I35-K39 WeakPolarHBondContact O-CB 3.39Å; I35-K39 PolarHBondContact O-N 3.43Å; I35-V45 HydrophobicContact CB-CG1 4.37Å; I35-V45 HydrophobicContact CG1-CG1 3.96Å; I35-V45 HydrophobicContact CG2-CG1 4.33Å; I35-L50 HydrophobicContact CG1-CD2 3.72Å; I35-I77 HydrophobicContact CD1-CD1 3.9Å; I35-I77 HydrophobicContact CD1-CG1 4.17Å; I35-I77 HydrophobicContact CD1-CG2 3.82Å
36	A	86.1	Confident	87.3	Confident	50 Å²	50	59.6 Å²	59.6	41%	0.413	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-42.5	177.1	0	0	0	0	0	112	L32 T33 V34 K39 Y40	L32-A36 WeakPolarHBondContact O-CB 3.06Å; L32-A36 PolarHBondContact O-N 2.99Å; T33-A36 PolarHBondContact O-N 3.33Å; V34-A36 VanDerWaalsContact C-N 3.33Å; V34-A36 PolarHBondContact O-N 3.04Å; A36-K39 PolarHBondContact O-N 3.43Å; A36-Y40 WeakPolarHBondContact O-CB 3.42Å; A36-Y40 PolarHBondContact O-N 2.72Å
37	S	87.9	Confident	87.4	Confident	42 Å²	42	55.5 Å²	55.5	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-48.4	173.7	178.7	0	0	0	0	112.2	T33 V34 K39 Y40 H41 K53	T33-S37 PolarHBondContact O-N 3.44Å; V34-S37 WeakPolarHBondContact O-CB 3.27Å; V34-S37 PolarHBondContact O-N 2.94Å; S37-K39 PolarHBondContact O-N 3.34Å; S37-Y40 WeakPolarHBondContact O-CB 3.5Å; S37-Y40 PolarHBondContact O-N 2.93Å; S37-H41 PolarHBondContact O-CD2 3.32Å; S37-H41 PolarHBondContact O-N 3.31Å; S37-K53 PolarHBondContact OG-NZ 2.96Å
38	I	88.2	Confident	87.4	Confident	1 Å²	1	62 Å²	62	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-64.5	-42	-179.5	-60.9	164.1	0	0	0	110.8	V34 I35 Y40 H41 R42 Q43 V45 R49 L50 K53	V34-I38 HydrophobicContact CG1-CD1 3.84Å; V34-I38 HydrophobicContact CG1-CG1 4.35Å; V34-I38 WeakPolarHBondContact O-CG1 3.39Å; V34-I38 PolarHBondContact O-N 2.97Å; I35-I38 PolarHBondContact O-N 3.47Å; I38-Y40 PolarHBondContact O-N 3.49Å; I38-H41 PolarHBondContact O-N 2.96Å; I38-R42 PolarHBondContact O-N 2.92Å; I38-Q43 HydrophobicContact CG2-CB 3.69Å; I38-Q43 PolarHBondContact O-N 2.83Å; I38-Q43 VanDerWaalsContact O-N 3.15Å; I38-V45 HydrophobicContact CB-CG1 4.42Å; I38-V45 HydrophobicContact CB-CG2 4.15Å; I38-V45 HydrophobicContact CD1-CG1 4.05Å; I38-V45 HydrophobicContact CG2-CB 4.32Å; I38-V45 HydrophobicContact CG2-CG1 4.48Å; I38-V45 HydrophobicContact CG2-CG2 3.89Å; I38-R49 HydrophobicContact CD1-CB 4.01Å; I38-L50 HydrophobicContact CD1-CD2 3.85Å; I38-L50 HydrophobicContact CD1-CG 4.34Å; I38-K53 HydrophobicContact CD1-CD 4.35Å; I38-K53 HydrophobicContact CG1-CD 3.78Å
39	K	83.3	Confident	87.4	Confident	68 Å²	68	66.7 Å²	66.7	30%	0.296	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-39.7	173.1	-77.2	-173.6	173.3	-176.4	0	112.8	I35 A36 S37 H41 R42 V45 N94	I35-K39 HydrophobicContact CG2-CD 4.41Å; I35-K39 WeakPolarHBondContact O-CB 3.39Å; I35-K39 PolarHBondContact O-N 3.43Å; A36-K39 PolarHBondContact O-N 3.43Å; S37-K39 PolarHBondContact O-N 3.34Å; K39-H41 VanDerWaalsContact C-N 3.32Å; K39-H41 PolarHBondContact O-N 3.25Å; K39-R42 WeakPolarHBondContact O-CA 3.4Å; K39-R42 PolarHBondContact O-N 2.98Å; K39-V45 HydrophobicContact CG-CG2 3.87Å; K39-N94 PolarHBondContact NZ-O 2.66Å
40	Y	79.9	Confident	87.5	Confident	191 Å²	191	63.4 Å²	63.4	75%	0.749	30%	0.301	S	S	*	.	H	α-helix	trans	-60	-41.3	178	180	-96.5	0	0	0	112	A36 S37 I38 R42	A36-Y40 WeakPolarHBondContact O-CB 3.42Å; A36-Y40 PolarHBondContact O-N 2.72Å; S37-Y40 WeakPolarHBondContact O-CB 3.5Å; S37-Y40 PolarHBondContact O-N 2.93Å; I38-Y40 PolarHBondContact O-N 3.49Å; Y40-R42 PolarHBondContact O-N 3.25Å
41	H	78.6	Confident	87.5	Confident	109 Å²	109	63.3 Å²	63.3	51%	0.505	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	11.3	173.4	-64.2	-74.9	0	0	0	114.2	S37 I38 K39 Q43	S37-H41 PolarHBondContact O-CD2 3.32Å; S37-H41 PolarHBondContact O-N 3.31Å; I38-H41 PolarHBondContact O-N 2.96Å; K39-H41 VanDerWaalsContact C-N 3.32Å; K39-H41 PolarHBondContact O-N 3.25Å; H41-Q43 HydrophobicContact CB-CG 4.44Å; H41-Q43 PolarHBondContact O-N 3.42Å; H41-Q43 VanDerWaalsContact O-N 3.17Å
42	R	78.3	Confident	87.2	Confident	194 Å²	194	67.1 Å²	67.1	73%	0.732	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	26.5	-178.4	-61.8	-173.6	171.3	-155.2	-3.1	114.8	I38 K39 Y40	I38-R42 PolarHBondContact O-N 2.92Å; K39-R42 WeakPolarHBondContact O-CA 3.4Å; K39-R42 PolarHBondContact O-N 2.98Å; Y40-R42 PolarHBondContact O-N 3.25Å
43	Q	82.9	Confident	87	Confident	87 Å²	87	67.8 Å²	67.8	41%	0.407	33%	0.328	S	S	.	.			trans	-92.5	147.3	178.1	-71.7	173.7	-8.5	0	0	111.1	I38 H41	I38-Q43 HydrophobicContact CG2-CB 3.69Å; I38-Q43 PolarHBondContact O-N 2.83Å; I38-Q43 VanDerWaalsContact O-N 3.15Å; H41-Q43 HydrophobicContact CB-CG 4.44Å; H41-Q43 PolarHBondContact O-N 3.42Å; H41-Q43 VanDerWaalsContact O-N 3.17Å
44	Q	81.8	Confident	86.9	Confident	50 Å²	50	63.3 Å²	63.3	23%	0.234	30%	0.3	C	S	.	.			trans	-63.4	136.8	168.2	-177.8	170.4	12.5	0	0	109.9	S46 R49 N84 L86	Q44-S46 VanDerWaalsContact C-N 3.34Å; Q44-S46 PolarHBondContact O-N 3.48Å; Q44-S46 VanDerWaalsContact O-N 3.14Å; Q44-R49 WeakPolarHBondContact O-CD 3.39Å; Q44-R49 PolarHBondContact O-NH1 3.43Å; Q44-N84 PolarHBondContact NE2-OD1 3.31Å; Q44-N84 PolarHBondContact OE1-ND2 3.49Å; Q44-L86 PolarHBondContact NE2-O 3.25Å; Q44-L86 VanDerWaalsContact NE2-O 3.11Å
45	V	89.9	Confident	86.4	Confident	3 Å²	3	71.9 Å²	71.9	2%	0.018	33%	0.332	C	S	.	.			trans	-91.6	66.4	-172.6	-166.5	0	0	0	0	110.2	I35 I38 K39 L50 S88 Y89	I35-V45 HydrophobicContact CB-CG1 4.37Å; I35-V45 HydrophobicContact CG1-CG1 3.96Å; I35-V45 HydrophobicContact CG2-CG1 4.33Å; I38-V45 HydrophobicContact CB-CG1 4.42Å; I38-V45 HydrophobicContact CB-CG2 4.15Å; I38-V45 HydrophobicContact CD1-CG1 4.05Å; I38-V45 HydrophobicContact CG2-CB 4.32Å; I38-V45 HydrophobicContact CG2-CG1 4.48Å; I38-V45 HydrophobicContact CG2-CG2 3.89Å; K39-V45 HydrophobicContact CG-CG2 3.87Å; V45-L50 HydrophobicContact CG1-CD1 4.37Å; V45-L50 HydrophobicContact CG1-CD2 3.93Å; V45-L50 HydrophobicContact CG1-CG 4.1Å; V45-S88 PolarHBondContact N-OG 3.43Å; V45-S88 VanDerWaalsContact N-OG 3.16Å; V45-S88 WeakPolarHBondContact O-CA 3.44Å; V45-Y89 WeakPolarHBondContact CB-O 3.42Å; V45-Y89 WeakPolarHBondContact O-CD2 3.27Å; V45-Y89 PolarHBondContact O-N 3.22Å
46	S	90.5	Very high	85.8	Confident	24 Å²	24	78 Å²	78	17%	0.168	37%	0.369	C	S	.	.			trans	-73.2	159.5	177.1	64.7	0	0	0	0	112.2	Q44 E48 R49 L50	Q44-S46 VanDerWaalsContact C-N 3.34Å; Q44-S46 PolarHBondContact O-N 3.48Å; Q44-S46 VanDerWaalsContact O-N 3.14Å; S46-E48 VanDerWaalsContact C-N 3.27Å; S46-E48 PolarHBondContact O-N 3.39Å; S46-R49 PolarHBondContact O-N 2.95Å; S46-R49 PolarHBondContact OG-N 3.26Å; S46-L50 PolarHBondContact O-N 3.13Å
47	L	90.5	Very high	85.4	Confident	53 Å²	53	79.6 Å²	79.6	28%	0.277	37%	0.37	S	S	.	.	H	α-helix	trans	-55.4	-42.6	175.6	178.8	59.3	0	0	0	111.9	R49 L50 K51 E65 L68 Y89	L47-R49 PolarHBondContact O-N 3.46Å; L47-L50 WeakPolarHBondContact O-CB 3.46Å; L47-L50 PolarHBondContact O-N 2.88Å; L47-K51 HydrophobicContact CD1-CG 4.43Å; L47-K51 HydrophobicContact CG-CD 4.49Å; L47-K51 WeakPolarHBondContact O-CG 3.29Å; L47-K51 PolarHBondContact O-N 3.18Å; L47-E65 HydrophobicContact CD1-CG 4.15Å; L47-E65 HydrophobicContact CD2-CG 4.43Å; L47-L68 HydrophobicContact CD1-CD2 3.75Å; L47-Y89 HydrophobicContact CB-CE2 4.11Å
48	E	88.7	Confident	85.1	Confident	154 Å²	154	80.6 Å²	80.6	72%	0.72	39%	0.387	S	S	*	.	H	α-helix	trans	-62	-40.4	178.6	-59.3	173.4	148.2	0	0	112.6	S46 K51 S52	S46-E48 VanDerWaalsContact C-N 3.27Å; S46-E48 PolarHBondContact O-N 3.39Å; E48-K51 PolarHBondContact O-N 3.39Å; E48-S52 WeakPolarHBondContact O-CB 3.42Å; E48-S52 PolarHBondContact O-N 3.32Å
49	R	90.2	Very high	84.8	Confident	102 Å²	102	81.8 Å²	81.8	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-70.9	-34	177.1	-76.4	175.3	175	151.8	4.6	112	I38 Q44 S46 L47 K53	I38-R49 HydrophobicContact CD1-CB 4.01Å; Q44-R49 WeakPolarHBondContact O-CD 3.39Å; Q44-R49 PolarHBondContact O-NH1 3.43Å; S46-R49 PolarHBondContact O-N 2.95Å; S46-R49 PolarHBondContact OG-N 3.26Å; L47-R49 PolarHBondContact O-N 3.46Å; R49-K53 PolarHBondContact O-N 3.36Å; R49-K53 VanDerWaalsContact O-N 3.09Å
50	L	91.6	Very high	84.8	Confident	0 Å²	0	84 Å²	84	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-63	-54.3	169.1	-70.2	173.8	0	0	0	110.6	V34 I35 I38 V45 S46 L47 S52 K53 S54 L68 Y89	V34-L50 HydrophobicContact CB-CD2 4.36Å; V34-L50 HydrophobicContact CG1-CD2 3.91Å; I35-L50 HydrophobicContact CG1-CD2 3.72Å; I38-L50 HydrophobicContact CD1-CD2 3.85Å; I38-L50 HydrophobicContact CD1-CG 4.34Å; V45-L50 HydrophobicContact CG1-CD1 4.37Å; V45-L50 HydrophobicContact CG1-CD2 3.93Å; V45-L50 HydrophobicContact CG1-CG 4.1Å; S46-L50 PolarHBondContact O-N 3.13Å; L47-L50 WeakPolarHBondContact O-CB 3.46Å; L47-L50 PolarHBondContact O-N 2.88Å; L50-S52 VanDerWaalsContact C-N 3.32Å; L50-S52 PolarHBondContact O-N 3.08Å; L50-K53 PolarHBondContact O-N 3.01Å; L50-S54 WeakPolarHBondContact O-CB 3.49Å; L50-S54 PolarHBondContact O-N 3.18Å; L50-S54 PolarHBondContact O-OG 3.44Å; L50-L68 HydrophobicContact CD1-CD1 4.3Å; L50-L68 HydrophobicContact CD1-CD2 3.72Å; L50-Y89 HydrophobicContact CD1-CD2 3.47Å; L50-Y89 VanDerWaalsContact CD1-CD2 3.47Å; L50-Y89 HydrophobicContact CD1-CE2 4.22Å; L50-Y89 HydrophobicContact CD1-CG 3.87Å
51	K	91.3	Very high	85.1	Confident	51 Å²	51	77.1 Å²	77.1	22%	0.222	39%	0.388	C	S	.	.	H	α-helix	trans	-52.2	-49.3	175.7	-72	-177.4	178.9	-165.7	0	112.1	L47 E48 S54 R55 S61 I64 E65	L47-K51 HydrophobicContact CD1-CG 4.43Å; L47-K51 HydrophobicContact CG-CD 4.49Å; L47-K51 WeakPolarHBondContact O-CG 3.29Å; L47-K51 PolarHBondContact O-N 3.18Å; E48-K51 PolarHBondContact O-N 3.39Å; K51-S54 PolarHBondContact O-N 3.48Å; K51-R55 WeakPolarHBondContact O-CG 3.36Å; K51-R55 PolarHBondContact O-N 3Å; K51-R55 VanDerWaalsContact O-N 3.11Å; K51-S61 WeakPolarHBondContact CD-OG 3.44Å; K51-S61 WeakPolarHBondContact CE-OG 3.27Å; K51-S61 PolarHBondContact NZ-OG 2.96Å; K51-S61 VanDerWaalsContact NZ-OG 3.09Å; K51-I64 HydrophobicContact CG-CG2 4.37Å; K51-E65 WeakPolarHBondContact CE-OE1 3.36Å; K51-E65 WeakPolarHBondContact CE-OE2 3.38Å; K51-E65 IonicContact NZ-OE1 2.73Å; K51-E65 PolarHBondContact NZ-OE1 2.7Å; K51-E65 IonicContact NZ-OE2 2.8Å; K51-E65 PolarHBondContact NZ-OE2 2.68Å
52	S	87.5	Confident	85.5	Confident	79 Å²	79	75.9 Å²	75.9	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-61	-47.7	-177	-177.3	0	0	0	0	112.5	E48 L50	E48-S52 WeakPolarHBondContact O-CB 3.42Å; E48-S52 PolarHBondContact O-N 3.32Å; L50-S52 VanDerWaalsContact C-N 3.32Å; L50-S52 PolarHBondContact O-N 3.08Å
53	K	87.3	Confident	86	Confident	60 Å²	60	69.1 Å²	69.1	26%	0.261	37%	0.372	S	S	.	.	H	α-helix	trans	-73	-36.4	175.9	-80.6	-170.2	173.6	-177.1	0	113.4	V34 S37 I38 R49 L50 R55 V56	V34-K53 HydrophobicContact CG1-CB 3.55Å; V34-K53 HydrophobicContact CG1-CD 4.12Å; V34-K53 HydrophobicContact CG1-CG 4.46Å; S37-K53 PolarHBondContact OG-NZ 2.96Å; I38-K53 HydrophobicContact CD1-CD 4.35Å; I38-K53 HydrophobicContact CG1-CD 3.78Å; R49-K53 PolarHBondContact O-N 3.36Å; R49-K53 VanDerWaalsContact O-N 3.09Å; L50-K53 PolarHBondContact O-N 3.01Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 3.36Å; K53-V56 VanDerWaalsContact O-CB 3.31Å; K53-V56 WeakPolarHBondContact O-CB 3.25Å; K53-V56 WeakPolarHBondContact O-CG2 3.33Å; K53-V56 PolarHBondContact O-N 3.15Å; K53-V56 VanDerWaalsContact O-N 3.08Å
54	S	87.8	Confident	86.3	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-70.9	-19	-178.5	-64	0	0	0	0	113.8	L50 K51 V56 L57 L59 I64	L50-S54 WeakPolarHBondContact O-CB 3.49Å; L50-S54 PolarHBondContact O-N 3.18Å; L50-S54 PolarHBondContact O-OG 3.44Å; K51-S54 PolarHBondContact O-N 3.48Å; S54-V56 PolarHBondContact O-N 3.42Å; S54-L57 WeakPolarHBondContact O-CA 3.35Å; S54-L57 WeakPolarHBondContact O-CB 3.23Å; S54-L57 PolarHBondContact O-N 2.98Å; S54-L59 PolarHBondContact O-N 3.42Å; S54-I64 VanDerWaalsContact CB-CD1 3.47Å
55	R	81.1	Confident	86.8	Confident	191 Å²	191	65.6 Å²	65.6	72%	0.721	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-56.2	-31.6	166.1	-77.2	175.5	-178.2	-170.8	0.2	112.7	K51 K53 L57 G58	K51-R55 WeakPolarHBondContact O-CG 3.36Å; K51-R55 PolarHBondContact O-N 3Å; K51-R55 VanDerWaalsContact O-N 3.11Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 3.36Å; R55-L57 PolarHBondContact O-N 2.85Å; R55-G58 PolarHBondContact O-N 2.92Å; R55-G58 VanDerWaalsContact O-N 3.12Å
56	V	78.8	Confident	86.8	Confident	129 Å²	129	71.9 Å²	71.9	78%	0.782	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-69.4	-17.1	176.9	-170.5	0	0	0	0	111.9	K53 S54	K53-V56 VanDerWaalsContact O-CB 3.31Å; K53-V56 WeakPolarHBondContact O-CB 3.25Å; K53-V56 WeakPolarHBondContact O-CG2 3.33Å; K53-V56 PolarHBondContact O-N 3.15Å; K53-V56 VanDerWaalsContact O-N 3.08Å; S54-V56 PolarHBondContact O-N 3.42Å
57	L	77	Confident	86.9	Confident	83 Å²	83	72.1 Å²	72.1	44%	0.435	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-96.4	7.3	174.7	-53.6	179.6	0	0	0	112.7	Q30 V34 S54 R55 L59	Q30-L57 HydrophobicContact CB-CD1 3.96Å; Q30-L57 HydrophobicContact CG-CD1 4.41Å; V34-L57 HydrophobicContact CG2-CD1 3.8Å; S54-L57 WeakPolarHBondContact O-CA 3.35Å; S54-L57 WeakPolarHBondContact O-CB 3.23Å; S54-L57 PolarHBondContact O-N 2.98Å; R55-L57 PolarHBondContact O-N 2.85Å; L57-L59 HydrophobicContact CB-CG 4.33Å; L57-L59 PolarHBondContact O-N 3.07Å
58	G	80.9	Confident	87	Confident	64 Å²	64	69.8 Å²	69.8	66%	0.66	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	5.5	-178	0	0	0	0	0	115.2	R55	R55-G58 PolarHBondContact O-N 2.92Å; R55-G58 VanDerWaalsContact O-N 3.12Å
59	L	82.2	Confident	87	Confident	25 Å²	25	68.5 Å²	68.5	13%	0.131	36%	0.363	C	S	.	.			trans	-77.7	127.8	-177.8	-63.9	178	0	0	0	112.1	I27 S54 L57 I64	I27-L59 HydrophobicContact CD1-CD2 4.38Å; I27-L59 HydrophobicContact CG1-CD2 4.22Å; I27-L59 HydrophobicContact CG2-CD1 4.12Å; S54-L59 PolarHBondContact O-N 3.42Å; L57-L59 HydrophobicContact CB-CG 4.33Å; L57-L59 PolarHBondContact O-N 3.07Å; L59-I64 HydrophobicContact CB-CD1 3.81Å; L59-I64 HydrophobicContact CB-CG1 3.72Å; L59-I64 HydrophobicContact CD1-CG1 4.31Å; L59-I64 WeakPolarHBondContact O-CD1 3.34Å
60	N	83.8	Confident	87	Confident	114 Å²	114	64.9 Å²	64.9	61%	0.61	35%	0.351	S	S	*	.			trans	-70.1	145.4	175.1	-77.3	-42.7	0	0	0	112.2	S62 V63 I64	N60-S62 VanDerWaalsContact C-N 3.34Å; N60-S62 PolarHBondContact O-N 3.37Å; N60-V63 HydrophobicContact CB-CB 4.49Å; N60-V63 HydrophobicContact CB-CG2 4.07Å; N60-V63 PolarHBondContact O-N 3.48Å; N60-V63 VanDerWaalsContact O-N 3.11Å; N60-I64 WeakPolarHBondContact O-CG1 3.25Å; N60-I64 PolarHBondContact O-N 2.9Å
61	S	85.8	Confident	87	Confident	47 Å²	47	64.9 Å²	64.9	33%	0.329	35%	0.351	S	S	.	.	H	α-helix	trans	-55.7	-44.6	-176.2	-173.5	0	0	0	0	113.4	K51 V63 I64 E65	K51-S61 WeakPolarHBondContact CD-OG 3.44Å; K51-S61 WeakPolarHBondContact CE-OG 3.27Å; K51-S61 PolarHBondContact NZ-OG 2.96Å; K51-S61 VanDerWaalsContact NZ-OG 3.09Å; S61-V63 VanDerWaalsContact C-N 3.32Å; S61-V63 PolarHBondContact O-N 2.69Å; S61-I64 WeakPolarHBondContact O-CB 3.33Å; S61-I64 PolarHBondContact O-N 2.89Å; S61-E65 PolarHBondContact O-N 3.42Å; S61-E65 VanDerWaalsContact O-OE2 3.13Å; S61-E65 PolarHBondContact OG-OE2 3.36Å
62	S	87	Confident	87	Confident	83 Å²	83	64.5 Å²	64.5	58%	0.58	35%	0.353	S	S	*	.	H	α-helix	trans	-63.5	-37.5	179.7	48.1	0	0	0	0	112.5	N60 E65 K66	N60-S62 VanDerWaalsContact C-N 3.34Å; N60-S62 PolarHBondContact O-N 3.37Å; S62-E65 PolarHBondContact O-N 2.84Å; S62-K66 WeakPolarHBondContact O-CB 3.46Å; S62-K66 PolarHBondContact O-N 2.93Å
63	V	89.1	Confident	87	Confident	53 Å²	53	66.3 Å²	66.3	32%	0.321	35%	0.351	S	S	.	.	H	α-helix	trans	-68.8	-42.9	175.9	-178	0	0	0	0	110.4	I27 N60 S61 E65 Q67	I27-V63 HydrophobicContact CD1-CG1 3.71Å; N60-V63 HydrophobicContact CB-CB 4.49Å; N60-V63 HydrophobicContact CB-CG2 4.07Å; N60-V63 PolarHBondContact O-N 3.48Å; N60-V63 VanDerWaalsContact O-N 3.11Å; S61-V63 VanDerWaalsContact C-N 3.32Å; S61-V63 PolarHBondContact O-N 2.69Å; V63-E65 VanDerWaalsContact C-N 3.33Å; V63-E65 PolarHBondContact O-N 2.8Å; V63-Q67 HydrophobicContact CG1-CG 4.15Å; V63-Q67 VanDerWaalsContact O-CB 3.28Å; V63-Q67 WeakPolarHBondContact O-CB 3.33Å; V63-Q67 VanDerWaalsContact O-CG 3.31Å; V63-Q67 WeakPolarHBondContact O-CG 3.37Å; V63-Q67 PolarHBondContact O-N 3.05Å
64	I	90	Very high	87	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-58.5	-45	175.2	-68.1	158	0	0	0	110.8	L31 K51 S54 L59 N60 S61 L68	L31-I64 HydrophobicContact CD2-CG2 4.18Å; K51-I64 HydrophobicContact CG-CG2 4.37Å; S54-I64 VanDerWaalsContact CB-CD1 3.47Å; L59-I64 HydrophobicContact CB-CD1 3.81Å; L59-I64 HydrophobicContact CB-CG1 3.72Å; L59-I64 HydrophobicContact CD1-CG1 4.31Å; L59-I64 WeakPolarHBondContact O-CD1 3.34Å; N60-I64 WeakPolarHBondContact O-CG1 3.25Å; N60-I64 PolarHBondContact O-N 2.9Å; S61-I64 WeakPolarHBondContact O-CB 3.33Å; S61-I64 PolarHBondContact O-N 2.89Å; I64-L68 WeakPolarHBondContact O-CB 3.3Å; I64-L68 PolarHBondContact O-N 3.03Å
65	E	90.8	Very high	86.8	Confident	62 Å²	62	69.3 Å²	69.3	29%	0.29	38%	0.376	S	S	.	.	H	α-helix	trans	-66.6	-53.4	179.4	-77.3	164.7	124.3	0	0	111.7	L47 K51 S61 S62 V63 Q67 L68 E69	L47-E65 HydrophobicContact CD1-CG 4.15Å; L47-E65 HydrophobicContact CD2-CG 4.43Å; K51-E65 WeakPolarHBondContact CE-OE1 3.36Å; K51-E65 WeakPolarHBondContact CE-OE2 3.38Å; K51-E65 IonicContact NZ-OE1 2.73Å; K51-E65 PolarHBondContact NZ-OE1 2.7Å; K51-E65 IonicContact NZ-OE2 2.8Å; K51-E65 PolarHBondContact NZ-OE2 2.68Å; S61-E65 PolarHBondContact O-N 3.42Å; S61-E65 VanDerWaalsContact O-OE2 3.13Å; S61-E65 PolarHBondContact OG-OE2 3.36Å; S62-E65 PolarHBondContact O-N 2.84Å; V63-E65 VanDerWaalsContact C-N 3.33Å; V63-E65 PolarHBondContact O-N 2.8Å; E65-Q67 VanDerWaalsContact C-N 3.34Å; E65-Q67 PolarHBondContact O-N 3.3Å; E65-L68 PolarHBondContact O-N 3.23Å; E65-E69 WeakPolarHBondContact O-CG 3.42Å; E65-E69 PolarHBondContact O-N 3.09Å
66	K	91	Very high	87.2	Confident	135 Å²	135	62.9 Å²	62.9	59%	0.587	36%	0.356	S	S	*	.	H	α-helix	trans	-57.4	-45.2	179	-172.7	175.2	-178.2	178.7	0	112.1	S62 E69 L70	S62-K66 WeakPolarHBondContact O-CB 3.46Å; S62-K66 PolarHBondContact O-N 2.93Å; K66-E69 PolarHBondContact O-N 2.7Å; K66-L70 HydrophobicContact CG-CD1 4.3Å; K66-L70 WeakPolarHBondContact O-CG 3.35Å; K66-L70 PolarHBondContact O-N 3.21Å
67	Q	91.9	Very high	87.7	Confident	29 Å²	29	56.8 Å²	56.8	14%	0.136	32%	0.319	C	S	.	.	H	α-helix	trans	-73.5	-31.5	-179.3	-66.2	-65	-5.3	0	0	113.1	D24 I27 V63 E65 A71	D24-Q67 HydrophobicContact CB-CG 4.47Å; I27-Q67 HydrophobicContact CB-CG 4.35Å; I27-Q67 HydrophobicContact CD1-CG 4.07Å; I27-Q67 HydrophobicContact CG2-CB 3.81Å; I27-Q67 HydrophobicContact CG2-CG 3.98Å; V63-Q67 HydrophobicContact CG1-CG 4.15Å; V63-Q67 VanDerWaalsContact O-CB 3.28Å; V63-Q67 WeakPolarHBondContact O-CB 3.33Å; V63-Q67 VanDerWaalsContact O-CG 3.31Å; V63-Q67 WeakPolarHBondContact O-CG 3.37Å; V63-Q67 PolarHBondContact O-N 3.05Å; E65-Q67 VanDerWaalsContact C-N 3.34Å; E65-Q67 PolarHBondContact O-N 3.3Å; Q67-A71 WeakPolarHBondContact O-CB 3.2Å; Q67-A71 PolarHBondContact O-N 2.93Å
68	L	92.6	Very high	88.2	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-69.7	-37.1	173.7	-176.1	63	0	0	0	111.7	L31 L47 L50 I64 E65 A71 V72 I77 Y89	L31-L68 HydrophobicContact CD1-CB 4.3Å; L31-L68 HydrophobicContact CD1-CD1 4.45Å; L47-L68 HydrophobicContact CD1-CD2 3.75Å; L50-L68 HydrophobicContact CD1-CD1 4.3Å; L50-L68 HydrophobicContact CD1-CD2 3.72Å; I64-L68 WeakPolarHBondContact O-CB 3.3Å; I64-L68 PolarHBondContact O-N 3.03Å; E65-L68 PolarHBondContact O-N 3.23Å; L68-A71 PolarHBondContact O-N 2.85Å; L68-V72 VanDerWaalsContact O-CG2 3.23Å; L68-V72 WeakPolarHBondContact O-CG2 3.37Å; L68-V72 PolarHBondContact O-N 2.85Å; L68-I77 HydrophobicContact CD1-CB 4.47Å; L68-I77 HydrophobicContact CD1-CD1 3.71Å; L68-I77 HydrophobicContact CD1-CG2 3.99Å; L68-Y89 HydrophobicContact CD1-CD1 3.84Å; L68-Y89 HydrophobicContact CD1-CE1 4.19Å; L68-Y89 HydrophobicContact CD1-CG 4.2Å; L68-Y89 HydrophobicContact CD2-CD1 4.07Å; L68-Y89 HydrophobicContact CD2-CD2 4.08Å; L68-Y89 HydrophobicContact CD2-CE1 3.79Å; L68-Y89 HydrophobicContact CD2-CE2 3.82Å; L68-Y89 HydrophobicContact CD2-CG 4.21Å; L68-Y89 HydrophobicContact CG-CD1 4.1Å; L68-Y89 HydrophobicContact CG-CE1 3.92Å
69	E	90.2	Very high	88.7	Confident	128 Å²	128	56.2 Å²	56.2	60%	0.598	30%	0.297	S	S	*	.	H	α-helix	trans	-70.2	-42.4	175.7	-69.8	-171.2	149.8	0	0	112.2	E65 K66 V72 K73	E65-E69 WeakPolarHBondContact O-CG 3.42Å; E65-E69 PolarHBondContact O-N 3.09Å; K66-E69 PolarHBondContact O-N 2.7Å; E69-V72 PolarHBondContact O-N 3.42Å; E69-K73 PolarHBondContact O-N 2.91Å
70	L	90	Very high	88.7	Confident	26 Å²	26	57.7 Å²	57.7	14%	0.136	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-43.9	170.3	-69.2	172.8	0	0	0	111.5	P23 K66 V72 K73 H74	P23-L70 HydrophobicContact CB-CB 3.82Å; K66-L70 HydrophobicContact CG-CD1 4.3Å; K66-L70 WeakPolarHBondContact O-CG 3.35Å; K66-L70 PolarHBondContact O-N 3.21Å; L70-V72 PolarHBondContact O-N 3.49Å; L70-K73 PolarHBondContact O-N 2.86Å; L70-H74 WeakPolarHBondContact O-CB 3.47Å; L70-H74 PolarHBondContact O-CD2 3.02Å; L70-H74 VanDerWaalsContact O-CD2 3.23Å; L70-H74 PolarHBondContact O-N 3.25Å
71	A	92.1	Very high	88.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-30.5	176.1	0	0	0	0	0	113.3	V28 Q67 L68 G75 L76 I77	V28-A71 HydrophobicContact CG2-CB 3.77Å; Q67-A71 WeakPolarHBondContact O-CB 3.2Å; Q67-A71 PolarHBondContact O-N 2.93Å; L68-A71 PolarHBondContact O-N 2.85Å; A71-G75 PolarHBondContact O-N 3.37Å; A71-L76 HydrophobicContact CB-CB 4.34Å; A71-L76 PolarHBondContact O-N 3.11Å; A71-I77 HydrophobicContact CB-CB 4.18Å; A71-I77 HydrophobicContact CB-CD1 3.81Å; A71-I77 HydrophobicContact CB-CG1 3.98Å; A71-I77 PolarHBondContact O-N 3.5Å
72	V	91.3	Very high	87.3	Confident	43 Å²	43	56.3 Å²	56.3	26%	0.261	30%	0.298	S	S	.	.	H	α-helix	trans	-75.8	-44.5	173	170.2	0	0	0	0	111.3	L68 E69 L70 H74 G75 I77 K79 Y89	L68-V72 VanDerWaalsContact O-CG2 3.23Å; L68-V72 WeakPolarHBondContact O-CG2 3.37Å; L68-V72 PolarHBondContact O-N 2.85Å; E69-V72 PolarHBondContact O-N 3.42Å; L70-V72 PolarHBondContact O-N 3.49Å; V72-H74 VanDerWaalsContact C-N 3.29Å; V72-H74 PolarHBondContact O-N 3.18Å; V72-G75 PolarHBondContact O-N 2.87Å; V72-G75 VanDerWaalsContact O-N 3.08Å; V72-I77 WeakPolarHBondContact CA-O 3.2Å; V72-I77 HydrophobicContact CG2-CB 4.42Å; V72-I77 HydrophobicContact CG2-CG2 4.41Å; V72-I77 WeakPolarHBondContact CG2-O 3.13Å; V72-K79 HydrophobicContact CG1-CB 3.87Å; V72-K79 HydrophobicContact CG1-CD 4.42Å; V72-K79 HydrophobicContact CG2-CB 3.97Å; V72-Y89 HydrophobicContact CG2-CD1 4.24Å; V72-Y89 HydrophobicContact CG2-CE1 4.14Å
73	K	87.3	Confident	86.1	Confident	116 Å²	116	60.2 Å²	60.2	50%	0.504	32%	0.319	S	S	.	.	H	α-helix	trans	-57.8	-41.2	175.6	-172.5	-168.8	177.3	-157.7	0	111.7	S19 D20 E69 L70 G75	S19-K73 PolarHBondContact O-NZ 3.21Å; D20-K73 IonicContact OD1-NZ 2.67Å; D20-K73 PolarHBondContact OD1-NZ 3.49Å; E69-K73 PolarHBondContact O-N 2.91Å; L70-K73 PolarHBondContact O-N 2.86Å; K73-G75 VanDerWaalsContact C-N 3.34Å
74	H	85.8	Confident	84.9	Confident	83 Å²	83	62.1 Å²	62.1	38%	0.384	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	5.2	178.4	-69.8	-104.7	0	0	0	114	P23 L70 V72 L76	P23-H74 HydrophobicContact CG-CB 4.2Å; L70-H74 WeakPolarHBondContact O-CB 3.47Å; L70-H74 PolarHBondContact O-CD2 3.02Å; L70-H74 VanDerWaalsContact O-CD2 3.23Å; L70-H74 PolarHBondContact O-N 3.25Å; V72-H74 VanDerWaalsContact C-N 3.29Å; V72-H74 PolarHBondContact O-N 3.18Å; H74-L76 HydrophobicContact CB-CG 4.37Å; H74-L76 PolarHBondContact O-N 2.89Å
75	G	84.5	Confident	84	Confident	40 Å²	40	64.4 Å²	64.4	41%	0.412	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	12.6	175.1	0	0	0	0	0	116	A71 V72 K73 P92	A71-G75 PolarHBondContact O-N 3.37Å; V72-G75 PolarHBondContact O-N 2.87Å; V72-G75 VanDerWaalsContact O-N 3.08Å; K73-G75 VanDerWaalsContact C-N 3.34Å; G75-P92 WeakPolarHBondContact O-CG 3.42Å
76	L	88.5	Confident	83.3	Confident	57 Å²	57	66.3 Å²	66.3	30%	0.298	36%	0.362	S	S	.	.	S	Bend	trans	-76.3	-23.5	176.3	-58.5	179.3	0	0	0	112.6	P23 M25 V28 A71 H74 P92	P23-L76 HydrophobicContact CG-CD1 3.63Å; M25-L76 HydrophobicContact CE-CD1 4.26Å; M25-L76 HydrophobicContact SD-CD1 3.63Å; V28-L76 HydrophobicContact CG1-CB 4.09Å; V28-L76 HydrophobicContact CG1-CD1 4.19Å; V28-L76 HydrophobicContact CG2-CD1 4.45Å; A71-L76 HydrophobicContact CB-CB 4.34Å; A71-L76 PolarHBondContact O-N 3.11Å; H74-L76 HydrophobicContact CB-CG 4.37Å; H74-L76 PolarHBondContact O-N 2.89Å; L76-P92 WeakPolarHBondContact O-CD 3.49Å; L76-P92 VanDerWaalsContact O-CG 3.32Å; L76-P92 WeakPolarHBondContact O-CG 3.48Å
77	I	90.8	Very high	82.9	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	36%	0.358	C	S	.	.	S	Bend	trans	-133.2	130.4	171.9	-64.6	174.5	0	0	0	108.3	L31 L32 I35 L68 A71 V72 Y89	L31-I77 HydrophobicContact CB-CD1 3.99Å; L31-I77 HydrophobicContact CD1-CD1 4.4Å; L32-I77 HydrophobicContact CD2-CG1 3.98Å; L32-I77 HydrophobicContact CG-CG1 4.4Å; I35-I77 HydrophobicContact CD1-CD1 3.9Å; I35-I77 HydrophobicContact CD1-CG1 4.17Å; I35-I77 HydrophobicContact CD1-CG2 3.82Å; L68-I77 HydrophobicContact CD1-CB 4.47Å; L68-I77 HydrophobicContact CD1-CD1 3.71Å; L68-I77 HydrophobicContact CD1-CG2 3.99Å; A71-I77 HydrophobicContact CB-CB 4.18Å; A71-I77 HydrophobicContact CB-CD1 3.81Å; A71-I77 HydrophobicContact CB-CG1 3.98Å; A71-I77 PolarHBondContact O-N 3.5Å; V72-I77 WeakPolarHBondContact CA-O 3.2Å; V72-I77 HydrophobicContact CG2-CB 4.42Å; V72-I77 HydrophobicContact CG2-CG2 4.41Å; V72-I77 WeakPolarHBondContact CG2-O 3.13Å; I77-Y89 HydrophobicContact CG2-CD1 4.09Å; I77-Y89 HydrophobicContact CG2-CG 4.5Å
78	L	87.6	Confident	82.7	Confident	54 Å²	54	65.9 Å²	65.9	28%	0.283	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	129.6	174.1	-58.4	-177.7	0	0	0	110.8	L80 Y89 A90 P92 V95 I97	L78-L80 HydrophobicContact CB-CD2 4.04Å; L78-L80 HydrophobicContact CB-CG 4.13Å; L78-L80 HydrophobicContact CD1-CD2 4.48Å; L78-Y89 CarbonylContact O-C 3.48Å; L78-Y89 WeakPolarHBondContact O-CA 3.34Å; L78-A90 HydrophobicContact CB-CB 4.47Å; L78-A90 PolarHBondContact N-O 2.84Å; L78-A90 PolarHBondContact O-N 3.02Å; L78-P92 HydrophobicContact CD1-CB 4.28Å; L78-P92 HydrophobicContact CD2-CB 4.3Å; L78-P92 HydrophobicContact CD2-CG 4.27Å; L78-P92 HydrophobicContact CG-CB 4Å; L78-P92 HydrophobicContact CG-CG 3.99Å; L78-V95 HydrophobicContact CD1-CG2 4.07Å; L78-I97 HydrophobicContact CD1-CD1 3.97Å
79	K	90.4	Very high	82.7	Confident	80 Å²	80	66.4 Å²	66.4	35%	0.348	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	105.7	168.8	-172.5	174.1	-175.3	174.6	0	108.5	V72 W87 Y89	V72-K79 HydrophobicContact CG1-CB 3.87Å; V72-K79 HydrophobicContact CG1-CD 4.42Å; V72-K79 HydrophobicContact CG2-CB 3.97Å; K79-W87 HydrophobicContact CD-CE3 4.43Å; K79-W87 HydrophobicContact CG-CD2 4.21Å; K79-W87 HydrophobicContact CG-CE3 3.7Å; K79-W87 HydrophobicContact CG-CZ3 4.2Å; K79-Y89 HydrophobicContact CB-CD1 4.22Å; K79-Y89 HydrophobicContact CB-CE1 3.98Å; K79-Y89 HydrophobicContact CD-CE1 3.95Å; K79-Y89 HydrophobicContact CG-CD1 4.31Å; K79-Y89 HydrophobicContact CG-CE1 3.7Å
80	L	83.4	Confident	82.6	Confident	56 Å²	56	60.4 Å²	60.4	29%	0.293	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	137.4	-173.4	-57.5	176.8	0	0	0	110.5	L78 W87 S88 A90 V95 I97	L78-L80 HydrophobicContact CB-CD2 4.04Å; L78-L80 HydrophobicContact CB-CG 4.13Å; L78-L80 HydrophobicContact CD1-CD2 4.48Å; L80-W87 WeakPolarHBondContact O-CA 3.29Å; L80-S88 PolarHBondContact N-O 2.86Å; L80-S88 PolarHBondContact O-N 3.23Å; L80-A90 HydrophobicContact CD1-CB 3.85Å; L80-V95 HydrophobicContact CD1-CG1 4.41Å; L80-I97 HydrophobicContact CD1-CD1 4.15Å; L80-I97 HydrophobicContact CD2-CD1 3.76Å
81	L	76.8	Confident	82.4	Confident	109 Å²	109	60.8 Å²	60.8	57%	0.571	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.1	171.2	-164.5	68.5	0	0	0	109.2	G85 W87	L81-G85 VanDerWaalsContact CD1-O 3.28Å; L81-G85 WeakPolarHBondContact CD1-O 3.34Å; L81-W87 HydrophobicContact CB-CE3 4.2Å; L81-W87 HydrophobicContact CB-CH2 4.45Å; L81-W87 HydrophobicContact CB-CZ3 3.94Å; L81-W87 HydrophobicContact CD1-CD2 3.94Å; L81-W87 HydrophobicContact CD1-CE3 4.02Å; L81-W87 HydrophobicContact CD1-CH2 4.21Å; L81-W87 HydrophobicContact CD1-CZ2 4.11Å; L81-W87 HydrophobicContact CD1-CZ3 4.16Å
82	G	61.8	Low	81.8	Confident	23 Å²	23	62.9 Å²	62.9	24%	0.237	35%	0.349	C	S	.	.			trans	-72.4	161.5	175.7	0	0	0	0	0	112.5	N84 G85 L86	G82-N84 PolarHBondContact O-N 2.88Å; G82-N84 VanDerWaalsContact O-N 3.09Å; G82-G85 PolarHBondContact O-N 2.63Å; G82-L86 PolarHBondContact N-O 3.45Å
83	V	61.9	Low	81	Confident	166 Å²	166	67.9 Å²	67.9	100%	1.006	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-19	174.5	-161.2	0	0	0	0	112
84	N	65.1	Low	79.9	Confident	93 Å²	93	67.1 Å²	67.1	50%	0.497	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	12.2	173.4	62.7	-9.5	0	0	0	114.2	Q44 G82 L86	Q44-N84 PolarHBondContact NE2-OD1 3.31Å; Q44-N84 PolarHBondContact OE1-ND2 3.49Å; G82-N84 PolarHBondContact O-N 2.88Å; G82-N84 VanDerWaalsContact O-N 3.09Å; N84-L86 PolarHBondContact O-N 2.99Å; N84-L86 VanDerWaalsContact O-N 3.15Å; N84-L86 PolarHBondContact OD1-N 3.31Å
85	G	69.9	Low	78.5	Confident	48 Å²	48	65.3 Å²	65.3	50%	0.495	37%	0.371	S	S	.	.	S	Bend	trans	72.1	-1	-178.7	0	0	0	0	0	115.4	L81 G82	L81-G85 VanDerWaalsContact CD1-O 3.28Å; L81-G85 WeakPolarHBondContact CD1-O 3.34Å; G82-G85 PolarHBondContact O-N 2.63Å
86	L	76.1	Confident	76.5	Confident	103 Å²	103	72 Å²	72	54%	0.539	40%	0.397	S	S	.	.			trans	-93.3	135.7	179.9	-65.6	177	0	0	0	111.5	Q44 G82 N84	Q44-L86 PolarHBondContact NE2-O 3.25Å; Q44-L86 VanDerWaalsContact NE2-O 3.11Å; G82-L86 PolarHBondContact N-O 3.45Å; N84-L86 PolarHBondContact O-N 2.99Å; N84-L86 VanDerWaalsContact O-N 3.15Å; N84-L86 PolarHBondContact OD1-N 3.31Å
87	W	84.1	Confident	74.2	Confident	132 Å²	132	73.3 Å²	73.3	50%	0.5	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	135.9	176	-65.2	109.8	0	0	0	112.1	K79 L80 L81	K79-W87 HydrophobicContact CD-CE3 4.43Å; K79-W87 HydrophobicContact CG-CD2 4.21Å; K79-W87 HydrophobicContact CG-CE3 3.7Å; K79-W87 HydrophobicContact CG-CZ3 4.2Å; L80-W87 WeakPolarHBondContact O-CA 3.29Å; L81-W87 HydrophobicContact CB-CE3 4.2Å; L81-W87 HydrophobicContact CB-CH2 4.45Å; L81-W87 HydrophobicContact CB-CZ3 3.94Å; L81-W87 HydrophobicContact CD1-CD2 3.94Å; L81-W87 HydrophobicContact CD1-CE3 4.02Å; L81-W87 HydrophobicContact CD1-CH2 4.21Å; L81-W87 HydrophobicContact CD1-CZ2 4.11Å; L81-W87 HydrophobicContact CD1-CZ3 4.16Å
88	S	87.8	Confident	71.6	Confident	23 Å²	23	75.5 Å²	75.5	16%	0.161	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.7	174.6	-172.2	0	0	0	0	110.6	V45 L80	V45-S88 PolarHBondContact N-OG 3.43Å; V45-S88 VanDerWaalsContact N-OG 3.16Å; V45-S88 WeakPolarHBondContact O-CA 3.44Å; L80-S88 PolarHBondContact N-O 2.86Å; L80-S88 PolarHBondContact O-N 3.23Å
89	Y	91.6	Very high	69.4	Low	13 Å²	13	82.7 Å²	82.7	5%	0.051	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	148.6	-179.8	-60.1	-82.5	0	0	0	112.5	V45 L47 L50 L68 V72 I77 L78 K79	V45-Y89 WeakPolarHBondContact CB-O 3.42Å; V45-Y89 WeakPolarHBondContact O-CD2 3.27Å; V45-Y89 PolarHBondContact O-N 3.22Å; L47-Y89 HydrophobicContact CB-CE2 4.11Å; L50-Y89 HydrophobicContact CD1-CD2 3.47Å; L50-Y89 VanDerWaalsContact CD1-CD2 3.47Å; L50-Y89 HydrophobicContact CD1-CE2 4.22Å; L50-Y89 HydrophobicContact CD1-CG 3.87Å; L68-Y89 HydrophobicContact CD1-CD1 3.84Å; L68-Y89 HydrophobicContact CD1-CE1 4.19Å; L68-Y89 HydrophobicContact CD1-CG 4.2Å; L68-Y89 HydrophobicContact CD2-CD1 4.07Å; L68-Y89 HydrophobicContact CD2-CD2 4.08Å; L68-Y89 HydrophobicContact CD2-CE1 3.79Å; L68-Y89 HydrophobicContact CD2-CE2 3.82Å; L68-Y89 HydrophobicContact CD2-CG 4.21Å; L68-Y89 HydrophobicContact CG-CD1 4.1Å; L68-Y89 HydrophobicContact CG-CE1 3.92Å; V72-Y89 HydrophobicContact CG2-CD1 4.24Å; V72-Y89 HydrophobicContact CG2-CE1 4.14Å; I77-Y89 HydrophobicContact CG2-CD1 4.09Å; I77-Y89 HydrophobicContact CG2-CG 4.5Å; L78-Y89 CarbonylContact O-C 3.48Å; L78-Y89 WeakPolarHBondContact O-CA 3.34Å; K79-Y89 HydrophobicContact CB-CD1 4.22Å; K79-Y89 HydrophobicContact CB-CE1 3.98Å; K79-Y89 HydrophobicContact CD-CE1 3.95Å; K79-Y89 HydrophobicContact CG-CD1 4.31Å; K79-Y89 HydrophobicContact CG-CE1 3.7Å
90	A	87.8	Confident	67.2	Low	3 Å²	3	85 Å²	85	3%	0.025	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	138.1	-177	0	0	0	0	0	113.6	L78 L80 P92 V95	L78-A90 HydrophobicContact CB-CB 4.47Å; L78-A90 PolarHBondContact N-O 2.84Å; L78-A90 PolarHBondContact O-N 3.02Å; L80-A90 HydrophobicContact CD1-CB 3.85Å; A90-P92 WeakPolarHBondContact O-CD 3.5Å; A90-V95 HydrophobicContact CB-CG2 3.74Å
91	D	85.6	Confident	65.8	Low	34 Å²	34	87.7 Å²	87.7	18%	0.182	47%	0.466	C	S	.	.			trans	-56.5	120.2	163.9	169	13.3	0	0	0	110.8	L32 N93 N94 V95	L32-D91 HydrophobicContact CD2-CB 3.65Å; D91-N93 PolarHBondContact O-N 3.41Å; D91-N93 VanDerWaalsContact OD1-CB 3.32Å; D91-N93 WeakPolarHBondContact OD1-CB 3.34Å; D91-N93 PolarHBondContact OD1-N 3.39Å; D91-N93 PolarHBondContact OD1-ND2 3.04Å; D91-N94 HydrophobicContact CB-CB 4.03Å; D91-N94 CarbonylContact O-C 3.58Å; D91-N94 PolarHBondContact O-N 3.03Å; D91-N94 WeakPolarHBondContact OD2-CB 3.45Å; D91-V95 WeakPolarHBondContact O-CG2 3.44Å
92	P	79.4	Confident	65	Low	43 Å²	43	86.2 Å²	86.2	28%	0.279	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-58.4	-30.3	179.7	-17.9	26.4	0	0	0	113.6	G75 L76 L78 A90 N94	G75-P92 WeakPolarHBondContact O-CG 3.42Å; L76-P92 WeakPolarHBondContact O-CD 3.49Å; L76-P92 VanDerWaalsContact O-CG 3.32Å; L76-P92 WeakPolarHBondContact O-CG 3.48Å; L78-P92 HydrophobicContact CD1-CB 4.28Å; L78-P92 HydrophobicContact CD2-CB 4.3Å; L78-P92 HydrophobicContact CD2-CG 4.27Å; L78-P92 HydrophobicContact CG-CB 4Å; L78-P92 HydrophobicContact CG-CG 3.99Å; A90-P92 WeakPolarHBondContact O-CD 3.5Å; P92-N94 PolarHBondContact O-N 2.84Å
93	N	75.3	Confident	65.2	Low	148 Å²	148	86.5 Å²	86.5	79%	0.791	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-74.9	-15.8	-179.9	-53.7	-81.2	0	0	0	112.3	D91	D91-N93 PolarHBondContact O-N 3.41Å; D91-N93 VanDerWaalsContact OD1-CB 3.32Å; D91-N93 WeakPolarHBondContact OD1-CB 3.34Å; D91-N93 PolarHBondContact OD1-N 3.39Å; D91-N93 PolarHBondContact OD1-ND2 3.04Å
94	N	64.9	Low	65.6	Low	101 Å²	101	84.7 Å²	84.7	54%	0.54	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-126	39.7	-170.3	-162.7	4.9	0	0	0	111.7	K39 D91 P92	K39-N94 PolarHBondContact NZ-O 2.66Å; D91-N94 HydrophobicContact CB-CB 4.03Å; D91-N94 CarbonylContact O-C 3.58Å; D91-N94 PolarHBondContact O-N 3.03Å; D91-N94 WeakPolarHBondContact OD2-CB 3.45Å; P92-N94 PolarHBondContact O-N 2.84Å
95	V	55.8	Low	65.9	Low	45 Å²	45	80.3 Å²	80.3	27%	0.273	42%	0.415	S	S	.	.			trans	-132.6	126.6	163.7	-145.8	0	0	0	0	109.8	L78 L80 A90 D91 I97	L78-V95 HydrophobicContact CD1-CG2 4.07Å; L80-V95 HydrophobicContact CD1-CG1 4.41Å; A90-V95 HydrophobicContact CB-CG2 3.74Å; D91-V95 WeakPolarHBondContact O-CG2 3.44Å; V95-I97 HydrophobicContact CB-CD1 4.1Å; V95-I97 HydrophobicContact CB-CG1 4.11Å; V95-I97 HydrophobicContact CG1-CD1 3.89Å; V95-I97 HydrophobicContact CG1-CG1 3.74Å; V95-I97 PolarHBondContact O-N 3.44Å
96	N	42.9	Very low	65.9	Low	180 Å²	180	81 Å²	81	96%	0.963	41%	0.408	S	S	*	.			trans	-78.5	50.6	168.8	-79.6	-55.5	0	0	0	111.2
97	I	39.4	Very low	65.5	Low	85 Å²	85	83.3 Å²	83.3	44%	0.436	42%	0.416	S	S	.	.			trans	-69.9	138.3	163.7	-68.8	165.7	0	0	0	107	L78 L80 V95 R99	L78-I97 HydrophobicContact CD1-CD1 3.97Å; L80-I97 HydrophobicContact CD1-CD1 4.15Å; L80-I97 HydrophobicContact CD2-CD1 3.76Å; V95-I97 HydrophobicContact CB-CD1 4.1Å; V95-I97 HydrophobicContact CB-CG1 4.11Å; V95-I97 HydrophobicContact CG1-CD1 3.89Å; V95-I97 HydrophobicContact CG1-CG1 3.74Å; V95-I97 PolarHBondContact O-N 3.44Å; I97-R99 PolarHBondContact O-N 3.41Å
98	G	36.4	Very low	64.9	Low	47 Å²	47	86.5 Å²	86.5	49%	0.485	43%	0.433	S	S	.	.			trans	-56.5	132	178	0	0	0	0	0	110.5	F100	G98-F100 VanDerWaalsContact C-N 3.31Å; G98-F100 PolarHBondContact O-N 3.49Å
99	R	41.4	Very low	64.4	Low	205 Å²	205	87.9 Å²	87.9	77%	0.774	44%	0.441	S	S	*	.			trans	-66.6	94	170.1	-72	-178.3	177.7	-174.3	-3.5	108.5	I97 R101	I97-R99 PolarHBondContact O-N 3.41Å; R99-R101 PolarHBondContact O-N 2.91Å
100	F	43.7	Very low	63.9	Low	129 Å²	129	90.7 Å²	90.7	57%	0.566	46%	0.456	S	S	*	.			trans	-50.5	110.5	156.4	-73.2	-70.3	0	0	0	106.9	G98 T102 D142	G98-F100 VanDerWaalsContact C-N 3.31Å; G98-F100 PolarHBondContact O-N 3.49Å; F100-T102 PolarHBondContact O-N 3.32Å; F100-D142 HydrophobicContact CB-CB 4.39Å
101	R	54.2	Low	63.8	Low	111 Å²	111	90.9 Å²	90.9	42%	0.419	46%	0.457	S	S	.	.			trans	-85.7	104.1	171.3	-69.3	-179.3	-177	-122.3	6.4	105.7	R99 L103 Y141 D142	R99-R101 PolarHBondContact O-N 2.91Å; R101-L103 PolarHBondContact O-N 3.47Å; R101-L103 VanDerWaalsContact O-N 3.13Å; R101-Y141 HydrophobicContact CB-CD1 3.75Å; R101-Y141 HydrophobicContact CB-CE1 3.95Å; R101-Y141 WeakPolarHBondContact O-CD1 3.43Å; R101-D142 PolarHBondContact O-N 3.1Å
102	T	60.2	Low	64	Low	79 Å²	79	89.2 Å²	89.2	49%	0.485	45%	0.448	S	S	.	.			trans	-54.8	121.7	169.4	-57.8	0	0	0	0	108.6	F100 D142 R144	F100-T102 PolarHBondContact O-N 3.32Å; T102-D142 CarbonylContact C-O 3.57Å; T102-D142 VanDerWaalsContact CA-O 3.25Å; T102-D142 WeakPolarHBondContact CA-O 3.34Å; T102-D142 WeakPolarHBondContact CB-OD2 3.47Å; T102-D142 WeakPolarHBondContact CG2-OD2 3.41Å; T102-D142 PolarHBondContact OG1-OD2 2.83Å; T102-R144 HydrophobicContact CG2-CG 4.28Å
103	L	65.1	Low	64.4	Low	29 Å²	29	95.7 Å²	95.7	15%	0.152	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	97.4	-176.4	-169.1	76.7	0	0	0	107.6	R101 V105 L111 I114 Y141 D142 M143 R144	R101-L103 PolarHBondContact O-N 3.47Å; R101-L103 VanDerWaalsContact O-N 3.13Å; L103-V105 HydrophobicContact CD2-CG2 3.79Å; L103-V105 HydrophobicContact CG-CG2 3.82Å; L103-L111 HydrophobicContact CD2-CD2 4.02Å; L103-I114 HydrophobicContact CD1-CD1 3.48Å; L103-I114 VanDerWaalsContact CD1-CD1 3.48Å; L103-I114 HydrophobicContact CD2-CD1 3.66Å; L103-I114 HydrophobicContact CG-CD1 4.21Å; L103-Y141 HydrophobicContact CB-CD1 4.24Å; L103-Y141 HydrophobicContact CD2-CD1 4.45Å; L103-D142 PolarHBondContact N-O 2.9Å; L103-M143 HydrophobicContact CB-CG 4.42Å; L103-M143 HydrophobicContact CD2-CE 4.39Å; L103-M143 HydrophobicContact CD2-CG 4.45Å; L103-R144 PolarHBondContact O-N 3.23Å
104	Q	70	Confident	64.9	Low	127 Å²	127	89.9 Å²	89.9	59%	0.593	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	130.1	166.9	-68.9	-175.4	-6.1	0	0	108.6	R144	Q104-R144 VanDerWaalsContact CA-O 3.32Å; Q104-R144 WeakPolarHBondContact CA-O 3.24Å; Q104-R144 HydrophobicContact CG-CB 4.26Å
105	V	72.4	Confident	66.1	Low	1 Å²	1	85.1 Å²	85.1	1%	0.006	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	106.2	-178.1	-178.1	0	0	0	0	109.2	L103 L111 M143 R144 V145 K146 L154	L103-V105 HydrophobicContact CD2-CG2 3.79Å; L103-V105 HydrophobicContact CG-CG2 3.82Å; V105-L111 HydrophobicContact CG1-CD1 4.15Å; V105-L111 HydrophobicContact CG1-CD2 4.3Å; V105-L111 HydrophobicContact CG1-CG 4.47Å; V105-L111 HydrophobicContact CG2-CD2 3.93Å; V105-M143 HydrophobicContact CB-CE 4.48Å; V105-M143 HydrophobicContact CG2-CE 3.75Å; V105-R144 PolarHBondContact N-O 3.46Å; V105-V145 HydrophobicContact CB-CG2 4.44Å; V105-V145 WeakPolarHBondContact O-CA 3.34Å; V105-K146 PolarHBondContact O-N 3.27Å; V105-L154 HydrophobicContact CG1-CD1 4.1Å; V105-L154 HydrophobicContact CG1-CD2 4.06Å
106	D	68.8	Low	67.7	Low	64 Å²	64	84.8 Å²	84.8	34%	0.342	41%	0.406	S	S	.	.			trans	-99.4	160.3	169	-57.5	-6.3	0	0	0	108.3	K108 T109 K146	D106-K108 PolarHBondContact O-N 3.33Å; D106-T109 PolarHBondContact N-OG1 3.05Å; D106-T109 VanDerWaalsContact O-CB 3.22Å; D106-T109 WeakPolarHBondContact O-CB 3.27Å; D106-T109 PolarHBondContact O-N 3.36Å; D106-T109 PolarHBondContact O-OG1 3.46Å; D106-K146 WeakPolarHBondContact OD1-CD 3.5Å; D106-K146 VanDerWaalsContact OD1-CG 3.31Å; D106-K146 WeakPolarHBondContact OD1-CG 3.3Å; D106-K146 IonicContact OD1-NZ 2.75Å; D106-K146 PolarHBondContact OD1-NZ 3.33Å; D106-K146 IonicContact OD2-NZ 2.6Å; D106-K146 PolarHBondContact OD2-NZ 2.81Å
107	E	68.7	Low	69.8	Low	151 Å²	151	80.1 Å²	80.1	71%	0.706	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.4	-34.1	179.9	-71.4	169.5	174.6	0	0	115.5	T109 L149	E107-T109 VanDerWaalsContact C-N 3.32Å; E107-T109 PolarHBondContact O-N 2.87Å; E107-L149 HydrophobicContact CG-CD1 3.82Å
108	K	72.2	Confident	72	Confident	198 Å²	198	76 Å²	76	86%	0.861	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	3.7	-174.1	-61.5	172.3	-175.7	171.9	0	113.6	D106	D106-K108 PolarHBondContact O-N 3.33Å
109	T	76.7	Confident	74.5	Confident	53 Å²	53	74.2 Å²	74.2	33%	0.325	33%	0.333	S	S	.	.			trans	-85.3	113	-171.4	-47.3	0	0	0	0	111.8	D106 E107 L111	D106-T109 PolarHBondContact N-OG1 3.05Å; D106-T109 VanDerWaalsContact O-CB 3.22Å; D106-T109 WeakPolarHBondContact O-CB 3.27Å; D106-T109 PolarHBondContact O-N 3.36Å; D106-T109 PolarHBondContact O-OG1 3.46Å; E107-T109 VanDerWaalsContact C-N 3.32Å; E107-T109 PolarHBondContact O-N 2.87Å; T109-L111 HydrophobicContact CG2-CD2 4.13Å; T109-L111 PolarHBondContact O-N 3.37Å
110	D	81	Confident	76.5	Confident	71 Å²	71	69.1 Å²	69.1	38%	0.38	31%	0.314	S	S	.	.			trans	-74.6	97.4	175.2	-174.7	16.9	0	0	0	112.3	A112 Q165	D110-A112 VanDerWaalsContact C-N 3.31Å; D110-A112 WeakPolarHBondContact OD1-CB 3.45Å; D110-A112 PolarHBondContact OD1-N 3.08Å; D110-Q165 PolarHBondContact OD2-NE2 2.97Å
111	L	86.5	Confident	78.2	Confident	7 Å²	7	66.7 Å²	66.7	4%	0.037	31%	0.307	C	S	.	.			trans	-77.6	-7.3	175	-60.3	179.3	0	0	0	113.6	L103 V105 T109 R113 I114 V115 L154 A158	L103-L111 HydrophobicContact CD2-CD2 4.02Å; V105-L111 HydrophobicContact CG1-CD1 4.15Å; V105-L111 HydrophobicContact CG1-CD2 4.3Å; V105-L111 HydrophobicContact CG1-CG 4.47Å; V105-L111 HydrophobicContact CG2-CD2 3.93Å; T109-L111 HydrophobicContact CG2-CD2 4.13Å; T109-L111 PolarHBondContact O-N 3.37Å; L111-R113 PolarHBondContact O-N 3.42Å; L111-R113 VanDerWaalsContact O-N 3.17Å; L111-I114 HydrophobicContact CD2-CD1 3.9Å; L111-I114 CarbonylContact O-C 3.58Å; L111-I114 WeakPolarHBondContact O-CA 3.41Å; L111-I114 WeakPolarHBondContact O-CB 3.18Å; L111-I114 PolarHBondContact O-N 2.58Å; L111-V115 PolarHBondContact O-N 3.37Å; L111-L154 HydrophobicContact CD1-CB 3.97Å; L111-A158 HydrophobicContact CB-CB 3.53Å
112	A	89.2	Confident	79.5	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.4	-37.7	-175.6	0	0	0	0	0	112.9	D110 I114 V115 Q116 K161 A162 L167	D110-A112 VanDerWaalsContact C-N 3.31Å; D110-A112 WeakPolarHBondContact OD1-CB 3.45Å; D110-A112 PolarHBondContact OD1-N 3.08Å; A112-I114 VanDerWaalsContact C-N 3.3Å; A112-I114 PolarHBondContact O-N 2.76Å; A112-V115 PolarHBondContact O-N 2.97Å; A112-Q116 WeakPolarHBondContact O-CB 3.45Å; A112-Q116 PolarHBondContact O-N 3.46Å; A112-K161 HydrophobicContact CB-CB 4.13Å; A112-A162 HydrophobicContact CB-CB 3.9Å; A112-L167 HydrophobicContact CB-CD1 4.31Å
113	R	86.7	Confident	80	Confident	179 Å²	179	63.8 Å²	63.8	68%	0.675	30%	0.296	S	S	*	.	H	α-helix	trans	-72.1	-19.6	174.6	-69.4	-174.7	174.5	-167.8	-0.5	114.2	L111 R117 L167	L111-R113 PolarHBondContact O-N 3.42Å; L111-R113 VanDerWaalsContact O-N 3.17Å; R113-R117 PolarHBondContact O-N 2.73Å; R113-L167 HydrophobicContact CG-CD1 4.16Å
114	I	86.1	Confident	80.6	Confident	26 Å²	26	64.9 Å²	64.9	13%	0.133	30%	0.302	C	S	.	.	H	α-helix	trans	-82	-45.7	173	-59.6	-179.6	0	0	0	108.8	L103 L111 A112 Q116 R117 V118 Y141	L103-I114 HydrophobicContact CD1-CD1 3.48Å; L103-I114 VanDerWaalsContact CD1-CD1 3.48Å; L103-I114 HydrophobicContact CD2-CD1 3.66Å; L103-I114 HydrophobicContact CG-CD1 4.21Å; L111-I114 HydrophobicContact CD2-CD1 3.9Å; L111-I114 CarbonylContact O-C 3.58Å; L111-I114 WeakPolarHBondContact O-CA 3.41Å; L111-I114 WeakPolarHBondContact O-CB 3.18Å; L111-I114 PolarHBondContact O-N 2.58Å; A112-I114 VanDerWaalsContact C-N 3.3Å; A112-I114 PolarHBondContact O-N 2.76Å; I114-Q116 VanDerWaalsContact C-N 3.31Å; I114-Q116 PolarHBondContact O-N 3.36Å; I114-R117 CarbonylContact O-C 3.6Å; I114-R117 WeakPolarHBondContact O-CA 3.4Å; I114-R117 VanDerWaalsContact O-CB 3.31Å; I114-R117 WeakPolarHBondContact O-CB 3.34Å; I114-R117 PolarHBondContact O-N 3.06Å; I114-V118 HydrophobicContact CG2-CG2 4.36Å; I114-V118 WeakPolarHBondContact O-CG2 3.23Å; I114-V118 PolarHBondContact O-N 2.95Å; I114-Y141 HydrophobicContact CG2-CE1 4.49Å; I114-Y141 HydrophobicContact CG2-CE2 4.45Å
115	V	90.1	Very high	80.5	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-56.8	-44.1	171.3	-176.8	0	0	0	0	111.1	L111 A112 R117 V118 V119 I133 L155 A158 V159 L168	L111-V115 PolarHBondContact O-N 3.37Å; A112-V115 PolarHBondContact O-N 2.97Å; V115-R117 PolarHBondContact O-N 2.81Å; V115-R117 VanDerWaalsContact O-N 3.16Å; V115-V118 PolarHBondContact O-N 3.31Å; V115-V118 VanDerWaalsContact O-N 3.09Å; V115-V119 HydrophobicContact CG1-CG2 4.24Å; V115-V119 WeakPolarHBondContact O-CG2 3.3Å; V115-V119 PolarHBondContact O-N 2.96Å; V115-I133 HydrophobicContact CG1-CD1 4.19Å; V115-I133 HydrophobicContact CG1-CG2 4.33Å; V115-L155 HydrophobicContact CG2-CD2 4.26Å; V115-A158 HydrophobicContact CG2-CB 3.55Å; V115-V159 HydrophobicContact CG1-CG2 3.57Å; V115-V159 HydrophobicContact CG2-CG2 4.44Å; V115-L168 HydrophobicContact CG1-CD1 3.77Å
116	Q	90.4	Very high	80.6	Confident	39 Å²	39	69.3 Å²	69.3	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-65.3	-16.3	174.6	-154.5	-152	37.5	0	0	114.2	A112 I114 R120 L167 L168 L178	A112-Q116 WeakPolarHBondContact O-CB 3.45Å; A112-Q116 PolarHBondContact O-N 3.46Å; I114-Q116 VanDerWaalsContact C-N 3.31Å; I114-Q116 PolarHBondContact O-N 3.36Å; Q116-R120 VanDerWaalsContact CD-NH2 3.27Å; Q116-R120 WeakPolarHBondContact O-CB 3.43Å; Q116-R120 PolarHBondContact O-NE 3.44Å; Q116-R120 VanDerWaalsContact O-NE 3.16Å; Q116-R120 PolarHBondContact O-NH2 3.34Å; Q116-L167 HydrophobicContact CB-CB 4.26Å; Q116-L167 HydrophobicContact CB-CD1 4.47Å; Q116-L167 HydrophobicContact CG-CB 3.83Å; Q116-L167 WeakPolarHBondContact CG-O 3.47Å; Q116-L167 PolarHBondContact NE2-O 2.75Å; Q116-L168 HydrophobicContact CG-CD2 4.27Å; Q116-L178 HydrophobicContact CG-CD2 3.72Å
117	R	85.5	Confident	81.3	Confident	81 Å²	81	66.3 Å²	66.3	31%	0.306	32%	0.321	S	S	.	.	H	α-helix	trans	-85.6	-46	168.5	-175.1	-173.7	-56	131.8	7.2	110.2	R113 I114 V115 R120 D121 Y141	R113-R117 PolarHBondContact O-N 2.73Å; I114-R117 CarbonylContact O-C 3.6Å; I114-R117 WeakPolarHBondContact O-CA 3.4Å; I114-R117 VanDerWaalsContact O-CB 3.31Å; I114-R117 WeakPolarHBondContact O-CB 3.34Å; I114-R117 PolarHBondContact O-N 3.06Å; V115-R117 PolarHBondContact O-N 2.81Å; V115-R117 VanDerWaalsContact O-N 3.16Å; R117-R120 CarbonylContact O-C 3.48Å; R117-R120 WeakPolarHBondContact O-CA 3.4Å; R117-R120 VanDerWaalsContact O-CB 3.29Å; R117-R120 WeakPolarHBondContact O-CB 3.25Å; R117-R120 PolarHBondContact O-N 3.4Å; R117-R120 VanDerWaalsContact O-N 3.08Å; R117-D121 WeakPolarHBondContact CG-OD2 3.47Å; R117-D121 WeakPolarHBondContact O-CB 3.39Å; R117-D121 VanDerWaalsContact O-CG 3.26Å; R117-D121 PolarHBondContact O-N 3.2Å; R117-Y141 PolarHBondContact NH1-OH 2.83Å
118	V	87.1	Confident	82.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-51.1	-179.8	173	0	0	0	0	111.3	I114 V115 R120 D121 I122 I133 Y136 V137	I114-V118 HydrophobicContact CG2-CG2 4.36Å; I114-V118 WeakPolarHBondContact O-CG2 3.23Å; I114-V118 PolarHBondContact O-N 2.95Å; V115-V118 PolarHBondContact O-N 3.31Å; V115-V118 VanDerWaalsContact O-N 3.09Å; V118-R120 PolarHBondContact O-N 2.93Å; V118-R120 VanDerWaalsContact O-N 3.14Å; V118-D121 PolarHBondContact O-N 2.91Å; V118-D121 VanDerWaalsContact O-N 3.09Å; V118-I122 HydrophobicContact CG1-CD1 3.54Å; V118-I122 HydrophobicContact CG1-CG1 4.26Å; V118-I122 VanDerWaalsContact O-CG1 3.25Å; V118-I122 WeakPolarHBondContact O-CG1 3.45Å; V118-I122 PolarHBondContact O-N 3.38Å; V118-I133 HydrophobicContact CB-CG2 4.42Å; V118-I133 HydrophobicContact CG1-CB 4.13Å; V118-I133 HydrophobicContact CG1-CG1 4.23Å; V118-I133 HydrophobicContact CG1-CG2 3.83Å; V118-Y136 HydrophobicContact CB-CD1 4.16Å; V118-Y136 HydrophobicContact CG1-CD1 3.65Å; V118-Y136 HydrophobicContact CG1-CG 3.85Å; V118-Y136 HydrophobicContact CG2-CD1 3.81Å; V118-Y136 HydrophobicContact CG2-CE1 4.19Å; V118-V137 HydrophobicContact CG1-CG2 4.4Å; V118-V137 HydrophobicContact CG2-CG2 3.71Å
119	V	87.6	Confident	83.1	Confident	9 Å²	9	51.8 Å²	51.8	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-28.4	176.1	176.1	0	0	0	0	112.6	V115 D123 I133 L168 Y176	V115-V119 HydrophobicContact CG1-CG2 4.24Å; V115-V119 WeakPolarHBondContact O-CG2 3.3Å; V115-V119 PolarHBondContact O-N 2.96Å; V119-D123 PolarHBondContact O-N 3.24Å; V119-I133 HydrophobicContact CG2-CD1 3.66Å; V119-I133 HydrophobicContact CG2-CG1 3.94Å; V119-L168 HydrophobicContact CB-CD2 3.98Å; V119-L168 HydrophobicContact CG1-CD2 3.88Å; V119-L168 HydrophobicContact CG2-CD1 4.16Å; V119-L168 HydrophobicContact CG2-CD2 4.17Å; V119-Y176 WeakPolarHBondContact CG1-O 3.35Å
120	R	84.7	Confident	83.7	Confident	98 Å²	98	51 Å²	51	37%	0.37	25%	0.252	S	S	.	.	H	α-helix	trans	-79.4	-35.4	177.1	-174.8	-171.3	-37.4	-161.3	2.5	113	Q116 R117 V118 L178	Q116-R120 VanDerWaalsContact CD-NH2 3.27Å; Q116-R120 WeakPolarHBondContact O-CB 3.43Å; Q116-R120 PolarHBondContact O-NE 3.44Å; Q116-R120 VanDerWaalsContact O-NE 3.16Å; Q116-R120 PolarHBondContact O-NH2 3.34Å; R117-R120 CarbonylContact O-C 3.48Å; R117-R120 WeakPolarHBondContact O-CA 3.4Å; R117-R120 VanDerWaalsContact O-CB 3.29Å; R117-R120 WeakPolarHBondContact O-CB 3.25Å; R117-R120 PolarHBondContact O-N 3.4Å; R117-R120 VanDerWaalsContact O-N 3.08Å; V118-R120 PolarHBondContact O-N 2.93Å; V118-R120 VanDerWaalsContact O-N 3.14Å; R120-L178 HydrophobicContact CB-CD1 3.84Å; R120-L178 HydrophobicContact CG-CD1 3.85Å
121	D	78.8	Confident	84	Confident	78 Å²	78	51.4 Å²	51.4	42%	0.417	26%	0.26	S	S	.	.	H	α-helix	trans	-86.3	-21.3	-177	-65	-11.6	0	0	0	111.4	R117 V118 Y136	R117-D121 WeakPolarHBondContact CG-OD2 3.47Å; R117-D121 WeakPolarHBondContact O-CB 3.39Å; R117-D121 VanDerWaalsContact O-CG 3.26Å; R117-D121 PolarHBondContact O-N 3.2Å; V118-D121 PolarHBondContact O-N 2.91Å; V118-D121 VanDerWaalsContact O-N 3.09Å; D121-Y136 HydrophobicContact CB-CE1 4.49Å; D121-Y136 HydrophobicContact CB-CE2 4.21Å; D121-Y136 VanDerWaalsContact CB-OH 3.32Å; D121-Y136 WeakPolarHBondContact CB-OH 3.29Å
122	I	82	Confident	84	Confident	46 Å²	46	53.5 Å²	53.5	24%	0.236	27%	0.27	C	S	.	.	H	α-helix	trans	-73.1	-31	166.1	-63.9	164.2	0	0	0	111.7	V118 N124 S128 E132 I133 Y136	V118-I122 HydrophobicContact CG1-CD1 3.54Å; V118-I122 HydrophobicContact CG1-CG1 4.26Å; V118-I122 VanDerWaalsContact O-CG1 3.25Å; V118-I122 WeakPolarHBondContact O-CG1 3.45Å; V118-I122 PolarHBondContact O-N 3.38Å; I122-N124 HydrophobicContact CG2-CB 4.01Å; I122-N124 PolarHBondContact O-N 2.85Å; I122-N124 VanDerWaalsContact O-N 3.08Å; I122-S128 VanDerWaalsContact CG2-OG 3.28Å; I122-S128 WeakPolarHBondContact CG2-OG 3.19Å; I122-E132 HydrophobicContact CD1-CB 4.4Å; I122-E132 WeakPolarHBondContact CD1-O 3.48Å; I122-I133 HydrophobicContact CD1-CG1 4.35Å; I122-Y136 HydrophobicContact CD1-CD2 4.34Å; I122-Y136 HydrophobicContact CD1-CG 4.26Å; I122-Y136 HydrophobicContact CG1-CD2 3.56Å; I122-Y136 HydrophobicContact CG1-CE2 4.25Å; I122-Y136 HydrophobicContact CG1-CG 3.96Å
123	D	70.2	Confident	83.9	Confident	83 Å²	83	53.5 Å²	53.5	44%	0.444	27%	0.27	S	S	.	.			trans	59.1	20.5	173	-164.8	59.1	0	0	0	115	V119 C125 K235	V119-D123 PolarHBondContact O-N 3.24Å; D123-C125 PolarHBondContact O-N 3.17Å; D123-K235 WeakPolarHBondContact OD1-CE 3.26Å; D123-K235 IonicContact OD1-NZ 2.69Å; D123-K235 PolarHBondContact OD1-NZ 2.79Å; D123-K235 IonicContact OD2-NZ 3.48Å; D123-K235 PolarHBondContact OD2-NZ 3.36Å
124	N	77.1	Confident	83.9	Confident	52 Å²	52	46.4 Å²	46.4	28%	0.278	24%	0.244	S	C	.	.			trans	-69	112.1	-179.6	-175.6	-10.6	0	0	0	111.3	I122 N126 G127 E132 R175	I122-N124 HydrophobicContact CG2-CB 4.01Å; I122-N124 PolarHBondContact O-N 2.85Å; I122-N124 VanDerWaalsContact O-N 3.08Å; N124-N126 PolarHBondContact O-N 3.03Å; N124-N126 VanDerWaalsContact O-N 3.12Å; N124-N126 PolarHBondContact OD1-N 2.96Å; N124-G127 PolarHBondContact ND2-O 3.3Å; N124-G127 PolarHBondContact O-N 3.03Å; N124-E132 PolarHBondContact ND2-OE2 3.18Å; N124-R175 PolarHBondContact ND2-NH1 2.82Å
125	C	68.6	Low	83.8	Confident	111 Å²	111	49 Å²	49	75%	0.75	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-10.8	-177	64.5	0	0	0	0	115	D123	D123-C125 PolarHBondContact O-N 3.17Å
126	N	74.6	Confident	83.5	Confident	109 Å²	109	51.3 Å²	51.3	58%	0.583	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	7.6	175.9	-61.2	-6.9	0	0	0	112.2	N124	N124-N126 PolarHBondContact O-N 3.03Å; N124-N126 VanDerWaalsContact O-N 3.12Å; N124-N126 PolarHBondContact OD1-N 2.96Å
127	G	82.9	Confident	83.2	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.01	26%	0.262	C	S	.	.			trans	77	149.5	-169.8	0	0	0	0	0	112.2	N124 R175 Y176	N124-G127 PolarHBondContact ND2-O 3.3Å; N124-G127 PolarHBondContact O-N 3.03Å; G127-R175 WeakPolarHBondContact O-CD 3.43Å; G127-R175 PolarHBondContact O-NH1 3.43Å; G127-Y176 CarbonylContact C-O 3.52Å; G127-Y176 VanDerWaalsContact CA-O 3.24Å; G127-Y176 WeakPolarHBondContact CA-O 3.19Å
128	S	88.5	Confident	83	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.007	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	141.4	179	-76.4	0	0	0	0	112.2	I122 E132 R175 Y176	I122-S128 VanDerWaalsContact CG2-OG 3.28Å; I122-S128 WeakPolarHBondContact CG2-OG 3.19Å; S128-E132 VanDerWaalsContact CA-OE2 3.26Å; S128-E132 WeakPolarHBondContact CA-OE2 3.41Å; S128-E132 VanDerWaalsContact CB-OE2 3.29Å; S128-E132 WeakPolarHBondContact CB-OE2 3.17Å; S128-E132 PolarHBondContact OG-OE2 3.17Å; S128-R175 CarbonylContact O-C 3.19Å; S128-R175 WeakPolarHBondContact O-CA 3.45Å; S128-Y176 PolarHBondContact N-O 2.87Å; S128-Y176 PolarHBondContact O-N 3.06Å
129	N	91	Very high	82.2	Confident	43 Å²	43	57.8 Å²	57.8	23%	0.23	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	172.2	173.2	69.7	13.2	0	0	0	111.7	S131 E132 I133 D174 R175	N129-S131 VanDerWaalsContact C-N 3.26Å; N129-S131 PolarHBondContact O-N 3.47Å; N129-S131 PolarHBondContact OD1-N 2.85Å; N129-E132 PolarHBondContact O-N 3.39Å; N129-E132 WeakPolarHBondContact OD1-CB 3.26Å; N129-E132 VanDerWaalsContact OD1-CG 3.31Å; N129-E132 WeakPolarHBondContact OD1-CG 3.33Å; N129-E132 PolarHBondContact OD1-N 3.25Å; N129-I133 WeakPolarHBondContact O-CD1 3.28Å; N129-I133 WeakPolarHBondContact O-CG1 3.36Å; N129-I133 PolarHBondContact O-N 2.9Å; N129-D174 VanDerWaalsContact CA-O 3.29Å; N129-D174 WeakPolarHBondContact CA-O 3.14Å; N129-D174 VanDerWaalsContact CB-O 3.28Å; N129-D174 WeakPolarHBondContact CB-O 3.3Å; N129-R175 HydrophobicContact CB-CG 4.13Å
130	L	90.1	Very high	81.4	Confident	38 Å²	38	61.8 Å²	61.8	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-59.5	-35.8	-177.8	-168.7	65.7	0	0	0	112.6	I133 E134 L155 R156 V159	L130-I133 WeakPolarHBondContact O-CB 3.33Å; L130-I133 PolarHBondContact O-N 3.12Å; L130-E134 WeakPolarHBondContact O-CB 3.12Å; L130-E134 PolarHBondContact O-N 2.96Å; L130-L155 HydrophobicContact CD1-CB 3.84Å; L130-R156 HydrophobicContact CD2-CB 4.24Å; L130-V159 HydrophobicContact CD1-CG2 3.99Å
131	S	86.8	Confident	80.8	Confident	78 Å²	78	57.6 Å²	57.6	55%	0.545	30%	0.301	S	S	.	.	H	α-helix	trans	-70.5	-40.2	179.2	-49.1	0	0	0	0	113.3	N129 I133 E134 V135	N129-S131 VanDerWaalsContact C-N 3.26Å; N129-S131 PolarHBondContact O-N 3.47Å; N129-S131 PolarHBondContact OD1-N 2.85Å; S131-I133 VanDerWaalsContact C-N 3.26Å; S131-I133 PolarHBondContact O-N 3.18Å; S131-E134 PolarHBondContact O-N 3.19Å; S131-V135 WeakPolarHBondContact O-CG2 3.33Å; S131-V135 PolarHBondContact O-N 3.05Å
132	E	85.3	Confident	80.4	Confident	52 Å²	52	56.2 Å²	56.2	24%	0.243	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-40.2	171.6	-76.3	168.7	-137.6	0	0	110.8	I122 N124 S128 N129 Y136 R175	I122-E132 HydrophobicContact CD1-CB 4.4Å; I122-E132 WeakPolarHBondContact CD1-O 3.48Å; N124-E132 PolarHBondContact ND2-OE2 3.18Å; S128-E132 VanDerWaalsContact CA-OE2 3.26Å; S128-E132 WeakPolarHBondContact CA-OE2 3.41Å; S128-E132 VanDerWaalsContact CB-OE2 3.29Å; S128-E132 WeakPolarHBondContact CB-OE2 3.17Å; S128-E132 PolarHBondContact OG-OE2 3.17Å; N129-E132 PolarHBondContact O-N 3.39Å; N129-E132 WeakPolarHBondContact OD1-CB 3.26Å; N129-E132 VanDerWaalsContact OD1-CG 3.31Å; N129-E132 WeakPolarHBondContact OD1-CG 3.33Å; N129-E132 PolarHBondContact OD1-N 3.25Å; E132-Y136 WeakPolarHBondContact O-CB 3.38Å; E132-Y136 PolarHBondContact O-N 3.25Å; E132-R175 IonicContact OE1-CZ 3.79Å; E132-R175 VanDerWaalsContact OE1-CZ 3.29Å; E132-R175 IonicContact OE1-NH1 3.41Å; E132-R175 PolarHBondContact OE1-NH1 3.43Å; E132-R175 IonicContact OE1-NH2 2.7Å; E132-R175 PolarHBondContact OE1-NH2 3.48Å; E132-R175 IonicContact OE2-NH1 3.67Å
133	I	88.5	Confident	79.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68.3	-44.2	176.4	-64.6	163.8	0	0	0	110.8	V115 V118 V119 I122 N129 L130 S131 Y136 V137 L155 V159	V115-I133 HydrophobicContact CG1-CD1 4.19Å; V115-I133 HydrophobicContact CG1-CG2 4.33Å; V118-I133 HydrophobicContact CB-CG2 4.42Å; V118-I133 HydrophobicContact CG1-CB 4.13Å; V118-I133 HydrophobicContact CG1-CG1 4.23Å; V118-I133 HydrophobicContact CG1-CG2 3.83Å; V119-I133 HydrophobicContact CG2-CD1 3.66Å; V119-I133 HydrophobicContact CG2-CG1 3.94Å; I122-I133 HydrophobicContact CD1-CG1 4.35Å; N129-I133 WeakPolarHBondContact O-CD1 3.28Å; N129-I133 WeakPolarHBondContact O-CG1 3.36Å; N129-I133 PolarHBondContact O-N 2.9Å; L130-I133 WeakPolarHBondContact O-CB 3.33Å; L130-I133 PolarHBondContact O-N 3.12Å; S131-I133 VanDerWaalsContact C-N 3.26Å; S131-I133 PolarHBondContact O-N 3.18Å; I133-Y136 PolarHBondContact O-N 3.15Å; I133-V137 HydrophobicContact CG2-CG2 4.49Å; I133-V137 WeakPolarHBondContact O-CB 3.32Å; I133-V137 VanDerWaalsContact O-CG2 3.24Å; I133-V137 WeakPolarHBondContact O-CG2 3.47Å; I133-V137 PolarHBondContact O-N 3.28Å; I133-L155 HydrophobicContact CG2-CD1 4.46Å; I133-L155 HydrophobicContact CG2-CD2 4.31Å; I133-V159 HydrophobicContact CD1-CG2 4.13Å
134	E	86.8	Confident	79.9	Confident	30 Å²	30	58.9 Å²	58.9	14%	0.14	30%	0.297	C	S	.	.	H	α-helix	trans	-65.9	-43.2	-177.8	-170.4	-178	134.3	0	0	113	L130 S131 V137 R138 L151 C152 L155	L130-E134 WeakPolarHBondContact O-CB 3.12Å; L130-E134 PolarHBondContact O-N 2.96Å; S131-E134 PolarHBondContact O-N 3.19Å; E134-V137 PolarHBondContact O-N 3.33Å; E134-R138 PolarHBondContact O-N 2.76Å; E134-R138 IonicContact OE1-CZ 2.81Å; E134-R138 IonicContact OE1-NH1 3.43Å; E134-R138 PolarHBondContact OE1-NH1 3.23Å; E134-R138 IonicContact OE1-NH2 2.64Å; E134-R138 PolarHBondContact OE1-NH2 2.97Å; E134-L151 HydrophobicContact CG-CD2 3.88Å; E134-L151 HydrophobicContact CG-CG 4.21Å; E134-C152 VanDerWaalsContact CD-SG 3.59Å; E134-C152 PolarHBondContact OE2-SG 3.36Å; E134-L155 HydrophobicContact CB-CD1 3.75Å; E134-L155 HydrophobicContact CG-CD1 3.87Å
135	V	84.5	Confident	79.5	Confident	79 Å²	79	59 Å²	59	48%	0.479	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-50.1	174.4	172.2	0	0	0	0	110.4	S131 V137 R138 D139	S131-V135 WeakPolarHBondContact O-CG2 3.33Å; S131-V135 PolarHBondContact O-N 3.05Å; V135-V137 PolarHBondContact O-N 3.15Å; V135-R138 PolarHBondContact O-N 3.08Å; V135-R138 VanDerWaalsContact O-N 3.16Å; V135-D139 PolarHBondContact O-N 2.81Å
136	Y	83.6	Confident	79.4	Confident	49 Å²	49	59 Å²	59	19%	0.192	29%	0.286	C	S	.	.	H	α-helix	trans	-57.8	-37.9	178	-172.6	-74.8	0	0	0	112.3	V118 D121 I122 E132 I133 Y140	V118-Y136 HydrophobicContact CB-CD1 4.16Å; V118-Y136 HydrophobicContact CG1-CD1 3.65Å; V118-Y136 HydrophobicContact CG1-CG 3.85Å; V118-Y136 HydrophobicContact CG2-CD1 3.81Å; V118-Y136 HydrophobicContact CG2-CE1 4.19Å; D121-Y136 HydrophobicContact CB-CE1 4.49Å; D121-Y136 HydrophobicContact CB-CE2 4.21Å; D121-Y136 VanDerWaalsContact CB-OH 3.32Å; D121-Y136 WeakPolarHBondContact CB-OH 3.29Å; I122-Y136 HydrophobicContact CD1-CD2 4.34Å; I122-Y136 HydrophobicContact CD1-CG 4.26Å; I122-Y136 HydrophobicContact CG1-CD2 3.56Å; I122-Y136 HydrophobicContact CG1-CE2 4.25Å; I122-Y136 HydrophobicContact CG1-CG 3.96Å; E132-Y136 WeakPolarHBondContact O-CB 3.38Å; E132-Y136 PolarHBondContact O-N 3.25Å; I133-Y136 PolarHBondContact O-N 3.15Å; Y136-Y140 HydrophobicContact CE1-CD2 4.42Å; Y136-Y140 HydrophobicContact CE1-CG 4.1Å; Y136-Y140 VanDerWaalsContact O-CB 3.28Å; Y136-Y140 WeakPolarHBondContact O-CB 3.21Å; Y136-Y140 PolarHBondContact O-N 3.21Å
137	V	83.1	Confident	79	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.018	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-44.9	178.3	166.7	0	0	0	0	111.4	V118 I133 E134 V135 D139 Y140 Y141 M143 L151 L155	V118-V137 HydrophobicContact CG1-CG2 4.4Å; V118-V137 HydrophobicContact CG2-CG2 3.71Å; I133-V137 HydrophobicContact CG2-CG2 4.49Å; I133-V137 WeakPolarHBondContact O-CB 3.32Å; I133-V137 VanDerWaalsContact O-CG2 3.24Å; I133-V137 WeakPolarHBondContact O-CG2 3.47Å; I133-V137 PolarHBondContact O-N 3.28Å; E134-V137 PolarHBondContact O-N 3.33Å; V135-V137 PolarHBondContact O-N 3.15Å; V137-D139 PolarHBondContact O-N 3.47Å; V137-Y140 PolarHBondContact O-N 3.08Å; V137-Y141 PolarHBondContact O-N 3.36Å; V137-M143 HydrophobicContact CG1-CG 4.31Å; V137-M143 HydrophobicContact CG1-SD 3.25Å; V137-M143 WeakPolarHBondContact CG1-SD 3.13Å; V137-L151 HydrophobicContact CG1-CD1 4.23Å; V137-L155 HydrophobicContact CG2-CD2 4.15Å
138	R	80.7	Confident	78.3	Confident	136 Å²	136	64.5 Å²	64.5	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-60.9	-42.3	174.1	-72.4	-166.4	-178.9	97.5	7.4	112.5	E134 V135 Y140 L151	E134-R138 PolarHBondContact O-N 2.76Å; E134-R138 IonicContact OE1-CZ 2.81Å; E134-R138 IonicContact OE1-NH1 3.43Å; E134-R138 PolarHBondContact OE1-NH1 3.23Å; E134-R138 IonicContact OE1-NH2 2.64Å; E134-R138 PolarHBondContact OE1-NH2 2.97Å; V135-R138 PolarHBondContact O-N 3.08Å; V135-R138 VanDerWaalsContact O-N 3.16Å; R138-Y140 VanDerWaalsContact C-N 3.27Å; R138-Y140 PolarHBondContact O-N 3.29Å; R138-L151 HydrophobicContact CG-CD2 3.9Å
139	D	71.6	Confident	77.4	Confident	118 Å²	118	67.2 Å²	67.2	63%	0.631	34%	0.343	S	S	*	.	H	α-helix	trans	-71.5	-18.2	-176.2	-69.8	-8.3	0	0	0	113.6	V135 V137	V135-D139 PolarHBondContact O-N 2.81Å; V137-D139 PolarHBondContact O-N 3.47Å
140	Y	71	Confident	76.8	Confident	93 Å²	93	68.5 Å²	68.5	37%	0.365	35%	0.353	S	S	.	.	H	α-helix	trans	-123.4	-16.1	-168.6	-152.4	-87.2	0	0	0	115.5	Y136 V137 R138	Y136-Y140 HydrophobicContact CE1-CD2 4.42Å; Y136-Y140 HydrophobicContact CE1-CG 4.1Å; Y136-Y140 VanDerWaalsContact O-CB 3.28Å; Y136-Y140 WeakPolarHBondContact O-CB 3.21Å; Y136-Y140 PolarHBondContact O-N 3.21Å; V137-Y140 PolarHBondContact O-N 3.08Å; R138-Y140 VanDerWaalsContact C-N 3.27Å; R138-Y140 PolarHBondContact O-N 3.29Å
141	Y	72.3	Confident	76.3	Confident	9 Å²	9	68.1 Å²	68.1	4%	0.035	35%	0.35	C	S	.	.			trans	-129.3	128.4	-176.6	-64.2	-97.3	0	0	0	111.9	R101 L103 I114 R117 V137 M143	R101-Y141 HydrophobicContact CB-CD1 3.75Å; R101-Y141 HydrophobicContact CB-CE1 3.95Å; R101-Y141 WeakPolarHBondContact O-CD1 3.43Å; L103-Y141 HydrophobicContact CB-CD1 4.24Å; L103-Y141 HydrophobicContact CD2-CD1 4.45Å; I114-Y141 HydrophobicContact CG2-CE1 4.49Å; I114-Y141 HydrophobicContact CG2-CE2 4.45Å; R117-Y141 PolarHBondContact NH1-OH 2.83Å; V137-Y141 PolarHBondContact O-N 3.36Å; Y141-M143 PolarHBondContact O-N 2.54Å
142	D	70.3	Confident	76.1	Confident	49 Å²	49	66.4 Å²	66.4	26%	0.262	34%	0.338	S	S	.	.			trans	-73.6	90.2	166.3	162.9	38	0	0	0	108.1	F100 R101 T102 L103 R144	F100-D142 HydrophobicContact CB-CB 4.39Å; R101-D142 PolarHBondContact O-N 3.1Å; T102-D142 CarbonylContact C-O 3.57Å; T102-D142 VanDerWaalsContact CA-O 3.25Å; T102-D142 WeakPolarHBondContact CA-O 3.34Å; T102-D142 WeakPolarHBondContact CB-OD2 3.47Å; T102-D142 WeakPolarHBondContact CG2-OD2 3.41Å; T102-D142 PolarHBondContact OG1-OD2 2.83Å; L103-D142 PolarHBondContact N-O 2.9Å; D142-R144 IonicContact OD1-NE 2.63Å; D142-R144 IonicContact OD1-NH2 2.6Å; D142-R144 IonicContact OD2-CZ 3.94Å; D142-R144 IonicContact OD2-NE 2.69Å; D142-R144 PolarHBondContact OD2-NE 3.43Å; D142-R144 IonicContact OD2-NH2 3.67Å; D142-R144 PolarHBondContact OD2-NH2 3.08Å
143	M	69.9	Low	76	Confident	46 Å²	46	67.9 Å²	67.9	23%	0.227	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	122.7	-174.9	-75.2	-159.4	59.6	0	0	112.4	L103 V105 V137 Y141 V145 L151	L103-M143 HydrophobicContact CB-CG 4.42Å; L103-M143 HydrophobicContact CD2-CE 4.39Å; L103-M143 HydrophobicContact CD2-CG 4.45Å; V105-M143 HydrophobicContact CB-CE 4.48Å; V105-M143 HydrophobicContact CG2-CE 3.75Å; V137-M143 HydrophobicContact CG1-CG 4.31Å; V137-M143 HydrophobicContact CG1-SD 3.25Å; V137-M143 WeakPolarHBondContact CG1-SD 3.13Å; Y141-M143 PolarHBondContact O-N 2.54Å; M143-V145 HydrophobicContact CE-CG2 4.19Å; M143-L151 HydrophobicContact CE-CD1 3.61Å; M143-L151 HydrophobicContact SD-CD1 3.44Å; M143-L151 WeakPolarHBondContact SD-CD1 3.43Å
144	R	70.2	Confident	75.9	Confident	140 Å²	140	68.9 Å²	68.9	53%	0.528	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	90.1	176.4	-60.6	-174.8	-170.6	-139.8	-0.2	109	T102 L103 Q104 V105 D142	T102-R144 HydrophobicContact CG2-CG 4.28Å; L103-R144 PolarHBondContact O-N 3.23Å; Q104-R144 VanDerWaalsContact CA-O 3.32Å; Q104-R144 WeakPolarHBondContact CA-O 3.24Å; Q104-R144 HydrophobicContact CG-CB 4.26Å; V105-R144 PolarHBondContact N-O 3.46Å; D142-R144 IonicContact OD1-NE 2.63Å; D142-R144 IonicContact OD1-NH2 2.6Å; D142-R144 IonicContact OD2-CZ 3.94Å; D142-R144 IonicContact OD2-NE 2.69Å; D142-R144 PolarHBondContact OD2-NE 3.43Å; D142-R144 IonicContact OD2-NH2 3.67Å; D142-R144 PolarHBondContact OD2-NH2 3.08Å
145	V	68.7	Low	76	Confident	53 Å²	53	67.7 Å²	67.7	32%	0.321	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	142.3	176.6	-176.5	0	0	0	0	109.3	V105 M143 L149 L154	V105-V145 HydrophobicContact CB-CG2 4.44Å; V105-V145 WeakPolarHBondContact O-CA 3.34Å; M143-V145 HydrophobicContact CE-CG2 4.19Å; V145-L149 HydrophobicContact CG1-CB 4.01Å; V145-L154 HydrophobicContact CG1-CD1 3.95Å; V145-L154 HydrophobicContact CG2-CD1 3.82Å
146	K	67.6	Low	76.2	Confident	111 Å²	111	70.3 Å²	70.3	48%	0.483	35%	0.346	S	S	.	.			trans	-106	138.2	163.7	-61.3	-163.1	-160.3	84.6	0	110.1	V105 D106	V105-K146 PolarHBondContact O-N 3.27Å; D106-K146 WeakPolarHBondContact OD1-CD 3.5Å; D106-K146 VanDerWaalsContact OD1-CG 3.31Å; D106-K146 WeakPolarHBondContact OD1-CG 3.3Å; D106-K146 IonicContact OD1-NZ 2.75Å; D106-K146 PolarHBondContact OD1-NZ 3.33Å; D106-K146 IonicContact OD2-NZ 2.6Å; D106-K146 PolarHBondContact OD2-NZ 2.81Å
147	G	66.2	Low	76.4	Confident	56 Å²	56	72 Å²	72	58%	0.577	36%	0.358	S	S	*	.	S	Bend	trans	82.6	173.6	-176.4	0	0	0	0	0	113.6	L149	G147-L149 PolarHBondContact O-N 3.17Å
148	D	68.7	Low	76.8	Confident	171 Å²	171	72 Å²	72	91%	0.914	36%	0.359	S	S	*	.	S	Bend	trans	-78.1	30.8	-167.6	-52.8	-44.9	0	0	0	114.4
149	L	68.1	Low	77.3	Confident	58 Å²	58	65.7 Å²	65.7	30%	0.304	34%	0.335	S	S	.	.			trans	-90	122.4	-171.5	-72	161.7	0	0	0	112	E107 V145 G147 L154	E107-L149 HydrophobicContact CG-CD1 3.82Å; V145-L149 HydrophobicContact CG1-CB 4.01Å; G147-L149 PolarHBondContact O-N 3.17Å; L149-L154 HydrophobicContact CB-CD1 4.12Å; L149-L154 HydrophobicContact CB-CD2 4.34Å; L149-L154 HydrophobicContact CB-CG 4.17Å; L149-L154 HydrophobicContact CD1-CD2 4.28Å
150	T	78.2	Confident	78.1	Confident	70 Å²	70	63.4 Å²	63.4	43%	0.429	33%	0.326	S	S	.	.			trans	-75.9	146.2	175.3	70.7	0	0	0	0	111.7	C152 Q153 L154	T150-C152 PolarHBondContact O-N 3.26Å; T150-Q153 PolarHBondContact O-N 2.92Å; T150-Q153 VanDerWaalsContact O-N 3.13Å; T150-Q153 VanDerWaalsContact OG1-CG 3.32Å; T150-Q153 WeakPolarHBondContact OG1-CG 3.5Å; T150-Q153 PolarHBondContact OG1-N 2.85Å; T150-Q153 PolarHBondContact OG1-OE1 2.88Å; T150-L154 PolarHBondContact O-N 3.11Å
151	L	81.2	Confident	79.1	Confident	29 Å²	29	63.8 Å²	63.8	15%	0.152	33%	0.329	C	S	.	.	H	α-helix	trans	-54.6	-36.8	174.2	-179.3	59	0	0	0	112.4	E134 V137 R138 M143 L154 L155	E134-L151 HydrophobicContact CG-CD2 3.88Å; E134-L151 HydrophobicContact CG-CG 4.21Å; V137-L151 HydrophobicContact CG1-CD1 4.23Å; R138-L151 HydrophobicContact CG-CD2 3.9Å; M143-L151 HydrophobicContact CE-CD1 3.61Å; M143-L151 HydrophobicContact SD-CD1 3.44Å; M143-L151 WeakPolarHBondContact SD-CD1 3.43Å; L151-L154 PolarHBondContact O-N 3.28Å; L151-L155 HydrophobicContact CD1-CD1 3.84Å; L151-L155 HydrophobicContact CD1-CD2 4.48Å; L151-L155 HydrophobicContact CD1-CG 3.86Å; L151-L155 HydrophobicContact CD2-CD1 4.47Å; L151-L155 HydrophobicContact CG-CD1 3.85Å; L151-L155 HydrophobicContact CG-CG 4.27Å; L151-L155 WeakPolarHBondContact O-CB 3.1Å; L151-L155 WeakPolarHBondContact O-CG 3.49Å; L151-L155 PolarHBondContact O-N 2.95Å
152	C	82.6	Confident	80	Confident	42 Å²	42	63.3 Å²	63.3	28%	0.284	33%	0.328	S	S	.	.	H	α-helix	trans	-66.9	-36.9	-179.3	-50.7	0	0	0	0	112.5	E134 T150 R156	E134-C152 VanDerWaalsContact CD-SG 3.59Å; E134-C152 PolarHBondContact OE2-SG 3.36Å; T150-C152 PolarHBondContact O-N 3.26Å; C152-R156 VanDerWaalsContact O-CB 3.3Å; C152-R156 WeakPolarHBondContact O-CB 3.2Å; C152-R156 PolarHBondContact O-N 3.02Å
153	Q	83	Confident	80.9	Confident	84 Å²	84	63 Å²	63	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-67.7	-52.6	171.8	-73.1	156.9	-44.8	0	0	110.3	T150 L155 R156 D157	T150-Q153 PolarHBondContact O-N 2.92Å; T150-Q153 VanDerWaalsContact O-N 3.13Å; T150-Q153 VanDerWaalsContact OG1-CG 3.32Å; T150-Q153 WeakPolarHBondContact OG1-CG 3.5Å; T150-Q153 PolarHBondContact OG1-N 2.85Å; T150-Q153 PolarHBondContact OG1-OE1 2.88Å; Q153-L155 VanDerWaalsContact C-N 3.3Å; Q153-L155 PolarHBondContact O-N 3.02Å; Q153-R156 WeakPolarHBondContact O-CB 3.39Å; Q153-R156 PolarHBondContact O-N 3Å; Q153-D157 PolarHBondContact O-N 3.25Å
154	L	85.4	Confident	81.8	Confident	20 Å²	20	66.8 Å²	66.8	11%	0.105	35%	0.348	C	S	.	.	H	α-helix	trans	-54.3	-43.4	-179.3	-73	168.4	0	0	0	112.7	V105 L111 V145 L149 T150 L151 A158	V105-L154 HydrophobicContact CG1-CD1 4.1Å; V105-L154 HydrophobicContact CG1-CD2 4.06Å; L111-L154 HydrophobicContact CD1-CB 3.97Å; V145-L154 HydrophobicContact CG1-CD1 3.95Å; V145-L154 HydrophobicContact CG2-CD1 3.82Å; L149-L154 HydrophobicContact CB-CD1 4.12Å; L149-L154 HydrophobicContact CB-CD2 4.34Å; L149-L154 HydrophobicContact CB-CG 4.17Å; L149-L154 HydrophobicContact CD1-CD2 4.28Å; T150-L154 PolarHBondContact O-N 3.11Å; L151-L154 PolarHBondContact O-N 3.28Å; L154-A158 WeakPolarHBondContact O-CB 3.5Å; L154-A158 PolarHBondContact O-N 3.46Å; L154-A158 VanDerWaalsContact O-N 3.14Å
155	L	89	Confident	82.7	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-73.2	-34.1	177.2	-68.9	176.1	0	0	0	113	V115 L130 I133 E134 V137 L151 Q153 A158 V159	V115-L155 HydrophobicContact CG2-CD2 4.26Å; L130-L155 HydrophobicContact CD1-CB 3.84Å; I133-L155 HydrophobicContact CG2-CD1 4.46Å; I133-L155 HydrophobicContact CG2-CD2 4.31Å; E134-L155 HydrophobicContact CB-CD1 3.75Å; E134-L155 HydrophobicContact CG-CD1 3.87Å; V137-L155 HydrophobicContact CG2-CD2 4.15Å; L151-L155 HydrophobicContact CD1-CD1 3.84Å; L151-L155 HydrophobicContact CD1-CD2 4.48Å; L151-L155 HydrophobicContact CD1-CG 3.86Å; L151-L155 HydrophobicContact CD2-CD1 4.47Å; L151-L155 HydrophobicContact CG-CD1 3.85Å; L151-L155 HydrophobicContact CG-CG 4.27Å; L151-L155 WeakPolarHBondContact O-CB 3.1Å; L151-L155 WeakPolarHBondContact O-CG 3.49Å; L151-L155 PolarHBondContact O-N 2.95Å; Q153-L155 VanDerWaalsContact C-N 3.3Å; Q153-L155 PolarHBondContact O-N 3.02Å; L155-A158 PolarHBondContact O-N 3.31Å; L155-V159 WeakPolarHBondContact O-CB 3.15Å; L155-V159 VanDerWaalsContact O-CG2 3.22Å; L155-V159 WeakPolarHBondContact O-CG2 3.21Å; L155-V159 PolarHBondContact O-N 3.27Å
156	R	89.1	Confident	83.6	Confident	134 Å²	134	64.3 Å²	64.3	51%	0.506	35%	0.353	S	S	.	.	H	α-helix	trans	-64.1	-49.6	176.5	-172.5	-178.6	-61.7	134	2.8	110.8	L130 C152 Q153 A158 V159 T160	L130-R156 HydrophobicContact CD2-CB 4.24Å; C152-R156 VanDerWaalsContact O-CB 3.3Å; C152-R156 WeakPolarHBondContact O-CB 3.2Å; C152-R156 PolarHBondContact O-N 3.02Å; Q153-R156 WeakPolarHBondContact O-CB 3.39Å; Q153-R156 PolarHBondContact O-N 3Å; R156-A158 VanDerWaalsContact C-N 3.27Å; R156-A158 PolarHBondContact O-N 3.02Å; R156-V159 WeakPolarHBondContact O-CB 3.22Å; R156-V159 PolarHBondContact O-N 2.76Å; R156-V159 VanDerWaalsContact O-N 3.16Å; R156-T160 PolarHBondContact O-N 2.94Å; R156-T160 PolarHBondContact O-OG1 3.28Å; R156-T160 VanDerWaalsContact O-OG1 3.14Å
157	D	87.8	Confident	84.6	Confident	85 Å²	85	60.6 Å²	60.6	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-63.2	-36.9	178.2	-66.4	-3.9	0	0	0	111.7	Q153 T160 K161	Q153-D157 PolarHBondContact O-N 3.25Å; D157-T160 PolarHBondContact O-N 3.1Å; D157-K161 WeakPolarHBondContact O-CB 3.44Å; D157-K161 WeakPolarHBondContact O-CD 3.44Å; D157-K161 VanDerWaalsContact O-CG 3.23Å; D157-K161 WeakPolarHBondContact O-CG 3.39Å; D157-K161 PolarHBondContact O-N 3.07Å
158	A	90.6	Very high	85.7	Confident	3 Å²	3	58.1 Å²	58.1	3%	0.025	31%	0.311	C	S	.	.	H	α-helix	trans	-68.7	-34.3	175.9	0	0	0	0	0	113.4	L111 V115 L154 L155 R156 A162	L111-A158 HydrophobicContact CB-CB 3.53Å; V115-A158 HydrophobicContact CG2-CB 3.55Å; L154-A158 WeakPolarHBondContact O-CB 3.5Å; L154-A158 PolarHBondContact O-N 3.46Å; L154-A158 VanDerWaalsContact O-N 3.14Å; L155-A158 PolarHBondContact O-N 3.31Å; R156-A158 VanDerWaalsContact C-N 3.27Å; R156-A158 PolarHBondContact O-N 3.02Å; A158-A162 WeakPolarHBondContact O-CB 3.48Å; A158-A162 PolarHBondContact O-N 3.16Å
159	V	91.3	Very high	86.7	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-67.7	-47.2	172.6	163.1	0	0	0	0	110.3	V115 L130 I133 L155 R156 A162 V163 Y176	V115-V159 HydrophobicContact CG1-CG2 3.57Å; V115-V159 HydrophobicContact CG2-CG2 4.44Å; L130-V159 HydrophobicContact CD1-CG2 3.99Å; I133-V159 HydrophobicContact CD1-CG2 4.13Å; L155-V159 WeakPolarHBondContact O-CB 3.15Å; L155-V159 VanDerWaalsContact O-CG2 3.22Å; L155-V159 WeakPolarHBondContact O-CG2 3.21Å; L155-V159 PolarHBondContact O-N 3.27Å; R156-V159 WeakPolarHBondContact O-CB 3.22Å; R156-V159 PolarHBondContact O-N 2.76Å; R156-V159 VanDerWaalsContact O-N 3.16Å; V159-A162 PolarHBondContact O-N 2.8Å; V159-A162 VanDerWaalsContact O-N 3.14Å; V159-V163 PolarHBondContact O-N 2.88Å; V159-Y176 HydrophobicContact CG1-CD1 3.66Å; V159-Y176 HydrophobicContact CG1-CD2 3.75Å; V159-Y176 HydrophobicContact CG1-CE1 3.38Å; V159-Y176 HydrophobicContact CG1-CE2 3.51Å; V159-Y176 HydrophobicContact CG1-CG 3.83Å
160	T	90	Very high	87.6	Confident	71 Å²	71	53.2 Å²	53.2	44%	0.436	29%	0.291	S	S	.	.	H	α-helix	trans	-57.4	-54.2	175.4	-53	0	0	0	0	110.6	R156 D157 A162 V163 D164	R156-T160 PolarHBondContact O-N 2.94Å; R156-T160 PolarHBondContact O-OG1 3.28Å; R156-T160 VanDerWaalsContact O-OG1 3.14Å; D157-T160 PolarHBondContact O-N 3.1Å; T160-A162 PolarHBondContact O-N 3.12Å; T160-V163 WeakPolarHBondContact O-CA 3.25Å; T160-V163 WeakPolarHBondContact O-CB 3.36Å; T160-V163 PolarHBondContact O-N 3.06Å; T160-D164 VanDerWaalsContact O-CG 3.28Å; T160-D164 PolarHBondContact O-N 3.12Å
161	K	90.4	Very high	87.7	Confident	100 Å²	100	51.1 Å²	51.1	44%	0.435	28%	0.278	S	S	.	.	H	α-helix	trans	-56.2	-35.1	175.2	-71.6	165.6	-175.2	167.5	0	112.7	A112 D157 Q165	A112-K161 HydrophobicContact CB-CB 4.13Å; D157-K161 WeakPolarHBondContact O-CB 3.44Å; D157-K161 WeakPolarHBondContact O-CD 3.44Å; D157-K161 VanDerWaalsContact O-CG 3.23Å; D157-K161 WeakPolarHBondContact O-CG 3.39Å; D157-K161 PolarHBondContact O-N 3.07Å; K161-Q165 VanDerWaalsContact O-CB 3.24Å; K161-Q165 WeakPolarHBondContact O-CB 3.49Å; K161-Q165 WeakPolarHBondContact O-CG 3.31Å; K161-Q165 PolarHBondContact O-N 2.97Å
162	A	91.2	Very high	87.3	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-72.8	-28.6	176.1	0	0	0	0	0	113.4	A112 A158 V159 T160 L167 L168	A112-A162 HydrophobicContact CB-CB 3.9Å; A158-A162 WeakPolarHBondContact O-CB 3.48Å; A158-A162 PolarHBondContact O-N 3.16Å; V159-A162 PolarHBondContact O-N 2.8Å; V159-A162 VanDerWaalsContact O-N 3.14Å; T160-A162 PolarHBondContact O-N 3.12Å; A162-L167 HydrophobicContact CB-CB 4.27Å; A162-L167 CarbonylContact O-C 3.48Å; A162-L167 WeakPolarHBondContact O-CA 3.3Å; A162-L167 VanDerWaalsContact O-CB 3.29Å; A162-L167 WeakPolarHBondContact O-CB 3.45Å; A162-L167 PolarHBondContact O-N 2.86Å; A162-L168 HydrophobicContact CB-CB 4.41Å; A162-L168 HydrophobicContact CB-CD1 3.7Å; A162-L168 HydrophobicContact CB-CG 3.97Å; A162-L168 PolarHBondContact O-N 3.32Å
163	V	90.9	Very high	86.8	Confident	43 Å²	43	57.5 Å²	57.5	26%	0.261	32%	0.322	S	S	.	.	H	α-helix	trans	-72.6	-47.6	170	172.6	0	0	0	0	110.1	V159 T160 Q165 G166 L168 P170 Y176	V159-V163 PolarHBondContact O-N 2.88Å; T160-V163 WeakPolarHBondContact O-CA 3.25Å; T160-V163 WeakPolarHBondContact O-CB 3.36Å; T160-V163 PolarHBondContact O-N 3.06Å; V163-Q165 PolarHBondContact O-N 3.14Å; V163-G166 WeakPolarHBondContact O-CA 3.34Å; V163-G166 PolarHBondContact O-N 3.04Å; V163-L168 HydrophobicContact CG2-CB 4.21Å; V163-P170 HydrophobicContact CG1-CG 4.49Å; V163-Y176 HydrophobicContact CG2-CD1 3.85Å; V163-Y176 HydrophobicContact CG2-CE1 4.11Å
164	D	88.5	Confident	86.8	Confident	124 Å²	124	59.6 Å²	59.6	66%	0.663	34%	0.336	S	S	*	.	H	α-helix	trans	-61.4	-40.4	-179.9	-57.7	-30.6	0	0	0	112.5	T160 G166	T160-D164 VanDerWaalsContact O-CG 3.28Å; T160-D164 PolarHBondContact O-N 3.12Å; D164-G166 PolarHBondContact O-N 3.24Å
165	Q	88.7	Confident	86.9	Confident	93 Å²	93	61.9 Å²	61.9	44%	0.435	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	0.7	173.8	-69.5	178.6	27.7	0	0	113.5	D110 K161 V163 L167	D110-Q165 PolarHBondContact OD2-NE2 2.97Å; K161-Q165 VanDerWaalsContact O-CB 3.24Å; K161-Q165 WeakPolarHBondContact O-CB 3.49Å; K161-Q165 WeakPolarHBondContact O-CG 3.31Å; K161-Q165 PolarHBondContact O-N 2.97Å; V163-Q165 PolarHBondContact O-N 3.14Å; Q165-L167 HydrophobicContact CB-CD1 4.2Å; Q165-L167 HydrophobicContact CB-CG 3.82Å; Q165-L167 PolarHBondContact O-N 3.3Å; Q165-L167 VanDerWaalsContact OE1-CD1 3.25Å
166	G	87.2	Confident	87	Confident	49 Å²	49	64 Å²	64	51%	0.505	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	22.9	-175.5	0	0	0	0	0	113.8	V163 D164 P179	V163-G166 WeakPolarHBondContact O-CA 3.34Å; V163-G166 PolarHBondContact O-N 3.04Å; D164-G166 PolarHBondContact O-N 3.24Å; G166-P179 WeakPolarHBondContact O-CG 3.48Å
167	L	88.2	Confident	87	Confident	32 Å²	32	61.3 Å²	61.3	17%	0.168	35%	0.345	C	S	.	.	S	Bend	trans	-82	-28.5	177.3	-62.8	-175	0	0	0	111.9	A112 R113 Q116 A162 Q165 P179	A112-L167 HydrophobicContact CB-CD1 4.31Å; R113-L167 HydrophobicContact CG-CD1 4.16Å; Q116-L167 HydrophobicContact CB-CB 4.26Å; Q116-L167 HydrophobicContact CB-CD1 4.47Å; Q116-L167 HydrophobicContact CG-CB 3.83Å; Q116-L167 WeakPolarHBondContact CG-O 3.47Å; Q116-L167 PolarHBondContact NE2-O 2.75Å; A162-L167 HydrophobicContact CB-CB 4.27Å; A162-L167 CarbonylContact O-C 3.48Å; A162-L167 WeakPolarHBondContact O-CA 3.3Å; A162-L167 VanDerWaalsContact O-CB 3.29Å; A162-L167 WeakPolarHBondContact O-CB 3.45Å; A162-L167 PolarHBondContact O-N 2.86Å; Q165-L167 HydrophobicContact CB-CD1 4.2Å; Q165-L167 HydrophobicContact CB-CG 3.82Å; Q165-L167 PolarHBondContact O-N 3.3Å; Q165-L167 VanDerWaalsContact OE1-CD1 3.25Å; L167-P179 WeakPolarHBondContact O-CD 3.31Å
168	L	90.4	Very high	86.9	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	34%	0.339	C	S	.	.			trans	-130.6	164.3	176.5	-65.4	177.2	0	0	0	111	V115 Q116 V119 A162 V163 Q177 L178	V115-L168 HydrophobicContact CG1-CD1 3.77Å; Q116-L168 HydrophobicContact CG-CD2 4.27Å; V119-L168 HydrophobicContact CB-CD2 3.98Å; V119-L168 HydrophobicContact CG1-CD2 3.88Å; V119-L168 HydrophobicContact CG2-CD1 4.16Å; V119-L168 HydrophobicContact CG2-CD2 4.17Å; A162-L168 HydrophobicContact CB-CB 4.41Å; A162-L168 HydrophobicContact CB-CD1 3.7Å; A162-L168 HydrophobicContact CB-CG 3.97Å; A162-L168 PolarHBondContact O-N 3.32Å; V163-L168 HydrophobicContact CG2-CB 4.21Å; L168-Q177 CarbonylContact C-O 3.54Å; L168-Q177 VanDerWaalsContact CA-O 3.24Å; L168-Q177 WeakPolarHBondContact CA-O 3.32Å; L168-Q177 WeakPolarHBondContact CD2-O 3.38Å; L168-L178 HydrophobicContact CD2-CD2 4.08Å
169	V	88.1	Confident	86.4	Confident	56 Å²	56	62.6 Å²	62.6	34%	0.339	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.9	173.3	-173.3	0	0	0	0	108.3	Y176 Q177 P179	V169-Y176 WeakPolarHBondContact O-CA 3.44Å; V169-Q177 HydrophobicContact CB-CG 4.19Å; V169-Q177 PolarHBondContact N-O 2.87Å; V169-Q177 PolarHBondContact O-N 3.19Å; V169-P179 HydrophobicContact CG2-CB 3.92Å; V169-P179 HydrophobicContact CG2-CG 3.82Å
170	P	88	Confident	85.1	Confident	70 Å²	70	71.4 Å²	71.4	46%	0.455	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	149.9	174.2	29.5	-34.6	0	0	0	111.7	V163 R175 Y176	V163-P170 HydrophobicContact CG1-CG 4.49Å; P170-R175 CarbonylContact C-O 3.4Å; P170-R175 WeakPolarHBondContact CA-O 3.48Å; P170-Y176 HydrophobicContact CB-CD1 4.34Å; P170-Y176 HydrophobicContact CB-CE1 4.29Å
171	V	81.1	Confident	83.1	Confident	26 Å²	26	77.8 Å²	77.8	16%	0.158	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	124.3	-177.4	-172.1	0	0	0	0	107.7	G173 R175 Q177	V171-G173 VanDerWaalsContact C-N 3.32Å; V171-G173 PolarHBondContact O-N 2.85Å; V171-R175 HydrophobicContact CB-CB 4.29Å; V171-R175 PolarHBondContact N-O 3.49Å; V171-R175 WeakPolarHBondContact O-CB 3.37Å; V171-R175 PolarHBondContact O-N 2.96Å; V171-Q177 HydrophobicContact CG2-CB 4.02Å; V171-Q177 VanDerWaalsContact CG2-CD 3.44Å; V171-Q177 HydrophobicContact CG2-CG 3.5Å; V171-Q177 VanDerWaalsContact CG2-CG 3.5Å
172	N	71	Confident	80.3	Confident	152 Å²	152	75.3 Å²	75.3	81%	0.813	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	47.8	173.2	-56.1	-13.1	0	0	0	113.9	D174	N172-D174 PolarHBondContact O-N 3.32Å
173	G	72.2	Confident	77.3	Confident	54 Å²	54	80.1 Å²	80.1	56%	0.557	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-80	-177.5	0	0	0	0	0	112.8	V171	V171-G173 VanDerWaalsContact C-N 3.32Å; V171-G173 PolarHBondContact O-N 2.85Å
174	D	82.9	Confident	74.4	Confident	127 Å²	127	83.2 Å²	83.2	68%	0.679	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	9.7	-158.7	-53.7	-29.7	0	0	0	114.6	N129 N172	N129-D174 VanDerWaalsContact CA-O 3.29Å; N129-D174 WeakPolarHBondContact CA-O 3.14Å; N129-D174 VanDerWaalsContact CB-O 3.28Å; N129-D174 WeakPolarHBondContact CB-O 3.3Å; N172-D174 PolarHBondContact O-N 3.32Å
175	R	88.9	Confident	71.9	Confident	69 Å²	69	82.2 Å²	82.2	26%	0.26	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	151.3	-178.5	-67.7	178.9	170.1	-77.9	-14.2	111.8	N124 G127 S128 N129 E132 P170 V171	N124-R175 PolarHBondContact ND2-NH1 2.82Å; G127-R175 WeakPolarHBondContact O-CD 3.43Å; G127-R175 PolarHBondContact O-NH1 3.43Å; S128-R175 CarbonylContact O-C 3.19Å; S128-R175 WeakPolarHBondContact O-CA 3.45Å; N129-R175 HydrophobicContact CB-CG 4.13Å; E132-R175 IonicContact OE1-CZ 3.79Å; E132-R175 VanDerWaalsContact OE1-CZ 3.29Å; E132-R175 IonicContact OE1-NH1 3.41Å; E132-R175 PolarHBondContact OE1-NH1 3.43Å; E132-R175 IonicContact OE1-NH2 2.7Å; E132-R175 PolarHBondContact OE1-NH2 3.48Å; E132-R175 IonicContact OE2-NH1 3.67Å; P170-R175 CarbonylContact C-O 3.4Å; P170-R175 WeakPolarHBondContact CA-O 3.48Å; V171-R175 HydrophobicContact CB-CB 4.29Å; V171-R175 PolarHBondContact N-O 3.49Å; V171-R175 WeakPolarHBondContact O-CB 3.37Å; V171-R175 PolarHBondContact O-N 2.96Å
176	Y	90.4	Very high	69.1	Low	48 Å²	48	83.6 Å²	83.6	19%	0.188	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.5	-176	-52.3	-85.1	0	0	0	110.5	V119 G127 S128 V159 V163 V169 P170	V119-Y176 WeakPolarHBondContact CG1-O 3.35Å; G127-Y176 CarbonylContact C-O 3.52Å; G127-Y176 VanDerWaalsContact CA-O 3.24Å; G127-Y176 WeakPolarHBondContact CA-O 3.19Å; S128-Y176 PolarHBondContact N-O 2.87Å; S128-Y176 PolarHBondContact O-N 3.06Å; V159-Y176 HydrophobicContact CG1-CD1 3.66Å; V159-Y176 HydrophobicContact CG1-CD2 3.75Å; V159-Y176 HydrophobicContact CG1-CE1 3.38Å; V159-Y176 HydrophobicContact CG1-CE2 3.51Å; V159-Y176 HydrophobicContact CG1-CG 3.83Å; V163-Y176 HydrophobicContact CG2-CD1 3.85Å; V163-Y176 HydrophobicContact CG2-CE1 4.11Å; V169-Y176 WeakPolarHBondContact O-CA 3.44Å; P170-Y176 HydrophobicContact CB-CD1 4.34Å; P170-Y176 HydrophobicContact CB-CE1 4.29Å
177	Q	88.6	Confident	66.7	Low	79 Å²	79	86.2 Å²	86.2	37%	0.369	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	169.5	179.4	71.9	178.8	-20.7	0	0	112	L168 V169 V171	L168-Q177 CarbonylContact C-O 3.54Å; L168-Q177 VanDerWaalsContact CA-O 3.24Å; L168-Q177 WeakPolarHBondContact CA-O 3.32Å; L168-Q177 WeakPolarHBondContact CD2-O 3.38Å; V169-Q177 HydrophobicContact CB-CG 4.19Å; V169-Q177 PolarHBondContact N-O 2.87Å; V169-Q177 PolarHBondContact O-N 3.19Å; V171-Q177 HydrophobicContact CG2-CB 4.02Å; V171-Q177 VanDerWaalsContact CG2-CD 3.44Å; V171-Q177 HydrophobicContact CG2-CG 3.5Å; V171-Q177 VanDerWaalsContact CG2-CG 3.5Å
178	L	86	Confident	64	Low	65 Å²	65	89 Å²	89	34%	0.34	54%	0.538	S	S	.	.			trans	-78.1	142.4	172.8	-64.3	167	0	0	0	111.4	Q116 R120 L168 Y180	Q116-L178 HydrophobicContact CG-CD2 3.72Å; R120-L178 HydrophobicContact CB-CD1 3.84Å; R120-L178 HydrophobicContact CG-CD1 3.85Å; L168-L178 HydrophobicContact CD2-CD2 4.08Å; L178-Y180 PolarHBondContact O-N 3.45Å
179	P	80.5	Confident	61.2	Low	50 Å²	50	96.5 Å²	96.5	33%	0.325	58%	0.577	S	S	.	*			trans	-61	128.6	176.2	-18.4	25.9	0	0	0	113.3	G166 L167 V169 K181	G166-P179 WeakPolarHBondContact O-CG 3.48Å; L167-P179 WeakPolarHBondContact O-CD 3.31Å; V169-P179 HydrophobicContact CG2-CB 3.92Å; V169-P179 HydrophobicContact CG2-CG 3.82Å; P179-K181 PolarHBondContact O-N 2.97Å
180	Y	64	Low	58.4	Low	187 Å²	187	97.6 Å²	97.6	73%	0.733	60%	0.601	S	S	*	*			trans	-80.5	100.1	179.4	-175.1	-97.8	0	0	0	112	L178 G182	L178-Y180 PolarHBondContact O-N 3.45Å; Y180-G182 PolarHBondContact O-N 3.15Å; Y180-G182 VanDerWaalsContact O-N 3.08Å
181	K	47.7	Very low	55.7	Low	206 Å²	206	99.4 Å²	99.4	90%	0.896	62%	0.621	S	S	*	*			trans	-79.6	86.2	173.9	-67.2	-164.1	175	-167.8	0	111.2	P179	P179-K181 PolarHBondContact O-N 2.97Å
182	G	31.1	Very low	53.1	Low	48 Å²	48	107.6 Å²	107.6	50%	0.495	66%	0.655	S	S	.	*			trans	-160.3	22.1	-175.2	0	0	0	0	0	118	Y180	Y180-G182 PolarHBondContact O-N 3.15Å; Y180-G182 VanDerWaalsContact O-N 3.08Å
183	A	29.1	Very low	51.4	Low	101 Å²	101	109.7 Å²	109.7	84%	0.835	66%	0.659	S	S	*	*			trans	-150.8	126.8	163.7	0	0	0	0	0	109.3
184	A	30.6	Very low	49.3	Very low	107 Å²	107	112.2 Å²	112.2	88%	0.884	67%	0.668	S	S	*	*			trans	-151.2	106	177.1	0	0	0	0	0	110.1
185	S	34.9	Very low	46.9	Very low	104 Å²	104	111.4 Å²	111.4	73%	0.727	67%	0.673	S	S	*	*			trans	-160.8	113.4	173.9	52	0	0	0	0	108.6
186	S	30.9	Very low	43.9	Very low	121 Å²	121	113 Å²	113	85%	0.846	69%	0.694	S	S	*	*			trans	58.8	134.1	177.6	47.9	0	0	0	0	116
187	S	35.2	Very low	41	Very low	104 Å²	104	118.8 Å²	118.8	73%	0.727	73%	0.725	S	S	*	*			cis	-146.4	170.3	18	-55.5	0	0	0	0	113.3
188	S	33.4	Very low	38.4	Very low	92 Å²	92	120.9 Å²	120.9	64%	0.643	75%	0.749	S	S	*	*			trans	14.2	145.2	144	57.3	0	0	0	0	121.2
189	N	31.4	Very low	35.8	Very low	160 Å²	160	127.8 Å²	127.8	86%	0.856	78%	0.776	S	S	*	*			cis	-166.7	154.9	2.1	-105	-10.8	0	0	0	110.3
190	G	28.2	Very low	33.5	Very low	80 Å²	80	135.5 Å²	135.5	83%	0.825	80%	0.804	S	S	*	*			trans	73.4	155.7	164.6	0	0	0	0	0	116.2
191	A	31.5	Very low	32.1	Very low	107 Å²	107	136.1 Å²	136.1	88%	0.884	81%	0.811	S	S	*	*			cis	-139.3	158	-11.9	0	0	0	0	0	109.8
192	K	27.2	Very low	31.2	Very low	199 Å²	199	131.5 Å²	131.5	87%	0.865	81%	0.805	S	S	*	*			trans	-87.4	143.3	174.8	-59.4	170.9	-177.6	171.5	0	109.5
193	H	34.1	Very low	31.3	Very low	195 Å²	195	133 Å²	133	90%	0.903	82%	0.82	S	S	*	*			trans	-154.7	159.5	137.4	-110.3	-76.4	0	0	0	110.4
194	S	27.9	Very low	31.5	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	81%	0.814	S	S	*	*			trans	-144.5	125.9	-156.7	55	0	0	0	0	115
195	S	32.9	Very low	32.2	Very low	110 Å²	110	133.6 Å²	133.6	77%	0.769	80%	0.802	S	S	*	*			trans	-171.9	111	158.9	42.2	0	0	0	0	106.6
196	S	26.4	Very low	33.2	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	80%	0.795	S	S	*	*				81.3	139.7	68.5	72.1	0	0	0	0	114.3
197	M	30.2	Very low	35	Very low	169 Å²	169	132.1 Å²	132.1	83%	0.833	78%	0.78	S	S	*	*			trans	69.1	92.7	169.6	-52.6	-51.3	175.5	0	0	119.5
198	S	33.2	Very low	37.4	Very low	124 Å²	124	133.9 Å²	133.9	87%	0.867	77%	0.77	S	S	*	*				167.3	144.9	102.1	-78.3	0	0	0	0	114.5
199	K	30.6	Very low	40.1	Very low	209 Å²	209	129.6 Å²	129.6	91%	0.909	74%	0.74	S	S	*	*			trans	-86.1	127.7	177.6	-62.9	170	-179.6	170.6	0	111.5
200	K	32.2	Very low	42.8	Very low	212 Å²	212	125.2 Å²	125.2	92%	0.922	71%	0.712	S	S	*	*			trans	-151.5	105	157.9	-114.8	167.8	-173.1	175.3	0	115
201	K	34.8	Very low	45.6	Very low	201 Å²	201	125 Å²	125	87%	0.874	69%	0.692	S	S	*	*			trans	21.3	103.2	155.7	-62.8	-178.4	178.6	179.4	0	120.9
202	S	30	Very low	48.4	Very low	109 Å²	109	121 Å²	121	76%	0.762	66%	0.657	S	S	*	*				29.1	129.4	127.5	61.2	0	0	0	0	122.6
203	G	33.2	Very low	51.3	Low	80 Å²	80	117.5 Å²	117.5	83%	0.825	64%	0.642	S	S	*	*			trans	-137.2	119.3	155.7	0	0	0	0	0	111.9
204	T	32.8	Very low	53.6	Low	116 Å²	116	108.2 Å²	108.2	71%	0.712	60%	0.599	S	S	*	*			trans	-106.1	128	-160.6	52.3	0	0	0	0	115.7
205	T	45.6	Very low	56.4	Low	103 Å²	103	104.2 Å²	104.2	63%	0.632	57%	0.571	S	S	*	*			trans	-146	-15.1	166.2	41.9	0	0	0	0	118.5
206	L	55.3	Low	58.9	Low	109 Å²	109	106 Å²	106	57%	0.571	57%	0.565	S	S	*	*	S	Bend	trans	-113.2	41.1	-173	-81	168.8	0	0	0	116	R236	L206-R236 VanDerWaalsContact O-CD 3.29Å; L206-R236 WeakPolarHBondContact O-CD 3.36Å
207	T	68.8	Low	61.5	Low	86 Å²	86	111.1 Å²	111.1	53%	0.528	57%	0.569	S	S	.	*	S	Bend	trans	-107.2	4.2	176.9	50.7	0	0	0	0	114.4
208	R	85.9	Confident	64.1	Low	141 Å²	141	108.2 Å²	108.2	53%	0.532	55%	0.548	S	S	.	.	S	Bend	trans	-116.7	158.6	-172.5	-73.2	172.5	170.9	-150.4	2.9	112.7	K213 G214	R208-K213 WeakPolarHBondContact CD-O 3.32Å; R208-K213 WeakPolarHBondContact CG-O 3.41Å; R208-G214 CarbonylContact C-O 3.36Å; R208-G214 WeakPolarHBondContact CA-O 3.26Å; R208-G214 VanDerWaalsContact CB-O 3.28Å; R208-G214 WeakPolarHBondContact CB-O 3.24Å
209	C	90.2	Very high	66.6	Low	2 Å²	2	102.6 Å²	102.6	1%	0.014	51%	0.509	C	S	.	.			trans	-69	131	175.1	172	0	0	0	0	110.6	L211 C212 K213 G214 L227 R236 H238	C209-L211 PolarHBondContact O-N 3.17Å; C209-C212 WeakPolarHBondContact CB-SG 3.17Å; C209-C212 PolarHBondContact SG-SG 3.48Å; C209-K213 WeakPolarHBondContact O-CA 3.4Å; C209-K213 PolarHBondContact O-N 3.39Å; C209-G214 PolarHBondContact N-O 2.87Å; C209-L227 HydrophobicContact CB-CD2 4.1Å; C209-R236 CarbonylContact C-O 3.46Å; C209-R236 VanDerWaalsContact CA-O 3.26Å; C209-R236 WeakPolarHBondContact CA-O 3.42Å; C209-H238 VanDerWaalsContact CB-ND1 3.32Å; C209-H238 WeakPolarHBondContact CB-ND1 3.31Å
210	Y	87.7	Confident	69	Low	68 Å²	68	98.6 Å²	98.6	27%	0.267	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.8	-176.8	76.5	-95.8	0	0	0	113.1	K213 K235 R236 A237 W258	Y210-K213 PolarHBondContact O-NZ 2.98Å; Y210-K235 HydrophobicContact CD1-CB 3.97Å; Y210-K235 HydrophobicContact CG-CB 4.5Å; Y210-R236 VanDerWaalsContact CD1-O 3.3Å; Y210-R236 WeakPolarHBondContact CD1-O 3.08Å; Y210-R236 PolarHBondContact N-O 3.3Å; Y210-A237 HydrophobicContact CD1-CB 3.82Å; Y210-A237 HydrophobicContact CE1-CB 3.65Å; Y210-W258 HydrophobicContact CE1-CH2 4.19Å
211	L	88	Confident	71.3	Confident	74 Å²	74	92.9 Å²	92.9	39%	0.387	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-70.4	178.7	-62.7	166.7	0	0	0	110.8	C209 A237 C241 L242	C209-L211 PolarHBondContact O-N 3.17Å; L211-A237 HydrophobicContact CD1-CB 4.39Å; L211-C241 HydrophobicContact CB-CB 4.17Å; L211-C241 HydrophobicContact CD1-CB 3.72Å; L211-C241 WeakPolarHBondContact CD1-O 3.28Å; L211-L242 HydrophobicContact CD1-CD2 4.01Å; L211-L242 HydrophobicContact CD1-CG 4.44Å
212	C	90.2	Very high	73.4	Confident	24 Å²	24	85.8 Å²	85.8	16%	0.162	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-4.7	-172	69.6	0	0	0	0	115.5	C209 G214 Q220 H238 C241	C209-C212 WeakPolarHBondContact CB-SG 3.17Å; C209-C212 PolarHBondContact SG-SG 3.48Å; C212-G214 PolarHBondContact O-N 3.21Å; C212-G214 PolarHBondContact SG-N 3.4Å; C212-Q220 HydrophobicContact CB-CG 3.28Å; C212-H238 PolarHBondContact SG-ND1 2.91Å; C212-H238 VanDerWaalsContact SG-ND1 3.41Å; C212-C241 VanDerWaalsContact SG-SG 3.65Å
213	K	86.6	Confident	75.8	Confident	126 Å²	126	83.5 Å²	83.5	55%	0.548	44%	0.436	S	S	.	.			trans	58.3	7.6	-170.6	-40.2	-53	179.8	-169.8	0	114.7	R208 C209 Y210	R208-K213 WeakPolarHBondContact CD-O 3.32Å; R208-K213 WeakPolarHBondContact CG-O 3.41Å; C209-K213 WeakPolarHBondContact O-CA 3.4Å; C209-K213 PolarHBondContact O-N 3.39Å; Y210-K213 PolarHBondContact O-NZ 2.98Å
214	G	83.5	Confident	78.3	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	43%	0.428	C	S	.	.			trans	-67.9	173.4	175.2	0	0	0	0	0	114.3	R208 C209 C212 W218	R208-G214 CarbonylContact C-O 3.36Å; R208-G214 WeakPolarHBondContact CA-O 3.26Å; R208-G214 VanDerWaalsContact CB-O 3.28Å; R208-G214 WeakPolarHBondContact CB-O 3.24Å; C209-G214 PolarHBondContact N-O 2.87Å; C212-G214 PolarHBondContact O-N 3.21Å; C212-G214 PolarHBondContact SG-N 3.4Å; G214-W218 CarbonylContact C-O 3.56Å; G214-W218 VanDerWaalsContact CA-CE3 3.47Å; G214-W218 WeakPolarHBondContact CA-O 3.42Å
215	S	85.6	Confident	80.8	Confident	24 Å²	24	80.6 Å²	80.6	17%	0.168	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-121.3	179.9	-175.4	72.3	0	0	0	0	111.1	R217 W218 H238	S215-R217 PolarHBondContact O-N 2.85Å; S215-R217 PolarHBondContact OG-N 3.47Å; S215-W218 PolarHBondContact N-O 2.9Å; S215-W218 CarbonylContact O-C 3.38Å; S215-W218 PolarHBondContact O-N 2.89Å; S215-W218 VanDerWaalsContact OG-CD1 3.22Å; S215-W218 PolarHBondContact OG-NE1 2.74Å; S215-H238 PolarHBondContact O-CE1 3.46Å; S215-H238 PolarHBondContact O-NE2 3.39Å
216	K	86.2	Confident	82.7	Confident	146 Å²	146	76.7 Å²	76.7	64%	0.635	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-23.4	172.9	-167.6	-178.5	175.1	-172.3	0	112.2	S224 E225 L227	K216-S224 WeakPolarHBondContact O-CA 3.42Å; K216-S224 PolarHBondContact O-OG 3.24Å; K216-E225 WeakPolarHBondContact CA-O 3.44Å; K216-E225 WeakPolarHBondContact CG-O 3.19Å; K216-E225 PolarHBondContact O-N 3.31Å; K216-L227 HydrophobicContact CB-CD1 3.95Å
217	R	81.7	Confident	84.4	Confident	211 Å²	211	72.3 Å²	72.3	80%	0.796	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-16.3	178.9	-58.9	-177.7	179.8	-178.5	-1.6	114.4	S215	S215-R217 PolarHBondContact O-N 2.85Å; S215-R217 PolarHBondContact OG-N 3.47Å
218	W	84.9	Confident	85.4	Confident	108 Å²	108	68.5 Å²	68.5	41%	0.409	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-159.3	130.9	-178.3	60.3	-90.4	0	0	0	113.3	G214 S215 L223 H238	G214-W218 CarbonylContact C-O 3.56Å; G214-W218 VanDerWaalsContact CA-CE3 3.47Å; G214-W218 WeakPolarHBondContact CA-O 3.42Å; S215-W218 PolarHBondContact N-O 2.9Å; S215-W218 CarbonylContact O-C 3.38Å; S215-W218 PolarHBondContact O-N 2.89Å; S215-W218 VanDerWaalsContact OG-CD1 3.22Å; S215-W218 PolarHBondContact OG-NE1 2.74Å; W218-L223 CarbonylContact C-O 3.48Å; W218-L223 WeakPolarHBondContact CA-O 3.2Å; W218-H238 PolarHBondContact O-CE1 3.38Å; W218-H238 PolarHBondContact O-NE2 3.38Å
219	N	85.6	Confident	85.7	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.032	32%	0.324	C	S	.	.			trans	-98.5	-161	170.6	74.5	-5.3	0	0	0	110.9	D221 G222 L223 E225 H238 S240	N219-D221 VanDerWaalsContact C-N 3.29Å; N219-D221 PolarHBondContact ND2-OD2 3.09Å; N219-D221 VanDerWaalsContact ND2-OD2 3.08Å; N219-D221 PolarHBondContact O-N 2.81Å; N219-D221 WeakPolarHBondContact OD1-CA 3.48Å; N219-D221 WeakPolarHBondContact OD1-CB 3.41Å; N219-D221 PolarHBondContact OD1-N 3.49Å; N219-G222 PolarHBondContact O-N 2.83Å; N219-G222 PolarHBondContact OD1-N 2.88Å; N219-L223 PolarHBondContact N-O 3.19Å; N219-L223 PolarHBondContact OD1-N 3.37Å; N219-L223 PolarHBondContact OD1-O 3.36Å; N219-E225 HydrophobicContact CB-CB 4.4Å; N219-E225 WeakPolarHBondContact CB-OE2 3.15Å; N219-E225 PolarHBondContact ND2-OE2 3.45Å; N219-H238 HydrophobicContact CB-CB 4.4Å; N219-S240 PolarHBondContact ND2-OG 2.96Å
220	Q	81	Confident	85.7	Confident	125 Å²	125	63.8 Å²	63.8	58%	0.584	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-30.4	177.5	-73.3	173.8	-63.4	0	0	113.6	C212 G222 C241	C212-Q220 HydrophobicContact CB-CG 3.28Å; Q220-G222 VanDerWaalsContact C-N 3.27Å; Q220-G222 PolarHBondContact O-N 3.46Å; Q220-C241 PolarHBondContact OE1-SG 2.66Å
221	D	80.5	Confident	85.7	Confident	92 Å²	92	63.2 Å²	63.2	49%	0.492	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	3.3	178.5	-41	-71.2	0	0	0	112.6	N219 L223	N219-D221 VanDerWaalsContact C-N 3.29Å; N219-D221 PolarHBondContact ND2-OD2 3.09Å; N219-D221 VanDerWaalsContact ND2-OD2 3.08Å; N219-D221 PolarHBondContact O-N 2.81Å; N219-D221 WeakPolarHBondContact OD1-CA 3.48Å; N219-D221 WeakPolarHBondContact OD1-CB 3.41Å; N219-D221 PolarHBondContact OD1-N 3.49Å; D221-L223 VanDerWaalsContact C-N 3.3Å; D221-L223 HydrophobicContact CB-CD1 4.19Å; D221-L223 HydrophobicContact CB-CG 4.16Å; D221-L223 PolarHBondContact O-N 2.82Å
222	G	78.9	Confident	85.5	Confident	52 Å²	52	61.9 Å²	61.9	54%	0.536	33%	0.326	S	S	.	.	S	Bend	trans	78.4	6.1	-173.7	0	0	0	0	0	114.9	N219 Q220	N219-G222 PolarHBondContact O-N 2.83Å; N219-G222 PolarHBondContact OD1-N 2.88Å; Q220-G222 VanDerWaalsContact C-N 3.27Å; Q220-G222 PolarHBondContact O-N 3.46Å
223	L	80.6	Confident	85.4	Confident	61 Å²	61	62.4 Å²	62.4	32%	0.319	33%	0.329	S	S	.	.			trans	-90.7	145	-173.2	-62.4	176.4	0	0	0	113.3	W218 N219 D221 E225 V536	W218-L223 CarbonylContact C-O 3.48Å; W218-L223 WeakPolarHBondContact CA-O 3.2Å; N219-L223 PolarHBondContact N-O 3.19Å; N219-L223 PolarHBondContact OD1-N 3.37Å; N219-L223 PolarHBondContact OD1-O 3.36Å; D221-L223 VanDerWaalsContact C-N 3.3Å; D221-L223 HydrophobicContact CB-CD1 4.19Å; D221-L223 HydrophobicContact CB-CG 4.16Å; D221-L223 PolarHBondContact O-N 2.82Å; L223-E225 PolarHBondContact O-N 3Å; L223-V536 HydrophobicContact CD1-CG2 4.49Å; L223-V536 HydrophobicContact CD2-CG2 4.1Å
224	S	83.9	Confident	85.4	Confident	95 Å²	95	64.7 Å²	64.7	66%	0.664	34%	0.335	S	S	*	.			trans	-72.8	117.8	177.1	171	0	0	0	0	111.1	K216	K216-S224 WeakPolarHBondContact O-CA 3.42Å; K216-S224 PolarHBondContact O-OG 3.24Å
225	E	85.6	Confident	85.5	Confident	39 Å²	39	66.9 Å²	66.9	18%	0.182	34%	0.344	C	S	.	.			trans	-146.3	147.2	-171.4	-173.5	-175.5	169.7	0	0	111.3	K216 N219 L223 H238 P239 S240	K216-E225 WeakPolarHBondContact CA-O 3.44Å; K216-E225 WeakPolarHBondContact CG-O 3.19Å; K216-E225 PolarHBondContact O-N 3.31Å; N219-E225 HydrophobicContact CB-CB 4.4Å; N219-E225 WeakPolarHBondContact CB-OE2 3.15Å; N219-E225 PolarHBondContact ND2-OE2 3.45Å; L223-E225 PolarHBondContact O-N 3Å; E225-H238 HydrophobicContact CG-CB 4.45Å; E225-H238 PolarHBondContact O-CD2 2.97Å; E225-P239 WeakPolarHBondContact OE1-CB 3.33Å; E225-P239 WeakPolarHBondContact OE1-CD 3.26Å; E225-S240 VanDerWaalsContact CD-OG 3.28Å; E225-S240 WeakPolarHBondContact OE1-CB 3.43Å; E225-S240 PolarHBondContact OE1-N 3.37Å; E225-S240 PolarHBondContact OE1-OG 3.36Å; E225-S240 WeakPolarHBondContact OE2-CB 3.16Å; E225-S240 PolarHBondContact OE2-OG 2.67Å
226	G	85.8	Confident	85.7	Confident	22 Å²	22	69.6 Å²	69.6	23%	0.227	35%	0.351	C	S	.	.			trans	-65	153	176.5	0	0	0	0	0	113.3	P239	G226-P239 WeakPolarHBondContact O-CD 3.3Å
227	L	90.6	Very high	86	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.089	32%	0.32	C	S	.	.			trans	-108.1	110.2	172.4	-74.6	84.3	0	0	0	110.5	C209 K216 T229 R236 A237	C209-L227 HydrophobicContact CB-CD2 4.1Å; K216-L227 HydrophobicContact CB-CD1 3.95Å; L227-T229 PolarHBondContact O-OG1 3.47Å; L227-R236 HydrophobicContact CB-CB 4.28Å; L227-R236 HydrophobicContact CD2-CB 3.87Å; L227-A237 CarbonylContact C-O 3.44Å; L227-A237 WeakPolarHBondContact CA-O 3.41Å
228	L	90.8	Very high	86.5	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	141.5	162.9	-68.3	171.5	0	0	0	108.5	R236 A237 P239 L242 L244 L252 F253 W258	L228-R236 CarbonylContact O-C 2.96Å; L228-R236 WeakPolarHBondContact O-CA 3.21Å; L228-A237 PolarHBondContact N-O 3.06Å; L228-A237 PolarHBondContact O-N 3.31Å; L228-P239 HydrophobicContact CD1-CB 4.49Å; L228-P239 HydrophobicContact CD1-CG 3.97Å; L228-P239 HydrophobicContact CG-CG 4.11Å; L228-L242 HydrophobicContact CD1-CD1 4.05Å; L228-L244 HydrophobicContact CD1-CD1 3.47Å; L228-L244 VanDerWaalsContact CD1-CD1 3.47Å; L228-L252 HydrophobicContact CD1-CB 4.34Å; L228-L252 HydrophobicContact CD1-CD1 4.17Å; L228-L252 HydrophobicContact CD2-CB 3.71Å; L228-F253 HydrophobicContact CD2-CD1 3.61Å; L228-F253 HydrophobicContact CD2-CD2 4.3Å; L228-F253 HydrophobicContact CD2-CE1 3.62Å; L228-F253 HydrophobicContact CD2-CE2 4.31Å; L228-F253 HydrophobicContact CD2-CG 3.95Å; L228-F253 HydrophobicContact CD2-CZ 3.97Å; L228-F253 HydrophobicContact CG-CD1 4.4Å; L228-F253 HydrophobicContact CG-CE1 3.9Å; L228-F253 HydrophobicContact CG-CE2 4.49Å; L228-F253 HydrophobicContact CG-CZ 3.93Å; L228-W258 HydrophobicContact CB-CD2 3.84Å; L228-W258 HydrophobicContact CB-CE3 3.64Å; L228-W258 HydrophobicContact CB-CG 4.19Å; L228-W258 HydrophobicContact CB-CZ3 4.17Å; L228-W258 HydrophobicContact CD1-CD2 4.39Å; L228-W258 HydrophobicContact CD1-CG 4.19Å; L228-W258 HydrophobicContact CD2-CB 4.42Å
229	T	91.3	Very high	86.8	Confident	44 Å²	44	47.7 Å²	47.7	27%	0.27	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.7	-174.9	-61.2	0	0	0	0	108.2	L227 R236	L227-T229 PolarHBondContact O-OG1 3.47Å; T229-R236 HydrophobicContact CG2-CG 4.09Å; T229-R236 PolarHBondContact OG1-NE 3.13Å
230	C	91.6	Very high	87	Confident	1 Å²	1	49 Å²	49	1%	0.007	27%	0.274	C	S	.	.			trans	-69.8	136.1	-170.7	170.8	0	0	0	0	111.9	S232 C233 R234 K235 W258 C260	C230-S232 PolarHBondContact O-N 3.41Å; C230-S232 PolarHBondContact SG-N 3.2Å; C230-S232 VanDerWaalsContact SG-N 3.38Å; C230-C233 WeakPolarHBondContact CB-SG 3.43Å; C230-C233 PolarHBondContact SG-N 2.92Å; C230-C233 VanDerWaalsContact SG-N 3.38Å; C230-C233 PolarHBondContact SG-SG 2.8Å; C230-R234 VanDerWaalsContact O-CA 3.28Å; C230-R234 WeakPolarHBondContact O-CA 3.38Å; C230-R234 PolarHBondContact O-N 3.13Å; C230-R234 VanDerWaalsContact O-N 3.13Å; C230-K235 PolarHBondContact N-O 2.98Å; C230-W258 WeakPolarHBondContact CA-O 3.47Å; C230-W258 HydrophobicContact CB-CE3 3.96Å; C230-W258 HydrophobicContact CB-CH2 4.47Å; C230-W258 HydrophobicContact CB-CZ3 3.78Å; C230-C260 HydrophobicContact CB-CB 3.84Å; C230-C260 PolarHBondContact SG-N 2.83Å; C230-C260 PolarHBondContact SG-SG 2.83Å
231	C	87.2	Confident	87.4	Confident	56 Å²	56	43.4 Å²	43.4	38%	0.378	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-51.1	175.7	-56.2	0	0	0	0	112.9	S256 W258 H259	C231-S256 PolarHBondContact SG-O 3.08Å; C231-W258 PolarHBondContact N-O 3.2Å; C231-W258 PolarHBondContact SG-O 3.03Å; C231-W258 VanDerWaalsContact SG-O 3.36Å; C231-H259 VanDerWaalsContact SG-CE1 3.54Å
232	S	84.1	Confident	87.7	Confident	46 Å²	46	40.6 Å²	40.6	32%	0.322	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-65.8	-175.8	-15.1	0	0	0	0	112.4	C230 R234 H259	C230-S232 PolarHBondContact O-N 3.41Å; C230-S232 PolarHBondContact SG-N 3.2Å; C230-S232 VanDerWaalsContact SG-N 3.38Å; S232-R234 VanDerWaalsContact C-N 3.3Å; S232-R234 PolarHBondContact O-N 2.91Å; S232-H259 PolarHBondContact OG-CD2 3.34Å
233	C	87.4	Confident	88	Confident	34 Å²	34	46.1 Å²	46.1	23%	0.23	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.7	-171.5	70.5	0	0	0	0	114.8	C230 K235 C260	C230-C233 WeakPolarHBondContact CB-SG 3.43Å; C230-C233 PolarHBondContact SG-N 2.92Å; C230-C233 VanDerWaalsContact SG-N 3.38Å; C230-C233 PolarHBondContact SG-SG 2.8Å; C233-K235 HydrophobicContact CB-CD 4.27Å; C233-K235 HydrophobicContact CB-CG 4.12Å; C233-K235 PolarHBondContact O-N 3.11Å; C233-K235 VanDerWaalsContact SG-CB 3.51Å; C233-K235 VanDerWaalsContact SG-CG 3.52Å; C233-C260 WeakPolarHBondContact CB-SG 3.21Å; C233-C260 WeakPolarHBondContact SG-CB 3.28Å; C233-C260 CovalentContact SG-SG 2.05Å; C233-C260 PolarHBondContact SG-SG 3.13Å
234	R	86.6	Confident	88.3	Confident	175 Å²	175	44.6 Å²	44.6	66%	0.66	24%	0.237	S	C	*	.			trans	52.9	0.2	-172.7	-62.3	-67.3	-174.6	152.9	2.8	116.7	C230 S232 R236	C230-R234 VanDerWaalsContact O-CA 3.28Å; C230-R234 WeakPolarHBondContact O-CA 3.38Å; C230-R234 PolarHBondContact O-N 3.13Å; C230-R234 VanDerWaalsContact O-N 3.13Å; S232-R234 VanDerWaalsContact C-N 3.3Å; S232-R234 PolarHBondContact O-N 2.91Å; R234-R236 WeakPolarHBondContact O-CG 3.35Å
235	K	85.9	Confident	88.3	Confident	46 Å²	46	43 Å²	43	20%	0.2	22%	0.223	C	C	.	.			trans	-52.7	141.8	168.2	-59.8	175.1	-172.2	169.5	0	108.9	D123 Y210 C230 C233 W258	D123-K235 WeakPolarHBondContact OD1-CE 3.26Å; D123-K235 IonicContact OD1-NZ 2.69Å; D123-K235 PolarHBondContact OD1-NZ 2.79Å; D123-K235 IonicContact OD2-NZ 3.48Å; D123-K235 PolarHBondContact OD2-NZ 3.36Å; Y210-K235 HydrophobicContact CD1-CB 3.97Å; Y210-K235 HydrophobicContact CG-CB 4.5Å; C230-K235 PolarHBondContact N-O 2.98Å; C233-K235 HydrophobicContact CB-CD 4.27Å; C233-K235 HydrophobicContact CB-CG 4.12Å; C233-K235 PolarHBondContact O-N 3.11Å; C233-K235 VanDerWaalsContact SG-CB 3.51Å; C233-K235 VanDerWaalsContact SG-CG 3.52Å; K235-W258 WeakPolarHBondContact O-CZ3 3.36Å
236	R	90.3	Very high	88.2	Confident	81 Å²	81	45 Å²	45	31%	0.306	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.8	-172.8	-48.9	-173.8	74.6	178.8	-1.2	109.8	L206 C209 Y210 L227 L228 T229 R234	L206-R236 VanDerWaalsContact O-CD 3.29Å; L206-R236 WeakPolarHBondContact O-CD 3.36Å; C209-R236 CarbonylContact C-O 3.46Å; C209-R236 VanDerWaalsContact CA-O 3.26Å; C209-R236 WeakPolarHBondContact CA-O 3.42Å; Y210-R236 VanDerWaalsContact CD1-O 3.3Å; Y210-R236 WeakPolarHBondContact CD1-O 3.08Å; Y210-R236 PolarHBondContact N-O 3.3Å; L227-R236 HydrophobicContact CB-CB 4.28Å; L227-R236 HydrophobicContact CD2-CB 3.87Å; L228-R236 CarbonylContact O-C 2.96Å; L228-R236 WeakPolarHBondContact O-CA 3.21Å; T229-R236 HydrophobicContact CG2-CG 4.09Å; T229-R236 PolarHBondContact OG1-NE 3.13Å; R234-R236 WeakPolarHBondContact O-CG 3.35Å
237	A	90.9	Very high	88.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	153.8	174.1	0	0	0	0	0	112.7	Y210 L211 L227 L228 L242 W258	Y210-A237 HydrophobicContact CD1-CB 3.82Å; Y210-A237 HydrophobicContact CE1-CB 3.65Å; L211-A237 HydrophobicContact CD1-CB 4.39Å; L227-A237 CarbonylContact C-O 3.44Å; L227-A237 WeakPolarHBondContact CA-O 3.41Å; L228-A237 PolarHBondContact N-O 3.06Å; L228-A237 PolarHBondContact O-N 3.31Å; A237-L242 HydrophobicContact CB-CD1 3.86Å; A237-L242 HydrophobicContact CB-CD2 4.09Å; A237-L242 HydrophobicContact CB-CG 3.86Å; A237-W258 HydrophobicContact CB-CH2 4.32Å
238	H	93	Very high	87.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.			trans	-69.9	138.6	169.7	-59.1	107.1	0	0	0	110.7	C209 C212 S215 W218 N219 E225 S240 C241 L242	C209-H238 VanDerWaalsContact CB-ND1 3.32Å; C209-H238 WeakPolarHBondContact CB-ND1 3.31Å; C212-H238 PolarHBondContact SG-ND1 2.91Å; C212-H238 VanDerWaalsContact SG-ND1 3.41Å; S215-H238 PolarHBondContact O-CE1 3.46Å; S215-H238 PolarHBondContact O-NE2 3.39Å; W218-H238 PolarHBondContact O-CE1 3.38Å; W218-H238 PolarHBondContact O-NE2 3.38Å; N219-H238 HydrophobicContact CB-CB 4.4Å; E225-H238 HydrophobicContact CG-CB 4.45Å; E225-H238 PolarHBondContact O-CD2 2.97Å; H238-S240 VanDerWaalsContact C-N 3.26Å; H238-S240 WeakPolarHBondContact CB-OG 3.37Å; H238-S240 PolarHBondContact O-N 3.06Å; H238-C241 HydrophobicContact CB-CB 4.29Å; H238-C241 PolarHBondContact O-N 3.5Å; H238-L242 WeakPolarHBondContact O-CG 3.44Å; H238-L242 PolarHBondContact O-N 3.42Å
239	P	90.8	Very high	87.7	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.032	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-40.9	169.1	-26.8	29.8	0	0	0	115	E225 G226 L228 L242 H243 L244 A249 F253	E225-P239 WeakPolarHBondContact OE1-CB 3.33Å; E225-P239 WeakPolarHBondContact OE1-CD 3.26Å; G226-P239 WeakPolarHBondContact O-CD 3.3Å; L228-P239 HydrophobicContact CD1-CB 4.49Å; L228-P239 HydrophobicContact CD1-CG 3.97Å; L228-P239 HydrophobicContact CG-CG 4.11Å; P239-L242 CarbonylContact O-C 3.48Å; P239-L242 WeakPolarHBondContact O-CA 3.28Å; P239-L242 WeakPolarHBondContact O-CB 3.21Å; P239-L242 PolarHBondContact O-N 3.28Å; P239-L242 VanDerWaalsContact O-N 3.13Å; P239-H243 PolarHBondContact O-N 2.75Å; P239-H243 VanDerWaalsContact O-N 3.11Å; P239-L244 HydrophobicContact CB-CB 4.31Å; P239-L244 HydrophobicContact CB-CD1 4.46Å; P239-L244 PolarHBondContact O-N 3.21Å; P239-A249 HydrophobicContact CB-CB 3.55Å; P239-A249 HydrophobicContact CG-CB 3.64Å; P239-F253 HydrophobicContact CG-CE2 3.73Å; P239-F253 HydrophobicContact CG-CZ 3.77Å
240	S	89.9	Confident	87.4	Confident	33 Å²	33	51.9 Å²	51.9	23%	0.231	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-53.5	174.8	56.2	0	0	0	0	112.6	N219 E225 H238 L242 H243	N219-S240 PolarHBondContact ND2-OG 2.96Å; E225-S240 VanDerWaalsContact CD-OG 3.28Å; E225-S240 WeakPolarHBondContact OE1-CB 3.43Å; E225-S240 PolarHBondContact OE1-N 3.37Å; E225-S240 PolarHBondContact OE1-OG 3.36Å; E225-S240 WeakPolarHBondContact OE2-CB 3.16Å; E225-S240 PolarHBondContact OE2-OG 2.67Å; H238-S240 VanDerWaalsContact C-N 3.26Å; H238-S240 WeakPolarHBondContact CB-OG 3.37Å; H238-S240 PolarHBondContact O-N 3.06Å; S240-L242 PolarHBondContact O-N 3.34Å; S240-H243 WeakPolarHBondContact O-CA 3.26Å; S240-H243 PolarHBondContact O-N 3.48Å
241	C	89.7	Confident	87	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.054	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.1	177.3	-59	0	0	0	0	112.8	L211 C212 Q220 H238	L211-C241 HydrophobicContact CB-CB 4.17Å; L211-C241 HydrophobicContact CD1-CB 3.72Å; L211-C241 WeakPolarHBondContact CD1-O 3.28Å; C212-C241 VanDerWaalsContact SG-SG 3.65Å; Q220-C241 PolarHBondContact OE1-SG 2.66Å; H238-C241 HydrophobicContact CB-CB 4.29Å; H238-C241 PolarHBondContact O-N 3.5Å
242	L	87.5	Confident	87	Confident	33 Å²	33	54.1 Å²	54.1	17%	0.173	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.5	174.5	-66.7	167.9	0	0	0	113.1	L211 L228 A237 H238 P239 S240 L244 W258	L211-L242 HydrophobicContact CD1-CD2 4.01Å; L211-L242 HydrophobicContact CD1-CG 4.44Å; L228-L242 HydrophobicContact CD1-CD1 4.05Å; A237-L242 HydrophobicContact CB-CD1 3.86Å; A237-L242 HydrophobicContact CB-CD2 4.09Å; A237-L242 HydrophobicContact CB-CG 3.86Å; H238-L242 WeakPolarHBondContact O-CG 3.44Å; H238-L242 PolarHBondContact O-N 3.42Å; P239-L242 CarbonylContact O-C 3.48Å; P239-L242 WeakPolarHBondContact O-CA 3.28Å; P239-L242 WeakPolarHBondContact O-CB 3.21Å; P239-L242 PolarHBondContact O-N 3.28Å; P239-L242 VanDerWaalsContact O-N 3.13Å; S240-L242 PolarHBondContact O-N 3.34Å; L242-L244 VanDerWaalsContact C-N 3.26Å; L242-L244 HydrophobicContact CB-CD1 3.88Å; L242-L244 HydrophobicContact CB-CD2 4.43Å; L242-L244 HydrophobicContact CB-CG 3.7Å; L242-L244 HydrophobicContact CD1-CD1 3.9Å; L242-L244 PolarHBondContact O-N 2.99Å; L242-W258 HydrophobicContact CD1-CH2 4.04Å; L242-W258 HydrophobicContact CD1-CZ2 3.41Å; L242-W258 VanDerWaalsContact CD1-CZ2 3.41Å; L242-W258 HydrophobicContact CD2-CH2 4.44Å; L242-W258 HydrophobicContact CD2-CZ2 3.75Å; L242-W258 HydrophobicContact CG-CZ2 4.24Å
243	H	85.3	Confident	87.2	Confident	167 Å²	167	55.4 Å²	55.4	77%	0.773	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	37.4	-173.2	-50	-59.6	0	0	0	113.9	P239 S240	P239-H243 PolarHBondContact O-N 2.75Å; P239-H243 VanDerWaalsContact O-N 3.11Å; S240-H243 WeakPolarHBondContact O-CA 3.26Å; S240-H243 PolarHBondContact O-N 3.48Å
244	L	85.6	Confident	87	Confident	29 Å²	29	58 Å²	58	15%	0.152	29%	0.292	C	S	.	.			trans	-86.7	141.9	176.2	-54.3	174.5	0	0	0	110.2	L228 P239 L242 L248 L252	L228-L244 HydrophobicContact CD1-CD1 3.47Å; L228-L244 VanDerWaalsContact CD1-CD1 3.47Å; P239-L244 HydrophobicContact CB-CB 4.31Å; P239-L244 HydrophobicContact CB-CD1 4.46Å; P239-L244 PolarHBondContact O-N 3.21Å; L242-L244 VanDerWaalsContact C-N 3.26Å; L242-L244 HydrophobicContact CB-CD1 3.88Å; L242-L244 HydrophobicContact CB-CD2 4.43Å; L242-L244 HydrophobicContact CB-CG 3.7Å; L242-L244 HydrophobicContact CD1-CD1 3.9Å; L242-L244 PolarHBondContact O-N 2.99Å; L244-L248 HydrophobicContact CB-CD2 4.36Å; L244-L248 HydrophobicContact CD2-CD2 3.73Å; L244-L252 HydrophobicContact CD1-CD1 3.85Å
245	T	84.6	Confident	86.8	Confident	62 Å²	62	53.9 Å²	53.9	38%	0.38	29%	0.286	S	S	.	.			trans	-68.3	152.1	172.2	82.3	0	0	0	0	110.4	E247 L248 A249	T245-E247 VanDerWaalsContact C-N 3.26Å; T245-E247 WeakPolarHBondContact CB-OE2 3.32Å; T245-E247 PolarHBondContact O-N 2.97Å; T245-E247 PolarHBondContact OG1-OE2 2.69Å; T245-L248 PolarHBondContact O-N 3.08Å; T245-L248 PolarHBondContact OG1-N 3.41Å; T245-A249 PolarHBondContact O-N 3.31Å
246	P	83.9	Confident	86.4	Confident	80 Å²	80	56 Å²	56	52%	0.519	31%	0.306	S	S	.	.	H	α-helix	trans	-55	-40.7	179.7	-26.7	35.9	0	0	0	112.9	L248 A249 D250	P246-L248 VanDerWaalsContact C-N 3.28Å; P246-L248 PolarHBondContact O-N 3.16Å; P246-A249 WeakPolarHBondContact O-CB 3.48Å; P246-A249 PolarHBondContact O-N 3.2Å; P246-A249 VanDerWaalsContact O-N 3.1Å; P246-D250 PolarHBondContact O-N 2.99Å
247	E	83	Confident	85.9	Confident	119 Å²	119	55 Å²	55	56%	0.556	31%	0.312	S	S	*	.	H	α-helix	trans	-68.5	-27.8	-180	-40.8	79.5	179.4	0	0	111.8	T245 R251	T245-E247 VanDerWaalsContact C-N 3.26Å; T245-E247 WeakPolarHBondContact CB-OE2 3.32Å; T245-E247 PolarHBondContact O-N 2.97Å; T245-E247 PolarHBondContact OG1-OE2 2.69Å; E247-R251 WeakPolarHBondContact O-CG 3.03Å; E247-R251 PolarHBondContact O-NE 3Å; E247-R251 PolarHBondContact O-NH2 2.83Å
248	L	85.3	Confident	85.9	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-76.8	-39.3	169.7	-179.7	59.9	0	0	0	111.6	L244 T245 P246 R251 L252 D281 D284	L244-L248 HydrophobicContact CB-CD2 4.36Å; L244-L248 HydrophobicContact CD2-CD2 3.73Å; T245-L248 PolarHBondContact O-N 3.08Å; T245-L248 PolarHBondContact OG1-N 3.41Å; P246-L248 VanDerWaalsContact C-N 3.28Å; P246-L248 PolarHBondContact O-N 3.16Å; L248-R251 PolarHBondContact O-N 3.08Å; L248-L252 HydrophobicContact CD1-CD1 3.98Å; L248-L252 HydrophobicContact CD1-CG 4.06Å; L248-L252 HydrophobicContact CG-CD1 3.83Å; L248-L252 HydrophobicContact CG-CG 4.36Å; L248-L252 WeakPolarHBondContact O-CB 3.33Å; L248-L252 VanDerWaalsContact O-CG 3.27Å; L248-L252 WeakPolarHBondContact O-CG 3.48Å; L248-L252 PolarHBondContact O-N 3.44Å; L248-D281 WeakPolarHBondContact CD2-O 3.46Å; L248-D284 HydrophobicContact CD1-CB 4.36Å; L248-D284 HydrophobicContact CD2-CB 4.34Å
249	A	88	Confident	85.7	Confident	6 Å²	6	58 Å²	58	5%	0.05	33%	0.326	C	S	.	.	H	α-helix	trans	-57.5	-53	176.4	0	0	0	0	0	111.6	P239 T245 P246 R251 L252 F253	P239-A249 HydrophobicContact CB-CB 3.55Å; P239-A249 HydrophobicContact CG-CB 3.64Å; T245-A249 PolarHBondContact O-N 3.31Å; P246-A249 WeakPolarHBondContact O-CB 3.48Å; P246-A249 PolarHBondContact O-N 3.2Å; P246-A249 VanDerWaalsContact O-N 3.1Å; A249-R251 VanDerWaalsContact C-N 3.33Å; A249-R251 PolarHBondContact O-N 3.27Å; A249-L252 PolarHBondContact O-N 2.92Å; A249-L252 VanDerWaalsContact O-N 3.08Å; A249-F253 HydrophobicContact CB-CE2 4.29Å; A249-F253 WeakPolarHBondContact O-CD2 3.22Å; A249-F253 PolarHBondContact O-N 2.83Å
250	D	84.9	Confident	85.6	Confident	102 Å²	102	57.8 Å²	57.8	55%	0.545	32%	0.324	S	S	.	.	H	α-helix	trans	-59.3	-42.9	180	-68.1	-24.4	0	0	0	111.9	P246 L252 F253 A254	P246-D250 PolarHBondContact O-N 2.99Å; D250-L252 VanDerWaalsContact C-N 3.34Å; D250-L252 PolarHBondContact O-N 3Å; D250-F253 PolarHBondContact O-N 3.36Å; D250-A254 WeakPolarHBondContact O-CB 3.21Å; D250-A254 PolarHBondContact O-N 3.09Å
251	R	83.4	Confident	85.3	Confident	97 Å²	97	59.2 Å²	59.2	37%	0.366	33%	0.334	S	S	.	.	H	α-helix	trans	-64.4	-37.2	175.8	-74.5	179.8	-66.6	142.5	9.8	112.3	E247 L248 A249 A254 T255 G282	E247-R251 WeakPolarHBondContact O-CG 3.03Å; E247-R251 PolarHBondContact O-NE 3Å; E247-R251 PolarHBondContact O-NH2 2.83Å; L248-R251 PolarHBondContact O-N 3.08Å; A249-R251 VanDerWaalsContact C-N 3.33Å; A249-R251 PolarHBondContact O-N 3.27Å; R251-A254 PolarHBondContact O-N 3.23Å; R251-T255 WeakPolarHBondContact O-CG2 3.45Å; R251-T255 PolarHBondContact O-N 2.88Å; R251-T255 PolarHBondContact O-OG1 2.83Å; R251-T255 VanDerWaalsContact O-OG1 3.06Å; R251-G282 PolarHBondContact NH1-O 3.3Å; R251-G282 PolarHBondContact NH2-O 3.49Å
252	L	88.1	Confident	85	Confident	8 Å²	8	62.7 Å²	62.7	4%	0.042	36%	0.355	C	S	.	.	H	α-helix	trans	-75.1	-29.8	177.4	-72	170.2	0	0	0	113.3	L228 L244 L248 A249 D250 S256 W258 D284	L228-L252 HydrophobicContact CD1-CB 4.34Å; L228-L252 HydrophobicContact CD1-CD1 4.17Å; L228-L252 HydrophobicContact CD2-CB 3.71Å; L244-L252 HydrophobicContact CD1-CD1 3.85Å; L248-L252 HydrophobicContact CD1-CD1 3.98Å; L248-L252 HydrophobicContact CD1-CG 4.06Å; L248-L252 HydrophobicContact CG-CD1 3.83Å; L248-L252 HydrophobicContact CG-CG 4.36Å; L248-L252 WeakPolarHBondContact O-CB 3.33Å; L248-L252 VanDerWaalsContact O-CG 3.27Å; L248-L252 WeakPolarHBondContact O-CG 3.48Å; L248-L252 PolarHBondContact O-N 3.44Å; A249-L252 PolarHBondContact O-N 2.92Å; A249-L252 VanDerWaalsContact O-N 3.08Å; D250-L252 VanDerWaalsContact C-N 3.34Å; D250-L252 PolarHBondContact O-N 3Å; L252-S256 VanDerWaalsContact O-CA 3.29Å; L252-S256 WeakPolarHBondContact O-CA 3.49Å; L252-S256 PolarHBondContact O-N 3.32Å; L252-W258 HydrophobicContact CB-CB 4.41Å; L252-W258 HydrophobicContact CD2-CB 4.15Å; L252-D284 HydrophobicContact CD1-CB 4.07Å; L252-D284 HydrophobicContact CD2-CB 4.22Å
253	F	87.8	Confident	85	Confident	73 Å²	73	63 Å²	63	32%	0.32	36%	0.36	S	S	.	.	H	α-helix	trans	-66	-49.2	167	-72.9	-60.8	0	0	0	110.4	L228 P239 A249 D250 T255 S256	L228-F253 HydrophobicContact CD2-CD1 3.61Å; L228-F253 HydrophobicContact CD2-CD2 4.3Å; L228-F253 HydrophobicContact CD2-CE1 3.62Å; L228-F253 HydrophobicContact CD2-CE2 4.31Å; L228-F253 HydrophobicContact CD2-CG 3.95Å; L228-F253 HydrophobicContact CD2-CZ 3.97Å; L228-F253 HydrophobicContact CG-CD1 4.4Å; L228-F253 HydrophobicContact CG-CE1 3.9Å; L228-F253 HydrophobicContact CG-CE2 4.49Å; L228-F253 HydrophobicContact CG-CZ 3.93Å; P239-F253 HydrophobicContact CG-CE2 3.73Å; P239-F253 HydrophobicContact CG-CZ 3.77Å; A249-F253 HydrophobicContact CB-CE2 4.29Å; A249-F253 WeakPolarHBondContact O-CD2 3.22Å; A249-F253 PolarHBondContact O-N 2.83Å; D250-F253 PolarHBondContact O-N 3.36Å; F253-T255 PolarHBondContact O-N 3.35Å; F253-S256 PolarHBondContact O-N 3.11Å; F253-S256 PolarHBondContact O-OG 3.4Å
254	A	83	Confident	85.1	Confident	89 Å²	89	55.8 Å²	55.8	74%	0.736	33%	0.326	S	S	*	.	H	α-helix	trans	-63.1	-40	-178.3	0	0	0	0	0	113.7	D250 R251	D250-A254 WeakPolarHBondContact O-CB 3.21Å; D250-A254 PolarHBondContact O-N 3.09Å; R251-A254 PolarHBondContact O-N 3.23Å
255	T	81.3	Confident	85.3	Confident	88 Å²	88	57.2 Å²	57.2	54%	0.54	34%	0.336	S	S	.	.	H	α-helix	trans	-85.4	-14.1	176.1	62.5	0	0	0	0	113.8	R251 F253 S257	R251-T255 WeakPolarHBondContact O-CG2 3.45Å; R251-T255 PolarHBondContact O-N 2.88Å; R251-T255 PolarHBondContact O-OG1 2.83Å; R251-T255 VanDerWaalsContact O-OG1 3.06Å; F253-T255 PolarHBondContact O-N 3.35Å; T255-S257 PolarHBondContact O-N 3.47Å; T255-S257 WeakPolarHBondContact OG1-CB 3.07Å; T255-S257 PolarHBondContact OG1-N 3.38Å; T255-S257 PolarHBondContact OG1-OG 2.86Å
256	S	77.4	Confident	85.5	Confident	90 Å²	90	54.2 Å²	54.2	63%	0.629	32%	0.318	S	S	*	.			trans	49.1	21.8	-169.1	-69.3	0	0	0	0	114.5	C231 L252 F253 W258	C231-S256 PolarHBondContact SG-O 3.08Å; L252-S256 VanDerWaalsContact O-CA 3.29Å; L252-S256 WeakPolarHBondContact O-CA 3.49Å; L252-S256 PolarHBondContact O-N 3.32Å; F253-S256 PolarHBondContact O-N 3.11Å; F253-S256 PolarHBondContact O-OG 3.4Å; S256-W258 PolarHBondContact O-N 3.24Å
257	S	80.9	Confident	85.5	Confident	61 Å²	61	52.3 Å²	52.3	43%	0.427	31%	0.305	S	S	.	.			trans	-95.4	15	-166.8	72.4	0	0	0	0	114.6	T255 H259	T255-S257 PolarHBondContact O-N 3.47Å; T255-S257 WeakPolarHBondContact OG1-CB 3.07Å; T255-S257 PolarHBondContact OG1-N 3.38Å; T255-S257 PolarHBondContact OG1-OG 2.86Å; S257-H259 PolarHBondContact O-ND1 3.22Å
258	W	89.6	Confident	85.5	Confident	6 Å²	6	49.3 Å²	49.3	2%	0.023	29%	0.292	C	S	.	.			trans	-71.8	142.1	-173.6	178.3	68.7	0	0	0	112.9	Y210 L228 C230 C231 K235 A237 L242 L252 S256 C260 D284	Y210-W258 HydrophobicContact CE1-CH2 4.19Å; L228-W258 HydrophobicContact CB-CD2 3.84Å; L228-W258 HydrophobicContact CB-CE3 3.64Å; L228-W258 HydrophobicContact CB-CG 4.19Å; L228-W258 HydrophobicContact CB-CZ3 4.17Å; L228-W258 HydrophobicContact CD1-CD2 4.39Å; L228-W258 HydrophobicContact CD1-CG 4.19Å; L228-W258 HydrophobicContact CD2-CB 4.42Å; C230-W258 WeakPolarHBondContact CA-O 3.47Å; C230-W258 HydrophobicContact CB-CE3 3.96Å; C230-W258 HydrophobicContact CB-CH2 4.47Å; C230-W258 HydrophobicContact CB-CZ3 3.78Å; C231-W258 PolarHBondContact N-O 3.2Å; C231-W258 PolarHBondContact SG-O 3.03Å; C231-W258 VanDerWaalsContact SG-O 3.36Å; K235-W258 WeakPolarHBondContact O-CZ3 3.36Å; A237-W258 HydrophobicContact CB-CH2 4.32Å; L242-W258 HydrophobicContact CD1-CH2 4.04Å; L242-W258 HydrophobicContact CD1-CZ2 3.41Å; L242-W258 VanDerWaalsContact CD1-CZ2 3.41Å; L242-W258 HydrophobicContact CD2-CH2 4.44Å; L242-W258 HydrophobicContact CD2-CZ2 3.75Å; L242-W258 HydrophobicContact CG-CZ2 4.24Å; L252-W258 HydrophobicContact CB-CB 4.41Å; L252-W258 HydrophobicContact CD2-CB 4.15Å; S256-W258 PolarHBondContact O-N 3.24Å; W258-C260 HydrophobicContact CH2-CB 4.14Å; W258-C260 HydrophobicContact CZ2-CB 4.42Å; W258-D284 PolarHBondContact NE1-OD2 2.82Å
259	H	89.3	Confident	85.6	Confident	56 Å²	56	51.3 Å²	51.3	26%	0.259	31%	0.306	S	S	.	.			trans	-126.3	127.7	179.1	-72.5	66.5	0	0	0	111	C231 S232 S257 K264	C231-H259 VanDerWaalsContact SG-CE1 3.54Å; S232-H259 PolarHBondContact OG-CD2 3.34Å; S257-H259 PolarHBondContact O-ND1 3.22Å; H259-K264 HydrophobicContact CB-CB 4.49Å; H259-K264 VanDerWaalsContact O-CE 3.26Å; H259-K264 WeakPolarHBondContact O-CE 3.41Å; H259-K264 PolarHBondContact O-NZ 3.44Å
260	C	88.9	Confident	85.4	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.007	34%	0.338	C	S	.	.			trans	-59.8	155.4	174.7	63.7	0	0	0	0	110.8	C230 C233 W258 T262 C263 K264	C230-C260 HydrophobicContact CB-CB 3.84Å; C230-C260 PolarHBondContact SG-N 2.83Å; C230-C260 PolarHBondContact SG-SG 2.83Å; C233-C260 WeakPolarHBondContact CB-SG 3.21Å; C233-C260 WeakPolarHBondContact SG-CB 3.28Å; C233-C260 CovalentContact SG-SG 2.05Å; C233-C260 PolarHBondContact SG-SG 3.13Å; W258-C260 HydrophobicContact CH2-CB 4.14Å; W258-C260 HydrophobicContact CZ2-CB 4.42Å; C260-T262 PolarHBondContact O-N 2.91Å; C260-T262 VanDerWaalsContact O-N 3.09Å; C260-C263 PolarHBondContact O-N 3.15Å; C260-K264 PolarHBondContact O-N 2.96Å
261	S	83.1	Confident	85.4	Confident	62 Å²	62	62.1 Å²	62.1	43%	0.434	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-35.6	-174.2	46.3	0	0	0	0	113.8
262	T	83.8	Confident	85.4	Confident	81 Å²	81	61.4 Å²	61.4	50%	0.497	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-26.1	179.1	57.8	0	0	0	0	114.3	C260	C260-T262 PolarHBondContact O-N 2.91Å; C260-T262 VanDerWaalsContact O-N 3.09Å
263	C	88.3	Confident	85	Confident	41 Å²	41	61.8 Å²	61.8	28%	0.277	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	7.3	179.6	-66.4	0	0	0	0	113.7	C260	C260-C263 PolarHBondContact O-N 3.15Å
264	K	87.9	Confident	84.4	Confident	14 Å²	14	64.7 Å²	64.7	6%	0.061	37%	0.367	C	S	.	.			trans	-76.8	132.9	174.4	-167	157.3	-78.1	158.9	0	109.2	H259 C260 V273 D284	H259-K264 HydrophobicContact CB-CB 4.49Å; H259-K264 VanDerWaalsContact O-CE 3.26Å; H259-K264 WeakPolarHBondContact O-CE 3.41Å; H259-K264 PolarHBondContact O-NZ 3.44Å; C260-K264 PolarHBondContact O-N 2.96Å; K264-V273 HydrophobicContact CB-CG2 3.71Å; K264-V273 HydrophobicContact CD-CG2 4.48Å; K264-V273 HydrophobicContact CG-CG2 3.66Å; K264-V273 WeakPolarHBondContact O-CG2 3.44Å; K264-V273 PolarHBondContact O-N 3.2Å; K264-D284 WeakPolarHBondContact CD-O 3.39Å; K264-D284 WeakPolarHBondContact CE-O 3.46Å; K264-D284 WeakPolarHBondContact CE-OD2 3.45Å; K264-D284 PolarHBondContact NZ-O 3.48Å; K264-D284 IonicContact NZ-OD1 2.7Å; K264-D284 PolarHBondContact NZ-OD1 2.85Å; K264-D284 IonicContact NZ-OD2 2.75Å; K264-D284 PolarHBondContact NZ-OD2 3.3Å
265	V	88	Confident	83.7	Confident	59 Å²	59	65.6 Å²	65.6	36%	0.358	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-112.4	157.5	177	-65.5	0	0	0	0	111.1	T267 R270	V265-T267 PolarHBondContact O-N 3.24Å; V265-R270 WeakPolarHBondContact CB-O 3.11Å; V265-R270 WeakPolarHBondContact CG1-O 3.28Å
266	C	88.6	Confident	83.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-68.6	128.2	172.6	179	0	0	0	0	110.1	L268 C269 R270 K271 V273 G286 H288	C266-L268 PolarHBondContact O-N 3.36Å; C266-L268 VanDerWaalsContact O-N 3.14Å; C266-C269 VanDerWaalsContact CB-SG 3.57Å; C266-C269 VanDerWaalsContact SG-SG 3.64Å; C266-R270 WeakPolarHBondContact O-CA 3.43Å; C266-R270 PolarHBondContact O-N 3.48Å; C266-K271 PolarHBondContact N-O 3.03Å; C266-V273 HydrophobicContact CB-CG1 3.86Å; C266-G286 WeakPolarHBondContact CA-O 3.38Å; C266-H288 VanDerWaalsContact CB-CE1 3.41Å; C266-H288 WeakPolarHBondContact CB-CE1 3.47Å; C266-H288 WeakPolarHBondContact CB-ND1 3.31Å; C266-H288 PolarHBondContact SG-N 3.22Å; C266-H288 PolarHBondContact SG-ND1 3.1Å
267	T	85.3	Confident	83.2	Confident	40 Å²	40	64.2 Å²	64.2	25%	0.245	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-28.6	-179.3	-54.1	0	0	0	0	112.6	V265 K285 G286 Y287	V265-T267 PolarHBondContact O-N 3.24Å; T267-K285 HydrophobicContact CG2-CD 4.04Å; T267-G286 PolarHBondContact N-O 3.33Å; T267-G286 PolarHBondContact OG1-O 2.99Å; T267-Y287 HydrophobicContact CG2-CE1 4.33Å
268	L	82.4	Confident	83.1	Confident	56 Å²	56	65.1 Å²	65.1	29%	0.293	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-52.8	-171.8	-57.3	171.9	0	0	0	112.4	C266 Y287 C291 L295	C266-L268 PolarHBondContact O-N 3.36Å; C266-L268 VanDerWaalsContact O-N 3.14Å; L268-Y287 HydrophobicContact CD1-CD1 3.95Å; L268-Y287 HydrophobicContact CD1-CE1 4.44Å; L268-Y287 HydrophobicContact CG-CD1 4.05Å; L268-Y287 HydrophobicContact CG-CE1 4.28Å; L268-C291 HydrophobicContact CB-CB 4.1Å; L268-C291 HydrophobicContact CD1-CB 3.82Å; L268-C291 VanDerWaalsContact CD1-O 3.31Å; L268-C291 WeakPolarHBondContact CD1-O 3.34Å; L268-L295 HydrophobicContact CD1-CD1 3.75Å; L268-L295 HydrophobicContact CD1-CG 4.06Å; L268-L295 HydrophobicContact CD2-CD1 4.02Å
269	C	86.8	Confident	82.7	Confident	48 Å²	48	72.2 Å²	72.2	32%	0.324	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	0.6	-176.2	72	0	0	0	0	114.6	C266 K271 H288 C291	C266-C269 VanDerWaalsContact CB-SG 3.57Å; C266-C269 VanDerWaalsContact SG-SG 3.64Å; C269-K271 PolarHBondContact O-N 3.48Å; C269-H288 VanDerWaalsContact SG-CE1 3.59Å; C269-H288 PolarHBondContact SG-ND1 3.1Å; C269-C291 VanDerWaalsContact SG-SG 3.64Å
270	R	85.3	Confident	82.3	Confident	190 Å²	190	70.8 Å²	70.8	72%	0.717	39%	0.385	S	S	*	.			trans	58.1	-2.7	-178	-56.8	-58.8	-172.8	126	6.2	117.3	V265 C266	V265-R270 WeakPolarHBondContact CB-O 3.11Å; V265-R270 WeakPolarHBondContact CG1-O 3.28Å; C266-R270 WeakPolarHBondContact O-CA 3.43Å; C266-R270 PolarHBondContact O-N 3.48Å
271	K	84.5	Confident	81.5	Confident	145 Å²	145	76.9 Å²	76.9	63%	0.63	42%	0.418	S	S	*	.	S	Bend	trans	-71	152.6	173.8	-60.2	-179.1	-177.7	-174.3	0	111.5	C266 C269 H288	C266-K271 PolarHBondContact N-O 3.03Å; C269-K271 PolarHBondContact O-N 3.48Å; K271-H288 PolarHBondContact O-CE1 3.24Å
272	P	82.9	Confident	80.9	Confident	82 Å²	82	74.6 Å²	74.6	53%	0.532	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-56	143.7	179.2	-25.9	35	0	0	0	113.4	H288	P272-H288 PolarHBondContact O-CE1 2.8Å; P272-H288 PolarHBondContact O-NE2 3.22Å
273	V	80.9	Confident	80.6	Confident	15 Å²	15	72 Å²	72	9%	0.091	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-98.5	117.3	174.9	-80	0	0	0	0	112.2	K264 C266 S277	K264-V273 HydrophobicContact CB-CG2 3.71Å; K264-V273 HydrophobicContact CD-CG2 4.48Å; K264-V273 HydrophobicContact CG-CG2 3.66Å; K264-V273 WeakPolarHBondContact O-CG2 3.44Å; K264-V273 PolarHBondContact O-N 3.2Å; C266-V273 HydrophobicContact CB-CG1 3.86Å; V273-S277 WeakPolarHBondContact CB-OG 3.48Å
274	H	73.4	Confident	80.4	Confident	135 Å²	135	70.8 Å²	70.8	63%	0.625	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-69.8	164.8	171.1	-51.2	-71.2	0	0	0	111.6	T276 S277	H274-T276 PolarHBondContact O-N 2.96Å; H274-S277 PolarHBondContact N-OG 3.35Å; H274-S277 WeakPolarHBondContact O-CB 3.43Å; H274-S277 PolarHBondContact O-N 3.17Å; H274-S277 PolarHBondContact O-OG 3.43Å
275	A	69.3	Low	80.3	Confident	108 Å²	108	74.7 Å²	74.7	89%	0.893	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-21.5	-177.8	0	0	0	0	0	115.4	S277	A275-S277 VanDerWaalsContact C-N 3.29Å; A275-S277 PolarHBondContact O-N 3.25Å
276	T	68.3	Low	80.1	Confident	131 Å²	131	72 Å²	72	80%	0.804	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	0.4	174.9	51.7	0	0	0	0	114.4	H274	H274-T276 PolarHBondContact O-N 2.96Å
277	S	79.4	Confident	80	Confident	17 Å²	17	72.7 Å²	72.7	12%	0.119	38%	0.383	C	S	.	.	S	Bend	trans	-86.1	153.9	179.8	-49.5	0	0	0	0	111.6	V273 H274 A275 Y287	V273-S277 WeakPolarHBondContact CB-OG 3.48Å; H274-S277 PolarHBondContact N-OG 3.35Å; H274-S277 WeakPolarHBondContact O-CB 3.43Å; H274-S277 PolarHBondContact O-N 3.17Å; H274-S277 PolarHBondContact O-OG 3.43Å; A275-S277 VanDerWaalsContact C-N 3.29Å; A275-S277 PolarHBondContact O-N 3.25Å; S277-Y287 WeakPolarHBondContact CB-O 3.21Å
278	L	80.1	Confident	80.1	Confident	81 Å²	81	72.4 Å²	72.4	42%	0.424	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	133.9	-179.7	-60.6	171.1	0	0	0	110.1	G286 Y287 L292	L278-G286 CarbonylContact O-C 3.59Å; L278-G286 WeakPolarHBondContact O-CA 3.18Å; L278-Y287 PolarHBondContact N-O 3.06Å; L278-Y287 PolarHBondContact O-N 3.29Å; L278-L292 HydrophobicContact CD1-CD2 3.54Å
279	R	81	Confident	80.1	Confident	155 Å²	155	77.3 Å²	77.3	59%	0.585	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	143.4	168.8	-60.1	-173.8	-63.4	-138.7	5.6	108	K285	R279-K285 WeakPolarHBondContact CA-O 3.49Å
280	C	79.8	Confident	79.8	Confident	25 Å²	25	78.3 Å²	78.3	17%	0.169	41%	0.41	C	S	.	.			trans	-95	107.8	178.2	-179.9	0	0	0	0	110.6	G282 C283 D284 K285 Y287	C280-G282 PolarHBondContact O-N 2.95Å; C280-C283 PolarHBondContact O-N 2.86Å; C280-C283 VanDerWaalsContact SG-SG 3.66Å; C280-D284 WeakPolarHBondContact O-CA 3.26Å; C280-D284 PolarHBondContact O-N 2.98Å; C280-K285 PolarHBondContact N-O 3.32Å; C280-Y287 HydrophobicContact CB-CE2 4.16Å
281	D	73.3	Confident	79.5	Confident	130 Å²	130	70.5 Å²	70.5	70%	0.695	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.3	178	-39.1	-47.8	0	0	0	112.9	L248	L248-D281 WeakPolarHBondContact CD2-O 3.46Å
282	G	70.7	Confident	79	Confident	14 Å²	14	66.4 Å²	66.4	14%	0.144	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-20.6	173.1	0	0	0	0	0	115.2	R251 C280 A310	R251-G282 PolarHBondContact NH1-O 3.3Å; R251-G282 PolarHBondContact NH2-O 3.49Å; C280-G282 PolarHBondContact O-N 2.95Å; G282-A310 WeakPolarHBondContact O-CB 3.5Å
283	C	77.6	Confident	78.2	Confident	25 Å²	25	65.4 Å²	65.4	17%	0.169	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-158.6	11.5	-174.4	69.8	0	0	0	0	116.4	C280 K285	C280-C283 PolarHBondContact O-N 2.86Å; C280-C283 VanDerWaalsContact SG-SG 3.66Å; C283-K285 PolarHBondContact O-N 3.44Å
284	D	83.6	Confident	77.2	Confident	16 Å²	16	68.9 Å²	68.9	9%	0.086	39%	0.388	C	S	.	.			trans	59.1	5.7	-179.2	-165.7	41.3	0	0	0	116.6	L248 L252 W258 K264 C280	L248-D284 HydrophobicContact CD1-CB 4.36Å; L248-D284 HydrophobicContact CD2-CB 4.34Å; L252-D284 HydrophobicContact CD1-CB 4.07Å; L252-D284 HydrophobicContact CD2-CB 4.22Å; W258-D284 PolarHBondContact NE1-OD2 2.82Å; K264-D284 WeakPolarHBondContact CD-O 3.39Å; K264-D284 WeakPolarHBondContact CE-O 3.46Å; K264-D284 WeakPolarHBondContact CE-OD2 3.45Å; K264-D284 PolarHBondContact NZ-O 3.48Å; K264-D284 IonicContact NZ-OD1 2.7Å; K264-D284 PolarHBondContact NZ-OD1 2.85Å; K264-D284 IonicContact NZ-OD2 2.75Å; K264-D284 PolarHBondContact NZ-OD2 3.3Å; C280-D284 WeakPolarHBondContact O-CA 3.26Å; C280-D284 PolarHBondContact O-N 2.98Å
285	K	84.5	Confident	76.4	Confident	97 Å²	97	66.1 Å²	66.1	42%	0.422	38%	0.378	S	S	.	.			trans	-66.8	140.5	177.3	-74	-172.1	178.3	-167.8	0	112.5	T267 R279 C280 C283 Y287	T267-K285 HydrophobicContact CG2-CD 4.04Å; R279-K285 WeakPolarHBondContact CA-O 3.49Å; C280-K285 PolarHBondContact N-O 3.32Å; C283-K285 PolarHBondContact O-N 3.44Å; K285-Y287 HydrophobicContact CB-CE2 3.69Å
286	G	85.4	Confident	75.7	Confident	2 Å²	2	66.1 Å²	66.1	2%	0.021	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	148.3	174.3	0	0	0	0	0	113.2	C266 T267 L278	C266-G286 WeakPolarHBondContact CA-O 3.38Å; T267-G286 PolarHBondContact N-O 3.33Å; T267-G286 PolarHBondContact OG1-O 2.99Å; L278-G286 CarbonylContact O-C 3.59Å; L278-G286 WeakPolarHBondContact O-CA 3.18Å
287	Y	86	Confident	74.8	Confident	15 Å²	15	69 Å²	69	6%	0.059	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	127	177.2	-60.5	-98	0	0	0	110.2	T267 L268 S277 L278 C280 K285 L292 G306	T267-Y287 HydrophobicContact CG2-CE1 4.33Å; L268-Y287 HydrophobicContact CD1-CD1 3.95Å; L268-Y287 HydrophobicContact CD1-CE1 4.44Å; L268-Y287 HydrophobicContact CG-CD1 4.05Å; L268-Y287 HydrophobicContact CG-CE1 4.28Å; S277-Y287 WeakPolarHBondContact CB-O 3.21Å; L278-Y287 PolarHBondContact N-O 3.06Å; L278-Y287 PolarHBondContact O-N 3.29Å; C280-Y287 HydrophobicContact CB-CE2 4.16Å; K285-Y287 HydrophobicContact CB-CE2 3.69Å; Y287-L292 HydrophobicContact CD1-CD1 3.96Å; Y287-L292 HydrophobicContact CE1-CD1 4.49Å; Y287-L292 HydrophobicContact CG-CD1 4.26Å; Y287-G306 PolarHBondContact OH-O 2.96Å
288	H	87	Confident	72.9	Confident	33 Å²	33	74.1 Å²	74.1	15%	0.153	39%	0.39	C	S	.	.			trans	-66.5	142.6	166.3	-59.8	109.9	0	0	0	110	C266 C269 K271 P272 A290 C291 L292	C266-H288 VanDerWaalsContact CB-CE1 3.41Å; C266-H288 WeakPolarHBondContact CB-CE1 3.47Å; C266-H288 WeakPolarHBondContact CB-ND1 3.31Å; C266-H288 PolarHBondContact SG-N 3.22Å; C266-H288 PolarHBondContact SG-ND1 3.1Å; C269-H288 VanDerWaalsContact SG-CE1 3.59Å; C269-H288 PolarHBondContact SG-ND1 3.1Å; K271-H288 PolarHBondContact O-CE1 3.24Å; P272-H288 PolarHBondContact O-CE1 2.8Å; P272-H288 PolarHBondContact O-NE2 3.22Å; H288-A290 PolarHBondContact O-N 3.22Å; H288-C291 HydrophobicContact CB-CB 4.29Å; H288-C291 PolarHBondContact O-N 3.44Å; H288-C291 VanDerWaalsContact O-N 3.13Å; H288-L292 PolarHBondContact O-N 2.94Å
289	K	82.2	Confident	70.8	Confident	160 Å²	160	79.4 Å²	79.4	70%	0.696	41%	0.41	S	S	*	.	H	α-helix	trans	-52.4	-43.8	176.2	-171.1	-175.4	178.2	-169.8	0	111.8	L292 S293	K289-L292 PolarHBondContact O-N 2.92Å; K289-S293 PolarHBondContact O-N 3.04Å; K289-S293 PolarHBondContact O-OG 3.27Å
290	A	80.4	Confident	68.7	Low	69 Å²	69	76.8 Å²	76.8	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-62.3	-45.5	178.2	0	0	0	0	0	113.2	H288 L292 S293 S294	H288-A290 PolarHBondContact O-N 3.22Å; A290-L292 VanDerWaalsContact C-N 3.32Å; A290-L292 PolarHBondContact O-N 3.18Å; A290-S293 WeakPolarHBondContact CA-OG 3.38Å; A290-S293 PolarHBondContact O-N 3.13Å; A290-S293 PolarHBondContact O-OG 3.44Å; A290-S294 PolarHBondContact O-N 2.97Å; A290-S294 PolarHBondContact O-OG 2.79Å
291	C	78.7	Confident	66.9	Low	26 Å²	26	80.5 Å²	80.5	18%	0.176	44%	0.439	C	S	.	.	H	α-helix	trans	-67.6	-32.8	178.1	-58.9	0	0	0	0	112.2	L268 C269 H288 S294	L268-C291 HydrophobicContact CB-CB 4.1Å; L268-C291 HydrophobicContact CD1-CB 3.82Å; L268-C291 VanDerWaalsContact CD1-O 3.31Å; L268-C291 WeakPolarHBondContact CD1-O 3.34Å; C269-C291 VanDerWaalsContact SG-SG 3.64Å; H288-C291 HydrophobicContact CB-CB 4.29Å; H288-C291 PolarHBondContact O-N 3.44Å; H288-C291 VanDerWaalsContact O-N 3.13Å; C291-S294 WeakPolarHBondContact O-CB 3.15Å; C291-S294 PolarHBondContact O-N 3.42Å
292	L	74.5	Confident	65.7	Low	59 Å²	59	78 Å²	78	31%	0.309	43%	0.433	S	S	.	.	H	α-helix	trans	-68.3	-38.2	174.3	-159.7	76.6	0	0	0	111.4	L278 Y287 H288 K289 A290 S294 L295 T296	L278-L292 HydrophobicContact CD1-CD2 3.54Å; Y287-L292 HydrophobicContact CD1-CD1 3.96Å; Y287-L292 HydrophobicContact CE1-CD1 4.49Å; Y287-L292 HydrophobicContact CG-CD1 4.26Å; H288-L292 PolarHBondContact O-N 2.94Å; K289-L292 PolarHBondContact O-N 2.92Å; A290-L292 VanDerWaalsContact C-N 3.32Å; A290-L292 PolarHBondContact O-N 3.18Å; L292-S294 PolarHBondContact O-N 3.05Å; L292-L295 HydrophobicContact CD1-CD1 4.36Å; L292-L295 WeakPolarHBondContact O-CB 3.34Å; L292-L295 PolarHBondContact O-N 2.95Å; L292-T296 PolarHBondContact O-N 2.96Å
293	S	65.3	Low	64.6	Low	60 Å²	60	83.8 Å²	83.8	42%	0.42	46%	0.46	S	S	.	.	H	α-helix	trans	-66.2	-18	174.9	46.7	0	0	0	0	114.6	K289 A290 T296	K289-S293 PolarHBondContact O-N 3.04Å; K289-S293 PolarHBondContact O-OG 3.27Å; A290-S293 WeakPolarHBondContact CA-OG 3.38Å; A290-S293 PolarHBondContact O-N 3.13Å; A290-S293 PolarHBondContact O-OG 3.44Å; S293-T296 WeakPolarHBondContact CA-OG1 3.24Å; S293-T296 PolarHBondContact O-OG1 3.4Å
294	S	59.7	Low	63.2	Low	89 Å²	89	87.5 Å²	87.5	62%	0.622	47%	0.473	S	S	*	.	H	α-helix	trans	-69.5	-35.3	168.9	-53.3	0	0	0	0	112.1	A290 C291 L292	A290-S294 PolarHBondContact O-N 2.97Å; A290-S294 PolarHBondContact O-OG 2.79Å; C291-S294 WeakPolarHBondContact O-CB 3.15Å; C291-S294 PolarHBondContact O-N 3.42Å; L292-S294 PolarHBondContact O-N 3.05Å
295	L	58.4	Low	61.3	Low	77 Å²	77	91.9 Å²	91.9	40%	0.403	51%	0.511	S	S	.	.	H	α-helix	trans	-73.4	-31.1	177	-66.8	178.8	0	0	0	112.8	L268 L292 K297	L268-L295 HydrophobicContact CD1-CD1 3.75Å; L268-L295 HydrophobicContact CD1-CG 4.06Å; L268-L295 HydrophobicContact CD2-CD1 4.02Å; L292-L295 HydrophobicContact CD1-CD1 4.36Å; L292-L295 WeakPolarHBondContact O-CB 3.34Å; L292-L295 PolarHBondContact O-N 2.95Å; L295-K297 VanDerWaalsContact C-N 3.26Å; L295-K297 PolarHBondContact O-N 3.29Å
296	T	54	Low	59.8	Low	108 Å²	108	88.1 Å²	88.1	66%	0.663	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-2.2	-174.3	55.6	0	0	0	0	114.6	L292 S293	L292-T296 PolarHBondContact O-N 2.96Å; S293-T296 WeakPolarHBondContact CA-OG1 3.24Å; S293-T296 PolarHBondContact O-OG1 3.4Å
297	K	49.1	Very low	58.2	Low	192 Å²	192	90.3 Å²	90.3	84%	0.835	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-17.2	174.9	-73.7	-166.2	173.5	-169.2	0	113.9	L295	L295-K297 VanDerWaalsContact C-N 3.26Å; L295-K297 PolarHBondContact O-N 3.29Å
298	E	39.5	Very low	57	Low	123 Å²	123	89.8 Å²	89.8	58%	0.575	52%	0.517	S	S	*	.	S	Bend	trans	-90.9	140.6	169.4	-71	-169.8	-168.1	0	0	110.9	A300 K304	E298-A300 PolarHBondContact O-N 3.5Å; E298-K304 IonicContact OE2-NZ 3.94Å; E298-K304 PolarHBondContact OE2-NZ 2.75Å
299	K	36.4	Very low	55.7	Low	193 Å²	193	95.2 Å²	95.2	84%	0.839	54%	0.54	S	S	*	.			trans	-68.6	116.6	-177.6	-68.1	177.7	179.6	175.3	0	110.9	D301	K299-D301 PolarHBondContact O-N 3.03Å
300	A	36.2	Very low	54.5	Low	100 Å²	100	88 Å²	88	83%	0.826	51%	0.511	S	S	*	.			trans	41.6	6.9	143.9	0	0	0	0	0	122.6	E298 S302	E298-A300 PolarHBondContact O-N 3.5Å; A300-S302 PolarHBondContact O-N 2.89Å
301	D	41.8	Very low	53.5	Low	102 Å²	102	89 Å²	89	55%	0.545	51%	0.506	S	S	.	.			trans	-69.6	88	-177.5	-71.8	-34.1	0	0	0	112.1	K299 N303 K304	K299-D301 PolarHBondContact O-N 3.03Å; D301-N303 PolarHBondContact O-N 3.16Å; D301-K304 HydrophobicContact CB-CD 3.97Å; D301-K304 HydrophobicContact CB-CG 4.09Å; D301-K304 PolarHBondContact O-N 2.6Å; D301-K304 WeakPolarHBondContact OD2-CE 3.15Å; D301-K304 IonicContact OD2-NZ 2.87Å; D301-K304 PolarHBondContact OD2-NZ 2.92Å
302	S	48.7	Very low	52.7	Low	79 Å²	79	93.5 Å²	93.5	55%	0.552	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	2.7	-176	61	0	0	0	0	116.8	A300	A300-S302 PolarHBondContact O-N 2.89Å
303	N	47.4	Very low	52.2	Low	134 Å²	134	94 Å²	94	72%	0.717	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-11.3	173.1	-89.1	-21.9	0	0	0	115.3	D301 R312	D301-N303 PolarHBondContact O-N 3.16Å; N303-R312 PolarHBondContact OD1-NH2 2.88Å; N303-R312 VanDerWaalsContact OD1-NH2 3.12Å
304	K	48.7	Very low	52.1	Low	104 Å²	104	96.7 Å²	96.7	45%	0.452	53%	0.526	S	S	.	.	S	Bend	trans	-67.5	149.2	-178.1	-78.1	178.2	175.8	160.6	0	113.2	E298 D301 G306	E298-K304 IonicContact OE2-NZ 3.94Å; E298-K304 PolarHBondContact OE2-NZ 2.75Å; D301-K304 HydrophobicContact CB-CD 3.97Å; D301-K304 HydrophobicContact CB-CG 4.09Å; D301-K304 PolarHBondContact O-N 2.6Å; D301-K304 WeakPolarHBondContact OD2-CE 3.15Å; D301-K304 IonicContact OD2-NZ 2.87Å; D301-K304 PolarHBondContact OD2-NZ 2.92Å; K304-G306 PolarHBondContact O-N 2.05Å
305	A	43.5	Very low	52.4	Low	107 Å²	107	96.1 Å²	96.1	88%	0.884	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	93.7	-177.1	0	0	0	0	0	112
306	G	52.2	Low	52.9	Low	18 Å²	18	100.9 Å²	100.9	19%	0.186	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	175.6	-30.9	177.6	0	0	0	0	0	113.9	Y287 K304	Y287-G306 PolarHBondContact OH-O 2.96Å; K304-G306 PolarHBondContact O-N 2.05Å
307	A	53.8	Low	53.7	Low	48 Å²	48	101.2 Å²	101.2	40%	0.397	53%	0.526	S	S	.	.			trans	-55.4	135.8	175.6	0	0	0	0	0	112.1	R312	A307-R312 HydrophobicContact CB-CG 3.99Å
308	C	59.2	Low	54.7	Low	5 Å²	5	98.2 Å²	98.2	3%	0.034	51%	0.513	C	S	.	.			trans	-72.8	153.2	177.3	81.8	0	0	0	0	110.8	A310 D311 R312	C308-A310 PolarHBondContact O-N 2.99Å; C308-D311 PolarHBondContact O-N 3.09Å; C308-D311 PolarHBondContact SG-N 3.07Å; C308-D311 PolarHBondContact SG-OD2 3.4Å; C308-R312 PolarHBondContact O-N 2.84Å
309	K	59.4	Low	56.4	Low	146 Å²	146	98.8 Å²	98.8	64%	0.635	51%	0.513	S	S	*	.	H	α-helix	trans	-57.6	-41.7	-179.3	-167	-171.8	169.3	178.9	0	111	D311 R312 D313	K309-D311 VanDerWaalsContact C-N 3.29Å; K309-D311 PolarHBondContact O-N 3.24Å; K309-R312 PolarHBondContact O-N 2.92Å; K309-R312 VanDerWaalsContact O-N 3.1Å; K309-D313 WeakPolarHBondContact CG-OD2 3.06Å; K309-D313 WeakPolarHBondContact O-CB 3.42Å; K309-D313 PolarHBondContact O-N 3.48Å
310	A	58.5	Low	58.3	Low	10 Å²	10	94.4 Å²	94.4	8%	0.083	50%	0.498	C	S	.	.	H	α-helix	trans	-63.4	-27.6	176.7	0	0	0	0	0	114.4	G282 C308 K314	G282-A310 WeakPolarHBondContact O-CB 3.5Å; C308-A310 PolarHBondContact O-N 2.99Å; A310-K314 WeakPolarHBondContact O-CB 3.33Å; A310-K314 WeakPolarHBondContact O-CD 3.48Å; A310-K314 WeakPolarHBondContact O-CG 3.45Å; A310-K314 PolarHBondContact O-N 2.72Å
311	D	58.3	Low	60.1	Low	88 Å²	88	94.6 Å²	94.6	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-74.3	-43.4	170.1	-87.8	-48.3	0	0	0	110.9	C308 K309 D313 K314 V315	C308-D311 PolarHBondContact O-N 3.09Å; C308-D311 PolarHBondContact SG-N 3.07Å; C308-D311 PolarHBondContact SG-OD2 3.4Å; K309-D311 VanDerWaalsContact C-N 3.29Å; K309-D311 PolarHBondContact O-N 3.24Å; D311-D313 VanDerWaalsContact C-N 3.27Å; D311-D313 PolarHBondContact O-N 3.14Å; D311-K314 PolarHBondContact O-N 3.07Å; D311-V315 VanDerWaalsContact O-CB 3.25Å; D311-V315 WeakPolarHBondContact O-CB 3.49Å; D311-V315 WeakPolarHBondContact O-CG2 3.46Å; D311-V315 PolarHBondContact O-N 2.96Å
312	R	61.4	Low	61.7	Low	122 Å²	122	98.3 Å²	98.3	46%	0.46	49%	0.49	S	S	.	.	H	α-helix	trans	-61.3	-40.1	176	-58.6	-170.7	93.7	-177.1	4.9	110.9	N303 A307 C308 K309 R316	N303-R312 PolarHBondContact OD1-NH2 2.88Å; N303-R312 VanDerWaalsContact OD1-NH2 3.12Å; A307-R312 HydrophobicContact CB-CG 3.99Å; C308-R312 PolarHBondContact O-N 2.84Å; K309-R312 PolarHBondContact O-N 2.92Å; K309-R312 VanDerWaalsContact O-N 3.1Å; R312-R316 VanDerWaalsContact O-CB 3.27Å; R312-R316 WeakPolarHBondContact O-CB 3.41Å; R312-R316 PolarHBondContact O-N 3Å
313	D	65.5	Low	63	Low	70 Å²	70	98.1 Å²	98.1	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-66	-49.4	174.8	-63.4	-25.7	0	0	0	111.1	K309 D311 V315 R316 E317	K309-D313 WeakPolarHBondContact CG-OD2 3.06Å; K309-D313 WeakPolarHBondContact O-CB 3.42Å; K309-D313 PolarHBondContact O-N 3.48Å; D311-D313 VanDerWaalsContact C-N 3.27Å; D311-D313 PolarHBondContact O-N 3.14Å; D313-V315 VanDerWaalsContact C-N 3.34Å; D313-V315 PolarHBondContact O-N 2.94Å; D313-R316 WeakPolarHBondContact O-CB 3.2Å; D313-R316 PolarHBondContact O-N 3.23Å; D313-E317 WeakPolarHBondContact O-CB 3.4Å; D313-E317 PolarHBondContact O-N 3.45Å
314	K	63.2	Low	64.3	Low	115 Å²	115	94.1 Å²	94.1	50%	0.5	47%	0.467	S	S	.	.	H	α-helix	trans	-63.4	-32.6	175.7	-77.4	172	-179.8	179.3	0	113.7	A310 D311 K318	A310-K314 WeakPolarHBondContact O-CB 3.33Å; A310-K314 WeakPolarHBondContact O-CD 3.48Å; A310-K314 WeakPolarHBondContact O-CG 3.45Å; A310-K314 PolarHBondContact O-N 2.72Å; D311-K314 PolarHBondContact O-N 3.07Å; K314-K318 VanDerWaalsContact O-CB 3.3Å; K314-K318 WeakPolarHBondContact O-CB 3.48Å; K314-K318 VanDerWaalsContact O-CG 3.24Å; K314-K318 WeakPolarHBondContact O-CG 3.48Å; K314-K318 PolarHBondContact O-N 3.3Å
315	V	65.4	Low	65.4	Low	77 Å²	77	91.5 Å²	91.5	47%	0.467	46%	0.464	S	S	.	.	H	α-helix	trans	-73.5	-40.8	175.2	167.8	0	0	0	0	110.3	D311 D313 K318 K319	D311-V315 VanDerWaalsContact O-CB 3.25Å; D311-V315 WeakPolarHBondContact O-CB 3.49Å; D311-V315 WeakPolarHBondContact O-CG2 3.46Å; D311-V315 PolarHBondContact O-N 2.96Å; D313-V315 VanDerWaalsContact C-N 3.34Å; D313-V315 PolarHBondContact O-N 2.94Å; V315-K318 PolarHBondContact O-N 2.96Å; V315-K319 WeakPolarHBondContact O-CB 3.42Å; V315-K319 PolarHBondContact O-N 2.99Å
316	R	69.6	Low	67	Low	177 Å²	177	92.9 Å²	92.9	67%	0.668	45%	0.446	S	S	*	.	H	α-helix	trans	-62	-47.2	173	-175.6	-179.7	-176.2	-178.2	2	111.2	R312 D313 K319 I320	R312-R316 VanDerWaalsContact O-CB 3.27Å; R312-R316 WeakPolarHBondContact O-CB 3.41Å; R312-R316 PolarHBondContact O-N 3Å; D313-R316 WeakPolarHBondContact O-CB 3.2Å; D313-R316 PolarHBondContact O-N 3.23Å; R316-K319 WeakPolarHBondContact O-CB 3.15Å; R316-K319 PolarHBondContact O-N 3.49Å; R316-I320 HydrophobicContact CG-CD1 4.06Å; R316-I320 WeakPolarHBondContact O-CG1 3.48Å; R316-I320 PolarHBondContact O-N 3.09Å
317	E	69.6	Low	68.1	Low	116 Å²	116	96.2 Å²	96.2	54%	0.542	46%	0.46	S	S	.	.	H	α-helix	trans	-59.2	-48.8	175	-177.8	177.6	-133	0	0	111.4	D313 K319 I320 I321	D313-E317 WeakPolarHBondContact O-CB 3.4Å; D313-E317 PolarHBondContact O-N 3.45Å; E317-K319 VanDerWaalsContact C-N 3.29Å; E317-K319 PolarHBondContact O-N 3.11Å; E317-I320 PolarHBondContact O-N 3.29Å; E317-I321 HydrophobicContact CG-CD1 3.84Å; E317-I321 WeakPolarHBondContact O-CG1 3.47Å; E317-I321 PolarHBondContact O-N 2.85Å
318	K	71.5	Confident	69	Low	129 Å²	129	97.8 Å²	97.8	56%	0.561	46%	0.464	S	S	*	.	H	α-helix	trans	-62.2	-32.3	173.9	-77.1	173.9	179.8	177.9	0	113.4	K314 V315 R322	K314-K318 VanDerWaalsContact O-CB 3.3Å; K314-K318 WeakPolarHBondContact O-CB 3.48Å; K314-K318 VanDerWaalsContact O-CG 3.24Å; K314-K318 WeakPolarHBondContact O-CG 3.48Å; K314-K318 PolarHBondContact O-N 3.3Å; V315-K318 PolarHBondContact O-N 2.96Å; K318-R322 VanDerWaalsContact O-CB 3.3Å; K318-R322 WeakPolarHBondContact O-CB 3.33Å; K318-R322 WeakPolarHBondContact O-CD 3.06Å; K318-R322 WeakPolarHBondContact O-CG 3.46Å; K318-R322 PolarHBondContact O-N 2.94Å
319	K	74.4	Confident	69.7	Low	135 Å²	135	105.2 Å²	105.2	59%	0.587	50%	0.496	S	S	*	.	H	α-helix	trans	-65.1	-51.6	172.4	-172.7	-179.6	175.9	-176.5	0	109.9	V315 R316 E317 I321 R322 E323	V315-K319 WeakPolarHBondContact O-CB 3.42Å; V315-K319 PolarHBondContact O-N 2.99Å; R316-K319 WeakPolarHBondContact O-CB 3.15Å; R316-K319 PolarHBondContact O-N 3.49Å; E317-K319 VanDerWaalsContact C-N 3.29Å; E317-K319 PolarHBondContact O-N 3.11Å; K319-I321 PolarHBondContact O-N 3.34Å; K319-R322 PolarHBondContact O-N 3.27Å; K319-E323 VanDerWaalsContact O-CB 3.27Å; K319-E323 WeakPolarHBondContact O-CB 3.43Å; K319-E323 PolarHBondContact O-N 2.98Å
320	I	75.7	Confident	70.3	Confident	100 Å²	100	100.8 Å²	100.8	51%	0.513	48%	0.483	S	S	.	.	H	α-helix	trans	-57.7	-46	178.2	-66.3	162.8	0	0	0	111.3	R316 E317 E323 A324	R316-I320 HydrophobicContact CG-CD1 4.06Å; R316-I320 WeakPolarHBondContact O-CG1 3.48Å; R316-I320 PolarHBondContact O-N 3.09Å; E317-I320 PolarHBondContact O-N 3.29Å; I320-E323 WeakPolarHBondContact O-CB 3.19Å; I320-E323 PolarHBondContact O-N 2.92Å; I320-A324 WeakPolarHBondContact O-CB 3.39Å; I320-A324 PolarHBondContact O-N 2.91Å
321	I	74	Confident	70.8	Confident	105 Å²	105	107.6 Å²	107.6	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-64.4	-42.5	178.3	-67.5	168.4	0	0	0	111.4	E317 K319 E323 A325	E317-I321 HydrophobicContact CG-CD1 3.84Å; E317-I321 WeakPolarHBondContact O-CG1 3.47Å; E317-I321 PolarHBondContact O-N 2.85Å; K319-I321 PolarHBondContact O-N 3.34Å; I321-E323 VanDerWaalsContact C-N 3.33Å; I321-E323 PolarHBondContact O-N 3.02Å; I321-A325 VanDerWaalsContact O-CB 3.25Å; I321-A325 WeakPolarHBondContact O-CB 3.23Å; I321-A325 PolarHBondContact O-N 3.47Å
322	R	75.7	Confident	70.7	Confident	180 Å²	180	110.5 Å²	110.5	68%	0.679	51%	0.512	S	S	*	.	H	α-helix	trans	-63.9	-38	174.6	-77	169.4	171.9	177.3	-6.1	112.2	K318 K319 R326	K318-R322 VanDerWaalsContact O-CB 3.3Å; K318-R322 WeakPolarHBondContact O-CB 3.33Å; K318-R322 WeakPolarHBondContact O-CD 3.06Å; K318-R322 WeakPolarHBondContact O-CG 3.46Å; K318-R322 PolarHBondContact O-N 2.94Å; K319-R322 PolarHBondContact O-N 3.27Å; R322-R326 VanDerWaalsContact O-CB 3.3Å; R322-R326 WeakPolarHBondContact O-CB 3.17Å; R322-R326 PolarHBondContact O-N 3.22Å
323	E	76.1	Confident	70.8	Confident	74 Å²	74	113 Å²	113	35%	0.346	53%	0.527	S	S	.	.	H	α-helix	trans	-67.3	-49	179	-162.8	116.8	-107.3	0	0	111	K319 I320 I321 A325 R326 N327	K319-E323 VanDerWaalsContact O-CB 3.27Å; K319-E323 WeakPolarHBondContact O-CB 3.43Å; K319-E323 PolarHBondContact O-N 2.98Å; I320-E323 WeakPolarHBondContact O-CB 3.19Å; I320-E323 PolarHBondContact O-N 2.92Å; I321-E323 VanDerWaalsContact C-N 3.33Å; I321-E323 PolarHBondContact O-N 3.02Å; E323-A325 PolarHBondContact O-N 2.71Å; E323-R326 WeakPolarHBondContact O-CB 3.39Å; E323-R326 PolarHBondContact O-N 2.94Å; E323-R326 IonicContact OE1-CZ 3.41Å; E323-R326 IonicContact OE1-NH1 3.13Å; E323-R326 PolarHBondContact OE1-NH1 2.85Å; E323-N327 PolarHBondContact O-N 3.22Å
324	A	74.4	Confident	70.2	Confident	51 Å²	51	118.1 Å²	118.1	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-58.4	-47.6	172.3	0	0	0	0	0	111.6	I320 R326 N327 V328	I320-A324 WeakPolarHBondContact O-CB 3.39Å; I320-A324 PolarHBondContact O-N 2.91Å; A324-R326 VanDerWaalsContact C-N 3.29Å; A324-R326 PolarHBondContact O-N 3.44Å; A324-N327 PolarHBondContact O-N 2.83Å; A324-N327 VanDerWaalsContact O-N 3.15Å; A324-V328 WeakPolarHBondContact O-CG2 3.14Å; A324-V328 PolarHBondContact O-N 2.6Å
325	A	72.7	Confident	69.6	Low	48 Å²	48	116.9 Å²	116.9	40%	0.397	55%	0.551	S	S	.	*	H	α-helix	trans	-63.2	-33.4	176.5	0	0	0	0	0	112.9	I321 E323 K329	I321-A325 VanDerWaalsContact O-CB 3.25Å; I321-A325 WeakPolarHBondContact O-CB 3.23Å; I321-A325 PolarHBondContact O-N 3.47Å; E323-A325 PolarHBondContact O-N 2.71Å; A325-K329 WeakPolarHBondContact O-CB 3.39Å; A325-K329 WeakPolarHBondContact O-CG 3.35Å; A325-K329 PolarHBondContact O-N 2.98Å
326	R	77.2	Confident	68.6	Low	137 Å²	137	124.1 Å²	124.1	52%	0.517	57%	0.57	S	S	.	*	H	α-helix	trans	-68.8	-39.3	173.7	-159.7	-168.2	-53.6	114.4	-6.1	111.2	R322 E323 A324 K329 S330	R322-R326 VanDerWaalsContact O-CB 3.3Å; R322-R326 WeakPolarHBondContact O-CB 3.17Å; R322-R326 PolarHBondContact O-N 3.22Å; E323-R326 WeakPolarHBondContact O-CB 3.39Å; E323-R326 PolarHBondContact O-N 2.94Å; E323-R326 IonicContact OE1-CZ 3.41Å; E323-R326 IonicContact OE1-NH1 3.13Å; E323-R326 PolarHBondContact OE1-NH1 2.85Å; A324-R326 VanDerWaalsContact C-N 3.29Å; A324-R326 PolarHBondContact O-N 3.44Å; R326-K329 PolarHBondContact O-N 3.25Å; R326-S330 WeakPolarHBondContact O-CB 3.34Å; R326-S330 PolarHBondContact O-N 3.44Å; R326-S330 PolarHBondContact O-OG 2.9Å
327	N	75.2	Confident	67.1	Low	87 Å²	87	118.5 Å²	118.5	47%	0.465	57%	0.567	S	S	.	*	H	α-helix	trans	-71.1	-37.5	177.3	-69.9	-7.9	0	0	0	112.5	E323 A324 S330 R331	E323-N327 PolarHBondContact O-N 3.22Å; A324-N327 PolarHBondContact O-N 2.83Å; A324-N327 VanDerWaalsContact O-N 3.15Å; N327-S330 WeakPolarHBondContact CA-OG 3.36Å; N327-S330 PolarHBondContact O-N 3.29Å; N327-S330 PolarHBondContact O-OG 3.21Å; N327-S330 VanDerWaalsContact O-OG 3.07Å; N327-R331 WeakPolarHBondContact O-CB 3.22Å; N327-R331 WeakPolarHBondContact O-CG 3.17Å; N327-R331 PolarHBondContact O-N 2.85Å
328	V	72.3	Confident	65.3	Low	81 Å²	81	123.8 Å²	123.8	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-63.4	-47.8	169.9	173	0	0	0	0	110.1	A324 S330 R331 Y332	A324-V328 WeakPolarHBondContact O-CG2 3.14Å; A324-V328 PolarHBondContact O-N 2.6Å; V328-S330 VanDerWaalsContact C-N 3.32Å; V328-S330 PolarHBondContact O-N 3.34Å; V328-R331 PolarHBondContact O-N 3.05Å; V328-Y332 HydrophobicContact CG1-CD2 3.9Å; V328-Y332 HydrophobicContact CG1-CE2 4.15Å; V328-Y332 WeakPolarHBondContact O-CD2 3.36Å; V328-Y332 PolarHBondContact O-N 3.16Å
329	K	72.8	Confident	63.5	Low	161 Å²	161	123 Å²	123	70%	0.7	59%	0.59	S	S	*	*	H	α-helix	trans	-61.6	-35.8	176	-77.6	-174.7	176.5	-170.5	0	113.1	A325 R326 K333	A325-K329 WeakPolarHBondContact O-CB 3.39Å; A325-K329 WeakPolarHBondContact O-CG 3.35Å; A325-K329 PolarHBondContact O-N 2.98Å; R326-K329 PolarHBondContact O-N 3.25Å; K329-K333 VanDerWaalsContact O-CB 3.29Å; K329-K333 WeakPolarHBondContact O-CB 3.48Å; K329-K333 PolarHBondContact O-N 3.14Å
330	S	72.5	Confident	61.4	Low	53 Å²	53	126.6 Å²	126.6	37%	0.371	61%	0.606	S	S	.	*	H	α-helix	trans	-74.9	-38.2	177.8	71.2	0	0	0	0	112.5	R326 N327 V328 K333 K334	R326-S330 WeakPolarHBondContact O-CB 3.34Å; R326-S330 PolarHBondContact O-N 3.44Å; R326-S330 PolarHBondContact O-OG 2.9Å; N327-S330 WeakPolarHBondContact CA-OG 3.36Å; N327-S330 PolarHBondContact O-N 3.29Å; N327-S330 PolarHBondContact O-OG 3.21Å; N327-S330 VanDerWaalsContact O-OG 3.07Å; V328-S330 VanDerWaalsContact C-N 3.32Å; V328-S330 PolarHBondContact O-N 3.34Å; S330-K333 PolarHBondContact O-N 2.94Å; S330-K334 WeakPolarHBondContact O-CB 3.28Å; S330-K334 WeakPolarHBondContact O-CG 3.47Å; S330-K334 PolarHBondContact O-N 2.63Å
331	R	69.2	Low	59.4	Low	153 Å²	153	126.1 Å²	126.1	58%	0.577	62%	0.617	S	S	*	*	H	α-helix	trans	-55.4	-53.7	167.9	-76.3	-179.6	177.4	-169.7	-1.8	110.4	N327 V328 K333 K334 S335 E513	N327-R331 WeakPolarHBondContact O-CB 3.22Å; N327-R331 WeakPolarHBondContact O-CG 3.17Å; N327-R331 PolarHBondContact O-N 2.85Å; V328-R331 PolarHBondContact O-N 3.05Å; R331-K333 PolarHBondContact O-N 3.18Å; R331-K334 PolarHBondContact O-N 3.44Å; R331-S335 PolarHBondContact O-N 3.37Å; R331-S335 PolarHBondContact O-OG 2.98Å; R331-E513 IonicContact NH2-OE2 3.86Å
332	Y	57	Low	57.3	Low	149 Å²	149	124.2 Å²	124.2	58%	0.584	62%	0.623	S	S	*	*	H	α-helix	trans	-67	-29.1	179.8	-89.3	-86.2	0	0	0	114.9	V328 S335 R336	V328-Y332 HydrophobicContact CG1-CD2 3.9Å; V328-Y332 HydrophobicContact CG1-CE2 4.15Å; V328-Y332 WeakPolarHBondContact O-CD2 3.36Å; V328-Y332 PolarHBondContact O-N 3.16Å; Y332-S335 PolarHBondContact O-OG 2.91Å; Y332-R336 PolarHBondContact O-N 2.81Å
333	K	61.9	Low	55.3	Low	175 Å²	175	123.9 Å²	123.9	76%	0.761	63%	0.627	S	S	*	*	H	α-helix	trans	-77.9	-34.7	174.7	-165.1	176.1	-177.8	-175.1	0	111.9	K329 S330 R331	K329-K333 VanDerWaalsContact O-CB 3.29Å; K329-K333 WeakPolarHBondContact O-CB 3.48Å; K329-K333 PolarHBondContact O-N 3.14Å; S330-K333 PolarHBondContact O-N 2.94Å; R331-K333 PolarHBondContact O-N 3.18Å
334	K	54.3	Low	53	Low	178 Å²	178	132 Å²	132	77%	0.774	65%	0.654	S	S	*	*	H	α-helix	trans	-70.5	-38.6	173.9	-75.2	-172.9	173.6	-169.8	0	112.3	S330 R331 R336 G337	S330-K334 WeakPolarHBondContact O-CB 3.28Å; S330-K334 WeakPolarHBondContact O-CG 3.47Å; S330-K334 PolarHBondContact O-N 2.63Å; R331-K334 PolarHBondContact O-N 3.44Å; K334-R336 VanDerWaalsContact C-N 3.33Å; K334-R336 PolarHBondContact O-N 3.21Å; K334-G337 PolarHBondContact O-N 3.23Å
335	S	49.1	Very low	51.2	Low	88 Å²	88	135.6 Å²	135.6	62%	0.615	66%	0.662	S	S	*	*	H	α-helix	trans	-71.9	-21.5	179.4	62.4	0	0	0	0	114.6	R331 Y332	R331-S335 PolarHBondContact O-N 3.37Å; R331-S335 PolarHBondContact O-OG 2.98Å; Y332-S335 PolarHBondContact O-OG 2.91Å
336	R	45.1	Very low	49.4	Very low	230 Å²	230	142.4 Å²	142.4	87%	0.868	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	6.7	171.9	-82.6	-173.8	162.6	177.8	-5	114.6	Y332 K334	Y332-R336 PolarHBondContact O-N 2.81Å; K334-R336 VanDerWaalsContact C-N 3.33Å; K334-R336 PolarHBondContact O-N 3.21Å
337	G	38.1	Very low	47.5	Very low	58 Å²	58	139.9 Å²	139.9	60%	0.598	70%	0.695	S	S	*	*			trans	-105.6	11.5	-169.9	0	0	0	0	0	117	K334	K334-G337 PolarHBondContact O-N 3.23Å
338	R	32.9	Very low	45.6	Very low	228 Å²	228	143.8 Å²	143.8	86%	0.86	71%	0.71	S	S	*	*			trans	-108.9	108.1	178.4	-178.7	174.6	-80	-136.6	-1.4	110.8
339	P	32.7	Very low	43.8	Very low	111 Å²	111	148 Å²	148	72%	0.721	72%	0.724	S	S	*	*			trans	-64.9	141.2	168.9	-16.8	30.8	0	0	0	110.4	A341	P339-A341 PolarHBondContact O-N 2.75Å
340	F	31.4	Very low	42	Very low	211 Å²	211	146.4 Å²	146.4	93%	0.925	73%	0.731	S	S	*	*			trans	-91.9	78.6	170.2	-152	-80.8	0	0	0	109.1
341	A	33.1	Very low	40.2	Very low	90 Å²	90	148.9 Å²	148.9	74%	0.744	75%	0.748	S	S	*	*			trans	-92.2	145.6	174.8	0	0	0	0	0	110.6	P339	P339-A341 PolarHBondContact O-N 2.75Å
342	G	29.4	Very low	38.7	Very low	65 Å²	65	146 Å²	146	67%	0.67	76%	0.757	S	S	*	*			trans	121.8	123.4	167.6	0	0	0	0	0	115.2
343	K	33	Very low	37.7	Very low	173 Å²	173	148 Å²	148	75%	0.752	77%	0.773	S	S	*	*			trans	70.6	97.7	167.3	-63.7	-170.2	164.5	-102.2	0	118.3	E345	K343-E345 IonicContact NZ-OE1 3.9Å; K343-E345 PolarHBondContact NZ-OE1 3.26Å; K343-E345 IonicContact NZ-OE2 3.85Å
344	R	29.3	Very low	36.3	Very low	246 Å²	246	146 Å²	146	93%	0.928	78%	0.776	S	S	*	*			trans	-132.9	101.3	142.3	-176.1	-179.2	-174.4	-167.4	-1.1	106.9
345	E	36.4	Very low	35.6	Very low	126 Å²	126	142.4 Å²	142.4	59%	0.589	77%	0.771	S	S	*	*			trans	-76.1	138.7	170	-74.8	129.6	175.3	0	0	109.4	K343	K343-E345 IonicContact NZ-OE1 3.9Å; K343-E345 PolarHBondContact NZ-OE1 3.26Å; K343-E345 IonicContact NZ-OE2 3.85Å
346	E	34.3	Very low	34.9	Very low	190 Å²	190	144.3 Å²	144.3	89%	0.888	78%	0.779	S	S	*	*			trans	27	143.3	143.1	-61.8	165	168.4	0	0	119.9
347	A	36.9	Very low	34.5	Very low	85 Å²	85	137.6 Å²	137.6	70%	0.702	77%	0.768	S	S	*	*			cis	-152.9	176.1	22.3	0	0	0	0	0	113.6
348	E	35.7	Very low	34.4	Very low	169 Å²	169	143.6 Å²	143.6	79%	0.79	78%	0.778	S	S	*	*			trans	58.2	104.7	160.2	-65.9	178.7	143.4	0	0	118.7
349	Q	34.5	Very low	34.7	Very low	168 Å²	168	138.9 Å²	138.9	79%	0.785	77%	0.77	S	S	*	*				83.6	143	82.3	-81.7	-161.2	57.2	0	0	113.3
350	P	35.3	Very low	35.1	Very low	129 Å²	129	140.2 Å²	140.2	84%	0.838	77%	0.77	S	S	*	*			cis	-124.8	-160.3	43.9	42	-27.1	0	0	0	115.7
351	S	34.4	Very low	35.5	Very low	105 Å²	105	137.1 Å²	137.1	73%	0.734	76%	0.763	S	S	*	*			trans	-123	-174	-150	58.1	0	0	0	0	116.1
352	A	38	Very low	35.9	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	76%	0.757	S	S	*	*			trans	75.2	144.4	-179.9	0	0	0	0	0	116.9
353	M	36.7	Very low	36.3	Very low	189 Å²	189	145.2 Å²	145.2	93%	0.931	76%	0.763	S	S	*	*			cis	-179.3	159.6	-36.5	-114.2	174.8	157.2	0	0	105.9
354	T	31.7	Very low	36.5	Very low	134 Å²	134	143 Å²	143	82%	0.822	76%	0.759	S	S	*	*			trans	-104.5	-166	-169.6	53.7	0	0	0	0	110.7
355	P	39.8	Very low	36.9	Very low	102 Å²	102	140.4 Å²	140.4	66%	0.662	76%	0.757	S	S	*	*			cis	-145.2	-169.4	3.6	37.7	-13.7	0	0	0	117.6
356	T	34.4	Very low	36.8	Very low	128 Å²	128	137 Å²	137	79%	0.785	76%	0.756	S	S	*	*			trans	67.6	156.7	151.3	37.8	0	0	0	0	119.8
357	S	37	Very low	36.8	Very low	90 Å²	90	139.7 Å²	139.7	63%	0.629	76%	0.758	S	S	*	*			cis	-167.1	161.8	-5.3	39.5	0	0	0	0	111.7
358	F	35.2	Very low	36.7	Very low	183 Å²	183	139 Å²	139	80%	0.803	76%	0.76	S	S	*	*			trans	66.8	143.4	157	-74.2	-164.1	0	0	0	118
359	D	39.5	Very low	36.4	Very low	130 Å²	130	135.4 Å²	135.4	70%	0.695	76%	0.759	S	S	*	*			cis	-149.5	-143.8	-13.5	-114.5	1.2	0	0	0	110.3
360	D	40.4	Very low	36.4	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	77%	0.765	S	S	*	*			cis	-162	-177.4	20.2	-167.8	10.9	0	0	0	111.8
361	L	40.3	Very low	36.1	Very low	147 Å²	147	134.8 Å²	134.8	77%	0.77	76%	0.761	S	S	*	*			trans	-65.6	168.3	-179	-57.5	158.5	0	0	0	113.5
362	D	40.8	Very low	36.4	Very low	114 Å²	114	134.7 Å²	134.7	61%	0.61	76%	0.758	S	S	*	*			cis	-157.9	180	12.6	-148.7	11.3	0	0	0	107.5
363	R	39.1	Very low	36.1	Very low	211 Å²	211	137.4 Å²	137.4	80%	0.796	76%	0.758	S	S	*	*			cis	-150.9	172.4	3.4	-162.6	160.9	-171.4	73.5	9.9	111.8
364	D	37.6	Very low	35.7	Very low	127 Å²	127	134.5 Å²	134.5	68%	0.679	75%	0.746	S	S	*	*			trans	-86.6	152	-178.4	-177	24.4	0	0	0	116.5	G366	D364-G366 PolarHBondContact OD1-N 3.11Å
365	E	37.7	Very low	35.5	Very low	191 Å²	191	133.6 Å²	133.6	89%	0.893	74%	0.744	S	S	*	*				-164.2	111.6	126.1	-93.3	-118.2	130.8	0	0	109
366	G	33.7	Very low	35.2	Very low	54 Å²	54	136.7 Å²	136.7	56%	0.557	75%	0.754	S	S	*	*			trans	-130.6	178.5	-175.7	0	0	0	0	0	116.5	D364	D364-G366 PolarHBondContact OD1-N 3.11Å
367	R	34.7	Very low	35	Very low	246 Å²	246	137.7 Å²	137.7	93%	0.928	76%	0.755	S	S	*	*			trans	-176	133.7	158.3	-111.5	164.9	-112.5	-108.5	0.4	113.9
368	G	34	Very low	34.8	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	76%	0.761	S	S	*	*			trans	76.2	124.7	165.3	0	0	0	0	0	115.9
369	A	30.6	Very low	34.6	Very low	93 Å²	93	136.4 Å²	136.4	77%	0.769	76%	0.758	S	S	*	*			cis	59.2	135	14.5	0	0	0	0	0	114
370	L	34.4	Very low	34.2	Very low	174 Å²	174	137.5 Å²	137.5	91%	0.911	76%	0.763	S	S	*	*			cis	-129	-176	17	-76.5	164.5	0	0	0	113.5
371	S	28.4	Very low	34	Very low	109 Å²	109	136 Å²	136	76%	0.762	76%	0.76	S	S	*	*			trans	-107.8	-127	-168.7	40.5	0	0	0	0	115.6
372	P	39.5	Very low	33.5	Very low	103 Å²	103	136.3 Å²	136.3	67%	0.669	76%	0.758	S	S	*	*				-120.4	-123.9	-122.4	40.5	-20.9	0	0	0	113.7
373	I	32.8	Very low	32.8	Very low	150 Å²	150	137.3 Å²	137.3	77%	0.769	76%	0.762	S	S	*	*			trans	85.7	109.3	-171.4	-54.4	159.9	0	0	0	111.6
374	D	27.9	Very low	32.3	Very low	128 Å²	128	133 Å²	133	68%	0.684	76%	0.763	S	S	*	*			cis	95.2	133.5	32.7	-67.7	-53.2	0	0	0	114.8
375	C	27.3	Very low	32.1	Very low	115 Å²	115	131.2 Å²	131.2	78%	0.777	77%	0.766	S	S	*	*			trans	52.7	135	156.4	-56.6	0	0	0	0	118.8
376	L	33.7	Very low	32.1	Very low	167 Å²	167	127.7 Å²	127.7	87%	0.874	76%	0.759	S	S	*	*				-151.1	156.7	70.5	-127.9	76.9	0	0	0	113.6
377	D	29.5	Very low	31.8	Very low	149 Å²	149	130.6 Å²	130.6	80%	0.797	77%	0.767	S	S	*	*			trans	-68.9	154.6	164.1	-73.3	-73.5	0	0	0	112.8
378	S	34	Very low	31.5	Very low	108 Å²	108	124.9 Å²	124.9	76%	0.755	76%	0.755	S	S	*	*			trans	-169.2	115.5	136.5	-86.9	0	0	0	0	114.2
379	N	30.9	Very low	31.2	Very low	138 Å²	138	130.2 Å²	130.2	74%	0.738	76%	0.757	S	S	*	*			trans	33	120.5	132.8	-61.5	-55.6	0	0	0	121.6
380	L	30.8	Very low	31.1	Very low	154 Å²	154	132.3 Å²	132.3	81%	0.806	77%	0.765	S	S	*	*				43.5	159.3	119.3	-89.4	72	0	0	0	122.1
381	P	35.8	Very low	30.7	Very low	105 Å²	105	127.4 Å²	127.4	68%	0.682	76%	0.756	S	S	*	*			cis	-124.4	-125.5	-18.3	25.3	1	0	0	0	110.2
382	Q	29.4	Very low	30.9	Very low	154 Å²	154	128.6 Å²	128.6	72%	0.72	76%	0.759	S	S	*	*			cis	-165.2	176.6	-9.3	-142.7	-178.5	3.6	0	0	111
383	I	27.4	Very low	30.2	Very low	135 Å²	135	133.2 Å²	133.2	69%	0.692	77%	0.769	S	S	*	*			trans	76.9	138.1	149.8	-71.6	161.1	0	0	0	120.9
384	C	29.1	Very low	30.1	Very low	122 Å²	122	131.6 Å²	131.6	82%	0.824	77%	0.766	S	S	*	*			trans	69.1	102.9	163.5	-78.6	0	0	0	0	122.4
385	A	32.3	Very low	30.2	Very low	89 Å²	89	134 Å²	134	74%	0.736	77%	0.773	S	S	*	*			trans	-90.6	171.8	131.3	0	0	0	0	0	109.2
386	P	36.9	Very low	30.7	Very low	116 Å²	116	133.1 Å²	133.1	75%	0.753	77%	0.765	S	S	*	*				-153.4	152.2	83.9	39.8	-20.6	0	0	0	118.5
387	T	29.2	Very low	30.4	Very low	116 Å²	116	132.1 Å²	132.1	71%	0.712	76%	0.761	S	S	*	*			trans	15.9	152.4	142.2	73.8	0	0	0	0	125.1
388	N	28	Very low	30.6	Very low	126 Å²	126	131.5 Å²	131.5	67%	0.674	76%	0.763	S	S	*	*				108.6	124.3	127.9	-85.5	-41.6	0	0	0	123.2
389	K	27.5	Very low	30.4	Very low	183 Å²	183	132 Å²	132	80%	0.796	77%	0.766	S	S	*	*			trans	70.2	95.8	137.7	-63.8	172.1	-175.4	-178.7	0	122.5
390	C	29.2	Very low	30.5	Very low	138 Å²	138	129.3 Å²	129.3	93%	0.932	77%	0.771	S	S	*	*				-179.4	158	111.6	57.6	0	0	0	0	110.3
391	G	25.6	Very low	30.2	Very low	70 Å²	70	127.2 Å²	127.2	72%	0.722	77%	0.768	S	S	*	*			cis	-178	20	-1.2	0	0	0	0	0	117.4
392	T	31.7	Very low	30.1	Very low	135 Å²	135	128.3 Å²	128.3	83%	0.828	78%	0.775	S	S	*	*			trans	-146.8	126.5	179	43.7	0	0	0	0	108.6
393	F	24.7	Very low	30.1	Very low	199 Å²	199	129.3 Å²	129.3	87%	0.873	78%	0.78	S	S	*	*			cis	65.9	113.5	33.9	-139.9	-127.8	0	0	0	109.8
394	V	31.1	Very low	30.3	Very low	116 Å²	116	127.9 Å²	127.9	70%	0.703	78%	0.779	S	S	*	*			cis	-150.1	151.3	39.9	163.6	0	0	0	0	112.1
395	Q	30.8	Very low	30.2	Very low	180 Å²	180	131.6 Å²	131.6	84%	0.841	78%	0.782	S	S	*	*			trans	-102.4	175.6	165.7	-75.9	-167.1	-81.1	0	0	109.5
396	P	37.3	Very low	30.1	Very low	95 Å²	95	132.2 Å²	132.2	62%	0.617	78%	0.776	S	S	*	*			cis	-152.2	-163.6	25.8	44.4	-21.1	0	0	0	117.3
397	D	27.5	Very low	29.8	Very low	146 Å²	146	133.4 Å²	133.4	78%	0.781	78%	0.776	S	S	*	*			trans	65.7	160.6	150.8	-61.2	-23.1	0	0	0	119.7
398	V	34.2	Very low	29.9	Very low	137 Å²	137	133.6 Å²	133.6	83%	0.83	77%	0.769	S	S	*	*			cis	-126.2	161.8	14.3	-176.1	0	0	0	0	112.4
399	S	30	Very low	30.3	Very low	119 Å²	119	134.6 Å²	134.6	83%	0.832	77%	0.767	S	S	*	*			trans	-72	171.5	-178.6	59.1	0	0	0	0	116.1
400	G	31.7	Very low	30.5	Very low	81 Å²	81	129.1 Å²	129.1	84%	0.835	76%	0.763	S	S	*	*			trans	163.8	77.5	167.8	0	0	0	0	0	116.6
401	C	24.8	Very low	30.5	Very low	110 Å²	110	129.8 Å²	129.8	74%	0.743	76%	0.762	S	S	*	*			trans	-111.7	146.9	169	-173	0	0	0	0	109.8
402	P	34.3	Very low	30.5	Very low	127 Å²	127	131.6 Å²	131.6	83%	0.825	76%	0.763	S	S	*	*				-135.5	164.6	127.4	32.2	-18.3	0	0	0	115.6
403	Q	29.7	Very low	30.5	Very low	176 Å²	176	132.1 Å²	132.1	82%	0.822	77%	0.766	S	S	*	*			trans	-82	170.8	-171.6	-86.6	-92.3	-54.1	0	0	114.1
404	P	30.7	Very low	30.5	Very low	104 Å²	104	126.8 Å²	126.8	68%	0.675	76%	0.759	S	S	*	*			trans	-92.9	172.6	-163.2	37.9	-37.1	0	0	0	114.8
405	F	28	Very low	30.5	Very low	201 Å²	201	127 Å²	127	88%	0.882	76%	0.763	S	S	*	*			trans	-137.4	167.9	158.9	-140.5	-99	0	0	0	112.3
406	V	29.1	Very low	30.4	Very low	102 Å²	102	128.6 Å²	128.6	62%	0.618	77%	0.767	S	S	*	*			trans	-116.3	159.4	-150.8	-100.6	0	0	0	0	115.7
407	D	30.7	Very low	29.9	Very low	140 Å²	140	131.2 Å²	131.2	75%	0.749	77%	0.774	S	S	*	*			trans	57.2	115.4	152.3	-54.6	-19	0	0	0	121.4
408	E	31.9	Very low	29.7	Very low	120 Å²	120	130.4 Å²	130.4	56%	0.561	78%	0.779	S	S	*	*				167	132.8	89.7	-106.1	-148.4	102.8	0	0	113.3	K895	E408-K895 PolarHBondContact O-NZ 3.23Å; E408-K895 VanDerWaalsContact O-NZ 3.08Å
409	K	36.3	Very low	29.4	Very low	148 Å²	148	128 Å²	128	64%	0.643	77%	0.773	S	S	*	*			trans	80	113.5	160.2	-59.2	144.7	174.6	138.4	0	118.1	K895	K409-K895 HydrophobicContact CD-CD 4.36Å
410	G	31.2	Very low	29.5	Very low	68 Å²	68	129.6 Å²	129.6	70%	0.701	77%	0.772	S	S	*	*				146.7	87.1	115	0	0	0	0	0	119.5
411	V	30.1	Very low	29.4	Very low	152 Å²	152	133 Å²	133	92%	0.921	77%	0.771	S	S	*	*			trans	68.4	127	154.5	-172.6	0	0	0	0	117.3
412	S	25.6	Very low	29.6	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	78%	0.775	S	S	*	*			trans	-99.8	139.8	177.6	48.1	0	0	0	0	113.1
413	V	30	Very low	29.5	Very low	146 Å²	146	135 Å²	135	89%	0.885	77%	0.77	S	S	*	*			trans	-142.8	116.6	142.4	-175.7	0	0	0	0	108
414	A	26.4	Very low	29.5	Very low	88 Å²	88	131.8 Å²	131.8	73%	0.727	76%	0.763	S	S	*	*			trans	-122	158.1	171.4	0	0	0	0	0	109.3
415	P	30	Very low	29.4	Very low	120 Å²	120	136 Å²	136	78%	0.779	77%	0.771	S	S	*	*			trans	-92.3	152	-143	33.8	-36.7	0	0	0	115.6
416	K	28.8	Very low	29.4	Very low	213 Å²	213	133.1 Å²	133.1	93%	0.926	77%	0.765	S	S	*	*			trans	-93.6	108.9	163.5	-78.5	-169	172.4	-171.2	0	111
417	I	26.2	Very low	29.3	Very low	150 Å²	150	135.6 Å²	135.6	77%	0.769	77%	0.774	S	S	*	*			trans	-135.6	153.2	160.1	-58.2	-178.4	0	0	0	106.5
418	C	23.9	Very low	29.2	Very low	130 Å²	130	141.2 Å²	141.2	88%	0.878	79%	0.785	S	S	*	*			trans	73.3	72.6	178.4	-66	0	0	0	0	117.6
419	A	28.6	Very low	29	Very low	85 Å²	85	140.5 Å²	140.5	70%	0.702	79%	0.794	S	S	*	*			trans	-160.9	131.4	151.9	0	0	0	0	0	105.6
420	D	31.8	Very low	28.4	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	80%	0.801	S	S	*	*	S	Bend	cis	-147.4	-164.3	8.8	-85.2	-50.5	0	0	0	111.6
421	L	30.7	Very low	28.4	Very low	154 Å²	154	144.1 Å²	144.1	81%	0.806	81%	0.805	S	S	*	*			trans	76.6	56.7	165.3	-56.5	-177.5	0	0	0	117.7	V423	L421-V423 PolarHBondContact O-N 3.28Å; L421-V423 VanDerWaalsContact O-N 3.11Å
422	N	28.2	Very low	28.2	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	79%	0.794	S	S	*	*			trans	-64.1	93.1	145.6	177.2	59.2	0	0	0	110.2
423	V	31.1	Very low	28.5	Very low	120 Å²	120	143.5 Å²	143.5	73%	0.727	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-97.5	131.7	168.8	-179	0	0	0	0	109.2	L421	L421-V423 PolarHBondContact O-N 3.28Å; L421-V423 VanDerWaalsContact O-N 3.11Å
424	T	31	Very low	28.3	Very low	110 Å²	110	143.4 Å²	143.4	68%	0.675	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-74.3	151.2	-172.2	39.5	0	0	0	0	112.9	D426	T424-D426 PolarHBondContact O-N 3.41Å
425	K	27.9	Very low	28.4	Very low	193 Å²	193	145.3 Å²	145.3	84%	0.839	79%	0.792	S	S	*	*	S	Bend	trans	-57.9	117.3	147.4	-82.8	-170.4	169.1	-162.7	0	107.3
426	D	28.3	Very low	28.5	Very low	139 Å²	139	148.8 Å²	148.8	74%	0.743	80%	0.795	S	S	*	*				-170.3	168	125.7	-79	-29.9	0	0	0	106.6	T424	T424-D426 PolarHBondContact O-N 3.41Å
427	N	27.5	Very low	28.4	Very low	154 Å²	154	141.8 Å²	141.8	82%	0.824	78%	0.783	S	S	*	*			trans	55.8	75.5	-174.5	-64.7	-4.7	0	0	0	116.5
428	W	27.4	Very low	28.7	Very low	258 Å²	258	142.7 Å²	142.7	98%	0.977	79%	0.789	S	S	*	*			trans	-131.4	87.1	145.5	-80.3	92.5	0	0	0	108.8
429	S	27.1	Very low	28.9	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	79%	0.789	S	S	*	*			trans	-67.8	155	165.5	34.2	0	0	0	0	110.7
430	E	25.2	Very low	29	Very low	171 Å²	171	144 Å²	144	80%	0.799	80%	0.795	S	S	*	*			trans	-67.1	136.8	171.5	-65.5	172.4	119.9	0	0	109.8	T432	E430-T432 VanDerWaalsContact C-N 3.25Å; E430-T432 PolarHBondContact O-N 2.93Å
431	P	30.1	Very low	28.8	Very low	121 Å²	121	146.1 Å²	146.1	79%	0.786	80%	0.797	S	S	*	*			trans	-72.9	85.6	166.6	30.3	-32.4	0	0	0	108.8	V433	P431-V433 PolarHBondContact O-N 3.46Å
432	T	26.5	Very low	28.7	Very low	113 Å²	113	146.7 Å²	146.7	69%	0.693	80%	0.8	S	S	*	*			trans	-65.9	92.6	173	-57.1	0	0	0	0	109.6	E430 Q434	E430-T432 VanDerWaalsContact C-N 3.25Å; E430-T432 PolarHBondContact O-N 2.93Å; T432-Q434 PolarHBondContact O-N 2.86Å
433	V	32	Very low	28.7	Very low	133 Å²	133	144 Å²	144	81%	0.806	79%	0.794	S	S	*	*			trans	-72	99	174.3	-177.8	0	0	0	0	108.8	P431	P431-V433 PolarHBondContact O-N 3.46Å
434	Q	26.8	Very low	28.7	Very low	144 Å²	144	143.6 Å²	143.6	67%	0.673	80%	0.796	S	S	*	*			trans	-74.7	138.6	166.7	-70.2	-174.6	-37.1	0	0	109.9	T432 F436	T432-Q434 PolarHBondContact O-N 2.86Å; Q434-F436 PolarHBondContact O-N 2.87Å
435	P	27.5	Very low	28.7	Very low	128 Å²	128	144.6 Å²	144.6	83%	0.831	81%	0.805	S	S	*	*			trans	-81.5	108.6	174.7	31.9	-31.4	0	0	0	110.1
436	F	31.6	Very low	28.8	Very low	194 Å²	194	139 Å²	139	85%	0.851	80%	0.795	S	S	*	*			trans	-96	117.4	153.7	-88.6	-89.6	0	0	0	107.9	Q434	Q434-F436 PolarHBondContact O-N 2.87Å
437	G	26.9	Very low	28.9	Very low	65 Å²	65	142 Å²	142	67%	0.67	80%	0.801	S	S	*	*			trans	-94.6	152.4	164.7	0	0	0	0	0	109.7
438	D	32.5	Very low	28.9	Very low	169 Å²	169	146.5 Å²	146.5	90%	0.904	81%	0.806	S	S	*	*			trans	-151.8	152.6	134.9	-113.6	-34	0	0	0	110.3
439	T	27.9	Very low	29	Very low	141 Å²	141	140.3 Å²	140.3	87%	0.865	80%	0.802	S	S	*	*			trans	-99.4	119	-166.6	55.2	0	0	0	0	113.2
440	A	31.8	Very low	29.3	Very low	101 Å²	101	139.8 Å²	139.8	84%	0.835	81%	0.805	S	S	*	*			trans	-131.4	122.9	162.7	0	0	0	0	0	110.4
441	K	27.2	Very low	29.4	Very low	199 Å²	199	142.6 Å²	142.6	87%	0.865	81%	0.808	S	S	*	*			trans	-83.3	146	171.6	-56.9	169.2	-176.7	172.7	0	108.8
442	L	28.8	Very low	29.3	Very low	165 Å²	165	144.2 Å²	144.2	86%	0.864	81%	0.809	S	S	*	*			trans	171.3	111.5	131.9	-92.5	157.7	0	0	0	113.8
443	S	28.5	Very low	29.4	Very low	101 Å²	101	149.7 Å²	149.7	71%	0.706	82%	0.817	S	S	*	*			trans	36.1	134.8	138.3	60.3	0	0	0	0	123.9
444	S	30	Very low	29.5	Very low	111 Å²	111	148.3 Å²	148.3	78%	0.776	81%	0.811	S	S	*	*			trans	93	115.9	147.4	-155.7	0	0	0	0	118.9
445	P	30.3	Very low	29.6	Very low	132 Å²	132	152.8 Å²	152.8	86%	0.857	82%	0.821	S	S	*	*			trans	-97.2	100.6	-177.7	35.9	-31.7	0	0	0	114
446	A	30.4	Very low	29.9	Very low	76 Å²	76	154.2 Å²	154.2	63%	0.628	82%	0.822	S	S	*	*			trans	-155.3	157.2	163.2	0	0	0	0	0	112.4
447	K	30.2	Very low	30.1	Very low	201 Å²	201	150.7 Å²	150.7	87%	0.874	82%	0.818	S	S	*	*			trans	70.6	40.1	169.2	-50.3	178	-179.6	175.4	0	118.6
448	W	27.8	Very low	30.2	Very low	248 Å²	248	153.1 Å²	153.1	94%	0.939	82%	0.822	S	S	*	*			trans	-104.6	6	175.5	-96.6	49.1	0	0	0	117.1	A450	W448-A450 VanDerWaalsContact C-N 3.26Å; W448-A450 PolarHBondContact O-N 3.43Å; W448-A450 VanDerWaalsContact O-N 3.12Å
449	S	30.8	Very low	30.3	Very low	128 Å²	128	153.5 Å²	153.5	90%	0.895	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	10.5	-177	52.2	0	0	0	0	116.6
450	A	32.1	Very low	30.7	Very low	94 Å²	94	154.4 Å²	154.4	78%	0.777	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	2.3	-165.5	0	0	0	0	0	116.9	W448	W448-A450 VanDerWaalsContact C-N 3.26Å; W448-A450 PolarHBondContact O-N 3.43Å; W448-A450 VanDerWaalsContact O-N 3.12Å
451	R	28.1	Very low	30.7	Very low	230 Å²	230	153.1 Å²	153.1	87%	0.868	81%	0.814	S	S	*	*			trans	-129.7	41.2	-166.9	-155.4	172.2	-77.2	-152.3	-0.8	116.1
452	L	27.9	Very low	30.9	Very low	155 Å²	155	151 Å²	151	81%	0.812	81%	0.811	S	S	*	*			trans	-120.4	82.8	163.8	-69.7	176.7	0	0	0	111.1
453	R	28.3	Very low	31	Very low	229 Å²	229	150.2 Å²	150.2	86%	0.864	81%	0.808	S	S	*	*			trans	-121.9	119.1	160.9	-68.5	-170.2	-169.1	-175.9	6.1	108.6	R455	R453-R455 PolarHBondContact O-N 3.37Å
454	P	33.3	Very low	31.2	Very low	104 Å²	104	149.5 Å²	149.5	68%	0.675	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60.7	118.7	163.2	-20.4	32.8	0	0	0	109.3	A657	P454-A657 VanDerWaalsContact CG-O 3.31Å; P454-A657 WeakPolarHBondContact CG-O 3.43Å
455	R	28.6	Very low	31.4	Very low	237 Å²	237	152.7 Å²	152.7	89%	0.894	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-82	124	163.5	-73.7	-170.2	178.9	-152.6	2.7	107.9	R453	R453-R455 PolarHBondContact O-N 3.37Å
456	L	34.9	Very low	31.5	Very low	159 Å²	159	151.3 Å²	151.3	83%	0.832	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.9	154.5	154.5	-75.7	166.4	0	0	0	108.3
457	P	35.3	Very low	31.6	Very low	120 Å²	120	152.5 Å²	152.5	78%	0.779	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70.5	153.4	-163.1	26.8	-35.5	0	0	0	113.7
458	P	29.6	Very low	31.8	Very low	116 Å²	116	149.8 Å²	149.8	75%	0.753	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-96.3	144.6	176.4	36.7	-31.2	0	0	0	112.6
459	E	34.8	Very low	32.1	Very low	177 Å²	177	141 Å²	141	83%	0.827	79%	0.794	S	S	*	*			trans	-139	124.5	152.4	-70.9	-165.4	138.3	0	0	109.6
460	N	35.5	Very low	32.1	Very low	160 Å²	160	142.7 Å²	142.7	86%	0.856	79%	0.793	S	S	*	*			trans	37	123.4	145.2	-45.8	-25.6	0	0	0	119.5
461	G	31.6	Very low	32.3	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	80%	0.796	S	S	*	*			cis	167	174.6	-2	0	0	0	0	0	112.2
462	L	32.9	Very low	32.5	Very low	154 Å²	154	145.7 Å²	145.7	81%	0.806	80%	0.796	S	S	*	*			trans	70.1	74.8	167.1	-54.8	178.5	0	0	0	119.4
463	D	29.8	Very low	32.5	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	79%	0.793	S	S	*	*				67.7	166.8	111.3	-54	-23.5	0	0	0	124.9
464	A	34.1	Very low	32.7	Very low	86 Å²	86	144.5 Å²	144.5	71%	0.711	80%	0.796	S	S	*	*			trans	85.9	82.4	163.2	0	0	0	0	0	121
465	H	33.6	Very low	33	Very low	179 Å²	179	144.1 Å²	144.1	83%	0.829	80%	0.796	S	S	*	*				54.1	128.5	121.5	-76.9	-85.3	0	0	0	123.3
466	S	32.1	Very low	33.3	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	80%	0.799	S	S	*	*			trans	38.9	147.3	137.2	61.4	0	0	0	0	122.4
467	S	32.2	Very low	33.6	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	79%	0.79	S	S	*	*			cis	-178.7	178.2	-9.2	54.2	0	0	0	0	108.9
468	V	35	Very low	33.4	Very low	144 Å²	144	142.5 Å²	142.5	87%	0.873	79%	0.793	S	S	*	*			trans	71.3	151.7	171.5	-173.4	0	0	0	0	114.7
469	G	33.1	Very low	33.8	Very low	63 Å²	63	145.7 Å²	145.7	65%	0.649	80%	0.795	S	S	*	*			trans	-96.6	-176.4	-169.4	0	0	0	0	0	115.4
470	N	31.8	Very low	34.2	Very low	164 Å²	164	139.2 Å²	139.2	88%	0.877	77%	0.77	S	S	*	*			trans	47.1	97.1	174.3	-71.9	-8.1	0	0	0	116.8
471	D	35.5	Very low	34.4	Very low	158 Å²	158	137.7 Å²	137.7	85%	0.845	76%	0.761	S	S	*	*				-159.7	179.9	105.8	-134.3	-38.8	0	0	0	114.7
472	R	33	Very low	35.1	Very low	230 Å²	230	139.9 Å²	139.9	87%	0.868	75%	0.754	S	S	*	*			trans	-92.1	106.9	-172.5	-63.2	164.5	167.3	173.1	-2.1	113
473	C	28.5	Very low	35.6	Very low	111 Å²	111	135.4 Å²	135.4	75%	0.75	74%	0.736	S	S	*	*			trans	-147.6	98.5	154.6	-148	0	0	0	0	111.2	S475	C473-S475 VanDerWaalsContact C-N 3.27Å; C473-S475 PolarHBondContact O-N 3.32Å; C473-S475 VanDerWaalsContact O-N 3.11Å
474	R	32.2	Very low	36.2	Very low	247 Å²	247	134 Å²	134	93%	0.932	72%	0.724	S	S	*	*				62.7	13.3	88.2	-69.6	-170.2	171.3	-161.2	0.6	116.9
475	S	39.2	Very low	36.5	Very low	96 Å²	96	136.8 Å²	136.8	67%	0.671	73%	0.727	S	S	*	*			trans	-92.9	149.4	161.7	68.9	0	0	0	0	112.7	C473	C473-S475 VanDerWaalsContact C-N 3.27Å; C473-S475 PolarHBondContact O-N 3.32Å; C473-S475 VanDerWaalsContact O-N 3.11Å
476	R	34.8	Very low	36.8	Very low	251 Å²	251	137.5 Å²	137.5	95%	0.947	72%	0.722	S	S	*	*	S	Bend	trans	-102.3	29	-165.7	-79.6	-176	168.7	177.7	-2.2	115.6
477	T	40.3	Very low	37.3	Very low	105 Å²	105	135.8 Å²	135.8	64%	0.644	71%	0.714	S	S	*	*	S	Bend	trans	-113.6	-33.1	-171	45.4	0	0	0	0	115.8	S480	T477-S480 PolarHBondContact O-OG 2.83Å
478	C	31.9	Very low	37.5	Very low	126 Å²	126	135.5 Å²	135.5	85%	0.851	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	15	-166.4	-144.6	0	0	0	0	117
479	K	38.9	Very low	37.8	Very low	183 Å²	183	133.4 Å²	133.4	80%	0.796	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	7.9	166.6	-73.3	-175.6	178.1	177.4	0	113.2	S483	K479-S483 VanDerWaalsContact O-CB 3.23Å; K479-S483 WeakPolarHBondContact O-CB 3.2Å; K479-S483 PolarHBondContact O-OG 2.69Å
480	S	41.5	Very low	37.8	Very low	41 Å²	41	142 Å²	142	29%	0.287	72%	0.718	S	S	.	*	H	α-helix	trans	-76.1	-47.1	-174.2	72.9	0	0	0	0	112.6	T477 I482 S483 Q484	T477-S480 PolarHBondContact O-OG 2.83Å; S480-I482 PolarHBondContact O-N 3.06Å; S480-S483 CarbonylContact O-C 3.58Å; S480-S483 PolarHBondContact O-N 3.19Å; S480-Q484 VanDerWaalsContact CB-OE1 3.3Å; S480-Q484 WeakPolarHBondContact O-CB 3.45Å; S480-Q484 WeakPolarHBondContact O-CG 3.46Å; S480-Q484 PolarHBondContact O-N 3.04Å; S480-Q484 PolarHBondContact O-OE1 3.1Å; S480-Q484 PolarHBondContact OG-OE1 3.04Å
481	L	39.8	Very low	37.8	Very low	129 Å²	129	137.8 Å²	137.8	68%	0.675	71%	0.714	S	S	*	*	H	α-helix	trans	-61.2	-44.1	-169.3	-138.9	75.9	0	0	0	114.3	S483 L485	L481-S483 VanDerWaalsContact C-N 3.33Å; L481-L485 WeakPolarHBondContact O-CB 3.39Å; L481-L485 PolarHBondContact O-N 3.39Å
482	I	46.8	Very low	37.8	Very low	119 Å²	119	141.3 Å²	141.3	61%	0.61	72%	0.715	S	S	*	*	H	α-helix	trans	-78	-18.5	177.2	-68.2	175.2	0	0	0	112.1	S480 R486	S480-I482 PolarHBondContact O-N 3.06Å; I482-R486 WeakPolarHBondContact O-CB 3.43Å; I482-R486 WeakPolarHBondContact O-CD 3.35Å; I482-R486 VanDerWaalsContact O-CG 3.25Å; I482-R486 WeakPolarHBondContact O-CG 3.26Å
483	S	44.3	Very low	37.5	Very low	60 Å²	60	139.7 Å²	139.7	42%	0.42	71%	0.711	S	S	.	*	H	α-helix	trans	-90.3	-35.5	175.4	-54.1	0	0	0	0	112.6	K479 S480 L481 R486 A487	K479-S483 VanDerWaalsContact O-CB 3.23Å; K479-S483 WeakPolarHBondContact O-CB 3.2Å; K479-S483 PolarHBondContact O-OG 2.69Å; S480-S483 CarbonylContact O-C 3.58Å; S480-S483 PolarHBondContact O-N 3.19Å; L481-S483 VanDerWaalsContact C-N 3.33Å; S483-R486 CarbonylContact O-C 3.49Å; S483-R486 PolarHBondContact O-N 2.87Å; S483-R486 VanDerWaalsContact O-N 3.09Å; S483-A487 WeakPolarHBondContact O-CA 3.37Å; S483-A487 WeakPolarHBondContact O-CB 3.43Å; S483-A487 PolarHBondContact O-N 3.32Å
484	Q	41.9	Very low	37.7	Very low	119 Å²	119	141.5 Å²	141.5	56%	0.556	72%	0.718	S	S	*	*	H	α-helix	trans	-71.3	-39.3	178.4	-73.6	166.1	-36.3	0	0	110.2	S480 R486 A488	S480-Q484 VanDerWaalsContact CB-OE1 3.3Å; S480-Q484 WeakPolarHBondContact O-CB 3.45Å; S480-Q484 WeakPolarHBondContact O-CG 3.46Å; S480-Q484 PolarHBondContact O-N 3.04Å; S480-Q484 PolarHBondContact O-OE1 3.1Å; S480-Q484 PolarHBondContact OG-OE1 3.04Å; Q484-R486 PolarHBondContact O-N 2.96Å; Q484-A488 VanDerWaalsContact O-CB 3.27Å; Q484-A488 WeakPolarHBondContact O-CB 3.12Å; Q484-A488 PolarHBondContact O-N 2.83Å; Q484-A488 VanDerWaalsContact O-N 3.13Å
485	L	39.7	Very low	37.5	Very low	145 Å²	145	139.9 Å²	139.9	76%	0.759	71%	0.711	S	S	*	*	H	α-helix	trans	-71.4	-3.4	168.9	-68.5	172.2	0	0	0	114.4	L481	L481-L485 WeakPolarHBondContact O-CB 3.39Å; L481-L485 PolarHBondContact O-N 3.39Å
486	R	40.1	Very low	37	Very low	194 Å²	194	147.4 Å²	147.4	73%	0.732	73%	0.725	S	S	*	*	H	α-helix	trans	-125.9	-4.6	177.3	-66.3	-178.2	175.2	170.8	-1.4	115.1	I482 S483 Q484 T489	I482-R486 WeakPolarHBondContact O-CB 3.43Å; I482-R486 WeakPolarHBondContact O-CD 3.35Å; I482-R486 VanDerWaalsContact O-CG 3.25Å; I482-R486 WeakPolarHBondContact O-CG 3.26Å; S483-R486 CarbonylContact O-C 3.49Å; S483-R486 PolarHBondContact O-N 2.87Å; S483-R486 VanDerWaalsContact O-N 3.09Å; Q484-R486 PolarHBondContact O-N 2.96Å; R486-T489 PolarHBondContact O-OG1 3.47Å
487	A	42.1	Very low	36.6	Very low	66 Å²	66	140.5 Å²	140.5	55%	0.545	72%	0.715	S	S	.	*	H	α-helix	trans	-124.1	-10.8	-179.4	0	0	0	0	0	113.5	S483 T489 R490	S483-A487 WeakPolarHBondContact O-CA 3.37Å; S483-A487 WeakPolarHBondContact O-CB 3.43Å; S483-A487 PolarHBondContact O-N 3.32Å; A487-T489 PolarHBondContact O-N 2.86Å; A487-R490 PolarHBondContact O-N 2.9Å
488	A	36.5	Very low	36.3	Very low	94 Å²	94	144.5 Å²	144.5	78%	0.777	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-8.5	160	0	0	0	0	0	112.9	Q484	Q484-A488 VanDerWaalsContact O-CB 3.27Å; Q484-A488 WeakPolarHBondContact O-CB 3.12Å; Q484-A488 PolarHBondContact O-N 2.83Å; Q484-A488 VanDerWaalsContact O-N 3.13Å
489	T	40.8	Very low	36.2	Very low	100 Å²	100	149.7 Å²	149.7	61%	0.613	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	37.1	-177.5	44.5	0	0	0	0	114.3	R486 A487	R486-T489 PolarHBondContact O-OG1 3.47Å; A487-T489 PolarHBondContact O-N 2.86Å
490	R	33.5	Very low	35.6	Very low	243 Å²	243	149.9 Å²	149.9	92%	0.917	73%	0.732	S	S	*	*	S	Bend	trans	-177.6	94.4	149.1	-94.9	141.3	-166.3	-176.9	3.5	116.2	A487	A487-R490 PolarHBondContact O-N 2.9Å
491	G	32.9	Very low	35.1	Very low	77 Å²	77	153.7 Å²	153.7	79%	0.794	76%	0.755	S	S	*	*			trans	79.7	173	150	0	0	0	0	0	118.8
492	R	35.4	Very low	34.8	Very low	232 Å²	232	157.3 Å²	157.3	88%	0.875	77%	0.766	S	S	*	*			cis	-163.4	127.7	-11.7	-169.1	-173.6	-68.4	171	0.1	111.4
493	Y	26.7	Very low	34.1	Very low	196 Å²	196	160 Å²	160	77%	0.769	78%	0.78	S	S	*	*			trans	39.4	121	159.6	-87.2	-98.5	0	0	0	122	R495	Y493-R495 HydrophobicContact CD1-CG 4.44Å
494	V	31.6	Very low	33.6	Very low	148 Å²	148	163 Å²	163	90%	0.897	80%	0.796	S	S	*	*				-136.9	153.2	122.4	179.5	0	0	0	0	107.8
495	R	27.9	Very low	33	Very low	213 Å²	213	160.3 Å²	160.3	80%	0.804	79%	0.791	S	S	*	*			trans	-96.2	142.2	-177.3	-62.1	173.4	175.4	170.8	-4.7	112.7	Y493	Y493-R495 HydrophobicContact CD1-CG 4.44Å
496	R	28.8	Very low	33	Very low	255 Å²	255	160.1 Å²	160.1	96%	0.962	78%	0.784	S	S	*	*			trans	-149.3	157.7	133.1	-114.9	174.1	-179.5	170.4	-0.2	109.3
497	S	27.4	Very low	33.1	Very low	106 Å²	106	158.1 Å²	158.1	74%	0.741	78%	0.783	S	S	*	*			trans	-107.1	137.8	-158.8	49.6	0	0	0	0	113.6
498	H	33	Very low	33.1	Very low	188 Å²	188	161.2 Å²	161.2	87%	0.87	79%	0.79	S	S	*	*			trans	-147.7	166.8	141.4	-123.9	-102.3	0	0	0	110.6
499	R	30.8	Very low	33.8	Very low	236 Å²	236	161.7 Å²	161.7	89%	0.891	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-75.4	149.4	-158.7	-62.5	174.7	178.4	165.3	-1.6	114.1
500	Q	26.4	Very low	34.1	Very low	186 Å²	186	161.2 Å²	161.2	87%	0.869	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-89.3	142	177.3	-67.9	-179.9	-19.5	0	0	112.6
501	P	31.6	Very low	35.9	Very low	121 Å²	121	152.4 Å²	152.4	79%	0.786	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-74.6	146.1	150.7	-6.1	24.4	0	0	0	110.3
502	K	33.1	Very low	37.7	Very low	206 Å²	206	157.4 Å²	157.4	90%	0.896	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-74	133.7	179.4	-64	176.4	-179.4	176.4	0	111
503	L	30.8	Very low	39.3	Very low	174 Å²	174	152.4 Å²	152.4	91%	0.911	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-82.3	138.1	163.4	-91.7	163	0	0	0	109.7
504	V	34.4	Very low	41	Very low	123 Å²	123	146.3 Å²	146.3	75%	0.745	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-77.9	145.9	172.5	-175.8	0	0	0	0	109.2
505	S	30.1	Very low	42.7	Very low	64 Å²	64	144 Å²	144	45%	0.448	70%	0.696	S	S	.	*	P	Polyproline II helix	trans	-53.6	146.4	172.7	29.9	0	0	0	0	112.1	E507 D508	S505-E507 WeakPolarHBondContact CB-OE2 3.42Å; S505-D508 PolarHBondContact OG-OD2 2.81Å
506	F	39.3	Very low	45	Very low	140 Å²	140	138.5 Å²	138.5	61%	0.614	69%	0.686	S	S	*	*	S	Bend	trans	-92.3	-11.1	178.1	-164.9	-96.3	0	0	0	111.9	D508 L509 V510	F506-D508 PolarHBondContact O-N 2.64Å; F506-D508 VanDerWaalsContact O-N 3.16Å; F506-L509 HydrophobicContact CD2-CD1 3.85Å; F506-L509 HydrophobicContact CE2-CB 4.42Å; F506-L509 HydrophobicContact CE2-CD1 3.86Å; F506-L509 HydrophobicContact CZ-CB 4.41Å; F506-L509 PolarHBondContact O-N 2.94Å; F506-L509 VanDerWaalsContact O-N 3.09Å; F506-V510 HydrophobicContact CE1-CG2 4.31Å
507	E	41.4	Very low	47	Very low	153 Å²	153	131.6 Å²	131.6	72%	0.715	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-58.9	-24.6	-177.9	-72	60.6	-143.4	0	0	113.1	S505	S505-E507 WeakPolarHBondContact CB-OE2 3.42Å
508	D	42.8	Very low	48.9	Very low	131 Å²	131	133.1 Å²	133.1	70%	0.701	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-84.5	-0.8	178.5	-58.4	-62.3	0	0	0	114.4	S505 F506	S505-D508 PolarHBondContact OG-OD2 2.81Å; F506-D508 PolarHBondContact O-N 2.64Å; F506-D508 VanDerWaalsContact O-N 3.16Å
509	L	50.4	Low	50.8	Low	104 Å²	104	129.8 Å²	129.8	55%	0.545	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-106.3	-1.2	-171.8	-83.1	162.6	0	0	0	115.8	F506	F506-L509 HydrophobicContact CD2-CD1 3.85Å; F506-L509 HydrophobicContact CE2-CB 4.42Å; F506-L509 HydrophobicContact CE2-CD1 3.86Å; F506-L509 HydrophobicContact CZ-CB 4.41Å; F506-L509 PolarHBondContact O-N 2.94Å; F506-L509 VanDerWaalsContact O-N 3.09Å
510	V	48.4	Very low	52.9	Low	89 Å²	89	121.2 Å²	121.2	54%	0.539	61%	0.614	S	S	.	*	S	Bend	trans	-121.4	115.2	175.6	-178.2	0	0	0	0	109	F506 D514	F506-V510 HydrophobicContact CE1-CG2 4.31Å; V510-D514 HydrophobicContact CG1-CB 4.3Å
511	T	71.4	Confident	54.6	Low	59 Å²	59	115.8 Å²	115.8	36%	0.362	60%	0.596	S	S	.	*			trans	-81.7	158.3	179.4	73.5	0	0	0	0	111.3	E513 D514 E515	T511-E513 PolarHBondContact O-N 2.91Å; T511-E513 WeakPolarHBondContact OG1-CB 3.31Å; T511-E513 PolarHBondContact OG1-N 3.13Å; T511-D514 WeakPolarHBondContact CB-OD2 3.32Å; T511-D514 PolarHBondContact N-OD2 3Å; T511-D514 PolarHBondContact O-N 2.81Å; T511-D514 VanDerWaalsContact O-N 3.1Å; T511-D514 VanDerWaalsContact OG1-CG 3.28Å; T511-D514 PolarHBondContact OG1-N 3.38Å; T511-D514 VanDerWaalsContact OG1-N 3.16Å; T511-D514 PolarHBondContact OG1-OD2 3.23Å; T511-E515 PolarHBondContact O-N 3.02Å
512	K	70.2	Confident	56.3	Low	181 Å²	181	115.5 Å²	115.5	79%	0.787	58%	0.584	S	S	*	*	H	α-helix	trans	-59.6	-25.7	168.8	-67.6	-177.8	178.7	177.9	0	112.2	V516	K512-V516 WeakPolarHBondContact O-CG2 3.49Å; K512-V516 PolarHBondContact O-N 2.96Å
513	E	68.2	Low	57.8	Low	128 Å²	128	112.8 Å²	112.8	60%	0.598	57%	0.568	S	S	*	*	H	α-helix	trans	-64.8	-44.1	173.9	-48	-177	154.8	0	0	111	R331 T511 E515 V516 L517	R331-E513 IonicContact NH2-OE2 3.86Å; T511-E513 PolarHBondContact O-N 2.91Å; T511-E513 WeakPolarHBondContact OG1-CB 3.31Å; T511-E513 PolarHBondContact OG1-N 3.13Å; E513-E515 PolarHBondContact O-N 2.66Å; E513-V516 PolarHBondContact O-N 3.43Å; E513-L517 WeakPolarHBondContact O-CB 3.49Å; E513-L517 PolarHBondContact O-N 3.47Å
514	D	63.3	Low	59.3	Low	68 Å²	68	110.1 Å²	110.1	36%	0.364	55%	0.549	S	S	.	.	H	α-helix	trans	-65.4	-38	179.8	-59.8	-63.8	0	0	0	111.7	V510 T511 L517 F518	V510-D514 HydrophobicContact CG1-CB 4.3Å; T511-D514 WeakPolarHBondContact CB-OD2 3.32Å; T511-D514 PolarHBondContact N-OD2 3Å; T511-D514 PolarHBondContact O-N 2.81Å; T511-D514 VanDerWaalsContact O-N 3.1Å; T511-D514 VanDerWaalsContact OG1-CG 3.28Å; T511-D514 PolarHBondContact OG1-N 3.38Å; T511-D514 VanDerWaalsContact OG1-N 3.16Å; T511-D514 PolarHBondContact OG1-OD2 3.23Å; D514-L517 PolarHBondContact O-N 3.02Å; D514-F518 WeakPolarHBondContact O-CB 3.49Å; D514-F518 PolarHBondContact O-N 2.95Å
515	E	66.6	Low	60	Low	99 Å²	99	107.2 Å²	107.2	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-67	-42.3	177.4	-158.3	-156.1	146.1	0	0	112.1	T511 E513 F518 K519	T511-E515 PolarHBondContact O-N 3.02Å; E513-E515 PolarHBondContact O-N 2.66Å; E515-F518 PolarHBondContact O-N 2.89Å; E515-K519 WeakPolarHBondContact O-CG 3.23Å; E515-K519 PolarHBondContact O-N 3.44Å; E515-K519 VanDerWaalsContact O-N 3.07Å; E515-K519 VanDerWaalsContact OE1-CE 3.3Å; E515-K519 WeakPolarHBondContact OE1-CE 3.22Å; E515-K519 IonicContact OE1-NZ 2.72Å; E515-K519 PolarHBondContact OE1-NZ 2.94Å
516	V	76	Confident	61	Low	98 Å²	98	107.3 Å²	107.3	59%	0.594	54%	0.538	S	S	*	.	H	α-helix	trans	-64.7	-42.5	173.8	170.6	0	0	0	0	110.7	K512 E513 F518 K519 E520	K512-V516 WeakPolarHBondContact O-CG2 3.49Å; K512-V516 PolarHBondContact O-N 2.96Å; E513-V516 PolarHBondContact O-N 3.43Å; V516-F518 VanDerWaalsContact C-N 3.33Å; V516-F518 PolarHBondContact O-N 2.74Å; V516-K519 PolarHBondContact O-N 3.17Å; V516-E520 WeakPolarHBondContact O-CB 3.25Å; V516-E520 PolarHBondContact O-N 2.83Å
517	L	71.3	Confident	61.3	Low	110 Å²	110	106.6 Å²	106.6	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-61.2	-41.5	176.7	-170.4	71.3	0	0	0	111.6	E513 D514 E520 C521	E513-L517 WeakPolarHBondContact O-CB 3.49Å; E513-L517 PolarHBondContact O-N 3.47Å; D514-L517 PolarHBondContact O-N 3.02Å; L517-E520 PolarHBondContact O-N 3.09Å; L517-C521 WeakPolarHBondContact O-CB 3.45Å; L517-C521 PolarHBondContact O-N 2.91Å; L517-C521 PolarHBondContact O-SG 2.82Å
518	F	67.3	Low	61.5	Low	138 Å²	138	105 Å²	105	61%	0.605	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-46.9	175.8	-177.9	-97.6	0	0	0	112.1	D514 E515 V516 E520 C521 Q522	D514-F518 WeakPolarHBondContact O-CB 3.49Å; D514-F518 PolarHBondContact O-N 2.95Å; E515-F518 PolarHBondContact O-N 2.89Å; V516-F518 VanDerWaalsContact C-N 3.33Å; V516-F518 PolarHBondContact O-N 2.74Å; F518-E520 PolarHBondContact O-N 3.45Å; F518-C521 PolarHBondContact O-N 3.37Å; F518-Q522 PolarHBondContact O-N 3.09Å
519	K	73.2	Confident	61.3	Low	117 Å²	117	106 Å²	106	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-61.2	-41.9	177.3	-76.4	168	168.9	171.2	0	112.3	E515 V516 Q522 R523	E515-K519 WeakPolarHBondContact O-CG 3.23Å; E515-K519 PolarHBondContact O-N 3.44Å; E515-K519 VanDerWaalsContact O-N 3.07Å; E515-K519 VanDerWaalsContact OE1-CE 3.3Å; E515-K519 WeakPolarHBondContact OE1-CE 3.22Å; E515-K519 IonicContact OE1-NZ 2.72Å; E515-K519 PolarHBondContact OE1-NZ 2.94Å; V516-K519 PolarHBondContact O-N 3.17Å; K519-Q522 PolarHBondContact O-N 2.85Å; K519-R523 PolarHBondContact O-N 3.14Å
520	E	73.8	Confident	60.6	Low	56 Å²	56	104.6 Å²	104.6	26%	0.262	53%	0.53	S	S	.	.	H	α-helix	trans	-69.4	-37	177	174.8	57.8	-172.7	0	0	112.8	V516 L517 F518 R523 K524	V516-E520 WeakPolarHBondContact O-CB 3.25Å; V516-E520 PolarHBondContact O-N 2.83Å; L517-E520 PolarHBondContact O-N 3.09Å; F518-E520 PolarHBondContact O-N 3.45Å; E520-R523 VanDerWaalsContact CD-NH2 3.28Å; E520-R523 PolarHBondContact O-N 3.38Å; E520-R523 IonicContact OE1-CZ 3.99Å; E520-R523 IonicContact OE1-NH2 2.72Å; E520-R523 PolarHBondContact OE1-NH2 3.27Å; E520-R523 IonicContact OE2-CZ 2.6Å; E520-R523 VanDerWaalsContact OE2-CZ 3.24Å; E520-R523 IonicContact OE2-NE 3.24Å; E520-R523 PolarHBondContact OE2-NE 3.06Å; E520-R523 IonicContact OE2-NH2 3.84Å; E520-R523 PolarHBondContact OE2-NH2 2.9Å; E520-K524 HydrophobicContact CG-CD 4.39Å; E520-K524 WeakPolarHBondContact O-CG 3.32Å; E520-K524 PolarHBondContact O-N 2.89Å; E520-K524 WeakPolarHBondContact OE1-CE 3.36Å; E520-K524 IonicContact OE1-NZ 2.92Å; E520-K524 PolarHBondContact OE1-NZ 2.9Å
521	C	63.7	Low	60.2	Low	73 Å²	73	106.6 Å²	106.6	49%	0.493	54%	0.537	S	S	.	.	H	α-helix	trans	-62.2	-42.9	170.9	-75.8	0	0	0	0	111.7	L517 F518 K524 A525	L517-C521 WeakPolarHBondContact O-CB 3.45Å; L517-C521 PolarHBondContact O-N 2.91Å; L517-C521 PolarHBondContact O-SG 2.82Å; F518-C521 PolarHBondContact O-N 3.37Å; C521-K524 PolarHBondContact O-N 3.16Å; C521-A525 PolarHBondContact O-N 3.49Å
522	Q	66.5	Low	58.5	Low	114 Å²	114	107.9 Å²	107.9	53%	0.533	55%	0.548	S	S	.	.	H	α-helix	trans	-62.6	-45.6	176.1	-169.8	176.8	50.7	0	0	111.3	F518 K519 K524 A525 S526	F518-Q522 PolarHBondContact O-N 3.09Å; K519-Q522 PolarHBondContact O-N 2.85Å; Q522-K524 PolarHBondContact O-N 3.14Å; Q522-A525 PolarHBondContact O-N 2.88Å; Q522-S526 PolarHBondContact O-N 3.08Å; Q522-S526 PolarHBondContact O-OG 2.72Å
523	R	64.2	Low	56.9	Low	149 Å²	149	107.5 Å²	107.5	56%	0.562	55%	0.546	S	S	*	.	H	α-helix	trans	-58.7	-44.6	176.7	-167.9	-175.4	68.6	91.1	3.3	112.4	K519 E520 S526 H527	K519-R523 PolarHBondContact O-N 3.14Å; E520-R523 VanDerWaalsContact CD-NH2 3.28Å; E520-R523 PolarHBondContact O-N 3.38Å; E520-R523 IonicContact OE1-CZ 3.99Å; E520-R523 IonicContact OE1-NH2 2.72Å; E520-R523 PolarHBondContact OE1-NH2 3.27Å; E520-R523 IonicContact OE2-CZ 2.6Å; E520-R523 VanDerWaalsContact OE2-CZ 3.24Å; E520-R523 IonicContact OE2-NE 3.24Å; E520-R523 PolarHBondContact OE2-NE 3.06Å; E520-R523 IonicContact OE2-NH2 3.84Å; E520-R523 PolarHBondContact OE2-NH2 2.9Å; R523-S526 PolarHBondContact O-N 3.05Å; R523-H527 PolarHBondContact O-N 2.85Å
524	K	62.9	Low	55.3	Low	119 Å²	119	107.3 Å²	107.3	52%	0.517	55%	0.549	S	S	.	.	H	α-helix	trans	-62.7	-42	175.4	-79.7	168.1	164	131	0	112.4	E520 C521 Q522 H527 N528	E520-K524 HydrophobicContact CG-CD 4.39Å; E520-K524 WeakPolarHBondContact O-CG 3.32Å; E520-K524 PolarHBondContact O-N 2.89Å; E520-K524 WeakPolarHBondContact OE1-CE 3.36Å; E520-K524 IonicContact OE1-NZ 2.92Å; E520-K524 PolarHBondContact OE1-NZ 2.9Å; C521-K524 PolarHBondContact O-N 3.16Å; Q522-K524 PolarHBondContact O-N 3.14Å; K524-H527 PolarHBondContact O-N 2.93Å; K524-N528 PolarHBondContact O-N 3.22Å
525	A	49.8	Very low	53.9	Low	61 Å²	61	109.7 Å²	109.7	50%	0.504	56%	0.561	S	S	.	*	H	α-helix	trans	-63	-43.1	174.3	0	0	0	0	0	112	C521 Q522 H527 N528 F529	C521-A525 PolarHBondContact O-N 3.49Å; Q522-A525 PolarHBondContact O-N 2.88Å; A525-H527 PolarHBondContact O-N 3.39Å; A525-N528 PolarHBondContact O-N 2.96Å; A525-F529 WeakPolarHBondContact O-CB 3.43Å; A525-F529 PolarHBondContact O-N 2.94Å
526	S	49.9	Very low	52.6	Low	66 Å²	66	108.1 Å²	108.1	46%	0.462	56%	0.558	S	S	.	*	H	α-helix	trans	-63.9	-37	177	-64	0	0	0	0	113.5	Q522 R523 F529 S530	Q522-S526 PolarHBondContact O-N 3.08Å; Q522-S526 PolarHBondContact O-OG 2.72Å; R523-S526 PolarHBondContact O-N 3.05Å; S526-F529 PolarHBondContact O-N 2.92Å; S526-S530 PolarHBondContact O-N 3.17Å; S526-S530 PolarHBondContact O-OG 2.99Å
527	H	46.6	Very low	51.3	Low	126 Å²	126	111 Å²	111	58%	0.583	56%	0.562	S	S	*	*	H	α-helix	trans	-64.7	-47.5	175.4	-167.2	-87.9	0	0	0	111.4	R523 K524 A525 F529 S530	R523-H527 PolarHBondContact O-N 2.85Å; K524-H527 PolarHBondContact O-N 2.93Å; A525-H527 PolarHBondContact O-N 3.39Å; H527-F529 PolarHBondContact O-N 2.83Å; H527-S530 WeakPolarHBondContact O-CB 3.36Å; H527-S530 PolarHBondContact O-N 2.81Å; H527-S530 VanDerWaalsContact O-N 3.08Å
528	N	44.4	Very low	50.3	Low	118 Å²	118	108 Å²	108	63%	0.631	55%	0.547	S	S	*	.	H	α-helix	trans	-65.6	-27.9	176.2	-69.3	0	0	0	0	112.6	K524 A525	K524-N528 PolarHBondContact O-N 3.22Å; A525-N528 PolarHBondContact O-N 2.96Å
529	F	39.1	Very low	50.1	Low	154 Å²	154	105.5 Å²	105.5	68%	0.675	54%	0.544	S	S	*	.	H	α-helix	trans	-76.7	-22.7	173.5	-165	-99.2	0	0	0	113.4	A525 S526 H527 L531 C532	A525-F529 WeakPolarHBondContact O-CB 3.43Å; A525-F529 PolarHBondContact O-N 2.94Å; S526-F529 PolarHBondContact O-N 2.92Å; H527-F529 PolarHBondContact O-N 2.83Å; F529-L531 PolarHBondContact O-N 2.87Å; F529-C532 WeakPolarHBondContact O-CB 3.44Å; F529-C532 PolarHBondContact O-N 3.14Å
530	S	35.3	Very low	50.3	Low	73 Å²	73	102.1 Å²	102.1	51%	0.51	53%	0.529	S	S	.	.	H	α-helix	trans	-73.4	-23.2	-177.5	-69.4	0	0	0	0	114.2	S526 H527 C532 K533	S526-S530 PolarHBondContact O-N 3.17Å; S526-S530 PolarHBondContact O-OG 2.99Å; H527-S530 WeakPolarHBondContact O-CB 3.36Å; H527-S530 PolarHBondContact O-N 2.81Å; H527-S530 VanDerWaalsContact O-N 3.08Å; S530-C532 PolarHBondContact O-N 2.79Å; S530-K533 PolarHBondContact O-N 3.5Å
531	L	40.4	Very low	50.7	Low	131 Å²	131	99.6 Å²	99.6	69%	0.686	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.8	170.7	-69.3	172.3	0	0	0	113.1	F529 K533	F529-L531 PolarHBondContact O-N 2.87Å; L531-K533 VanDerWaalsContact C-N 3.32Å; L531-K533 PolarHBondContact O-N 3.19Å
532	C	36	Very low	51.7	Low	87 Å²	87	102.5 Å²	102.5	59%	0.588	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	9.4	178.1	-65.7	0	0	0	0	114.4	F529 S530	F529-C532 WeakPolarHBondContact O-CB 3.44Å; F529-C532 PolarHBondContact O-N 3.14Å; S530-C532 PolarHBondContact O-N 2.79Å
533	K	35.6	Very low	53	Low	172 Å²	172	97.2 Å²	97.2	75%	0.748	49%	0.494	S	S	*	.			trans	-87.2	3.8	-174.2	-99.9	-172.7	174.6	-175.6	0	116.9	S530 L531 D535	S530-K533 PolarHBondContact O-N 3.5Å; L531-K533 VanDerWaalsContact C-N 3.32Å; L531-K533 PolarHBondContact O-N 3.19Å; K533-D535 VanDerWaalsContact C-N 3.34Å; K533-D535 PolarHBondContact O-N 2.91Å
534	L	34.8	Very low	54.5	Low	125 Å²	125	90.1 Å²	90.1	65%	0.654	47%	0.467	S	S	*	.			trans	-72.7	91.9	161.2	-75	174.1	0	0	0	108.6	V536	L534-V536 PolarHBondContact O-N 3.26Å
535	D	35.6	Very low	56	Low	117 Å²	117	85.2 Å²	85.2	63%	0.626	45%	0.447	S	S	*	.			trans	-72.9	45.5	-178.5	-168.5	25.2	0	0	0	112.9	K533 K537	K533-D535 VanDerWaalsContact C-N 3.34Å; K533-D535 PolarHBondContact O-N 2.91Å; D535-K537 PolarHBondContact O-N 3.01Å; D535-K537 WeakPolarHBondContact OD1-CE 3.36Å; D535-K537 IonicContact OD1-NZ 2.83Å; D535-K537 PolarHBondContact OD1-NZ 2.86Å; D535-K537 WeakPolarHBondContact OD2-CE 3.35Å; D535-K537 IonicContact OD2-NZ 2.66Å; D535-K537 PolarHBondContact OD2-NZ 3.48Å
536	V	39.1	Very low	58.2	Low	66 Å²	66	82.6 Å²	82.6	40%	0.4	43%	0.425	S	S	.	.			trans	-74	93.3	168.7	-175.9	0	0	0	0	107.3	L223 L534 L538	L223-V536 HydrophobicContact CD1-CG2 4.49Å; L223-V536 HydrophobicContact CD2-CG2 4.1Å; L534-V536 PolarHBondContact O-N 3.26Å; V536-L538 VanDerWaalsContact C-N 3.3Å; V536-L538 HydrophobicContact CG1-CD2 4.36Å; V536-L538 PolarHBondContact O-N 2.86Å
537	K	47.2	Very low	60.1	Low	158 Å²	158	80.8 Å²	80.8	69%	0.687	42%	0.416	S	S	*	.			trans	-67	88.3	173.9	-71.2	170.4	-178	117.6	0	109.4	D535	D535-K537 PolarHBondContact O-N 3.01Å; D535-K537 WeakPolarHBondContact OD1-CE 3.36Å; D535-K537 IonicContact OD1-NZ 2.83Å; D535-K537 PolarHBondContact OD1-NZ 2.86Å; D535-K537 WeakPolarHBondContact OD2-CE 3.35Å; D535-K537 IonicContact OD2-NZ 2.66Å; D535-K537 PolarHBondContact OD2-NZ 3.48Å
538	L	50.6	Low	62.2	Low	49 Å²	49	82.3 Å²	82.3	26%	0.257	42%	0.421	S	S	.	.			trans	-52.7	136.1	174.8	-64.2	174.8	0	0	0	109.7	V536 Y540 R542	V536-L538 VanDerWaalsContact C-N 3.3Å; V536-L538 HydrophobicContact CG1-CD2 4.36Å; V536-L538 PolarHBondContact O-N 2.86Å; L538-Y540 HydrophobicContact CB-CE1 4.4Å; L538-Y540 HydrophobicContact CD1-CE2 4.43Å; L538-Y540 PolarHBondContact O-N 2.89Å; L538-R542 HydrophobicContact CD1-CG 4.03Å
539	P	63.9	Low	64.7	Low	84 Å²	84	80.7 Å²	80.7	55%	0.545	41%	0.406	S	S	.	.	S	Bend	trans	-78.7	19.8	-175.8	30.7	-33.2	0	0	0	113.9
540	Y	77.2	Confident	67.3	Low	47 Å²	47	77.2 Å²	77.2	18%	0.184	40%	0.397	C	S	.	.	S	Bend	trans	-153.9	154.9	-177.5	53.2	-89.9	0	0	0	110.1	L538 A564	L538-Y540 HydrophobicContact CB-CE1 4.4Å; L538-Y540 HydrophobicContact CD1-CE2 4.43Å; L538-Y540 PolarHBondContact O-N 2.89Å; Y540-A564 CarbonylContact C-O 3.46Å; Y540-A564 VanDerWaalsContact CA-O 3.23Å; Y540-A564 WeakPolarHBondContact CA-O 3.45Å; Y540-A564 PolarHBondContact N-O 3.46Å
541	P	81.9	Confident	70.1	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.013	38%	0.375	C	S	.	.			trans	-66.5	143.1	-177.9	28.2	-36	0	0	0	111	S553 A564 L566 L569	P541-S553 WeakPolarHBondContact O-CB 3.25Å; P541-S553 PolarHBondContact O-OG 3.28Å; P541-A564 VanDerWaalsContact N-O 3.12Å; P541-L566 WeakPolarHBondContact CA-O 3.37Å; P541-L566 WeakPolarHBondContact CB-O 3.43Å; P541-L569 HydrophobicContact CB-CB 4.04Å; P541-L569 HydrophobicContact CG-CB 4.09Å; P541-L569 HydrophobicContact CG-CD2 4.29Å
542	R	85.8	Confident	72.6	Confident	134 Å²	134	73.5 Å²	73.5	51%	0.506	37%	0.372	S	S	.	.	S	Bend	trans	-68.4	-37.4	-179.5	-77.6	-175.9	169.9	-174.4	-1.1	112.7	L538 S553	L538-R542 HydrophobicContact CD1-CG 4.03Å; R542-S553 PolarHBondContact O-N 3.36Å
543	A	92.4	Very high	75.2	Confident	4 Å²	4	70.3 Å²	70.3	3%	0.033	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.7	177.7	0	0	0	0	0	112.7	V550 I551 N567 K568 L569	A543-V550 HydrophobicContact CB-CG1 4.03Å; A543-I551 CarbonylContact C-O 3.52Å; A543-I551 WeakPolarHBondContact CA-O 3.08Å; A543-I551 WeakPolarHBondContact CB-O 3.42Å; A543-N567 PolarHBondContact N-O 3.47Å; A543-K568 HydrophobicContact CB-CG 4.48Å; A543-K568 VanDerWaalsContact O-CA 3.3Å; A543-K568 WeakPolarHBondContact O-CA 3.44Å; A543-L569 PolarHBondContact O-N 2.81Å
544	I	95	Very high	77.8	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	135.5	173.2	-64.5	-173	0	0	0	109.3	I546 V550 I551 L569 V571 L630 V633	I544-I546 HydrophobicContact CG2-CB 4.42Å; I544-V550 CarbonylContact O-C 3.47Å; I544-V550 WeakPolarHBondContact O-CA 3.29Å; I544-I551 PolarHBondContact N-O 3.35Å; I544-I551 PolarHBondContact O-N 3.01Å; I544-L569 CarbonylContact C-O 3.5Å; I544-L569 WeakPolarHBondContact CA-O 3.49Å; I544-L569 HydrophobicContact CG1-CB 4.36Å; I544-V571 HydrophobicContact CG2-CB 4.28Å; I544-V571 HydrophobicContact CG2-CG2 3.77Å; I544-L630 HydrophobicContact CD1-CD1 3.8Å; I544-L630 HydrophobicContact CG2-CD1 4.16Å; I544-V633 HydrophobicContact CD1-CB 4.23Å; I544-V633 HydrophobicContact CD1-CG1 3.96Å; I544-V633 HydrophobicContact CD1-CG2 3.72Å
545	V	95.9	Very high	80.3	Confident	16 Å²	16	64.9 Å²	64.9	10%	0.097	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113.9	172.3	-172.8	0	0	0	0	108	W549 V550 K568 L569 Y570 V571	V545-W549 CarbonylContact C-O 3.44Å; V545-W549 WeakPolarHBondContact CA-O 3.47Å; V545-V550 HydrophobicContact CG1-CG2 4.49Å; V545-V550 HydrophobicContact CG2-CG1 4.44Å; V545-V550 HydrophobicContact CG2-CG2 4.24Å; V545-K568 HydrophobicContact CG2-CB 4.21Å; V545-K568 HydrophobicContact CG2-CD 4.07Å; V545-L569 PolarHBondContact N-O 2.86Å; V545-Y570 HydrophobicContact CB-CD1 3.69Å; V545-Y570 HydrophobicContact CB-CE1 3.93Å; V545-Y570 HydrophobicContact CB-CG 4.35Å; V545-Y570 HydrophobicContact CG1-CD1 3.89Å; V545-Y570 HydrophobicContact CG1-CE1 3.98Å; V545-Y570 HydrophobicContact CG2-CD1 4Å; V545-Y570 HydrophobicContact CG2-CE1 3.78Å; V545-V571 PolarHBondContact O-N 2.85Å
546	I	94.9	Very high	82.7	Confident	6 Å²	6	61.9 Å²	61.9	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	117.2	-179.9	-172.8	170.2	0	0	0	109.8	I544 K548 W549 I551 V571 E573 L576 L630	I544-I546 HydrophobicContact CG2-CB 4.42Å; I546-K548 PolarHBondContact O-N 3.35Å; I546-W549 HydrophobicContact CG2-CB 4.41Å; I546-W549 PolarHBondContact N-O 3.45Å; I546-W549 WeakPolarHBondContact O-CB 3.38Å; I546-W549 PolarHBondContact O-N 3.13Å; I546-I551 HydrophobicContact CG2-CD1 3.66Å; I546-V571 HydrophobicContact CB-CB 4.36Å; I546-V571 HydrophobicContact CD1-CG1 4.04Å; I546-V571 HydrophobicContact CG1-CB 4.44Å; I546-V571 HydrophobicContact CG1-CG1 4.34Å; I546-E573 HydrophobicContact CG1-CB 3.88Å; I546-L576 HydrophobicContact CD1-CD2 4.24Å; I546-L630 HydrophobicContact CD1-CD2 3.83Å
547	G	91.5	Very high	85	Confident	27 Å²	27	58.8 Å²	58.8	28%	0.278	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	-125.7	-168.9	0	0	0	0	0	111.9	W549 E573	G547-W549 VanDerWaalsContact C-N 3.32Å; G547-W549 PolarHBondContact O-N 3.24Å; G547-E573 WeakPolarHBondContact CA-OE1 3.42Å; G547-E573 WeakPolarHBondContact CA-OE2 3.38Å
548	K	90.5	Very high	87	Confident	158 Å²	158	53.4 Å²	53.4	69%	0.687	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-3.8	176	65.5	-164.8	170.4	-157	0	115.3	I546	I546-K548 PolarHBondContact O-N 3.35Å
549	W	95.2	Very high	88.9	Confident	85 Å²	85	51.7 Å²	51.7	32%	0.322	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	141.7	-174.2	-58	112.7	0	0	0	112.7	V545 I546 G547 I551 P686 Y687	V545-W549 CarbonylContact C-O 3.44Å; V545-W549 WeakPolarHBondContact CA-O 3.47Å; I546-W549 HydrophobicContact CG2-CB 4.41Å; I546-W549 PolarHBondContact N-O 3.45Å; I546-W549 WeakPolarHBondContact O-CB 3.38Å; I546-W549 PolarHBondContact O-N 3.13Å; G547-W549 VanDerWaalsContact C-N 3.32Å; G547-W549 PolarHBondContact O-N 3.24Å; W549-I551 HydrophobicContact CB-CD1 4.12Å; W549-I551 HydrophobicContact CB-CG1 3.87Å; W549-P686 HydrophobicContact CB-CG 4.33Å; W549-P686 HydrophobicContact CD2-CB 3.59Å; W549-P686 HydrophobicContact CD2-CG 3.81Å; W549-P686 HydrophobicContact CE3-CB 3.74Å; W549-P686 HydrophobicContact CE3-CG 4.36Å; W549-P686 HydrophobicContact CG-CB 4.12Å; W549-P686 HydrophobicContact CG-CG 3.78Å; W549-P686 HydrophobicContact CH2-CB 4.12Å; W549-P686 HydrophobicContact CZ2-CB 3.96Å; W549-P686 HydrophobicContact CZ3-CB 4Å; W549-Y687 AromaticContact NE1-CE2 3.6Å; W549-Y687 AromaticContact NE1-CZ 3.54Å; W549-Y687 PolarHBondContact NE1-OH 3.41Å
550	V	94.7	Very high	90	Very high	81 Å²	81	49.6 Å²	49.6	49%	0.491	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.1	159.1	-174.2	0	0	0	0	106.1	A543 I544 V545	A543-V550 HydrophobicContact CB-CG1 4.03Å; I544-V550 CarbonylContact O-C 3.47Å; I544-V550 WeakPolarHBondContact O-CA 3.29Å; V545-V550 HydrophobicContact CG1-CG2 4.49Å; V545-V550 HydrophobicContact CG2-CG1 4.44Å; V545-V550 HydrophobicContact CG2-CG2 4.24Å
551	I	94	Very high	90.3	Very high	9 Å²	9	52.3 Å²	52.3	5%	0.046	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.8	-170.1	-48.2	174	0	0	0	108.6	A543 I544 I546 W549 Y634 P685 P686	A543-I551 CarbonylContact C-O 3.52Å; A543-I551 WeakPolarHBondContact CA-O 3.08Å; A543-I551 WeakPolarHBondContact CB-O 3.42Å; I544-I551 PolarHBondContact N-O 3.35Å; I544-I551 PolarHBondContact O-N 3.01Å; I546-I551 HydrophobicContact CG2-CD1 3.66Å; W549-I551 HydrophobicContact CB-CD1 4.12Å; W549-I551 HydrophobicContact CB-CG1 3.87Å; I551-Y634 HydrophobicContact CG2-CE1 3.74Å; I551-Y634 WeakPolarHBondContact CG2-OH 3.28Å; I551-P685 HydrophobicContact CG2-CB 3.84Å; I551-P685 HydrophobicContact CG2-CG 3.71Å; I551-P686 HydrophobicContact CD1-CG 3.83Å; I551-P686 HydrophobicContact CG1-CG 4.27Å
552	D	92.7	Very high	90.4	Very high	117 Å²	117	56.6 Å²	56.6	63%	0.626	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	140.3	176.6	-58.6	-50	0	0	0	111.1
553	S	91.1	Very high	90.6	Very high	19 Å²	19	52.3 Å²	52.3	13%	0.133	27%	0.265	C	S	.	.			trans	-86.3	132.1	-174.4	-64.7	0	0	0	0	111.4	P541 R542 V633	P541-S553 WeakPolarHBondContact O-CB 3.25Å; P541-S553 PolarHBondContact O-OG 3.28Å; R542-S553 PolarHBondContact O-N 3.36Å; S553-V633 WeakPolarHBondContact OG-CG1 3.42Å
554	W	89.4	Confident	90.1	Very high	115 Å²	115	52.3 Å²	52.3	44%	0.436	27%	0.265	S	S	.	.			trans	-94.7	-39.7	-172.3	-58.7	-7.7	0	0	0	112.8	V633 Y634 P685	W554-V633 WeakPolarHBondContact CB-O 3.36Å; W554-V633 PolarHBondContact N-O 3.47Å; W554-Y634 AromaticContact CD2-CD1 3.96Å; W554-Y634 HydrophobicContact CD2-CD1 3.96Å; W554-Y634 HydrophobicContact CE3-CD1 4.28Å; W554-Y634 HydrophobicContact CG-CD1 4.13Å; W554-P685 HydrophobicContact CH2-CG 4.13Å; W554-P685 HydrophobicContact CZ2-CB 3.96Å; W554-P685 HydrophobicContact CZ2-CG 3.64Å
555	F	88.3	Confident	89.4	Confident	68 Å²	68	60.7 Å²	60.7	30%	0.298	30%	0.297	S	S	.	.	S	Bend	trans	-130.5	154.7	-177	-54	-76.3	0	0	0	111	A557 V633 D636	F555-A557 PolarHBondContact O-N 3.04Å; F555-V633 PolarHBondContact N-O 2.86Å; F555-D636 HydrophobicContact CD1-CB 3.8Å; F555-D636 HydrophobicContact CD2-CB 4.45Å; F555-D636 HydrophobicContact CE1-CB 3.58Å; F555-D636 HydrophobicContact CE2-CB 4.26Å; F555-D636 HydrophobicContact CG-CB 4.24Å; F555-D636 HydrophobicContact CZ-CB 3.83Å
556	S	86	Confident	88.9	Confident	54 Å²	54	62 Å²	62	38%	0.378	30%	0.303	S	S	.	.			trans	-62.7	135.4	171.3	-164.1	0	0	0	0	110.8	K632	S556-K632 PolarHBondContact O-NZ 2.92Å
557	A	87.2	Confident	88.5	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.017	33%	0.332	C	S	.	.			trans	-126.9	139.3	173.7	0	0	0	0	0	109.8	F555 Y559 K632 V633	F555-A557 PolarHBondContact O-N 3.04Å; A557-Y559 HydrophobicContact CB-CD2 4.02Å; A557-Y559 HydrophobicContact CB-CE2 3.99Å; A557-Y559 PolarHBondContact O-N 3.26Å; A557-K632 HydrophobicContact CB-CB 3.91Å; A557-K632 HydrophobicContact CB-CG 3.79Å; A557-V633 HydrophobicContact CB-CG2 3.53Å
558	P	88.1	Confident	88.5	Confident	45 Å²	45	70.8 Å²	70.8	29%	0.292	34%	0.339	S	S	.	.			trans	-80.7	59.1	-173.6	33.4	-34.3	0	0	0	111.8	L629 Y641 Y642	P558-L629 HydrophobicContact CG-CD2 4.01Å; P558-L629 WeakPolarHBondContact O-CD2 3.48Å; P558-Y641 HydrophobicContact CB-CE2 4.12Å; P558-Y641 HydrophobicContact CG-CD1 4.23Å; P558-Y641 HydrophobicContact CG-CD2 3.82Å; P558-Y641 HydrophobicContact CG-CE1 3.8Å; P558-Y641 HydrophobicContact CG-CE2 3.32Å; P558-Y641 HydrophobicContact CG-CG 4.26Å; P558-Y642 PolarHBondContact O-OH 3.36Å
559	Y	90.3	Very high	88.7	Confident	12 Å²	12	63.2 Å²	63.2	5%	0.047	31%	0.306	C	S	.	.			trans	-65.8	151.2	161.2	-72.1	-75.1	0	0	0	109.7	A557 L569 Y578 L629 L630 V633	A557-Y559 HydrophobicContact CB-CD2 4.02Å; A557-Y559 HydrophobicContact CB-CE2 3.99Å; A557-Y559 PolarHBondContact O-N 3.26Å; Y559-L569 HydrophobicContact CD1-CD2 3.94Å; Y559-L569 HydrophobicContact CD2-CD2 3.89Å; Y559-L569 HydrophobicContact CE1-CD2 3.72Å; Y559-L569 HydrophobicContact CE2-CD2 3.65Å; Y559-L569 HydrophobicContact CG-CD2 4.02Å; Y559-Y578 AromaticContact CD1-CD1 4Å; Y559-Y578 HydrophobicContact CD1-CD1 4Å; Y559-Y578 HydrophobicContact CD1-CD2 4.13Å; Y559-Y578 HydrophobicContact CD1-CE1 4.19Å; Y559-Y578 HydrophobicContact CD1-CE2 4.33Å; Y559-Y578 AromaticContact CD1-CG 3.97Å; Y559-Y578 HydrophobicContact CD1-CG 3.97Å; Y559-Y578 AromaticContact CE1-CD1 3.7Å; Y559-Y578 HydrophobicContact CE1-CD1 3.7Å; Y559-Y578 HydrophobicContact CE1-CD2 4.48Å; Y559-Y578 HydrophobicContact CE1-CE1 4.21Å; Y559-Y578 AromaticContact CE1-CG 3.85Å; Y559-Y578 HydrophobicContact CE1-CG 3.85Å; Y559-L629 HydrophobicContact CD1-CB 4.35Å; Y559-L629 HydrophobicContact CD1-CD1 4.13Å; Y559-L629 HydrophobicContact CE1-CB 3.71Å; Y559-L629 HydrophobicContact CE1-CD1 4.1Å; Y559-L629 HydrophobicContact CE1-CG 4.45Å; Y559-L630 WeakPolarHBondContact OH-CA 3.41Å; Y559-L630 PolarHBondContact OH-N 3.02Å; Y559-V633 HydrophobicContact CE2-CG2 3.84Å
560	P	88.8	Confident	88.7	Confident	40 Å²	40	61.5 Å²	61.5	26%	0.26	30%	0.3	S	S	.	.			trans	-55.5	146.8	174.9	-22.3	32.5	0	0	0	111.6	E562 Y563 A564 Y578	P560-E562 VanDerWaalsContact CB-OE2 3.25Å; P560-E562 WeakPolarHBondContact CB-OE2 3.2Å; P560-E562 PolarHBondContact O-N 3.26Å; P560-Y563 HydrophobicContact CB-CD2 4Å; P560-Y563 HydrophobicContact CB-CE2 4.47Å; P560-Y563 HydrophobicContact CG-CD2 4.23Å; P560-Y563 WeakPolarHBondContact O-CA 3.29Å; P560-Y563 WeakPolarHBondContact O-CB 3.42Å; P560-Y563 PolarHBondContact O-N 3.17Å; P560-A564 PolarHBondContact O-N 3.29Å; P560-Y578 HydrophobicContact CG-CE2 4.33Å
561	Q	82.2	Confident	88.8	Confident	104 Å²	104	57.7 Å²	57.7	49%	0.486	28%	0.277	S	S	.	.	H	α-helix	trans	-56.8	-28.5	-164.5	-179.9	66.7	-86.4	0	0	113.9	Y563 R565	Q561-Y563 VanDerWaalsContact C-N 3.3Å; Q561-R565 VanDerWaalsContact CD-NE 3.26Å; Q561-R565 WeakPolarHBondContact O-CG 3.24Å
562	E	85.1	Confident	88.9	Confident	93 Å²	93	57.4 Å²	57.4	44%	0.435	28%	0.275	S	S	.	.	H	α-helix	trans	-81.7	-3.9	177.6	77.7	-71.7	-178	0	0	114.6	P560	P560-E562 VanDerWaalsContact CB-OE2 3.25Å; P560-E562 WeakPolarHBondContact CB-OE2 3.2Å; P560-E562 PolarHBondContact O-N 3.26Å
563	Y	88.9	Confident	88.9	Confident	44 Å²	44	54 Å²	54	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-108.1	-35.7	165.5	-61.2	-87.3	0	0	0	111.7	P560 Q561 R565 L566 L569 Y578 K580	P560-Y563 HydrophobicContact CB-CD2 4Å; P560-Y563 HydrophobicContact CB-CE2 4.47Å; P560-Y563 HydrophobicContact CG-CD2 4.23Å; P560-Y563 WeakPolarHBondContact O-CA 3.29Å; P560-Y563 WeakPolarHBondContact O-CB 3.42Å; P560-Y563 PolarHBondContact O-N 3.17Å; Q561-Y563 VanDerWaalsContact C-N 3.3Å; Y563-R565 PolarHBondContact O-N 3.18Å; Y563-R565 VanDerWaalsContact O-N 3.17Å; Y563-L566 HydrophobicContact CD1-CD1 4.21Å; Y563-L566 WeakPolarHBondContact O-CB 3.15Å; Y563-L566 WeakPolarHBondContact O-CG 3.12Å; Y563-L566 PolarHBondContact O-N 2.78Å; Y563-L566 VanDerWaalsContact O-N 3.12Å; Y563-L569 HydrophobicContact CD1-CD1 3.68Å; Y563-L569 HydrophobicContact CG-CD1 4.2Å; Y563-Y578 AromaticContact CD1-CD2 3.76Å; Y563-Y578 HydrophobicContact CD1-CD2 3.76Å; Y563-Y578 HydrophobicContact CD1-CE2 4.34Å; Y563-Y578 HydrophobicContact CD2-CD2 4.02Å; Y563-Y578 AromaticContact CD2-CE2 3.76Å; Y563-Y578 HydrophobicContact CD2-CE2 3.76Å; Y563-Y578 AromaticContact CE1-CD2 3.78Å; Y563-Y578 HydrophobicContact CE1-CD2 3.78Å; Y563-Y578 HydrophobicContact CE1-CE2 4.25Å; Y563-Y578 HydrophobicContact CE2-CD2 4.06Å; Y563-Y578 AromaticContact CE2-CE2 3.68Å; Y563-Y578 HydrophobicContact CE2-CE2 3.68Å; Y563-Y578 AromaticContact CG-CD2 3.87Å; Y563-Y578 HydrophobicContact CG-CD2 3.87Å; Y563-Y578 HydrophobicContact CG-CE2 4.1Å; Y563-Y578 AromaticContact CZ-CD2 3.95Å; Y563-Y578 AromaticContact CZ-CE2 3.94Å; Y563-K580 HydrophobicContact CD1-CG 3.7Å; Y563-K580 HydrophobicContact CE1-CD 4.19Å; Y563-K580 HydrophobicContact CE1-CG 3.33Å
564	A	82.4	Confident	89.1	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	26%	0.255	C	S	.	.	H	α-helix	trans	-55.3	-32.9	179.6	0	0	0	0	0	113.2	Y540 P541 P560 L566	Y540-A564 CarbonylContact C-O 3.46Å; Y540-A564 VanDerWaalsContact CA-O 3.23Å; Y540-A564 WeakPolarHBondContact CA-O 3.45Å; Y540-A564 PolarHBondContact N-O 3.46Å; P541-A564 VanDerWaalsContact N-O 3.12Å; P560-A564 PolarHBondContact O-N 3.29Å; A564-L566 PolarHBondContact O-N 3.32Å
565	R	79.6	Confident	89.4	Confident	176 Å²	176	49.8 Å²	49.8	66%	0.664	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	4	-178.2	-62.7	171.8	-176.3	-174.5	-0.4	115	Q561 Y563	Q561-R565 VanDerWaalsContact CD-NE 3.26Å; Q561-R565 WeakPolarHBondContact O-CG 3.24Å; Y563-R565 PolarHBondContact O-N 3.18Å; Y563-R565 VanDerWaalsContact O-N 3.17Å
566	L	85.7	Confident	89.8	Confident	43 Å²	43	46.7 Å²	46.7	23%	0.225	23%	0.227	C	C	.	.			trans	-84.4	133.9	-174.2	-62.7	175.3	0	0	0	112.2	P541 Y563 A564 K568 L569 K580	P541-L566 WeakPolarHBondContact CA-O 3.37Å; P541-L566 WeakPolarHBondContact CB-O 3.43Å; Y563-L566 HydrophobicContact CD1-CD1 4.21Å; Y563-L566 WeakPolarHBondContact O-CB 3.15Å; Y563-L566 WeakPolarHBondContact O-CG 3.12Å; Y563-L566 PolarHBondContact O-N 2.78Å; Y563-L566 VanDerWaalsContact O-N 3.12Å; A564-L566 PolarHBondContact O-N 3.32Å; L566-K568 PolarHBondContact O-N 2.68Å; L566-L569 HydrophobicContact CD1-CD1 4.1Å; L566-K580 HydrophobicContact CD1-CB 4.13Å; L566-K580 HydrophobicContact CD1-CG 4.24Å
567	N	86.2	Confident	90.2	Very high	122 Å²	122	49.7 Å²	49.7	65%	0.652	23%	0.233	S	C	*	.	S	Bend	trans	-58.1	-31.2	171.7	-79.4	-34.3	0	0	0	112.9	A543	A543-N567 PolarHBondContact N-O 3.47Å
568	K	92.1	Very high	90.6	Very high	95 Å²	95	51.9 Å²	51.9	41%	0.413	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	127.9	173.1	-68.2	-171	176.4	-176.4	0	110.5	A543 V545 L566 Y570	A543-K568 HydrophobicContact CB-CG 4.48Å; A543-K568 VanDerWaalsContact O-CA 3.3Å; A543-K568 WeakPolarHBondContact O-CA 3.44Å; V545-K568 HydrophobicContact CG2-CB 4.21Å; V545-K568 HydrophobicContact CG2-CD 4.07Å; L566-K568 PolarHBondContact O-N 2.68Å; K568-Y570 HydrophobicContact CB-CE2 4.14Å
569	L	94.8	Very high	90.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.7	170.9	-174.8	64.3	0	0	0	109.5	P541 A543 I544 V545 Y559 Y563 L566 V571	P541-L569 HydrophobicContact CB-CB 4.04Å; P541-L569 HydrophobicContact CG-CB 4.09Å; P541-L569 HydrophobicContact CG-CD2 4.29Å; A543-L569 PolarHBondContact O-N 2.81Å; I544-L569 CarbonylContact C-O 3.5Å; I544-L569 WeakPolarHBondContact CA-O 3.49Å; I544-L569 HydrophobicContact CG1-CB 4.36Å; V545-L569 PolarHBondContact N-O 2.86Å; Y559-L569 HydrophobicContact CD1-CD2 3.94Å; Y559-L569 HydrophobicContact CD2-CD2 3.89Å; Y559-L569 HydrophobicContact CE1-CD2 3.72Å; Y559-L569 HydrophobicContact CE2-CD2 3.65Å; Y559-L569 HydrophobicContact CG-CD2 4.02Å; Y563-L569 HydrophobicContact CD1-CD1 3.68Å; Y563-L569 HydrophobicContact CG-CD1 4.2Å; L566-L569 HydrophobicContact CD1-CD1 4.1Å; L569-V571 HydrophobicContact CG-CG2 4.38Å
570	Y	95.6	Very high	91	Very high	48 Å²	48	54.2 Å²	54.2	19%	0.188	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.8	-179.7	-68.1	-94	0	0	0	110.2	V545 K568 Y578 M579 N582 L585	V545-Y570 HydrophobicContact CB-CD1 3.69Å; V545-Y570 HydrophobicContact CB-CE1 3.93Å; V545-Y570 HydrophobicContact CB-CG 4.35Å; V545-Y570 HydrophobicContact CG1-CD1 3.89Å; V545-Y570 HydrophobicContact CG1-CE1 3.98Å; V545-Y570 HydrophobicContact CG2-CD1 4Å; V545-Y570 HydrophobicContact CG2-CE1 3.78Å; K568-Y570 HydrophobicContact CB-CE2 4.14Å; Y570-Y578 CarbonylContact O-C 3.54Å; Y570-Y578 WeakPolarHBondContact O-CA 3.09Å; Y570-M579 PolarHBondContact N-O 3.05Å; Y570-M579 PolarHBondContact O-N 3.04Å; Y570-N582 HydrophobicContact CD1-CB 4.18Å; Y570-N582 HydrophobicContact CE1-CB 3.67Å; Y570-L585 HydrophobicContact CD1-CD2 4.04Å
571	V	96.2	Very high	91.2	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.6	-175.5	177.5	0	0	0	0	109.5	I544 V545 I546 L569 E573 L576	I544-V571 HydrophobicContact CG2-CB 4.28Å; I544-V571 HydrophobicContact CG2-CG2 3.77Å; V545-V571 PolarHBondContact O-N 2.85Å; I546-V571 HydrophobicContact CB-CB 4.36Å; I546-V571 HydrophobicContact CD1-CG1 4.04Å; I546-V571 HydrophobicContact CG1-CB 4.44Å; I546-V571 HydrophobicContact CG1-CG1 4.34Å; L569-V571 HydrophobicContact CG-CG2 4.38Å; V571-E573 PolarHBondContact O-N 3.2Å; V571-L576 HydrophobicContact CG1-CD2 4.49Å
572	C	95.8	Very high	91.6	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.02	24%	0.242	C	C	.	.			trans	-68.4	126.1	170.9	176.6	0	0	0	0	110	F574 C575 L576 K577 M579 L585 H588	C572-F574 VanDerWaalsContact C-N 3.26Å; C572-F574 PolarHBondContact O-N 3.11Å; C572-C575 VanDerWaalsContact SG-SG 3.62Å; C572-L576 WeakPolarHBondContact O-CA 3.31Å; C572-L576 PolarHBondContact O-N 3.47Å; C572-K577 PolarHBondContact N-O 2.9Å; C572-M579 HydrophobicContact CB-CE 3.95Å; C572-L585 HydrophobicContact CB-CD1 4.23Å; C572-H588 PolarHBondContact SG-NE2 3.12Å; C572-H588 VanDerWaalsContact SG-NE2 3.44Å
573	E	93.9	Very high	92	Very high	47 Å²	47	53 Å²	53	22%	0.22	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.6	-176.8	67.1	-158.8	118.1	0	0	114.9	I546 G547 V571 H661	I546-E573 HydrophobicContact CG1-CB 3.88Å; G547-E573 WeakPolarHBondContact CA-OE1 3.42Å; G547-E573 WeakPolarHBondContact CA-OE2 3.38Å; V571-E573 PolarHBondContact O-N 3.2Å; E573-H661 IonicContact OE2-CE1 3.5Å; E573-H661 PolarHBondContact OE2-CE1 3.23Å; E573-H661 IonicContact OE2-CG 2.62Å; E573-H661 IonicContact OE2-ND1 2.67Å; E573-H661 PolarHBondContact OE2-ND1 3.48Å
574	F	94.8	Very high	92.2	Very high	24 Å²	24	53.3 Å²	53.3	11%	0.105	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-44.3	-179.2	-55.7	-59.6	0	0	0	114	C572 L596 F597 Y623 H661	C572-F574 VanDerWaalsContact C-N 3.26Å; C572-F574 PolarHBondContact O-N 3.11Å; F574-L596 HydrophobicContact CB-CB 4.3Å; F574-L596 VanDerWaalsContact CB-O 3.23Å; F574-L596 WeakPolarHBondContact CB-O 3.21Å; F574-F597 WeakPolarHBondContact CD1-O 3.41Å; F574-F597 HydrophobicContact CD2-CD1 4.49Å; F574-F597 HydrophobicContact CE2-CD1 4.24Å; F574-Y623 WeakPolarHBondContact O-CE2 3.23Å; F574-H661 AromaticContact CE1-CE1 3.99Å; F574-H661 AromaticContact CZ-CE1 3.72Å
575	C	95	Very high	92.7	Very high	21 Å²	21	53.8 Å²	53.8	14%	0.142	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-3	-179.9	77.3	0	0	0	0	114.5	C572 K577 H588 L596	C572-C575 VanDerWaalsContact SG-SG 3.62Å; C575-K577 PolarHBondContact O-N 3.1Å; C575-K577 VanDerWaalsContact SG-CB 3.6Å; C575-H588 VanDerWaalsContact SG-CE1 3.51Å; C575-H588 PolarHBondContact SG-NE2 2.74Å; C575-L596 HydrophobicContact CB-CD1 3.9Å
576	L	96.9	Very high	93.2	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	24%	0.242	C	C	.	.			trans	59.4	7	179.2	-51.5	179.1	0	0	0	115.8	I546 V571 C572 Y578 Y623 N626 L627 L630 L662	I546-L576 HydrophobicContact CD1-CD2 4.24Å; V571-L576 HydrophobicContact CG1-CD2 4.49Å; C572-L576 WeakPolarHBondContact O-CA 3.31Å; C572-L576 PolarHBondContact O-N 3.47Å; L576-Y578 PolarHBondContact O-N 3Å; L576-Y623 HydrophobicContact CB-CE2 4.46Å; L576-Y623 HydrophobicContact CD1-CD2 4.11Å; L576-Y623 HydrophobicContact CD1-CE1 4.12Å; L576-Y623 HydrophobicContact CD1-CE2 3.52Å; L576-Y623 HydrophobicContact CG-CD2 4.19Å; L576-Y623 HydrophobicContact CG-CE2 3.65Å; L576-N626 HydrophobicContact CB-CB 3.65Å; L576-N626 WeakPolarHBondContact O-CB 3.41Å; L576-L627 HydrophobicContact CD1-CB 3.7Å; L576-L627 HydrophobicContact CD1-CD1 3.7Å; L576-L627 HydrophobicContact CD1-CG 4.22Å; L576-L630 HydrophobicContact CD2-CD2 4.25Å; L576-L662 HydrophobicContact CD1-CD2 4.23Å; L576-L662 HydrophobicContact CD2-CD2 3.72Å
577	K	95.3	Very high	93.5	Very high	118 Å²	118	52.8 Å²	52.8	51%	0.513	26%	0.256	S	S	.	.			trans	-60.5	126	174.7	-174.6	159.7	-173.1	151.9	0	110.8	C572 C575 M579	C572-K577 PolarHBondContact N-O 2.9Å; C575-K577 PolarHBondContact O-N 3.1Å; C575-K577 VanDerWaalsContact SG-CB 3.6Å; K577-M579 VanDerWaalsContact O-CE 3.28Å; K577-M579 WeakPolarHBondContact O-CE 3.41Å
578	Y	95	Very high	93.8	Very high	47 Å²	47	48 Å²	48	18%	0.184	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	146.4	177.1	54.7	-92.3	0	0	0	112	Y559 P560 Y563 Y570 L576 N626 L629	Y559-Y578 AromaticContact CD1-CD1 4Å; Y559-Y578 HydrophobicContact CD1-CD1 4Å; Y559-Y578 HydrophobicContact CD1-CD2 4.13Å; Y559-Y578 HydrophobicContact CD1-CE1 4.19Å; Y559-Y578 HydrophobicContact CD1-CE2 4.33Å; Y559-Y578 AromaticContact CD1-CG 3.97Å; Y559-Y578 HydrophobicContact CD1-CG 3.97Å; Y559-Y578 AromaticContact CE1-CD1 3.7Å; Y559-Y578 HydrophobicContact CE1-CD1 3.7Å; Y559-Y578 HydrophobicContact CE1-CD2 4.48Å; Y559-Y578 HydrophobicContact CE1-CE1 4.21Å; Y559-Y578 AromaticContact CE1-CG 3.85Å; Y559-Y578 HydrophobicContact CE1-CG 3.85Å; P560-Y578 HydrophobicContact CG-CE2 4.33Å; Y563-Y578 AromaticContact CD1-CD2 3.76Å; Y563-Y578 HydrophobicContact CD1-CD2 3.76Å; Y563-Y578 HydrophobicContact CD1-CE2 4.34Å; Y563-Y578 HydrophobicContact CD2-CD2 4.02Å; Y563-Y578 AromaticContact CD2-CE2 3.76Å; Y563-Y578 HydrophobicContact CD2-CE2 3.76Å; Y563-Y578 AromaticContact CE1-CD2 3.78Å; Y563-Y578 HydrophobicContact CE1-CD2 3.78Å; Y563-Y578 HydrophobicContact CE1-CE2 4.25Å; Y563-Y578 HydrophobicContact CE2-CD2 4.06Å; Y563-Y578 AromaticContact CE2-CE2 3.68Å; Y563-Y578 HydrophobicContact CE2-CE2 3.68Å; Y563-Y578 AromaticContact CG-CD2 3.87Å; Y563-Y578 HydrophobicContact CG-CD2 3.87Å; Y563-Y578 HydrophobicContact CG-CE2 4.1Å; Y563-Y578 AromaticContact CZ-CD2 3.95Å; Y563-Y578 AromaticContact CZ-CE2 3.94Å; Y570-Y578 CarbonylContact O-C 3.54Å; Y570-Y578 WeakPolarHBondContact O-CA 3.09Å; L576-Y578 PolarHBondContact O-N 3Å; Y578-N626 WeakPolarHBondContact CD1-OD1 3.48Å; Y578-N626 WeakPolarHBondContact CE1-OD1 3.17Å; Y578-L629 HydrophobicContact CE1-CD1 3.95Å
579	M	95	Very high	93.6	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.039	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.7	-164.9	-74.4	175.3	-85.1	0	0	111.8	Y570 C572 K577 V584 L585 H588	Y570-M579 PolarHBondContact N-O 3.05Å; Y570-M579 PolarHBondContact O-N 3.04Å; C572-M579 HydrophobicContact CB-CE 3.95Å; K577-M579 VanDerWaalsContact O-CE 3.28Å; K577-M579 WeakPolarHBondContact O-CE 3.41Å; M579-V584 HydrophobicContact CB-CB 4.15Å; M579-V584 HydrophobicContact CB-CG1 4.04Å; M579-V584 HydrophobicContact CG-CB 4.39Å; M579-V584 HydrophobicContact CG-CG1 3.77Å; M579-V584 HydrophobicContact SD-CB 4.33Å; M579-V584 HydrophobicContact SD-CG1 3.77Å; M579-L585 HydrophobicContact CE-CB 4.19Å; M579-L585 HydrophobicContact CE-CD1 3.56Å; M579-L585 HydrophobicContact CE-CG 4.49Å; M579-L585 HydrophobicContact SD-CB 4.34Å; M579-H588 HydrophobicContact CE-CB 4.31Å; M579-H588 HydrophobicContact SD-CB 3.79Å
580	K	92.2	Very high	93	Very high	98 Å²	98	52.6 Å²	52.6	43%	0.426	26%	0.261	S	S	.	.	S	Bend	trans	-81.5	-23.4	-168.8	-57.1	-173.8	-178.1	176	0	115.7	Y563 L566	Y563-K580 HydrophobicContact CD1-CG 3.7Å; Y563-K580 HydrophobicContact CE1-CD 4.19Å; Y563-K580 HydrophobicContact CE1-CG 3.33Å; L566-K580 HydrophobicContact CD1-CB 4.13Å; L566-K580 HydrophobicContact CD1-CG 4.24Å
581	S	91.9	Very high	92.5	Very high	33 Å²	33	55.4 Å²	55.4	23%	0.231	28%	0.279	C	S	.	.	S	Bend	trans	-148.9	164.3	177.8	82.6	0	0	0	0	111.9	D583 V584 L585	S581-D583 WeakPolarHBondContact CB-OD2 3.49Å; S581-D583 PolarHBondContact O-N 2.94Å; S581-D583 PolarHBondContact OG-N 3.12Å; S581-D583 PolarHBondContact OG-OD2 2.92Å; S581-V584 PolarHBondContact O-N 2.87Å; S581-V584 VanDerWaalsContact O-N 3.15Å; S581-L585 PolarHBondContact O-N 3.33Å
582	N	92.5	Very high	91.4	Very high	75 Å²	75	63.6 Å²	63.6	40%	0.401	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-35.4	173.7	-173.4	-94.9	0	0	0	112	Y570 V584 L585 T586	Y570-N582 HydrophobicContact CD1-CB 4.18Å; Y570-N582 HydrophobicContact CE1-CB 3.67Å; N582-V584 PolarHBondContact O-N 3.35Å; N582-L585 PolarHBondContact O-N 3.24Å; N582-L585 VanDerWaalsContact O-N 3.15Å; N582-T586 WeakPolarHBondContact O-CB 3.09Å; N582-T586 PolarHBondContact O-N 3.41Å; N582-T586 PolarHBondContact O-OG1 2.95Å; N582-T586 VanDerWaalsContact O-OG1 3.08Å; N582-T586 PolarHBondContact OD1-OG1 3.5Å; N582-T586 VanDerWaalsContact OD1-OG1 3.08Å
583	D	92.3	Very high	90.8	Very high	103 Å²	103	70.7 Å²	70.7	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-65.5	-25.5	179.6	-30.6	-89.8	0	0	0	112.7	S581 R587	S581-D583 WeakPolarHBondContact CB-OD2 3.49Å; S581-D583 PolarHBondContact O-N 2.94Å; S581-D583 PolarHBondContact OG-N 3.12Å; S581-D583 PolarHBondContact OG-OD2 2.92Å; D583-R587 WeakPolarHBondContact O-CB 3.37Å; D583-R587 VanDerWaalsContact O-CG 3.26Å; D583-R587 WeakPolarHBondContact O-CG 3.37Å; D583-R587 PolarHBondContact O-N 2.93Å; D583-R587 PolarHBondContact O-NE 3.33Å
584	V	93	Very high	90.5	Very high	51 Å²	51	69.2 Å²	69.2	31%	0.309	34%	0.339	S	S	.	.	H	α-helix	trans	-77.4	-45.6	173.1	-171.1	0	0	0	0	109.9	M579 S581 N582 R587 H588	M579-V584 HydrophobicContact CB-CB 4.15Å; M579-V584 HydrophobicContact CB-CG1 4.04Å; M579-V584 HydrophobicContact CG-CB 4.39Å; M579-V584 HydrophobicContact CG-CG1 3.77Å; M579-V584 HydrophobicContact SD-CB 4.33Å; M579-V584 HydrophobicContact SD-CG1 3.77Å; S581-V584 PolarHBondContact O-N 2.87Å; S581-V584 VanDerWaalsContact O-N 3.15Å; N582-V584 PolarHBondContact O-N 3.35Å; V584-R587 PolarHBondContact O-N 3.23Å; V584-H588 WeakPolarHBondContact O-CB 3.48Å; V584-H588 PolarHBondContact O-N 3.43Å
585	L	92.5	Very high	90.2	Very high	14 Å²	14	77 Å²	77	7%	0.073	37%	0.373	C	S	.	.	H	α-helix	trans	-59.2	-49.7	175.1	174.3	63.1	0	0	0	111.8	Y570 C572 M579 S581 N582 R587 H588 I589	Y570-L585 HydrophobicContact CD1-CD2 4.04Å; C572-L585 HydrophobicContact CB-CD1 4.23Å; M579-L585 HydrophobicContact CE-CB 4.19Å; M579-L585 HydrophobicContact CE-CD1 3.56Å; M579-L585 HydrophobicContact CE-CG 4.49Å; M579-L585 HydrophobicContact SD-CB 4.34Å; S581-L585 PolarHBondContact O-N 3.33Å; N582-L585 PolarHBondContact O-N 3.24Å; N582-L585 VanDerWaalsContact O-N 3.15Å; L585-R587 PolarHBondContact O-N 3.03Å; L585-H588 WeakPolarHBondContact O-CB 3.39Å; L585-H588 PolarHBondContact O-N 3.18Å; L585-H588 VanDerWaalsContact O-N 3.09Å; L585-I589 HydrophobicContact CD1-CD1 3.78Å; L585-I589 HydrophobicContact CD1-CG1 4.32Å; L585-I589 HydrophobicContact CG-CD1 4.03Å; L585-I589 WeakPolarHBondContact O-CG1 3.12Å; L585-I589 PolarHBondContact O-N 3.33Å
586	T	90.6	Very high	89.9	Confident	59 Å²	59	78.3 Å²	78.3	36%	0.362	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-41.7	178.1	-62.8	0	0	0	0	111.2	N582 H588 I589 V590	N582-T586 WeakPolarHBondContact O-CB 3.09Å; N582-T586 PolarHBondContact O-N 3.41Å; N582-T586 PolarHBondContact O-OG1 2.95Å; N582-T586 VanDerWaalsContact O-OG1 3.08Å; N582-T586 PolarHBondContact OD1-OG1 3.5Å; N582-T586 VanDerWaalsContact OD1-OG1 3.08Å; T586-H588 PolarHBondContact O-N 2.95Å; T586-I589 PolarHBondContact O-N 2.8Å; T586-V590 HydrophobicContact CG2-CG2 3.99Å; T586-V590 VanDerWaalsContact O-CB 3.24Å; T586-V590 WeakPolarHBondContact O-CB 3.43Å; T586-V590 VanDerWaalsContact O-CG2 3.26Å; T586-V590 WeakPolarHBondContact O-CG2 3.23Å; T586-V590 PolarHBondContact O-N 2.97Å
587	R	92.1	Very high	89.7	Confident	140 Å²	140	83.7 Å²	83.7	53%	0.528	40%	0.402	S	S	.	.	H	α-helix	trans	-67.1	-33	172.3	-78.7	-180	-66.4	161.3	-2.7	113.2	D583 V584 L585 L591	D583-R587 WeakPolarHBondContact O-CB 3.37Å; D583-R587 VanDerWaalsContact O-CG 3.26Å; D583-R587 WeakPolarHBondContact O-CG 3.37Å; D583-R587 PolarHBondContact O-N 2.93Å; D583-R587 PolarHBondContact O-NE 3.33Å; V584-R587 PolarHBondContact O-N 3.23Å; L585-R587 PolarHBondContact O-N 3.03Å; R587-L591 HydrophobicContact CB-CD1 4.07Å; R587-L591 HydrophobicContact CG-CD1 4.24Å; R587-L591 WeakPolarHBondContact O-CB 3.47Å; R587-L591 VanDerWaalsContact O-CG 3.28Å; R587-L591 WeakPolarHBondContact O-CG 3.38Å; R587-L591 PolarHBondContact O-N 3.43Å
588	H	92.8	Very high	89.7	Confident	21 Å²	21	81.8 Å²	81.8	10%	0.097	40%	0.395	C	S	.	.	H	α-helix	trans	-67.9	-38.6	177	166.3	75.5	0	0	0	112	C572 C575 M579 V584 L585 T586 K593 C594	C572-H588 PolarHBondContact SG-NE2 3.12Å; C572-H588 VanDerWaalsContact SG-NE2 3.44Å; C575-H588 VanDerWaalsContact SG-CE1 3.51Å; C575-H588 PolarHBondContact SG-NE2 2.74Å; M579-H588 HydrophobicContact CE-CB 4.31Å; M579-H588 HydrophobicContact SD-CB 3.79Å; V584-H588 WeakPolarHBondContact O-CB 3.48Å; V584-H588 PolarHBondContact O-N 3.43Å; L585-H588 WeakPolarHBondContact O-CB 3.39Å; L585-H588 PolarHBondContact O-N 3.18Å; L585-H588 VanDerWaalsContact O-N 3.09Å; T586-H588 PolarHBondContact O-N 2.95Å; H588-K593 WeakPolarHBondContact O-CB 3.36Å; H588-K593 PolarHBondContact O-N 3.38Å; H588-C594 PolarHBondContact O-N 2.94Å; H588-C594 VanDerWaalsContact O-N 3.1Å
589	I	86.8	Confident	89.8	Confident	88 Å²	88	79.7 Å²	79.7	45%	0.451	39%	0.387	S	S	.	.	H	α-helix	trans	-75.9	-59.7	175.3	-63.2	166.6	0	0	0	111.1	L585 T586 L591 K592	L585-I589 HydrophobicContact CD1-CD1 3.78Å; L585-I589 HydrophobicContact CD1-CG1 4.32Å; L585-I589 HydrophobicContact CG-CD1 4.03Å; L585-I589 WeakPolarHBondContact O-CG1 3.12Å; L585-I589 PolarHBondContact O-N 3.33Å; T586-I589 PolarHBondContact O-N 2.8Å; I589-L591 PolarHBondContact O-N 2.92Å; I589-K592 WeakPolarHBondContact O-CA 3.36Å; I589-K592 PolarHBondContact O-N 3.5Å
590	V	83.9	Confident	89.8	Confident	104 Å²	104	81.3 Å²	81.3	63%	0.63	40%	0.398	S	S	*	.	H	α-helix	trans	-65.8	-36.1	-169.9	175.8	0	0	0	0	112.6	T586 K592	T586-V590 HydrophobicContact CG2-CG2 3.99Å; T586-V590 VanDerWaalsContact O-CB 3.24Å; T586-V590 WeakPolarHBondContact O-CB 3.43Å; T586-V590 VanDerWaalsContact O-CG2 3.26Å; T586-V590 WeakPolarHBondContact O-CG2 3.23Å; T586-V590 PolarHBondContact O-N 2.97Å; V590-K592 PolarHBondContact O-N 3.22Å
591	L	83.3	Confident	89.9	Confident	107 Å²	107	77.7 Å²	77.7	56%	0.56	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	14.2	175.5	-52.2	175.1	0	0	0	112.8	R587 I589 K593	R587-L591 HydrophobicContact CB-CD1 4.07Å; R587-L591 HydrophobicContact CG-CD1 4.24Å; R587-L591 WeakPolarHBondContact O-CB 3.47Å; R587-L591 VanDerWaalsContact O-CG 3.28Å; R587-L591 WeakPolarHBondContact O-CG 3.38Å; R587-L591 PolarHBondContact O-N 3.43Å; I589-L591 PolarHBondContact O-N 2.92Å; L591-K593 HydrophobicContact CB-CG 4.26Å; L591-K593 PolarHBondContact O-N 3.3Å; L591-K593 VanDerWaalsContact O-N 3.1Å
592	K	74.8	Confident	90	Very high	173 Å²	173	81.2 Å²	81.2	75%	0.752	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	36	179.9	-59.8	-175.8	179	-179.6	0	113.7	I589 V590 C594	I589-K592 WeakPolarHBondContact O-CA 3.36Å; I589-K592 PolarHBondContact O-N 3.5Å; V590-K592 PolarHBondContact O-N 3.22Å; K592-C594 CarbonylContact C-O 3.52Å
593	K	82.3	Confident	90.2	Very high	152 Å²	152	81.4 Å²	81.4	66%	0.661	40%	0.404	S	S	*	.			trans	-75.9	-29.6	173.5	-62.2	-166.3	174.4	-159.6	0	111.2	H588 L591	H588-K593 WeakPolarHBondContact O-CB 3.36Å; H588-K593 PolarHBondContact O-N 3.38Å; L591-K593 HydrophobicContact CB-CG 4.26Å; L591-K593 PolarHBondContact O-N 3.3Å; L591-K593 VanDerWaalsContact O-N 3.1Å
594	C	87.2	Confident	90.2	Very high	15 Å²	15	76.9 Å²	76.9	10%	0.101	38%	0.38	C	S	.	.			trans	-75.2	124.1	157.6	-158.3	0	0	0	0	109.2	H588 K592 L596	H588-C594 PolarHBondContact O-N 2.94Å; H588-C594 VanDerWaalsContact O-N 3.1Å; K592-C594 CarbonylContact C-O 3.52Å; C594-L596 PolarHBondContact SG-O 2.88Å
595	K	88.4	Confident	90.2	Very high	188 Å²	188	74.7 Å²	74.7	82%	0.817	37%	0.366	S	S	*	.			trans	-101.2	-13.6	166.7	-63.6	179.7	-178.3	174.9	0	112.5	F597	K595-F597 WeakPolarHBondContact O-CD2 3.44Å
596	L	89.9	Confident	90.1	Very high	49 Å²	49	79.6 Å²	79.6	26%	0.257	38%	0.383	S	S	.	.			trans	-83.7	138.8	180	-65.6	176.9	0	0	0	111	F574 C575 C594 P600	F574-L596 HydrophobicContact CB-CB 4.3Å; F574-L596 VanDerWaalsContact CB-O 3.23Å; F574-L596 WeakPolarHBondContact CB-O 3.21Å; C575-L596 HydrophobicContact CB-CD1 3.9Å; C594-L596 PolarHBondContact SG-O 2.88Å; L596-P600 HydrophobicContact CD1-CB 4.22Å; L596-P600 HydrophobicContact CD1-CG 4.31Å; L596-P600 HydrophobicContact CD2-CB 4.22Å
597	F	92.7	Very high	90	Very high	115 Å²	115	79.2 Å²	79.2	50%	0.504	38%	0.377	S	S	.	.	S	Bend	trans	-127.5	6.5	170.1	-61.9	-86.9	0	0	0	111.5	F574 K595 Y658 G659 C660	F574-F597 WeakPolarHBondContact CD1-O 3.41Å; F574-F597 HydrophobicContact CD2-CD1 4.49Å; F574-F597 HydrophobicContact CE2-CD1 4.24Å; K595-F597 WeakPolarHBondContact O-CD2 3.44Å; F597-Y658 WeakPolarHBondContact CD1-O 3.41Å; F597-G659 CarbonylContact O-C 3.59Å; F597-G659 WeakPolarHBondContact O-CA 3.49Å; F597-C660 PolarHBondContact O-N 3.2Å
598	H	94.5	Very high	89.7	Confident	78 Å²	78	78.5 Å²	78.5	36%	0.361	38%	0.383	S	S	.	.	S	Bend	trans	-156	167.3	178.4	61.1	86.7	0	0	0	109.1	F613 C660	H598-F613 HydrophobicContact CB-CE1 4Å; H598-F613 HydrophobicContact CB-CE2 4.42Å; H598-F613 HydrophobicContact CB-CZ 3.78Å; H598-F613 AromaticContact ND1-CE1 3.72Å; H598-C660 HydrophobicContact CB-CB 3.75Å
599	P	96.9	Very high	89.6	Confident	3 Å²	3	80.2 Å²	80.2	2%	0.019	40%	0.397	C	S	.	.			trans	-57.4	141.9	173	-23.7	34.8	0	0	0	111.9	G601 F613 V615 Y623 V651 T653	P599-G601 VanDerWaalsContact C-N 3.27Å; P599-G601 PolarHBondContact O-N 2.8Å; P599-F613 HydrophobicContact CB-CB 3.82Å; P599-F613 HydrophobicContact CB-CD1 4.47Å; P599-F613 HydrophobicContact CB-CD2 4.33Å; P599-F613 HydrophobicContact CB-CG 3.97Å; P599-F613 HydrophobicContact CG-CB 4.06Å; P599-F613 HydrophobicContact CG-CD2 3.72Å; P599-F613 HydrophobicContact CG-CE2 4.35Å; P599-F613 HydrophobicContact CG-CG 3.88Å; P599-V615 HydrophobicContact CB-CG2 3.83Å; P599-Y623 HydrophobicContact CB-CE1 4.35Å; P599-V651 HydrophobicContact CB-CB 4.17Å; P599-V651 HydrophobicContact CB-CG1 4.18Å; P599-V651 HydrophobicContact CB-CG2 4.41Å; P599-V651 HydrophobicContact CG-CB 3.95Å; P599-V651 HydrophobicContact CG-CG1 3.59Å; P599-T653 HydrophobicContact CG-CG2 3.7Å
600	P	95.5	Very high	89.8	Confident	41 Å²	41	76.5 Å²	76.5	27%	0.266	38%	0.378	S	S	.	.	S	Bend	trans	-80.6	70.9	-177.3	34.1	-35.8	0	0	0	111.6	L596 V615 A620 Y623	L596-P600 HydrophobicContact CD1-CB 4.22Å; L596-P600 HydrophobicContact CD1-CG 4.31Å; L596-P600 HydrophobicContact CD2-CB 4.22Å; P600-V615 HydrophobicContact CG-CG1 4.4Å; P600-A620 HydrophobicContact CG-CB 4.03Å; P600-Y623 VanDerWaalsContact CD-CD2 3.46Å; P600-Y623 HydrophobicContact CG-CD1 3.85Å; P600-Y623 HydrophobicContact CG-CD2 3.77Å; P600-Y623 HydrophobicContact CG-CE1 4.43Å; P600-Y623 HydrophobicContact CG-CE2 4.34Å; P600-Y623 HydrophobicContact CG-CG 3.48Å; P600-Y623 VanDerWaalsContact CG-CG 3.48Å
601	G	94.4	Very high	90.3	Very high	23 Å²	23	71.5 Å²	71.5	24%	0.237	35%	0.348	C	S	.	.	S	Bend	trans	-165.6	-172.3	178.3	0	0	0	0	0	111.1	P599 E614	P599-G601 VanDerWaalsContact C-N 3.27Å; P599-G601 PolarHBondContact O-N 2.8Å; G601-E614 CarbonylContact C-O 3.55Å; G601-E614 VanDerWaalsContact CA-O 3.27Å; G601-E614 WeakPolarHBondContact CA-O 3.25Å
602	D	94.6	Very high	90.9	Very high	107 Å²	107	66.4 Å²	66.4	57%	0.572	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.8	-170.5	-65.1	-59.6	0	0	0	111.8	I604 F613 E614	D602-I604 VanDerWaalsContact C-N 3.31Å; D602-I604 HydrophobicContact CB-CG2 4.46Å; D602-I604 PolarHBondContact O-N 3.14Å; D602-F613 CarbonylContact O-C 3.56Å; D602-F613 VanDerWaalsContact O-CA 3.26Å; D602-F613 WeakPolarHBondContact O-CA 3.41Å; D602-E614 PolarHBondContact N-O 3.22Å; D602-E614 PolarHBondContact O-N 3.08Å
603	E	95.2	Very high	92	Very high	79 Å²	79	58.5 Å²	58.5	37%	0.369	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	80.4	178.7	-170.9	173.3	-148	0	0	110.5	Y605 R606 S611 F613	E603-Y605 VanDerWaalsContact C-N 3.26Å; E603-Y605 PolarHBondContact O-N 3.33Å; E603-R606 HydrophobicContact CG-CB 4.35Å; E603-R606 WeakPolarHBondContact OE1-CD 3.28Å; E603-R606 IonicContact OE1-CZ 2.7Å; E603-R606 IonicContact OE1-NE 2.7Å; E603-R606 IonicContact OE1-NH1 2.63Å; E603-R606 PolarHBondContact OE1-NH1 2.82Å; E603-R606 IonicContact OE2-NH1 2.74Å; E603-R606 PolarHBondContact OE2-NH1 3.49Å; E603-S611 VanDerWaalsContact OE1-CB 3.25Å; E603-S611 WeakPolarHBondContact OE1-CB 3.47Å; E603-S611 PolarHBondContact OE1-OG 3.49Å; E603-F613 HydrophobicContact CB-CD1 4.05Å; E603-F613 HydrophobicContact CB-CE1 3.72Å; E603-F613 HydrophobicContact CB-CZ 4.2Å; E603-F613 HydrophobicContact CG-CE1 4.12Å; E603-F613 HydrophobicContact CG-CZ 4.09Å
604	I	94	Very high	92.8	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.041	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-13.1	-176	60.4	159.5	0	0	0	114.1	D602 F612 E614 Y650 F699 V814 A815 A816	D602-I604 VanDerWaalsContact C-N 3.31Å; D602-I604 HydrophobicContact CB-CG2 4.46Å; D602-I604 PolarHBondContact O-N 3.14Å; I604-F612 HydrophobicContact CG1-CB 4.33Å; I604-F612 PolarHBondContact N-O 2.95Å; I604-F612 VanDerWaalsContact N-O 3.12Å; I604-E614 HydrophobicContact CD1-CB 4.11Å; I604-E614 HydrophobicContact CG1-CB 4.26Å; I604-E614 HydrophobicContact CG2-CB 3.79Å; I604-Y650 HydrophobicContact CD1-CD1 3.8Å; I604-Y650 HydrophobicContact CD1-CE1 3.74Å; I604-F699 HydrophobicContact CD1-CE1 3.63Å; I604-F699 HydrophobicContact CD1-CZ 3.65Å; I604-F699 HydrophobicContact CG1-CZ 4.16Å; I604-V814 HydrophobicContact CD1-CG1 4.4Å; I604-V814 CarbonylContact O-C 3.46Å; I604-V814 WeakPolarHBondContact O-CA 3.41Å; I604-A815 PolarHBondContact O-N 3.34Å; I604-A816 HydrophobicContact CB-CB 4.16Å; I604-A816 HydrophobicContact CD1-CB 4.1Å; I604-A816 HydrophobicContact CG2-CB 3.98Å
605	Y	92.7	Very high	93.2	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.016	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	140.2	173.6	175.8	-104.4	0	0	0	111	E603 K607 S611 F612 F699 S807 P809 E813 V814	E603-Y605 VanDerWaalsContact C-N 3.26Å; E603-Y605 PolarHBondContact O-N 3.33Å; Y605-K607 HydrophobicContact CE1-CB 3.95Å; Y605-K607 HydrophobicContact CE2-CB 4.24Å; Y605-K607 HydrophobicContact CE2-CD 4.39Å; Y605-K607 WeakPolarHBondContact OH-CB 3.2Å; Y605-K607 WeakPolarHBondContact OH-CD 3.41Å; Y605-S611 CarbonylContact O-C 3.53Å; Y605-S611 WeakPolarHBondContact O-CA 3.47Å; Y605-S611 VanDerWaalsContact O-CB 3.29Å; Y605-S611 WeakPolarHBondContact O-CB 3.2Å; Y605-F612 AromaticContact CD1-CD2 3.94Å; Y605-F612 HydrophobicContact CD1-CD2 3.94Å; Y605-F612 PolarHBondContact N-O 2.8Å; Y605-F612 PolarHBondContact O-N 3.16Å; Y605-F699 HydrophobicContact CD1-CE2 4.3Å; Y605-F699 AromaticContact CG-CE2 3.98Å; Y605-F699 HydrophobicContact CG-CE2 3.98Å; Y605-S807 PolarHBondContact OH-O 3.19Å; Y605-P809 HydrophobicContact CD1-CG 4.47Å; Y605-P809 HydrophobicContact CD2-CB 3.75Å; Y605-P809 HydrophobicContact CD2-CG 4.09Å; Y605-P809 HydrophobicContact CE1-CG 4.15Å; Y605-P809 HydrophobicContact CE2-CB 3.39Å; Y605-P809 HydrophobicContact CE2-CG 3.77Å; Y605-P809 HydrophobicContact CG-CG 4.4Å; Y605-E813 HydrophobicContact CD2-CB 4.29Å; Y605-E813 HydrophobicContact CE2-CB 4.06Å; Y605-V814 HydrophobicContact CD2-CG2 4.19Å
606	R	90.4	Very high	93.7	Very high	117 Å²	117	44.2 Å²	44.2	44%	0.442	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	128.6	173.7	-174.5	177.9	-170.9	93.5	5.5	110.4	E603 L610 N655	E603-R606 HydrophobicContact CG-CB 4.35Å; E603-R606 WeakPolarHBondContact OE1-CD 3.28Å; E603-R606 IonicContact OE1-CZ 2.7Å; E603-R606 IonicContact OE1-NE 2.7Å; E603-R606 IonicContact OE1-NH1 2.63Å; E603-R606 PolarHBondContact OE1-NH1 2.82Å; E603-R606 IonicContact OE2-NH1 2.74Å; E603-R606 PolarHBondContact OE2-NH1 3.49Å; R606-L610 WeakPolarHBondContact CA-O 3.44Å; R606-N655 PolarHBondContact NH1-ND2 2.96Å
607	K	87.2	Confident	93.9	Very high	52 Å²	52	41.9 Å²	41.9	23%	0.226	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	130.5	171.9	-152.6	162	-168	175.7	0	111.3	Y605 S609 L610 C806 E813	Y605-K607 HydrophobicContact CE1-CB 3.95Å; Y605-K607 HydrophobicContact CE2-CB 4.24Å; Y605-K607 HydrophobicContact CE2-CD 4.39Å; Y605-K607 WeakPolarHBondContact OH-CB 3.2Å; Y605-K607 WeakPolarHBondContact OH-CD 3.41Å; K607-S609 PolarHBondContact O-N 2.78Å; K607-S609 VanDerWaalsContact O-N 3.08Å; K607-L610 PolarHBondContact N-O 3.44Å; K607-L610 PolarHBondContact O-N 3.36Å; K607-L610 VanDerWaalsContact O-O 3.11Å; K607-C806 WeakPolarHBondContact CD-O 3.32Å; K607-C806 WeakPolarHBondContact CE-O 3.24Å; K607-C806 PolarHBondContact NZ-O 3.33Å; K607-E813 IonicContact NZ-OE1 3.92Å; K607-E813 PolarHBondContact NZ-OE1 3.2Å; K607-E813 IonicContact NZ-OE2 2.82Å; K607-E813 PolarHBondContact NZ-OE2 3.25Å
608	D	86.3	Confident	94	Very high	124 Å²	124	39.8 Å²	39.8	66%	0.663	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	-110.6	-175.3	-46.4	-49	0	0	0	112
609	S	90.1	Very high	94	Very high	57 Å²	57	44.2 Å²	44.2	40%	0.399	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	16	177	57.2	0	0	0	0	113.4	K607 M654 N655	K607-S609 PolarHBondContact O-N 2.78Å; K607-S609 VanDerWaalsContact O-N 3.08Å; S609-M654 CarbonylContact O-C 3.54Å; S609-M654 VanDerWaalsContact O-CA 3.31Å; S609-M654 WeakPolarHBondContact O-CA 3.48Å; S609-N655 PolarHBondContact O-N 3.03Å
610	L	92.4	Very high	94	Very high	10 Å²	10	44.7 Å²	44.7	5%	0.052	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	142.5	-179.1	-59.3	177.8	0	0	0	111.7	R606 K607 T653 M654 F692 L695 L804	R606-L610 WeakPolarHBondContact CA-O 3.44Å; K607-L610 PolarHBondContact N-O 3.44Å; K607-L610 PolarHBondContact O-N 3.36Å; K607-L610 VanDerWaalsContact O-O 3.11Å; L610-T653 WeakPolarHBondContact CA-O 3.35Å; L610-M654 HydrophobicContact CD2-CB 4.41Å; L610-M654 HydrophobicContact CD2-CE 4.41Å; L610-F692 HydrophobicContact CD1-CE1 4.16Å; L610-F692 HydrophobicContact CD2-CE1 3.82Å; L610-L695 HydrophobicContact CD1-CD2 4.06Å; L610-L804 HydrophobicContact CD1-CD2 3.9Å
611	S	94.1	Very high	94	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	154.1	171.3	-59.9	0	0	0	0	112.1	E603 Y605 L652 T653 N655	E603-S611 VanDerWaalsContact OE1-CB 3.25Å; E603-S611 WeakPolarHBondContact OE1-CB 3.47Å; E603-S611 PolarHBondContact OE1-OG 3.49Å; Y605-S611 CarbonylContact O-C 3.53Å; Y605-S611 WeakPolarHBondContact O-CA 3.47Å; Y605-S611 VanDerWaalsContact O-CB 3.29Å; Y605-S611 WeakPolarHBondContact O-CB 3.2Å; S611-L652 WeakPolarHBondContact O-CA 3.38Å; S611-L652 WeakPolarHBondContact O-CD1 3.26Å; S611-T653 PolarHBondContact N-O 2.93Å; S611-T653 PolarHBondContact O-N 3.4Å; S611-N655 PolarHBondContact OG-ND2 2.89Å
612	F	96.2	Very high	94	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.7	160.5	-77.8	-93.7	0	0	0	109.7	I604 Y605 V651 L652 F666 L695 Q696 F699	I604-F612 HydrophobicContact CG1-CB 4.33Å; I604-F612 PolarHBondContact N-O 2.95Å; I604-F612 VanDerWaalsContact N-O 3.12Å; Y605-F612 AromaticContact CD1-CD2 3.94Å; Y605-F612 HydrophobicContact CD1-CD2 3.94Å; Y605-F612 PolarHBondContact N-O 2.8Å; Y605-F612 PolarHBondContact O-N 3.16Å; F612-V651 WeakPolarHBondContact CA-O 3.44Å; F612-L652 HydrophobicContact CD1-CB 4.18Å; F612-L652 HydrophobicContact CD2-CD1 4.17Å; F612-L652 HydrophobicContact CE1-CB 3.82Å; F612-L652 HydrophobicContact CE1-CD1 4.36Å; F612-L652 HydrophobicContact CE1-CG 4.49Å; F612-L652 HydrophobicContact CE2-CD1 3.82Å; F612-L652 HydrophobicContact CZ-CB 4.15Å; F612-L652 HydrophobicContact CZ-CD1 3.93Å; F612-L652 HydrophobicContact CZ-CD2 4.28Å; F612-L652 HydrophobicContact CZ-CG 4.33Å; F612-F666 HydrophobicContact CE1-CE1 4.13Å; F612-L695 HydrophobicContact CE2-CD2 3.95Å; F612-L695 HydrophobicContact CE2-CG 3.93Å; F612-L695 HydrophobicContact CZ-CD2 4.31Å; F612-L695 HydrophobicContact CZ-CG 4.08Å; F612-Q696 HydrophobicContact CE1-CG 4.09Å; F612-Q696 HydrophobicContact CZ-CG 4.1Å; F612-F699 HydrophobicContact CB-CE1 4.27Å; F612-F699 HydrophobicContact CB-CE2 4.01Å; F612-F699 HydrophobicContact CB-CZ 3.85Å; F612-F699 HydrophobicContact CD1-CD1 4.21Å; F612-F699 HydrophobicContact CD1-CD2 4.35Å; F612-F699 HydrophobicContact CD1-CE1 4.43Å; F612-F699 HydrophobicContact CD1-CG 4.17Å; F612-F699 AromaticContact CD2-CD2 3.33Å; F612-F699 HydrophobicContact CD2-CD2 3.33Å; F612-F699 AromaticContact CD2-CE2 3.46Å; F612-F699 HydrophobicContact CD2-CE2 3.46Å; F612-F699 VanDerWaalsContact CD2-CE2 3.46Å; F612-F699 AromaticContact CD2-CG 3.94Å; F612-F699 HydrophobicContact CD2-CG 3.94Å; F612-F699 HydrophobicContact CD2-CZ 4.14Å; F612-F699 HydrophobicContact CE1-CB 4.1Å; F612-F699 HydrophobicContact CE1-CD1 4.35Å; F612-F699 HydrophobicContact CE1-CD2 4.37Å; F612-F699 HydrophobicContact CE1-CG 4.01Å; F612-F699 HydrophobicContact CE2-CB 4.02Å; F612-F699 AromaticContact CE2-CD2 3.36Å; F612-F699 HydrophobicContact CE2-CD2 3.36Å; F612-F699 HydrophobicContact CE2-CE2 4.01Å; F612-F699 AromaticContact CE2-CG 3.78Å; F612-F699 HydrophobicContact CE2-CG 3.78Å; F612-F699 HydrophobicContact CG-CD1 4.3Å; F612-F699 AromaticContact CG-CD2 3.86Å; F612-F699 HydrophobicContact CG-CD2 3.86Å; F612-F699 HydrophobicContact CG-CE1 4.23Å; F612-F699 AromaticContact CG-CE2 3.8Å; F612-F699 HydrophobicContact CG-CE2 3.8Å; F612-F699 HydrophobicContact CG-CG 4.13Å; F612-F699 AromaticContact CG-CZ 3.99Å; F612-F699 HydrophobicContact CG-CZ 3.99Å; F612-F699 HydrophobicContact CZ-CB 3.71Å; F612-F699 AromaticContact CZ-CD2 3.91Å; F612-F699 HydrophobicContact CZ-CD2 3.91Å; F612-F699 AromaticContact CZ-CG 3.82Å; F612-F699 HydrophobicContact CZ-CG 3.82Å
613	F	97.4	Very high	94.2	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.026	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.3	171.2	-67.2	-98.6	0	0	0	109.7	H598 P599 D602 E603 V615 F649 Y650 V651 T653 C660	H598-F613 HydrophobicContact CB-CE1 4Å; H598-F613 HydrophobicContact CB-CE2 4.42Å; H598-F613 HydrophobicContact CB-CZ 3.78Å; H598-F613 AromaticContact ND1-CE1 3.72Å; P599-F613 HydrophobicContact CB-CB 3.82Å; P599-F613 HydrophobicContact CB-CD1 4.47Å; P599-F613 HydrophobicContact CB-CD2 4.33Å; P599-F613 HydrophobicContact CB-CG 3.97Å; P599-F613 HydrophobicContact CG-CB 4.06Å; P599-F613 HydrophobicContact CG-CD2 3.72Å; P599-F613 HydrophobicContact CG-CE2 4.35Å; P599-F613 HydrophobicContact CG-CG 3.88Å; D602-F613 CarbonylContact O-C 3.56Å; D602-F613 VanDerWaalsContact O-CA 3.26Å; D602-F613 WeakPolarHBondContact O-CA 3.41Å; E603-F613 HydrophobicContact CB-CD1 4.05Å; E603-F613 HydrophobicContact CB-CE1 3.72Å; E603-F613 HydrophobicContact CB-CZ 4.2Å; E603-F613 HydrophobicContact CG-CE1 4.12Å; E603-F613 HydrophobicContact CG-CZ 4.09Å; F613-V615 HydrophobicContact CB-CG2 4.25Å; F613-F649 VanDerWaalsContact O-O 3.14Å; F613-Y650 WeakPolarHBondContact O-CA 3.11Å; F613-V651 HydrophobicContact CB-CB 4.48Å; F613-V651 PolarHBondContact N-O 3.06Å; F613-V651 PolarHBondContact O-N 3.36Å; F613-T653 HydrophobicContact CD2-CG2 4.06Å; F613-T653 HydrophobicContact CE2-CG2 4.08Å; F613-C660 HydrophobicContact CE2-CB 4.1Å; F613-C660 HydrophobicContact CZ-CB 4.33Å
614	E	98	Very high	94.3	Very high	28 Å²	28	43 Å²	43	13%	0.131	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	112.7	168.5	-175.3	171.8	87	0	0	108.9	G601 D602 I604 Y650	G601-E614 CarbonylContact C-O 3.55Å; G601-E614 VanDerWaalsContact CA-O 3.27Å; G601-E614 WeakPolarHBondContact CA-O 3.25Å; D602-E614 PolarHBondContact N-O 3.22Å; D602-E614 PolarHBondContact O-N 3.08Å; I604-E614 HydrophobicContact CD1-CB 4.11Å; I604-E614 HydrophobicContact CG1-CB 4.26Å; I604-E614 HydrophobicContact CG2-CB 3.79Å; E614-Y650 HydrophobicContact CB-CD1 4.34Å; E614-Y650 HydrophobicContact CB-CE1 3.98Å; E614-Y650 HydrophobicContact CG-CD1 4.42Å; E614-Y650 HydrophobicContact CG-CE1 3.72Å; E614-Y650 WeakPolarHBondContact OE2-CE1 3.21Å; E614-Y650 VanDerWaalsContact OE2-CZ 3.22Å; E614-Y650 PolarHBondContact OE2-OH 3.31Å
615	V	97.5	Very high	94.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113.5	-177.5	-177	0	0	0	0	109.1	P599 P600 F613 A620 Y623 F649 V651	P599-V615 HydrophobicContact CB-CG2 3.83Å; P600-V615 HydrophobicContact CG-CG1 4.4Å; F613-V615 HydrophobicContact CB-CG2 4.25Å; V615-A620 HydrophobicContact CG1-CB 3.51Å; V615-Y623 HydrophobicContact CG1-CD1 4Å; V615-Y623 HydrophobicContact CG1-CE1 4.34Å; V615-Y623 HydrophobicContact CG2-CE1 4.48Å; V615-F649 HydrophobicContact CB-CB 4.2Å; V615-F649 PolarHBondContact N-O 2.81Å; V615-F649 WeakPolarHBondContact O-CB 3.4Å; V615-F649 PolarHBondContact O-N 2.93Å; V615-V651 HydrophobicContact CB-CG2 4.49Å; V615-V651 HydrophobicContact CG2-CG2 3.94Å
616	D	97	Very high	94.7	Very high	28 Å²	28	44.7 Å²	44.7	15%	0.15	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	123.7	177.9	178.6	-7.4	0	0	0	111	C618 K619 A620 L648 K670	D616-C618 PolarHBondContact O-N 2.91Å; D616-C618 WeakPolarHBondContact OD1-CB 3.43Å; D616-C618 PolarHBondContact OD1-N 2.88Å; D616-K619 HydrophobicContact CB-CB 4.12Å; D616-K619 HydrophobicContact CB-CD 3.88Å; D616-K619 HydrophobicContact CB-CG 4Å; D616-K619 PolarHBondContact O-N 3.12Å; D616-K619 WeakPolarHBondContact OD2-CE 3.24Å; D616-K619 WeakPolarHBondContact OD2-CG 3.5Å; D616-K619 IonicContact OD2-NZ 3.04Å; D616-A620 WeakPolarHBondContact O-CB 3.44Å; D616-A620 PolarHBondContact O-N 3.04Å; D616-L648 HydrophobicContact CB-CD2 4.12Å; D616-K670 WeakPolarHBondContact OD1-CE 3.18Å; D616-K670 IonicContact OD1-NZ 3.31Å; D616-K670 PolarHBondContact OD1-NZ 2.77Å; D616-K670 IonicContact OD2-NZ 3.04Å
617	G	95.5	Very high	95	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-26.3	177.5	0	0	0	0	0	115.2	K621 V644 F647	G617-K621 VanDerWaalsContact O-CA 3.23Å; G617-K621 WeakPolarHBondContact O-CA 3.36Å; G617-K621 PolarHBondContact O-N 2.92Å; G617-V644 WeakPolarHBondContact CA-O 3.29Å; G617-F647 PolarHBondContact N-O 2.96Å
618	C	94.4	Very high	95.5	Very high	70 Å²	70	36.9 Å²	36.9	47%	0.473	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-51.9	171.5	-68.5	0	0	0	0	111	D616 A620 E645 K670	D616-C618 PolarHBondContact O-N 2.91Å; D616-C618 WeakPolarHBondContact OD1-CB 3.43Å; D616-C618 PolarHBondContact OD1-N 2.88Å; C618-A620 PolarHBondContact O-N 2.84Å; C618-E645 VanDerWaalsContact SG-CB 3.59Å; C618-E645 PolarHBondContact SG-O 2.87Å; C618-E645 VanDerWaalsContact SG-O 3.33Å; C618-K670 PolarHBondContact SG-NZ 3.05Å
619	K	95.3	Very high	95.9	Very high	171 Å²	171	31.1 Å²	31.1	74%	0.743	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-34.2	-175.4	-60.7	174.1	-167.8	166.3	0	112.4	D616	D616-K619 HydrophobicContact CB-CB 4.12Å; D616-K619 HydrophobicContact CB-CD 3.88Å; D616-K619 HydrophobicContact CB-CG 4Å; D616-K619 PolarHBondContact O-N 3.12Å; D616-K619 WeakPolarHBondContact OD2-CE 3.24Å; D616-K619 WeakPolarHBondContact OD2-CG 3.5Å; D616-K619 IonicContact OD2-NZ 3.04Å
620	A	95.4	Very high	96.1	Very high	13 Å²	13	28.5 Å²	28.5	11%	0.107	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	28.2	-171.2	0	0	0	0	0	113.8	P600 V615 D616 C618 I622 Y623 C624	P600-A620 HydrophobicContact CG-CB 4.03Å; V615-A620 HydrophobicContact CG1-CB 3.51Å; D616-A620 WeakPolarHBondContact O-CB 3.44Å; D616-A620 PolarHBondContact O-N 3.04Å; C618-A620 PolarHBondContact O-N 2.84Å; A620-I622 PolarHBondContact O-N 2.92Å; A620-Y623 WeakPolarHBondContact O-CA 3.44Å; A620-Y623 WeakPolarHBondContact O-CB 3.31Å; A620-Y623 PolarHBondContact O-N 2.71Å; A620-C624 PolarHBondContact O-N 3.37Å; A620-C624 VanDerWaalsContact O-N 3.1Å
621	K	95.8	Very high	96.2	Very high	85 Å²	85	28.1 Å²	28.1	37%	0.37	14%	0.141	S	C	.	.	H	α-helix	trans	-35.1	-57	-172.8	-174.8	167.2	-178.6	169	0	114.9	G617 Y623 C624 Q625 V644 E645	G617-K621 VanDerWaalsContact O-CA 3.23Å; G617-K621 WeakPolarHBondContact O-CA 3.36Å; G617-K621 PolarHBondContact O-N 2.92Å; K621-Y623 VanDerWaalsContact C-N 3.33Å; K621-Y623 PolarHBondContact O-N 3.07Å; K621-C624 PolarHBondContact O-N 2.76Å; K621-Q625 HydrophobicContact CG-CG 4.4Å; K621-Q625 WeakPolarHBondContact O-CB 3.35Å; K621-Q625 VanDerWaalsContact O-CG 3.28Å; K621-Q625 WeakPolarHBondContact O-CG 3.22Å; K621-Q625 PolarHBondContact O-N 2.89Å; K621-V644 HydrophobicContact CB-CG2 4.33Å; K621-V644 HydrophobicContact CG-CG2 3.87Å; K621-E645 WeakPolarHBondContact CD-OE1 3.47Å; K621-E645 WeakPolarHBondContact CE-OE1 3.47Å; K621-E645 IonicContact NZ-OE1 2.66Å; K621-E645 PolarHBondContact NZ-OE1 3.34Å
622	I	95.6	Very high	96.2	Very high	115 Å²	115	29.3 Å²	29.3	59%	0.59	15%	0.146	S	C	*	.	H	α-helix	trans	-61.1	-37.1	-178.6	-57.7	-58.7	0	0	0	113.1	A620 N626	A620-I622 PolarHBondContact O-N 2.92Å; I622-N626 WeakPolarHBondContact O-CB 3.31Å; I622-N626 PolarHBondContact O-N 3.18Å; I622-N626 VanDerWaalsContact O-N 3.11Å; I622-N626 PolarHBondContact O-ND2 3.21Å; I622-N626 VanDerWaalsContact O-ND2 3.1Å
623	Y	97.8	Very high	96	Very high	14 Å²	14	29.4 Å²	29.4	6%	0.055	15%	0.146	C	C	.	.	H	α-helix	trans	-68.7	-46	175.6	177.4	-90.5	0	0	0	111	F574 L576 P599 P600 V615 A620 K621 Q625 N626 L627 V651	F574-Y623 WeakPolarHBondContact O-CE2 3.23Å; L576-Y623 HydrophobicContact CB-CE2 4.46Å; L576-Y623 HydrophobicContact CD1-CD2 4.11Å; L576-Y623 HydrophobicContact CD1-CE1 4.12Å; L576-Y623 HydrophobicContact CD1-CE2 3.52Å; L576-Y623 HydrophobicContact CG-CD2 4.19Å; L576-Y623 HydrophobicContact CG-CE2 3.65Å; P599-Y623 HydrophobicContact CB-CE1 4.35Å; P600-Y623 VanDerWaalsContact CD-CD2 3.46Å; P600-Y623 HydrophobicContact CG-CD1 3.85Å; P600-Y623 HydrophobicContact CG-CD2 3.77Å; P600-Y623 HydrophobicContact CG-CE1 4.43Å; P600-Y623 HydrophobicContact CG-CE2 4.34Å; P600-Y623 HydrophobicContact CG-CG 3.48Å; P600-Y623 VanDerWaalsContact CG-CG 3.48Å; V615-Y623 HydrophobicContact CG1-CD1 4Å; V615-Y623 HydrophobicContact CG1-CE1 4.34Å; V615-Y623 HydrophobicContact CG2-CE1 4.48Å; A620-Y623 WeakPolarHBondContact O-CA 3.44Å; A620-Y623 WeakPolarHBondContact O-CB 3.31Å; A620-Y623 PolarHBondContact O-N 2.71Å; K621-Y623 VanDerWaalsContact C-N 3.33Å; K621-Y623 PolarHBondContact O-N 3.07Å; Y623-Q625 PolarHBondContact O-N 3.09Å; Y623-N626 PolarHBondContact O-N 3.2Å; Y623-L627 HydrophobicContact CE1-CD2 4.1Å; Y623-L627 WeakPolarHBondContact O-CB 3.49Å; Y623-L627 PolarHBondContact O-N 3.19Å; Y623-V651 HydrophobicContact CE1-CG2 4.3Å
624	C	97.7	Very high	95.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.4	-35.3	-179.9	-63.4	0	0	0	0	112.4	A620 K621 L627 C628 V644 F649	A620-C624 PolarHBondContact O-N 3.37Å; A620-C624 VanDerWaalsContact O-N 3.1Å; K621-C624 PolarHBondContact O-N 2.76Å; C624-L627 PolarHBondContact O-N 2.91Å; C624-C628 WeakPolarHBondContact O-CB 3.35Å; C624-C628 PolarHBondContact O-N 3.15Å; C624-C628 PolarHBondContact O-SG 3.37Å; C624-C628 VanDerWaalsContact O-SG 3.37Å; C624-V644 HydrophobicContact CB-CB 3.9Å; C624-V644 HydrophobicContact CB-CG1 4.13Å; C624-V644 HydrophobicContact CB-CG2 3.95Å; C624-F649 HydrophobicContact CB-CD2 3.98Å; C624-F649 HydrophobicContact CB-CE1 4.34Å; C624-F649 HydrophobicContact CB-CE2 3.63Å; C624-F649 HydrophobicContact CB-CG 4.48Å; C624-F649 HydrophobicContact CB-CZ 3.84Å; C624-F649 VanDerWaalsContact SG-CD2 3.52Å
625	Q	97.1	Very high	95.4	Very high	34 Å²	34	29.5 Å²	29.5	16%	0.159	15%	0.147	C	C	.	.	H	α-helix	trans	-64.6	-46.6	171.3	-70.8	-179.3	-17.7	0	0	111.8	K621 Y623 L627 C628 L629 Y642 V644	K621-Q625 HydrophobicContact CG-CG 4.4Å; K621-Q625 WeakPolarHBondContact O-CB 3.35Å; K621-Q625 VanDerWaalsContact O-CG 3.28Å; K621-Q625 WeakPolarHBondContact O-CG 3.22Å; K621-Q625 PolarHBondContact O-N 2.89Å; Y623-Q625 PolarHBondContact O-N 3.09Å; Q625-L627 VanDerWaalsContact C-N 3.31Å; Q625-L627 PolarHBondContact O-N 2.84Å; Q625-C628 PolarHBondContact O-N 3.33Å; Q625-L629 WeakPolarHBondContact O-CG 3.29Å; Q625-L629 PolarHBondContact O-N 2.82Å; Q625-Y642 PolarHBondContact NE2-O 3.26Å; Q625-V644 HydrophobicContact CG-CG1 4.02Å; Q625-V644 HydrophobicContact CG-CG2 3.96Å
626	N	97.3	Very high	94.7	Very high	15 Å²	15	33 Å²	33	8%	0.08	17%	0.166	C	C	.	.	H	α-helix	trans	-59.9	-41.3	174.7	-73.2	-28.4	0	0	0	112	L576 Y578 I622 Y623 L629 L630	L576-N626 HydrophobicContact CB-CB 3.65Å; L576-N626 WeakPolarHBondContact O-CB 3.41Å; Y578-N626 WeakPolarHBondContact CD1-OD1 3.48Å; Y578-N626 WeakPolarHBondContact CE1-OD1 3.17Å; I622-N626 WeakPolarHBondContact O-CB 3.31Å; I622-N626 PolarHBondContact O-N 3.18Å; I622-N626 VanDerWaalsContact O-N 3.11Å; I622-N626 PolarHBondContact O-ND2 3.21Å; I622-N626 VanDerWaalsContact O-ND2 3.1Å; Y623-N626 PolarHBondContact O-N 3.2Å; N626-L629 PolarHBondContact O-N 3.37Å; N626-L630 WeakPolarHBondContact O-CB 3.38Å; N626-L630 PolarHBondContact O-N 2.85Å
627	L	97.5	Very high	93.8	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-45.3	175.9	-176.4	58.2	0	0	0	111.5	L576 Y623 C624 Q625 L630 A631 F649 V651 L662 Y665	L576-L627 HydrophobicContact CD1-CB 3.7Å; L576-L627 HydrophobicContact CD1-CD1 3.7Å; L576-L627 HydrophobicContact CD1-CG 4.22Å; Y623-L627 HydrophobicContact CE1-CD2 4.1Å; Y623-L627 WeakPolarHBondContact O-CB 3.49Å; Y623-L627 PolarHBondContact O-N 3.19Å; C624-L627 PolarHBondContact O-N 2.91Å; Q625-L627 VanDerWaalsContact C-N 3.31Å; Q625-L627 PolarHBondContact O-N 2.84Å; L627-L630 PolarHBondContact O-N 2.8Å; L627-A631 WeakPolarHBondContact O-CB 3.48Å; L627-A631 PolarHBondContact O-N 2.83Å; L627-F649 HydrophobicContact CD2-CB 4.45Å; L627-F649 HydrophobicContact CD2-CD1 3.91Å; L627-V651 HydrophobicContact CD2-CG2 3.99Å; L627-L662 HydrophobicContact CD1-CD1 4.45Å; L627-L662 HydrophobicContact CD1-CD2 3.97Å; L627-Y665 HydrophobicContact CD1-CD1 3.53Å; L627-Y665 HydrophobicContact CD1-CE1 3.81Å; L627-Y665 HydrophobicContact CD1-CG 4.18Å; L627-Y665 HydrophobicContact CD2-CD1 3.94Å; L627-Y665 HydrophobicContact CD2-CD2 3.97Å; L627-Y665 HydrophobicContact CD2-CE1 4.28Å; L627-Y665 HydrophobicContact CD2-CE2 4.35Å; L627-Y665 HydrophobicContact CD2-CG 3.78Å; L627-Y665 HydrophobicContact CG-CD1 3.73Å; L627-Y665 HydrophobicContact CG-CD2 4.44Å; L627-Y665 HydrophobicContact CG-CE1 3.72Å; L627-Y665 HydrophobicContact CG-CE2 4.47Å; L627-Y665 HydrophobicContact CG-CG 4.1Å
628	C	96.8	Very high	93.4	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.014	19%	0.19	C	C	.	.	H	α-helix	trans	-62.7	-41.1	175.6	-80.8	0	0	0	0	113.2	C624 Q625 A631 K632 K638	C624-C628 WeakPolarHBondContact O-CB 3.35Å; C624-C628 PolarHBondContact O-N 3.15Å; C624-C628 PolarHBondContact O-SG 3.37Å; C624-C628 VanDerWaalsContact O-SG 3.37Å; Q625-C628 PolarHBondContact O-N 3.33Å; C628-A631 WeakPolarHBondContact O-CB 3.48Å; C628-A631 PolarHBondContact O-N 3.27Å; C628-K632 WeakPolarHBondContact O-CB 3.24Å; C628-K632 PolarHBondContact O-N 2.82Å; C628-K638 WeakPolarHBondContact SG-CE 3.28Å; C628-K638 PolarHBondContact SG-NZ 2.7Å
629	L	94.8	Very high	92.7	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-44.8	174.5	-72.9	170.9	0	0	0	111.3	P558 Y559 Y578 Q625 N626 A631 K632 Y641	P558-L629 HydrophobicContact CG-CD2 4.01Å; P558-L629 WeakPolarHBondContact O-CD2 3.48Å; Y559-L629 HydrophobicContact CD1-CB 4.35Å; Y559-L629 HydrophobicContact CD1-CD1 4.13Å; Y559-L629 HydrophobicContact CE1-CB 3.71Å; Y559-L629 HydrophobicContact CE1-CD1 4.1Å; Y559-L629 HydrophobicContact CE1-CG 4.45Å; Y578-L629 HydrophobicContact CE1-CD1 3.95Å; Q625-L629 WeakPolarHBondContact O-CG 3.29Å; Q625-L629 PolarHBondContact O-N 2.82Å; N626-L629 PolarHBondContact O-N 3.37Å; L629-A631 VanDerWaalsContact C-N 3.31Å; L629-A631 PolarHBondContact O-N 2.97Å; L629-K632 PolarHBondContact O-N 2.87Å; L629-Y641 HydrophobicContact CD2-CD2 4.04Å
630	L	95.6	Very high	92.1	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-62.7	-37.1	174.5	-179.8	62.5	0	0	0	112	I544 I546 Y559 L576 N626 L627 V633 Y634 L662 L684	I544-L630 HydrophobicContact CD1-CD1 3.8Å; I544-L630 HydrophobicContact CG2-CD1 4.16Å; I546-L630 HydrophobicContact CD1-CD2 3.83Å; Y559-L630 WeakPolarHBondContact OH-CA 3.41Å; Y559-L630 PolarHBondContact OH-N 3.02Å; L576-L630 HydrophobicContact CD2-CD2 4.25Å; N626-L630 WeakPolarHBondContact O-CB 3.38Å; N626-L630 PolarHBondContact O-N 2.85Å; L627-L630 PolarHBondContact O-N 2.8Å; L630-V633 WeakPolarHBondContact O-CB 3.39Å; L630-Y634 HydrophobicContact CD1-CE2 4.02Å; L630-Y634 VanDerWaalsContact O-CD2 3.26Å; L630-Y634 WeakPolarHBondContact O-CD2 3.34Å; L630-Y634 WeakPolarHBondContact O-CE2 3.34Å; L630-L662 HydrophobicContact CD2-CD2 3.93Å; L630-L684 HydrophobicContact CD2-CD2 4.35Å; L630-L684 HydrophobicContact CG-CD2 4.33Å
631	A	95	Very high	91.7	Very high	2 Å²	2	37 Å²	37	2%	0.017	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-42.3	176	0	0	0	0	0	112.2	L627 C628 L629 V633 Y634 L635 K638 Y665 V682	L627-A631 WeakPolarHBondContact O-CB 3.48Å; L627-A631 PolarHBondContact O-N 2.83Å; C628-A631 WeakPolarHBondContact O-CB 3.48Å; C628-A631 PolarHBondContact O-N 3.27Å; L629-A631 VanDerWaalsContact C-N 3.31Å; L629-A631 PolarHBondContact O-N 2.97Å; A631-V633 PolarHBondContact O-N 2.8Å; A631-V633 VanDerWaalsContact O-N 3.13Å; A631-Y634 CarbonylContact O-C 3.6Å; A631-Y634 PolarHBondContact O-N 2.93Å; A631-L635 HydrophobicContact CB-CD1 4.15Å; A631-L635 WeakPolarHBondContact O-CB 3.45Å; A631-L635 WeakPolarHBondContact O-CG 3.37Å; A631-L635 PolarHBondContact O-N 3.06Å; A631-K638 HydrophobicContact CB-CD 4.21Å; A631-Y665 HydrophobicContact CB-CE1 3.68Å; A631-Y665 VanDerWaalsContact CB-OH 3.26Å; A631-Y665 WeakPolarHBondContact CB-OH 3.48Å; A631-V682 HydrophobicContact CB-CG1 4.45Å
632	K	93.3	Very high	91.3	Very high	25 Å²	25	38 Å²	38	11%	0.109	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-23.7	-177.3	-178.9	66	-155.8	68.8	0	113.4	S556 A557 C628 L629 Y634 L635 D636 K638	S556-K632 PolarHBondContact O-NZ 2.92Å; A557-K632 HydrophobicContact CB-CB 3.91Å; A557-K632 HydrophobicContact CB-CG 3.79Å; C628-K632 WeakPolarHBondContact O-CB 3.24Å; C628-K632 PolarHBondContact O-N 2.82Å; L629-K632 PolarHBondContact O-N 2.87Å; K632-Y634 PolarHBondContact O-N 2.88Å; K632-L635 PolarHBondContact NZ-O 2.85Å; K632-D636 WeakPolarHBondContact CE-O 3.41Å; K632-D636 PolarHBondContact NZ-O 2.88Å; K632-K638 HydrophobicContact CD-CB 3.99Å; K632-K638 VanDerWaalsContact CD-O 3.22Å; K632-K638 WeakPolarHBondContact CD-O 3.33Å; K632-K638 WeakPolarHBondContact CE-O 3.45Å
633	V	92.3	Very high	91.1	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.012	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.6	175	-179.2	0	0	0	0	112.3	I544 S553 W554 F555 A557 Y559 L630 A631	I544-V633 HydrophobicContact CD1-CB 4.23Å; I544-V633 HydrophobicContact CD1-CG1 3.96Å; I544-V633 HydrophobicContact CD1-CG2 3.72Å; S553-V633 WeakPolarHBondContact OG-CG1 3.42Å; W554-V633 WeakPolarHBondContact CB-O 3.36Å; W554-V633 PolarHBondContact N-O 3.47Å; F555-V633 PolarHBondContact N-O 2.86Å; A557-V633 HydrophobicContact CB-CG2 3.53Å; Y559-V633 HydrophobicContact CE2-CG2 3.84Å; L630-V633 WeakPolarHBondContact O-CB 3.39Å; A631-V633 PolarHBondContact O-N 2.8Å; A631-V633 VanDerWaalsContact O-N 3.13Å
634	Y	92.3	Very high	91	Very high	9 Å²	9	36.5 Å²	36.5	4%	0.035	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	0.7	-178.3	-46.2	-68.8	0	0	0	113.1	I551 W554 L630 A631 K632 L684 P685	I551-Y634 HydrophobicContact CG2-CE1 3.74Å; I551-Y634 WeakPolarHBondContact CG2-OH 3.28Å; W554-Y634 AromaticContact CD2-CD1 3.96Å; W554-Y634 HydrophobicContact CD2-CD1 3.96Å; W554-Y634 HydrophobicContact CE3-CD1 4.28Å; W554-Y634 HydrophobicContact CG-CD1 4.13Å; L630-Y634 HydrophobicContact CD1-CE2 4.02Å; L630-Y634 VanDerWaalsContact O-CD2 3.26Å; L630-Y634 WeakPolarHBondContact O-CD2 3.34Å; L630-Y634 WeakPolarHBondContact O-CE2 3.34Å; A631-Y634 CarbonylContact O-C 3.6Å; A631-Y634 PolarHBondContact O-N 2.93Å; K632-Y634 PolarHBondContact O-N 2.88Å; Y634-L684 HydrophobicContact CD2-CD2 4.07Å; Y634-L684 HydrophobicContact CE2-CD2 3.81Å; Y634-P685 HydrophobicContact CD1-CG 3.56Å; Y634-P685 HydrophobicContact CE1-CG 3.62Å; Y634-P685 HydrophobicContact CG-CG 4.22Å
635	L	89	Confident	90.8	Very high	27 Å²	27	39.3 Å²	39.3	14%	0.141	19%	0.192	C	C	.	.			trans	-124.7	115.4	176.4	-63.9	176.4	0	0	0	109.9	A631 K632 K638 C680 V682	A631-L635 HydrophobicContact CB-CD1 4.15Å; A631-L635 WeakPolarHBondContact O-CB 3.45Å; A631-L635 WeakPolarHBondContact O-CG 3.37Å; A631-L635 PolarHBondContact O-N 3.06Å; K632-L635 PolarHBondContact NZ-O 2.85Å; L635-K638 HydrophobicContact CB-CB 4.18Å; L635-K638 HydrophobicContact CD1-CB 4.45Å; L635-K638 HydrophobicContact CD1-CD 4.17Å; L635-C680 HydrophobicContact CD1-CB 4.46Å; L635-V682 HydrophobicContact CD1-CB 4.42Å
636	D	82.7	Confident	90.7	Very high	74 Å²	74	41 Å²	41	40%	0.396	21%	0.207	S	C	.	.	S	Bend	trans	-57.3	-60.3	178.7	-171.8	-29	0	0	0	111.4	F555 K632 K638	F555-D636 HydrophobicContact CD1-CB 3.8Å; F555-D636 HydrophobicContact CD2-CB 4.45Å; F555-D636 HydrophobicContact CE1-CB 3.58Å; F555-D636 HydrophobicContact CE2-CB 4.26Å; F555-D636 HydrophobicContact CG-CB 4.24Å; F555-D636 HydrophobicContact CZ-CB 3.83Å; K632-D636 WeakPolarHBondContact CE-O 3.41Å; K632-D636 PolarHBondContact NZ-O 2.88Å; D636-K638 PolarHBondContact O-N 2.96Å
637	H	78.9	Confident	90.6	Very high	124 Å²	124	40.9 Å²	40.9	57%	0.574	21%	0.205	S	C	*	.	S	Bend	trans	-93.3	8	-163.2	-57.3	-15.2	0	0	0	115.7	T639	H637-T639 PolarHBondContact O-N 3.06Å
638	K	86.4	Confident	90.6	Very high	20 Å²	20	41.7 Å²	41.7	9%	0.087	21%	0.21	C	C	.	.			trans	-63.5	122.8	177.1	179.6	165.6	176.4	53.4	0	110.3	C628 A631 K632 L635 D636 L640	C628-K638 WeakPolarHBondContact SG-CE 3.28Å; C628-K638 PolarHBondContact SG-NZ 2.7Å; A631-K638 HydrophobicContact CB-CD 4.21Å; K632-K638 HydrophobicContact CD-CB 3.99Å; K632-K638 VanDerWaalsContact CD-O 3.22Å; K632-K638 WeakPolarHBondContact CD-O 3.33Å; K632-K638 WeakPolarHBondContact CE-O 3.45Å; L635-K638 HydrophobicContact CB-CB 4.18Å; L635-K638 HydrophobicContact CD1-CB 4.45Å; L635-K638 HydrophobicContact CD1-CD 4.17Å; D636-K638 PolarHBondContact O-N 2.96Å; K638-L640 WeakPolarHBondContact CE-O 3.15Å; K638-L640 PolarHBondContact NZ-O 3.16Å
639	T	79.8	Confident	90.6	Very high	91 Å²	91	41.7 Å²	41.7	56%	0.558	21%	0.209	S	C	*	.			trans	-100.5	-42	-174.6	44.9	0	0	0	0	113.4	H637 Y641	H637-T639 PolarHBondContact O-N 3.06Å; T639-Y641 WeakPolarHBondContact O-CD1 3.21Å; T639-Y641 WeakPolarHBondContact O-CE1 3.49Å
640	L	83.3	Confident	90.8	Very high	70 Å²	70	41.7 Å²	41.7	37%	0.366	21%	0.209	S	C	.	.			trans	-93.5	129.6	-178.3	-61.2	173.9	0	0	0	111.1	K638 F647	K638-L640 WeakPolarHBondContact CE-O 3.15Å; K638-L640 PolarHBondContact NZ-O 3.16Å; L640-F647 HydrophobicContact CD1-CE2 3.91Å; L640-F647 HydrophobicContact CD1-CZ 3.76Å
641	Y	86.3	Confident	90.9	Very high	62 Å²	62	41.6 Å²	41.6	24%	0.243	21%	0.209	C	C	.	.	S	Bend	trans	-154.1	-14.9	-178.7	50.6	-92.6	0	0	0	115.4	P558 L629 T639	P558-Y641 HydrophobicContact CB-CE2 4.12Å; P558-Y641 HydrophobicContact CG-CD1 4.23Å; P558-Y641 HydrophobicContact CG-CD2 3.82Å; P558-Y641 HydrophobicContact CG-CE1 3.8Å; P558-Y641 HydrophobicContact CG-CE2 3.32Å; P558-Y641 HydrophobicContact CG-CG 4.26Å; L629-Y641 HydrophobicContact CD2-CD2 4.04Å; T639-Y641 WeakPolarHBondContact O-CD1 3.21Å; T639-Y641 WeakPolarHBondContact O-CE1 3.49Å
642	Y	88.7	Confident	91	Very high	104 Å²	104	41.5 Å²	41.5	41%	0.408	21%	0.208	S	C	.	.	S	Bend	trans	-99.4	-42.6	166.3	-63.1	-40.6	0	0	0	111.6	P558 Q625 V644	P558-Y642 PolarHBondContact O-OH 3.36Å; Q625-Y642 PolarHBondContact NE2-O 3.26Å; Y642-V644 PolarHBondContact O-N 3.46Å
643	D	91.4	Very high	91.2	Very high	97 Å²	97	40.3 Å²	40.3	52%	0.519	20%	0.203	S	C	.	.			trans	-77.6	102.1	173.9	-34.4	-63.3	0	0	0	108.1
644	V	94.9	Very high	91.2	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.217	C	C	.	.			trans	-122.5	-18.2	-174	-66.5	0	0	0	0	112.2	G617 K621 C624 Q625 Y642 P646 F647 F649	G617-V644 WeakPolarHBondContact CA-O 3.29Å; K621-V644 HydrophobicContact CB-CG2 4.33Å; K621-V644 HydrophobicContact CG-CG2 3.87Å; C624-V644 HydrophobicContact CB-CB 3.9Å; C624-V644 HydrophobicContact CB-CG1 4.13Å; C624-V644 HydrophobicContact CB-CG2 3.95Å; Q625-V644 HydrophobicContact CG-CG1 4.02Å; Q625-V644 HydrophobicContact CG-CG2 3.96Å; Y642-V644 PolarHBondContact O-N 3.46Å; V644-P646 VanDerWaalsContact C-N 3.33Å; V644-F647 WeakPolarHBondContact O-CB 3.27Å; V644-F647 PolarHBondContact O-N 3.12Å; V644-F649 HydrophobicContact CB-CE2 4.11Å; V644-F649 HydrophobicContact CB-CZ 4.04Å; V644-F649 HydrophobicContact CG1-CZ 4.06Å
645	E	93.6	Very high	91.2	Very high	59 Å²	59	43.7 Å²	43.7	28%	0.276	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-38	176.3	-65.4	93.5	133.1	0	0	114.8	C618 K621 F647 K670	C618-E645 VanDerWaalsContact SG-CB 3.59Å; C618-E645 PolarHBondContact SG-O 2.87Å; C618-E645 VanDerWaalsContact SG-O 3.33Å; K621-E645 WeakPolarHBondContact CD-OE1 3.47Å; K621-E645 WeakPolarHBondContact CE-OE1 3.47Å; K621-E645 IonicContact NZ-OE1 2.66Å; K621-E645 PolarHBondContact NZ-OE1 3.34Å; E645-F647 PolarHBondContact O-N 3.4Å; E645-K670 WeakPolarHBondContact O-CE 3.44Å; E645-K670 PolarHBondContact O-NZ 2.95Å
646	P	94.2	Very high	91.3	Very high	71 Å²	71	46.3 Å²	46.3	46%	0.461	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7	175.9	-20.2	34.2	0	0	0	114.9	V644 K670	V644-P646 VanDerWaalsContact C-N 3.33Å; P646-K670 WeakPolarHBondContact O-CG 3.48Å; P646-K670 PolarHBondContact O-N 3.28Å
647	F	95.9	Very high	91.5	Very high	12 Å²	12	46.5 Å²	46.5	5%	0.053	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	144	-167.7	-59.2	-86.5	0	0	0	113.8	G617 L640 V644 E645 F649 K668 E669	G617-F647 PolarHBondContact N-O 2.96Å; L640-F647 HydrophobicContact CD1-CE2 3.91Å; L640-F647 HydrophobicContact CD1-CZ 3.76Å; V644-F647 WeakPolarHBondContact O-CB 3.27Å; V644-F647 PolarHBondContact O-N 3.12Å; E645-F647 PolarHBondContact O-N 3.4Å; F647-F649 HydrophobicContact CB-CD2 4.22Å; F647-F649 HydrophobicContact CB-CE2 3.55Å; F647-F649 HydrophobicContact CB-CZ 3.91Å; F647-K668 CarbonylContact C-O 3.59Å; F647-K668 VanDerWaalsContact CA-O 3.29Å; F647-K668 WeakPolarHBondContact CA-O 3.22Å; F647-E669 HydrophobicContact CD1-CG 4.05Å; F647-E669 HydrophobicContact CE1-CG 3.55Å; F647-E669 HydrophobicContact CZ-CG 4.33Å
648	L	96.8	Very high	91.9	Very high	19 Å²	19	49.2 Å²	49.2	10%	0.099	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	144.1	157.3	-60.6	179.5	0	0	0	109.1	D616 Y650 S667 K668 K670	D616-L648 HydrophobicContact CB-CD2 4.12Å; L648-Y650 HydrophobicContact CB-CE2 4.01Å; L648-Y650 WeakPolarHBondContact CD1-OH 3.35Å; L648-S667 CarbonylContact O-C 3.49Å; L648-S667 WeakPolarHBondContact O-CA 3.15Å; L648-K668 PolarHBondContact N-O 3.17Å; L648-K668 PolarHBondContact O-N 3.1Å; L648-K670 HydrophobicContact CD2-CG 4.29Å; L648-K670 HydrophobicContact CG-CG 3.98Å
649	F	98.1	Very high	92.1	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	113.9	-178.5	-65.8	-102.4	0	0	0	110	F613 V615 C624 L627 V644 F647 V651 Y665	F613-F649 VanDerWaalsContact O-O 3.14Å; V615-F649 HydrophobicContact CB-CB 4.2Å; V615-F649 PolarHBondContact N-O 2.81Å; V615-F649 WeakPolarHBondContact O-CB 3.4Å; V615-F649 PolarHBondContact O-N 2.93Å; C624-F649 HydrophobicContact CB-CD2 3.98Å; C624-F649 HydrophobicContact CB-CE1 4.34Å; C624-F649 HydrophobicContact CB-CE2 3.63Å; C624-F649 HydrophobicContact CB-CG 4.48Å; C624-F649 HydrophobicContact CB-CZ 3.84Å; C624-F649 VanDerWaalsContact SG-CD2 3.52Å; L627-F649 HydrophobicContact CD2-CB 4.45Å; L627-F649 HydrophobicContact CD2-CD1 3.91Å; V644-F649 HydrophobicContact CB-CE2 4.11Å; V644-F649 HydrophobicContact CB-CZ 4.04Å; V644-F649 HydrophobicContact CG1-CZ 4.06Å; F647-F649 HydrophobicContact CB-CD2 4.22Å; F647-F649 HydrophobicContact CB-CE2 3.55Å; F647-F649 HydrophobicContact CB-CZ 3.91Å; F649-V651 HydrophobicContact CB-CG2 4.38Å; F649-V651 PolarHBondContact O-N 2.96Å; F649-Y665 AromaticContact CD1-CD2 3.78Å; F649-Y665 HydrophobicContact CD1-CD2 3.78Å; F649-Y665 AromaticContact CD1-CE2 3.58Å; F649-Y665 HydrophobicContact CD1-CE2 3.58Å; F649-Y665 AromaticContact CE1-CE2 3.94Å; F649-Y665 HydrophobicContact CE1-CE2 3.94Å
650	Y	98.2	Very high	92.8	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.016	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	95.8	178.7	-65.7	-75.3	0	0	0	109.7	I604 F613 E614 L648 Y665 F666 K668 F699 L703	I604-Y650 HydrophobicContact CD1-CD1 3.8Å; I604-Y650 HydrophobicContact CD1-CE1 3.74Å; F613-Y650 WeakPolarHBondContact O-CA 3.11Å; E614-Y650 HydrophobicContact CB-CD1 4.34Å; E614-Y650 HydrophobicContact CB-CE1 3.98Å; E614-Y650 HydrophobicContact CG-CD1 4.42Å; E614-Y650 HydrophobicContact CG-CE1 3.72Å; E614-Y650 WeakPolarHBondContact OE2-CE1 3.21Å; E614-Y650 VanDerWaalsContact OE2-CZ 3.22Å; E614-Y650 PolarHBondContact OE2-OH 3.31Å; L648-Y650 HydrophobicContact CB-CE2 4.01Å; L648-Y650 WeakPolarHBondContact CD1-OH 3.35Å; Y650-Y665 WeakPolarHBondContact O-CA 3.34Å; Y650-Y665 WeakPolarHBondContact O-CB 3.49Å; Y650-F666 VanDerWaalsContact CB-CZ 3.48Å; Y650-F666 HydrophobicContact CD1-CZ 4.43Å; Y650-F666 AromaticContact CD2-CD2 3.88Å; Y650-F666 HydrophobicContact CD2-CD2 3.88Å; Y650-F666 HydrophobicContact CD2-CE1 4.34Å; Y650-F666 AromaticContact CD2-CE2 3.28Å; Y650-F666 HydrophobicContact CD2-CE2 3.28Å; Y650-F666 AromaticContact CD2-CZ 3.55Å; Y650-F666 HydrophobicContact CD2-CZ 3.55Å; Y650-F666 HydrophobicContact CE2-CE2 4.08Å; Y650-F666 HydrophobicContact CE2-CZ 4.45Å; Y650-F666 HydrophobicContact CG-CD2 4.44Å; Y650-F666 HydrophobicContact CG-CE1 4.01Å; Y650-F666 AromaticContact CG-CE2 3.79Å; Y650-F666 HydrophobicContact CG-CE2 3.79Å; Y650-F666 AromaticContact CG-CZ 3.54Å; Y650-F666 HydrophobicContact CG-CZ 3.54Å; Y650-F666 PolarHBondContact N-O 2.86Å; Y650-F666 PolarHBondContact O-N 3.33Å; Y650-K668 HydrophobicContact CE2-CB 4.11Å; Y650-K668 HydrophobicContact CE2-CD 4.48Å; Y650-F699 HydrophobicContact CD1-CE1 4.31Å; Y650-L703 HydrophobicContact CD1-CD1 3.9Å; Y650-L703 HydrophobicContact CD2-CD1 4.03Å; Y650-L703 HydrophobicContact CE1-CD1 3.55Å; Y650-L703 HydrophobicContact CE1-CD2 4.45Å; Y650-L703 HydrophobicContact CE2-CD1 3.7Å; Y650-L703 HydrophobicContact CG-CD1 4.12Å; Y650-L703 VanDerWaalsContact CZ-CD1 3.46Å
651	V	98	Very high	93.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.4	-170.3	-173	0	0	0	0	110.6	P599 F612 F613 V615 Y623 L627 F649 T653 L662	P599-V651 HydrophobicContact CB-CB 4.17Å; P599-V651 HydrophobicContact CB-CG1 4.18Å; P599-V651 HydrophobicContact CB-CG2 4.41Å; P599-V651 HydrophobicContact CG-CB 3.95Å; P599-V651 HydrophobicContact CG-CG1 3.59Å; F612-V651 WeakPolarHBondContact CA-O 3.44Å; F613-V651 HydrophobicContact CB-CB 4.48Å; F613-V651 PolarHBondContact N-O 3.06Å; F613-V651 PolarHBondContact O-N 3.36Å; V615-V651 HydrophobicContact CB-CG2 4.49Å; V615-V651 HydrophobicContact CG2-CG2 3.94Å; Y623-V651 HydrophobicContact CE1-CG2 4.3Å; L627-V651 HydrophobicContact CD2-CG2 3.99Å; F649-V651 HydrophobicContact CB-CG2 4.38Å; F649-V651 PolarHBondContact O-N 2.96Å; V651-T653 HydrophobicContact CG1-CG2 4.46Å; V651-L662 HydrophobicContact CG1-CD1 3.46Å; V651-L662 VanDerWaalsContact CG1-CD1 3.46Å
652	L	97.1	Very high	93.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.5	176.8	175	59.9	0	0	0	110.4	S611 F612 V663 G664 F692 L695 Q696	S611-L652 WeakPolarHBondContact O-CA 3.38Å; S611-L652 WeakPolarHBondContact O-CD1 3.26Å; F612-L652 HydrophobicContact CD1-CB 4.18Å; F612-L652 HydrophobicContact CD2-CD1 4.17Å; F612-L652 HydrophobicContact CE1-CB 3.82Å; F612-L652 HydrophobicContact CE1-CD1 4.36Å; F612-L652 HydrophobicContact CE1-CG 4.49Å; F612-L652 HydrophobicContact CE2-CD1 3.82Å; F612-L652 HydrophobicContact CZ-CB 4.15Å; F612-L652 HydrophobicContact CZ-CD1 3.93Å; F612-L652 HydrophobicContact CZ-CD2 4.28Å; F612-L652 HydrophobicContact CZ-CG 4.33Å; L652-V663 HydrophobicContact CD2-CB 4.45Å; L652-V663 HydrophobicContact CD2-CG1 4.01Å; L652-V663 HydrophobicContact CG-CB 4.13Å; L652-V663 HydrophobicContact CG-CG1 4.23Å; L652-V663 WeakPolarHBondContact O-CB 3.43Å; L652-V663 PolarHBondContact O-N 3.43Å; L652-G664 PolarHBondContact N-O 3.31Å; L652-G664 PolarHBondContact O-N 2.85Å; L652-F692 HydrophobicContact CD2-CB 3.89Å; L652-F692 HydrophobicContact CD2-CD1 4.06Å; L652-F692 HydrophobicContact CD2-CG 4.33Å; L652-L695 HydrophobicContact CD1-CD2 3.92Å; L652-L695 HydrophobicContact CD2-CD2 4.1Å; L652-Q696 HydrophobicContact CB-CG 4.35Å; L652-Q696 HydrophobicContact CD2-CG 3.76Å
653	T	96.6	Very high	94.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	157.3	176.8	62.5	0	0	0	0	113.4	P599 L610 S611 F613 V651 N655 C660 H661	P599-T653 HydrophobicContact CG-CG2 3.7Å; L610-T653 WeakPolarHBondContact CA-O 3.35Å; S611-T653 PolarHBondContact N-O 2.93Å; S611-T653 PolarHBondContact O-N 3.4Å; F613-T653 HydrophobicContact CD2-CG2 4.06Å; F613-T653 HydrophobicContact CE2-CG2 4.08Å; V651-T653 HydrophobicContact CG1-CG2 4.46Å; T653-N655 PolarHBondContact OG1-OD1 2.98Å; T653-C660 HydrophobicContact CG2-CB 3.9Å; T653-H661 CarbonylContact C-O 3.54Å; T653-H661 WeakPolarHBondContact CA-O 3.49Å; T653-H661 WeakPolarHBondContact CB-O 3.35Å
654	M	93.4	Very high	94.5	Very high	65 Å²	65	30.8 Å²	30.8	32%	0.32	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.5	163.6	179.5	174.7	-73.5	0	0	108.5	S609 L610 H661 V663 Y687 F692	S609-M654 CarbonylContact O-C 3.54Å; S609-M654 VanDerWaalsContact O-CA 3.31Å; S609-M654 WeakPolarHBondContact O-CA 3.48Å; L610-M654 HydrophobicContact CD2-CB 4.41Å; L610-M654 HydrophobicContact CD2-CE 4.41Å; M654-H661 PolarHBondContact N-O 2.85Å; M654-H661 WeakPolarHBondContact O-CB 3.29Å; M654-H661 PolarHBondContact O-CD2 3.29Å; M654-H661 PolarHBondContact O-N 3.19Å; M654-V663 HydrophobicContact CB-CG2 3.65Å; M654-Y687 HydrophobicContact SD-CE1 4.44Å; M654-F692 HydrophobicContact CE-CE1 4.33Å; M654-F692 HydrophobicContact CE-CE2 4.34Å; M654-F692 HydrophobicContact CE-CZ 3.59Å
655	N	92.5	Very high	94.7	Very high	17 Å²	17	30.8 Å²	30.8	9%	0.091	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.3	-166	-51.9	-20.7	0	0	0	110.5	R606 S609 S611 T653 G659 C660	R606-N655 PolarHBondContact NH1-ND2 2.96Å; S609-N655 PolarHBondContact O-N 3.03Å; S611-N655 PolarHBondContact OG-ND2 2.89Å; T653-N655 PolarHBondContact OG1-OD1 2.98Å; N655-G659 WeakPolarHBondContact CA-O 3.47Å; N655-C660 WeakPolarHBondContact OD1-CB 3.25Å; N655-C660 PolarHBondContact OD1-SG 2.91Å; N655-C660 VanDerWaalsContact OD1-SG 3.36Å
656	D	90.6	Very high	94.9	Very high	81 Å²	81	28 Å²	28	43%	0.433	15%	0.153	S	C	.	.			trans	-135.6	-164.7	169.3	74.6	25.6	0	0	0	111.4	Y658 G659 H661	D656-Y658 PolarHBondContact O-N 3.26Å; D656-Y658 WeakPolarHBondContact OD1-CB 3.39Å; D656-Y658 WeakPolarHBondContact OD1-CD2 3.35Å; D656-Y658 PolarHBondContact OD1-N 3.13Å; D656-G659 PolarHBondContact N-O 3.28Å; D656-H661 IonicContact OD1-CD2 3.51Å; D656-H661 IonicContact OD1-NE2 3.07Å; D656-H661 PolarHBondContact OD1-NE2 2.98Å; D656-H661 IonicContact OD2-NE2 2.72Å
657	A	88.3	Confident	95	Very high	78 Å²	78	24.7 Å²	24.7	65%	0.645	13%	0.131	S	C	*	.	S	Bend	trans	-69.6	-14.2	-178.6	0	0	0	0	0	114.7	P454	P454-A657 VanDerWaalsContact CG-O 3.31Å; P454-A657 WeakPolarHBondContact CG-O 3.43Å
658	Y	86.3	Confident	95	Very high	181 Å²	181	25.3 Å²	25.3	71%	0.71	13%	0.134	S	C	*	.	S	Bend	trans	-93.5	-31.8	177.1	-59.5	-77.3	0	0	0	112.6	F597 D656	F597-Y658 WeakPolarHBondContact CD1-O 3.41Å; D656-Y658 PolarHBondContact O-N 3.26Å; D656-Y658 WeakPolarHBondContact OD1-CB 3.39Å; D656-Y658 WeakPolarHBondContact OD1-CD2 3.35Å; D656-Y658 PolarHBondContact OD1-N 3.13Å
659	G	91.2	Very high	94.8	Very high	11 Å²	11	27 Å²	27	11%	0.113	14%	0.142	C	C	.	.			trans	162.3	-161	176	0	0	0	0	0	114.5	F597 N655 D656 H661	F597-G659 CarbonylContact O-C 3.59Å; F597-G659 WeakPolarHBondContact O-CA 3.49Å; N655-G659 WeakPolarHBondContact CA-O 3.47Å; D656-G659 PolarHBondContact N-O 3.28Å; G659-H661 PolarHBondContact O-CD2 3.35Å
660	C	94.7	Very high	94.6	Very high	17 Å²	17	29.2 Å²	29.2	12%	0.115	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	96.5	179.3	-56.7	0	0	0	0	108.9	F597 H598 F613 T653 N655	F597-C660 PolarHBondContact O-N 3.2Å; H598-C660 HydrophobicContact CB-CB 3.75Å; F613-C660 HydrophobicContact CE2-CB 4.1Å; F613-C660 HydrophobicContact CZ-CB 4.33Å; T653-C660 HydrophobicContact CG2-CB 3.9Å; N655-C660 WeakPolarHBondContact OD1-CB 3.25Å; N655-C660 PolarHBondContact OD1-SG 2.91Å; N655-C660 VanDerWaalsContact OD1-SG 3.36Å
661	H	94.9	Very high	94.1	Very high	19 Å²	19	35.1 Å²	35.1	9%	0.088	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.3	-172.4	-61.2	-94.5	0	0	0	111.6	E573 F574 T653 M654 D656 G659 V663	E573-H661 IonicContact OE2-CE1 3.5Å; E573-H661 PolarHBondContact OE2-CE1 3.23Å; E573-H661 IonicContact OE2-CG 2.62Å; E573-H661 IonicContact OE2-ND1 2.67Å; E573-H661 PolarHBondContact OE2-ND1 3.48Å; F574-H661 AromaticContact CE1-CE1 3.99Å; F574-H661 AromaticContact CZ-CE1 3.72Å; T653-H661 CarbonylContact C-O 3.54Å; T653-H661 WeakPolarHBondContact CA-O 3.49Å; T653-H661 WeakPolarHBondContact CB-O 3.35Å; M654-H661 PolarHBondContact N-O 2.85Å; M654-H661 WeakPolarHBondContact O-CB 3.29Å; M654-H661 PolarHBondContact O-CD2 3.29Å; M654-H661 PolarHBondContact O-N 3.19Å; D656-H661 IonicContact OD1-CD2 3.51Å; D656-H661 IonicContact OD1-NE2 3.07Å; D656-H661 PolarHBondContact OD1-NE2 2.98Å; D656-H661 IonicContact OD2-NE2 2.72Å; G659-H661 PolarHBondContact O-CD2 3.35Å; H661-V663 PolarHBondContact O-N 3.19Å
662	L	97.1	Very high	93.5	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.052	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	122.7	-179.5	178.8	64.4	0	0	0	112.7	L576 L627 L630 V651 G664 L684	L576-L662 HydrophobicContact CD1-CD2 4.23Å; L576-L662 HydrophobicContact CD2-CD2 3.72Å; L627-L662 HydrophobicContact CD1-CD1 4.45Å; L627-L662 HydrophobicContact CD1-CD2 3.97Å; L630-L662 HydrophobicContact CD2-CD2 3.93Å; V651-L662 HydrophobicContact CG1-CD1 3.46Å; V651-L662 VanDerWaalsContact CG1-CD1 3.46Å; L662-G664 WeakPolarHBondContact CD1-O 3.3Å; L662-L684 HydrophobicContact CD2-CD1 3.99Å; L662-L684 HydrophobicContact CG-CD1 3.94Å
663	V	96.1	Very high	92.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-39.4	174.1	171.3	0	0	0	0	111	L652 M654 H661 T683 L684 Y687 F692	L652-V663 HydrophobicContact CD2-CB 4.45Å; L652-V663 HydrophobicContact CD2-CG1 4.01Å; L652-V663 HydrophobicContact CG-CB 4.13Å; L652-V663 HydrophobicContact CG-CG1 4.23Å; L652-V663 WeakPolarHBondContact O-CB 3.43Å; L652-V663 PolarHBondContact O-N 3.43Å; M654-V663 HydrophobicContact CB-CG2 3.65Å; H661-V663 PolarHBondContact O-N 3.19Å; V663-T683 HydrophobicContact CG1-CG2 4.49Å; V663-L684 PolarHBondContact O-N 2.74Å; V663-Y687 HydrophobicContact CB-CD1 4.42Å; V663-Y687 HydrophobicContact CB-CG 4.4Å; V663-Y687 HydrophobicContact CG1-CD1 4.03Å; V663-Y687 HydrophobicContact CG1-CG 3.91Å; V663-Y687 HydrophobicContact CG2-CD1 3.95Å; V663-Y687 HydrophobicContact CG2-CE1 3.95Å; V663-Y687 HydrophobicContact CG2-CG 4.39Å; V663-F692 HydrophobicContact CG1-CB 3.85Å; V663-F692 HydrophobicContact CG1-CD1 4.06Å; V663-F692 HydrophobicContact CG1-CD2 3.72Å; V663-F692 HydrophobicContact CG1-CE2 4.28Å; V663-F692 HydrophobicContact CG1-CG 3.59Å
664	G	96.9	Very high	92	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179	-179.5	-177.8	0	0	0	0	0	111.1	L652 L662 V682	L652-G664 PolarHBondContact N-O 3.31Å; L652-G664 PolarHBondContact O-N 2.85Å; L662-G664 WeakPolarHBondContact CD1-O 3.3Å; G664-V682 VanDerWaalsContact CA-O 3.24Å; G664-V682 WeakPolarHBondContact CA-O 3.29Å
665	Y	97.9	Very high	91.7	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	168.7	164.9	79.7	-75.9	0	0	0	110.5	L627 A631 F649 Y650 V682	L627-Y665 HydrophobicContact CD1-CD1 3.53Å; L627-Y665 HydrophobicContact CD1-CE1 3.81Å; L627-Y665 HydrophobicContact CD1-CG 4.18Å; L627-Y665 HydrophobicContact CD2-CD1 3.94Å; L627-Y665 HydrophobicContact CD2-CD2 3.97Å; L627-Y665 HydrophobicContact CD2-CE1 4.28Å; L627-Y665 HydrophobicContact CD2-CE2 4.35Å; L627-Y665 HydrophobicContact CD2-CG 3.78Å; L627-Y665 HydrophobicContact CG-CD1 3.73Å; L627-Y665 HydrophobicContact CG-CD2 4.44Å; L627-Y665 HydrophobicContact CG-CE1 3.72Å; L627-Y665 HydrophobicContact CG-CE2 4.47Å; L627-Y665 HydrophobicContact CG-CG 4.1Å; A631-Y665 HydrophobicContact CB-CE1 3.68Å; A631-Y665 VanDerWaalsContact CB-OH 3.26Å; A631-Y665 WeakPolarHBondContact CB-OH 3.48Å; F649-Y665 AromaticContact CD1-CD2 3.78Å; F649-Y665 HydrophobicContact CD1-CD2 3.78Å; F649-Y665 AromaticContact CD1-CE2 3.58Å; F649-Y665 HydrophobicContact CD1-CE2 3.58Å; F649-Y665 AromaticContact CE1-CE2 3.94Å; F649-Y665 HydrophobicContact CE1-CE2 3.94Å; Y650-Y665 WeakPolarHBondContact O-CA 3.34Å; Y650-Y665 WeakPolarHBondContact O-CB 3.49Å; Y665-V682 HydrophobicContact CD1-CG1 3.47Å; Y665-V682 VanDerWaalsContact CD1-CG1 3.47Å; Y665-V682 HydrophobicContact CE1-CG1 3.38Å; Y665-V682 PolarHBondContact N-O 3.26Å; Y665-V682 VanDerWaalsContact N-O 3.12Å; Y665-V682 PolarHBondContact O-N 3.24Å
666	F	97.5	Very high	91.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.4	153.5	69.8	-86.6	0	0	0	110.7	F612 Y650 V678 C680 I681 Q696 F699 L703	F612-F666 HydrophobicContact CE1-CE1 4.13Å; Y650-F666 VanDerWaalsContact CB-CZ 3.48Å; Y650-F666 HydrophobicContact CD1-CZ 4.43Å; Y650-F666 AromaticContact CD2-CD2 3.88Å; Y650-F666 HydrophobicContact CD2-CD2 3.88Å; Y650-F666 HydrophobicContact CD2-CE1 4.34Å; Y650-F666 AromaticContact CD2-CE2 3.28Å; Y650-F666 HydrophobicContact CD2-CE2 3.28Å; Y650-F666 AromaticContact CD2-CZ 3.55Å; Y650-F666 HydrophobicContact CD2-CZ 3.55Å; Y650-F666 HydrophobicContact CE2-CE2 4.08Å; Y650-F666 HydrophobicContact CE2-CZ 4.45Å; Y650-F666 HydrophobicContact CG-CD2 4.44Å; Y650-F666 HydrophobicContact CG-CE1 4.01Å; Y650-F666 AromaticContact CG-CE2 3.79Å; Y650-F666 HydrophobicContact CG-CE2 3.79Å; Y650-F666 AromaticContact CG-CZ 3.54Å; Y650-F666 HydrophobicContact CG-CZ 3.54Å; Y650-F666 PolarHBondContact N-O 2.86Å; Y650-F666 PolarHBondContact O-N 3.33Å; F666-V678 HydrophobicContact CB-CG1 4.2Å; F666-V678 HydrophobicContact CD2-CG2 3.79Å; F666-V678 HydrophobicContact CE2-CG2 4.29Å; F666-V678 HydrophobicContact CG-CG2 4.34Å; F666-C680 CarbonylContact C-O 3.55Å; F666-C680 WeakPolarHBondContact CA-O 3.43Å; F666-C680 WeakPolarHBondContact CB-O 3.28Å; F666-I681 HydrophobicContact CB-CB 3.91Å; F666-I681 HydrophobicContact CB-CD1 4.4Å; F666-I681 HydrophobicContact CB-CG1 4.05Å; F666-Q696 HydrophobicContact CD1-CB 4.16Å; F666-F699 HydrophobicContact CE1-CB 4.21Å; F666-F699 HydrophobicContact CE1-CD1 4.07Å; F666-F699 HydrophobicContact CZ-CD1 4.02Å; F666-L703 HydrophobicContact CE2-CD1 4.28Å; F666-L703 HydrophobicContact CZ-CD1 3.89Å
667	S	96.6	Very high	92	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.007	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	150.8	171.7	57.9	0	0	0	0	110.9	L648 S679 C680	L648-S667 CarbonylContact O-C 3.49Å; L648-S667 WeakPolarHBondContact O-CA 3.15Å; S667-S679 PolarHBondContact O-N 2.69Å; S667-C680 PolarHBondContact N-O 3.15Å
668	K	95.6	Very high	92.4	Very high	26 Å²	26	43.3 Å²	43.3	11%	0.113	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	139.5	178	-177.3	-173.4	170.1	-179	0	108.6	F647 L648 Y650 E707	F647-K668 CarbonylContact C-O 3.59Å; F647-K668 VanDerWaalsContact CA-O 3.29Å; F647-K668 WeakPolarHBondContact CA-O 3.22Å; L648-K668 PolarHBondContact N-O 3.17Å; L648-K668 PolarHBondContact O-N 3.1Å; Y650-K668 HydrophobicContact CE2-CB 4.11Å; Y650-K668 HydrophobicContact CE2-CD 4.48Å; K668-E707 IonicContact NZ-OE1 2.73Å; K668-E707 PolarHBondContact NZ-OE1 3.08Å; K668-E707 IonicContact NZ-OE2 3.21Å; K668-E707 PolarHBondContact NZ-OE2 3.33Å
669	E	94.2	Very high	92.7	Very high	55 Å²	55	35.3 Å²	35.3	26%	0.257	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	137.8	170.2	-64.7	171.9	137.4	0	0	109.8	F647 Y671 S672 S679	F647-E669 HydrophobicContact CD1-CG 4.05Å; F647-E669 HydrophobicContact CE1-CG 3.55Å; F647-E669 HydrophobicContact CZ-CG 4.33Å; E669-Y671 PolarHBondContact O-N 3.13Å; E669-S672 WeakPolarHBondContact OE2-CB 3.42Å; E669-S672 PolarHBondContact OE2-OG 2.87Å; E669-S679 PolarHBondContact N-OG 3.31Å
670	K	92.4	Very high	92.9	Very high	46 Å²	46	35.9 Å²	35.9	20%	0.2	18%	0.183	C	C	.	.	S	Bend	trans	-61.1	-36.8	172.7	-71.1	169.5	178	174.1	0	111.6	D616 C618 E645 P646 L648	D616-K670 WeakPolarHBondContact OD1-CE 3.18Å; D616-K670 IonicContact OD1-NZ 3.31Å; D616-K670 PolarHBondContact OD1-NZ 2.77Å; D616-K670 IonicContact OD2-NZ 3.04Å; C618-K670 PolarHBondContact SG-NZ 3.05Å; E645-K670 WeakPolarHBondContact O-CE 3.44Å; E645-K670 PolarHBondContact O-NZ 2.95Å; P646-K670 WeakPolarHBondContact O-CG 3.48Å; P646-K670 PolarHBondContact O-N 3.28Å; L648-K670 HydrophobicContact CD2-CG 4.29Å; L648-K670 HydrophobicContact CG-CG 3.98Å
671	Y	89.1	Confident	93	Very high	128 Å²	128	36.7 Å²	36.7	50%	0.502	19%	0.186	S	C	.	.	S	Bend	trans	-131.4	114.1	176.5	-51.6	-72.3	0	0	0	108.3	E669 L824	E669-Y671 PolarHBondContact O-N 3.13Å; Y671-L824 WeakPolarHBondContact OH-CB 3.18Å; Y671-L824 WeakPolarHBondContact OH-CD1 3.48Å
672	S	84.2	Confident	93	Very high	28 Å²	28	36.4 Å²	36.4	20%	0.196	19%	0.185	C	C	.	.			trans	-124.3	109.3	179.6	-165.6	0	0	0	0	110.4	E669 Q674 K675 F676	E669-S672 WeakPolarHBondContact OE2-CB 3.42Å; E669-S672 PolarHBondContact OE2-OG 2.87Å; S672-Q674 PolarHBondContact O-N 2.77Å; S672-K675 PolarHBondContact O-N 2.96Å; S672-F676 WeakPolarHBondContact OG-CB 3.42Å; S672-F676 PolarHBondContact OG-N 3.14Å; S672-F676 VanDerWaalsContact OG-N 3.13Å
673	S	80.2	Confident	93	Very high	123 Å²	123	36.6 Å²	36.6	86%	0.86	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.3	179.4	56.3	0	0	0	0	113.3
674	Q	82.8	Confident	92.9	Very high	133 Å²	133	36.9 Å²	36.9	62%	0.621	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	9.6	176.8	-62.5	-178.4	55.6	0	0	112.9	S672 F676	S672-Q674 PolarHBondContact O-N 2.77Å; Q674-F676 VanDerWaalsContact C-N 3.29Å; Q674-F676 HydrophobicContact CB-CD1 4.37Å; Q674-F676 HydrophobicContact CB-CD2 4.04Å; Q674-F676 HydrophobicContact CB-CE1 4.04Å; Q674-F676 HydrophobicContact CB-CE2 3.68Å; Q674-F676 HydrophobicContact CB-CG 4.37Å; Q674-F676 HydrophobicContact CB-CZ 3.68Å; Q674-F676 HydrophobicContact CG-CE2 4.27Å; Q674-F676 HydrophobicContact CG-CZ 4.32Å; Q674-F676 PolarHBondContact O-N 3.29Å; Q674-F676 VanDerWaalsContact OE1-CZ 3.25Å
675	K	86.6	Confident	92.8	Very high	102 Å²	102	38.2 Å²	38.2	44%	0.443	20%	0.197	S	C	.	.			trans	53.1	41.7	-176.7	-58.7	-167.4	170.1	-166.6	0	113.3	S672 N677 E709	S672-K675 PolarHBondContact O-N 2.96Å; K675-N677 PolarHBondContact O-N 2.86Å; K675-E709 IonicContact NZ-OE1 2.72Å; K675-E709 PolarHBondContact NZ-OE1 2.99Å; K675-E709 IonicContact NZ-OE2 3.37Å; K675-E709 PolarHBondContact NZ-OE2 3.06Å
676	F	93.7	Very high	92.6	Very high	21 Å²	21	39.4 Å²	39.4	9%	0.092	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	120.2	175.4	-64.1	-43.7	0	0	0	111.2	S672 Q674 T712 E714	S672-F676 WeakPolarHBondContact OG-CB 3.42Å; S672-F676 PolarHBondContact OG-N 3.14Å; S672-F676 VanDerWaalsContact OG-N 3.13Å; Q674-F676 VanDerWaalsContact C-N 3.29Å; Q674-F676 HydrophobicContact CB-CD1 4.37Å; Q674-F676 HydrophobicContact CB-CD2 4.04Å; Q674-F676 HydrophobicContact CB-CE1 4.04Å; Q674-F676 HydrophobicContact CB-CE2 3.68Å; Q674-F676 HydrophobicContact CB-CG 4.37Å; Q674-F676 HydrophobicContact CB-CZ 3.68Å; Q674-F676 HydrophobicContact CG-CE2 4.27Å; Q674-F676 HydrophobicContact CG-CZ 4.32Å; Q674-F676 PolarHBondContact O-N 3.29Å; Q674-F676 VanDerWaalsContact OE1-CZ 3.25Å; F676-T712 CarbonylContact C-O 3.54Å; F676-T712 VanDerWaalsContact CA-O 3.24Å; F676-T712 WeakPolarHBondContact CA-O 3.49Å; F676-T712 HydrophobicContact CD1-CG2 3.72Å; F676-T712 HydrophobicContact CE1-CG2 3.86Å; F676-E714 HydrophobicContact CD1-CB 4.44Å; F676-E714 HydrophobicContact CD2-CB 4.08Å; F676-E714 HydrophobicContact CD2-CG 4.13Å; F676-E714 HydrophobicContact CE2-CB 4.3Å; F676-E714 HydrophobicContact CE2-CG 4Å; F676-E714 HydrophobicContact CG-CB 4.16Å; F676-E714 HydrophobicContact CZ-CG 4.45Å
677	N	95.3	Very high	92.4	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-8.9	175	71.1	-2.6	0	0	0	113.3	K675 S704 T712	K675-N677 PolarHBondContact O-N 2.86Å; N677-S704 VanDerWaalsContact CB-OG 3.27Å; N677-S704 WeakPolarHBondContact CB-OG 3.37Å; N677-S704 PolarHBondContact ND2-OG 3.48Å; N677-T712 PolarHBondContact N-O 3.42Å; N677-T712 PolarHBondContact OD1-O 2.86Å
678	V	96.3	Very high	92.1	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	122.4	174	175.9	0	0	0	0	109.8	F666 I681 S700 P713 E714 Y725	F666-V678 HydrophobicContact CB-CG1 4.2Å; F666-V678 HydrophobicContact CD2-CG2 3.79Å; F666-V678 HydrophobicContact CE2-CG2 4.29Å; F666-V678 HydrophobicContact CG-CG2 4.34Å; V678-I681 HydrophobicContact CG1-CB 3.84Å; V678-I681 HydrophobicContact CG1-CG2 4.02Å; V678-S700 WeakPolarHBondContact CG2-OG 3.31Å; V678-P713 HydrophobicContact CB-CB 4.28Å; V678-P713 WeakPolarHBondContact O-CA 3.45Å; V678-E714 WeakPolarHBondContact O-CB 3.32Å; V678-E714 PolarHBondContact O-N 2.96Å; V678-Y725 WeakPolarHBondContact CG2-OH 3.39Å
679	S	93.7	Very high	91.6	Very high	14 Å²	14	47.3 Å²	47.3	10%	0.098	25%	0.246	C	C	.	.	S	Bend	trans	-90.3	-42.5	171.5	-35.7	0	0	0	0	111.7	S667 E669 E714	S667-S679 PolarHBondContact O-N 2.69Å; E669-S679 PolarHBondContact N-OG 3.31Å; S679-E714 WeakPolarHBondContact CA-OE2 3.31Å; S679-E714 WeakPolarHBondContact CB-OE2 3.49Å
680	C	94.9	Very high	91.3	Very high	23 Å²	23	49.6 Å²	49.6	16%	0.155	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	141.8	176.5	-76.9	0	0	0	0	109.2	L635 F666 S667	L635-C680 HydrophobicContact CD1-CB 4.46Å; F666-C680 CarbonylContact C-O 3.55Å; F666-C680 WeakPolarHBondContact CA-O 3.43Å; F666-C680 WeakPolarHBondContact CB-O 3.28Å; S667-C680 PolarHBondContact N-O 3.15Å
681	I	96.1	Very high	91.1	Very high	34 Å²	34	48.2 Å²	48.2	17%	0.174	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134.4	174.8	179.1	166.6	0	0	0	110	F666 V678 Q696 I697 Y725	F666-I681 HydrophobicContact CB-CB 3.91Å; F666-I681 HydrophobicContact CB-CD1 4.4Å; F666-I681 HydrophobicContact CB-CG1 4.05Å; V678-I681 HydrophobicContact CG1-CB 3.84Å; V678-I681 HydrophobicContact CG1-CG2 4.02Å; I681-Q696 HydrophobicContact CD1-CB 3.72Å; I681-Q696 HydrophobicContact CG1-CB 4.39Å; I681-I697 HydrophobicContact CD1-CG1 3.71Å; I681-Y725 HydrophobicContact CG2-CE2 4.24Å
682	V	95.9	Very high	91.2	Very high	12 Å²	12	42.9 Å²	42.9	7%	0.073	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	145.8	177.2	70.8	0	0	0	0	111.3	A631 L635 G664 Y665 Q696	A631-V682 HydrophobicContact CB-CG1 4.45Å; L635-V682 HydrophobicContact CD1-CB 4.42Å; G664-V682 VanDerWaalsContact CA-O 3.24Å; G664-V682 WeakPolarHBondContact CA-O 3.29Å; Y665-V682 HydrophobicContact CD1-CG1 3.47Å; Y665-V682 VanDerWaalsContact CD1-CG1 3.47Å; Y665-V682 HydrophobicContact CE1-CG1 3.38Å; Y665-V682 PolarHBondContact N-O 3.26Å; Y665-V682 VanDerWaalsContact N-O 3.12Å; Y665-V682 PolarHBondContact O-N 3.24Å; V682-Q696 PolarHBondContact O-NE2 3.22Å; V682-Q696 PolarHBondContact O-OE1 2.72Å
683	T	96.2	Very high	91.6	Very high	14 Å²	14	42.5 Å²	42.5	9%	0.086	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.4	161.9	-58.9	0	0	0	0	106.2	V663 Q688 F692 G693 Q696	V663-T683 HydrophobicContact CG1-CG2 4.49Å; T683-Q688 HydrophobicContact CG2-CG 4.18Å; T683-Q688 WeakPolarHBondContact O-CG 3.26Å; T683-Q688 PolarHBondContact O-NE2 2.6Å; T683-F692 HydrophobicContact CG2-CB 4.11Å; T683-G693 PolarHBondContact OG1-N 2.9Å; T683-Q696 PolarHBondContact OG1-NE2 3.22Å
684	L	95.6	Very high	92.1	Very high	7 Å²	7	40 Å²	40	4%	0.037	21%	0.206	C	C	.	.			trans	-60.5	141.3	-177.9	-66.3	178	0	0	0	110.1	L630 Y634 L662 V663 P686 Y687 Q688	L630-L684 HydrophobicContact CD2-CD2 4.35Å; L630-L684 HydrophobicContact CG-CD2 4.33Å; Y634-L684 HydrophobicContact CD2-CD2 4.07Å; Y634-L684 HydrophobicContact CE2-CD2 3.81Å; L662-L684 HydrophobicContact CD2-CD1 3.99Å; L662-L684 HydrophobicContact CG-CD1 3.94Å; V663-L684 PolarHBondContact O-N 2.74Å; L684-P686 VanDerWaalsContact C-CD 3.46Å; L684-P686 VanDerWaalsContact O-N 3.12Å; L684-Y687 HydrophobicContact CB-CD2 4.17Å; L684-Y687 PolarHBondContact O-N 3.23Å; L684-Q688 PolarHBondContact O-N 3.13Å
685	P	94.5	Very high	92.6	Very high	28 Å²	28	33.9 Å²	33.9	18%	0.182	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-45.4	-45	-172.7	-32	36.8	0	0	0	117.2	I551 W554 Y634 Y687 Q688	I551-P685 HydrophobicContact CG2-CB 3.84Å; I551-P685 HydrophobicContact CG2-CG 3.71Å; W554-P685 HydrophobicContact CH2-CG 4.13Å; W554-P685 HydrophobicContact CZ2-CB 3.96Å; W554-P685 HydrophobicContact CZ2-CG 3.64Å; Y634-P685 HydrophobicContact CD1-CG 3.56Å; Y634-P685 HydrophobicContact CE1-CG 3.62Å; Y634-P685 HydrophobicContact CG-CG 4.22Å; P685-Y687 PolarHBondContact O-N 2.92Å; P685-Q688 PolarHBondContact O-N 3.35Å; P685-Q688 VanDerWaalsContact O-N 3.14Å
686	P	93.3	Very high	93	Very high	26 Å²	26	29 Å²	29	17%	0.169	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-65.5	-9.6	178.3	24.9	-34.1	0	0	0	114.9	W549 I551 L684 K690	W549-P686 HydrophobicContact CB-CG 4.33Å; W549-P686 HydrophobicContact CD2-CB 3.59Å; W549-P686 HydrophobicContact CD2-CG 3.81Å; W549-P686 HydrophobicContact CE3-CB 3.74Å; W549-P686 HydrophobicContact CE3-CG 4.36Å; W549-P686 HydrophobicContact CG-CB 4.12Å; W549-P686 HydrophobicContact CG-CG 3.78Å; W549-P686 HydrophobicContact CH2-CB 4.12Å; W549-P686 HydrophobicContact CZ2-CB 3.96Å; W549-P686 HydrophobicContact CZ3-CB 4Å; I551-P686 HydrophobicContact CD1-CG 3.83Å; I551-P686 HydrophobicContact CG1-CG 4.27Å; L684-P686 VanDerWaalsContact C-CD 3.46Å; L684-P686 VanDerWaalsContact O-N 3.12Å; P686-K690 WeakPolarHBondContact O-CE 3.41Å; P686-K690 PolarHBondContact O-NZ 3.33Å
687	Y	93.3	Very high	93	Very high	18 Å²	18	28.1 Å²	28.1	7%	0.071	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-108.7	-7.1	177.1	-59.5	-87.1	0	0	0	113.5	W549 M654 V663 L684 P685 F692	W549-Y687 AromaticContact NE1-CE2 3.6Å; W549-Y687 AromaticContact NE1-CZ 3.54Å; W549-Y687 PolarHBondContact NE1-OH 3.41Å; M654-Y687 HydrophobicContact SD-CE1 4.44Å; V663-Y687 HydrophobicContact CB-CD1 4.42Å; V663-Y687 HydrophobicContact CB-CG 4.4Å; V663-Y687 HydrophobicContact CG1-CD1 4.03Å; V663-Y687 HydrophobicContact CG1-CG 3.91Å; V663-Y687 HydrophobicContact CG2-CD1 3.95Å; V663-Y687 HydrophobicContact CG2-CE1 3.95Å; V663-Y687 HydrophobicContact CG2-CG 4.39Å; L684-Y687 HydrophobicContact CB-CD2 4.17Å; L684-Y687 PolarHBondContact O-N 3.23Å; P685-Y687 PolarHBondContact O-N 2.92Å; Y687-F692 HydrophobicContact CD1-CD2 4.48Å; Y687-F692 HydrophobicContact CD1-CE2 4.09Å; Y687-F692 WeakPolarHBondContact O-CD2 3.44Å
688	Q	90.9	Very high	92.9	Very high	44 Å²	44	28.4 Å²	28.4	21%	0.206	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	160.4	177.8	-67.6	179.3	10.1	0	0	112.4	T683 L684 P685 K690	T683-Q688 HydrophobicContact CG2-CG 4.18Å; T683-Q688 WeakPolarHBondContact O-CG 3.26Å; T683-Q688 PolarHBondContact O-NE2 2.6Å; L684-Q688 PolarHBondContact O-N 3.13Å; P685-Q688 PolarHBondContact O-N 3.35Å; P685-Q688 VanDerWaalsContact O-N 3.14Å; Q688-K690 PolarHBondContact O-N 3.01Å
689	N	85	Confident	92.8	Very high	131 Å²	131	28.2 Å²	28.2	70%	0.701	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	-1.4	-176.2	-68	-61.7	0	0	0	116.8	K800	N689-K800 WeakPolarHBondContact O-CE 3.4Å; N689-K800 PolarHBondContact O-NZ 3.32Å
690	K	87.5	Confident	92.9	Very high	103 Å²	103	27.6 Å²	27.6	45%	0.448	15%	0.149	S	C	.	.	S	Bend	trans	-87.2	-8.2	175.6	-63.7	174.7	-176.5	169	0	114.4	P686 Q688 F692	P686-K690 WeakPolarHBondContact O-CE 3.41Å; P686-K690 PolarHBondContact O-NZ 3.33Å; Q688-K690 PolarHBondContact O-N 3.01Å; K690-F692 HydrophobicContact CB-CD2 3.93Å; K690-F692 HydrophobicContact CB-CE2 3.74Å; K690-F692 HydrophobicContact CD-CE2 4.12Å
691	G	87.7	Confident	92.9	Very high	18 Å²	18	26.5 Å²	26.5	19%	0.186	14%	0.142	C	C	.	.	S	Bend	trans	110.2	-15.9	175.9	0	0	0	0	0	115	G693 R694 L695	G691-G693 VanDerWaalsContact C-N 3.28Å; G691-G693 PolarHBondContact O-N 2.87Å; G691-G693 VanDerWaalsContact O-N 3.15Å; G691-R694 WeakPolarHBondContact O-CA 3.44Å; G691-R694 WeakPolarHBondContact O-CB 3.3Å; G691-R694 PolarHBondContact O-N 2.71Å; G691-L695 PolarHBondContact O-N 2.63Å; G691-L695 VanDerWaalsContact O-N 3.13Å
692	F	91.6	Very high	92.8	Very high	16 Å²	16	25 Å²	25	7%	0.07	13%	0.134	C	C	.	.	H	α-helix	trans	-54.5	-36.4	-178.6	-59.2	-62.8	0	0	0	114.5	L610 L652 M654 V663 T683 Y687 K690 R694 L695 Q696 L804	L610-F692 HydrophobicContact CD1-CE1 4.16Å; L610-F692 HydrophobicContact CD2-CE1 3.82Å; L652-F692 HydrophobicContact CD2-CB 3.89Å; L652-F692 HydrophobicContact CD2-CD1 4.06Å; L652-F692 HydrophobicContact CD2-CG 4.33Å; M654-F692 HydrophobicContact CE-CE1 4.33Å; M654-F692 HydrophobicContact CE-CE2 4.34Å; M654-F692 HydrophobicContact CE-CZ 3.59Å; V663-F692 HydrophobicContact CG1-CB 3.85Å; V663-F692 HydrophobicContact CG1-CD1 4.06Å; V663-F692 HydrophobicContact CG1-CD2 3.72Å; V663-F692 HydrophobicContact CG1-CE2 4.28Å; V663-F692 HydrophobicContact CG1-CG 3.59Å; T683-F692 HydrophobicContact CG2-CB 4.11Å; Y687-F692 HydrophobicContact CD1-CD2 4.48Å; Y687-F692 HydrophobicContact CD1-CE2 4.09Å; Y687-F692 WeakPolarHBondContact O-CD2 3.44Å; K690-F692 HydrophobicContact CB-CD2 3.93Å; K690-F692 HydrophobicContact CB-CE2 3.74Å; K690-F692 HydrophobicContact CD-CE2 4.12Å; F692-R694 VanDerWaalsContact C-N 3.28Å; F692-R694 PolarHBondContact O-N 3.08Å; F692-L695 WeakPolarHBondContact O-CB 3.48Å; F692-L695 PolarHBondContact O-N 3Å; F692-L695 VanDerWaalsContact O-N 3.1Å; F692-Q696 WeakPolarHBondContact O-CG 3.14Å; F692-Q696 PolarHBondContact O-N 2.97Å; F692-L804 HydrophobicContact CD1-CD2 4.43Å; F692-L804 HydrophobicContact CE1-CD2 4.39Å
693	G	92.2	Very high	92.6	Very high	20 Å²	20	24.8 Å²	24.8	21%	0.206	13%	0.133	C	C	.	.	H	α-helix	trans	-59.1	-36.9	173	0	0	0	0	0	113.4	T683 G691 I697	T683-G693 PolarHBondContact OG1-N 2.9Å; G691-G693 VanDerWaalsContact C-N 3.28Å; G691-G693 PolarHBondContact O-N 2.87Å; G691-G693 VanDerWaalsContact O-N 3.15Å; G693-I697 WeakPolarHBondContact O-CG1 3.3Å; G693-I697 PolarHBondContact O-N 3.41Å; G693-I697 VanDerWaalsContact O-N 3.17Å
694	R	91.5	Very high	92.5	Very high	71 Å²	71	24.3 Å²	24.3	27%	0.268	13%	0.13	S	C	.	.	H	α-helix	trans	-73.2	-33.4	174.2	-179.6	177.6	161.7	132.1	4	112	G691 F692 A698 Y728 S731 E735 Y791 R801	G691-R694 WeakPolarHBondContact O-CA 3.44Å; G691-R694 WeakPolarHBondContact O-CB 3.3Å; G691-R694 PolarHBondContact O-N 2.71Å; F692-R694 VanDerWaalsContact C-N 3.28Å; F692-R694 PolarHBondContact O-N 3.08Å; R694-A698 WeakPolarHBondContact O-CB 3.42Å; R694-A698 PolarHBondContact O-N 3.12Å; R694-Y728 HydrophobicContact CG-CD2 4.22Å; R694-S731 VanDerWaalsContact NH1-CB 3.3Å; R694-S731 PolarHBondContact NH1-OG 3.05Å; R694-S731 PolarHBondContact NH2-OG 2.86Å; R694-E735 IonicContact NH2-OE1 3.8Å; R694-E735 PolarHBondContact NH2-OE1 3.17Å; R694-Y791 PolarHBondContact NH1-OH 3.4Å; R694-R801 VanDerWaalsContact NH2-NH1 3.18Å
695	L	91.8	Very high	92.3	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-45.6	172	178.6	67	0	0	0	111	L610 F612 L652 G691 F692 I697 A698 F699 L804 S807	L610-L695 HydrophobicContact CD1-CD2 4.06Å; F612-L695 HydrophobicContact CE2-CD2 3.95Å; F612-L695 HydrophobicContact CE2-CG 3.93Å; F612-L695 HydrophobicContact CZ-CD2 4.31Å; F612-L695 HydrophobicContact CZ-CG 4.08Å; L652-L695 HydrophobicContact CD1-CD2 3.92Å; L652-L695 HydrophobicContact CD2-CD2 4.1Å; G691-L695 PolarHBondContact O-N 2.63Å; G691-L695 VanDerWaalsContact O-N 3.13Å; F692-L695 WeakPolarHBondContact O-CB 3.48Å; F692-L695 PolarHBondContact O-N 3Å; F692-L695 VanDerWaalsContact O-N 3.1Å; L695-I697 PolarHBondContact O-N 3.35Å; L695-A698 WeakPolarHBondContact O-CB 3.36Å; L695-A698 PolarHBondContact O-N 3.35Å; L695-F699 WeakPolarHBondContact O-CB 3.2Å; L695-F699 PolarHBondContact O-N 2.91Å; L695-L804 HydrophobicContact CB-CD2 4.43Å; L695-L804 HydrophobicContact CD2-CD2 4.07Å; L695-S807 WeakPolarHBondContact CD1-O 3.49Å
696	Q	95	Very high	92.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62	-42.8	178.1	-67.6	-175.4	134.2	0	0	112.2	F612 L652 F666 I681 V682 T683 F692 F699 S700	F612-Q696 HydrophobicContact CE1-CG 4.09Å; F612-Q696 HydrophobicContact CZ-CG 4.1Å; L652-Q696 HydrophobicContact CB-CG 4.35Å; L652-Q696 HydrophobicContact CD2-CG 3.76Å; F666-Q696 HydrophobicContact CD1-CB 4.16Å; I681-Q696 HydrophobicContact CD1-CB 3.72Å; I681-Q696 HydrophobicContact CG1-CB 4.39Å; V682-Q696 PolarHBondContact O-NE2 3.22Å; V682-Q696 PolarHBondContact O-OE1 2.72Å; T683-Q696 PolarHBondContact OG1-NE2 3.22Å; F692-Q696 WeakPolarHBondContact O-CG 3.14Å; F692-Q696 PolarHBondContact O-N 2.97Å; Q696-F699 PolarHBondContact O-N 3.12Å; Q696-S700 PolarHBondContact O-N 2.81Å
697	I	95.2	Very high	91.9	Very high	2 Å²	2	31 Å²	31	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-41.2	173.4	-64	169	0	0	0	111.1	I681 G693 L695 F699 S700 Y701 Y725 Y728	I681-I697 HydrophobicContact CD1-CG1 3.71Å; G693-I697 WeakPolarHBondContact O-CG1 3.3Å; G693-I697 PolarHBondContact O-N 3.41Å; G693-I697 VanDerWaalsContact O-N 3.17Å; L695-I697 PolarHBondContact O-N 3.35Å; I697-F699 VanDerWaalsContact C-N 3.27Å; I697-F699 PolarHBondContact O-N 2.75Å; I697-S700 PolarHBondContact O-N 3.01Å; I697-S700 PolarHBondContact O-OG 3.25Å; I697-S700 VanDerWaalsContact O-OG 3.05Å; I697-Y701 HydrophobicContact CG2-CD2 3.86Å; I697-Y701 HydrophobicContact CG2-CE2 3.95Å; I697-Y701 WeakPolarHBondContact O-CD2 3.44Å; I697-Y701 PolarHBondContact O-N 3.39Å; I697-Y725 HydrophobicContact CB-CE1 4.41Å; I697-Y725 HydrophobicContact CD1-CD1 4.21Å; I697-Y725 HydrophobicContact CD1-CD2 4.04Å; I697-Y725 HydrophobicContact CD1-CE1 4.2Å; I697-Y725 HydrophobicContact CD1-CE2 4.01Å; I697-Y725 HydrophobicContact CD1-CG 4.13Å; I697-Y725 HydrophobicContact CG1-CD1 4.42Å; I697-Y725 HydrophobicContact CG1-CE1 3.94Å; I697-Y725 HydrophobicContact CG1-CE2 4.16Å; I697-Y725 HydrophobicContact CG2-CD1 3.91Å; I697-Y725 HydrophobicContact CG2-CE1 3.68Å; I697-Y728 HydrophobicContact CB-CD2 4.47Å; I697-Y728 HydrophobicContact CB-CG 4.4Å; I697-Y728 HydrophobicContact CG2-CD1 3.51Å; I697-Y728 HydrophobicContact CG2-CD2 3.93Å; I697-Y728 HydrophobicContact CG2-CE1 4Å; I697-Y728 HydrophobicContact CG2-CE2 4.36Å; I697-Y728 HydrophobicContact CG2-CG 3.48Å; I697-Y728 VanDerWaalsContact CG2-CG 3.48Å
698	A	93.1	Very high	91.7	Very high	9 Å²	9	33.4 Å²	33.4	7%	0.074	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-36.2	175.6	0	0	0	0	0	112.3	R694 L695 L702 Y728 L808	R694-A698 WeakPolarHBondContact O-CB 3.42Å; R694-A698 PolarHBondContact O-N 3.12Å; L695-A698 WeakPolarHBondContact O-CB 3.36Å; L695-A698 PolarHBondContact O-N 3.35Å; A698-L702 WeakPolarHBondContact O-CB 3.4Å; A698-L702 PolarHBondContact O-N 2.96Å; A698-Y728 HydrophobicContact CB-CE2 3.77Å; A698-L808 HydrophobicContact CB-CD2 3.66Å
699	F	94.4	Very high	91.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71.3	-40.7	177.8	-157.3	-81.2	0	0	0	112.3	I604 Y605 F612 Y650 F666 L695 Q696 I697 Y701 L702 L703 P809 V814	I604-F699 HydrophobicContact CD1-CE1 3.63Å; I604-F699 HydrophobicContact CD1-CZ 3.65Å; I604-F699 HydrophobicContact CG1-CZ 4.16Å; Y605-F699 HydrophobicContact CD1-CE2 4.3Å; Y605-F699 AromaticContact CG-CE2 3.98Å; Y605-F699 HydrophobicContact CG-CE2 3.98Å; F612-F699 HydrophobicContact CB-CE1 4.27Å; F612-F699 HydrophobicContact CB-CE2 4.01Å; F612-F699 HydrophobicContact CB-CZ 3.85Å; F612-F699 HydrophobicContact CD1-CD1 4.21Å; F612-F699 HydrophobicContact CD1-CD2 4.35Å; F612-F699 HydrophobicContact CD1-CE1 4.43Å; F612-F699 HydrophobicContact CD1-CG 4.17Å; F612-F699 AromaticContact CD2-CD2 3.33Å; F612-F699 HydrophobicContact CD2-CD2 3.33Å; F612-F699 AromaticContact CD2-CE2 3.46Å; F612-F699 HydrophobicContact CD2-CE2 3.46Å; F612-F699 VanDerWaalsContact CD2-CE2 3.46Å; F612-F699 AromaticContact CD2-CG 3.94Å; F612-F699 HydrophobicContact CD2-CG 3.94Å; F612-F699 HydrophobicContact CD2-CZ 4.14Å; F612-F699 HydrophobicContact CE1-CB 4.1Å; F612-F699 HydrophobicContact CE1-CD1 4.35Å; F612-F699 HydrophobicContact CE1-CD2 4.37Å; F612-F699 HydrophobicContact CE1-CG 4.01Å; F612-F699 HydrophobicContact CE2-CB 4.02Å; F612-F699 AromaticContact CE2-CD2 3.36Å; F612-F699 HydrophobicContact CE2-CD2 3.36Å; F612-F699 HydrophobicContact CE2-CE2 4.01Å; F612-F699 AromaticContact CE2-CG 3.78Å; F612-F699 HydrophobicContact CE2-CG 3.78Å; F612-F699 HydrophobicContact CG-CD1 4.3Å; F612-F699 AromaticContact CG-CD2 3.86Å; F612-F699 HydrophobicContact CG-CD2 3.86Å; F612-F699 HydrophobicContact CG-CE1 4.23Å; F612-F699 AromaticContact CG-CE2 3.8Å; F612-F699 HydrophobicContact CG-CE2 3.8Å; F612-F699 HydrophobicContact CG-CG 4.13Å; F612-F699 AromaticContact CG-CZ 3.99Å; F612-F699 HydrophobicContact CG-CZ 3.99Å; F612-F699 HydrophobicContact CZ-CB 3.71Å; F612-F699 AromaticContact CZ-CD2 3.91Å; F612-F699 HydrophobicContact CZ-CD2 3.91Å; F612-F699 AromaticContact CZ-CG 3.82Å; F612-F699 HydrophobicContact CZ-CG 3.82Å; Y650-F699 HydrophobicContact CD1-CE1 4.31Å; F666-F699 HydrophobicContact CE1-CB 4.21Å; F666-F699 HydrophobicContact CE1-CD1 4.07Å; F666-F699 HydrophobicContact CZ-CD1 4.02Å; L695-F699 WeakPolarHBondContact O-CB 3.2Å; L695-F699 PolarHBondContact O-N 2.91Å; Q696-F699 PolarHBondContact O-N 3.12Å; I697-F699 VanDerWaalsContact C-N 3.27Å; I697-F699 PolarHBondContact O-N 2.75Å; F699-Y701 VanDerWaalsContact C-N 3.33Å; F699-Y701 PolarHBondContact O-N 3.24Å; F699-L702 HydrophobicContact CD2-CD2 4.46Å; F699-L702 WeakPolarHBondContact O-CB 3.24Å; F699-L702 PolarHBondContact O-N 2.7Å; F699-L703 HydrophobicContact CD1-CD1 4.03Å; F699-L703 HydrophobicContact CD1-CG 4.06Å; F699-L703 HydrophobicContact CE1-CD1 4.02Å; F699-L703 HydrophobicContact CE1-CD2 3.98Å; F699-L703 HydrophobicContact CE1-CG 3.96Å; F699-L703 WeakPolarHBondContact O-CG 3.08Å; F699-L703 PolarHBondContact O-N 3.49Å; F699-P809 HydrophobicContact CD2-CG 3.66Å; F699-P809 HydrophobicContact CE2-CG 3.88Å; F699-V814 HydrophobicContact CE2-CG2 3.93Å; F699-V814 HydrophobicContact CZ-CG1 4.15Å; F699-V814 HydrophobicContact CZ-CG2 4Å
700	S	95.9	Very high	92	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64	-38.3	176.5	70.4	0	0	0	0	112.3	V678 Q696 I697 L703 S704	V678-S700 WeakPolarHBondContact CG2-OG 3.31Å; Q696-S700 PolarHBondContact O-N 2.81Å; I697-S700 PolarHBondContact O-N 3.01Å; I697-S700 PolarHBondContact O-OG 3.25Å; I697-S700 VanDerWaalsContact O-OG 3.05Å; S700-L703 PolarHBondContact O-N 2.91Å; S700-S704 PolarHBondContact O-N 2.8Å; S700-S704 PolarHBondContact O-OG 2.66Å
701	Y	95.1	Very high	92.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-71.8	-29.4	174.2	-83.4	-64.9	0	0	0	114	I697 F699 R705 G711 Y725 Y728 W729 G756 M757	I697-Y701 HydrophobicContact CG2-CD2 3.86Å; I697-Y701 HydrophobicContact CG2-CE2 3.95Å; I697-Y701 WeakPolarHBondContact O-CD2 3.44Å; I697-Y701 PolarHBondContact O-N 3.39Å; F699-Y701 VanDerWaalsContact C-N 3.33Å; F699-Y701 PolarHBondContact O-N 3.24Å; Y701-R705 PolarHBondContact O-N 3.15Å; Y701-R705 PolarHBondContact O-NH1 2.88Å; Y701-G711 WeakPolarHBondContact CE1-O 3.16Å; Y701-G711 PolarHBondContact OH-O 3.01Å; Y701-Y725 HydrophobicContact CE2-CD1 4.33Å; Y701-Y725 HydrophobicContact CE2-CE1 4.13Å; Y701-Y728 AromaticContact CD2-CD1 3.96Å; Y701-Y728 HydrophobicContact CD2-CD1 3.96Å; Y701-Y728 AromaticContact CD2-CE1 3.32Å; Y701-Y728 HydrophobicContact CD2-CE1 3.32Å; Y701-Y728 AromaticContact CD2-CZ 3.99Å; Y701-Y728 HydrophobicContact CE2-CD1 4.06Å; Y701-Y728 AromaticContact CE2-CE1 3.82Å; Y701-Y728 HydrophobicContact CE2-CE1 3.82Å; Y701-Y728 HydrophobicContact CG-CE1 4.02Å; Y701-W729 AromaticContact CE2-NE1 3.65Å; Y701-W729 AromaticContact CZ-NE1 3.55Å; Y701-W729 PolarHBondContact OH-NE1 3.19Å; Y701-G756 WeakPolarHBondContact CD1-O 3.42Å; Y701-G756 WeakPolarHBondContact CE1-O 3.4Å; Y701-M757 HydrophobicContact CD1-CG 4.21Å; Y701-M757 HydrophobicContact CE1-CB 4.29Å; Y701-M757 HydrophobicContact CE1-CG 3.77Å
702	L	92.8	Very high	92.6	Very high	4 Å²	4	26 Å²	26	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-66.1	-43.4	172.1	-179.9	77	0	0	0	111.8	A698 F699 R705 K706 P809 E811 V814	A698-L702 WeakPolarHBondContact O-CB 3.4Å; A698-L702 PolarHBondContact O-N 2.96Å; F699-L702 HydrophobicContact CD2-CD2 4.46Å; F699-L702 WeakPolarHBondContact O-CB 3.24Å; F699-L702 PolarHBondContact O-N 2.7Å; L702-R705 PolarHBondContact O-N 2.97Å; L702-K706 PolarHBondContact O-N 3.45Å; L702-P809 HydrophobicContact CD2-CB 3.49Å; L702-P809 VanDerWaalsContact CD2-CB 3.49Å; L702-P809 HydrophobicContact CD2-CG 3.71Å; L702-E811 HydrophobicContact CD1-CB 4.44Å; L702-E811 HydrophobicContact CD1-CG 3.69Å; L702-V814 HydrophobicContact CD2-CG2 3.54Å
703	L	92.4	Very high	92.8	Very high	7 Å²	7	25.2 Å²	25.2	4%	0.037	14%	0.142	C	C	.	.	H	α-helix	trans	-58.7	-47.9	173.9	-67.7	174.1	0	0	0	110.8	Y650 F666 F699 S700 R705 K706 E707 V814 A816	Y650-L703 HydrophobicContact CD1-CD1 3.9Å; Y650-L703 HydrophobicContact CD2-CD1 4.03Å; Y650-L703 HydrophobicContact CE1-CD1 3.55Å; Y650-L703 HydrophobicContact CE1-CD2 4.45Å; Y650-L703 HydrophobicContact CE2-CD1 3.7Å; Y650-L703 HydrophobicContact CG-CD1 4.12Å; Y650-L703 VanDerWaalsContact CZ-CD1 3.46Å; F666-L703 HydrophobicContact CE2-CD1 4.28Å; F666-L703 HydrophobicContact CZ-CD1 3.89Å; F699-L703 HydrophobicContact CD1-CD1 4.03Å; F699-L703 HydrophobicContact CD1-CG 4.06Å; F699-L703 HydrophobicContact CE1-CD1 4.02Å; F699-L703 HydrophobicContact CE1-CD2 3.98Å; F699-L703 HydrophobicContact CE1-CG 3.96Å; F699-L703 WeakPolarHBondContact O-CG 3.08Å; F699-L703 PolarHBondContact O-N 3.49Å; S700-L703 PolarHBondContact O-N 2.91Å; L703-R705 PolarHBondContact O-N 2.95Å; L703-K706 CarbonylContact O-C 3.6Å; L703-K706 PolarHBondContact O-N 2.52Å; L703-E707 VanDerWaalsContact O-CG 3.29Å; L703-E707 WeakPolarHBondContact O-CG 3.33Å; L703-E707 PolarHBondContact O-N 3.46Å; L703-V814 HydrophobicContact CD2-CG1 4.5Å; L703-A816 HydrophobicContact CD2-CB 4.38Å
704	S	92.6	Very high	92.7	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-53.7	-48.2	176.7	-58.3	0	0	0	0	112.6	N677 S700 K706 E707 G708 E709	N677-S704 VanDerWaalsContact CB-OG 3.27Å; N677-S704 WeakPolarHBondContact CB-OG 3.37Å; N677-S704 PolarHBondContact ND2-OG 3.48Å; S700-S704 PolarHBondContact O-N 2.8Å; S700-S704 PolarHBondContact O-OG 2.66Å; S704-K706 PolarHBondContact O-N 2.69Å; S704-E707 WeakPolarHBondContact O-CB 3.48Å; S704-E707 PolarHBondContact O-N 3.11Å; S704-G708 PolarHBondContact O-N 3.5Å; S704-E709 CarbonylContact C-O 3.53Å; S704-E709 WeakPolarHBondContact CB-O 3.47Å; S704-E709 PolarHBondContact O-N 2.96Å
705	R	92.7	Very high	92.6	Very high	61 Å²	61	29.2 Å²	29.2	23%	0.23	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-37.9	175.9	-68.6	-166.4	-51.5	-73.5	-5	113.2	Y701 L702 L703 E707 G708 T754 T755 E811	Y701-R705 PolarHBondContact O-N 3.15Å; Y701-R705 PolarHBondContact O-NH1 2.88Å; L702-R705 PolarHBondContact O-N 2.97Å; L703-R705 PolarHBondContact O-N 2.95Å; R705-E707 VanDerWaalsContact C-N 3.27Å; R705-E707 PolarHBondContact O-N 2.86Å; R705-G708 PolarHBondContact O-N 3.4Å; R705-G708 VanDerWaalsContact O-N 3.08Å; R705-T754 WeakPolarHBondContact CD-O 3.48Å; R705-T755 PolarHBondContact NH1-O 3.42Å; R705-E811 IonicContact CZ-OE1 2.67Å; R705-E811 IonicContact NE-OE1 3.26Å; R705-E811 PolarHBondContact NE-OE1 3.23Å; R705-E811 IonicContact NH2-OE1 3.05Å; R705-E811 PolarHBondContact NH2-OE1 3.42Å
706	K	89.4	Confident	92.3	Very high	74 Å²	74	34.3 Å²	34.3	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-67.7	-28.2	176.3	-163.4	178	-174	-169.6	0	112.8	L702 L703 S704 G708 V814 A816	L702-K706 PolarHBondContact O-N 3.45Å; L703-K706 CarbonylContact O-C 3.6Å; L703-K706 PolarHBondContact O-N 2.52Å; S704-K706 PolarHBondContact O-N 2.69Å; K706-G708 VanDerWaalsContact C-N 3.27Å; K706-V814 PolarHBondContact NZ-O 3.37Å; K706-A816 WeakPolarHBondContact CE-O 3.43Å; K706-A816 PolarHBondContact NZ-O 2.96Å
707	E	89	Confident	91.9	Very high	66 Å²	66	36.7 Å²	36.7	31%	0.308	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.3	172.4	-66.6	166.3	149.4	0	0	113	K668 L703 S704 R705 E709	K668-E707 IonicContact NZ-OE1 2.73Å; K668-E707 PolarHBondContact NZ-OE1 3.08Å; K668-E707 IonicContact NZ-OE2 3.21Å; K668-E707 PolarHBondContact NZ-OE2 3.33Å; L703-E707 VanDerWaalsContact O-CG 3.29Å; L703-E707 WeakPolarHBondContact O-CG 3.33Å; L703-E707 PolarHBondContact O-N 3.46Å; S704-E707 WeakPolarHBondContact O-CB 3.48Å; S704-E707 PolarHBondContact O-N 3.11Å; R705-E707 VanDerWaalsContact C-N 3.27Å; R705-E707 PolarHBondContact O-N 2.86Å; E707-E709 HydrophobicContact CB-CB 4.31Å; E707-E709 PolarHBondContact O-N 3.41Å
708	G	89.2	Confident	91.5	Very high	70 Å²	70	39.8 Å²	39.8	72%	0.722	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.1	13.4	-173	0	0	0	0	0	114	S704 R705 K706	S704-G708 PolarHBondContact O-N 3.5Å; R705-G708 PolarHBondContact O-N 3.4Å; R705-G708 VanDerWaalsContact O-N 3.08Å; K706-G708 VanDerWaalsContact C-N 3.27Å
709	E	89.7	Confident	91.2	Very high	82 Å²	82	46.4 Å²	46.4	38%	0.383	25%	0.253	S	S	.	.			trans	-117.4	158.7	-169	-88.5	-69.6	-173.8	0	0	113.2	K675 S704 E707	K675-E709 IonicContact NZ-OE1 2.72Å; K675-E709 PolarHBondContact NZ-OE1 2.99Å; K675-E709 IonicContact NZ-OE2 3.37Å; K675-E709 PolarHBondContact NZ-OE2 3.06Å; S704-E709 CarbonylContact C-O 3.53Å; S704-E709 WeakPolarHBondContact CB-O 3.47Å; S704-E709 PolarHBondContact O-N 2.96Å; E707-E709 HydrophobicContact CB-CB 4.31Å; E707-E709 PolarHBondContact O-N 3.41Å
710	V	93.4	Very high	90.8	Very high	43 Å²	43	50.9 Å²	50.9	26%	0.261	28%	0.277	S	S	.	.			trans	-104.5	135.4	178.3	-62.8	0	0	0	0	110.7	S752	V710-S752 WeakPolarHBondContact CG1-OG 3.47Å
711	G	93.2	Very high	90.5	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.01	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-126.6	150.7	-171.4	0	0	0	0	0	114.6	Y701 G756	Y701-G711 WeakPolarHBondContact CE1-O 3.16Å; Y701-G711 PolarHBondContact OH-O 3.01Å; G711-G756 PolarHBondContact N-O 3.44Å
712	T	94.6	Very high	90.3	Very high	13 Å²	13	59.4 Å²	59.4	8%	0.08	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	154.3	167.8	-160.4	0	0	0	0	108.2	F676 N677 T758 D761	F676-T712 CarbonylContact C-O 3.54Å; F676-T712 VanDerWaalsContact CA-O 3.24Å; F676-T712 WeakPolarHBondContact CA-O 3.49Å; F676-T712 HydrophobicContact CD1-CG2 3.72Å; F676-T712 HydrophobicContact CE1-CG2 3.86Å; N677-T712 PolarHBondContact N-O 3.42Å; N677-T712 PolarHBondContact OD1-O 2.86Å; T712-T758 HydrophobicContact CG2-CG2 4.42Å; T712-D761 WeakPolarHBondContact CB-OD2 3.37Å; T712-D761 VanDerWaalsContact OG1-CG 3.26Å; T712-D761 PolarHBondContact OG1-OD1 3.47Å; T712-D761 VanDerWaalsContact OG1-OD1 3.08Å; T712-D761 PolarHBondContact OG1-OD2 3.21Å
713	P	95.4	Very high	90.1	Very high	1 Å²	1	66 Å²	66	1%	0.006	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	153.8	170.6	31.4	-37.1	0	0	0	112	V678 L717 Y725 W729	V678-P713 HydrophobicContact CB-CB 4.28Å; V678-P713 WeakPolarHBondContact O-CA 3.45Å; P713-L717 HydrophobicContact CB-CD2 3.9Å; P713-L717 HydrophobicContact CG-CD1 4.01Å; P713-L717 HydrophobicContact CG-CD2 3.97Å; P713-L717 HydrophobicContact CG-CG 4.28Å; P713-Y725 HydrophobicContact CB-CE1 3.94Å; P713-Y725 HydrophobicContact CB-CE2 3.99Å; P713-Y725 HydrophobicContact CG-CD1 3.87Å; P713-Y725 HydrophobicContact CG-CD2 4.2Å; P713-Y725 HydrophobicContact CG-CE1 3.68Å; P713-Y725 HydrophobicContact CG-CE2 4.04Å; P713-Y725 HydrophobicContact CG-CG 4.14Å; P713-W729 HydrophobicContact CG-CZ2 4.34Å
714	E	91.3	Very high	90	Very high	73 Å²	73	67.7 Å²	67.7	34%	0.341	35%	0.353	S	S	.	.			trans	-54.8	137.3	171.2	-171.9	-173.2	150.7	0	0	111	F676 V678 S679	F676-E714 HydrophobicContact CD1-CB 4.44Å; F676-E714 HydrophobicContact CD2-CB 4.08Å; F676-E714 HydrophobicContact CD2-CG 4.13Å; F676-E714 HydrophobicContact CE2-CB 4.3Å; F676-E714 HydrophobicContact CE2-CG 4Å; F676-E714 HydrophobicContact CG-CB 4.16Å; F676-E714 HydrophobicContact CZ-CG 4.45Å; V678-E714 WeakPolarHBondContact O-CB 3.32Å; V678-E714 PolarHBondContact O-N 2.96Å; S679-E714 WeakPolarHBondContact CA-OE2 3.31Å; S679-E714 WeakPolarHBondContact CB-OE2 3.49Å
715	K	88.4	Confident	90.1	Very high	102 Å²	102	67.6 Å²	67.6	44%	0.443	35%	0.352	S	S	.	.	S	Bend	trans	-111.1	133.4	-178.1	-58.7	-178.7	-177.8	-179.8	0	108	D761	K715-D761 IonicContact NZ-OD1 3.04Å; K715-D761 PolarHBondContact NZ-OD1 3.17Å
716	P	86.4	Confident	90.1	Very high	110 Å²	110	67.4 Å²	67.4	71%	0.714	36%	0.357	S	S	*	.	S	Bend	cis	-89.8	130.8	15.3	33.7	-34.4	0	0	0	114.9
717	L	85.2	Confident	90.1	Very high	50 Å²	50	67.1 Å²	67.1	26%	0.262	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-65	141.8	166.2	-72.5	175.4	0	0	0	111.3	P713 R722 Y725	P713-L717 HydrophobicContact CB-CD2 3.9Å; P713-L717 HydrophobicContact CG-CD1 4.01Å; P713-L717 HydrophobicContact CG-CD2 3.97Å; P713-L717 HydrophobicContact CG-CG 4.28Å; L717-R722 HydrophobicContact CB-CB 4.34Å; L717-Y725 HydrophobicContact CD1-CD2 3.78Å; L717-Y725 HydrophobicContact CD1-CG 4.14Å; L717-Y725 HydrophobicContact CD2-CD2 3.81Å; L717-Y725 HydrophobicContact CD2-CE2 3.77Å; L717-Y725 HydrophobicContact CG-CD2 4.48Å
718	S	88.2	Confident	90.3	Very high	66 Å²	66	65.1 Å²	65.1	46%	0.462	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-62.9	158.5	165.1	68.2	0	0	0	0	111	L720 G721 R722	S718-L720 VanDerWaalsContact C-N 3.34Å; S718-L720 PolarHBondContact O-N 3.44Å; S718-G721 CarbonylContact O-C 3.59Å; S718-G721 WeakPolarHBondContact O-CA 3.37Å; S718-G721 PolarHBondContact O-N 3.04Å; S718-G721 PolarHBondContact OG-N 3.22Å; S718-R722 PolarHBondContact O-N 3.02Å
719	E	85.6	Confident	90.6	Very high	148 Å²	148	62.5 Å²	62.5	69%	0.692	32%	0.323	S	S	*	.	H	α-helix	trans	-55.7	-46.5	-179.3	-176.4	178	-172.9	0	0	112.3	G721 R722 F723	E719-G721 VanDerWaalsContact C-N 3.3Å; E719-G721 PolarHBondContact O-N 3.12Å; E719-R722 PolarHBondContact O-N 3.14Å; E719-F723 HydrophobicContact CG-CD2 3.91Å; E719-F723 HydrophobicContact CG-CE2 3.58Å; E719-F723 WeakPolarHBondContact O-CD2 3.2Å; E719-F723 PolarHBondContact O-N 3.04Å
720	L	86.8	Confident	90.8	Very high	94 Å²	94	62.4 Å²	62.4	49%	0.492	32%	0.322	S	S	.	.	H	α-helix	trans	-63.8	-35	174.4	-178	61.8	0	0	0	112.4	S718 S724	S718-L720 VanDerWaalsContact C-N 3.34Å; S718-L720 PolarHBondContact O-N 3.44Å; L720-S724 WeakPolarHBondContact O-CB 3.35Å; L720-S724 PolarHBondContact O-N 3.19Å; L720-S724 VanDerWaalsContact O-N 3.12Å; L720-S724 PolarHBondContact O-OG 3.37Å
721	G	89.2	Confident	90.7	Very high	9 Å²	9	60.4 Å²	60.4	9%	0.093	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-53.5	172.4	0	0	0	0	0	111.4	S718 E719 F723 S724 Y725	S718-G721 CarbonylContact O-C 3.59Å; S718-G721 WeakPolarHBondContact O-CA 3.37Å; S718-G721 PolarHBondContact O-N 3.04Å; S718-G721 PolarHBondContact OG-N 3.22Å; E719-G721 VanDerWaalsContact C-N 3.3Å; E719-G721 PolarHBondContact O-N 3.12Å; G721-F723 PolarHBondContact O-N 2.62Å; G721-S724 CarbonylContact O-C 3.59Å; G721-S724 WeakPolarHBondContact O-CA 3.36Å; G721-S724 WeakPolarHBondContact O-CB 3.42Å; G721-S724 PolarHBondContact O-N 3Å; G721-Y725 WeakPolarHBondContact O-CD2 3.21Å; G721-Y725 PolarHBondContact O-N 3.25Å
722	R	90	Very high	90.7	Very high	171 Å²	171	61 Å²	61	65%	0.645	31%	0.314	S	S	*	.	H	α-helix	trans	-56.1	-48.4	178.9	-170.7	176	-175	164	4.4	111.7	L717 S718 E719 S724 Y725 T726	L717-R722 HydrophobicContact CB-CB 4.34Å; S718-R722 PolarHBondContact O-N 3.02Å; E719-R722 PolarHBondContact O-N 3.14Å; R722-S724 PolarHBondContact O-N 3.36Å; R722-Y725 PolarHBondContact O-N 3.14Å; R722-T726 WeakPolarHBondContact O-CB 3.5Å; R722-T726 PolarHBondContact O-N 2.88Å; R722-T726 PolarHBondContact O-OG1 2.67Å; R722-T726 VanDerWaalsContact O-OG1 3.12Å
723	F	88.8	Confident	90.6	Very high	142 Å²	142	60.3 Å²	60.3	62%	0.623	31%	0.31	S	S	*	.	H	α-helix	trans	-59.3	-34.5	174.8	-77	-57.2	0	0	0	113.1	E719 G721 S727	E719-F723 HydrophobicContact CG-CD2 3.91Å; E719-F723 HydrophobicContact CG-CE2 3.58Å; E719-F723 WeakPolarHBondContact O-CD2 3.2Å; E719-F723 PolarHBondContact O-N 3.04Å; G721-F723 PolarHBondContact O-N 2.62Å; F723-S727 WeakPolarHBondContact O-CB 3.32Å; F723-S727 PolarHBondContact O-N 3.16Å
724	S	90.9	Very high	90.4	Very high	43 Å²	43	60.4 Å²	60.4	30%	0.301	31%	0.31	S	S	.	.	H	α-helix	trans	-73.4	-45.4	178.2	-57.8	0	0	0	0	112.4	L720 G721 R722 S727 Y728	L720-S724 WeakPolarHBondContact O-CB 3.35Å; L720-S724 PolarHBondContact O-N 3.19Å; L720-S724 VanDerWaalsContact O-N 3.12Å; L720-S724 PolarHBondContact O-OG 3.37Å; G721-S724 CarbonylContact O-C 3.59Å; G721-S724 WeakPolarHBondContact O-CA 3.36Å; G721-S724 WeakPolarHBondContact O-CB 3.42Å; G721-S724 PolarHBondContact O-N 3Å; R722-S724 PolarHBondContact O-N 3.36Å; S724-S727 PolarHBondContact O-N 2.95Å; S724-Y728 WeakPolarHBondContact O-CB 3.4Å; S724-Y728 PolarHBondContact O-N 3.19Å
725	Y	94.6	Very high	90.4	Very high	1 Å²	1	58.5 Å²	58.5	0%	0.004	30%	0.301	C	S	.	.	H	α-helix	trans	-66.3	-48.9	177.9	-82.9	-81.9	0	0	0	112.2	V678 I681 I697 Y701 P713 L717 G721 R722 S727 Y728 W729	V678-Y725 WeakPolarHBondContact CG2-OH 3.39Å; I681-Y725 HydrophobicContact CG2-CE2 4.24Å; I697-Y725 HydrophobicContact CB-CE1 4.41Å; I697-Y725 HydrophobicContact CD1-CD1 4.21Å; I697-Y725 HydrophobicContact CD1-CD2 4.04Å; I697-Y725 HydrophobicContact CD1-CE1 4.2Å; I697-Y725 HydrophobicContact CD1-CE2 4.01Å; I697-Y725 HydrophobicContact CD1-CG 4.13Å; I697-Y725 HydrophobicContact CG1-CD1 4.42Å; I697-Y725 HydrophobicContact CG1-CE1 3.94Å; I697-Y725 HydrophobicContact CG1-CE2 4.16Å; I697-Y725 HydrophobicContact CG2-CD1 3.91Å; I697-Y725 HydrophobicContact CG2-CE1 3.68Å; Y701-Y725 HydrophobicContact CE2-CD1 4.33Å; Y701-Y725 HydrophobicContact CE2-CE1 4.13Å; P713-Y725 HydrophobicContact CB-CE1 3.94Å; P713-Y725 HydrophobicContact CB-CE2 3.99Å; P713-Y725 HydrophobicContact CG-CD1 3.87Å; P713-Y725 HydrophobicContact CG-CD2 4.2Å; P713-Y725 HydrophobicContact CG-CE1 3.68Å; P713-Y725 HydrophobicContact CG-CE2 4.04Å; P713-Y725 HydrophobicContact CG-CG 4.14Å; L717-Y725 HydrophobicContact CD1-CD2 3.78Å; L717-Y725 HydrophobicContact CD1-CG 4.14Å; L717-Y725 HydrophobicContact CD2-CD2 3.81Å; L717-Y725 HydrophobicContact CD2-CE2 3.77Å; L717-Y725 HydrophobicContact CG-CD2 4.48Å; G721-Y725 WeakPolarHBondContact O-CD2 3.21Å; G721-Y725 PolarHBondContact O-N 3.25Å; R722-Y725 PolarHBondContact O-N 3.14Å; Y725-S727 VanDerWaalsContact C-N 3.25Å; Y725-S727 PolarHBondContact O-N 3.25Å; Y725-Y728 CarbonylContact O-C 3.58Å; Y725-Y728 WeakPolarHBondContact O-CA 3.19Å; Y725-Y728 WeakPolarHBondContact O-CB 3.27Å; Y725-Y728 PolarHBondContact O-N 2.89Å; Y725-W729 AromaticContact CD1-CZ2 3.96Å; Y725-W729 HydrophobicContact CD1-CZ2 3.96Å; Y725-W729 AromaticContact CD1-NE1 3.99Å; Y725-W729 HydrophobicContact CG-CZ2 4.29Å; Y725-W729 VanDerWaalsContact O-CG 3.27Å; Y725-W729 PolarHBondContact O-N 2.68Å
726	T	92	Very high	90.6	Very high	56 Å²	56	54 Å²	54	34%	0.344	28%	0.282	S	S	.	.	H	α-helix	trans	-60.1	-35.7	176.7	-54.9	0	0	0	0	112.2	R722 K730	R722-T726 WeakPolarHBondContact O-CB 3.5Å; R722-T726 PolarHBondContact O-N 2.88Å; R722-T726 PolarHBondContact O-OG1 2.67Å; R722-T726 VanDerWaalsContact O-OG1 3.12Å; T726-K730 VanDerWaalsContact O-CB 3.31Å; T726-K730 WeakPolarHBondContact O-CB 3.41Å; T726-K730 PolarHBondContact O-N 3.36Å; T726-K730 VanDerWaalsContact O-N 3.11Å
727	S	90.8	Very high	90.8	Very high	69 Å²	69	48.8 Å²	48.8	48%	0.483	25%	0.248	S	C	.	.	H	α-helix	trans	-69.3	-34.1	174.2	-174.6	0	0	0	0	113	F723 S724 Y725 S731	F723-S727 WeakPolarHBondContact O-CB 3.32Å; F723-S727 PolarHBondContact O-N 3.16Å; S724-S727 PolarHBondContact O-N 2.95Å; Y725-S727 VanDerWaalsContact C-N 3.25Å; Y725-S727 PolarHBondContact O-N 3.25Å; S727-S731 PolarHBondContact O-N 2.96Å
728	Y	93.3	Very high	91	Very high	24 Å²	24	48.3 Å²	48.3	9%	0.094	25%	0.246	C	C	.	.	H	α-helix	trans	-71.7	-51.3	173.7	177.3	-93.9	0	0	0	111.9	R694 I697 A698 Y701 S724 Y725 K730 S731 A732	R694-Y728 HydrophobicContact CG-CD2 4.22Å; I697-Y728 HydrophobicContact CB-CD2 4.47Å; I697-Y728 HydrophobicContact CB-CG 4.4Å; I697-Y728 HydrophobicContact CG2-CD1 3.51Å; I697-Y728 HydrophobicContact CG2-CD2 3.93Å; I697-Y728 HydrophobicContact CG2-CE1 4Å; I697-Y728 HydrophobicContact CG2-CE2 4.36Å; I697-Y728 HydrophobicContact CG2-CG 3.48Å; I697-Y728 VanDerWaalsContact CG2-CG 3.48Å; A698-Y728 HydrophobicContact CB-CE2 3.77Å; Y701-Y728 AromaticContact CD2-CD1 3.96Å; Y701-Y728 HydrophobicContact CD2-CD1 3.96Å; Y701-Y728 AromaticContact CD2-CE1 3.32Å; Y701-Y728 HydrophobicContact CD2-CE1 3.32Å; Y701-Y728 AromaticContact CD2-CZ 3.99Å; Y701-Y728 HydrophobicContact CE2-CD1 4.06Å; Y701-Y728 AromaticContact CE2-CE1 3.82Å; Y701-Y728 HydrophobicContact CE2-CE1 3.82Å; Y701-Y728 HydrophobicContact CG-CE1 4.02Å; S724-Y728 WeakPolarHBondContact O-CB 3.4Å; S724-Y728 PolarHBondContact O-N 3.19Å; Y725-Y728 CarbonylContact O-C 3.58Å; Y725-Y728 WeakPolarHBondContact O-CA 3.19Å; Y725-Y728 WeakPolarHBondContact O-CB 3.27Å; Y725-Y728 PolarHBondContact O-N 2.89Å; Y728-K730 PolarHBondContact O-N 3.48Å; Y728-S731 CarbonylContact O-C 3.59Å; Y728-S731 WeakPolarHBondContact O-CA 3.38Å; Y728-S731 WeakPolarHBondContact O-CB 3.47Å; Y728-S731 PolarHBondContact O-N 3.43Å; Y728-A732 HydrophobicContact CE1-CB 4.35Å; Y728-A732 PolarHBondContact O-N 2.97Å
729	W	95.2	Very high	91	Very high	14 Å²	14	53.2 Å²	53.2	5%	0.053	26%	0.259	C	S	.	.	H	α-helix	trans	-58.6	-44.9	-179.5	-63.3	-30.3	0	0	0	112.4	Y701 P713 Y725 S731 A732 I733 M757 D761 T765	Y701-W729 AromaticContact CE2-NE1 3.65Å; Y701-W729 AromaticContact CZ-NE1 3.55Å; Y701-W729 PolarHBondContact OH-NE1 3.19Å; P713-W729 HydrophobicContact CG-CZ2 4.34Å; Y725-W729 AromaticContact CD1-CZ2 3.96Å; Y725-W729 HydrophobicContact CD1-CZ2 3.96Å; Y725-W729 AromaticContact CD1-NE1 3.99Å; Y725-W729 HydrophobicContact CG-CZ2 4.29Å; Y725-W729 VanDerWaalsContact O-CG 3.27Å; Y725-W729 PolarHBondContact O-N 2.68Å; W729-S731 PolarHBondContact O-N 3.2Å; W729-A732 PolarHBondContact O-N 2.68Å; W729-I733 WeakPolarHBondContact O-CG1 3.33Å; W729-I733 PolarHBondContact O-N 3.22Å; W729-M757 HydrophobicContact CB-CE 3.59Å; W729-M757 HydrophobicContact CB-SD 4.25Å; W729-M757 VanDerWaalsContact CD1-CE 3.42Å; W729-M757 VanDerWaalsContact CD1-SD 3.58Å; W729-M757 HydrophobicContact CD2-CE 4.33Å; W729-M757 HydrophobicContact CG-CE 3.54Å; W729-M757 HydrophobicContact CG-SD 4.18Å; W729-D761 HydrophobicContact CD2-CB 4.39Å; W729-D761 HydrophobicContact CH2-CB 4.18Å; W729-D761 HydrophobicContact CZ2-CB 4.01Å; W729-D761 HydrophobicContact CZ3-CB 4.44Å; W729-T765 HydrophobicContact CB-CG2 3.95Å; W729-T765 WeakPolarHBondContact CB-OG1 3.49Å
730	K	93.2	Very high	91.2	Very high	81 Å²	81	49 Å²	49	35%	0.352	24%	0.241	S	C	.	.	H	α-helix	trans	-54.7	-40.7	172.2	176.9	170	-170	137.5	0	111.9	T726 Y728 F734 T765 L769	T726-K730 VanDerWaalsContact O-CB 3.31Å; T726-K730 WeakPolarHBondContact O-CB 3.41Å; T726-K730 PolarHBondContact O-N 3.36Å; T726-K730 VanDerWaalsContact O-N 3.11Å; Y728-K730 PolarHBondContact O-N 3.48Å; K730-F734 HydrophobicContact CG-CD2 4.4Å; K730-F734 HydrophobicContact CG-CE2 4.31Å; K730-F734 HydrophobicContact CG-CZ 4.42Å; K730-F734 WeakPolarHBondContact O-CB 3.38Å; K730-F734 VanDerWaalsContact O-CG 3.29Å; K730-F734 WeakPolarHBondContact O-CG 3.46Å; K730-F734 PolarHBondContact O-N 3.01Å; K730-F734 VanDerWaalsContact O-N 3.1Å; K730-T765 HydrophobicContact CB-CG2 4.47Å; K730-L769 HydrophobicContact CD-CD2 3.64Å; K730-L769 HydrophobicContact CG-CD1 4.32Å; K730-L769 HydrophobicContact CG-CD2 3.85Å
731	S	91.6	Very high	91.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.9	-46.3	178.5	-157.4	0	0	0	0	112	R694 S727 Y728 W729 I733 F734 E735 Y791 R801	R694-S731 VanDerWaalsContact NH1-CB 3.3Å; R694-S731 PolarHBondContact NH1-OG 3.05Å; R694-S731 PolarHBondContact NH2-OG 2.86Å; S727-S731 PolarHBondContact O-N 2.96Å; Y728-S731 CarbonylContact O-C 3.59Å; Y728-S731 WeakPolarHBondContact O-CA 3.38Å; Y728-S731 WeakPolarHBondContact O-CB 3.47Å; Y728-S731 PolarHBondContact O-N 3.43Å; W729-S731 PolarHBondContact O-N 3.2Å; S731-I733 VanDerWaalsContact C-N 3.35Å; S731-I733 PolarHBondContact O-N 3.3Å; S731-F734 PolarHBondContact O-N 3.21Å; S731-E735 VanDerWaalsContact O-CB 3.31Å; S731-E735 WeakPolarHBondContact O-CB 3.47Å; S731-E735 WeakPolarHBondContact O-CG 3.22Å; S731-E735 PolarHBondContact O-N 3.48Å; S731-E735 PolarHBondContact OG-OE1 3.19Å; S731-Y791 PolarHBondContact OG-OH 2.92Å; S731-R801 PolarHBondContact OG-NH1 3.13Å
732	A	92.4	Very high	90.8	Very high	13 Å²	13	56.6 Å²	56.6	11%	0.107	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-43.5	-179.9	0	0	0	0	0	111.7	Y728 W729 E735 F736 T755 M757	Y728-A732 HydrophobicContact CE1-CB 4.35Å; Y728-A732 PolarHBondContact O-N 2.97Å; W729-A732 PolarHBondContact O-N 2.68Å; A732-E735 PolarHBondContact O-N 3.09Å; A732-F736 WeakPolarHBondContact O-CB 3.34Å; A732-F736 PolarHBondContact O-N 3.18Å; A732-T755 HydrophobicContact CB-CG2 4.16Å; A732-M757 HydrophobicContact CB-SD 3.99Å
733	I	92.5	Very high	90.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.7	-43.7	177.5	-66.8	172.8	0	0	0	111.4	W729 S731 E735 F736 F737 I751 M757 I762 T765 M766	W729-I733 WeakPolarHBondContact O-CG1 3.33Å; W729-I733 PolarHBondContact O-N 3.22Å; S731-I733 VanDerWaalsContact C-N 3.35Å; S731-I733 PolarHBondContact O-N 3.3Å; I733-E735 VanDerWaalsContact C-N 3.34Å; I733-E735 PolarHBondContact O-N 3.35Å; I733-F736 WeakPolarHBondContact O-CB 3.44Å; I733-F736 PolarHBondContact O-N 3.46Å; I733-F737 HydrophobicContact CG2-CD2 3.82Å; I733-F737 HydrophobicContact CG2-CE2 3.52Å; I733-F737 VanDerWaalsContact O-CD2 3.23Å; I733-F737 WeakPolarHBondContact O-CD2 3.18Å; I733-F737 PolarHBondContact O-N 3.04Å; I733-I751 HydrophobicContact CG1-CG2 4.33Å; I733-M757 HydrophobicContact CD1-CE 4.18Å; I733-M757 HydrophobicContact CG1-CE 4.46Å; I733-I762 HydrophobicContact CD1-CG2 4.34Å; I733-T765 HydrophobicContact CD1-CG2 3.7Å; I733-M766 HydrophobicContact CD1-CG 4.05Å; I733-M766 HydrophobicContact CG2-CG 4.23Å
734	F	92.5	Very high	89.1	Confident	3 Å²	3	52.5 Å²	52.5	1%	0.013	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-36.7	176.4	-78.4	9.9	0	0	0	112.4	K730 S731 F737 D738 L769 M771 A787 I788 Y791	K730-F734 HydrophobicContact CG-CD2 4.4Å; K730-F734 HydrophobicContact CG-CE2 4.31Å; K730-F734 HydrophobicContact CG-CZ 4.42Å; K730-F734 WeakPolarHBondContact O-CB 3.38Å; K730-F734 VanDerWaalsContact O-CG 3.29Å; K730-F734 WeakPolarHBondContact O-CG 3.46Å; K730-F734 PolarHBondContact O-N 3.01Å; K730-F734 VanDerWaalsContact O-N 3.1Å; S731-F734 PolarHBondContact O-N 3.21Å; F734-F737 PolarHBondContact O-N 2.96Å; F734-D738 WeakPolarHBondContact O-CB 3.42Å; F734-D738 PolarHBondContact O-N 3.02Å; F734-L769 HydrophobicContact CD1-CD1 4.37Å; F734-L769 HydrophobicContact CE1-CD1 3.79Å; F734-L769 HydrophobicContact CE1-CD2 4.17Å; F734-L769 HydrophobicContact CE1-CG 4.48Å; F734-L769 HydrophobicContact CZ-CD2 4.07Å; F734-M771 HydrophobicContact CD1-CE 4.18Å; F734-M771 HydrophobicContact CE1-CE 3.51Å; F734-M771 HydrophobicContact CE1-SD 3.93Å; F734-M771 HydrophobicContact CZ-CE 4.28Å; F734-A787 HydrophobicContact CZ-CB 4.25Å; F734-I788 HydrophobicContact CB-CG1 4.42Å; F734-I788 HydrophobicContact CD1-CG1 3.88Å; F734-I788 HydrophobicContact CD2-CG1 4.41Å; F734-I788 HydrophobicContact CE1-CG1 4.14Å; F734-I788 HydrophobicContact CG-CG1 4.01Å; F734-I788 HydrophobicContact CZ-CG1 4.5Å; F734-Y791 HydrophobicContact CB-CD1 4.18Å; F734-Y791 AromaticContact CD2-CD1 3.8Å; F734-Y791 HydrophobicContact CD2-CD1 3.8Å; F734-Y791 HydrophobicContact CD2-CD2 4.25Å; F734-Y791 AromaticContact CD2-CG 3.58Å; F734-Y791 HydrophobicContact CD2-CG 3.58Å; F734-Y791 HydrophobicContact CE2-CG 4.16Å
735	E	90.9	Very high	88.2	Confident	32 Å²	32	53.5 Å²	53.5	15%	0.15	27%	0.27	C	S	.	.	H	α-helix	trans	-72.7	-31.5	175.3	-72.5	164.3	-128.3	0	0	112.8	R694 S731 A732 I733 K739 M792 R801	R694-E735 IonicContact NH2-OE1 3.8Å; R694-E735 PolarHBondContact NH2-OE1 3.17Å; S731-E735 VanDerWaalsContact O-CB 3.31Å; S731-E735 WeakPolarHBondContact O-CB 3.47Å; S731-E735 WeakPolarHBondContact O-CG 3.22Å; S731-E735 PolarHBondContact O-N 3.48Å; S731-E735 PolarHBondContact OG-OE1 3.19Å; A732-E735 PolarHBondContact O-N 3.09Å; I733-E735 VanDerWaalsContact C-N 3.34Å; I733-E735 PolarHBondContact O-N 3.35Å; E735-K739 WeakPolarHBondContact O-CB 3.46Å; E735-K739 VanDerWaalsContact O-CG 3.26Å; E735-K739 WeakPolarHBondContact O-CG 3.37Å; E735-K739 PolarHBondContact O-N 3Å; E735-M792 HydrophobicContact CG-CE 3.82Å; E735-M792 HydrophobicContact CG-SD 3.98Å; E735-R801 IonicContact OE1-CZ 3.67Å; E735-R801 VanDerWaalsContact OE1-CZ 3.31Å; E735-R801 IonicContact OE1-NH1 2.78Å; E735-R801 PolarHBondContact OE1-NH1 3.37Å; E735-R801 IonicContact OE1-NH2 3.37Å; E735-R801 PolarHBondContact OE1-NH2 2.69Å; E735-R801 IonicContact OE2-CZ 3.27Å; E735-R801 IonicContact OE2-NH1 2.68Å; E735-R801 IonicContact OE2-NH2 3.92Å; E735-R801 PolarHBondContact OE2-NH2 3.13Å
736	F	91.7	Very high	87.1	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-48.4	170.5	173.2	-90.1	0	0	0	110.8	A732 I733 K739 N740 M743 Q750 I751 T754	A732-F736 WeakPolarHBondContact O-CB 3.34Å; A732-F736 PolarHBondContact O-N 3.18Å; I733-F736 WeakPolarHBondContact O-CB 3.44Å; I733-F736 PolarHBondContact O-N 3.46Å; F736-K739 PolarHBondContact O-N 3.21Å; F736-N740 WeakPolarHBondContact O-CB 3.37Å; F736-N740 PolarHBondContact O-N 2.87Å; F736-N740 VanDerWaalsContact O-N 3.08Å; F736-N740 PolarHBondContact O-ND2 3.21Å; F736-M743 HydrophobicContact CE1-CE 3.71Å; F736-M743 HydrophobicContact CE1-SD 4.49Å; F736-M743 HydrophobicContact CZ-CE 4.03Å; F736-M743 HydrophobicContact CZ-SD 4.22Å; F736-Q750 HydrophobicContact CZ-CB 4.3Å; F736-I751 HydrophobicContact CD1-CG1 3.83Å; F736-I751 HydrophobicContact CE1-CD1 4.35Å; F736-I751 HydrophobicContact CE1-CG1 3.53Å; F736-I751 HydrophobicContact CE2-CG1 4.42Å; F736-I751 HydrophobicContact CG-CG1 4.4Å; F736-I751 HydrophobicContact CZ-CG1 3.86Å; F736-T754 HydrophobicContact CD2-CG2 3.8Å; F736-T754 HydrophobicContact CE2-CG2 4.14Å
737	F	91.2	Very high	86.7	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-68.8	-37.3	177.5	-71.2	-57	0	0	0	113.3	I733 F734 K739 N740 R741 M743 C746 I751 M766 M771 I783 W785 I788	I733-F737 HydrophobicContact CG2-CD2 3.82Å; I733-F737 HydrophobicContact CG2-CE2 3.52Å; I733-F737 VanDerWaalsContact O-CD2 3.23Å; I733-F737 WeakPolarHBondContact O-CD2 3.18Å; I733-F737 PolarHBondContact O-N 3.04Å; F734-F737 PolarHBondContact O-N 2.96Å; F737-K739 VanDerWaalsContact C-N 3.28Å; F737-K739 PolarHBondContact O-N 3.26Å; F737-N740 CarbonylContact O-C 3.49Å; F737-N740 PolarHBondContact O-N 2.96Å; F737-R741 PolarHBondContact O-N 3.41Å; F737-M743 HydrophobicContact CE1-CE 4.41Å; F737-C746 HydrophobicContact CE1-CB 4.23Å; F737-I751 HydrophobicContact CZ-CD1 4.27Å; F737-M766 HydrophobicContact CE2-CE 4.16Å; F737-M766 HydrophobicContact CZ-CE 3.9Å; F737-M771 HydrophobicContact CE2-SD 4.31Å; F737-I783 HydrophobicContact CD1-CD1 3.81Å; F737-I783 HydrophobicContact CD1-CG1 4.45Å; F737-I783 HydrophobicContact CD1-CG2 4.48Å; F737-I783 HydrophobicContact CE1-CD1 3.58Å; F737-I783 HydrophobicContact CE1-CG1 4.12Å; F737-I783 HydrophobicContact CG-CG2 4.34Å; F737-I783 HydrophobicContact CZ-CD1 4.24Å; F737-I783 HydrophobicContact CZ-CG1 4.3Å; F737-W785 HydrophobicContact CB-CH2 4.28Å; F737-W785 HydrophobicContact CB-CZ3 4.11Å; F737-W785 WeakPolarHBondContact O-CZ3 3.15Å; F737-I788 HydrophobicContact CB-CD1 3.69Å; F737-I788 HydrophobicContact CD2-CD1 4.25Å; F737-I788 HydrophobicContact CG-CD1 4.25Å
738	D	89.4	Confident	86.6	Confident	40 Å²	40	54.4 Å²	54.4	21%	0.214	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-33.4	176.6	-171.2	52.5	0	0	0	112.8	F734 R741 I788 M792	F734-D738 WeakPolarHBondContact O-CB 3.42Å; F734-D738 PolarHBondContact O-N 3.02Å; D738-R741 IonicContact OD1-CZ 3.92Å; D738-R741 IonicContact OD1-NE 3.29Å; D738-R741 PolarHBondContact OD1-NE 2.73Å; D738-R741 IonicContact OD1-NH2 3.62Å; D738-R741 PolarHBondContact OD1-NH2 2.87Å; D738-I788 HydrophobicContact CB-CG2 4.15Å; D738-M792 HydrophobicContact CB-CE 4.05Å; D738-M792 HydrophobicContact CB-CG 4.06Å; D738-M792 WeakPolarHBondContact OD2-CE 3.48Å
739	K	88.4	Confident	86.5	Confident	168 Å²	168	59.1 Å²	59.1	73%	0.73	29%	0.29	S	S	*	.	H	α-helix	trans	-78.2	-29.9	173.6	-71.7	172.8	-179.1	-179.7	0	113.7	E735 F736 F737	E735-K739 WeakPolarHBondContact O-CB 3.46Å; E735-K739 VanDerWaalsContact O-CG 3.26Å; E735-K739 WeakPolarHBondContact O-CG 3.37Å; E735-K739 PolarHBondContact O-N 3Å; F736-K739 PolarHBondContact O-N 3.21Å; F737-K739 VanDerWaalsContact C-N 3.28Å; F737-K739 PolarHBondContact O-N 3.26Å
740	N	89.2	Confident	86.3	Confident	59 Å²	59	62 Å²	62	32%	0.316	30%	0.304	S	S	.	.			trans	-111.9	42.1	-172	-65.8	-77.6	0	0	0	112.4	F736 F737 D742 M743	F736-N740 WeakPolarHBondContact O-CB 3.37Å; F736-N740 PolarHBondContact O-N 2.87Å; F736-N740 VanDerWaalsContact O-N 3.08Å; F736-N740 PolarHBondContact O-ND2 3.21Å; F737-N740 CarbonylContact O-C 3.49Å; F737-N740 PolarHBondContact O-N 2.96Å; N740-D742 VanDerWaalsContact C-N 3.28Å; N740-D742 PolarHBondContact O-N 3.1Å; N740-M743 HydrophobicContact CB-CB 4.14Å; N740-M743 HydrophobicContact CB-CE 4.15Å; N740-M743 HydrophobicContact CB-SD 4.32Å; N740-M743 WeakPolarHBondContact O-CB 3.15Å; N740-M743 PolarHBondContact O-N 2.94Å
741	R	86.5	Confident	86.2	Confident	107 Å²	107	58.1 Å²	58.1	40%	0.404	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-34	-177.5	-70.7	-177.6	-178.9	-117.3	4	113.9	F737 D738 M743 W785 D789	F737-R741 PolarHBondContact O-N 3.41Å; D738-R741 IonicContact OD1-CZ 3.92Å; D738-R741 IonicContact OD1-NE 3.29Å; D738-R741 PolarHBondContact OD1-NE 2.73Å; D738-R741 IonicContact OD1-NH2 3.62Å; D738-R741 PolarHBondContact OD1-NH2 2.87Å; R741-M743 VanDerWaalsContact C-N 3.26Å; R741-M743 PolarHBondContact O-N 2.8Å; R741-W785 HydrophobicContact CB-CH2 4.4Å; R741-W785 HydrophobicContact CG-CH2 4.12Å; R741-W785 HydrophobicContact CG-CZ3 3.8Å; R741-D789 IonicContact CZ-OD1 3.57Å; R741-D789 IonicContact NH1-OD1 2.96Å; R741-D789 PolarHBondContact NH1-OD1 2.84Å; R741-D789 IonicContact NH2-OD1 2.7Å; R741-D789 PolarHBondContact NH2-OD1 3.34Å
742	D	81	Confident	86.3	Confident	156 Å²	156	58.4 Å²	58.4	83%	0.834	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	1.3	-177.7	-54.7	-59.3	0	0	0	113.9	N740 K744	N740-D742 VanDerWaalsContact C-N 3.28Å; N740-D742 PolarHBondContact O-N 3.1Å; D742-K744 PolarHBondContact O-N 2.7Å; D742-K744 VanDerWaalsContact O-N 3.16Å
743	M	76.1	Confident	86.3	Confident	42 Å²	42	62.6 Å²	62.6	21%	0.207	31%	0.307	C	S	.	.			trans	-75.2	104.2	-171.8	-175.2	179.7	56.6	0	0	112.3	F736 F737 N740 R741 A745 C746	F736-M743 HydrophobicContact CE1-CE 3.71Å; F736-M743 HydrophobicContact CE1-SD 4.49Å; F736-M743 HydrophobicContact CZ-CE 4.03Å; F736-M743 HydrophobicContact CZ-SD 4.22Å; F737-M743 HydrophobicContact CE1-CE 4.41Å; N740-M743 HydrophobicContact CB-CB 4.14Å; N740-M743 HydrophobicContact CB-CE 4.15Å; N740-M743 HydrophobicContact CB-SD 4.32Å; N740-M743 WeakPolarHBondContact O-CB 3.15Å; N740-M743 PolarHBondContact O-N 2.94Å; R741-M743 VanDerWaalsContact C-N 3.26Å; R741-M743 PolarHBondContact O-N 2.8Å; M743-A745 VanDerWaalsContact CG-O 3.24Å; M743-A745 WeakPolarHBondContact CG-O 3.15Å; M743-A745 PolarHBondContact O-N 3.37Å; M743-A745 VanDerWaalsContact O-N 3.17Å; M743-C746 HydrophobicContact CE-CB 3.58Å
744	K	68.1	Low	86.3	Confident	185 Å²	185	66.3 Å²	66.3	80%	0.804	33%	0.329	S	S	*	.	S	Bend	trans	-71.3	-0.6	-178	-61	-176.2	-179	179.1	0	116.1	D742 F1006	D742-K744 PolarHBondContact O-N 2.7Å; D742-K744 VanDerWaalsContact O-N 3.16Å; K744-F1006 VanDerWaalsContact O-CD1 3.29Å; K744-F1006 WeakPolarHBondContact O-CD1 2.95Å; K744-F1006 WeakPolarHBondContact O-CE1 3.37Å
745	A	70.9	Confident	86.3	Confident	64 Å²	64	66.6 Å²	66.6	53%	0.529	33%	0.331	S	S	.	.	S	Bend	trans	-160.6	124.4	170.5	0	0	0	0	0	108.9	M743	M743-A745 VanDerWaalsContact CG-O 3.24Å; M743-A745 WeakPolarHBondContact CG-O 3.15Å; M743-A745 PolarHBondContact O-N 3.37Å; M743-A745 VanDerWaalsContact O-N 3.17Å
746	C	72.9	Confident	86.4	Confident	21 Å²	21	65.1 Å²	65.1	14%	0.142	33%	0.325	C	S	.	.			trans	-97.6	124.9	174.6	-176.4	0	0	0	0	110.3	F737 M743	F737-C746 HydrophobicContact CE1-CB 4.23Å; M743-C746 HydrophobicContact CE-CB 3.58Å
747	N	82.9	Confident	86.6	Confident	85 Å²	85	64.8 Å²	64.8	46%	0.455	32%	0.323	S	S	.	.			trans	-105.6	135	168.3	-172.6	-16.1	0	0	0	110	K749 Q750 I751	N747-K749 PolarHBondContact O-N 2.81Å; N747-K749 VanDerWaalsContact O-N 3.17Å; N747-K749 WeakPolarHBondContact OD1-CB 3.2Å; N747-K749 PolarHBondContact OD1-N 2.7Å; N747-Q750 HydrophobicContact CB-CG 4.15Å; N747-Q750 WeakPolarHBondContact O-CB 3.34Å; N747-Q750 PolarHBondContact O-N 2.89Å; N747-I751 PolarHBondContact O-N 2.79Å
748	I	89.5	Confident	86.7	Confident	40 Å²	40	65.7 Å²	65.7	21%	0.205	33%	0.329	C	S	.	.	H	α-helix	trans	-54.2	-33.9	173.2	-64.5	161.9	0	0	0	110.9	Q750 I751 S752 P759 I762 V763 F781	I748-Q750 VanDerWaalsContact C-N 3.34Å; I748-Q750 PolarHBondContact O-N 2.54Å; I748-I751 PolarHBondContact O-N 3.41Å; I748-S752 WeakPolarHBondContact O-CB 3.34Å; I748-S752 PolarHBondContact O-N 3.04Å; I748-P759 HydrophobicContact CG2-CB 3.9Å; I748-I762 HydrophobicContact CG2-CB 4.37Å; I748-I762 HydrophobicContact CG2-CD1 4.42Å; I748-I762 HydrophobicContact CG2-CG2 4.09Å; I748-V763 HydrophobicContact CD1-CG2 3.71Å; I748-F781 HydrophobicContact CD1-CE1 4.25Å; I748-F781 HydrophobicContact CD1-CZ 4.01Å; I748-F781 HydrophobicContact CG1-CE1 4.33Å; I748-F781 HydrophobicContact CG1-CZ 4.35Å
749	K	90.3	Very high	86.9	Confident	122 Å²	122	66.8 Å²	66.8	53%	0.53	34%	0.338	S	S	.	.	H	α-helix	trans	-56.9	-43.4	174.3	-168	173.7	-173.1	-74.6	0	112.4	N747 S752 E753	N747-K749 PolarHBondContact O-N 2.81Å; N747-K749 VanDerWaalsContact O-N 3.17Å; N747-K749 WeakPolarHBondContact OD1-CB 3.2Å; N747-K749 PolarHBondContact OD1-N 2.7Å; K749-S752 WeakPolarHBondContact O-CB 3.09Å; K749-S752 PolarHBondContact O-N 3.29Å; K749-E753 IonicContact NZ-OE1 2.69Å; K749-E753 PolarHBondContact NZ-OE1 2.72Å; K749-E753 VanDerWaalsContact O-CG 3.29Å; K749-E753 WeakPolarHBondContact O-CG 3.31Å; K749-E753 PolarHBondContact O-N 3.33Å
750	Q	90.4	Very high	87.1	Confident	74 Å²	74	62.8 Å²	62.8	35%	0.346	33%	0.327	S	S	.	.	H	α-helix	trans	-68	-37.8	178.7	-65	164.5	-50.5	0	0	112	F736 N747 I748 S752 T754	F736-Q750 HydrophobicContact CZ-CB 4.3Å; N747-Q750 HydrophobicContact CB-CG 4.15Å; N747-Q750 WeakPolarHBondContact O-CB 3.34Å; N747-Q750 PolarHBondContact O-N 2.89Å; I748-Q750 VanDerWaalsContact C-N 3.34Å; I748-Q750 PolarHBondContact O-N 2.54Å; Q750-S752 VanDerWaalsContact C-N 3.33Å; Q750-T754 VanDerWaalsContact O-CB 3.22Å; Q750-T754 WeakPolarHBondContact O-CB 3.29Å; Q750-T754 PolarHBondContact O-N 3.46Å; Q750-T754 PolarHBondContact O-OG1 2.9Å
751	I	92.3	Very high	87.4	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-45.7	172.3	-55.8	174.6	0	0	0	109.2	I733 F736 F737 N747 I748 T754 T755 I762 M766	I733-I751 HydrophobicContact CG1-CG2 4.33Å; F736-I751 HydrophobicContact CD1-CG1 3.83Å; F736-I751 HydrophobicContact CE1-CD1 4.35Å; F736-I751 HydrophobicContact CE1-CG1 3.53Å; F736-I751 HydrophobicContact CE2-CG1 4.42Å; F736-I751 HydrophobicContact CG-CG1 4.4Å; F736-I751 HydrophobicContact CZ-CG1 3.86Å; F737-I751 HydrophobicContact CZ-CD1 4.27Å; N747-I751 PolarHBondContact O-N 2.79Å; I748-I751 PolarHBondContact O-N 3.41Å; I751-T754 PolarHBondContact O-N 3.31Å; I751-T755 HydrophobicContact CG2-CG2 4.16Å; I751-T755 WeakPolarHBondContact O-CB 3.46Å; I751-T755 WeakPolarHBondContact O-CG2 3.28Å; I751-T755 PolarHBondContact O-N 3.06Å; I751-T755 PolarHBondContact O-OG1 3.29Å; I751-I762 HydrophobicContact CB-CD1 3.92Å; I751-I762 HydrophobicContact CB-CG2 4.29Å; I751-I762 HydrophobicContact CD1-CG2 3.93Å; I751-I762 HydrophobicContact CG2-CD1 3.67Å; I751-I762 HydrophobicContact CG2-CG1 3.89Å; I751-I762 HydrophobicContact CG2-CG2 3.96Å; I751-M766 HydrophobicContact CD1-SD 3.86Å
752	S	94.3	Very high	87.7	Confident	7 Å²	7	54.9 Å²	54.9	5%	0.049	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-50.1	-179.3	-163.4	0	0	0	0	111.8	V710 I748 K749 Q750 T755 G756 M757 I762	V710-S752 WeakPolarHBondContact CG1-OG 3.47Å; I748-S752 WeakPolarHBondContact O-CB 3.34Å; I748-S752 PolarHBondContact O-N 3.04Å; K749-S752 WeakPolarHBondContact O-CB 3.09Å; K749-S752 PolarHBondContact O-N 3.29Å; Q750-S752 VanDerWaalsContact C-N 3.33Å; S752-T755 PolarHBondContact O-N 2.99Å; S752-G756 WeakPolarHBondContact O-CA 3.43Å; S752-G756 PolarHBondContact O-N 3.39Å; S752-M757 WeakPolarHBondContact CA-O 3.39Å; S752-M757 WeakPolarHBondContact CB-O 3.45Å; S752-M757 PolarHBondContact OG-O 2.78Å; S752-I762 VanDerWaalsContact CA-CD1 3.49Å
753	E	91.4	Very high	88.3	Confident	101 Å²	101	49.3 Å²	49.3	47%	0.472	27%	0.265	S	S	.	.	H	α-helix	trans	-61.2	-46.5	175.3	-69.1	161.2	157.7	0	0	112.1	K749 T755	K749-E753 IonicContact NZ-OE1 2.69Å; K749-E753 PolarHBondContact NZ-OE1 2.72Å; K749-E753 VanDerWaalsContact O-CG 3.29Å; K749-E753 WeakPolarHBondContact O-CG 3.31Å; K749-E753 PolarHBondContact O-N 3.33Å; E753-T755 VanDerWaalsContact C-N 3.32Å; E753-T755 PolarHBondContact O-N 2.76Å
754	T	91.6	Very high	89	Confident	78 Å²	78	51.7 Å²	51.7	48%	0.479	28%	0.276	S	S	.	.	H	α-helix	trans	-73.5	-21.1	-175.7	-51.3	0	0	0	0	113.3	R705 F736 Q750 I751	R705-T754 WeakPolarHBondContact CD-O 3.48Å; F736-T754 HydrophobicContact CD2-CG2 3.8Å; F736-T754 HydrophobicContact CE2-CG2 4.14Å; Q750-T754 VanDerWaalsContact O-CB 3.22Å; Q750-T754 WeakPolarHBondContact O-CB 3.29Å; Q750-T754 PolarHBondContact O-N 3.46Å; Q750-T754 PolarHBondContact O-OG1 2.9Å; I751-T754 PolarHBondContact O-N 3.31Å
755	T	92.5	Very high	90.2	Very high	9 Å²	9	43.1 Å²	43.1	6%	0.055	24%	0.239	C	C	.	.	H	α-helix	trans	-109.7	-27.8	-177.3	61.2	0	0	0	0	113.9	R705 A732 I751 S752 E753 M757	R705-T755 PolarHBondContact NH1-O 3.42Å; A732-T755 HydrophobicContact CB-CG2 4.16Å; I751-T755 HydrophobicContact CG2-CG2 4.16Å; I751-T755 WeakPolarHBondContact O-CB 3.46Å; I751-T755 WeakPolarHBondContact O-CG2 3.28Å; I751-T755 PolarHBondContact O-N 3.06Å; I751-T755 PolarHBondContact O-OG1 3.29Å; S752-T755 PolarHBondContact O-N 2.99Å; E753-T755 VanDerWaalsContact C-N 3.32Å; E753-T755 PolarHBondContact O-N 2.76Å; T755-M757 VanDerWaalsContact C-N 3.27Å; T755-M757 HydrophobicContact CG2-SD 4.45Å; T755-M757 WeakPolarHBondContact OG1-CB 3.44Å; T755-M757 PolarHBondContact OG1-N 3.46Å; T755-M757 VanDerWaalsContact OG1-N 3.15Å
756	G	93.5	Very high	91.2	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.01	21%	0.214	C	C	.	.			trans	79.1	5.5	-166.5	0	0	0	0	0	113.6	Y701 G711 S752	Y701-G756 WeakPolarHBondContact CD1-O 3.42Å; Y701-G756 WeakPolarHBondContact CE1-O 3.4Å; G711-G756 PolarHBondContact N-O 3.44Å; S752-G756 WeakPolarHBondContact O-CA 3.43Å; S752-G756 PolarHBondContact O-N 3.39Å
757	M	95.6	Very high	92	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-79.6	146.2	176.9	-66	170.1	51.8	0	0	111.5	Y701 W729 A732 I733 S752 T755 D761 I762	Y701-M757 HydrophobicContact CD1-CG 4.21Å; Y701-M757 HydrophobicContact CE1-CB 4.29Å; Y701-M757 HydrophobicContact CE1-CG 3.77Å; W729-M757 HydrophobicContact CB-CE 3.59Å; W729-M757 HydrophobicContact CB-SD 4.25Å; W729-M757 VanDerWaalsContact CD1-CE 3.42Å; W729-M757 VanDerWaalsContact CD1-SD 3.58Å; W729-M757 HydrophobicContact CD2-CE 4.33Å; W729-M757 HydrophobicContact CG-CE 3.54Å; W729-M757 HydrophobicContact CG-SD 4.18Å; A732-M757 HydrophobicContact CB-SD 3.99Å; I733-M757 HydrophobicContact CD1-CE 4.18Å; I733-M757 HydrophobicContact CG1-CE 4.46Å; S752-M757 WeakPolarHBondContact CA-O 3.39Å; S752-M757 WeakPolarHBondContact CB-O 3.45Å; S752-M757 PolarHBondContact OG-O 2.78Å; T755-M757 VanDerWaalsContact C-N 3.27Å; T755-M757 HydrophobicContact CG2-SD 4.45Å; T755-M757 WeakPolarHBondContact OG1-CB 3.44Å; T755-M757 PolarHBondContact OG1-N 3.46Å; T755-M757 VanDerWaalsContact OG1-N 3.15Å; M757-D761 HydrophobicContact CE-CB 4.29Å; M757-I762 HydrophobicContact CB-CD1 4.05Å; M757-I762 HydrophobicContact CB-CG1 3.84Å; M757-I762 HydrophobicContact CE-CG1 3.8Å
758	T	94.5	Very high	92.3	Very high	21 Å²	21	43.4 Å²	43.4	13%	0.129	23%	0.233	C	C	.	.			trans	-65.4	151.5	171.7	73	0	0	0	0	111.4	T712 V760 D761 I762	T712-T758 HydrophobicContact CG2-CG2 4.42Å; T758-V760 PolarHBondContact O-N 3.47Å; T758-V760 VanDerWaalsContact O-N 3.16Å; T758-D761 PolarHBondContact O-N 3.18Å; T758-D761 PolarHBondContact OG1-N 3.46Å; T758-D761 VanDerWaalsContact OG1-N 3.16Å; T758-D761 PolarHBondContact OG1-OD2 3.29Å; T758-I762 WeakPolarHBondContact O-CD1 3.44Å; T758-I762 WeakPolarHBondContact O-CG1 3.47Å; T758-I762 PolarHBondContact O-N 3.13Å; T758-I762 VanDerWaalsContact O-N 3.12Å
759	P	93.8	Very high	92.2	Very high	62 Å²	62	42.7 Å²	42.7	40%	0.403	23%	0.229	S	C	.	.	H	α-helix	trans	-55	-30.5	172.4	-28.3	37	0	0	0	113.7	I748 V763	I748-P759 HydrophobicContact CG2-CB 3.9Å; P759-V763 VanDerWaalsContact O-CG2 3.31Å; P759-V763 WeakPolarHBondContact O-CG2 3.41Å; P759-V763 PolarHBondContact O-N 2.89Å
760	V	92.7	Very high	92	Very high	84 Å²	84	42.6 Å²	42.6	51%	0.509	24%	0.235	S	C	.	.	H	α-helix	trans	-67.5	-52.5	178	-177.3	0	0	0	0	110.8	T758 I762 V763 E764	T758-V760 PolarHBondContact O-N 3.47Å; T758-V760 VanDerWaalsContact O-N 3.16Å; V760-I762 PolarHBondContact O-N 2.93Å; V760-V763 PolarHBondContact O-N 3.36Å; V760-V763 VanDerWaalsContact O-N 3.14Å; V760-E764 HydrophobicContact CG1-CG 4.45Å; V760-E764 PolarHBondContact O-N 3.46Å
761	D	94.3	Very high	91.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-30.4	179.9	-54.4	-51	0	0	0	111.4	T712 K715 W729 M757 T758 T765	T712-D761 WeakPolarHBondContact CB-OD2 3.37Å; T712-D761 VanDerWaalsContact OG1-CG 3.26Å; T712-D761 PolarHBondContact OG1-OD1 3.47Å; T712-D761 VanDerWaalsContact OG1-OD1 3.08Å; T712-D761 PolarHBondContact OG1-OD2 3.21Å; K715-D761 IonicContact NZ-OD1 3.04Å; K715-D761 PolarHBondContact NZ-OD1 3.17Å; W729-D761 HydrophobicContact CD2-CB 4.39Å; W729-D761 HydrophobicContact CH2-CB 4.18Å; W729-D761 HydrophobicContact CZ2-CB 4.01Å; W729-D761 HydrophobicContact CZ3-CB 4.44Å; M757-D761 HydrophobicContact CE-CB 4.29Å; T758-D761 PolarHBondContact O-N 3.18Å; T758-D761 PolarHBondContact OG1-N 3.46Å; T758-D761 VanDerWaalsContact OG1-N 3.16Å; T758-D761 PolarHBondContact OG1-OD2 3.29Å; D761-T765 WeakPolarHBondContact O-CB 3.38Å; D761-T765 PolarHBondContact O-N 3.29Å; D761-T765 VanDerWaalsContact O-N 3.09Å; D761-T765 PolarHBondContact O-OG1 2.9Å
762	I	94	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.7	-51.3	172.5	-65.7	161.5	0	0	0	111	I733 I748 I751 S752 M757 T758 V760 T765 M766	I733-I762 HydrophobicContact CD1-CG2 4.34Å; I748-I762 HydrophobicContact CG2-CB 4.37Å; I748-I762 HydrophobicContact CG2-CD1 4.42Å; I748-I762 HydrophobicContact CG2-CG2 4.09Å; I751-I762 HydrophobicContact CB-CD1 3.92Å; I751-I762 HydrophobicContact CB-CG2 4.29Å; I751-I762 HydrophobicContact CD1-CG2 3.93Å; I751-I762 HydrophobicContact CG2-CD1 3.67Å; I751-I762 HydrophobicContact CG2-CG1 3.89Å; I751-I762 HydrophobicContact CG2-CG2 3.96Å; S752-I762 VanDerWaalsContact CA-CD1 3.49Å; M757-I762 HydrophobicContact CB-CD1 4.05Å; M757-I762 HydrophobicContact CB-CG1 3.84Å; M757-I762 HydrophobicContact CE-CG1 3.8Å; T758-I762 WeakPolarHBondContact O-CD1 3.44Å; T758-I762 WeakPolarHBondContact O-CG1 3.47Å; T758-I762 PolarHBondContact O-N 3.13Å; T758-I762 VanDerWaalsContact O-N 3.12Å; V760-I762 PolarHBondContact O-N 2.93Å; I762-T765 PolarHBondContact O-N 3.38Å; I762-M766 HydrophobicContact CG2-CG 4.33Å; I762-M766 HydrophobicContact CG2-SD 3.89Å; I762-M766 WeakPolarHBondContact O-CB 2.95Å; I762-M766 WeakPolarHBondContact O-CG 3.35Å; I762-M766 PolarHBondContact O-N 3.39Å
763	V	92.2	Very high	90.5	Very high	40 Å²	40	43.1 Å²	43.1	24%	0.242	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-47.3	-179.2	169.3	0	0	0	0	111.3	I748 P759 V760 T765 M766 Q767 I772	I748-V763 HydrophobicContact CD1-CG2 3.71Å; P759-V763 VanDerWaalsContact O-CG2 3.31Å; P759-V763 WeakPolarHBondContact O-CG2 3.41Å; P759-V763 PolarHBondContact O-N 2.89Å; V760-V763 PolarHBondContact O-N 3.36Å; V760-V763 VanDerWaalsContact O-N 3.14Å; V763-T765 VanDerWaalsContact C-N 3.28Å; V763-T765 PolarHBondContact O-N 2.89Å; V763-M766 PolarHBondContact O-N 3.45Å; V763-Q767 HydrophobicContact CG1-CG 4.3Å; V763-Q767 WeakPolarHBondContact O-CB 3.46Å; V763-Q767 VanDerWaalsContact O-CG 3.28Å; V763-Q767 WeakPolarHBondContact O-CG 3.31Å; V763-Q767 PolarHBondContact O-N 3.19Å; V763-I772 HydrophobicContact CB-CD1 4.49Å; V763-I772 HydrophobicContact CG1-CD1 4.24Å; V763-I772 HydrophobicContact CG2-CD1 4.31Å
764	E	91.4	Very high	89.6	Confident	92 Å²	92	45.1 Å²	45.1	43%	0.43	25%	0.252	S	S	.	.	H	α-helix	trans	-54.9	-45.7	174.3	-75.7	-173.7	-151.8	0	0	110.9	V760 S768	V760-E764 HydrophobicContact CG1-CG 4.45Å; V760-E764 PolarHBondContact O-N 3.46Å; E764-S768 WeakPolarHBondContact O-CB 3.45Å; E764-S768 PolarHBondContact O-N 2.96Å
765	T	93	Very high	88.2	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-68.2	-45	-179.8	-56.7	0	0	0	0	111.4	W729 K730 I733 D761 I762 V763 Q767 S768 L769	W729-T765 HydrophobicContact CB-CG2 3.95Å; W729-T765 WeakPolarHBondContact CB-OG1 3.49Å; K730-T765 HydrophobicContact CB-CG2 4.47Å; I733-T765 HydrophobicContact CD1-CG2 3.7Å; D761-T765 WeakPolarHBondContact O-CB 3.38Å; D761-T765 PolarHBondContact O-N 3.29Å; D761-T765 VanDerWaalsContact O-N 3.09Å; D761-T765 PolarHBondContact O-OG1 2.9Å; I762-T765 PolarHBondContact O-N 3.38Å; V763-T765 VanDerWaalsContact C-N 3.28Å; V763-T765 PolarHBondContact O-N 2.89Å; T765-Q767 PolarHBondContact O-N 3.18Å; T765-S768 PolarHBondContact O-N 2.96Å; T765-S768 PolarHBondContact O-OG 3.31Å; T765-L769 HydrophobicContact CG2-CD1 3.93Å; T765-L769 WeakPolarHBondContact O-CD1 3.29Å; T765-L769 WeakPolarHBondContact O-CG 3.36Å; T765-L769 PolarHBondContact O-N 3.08Å; T765-L769 VanDerWaalsContact O-N 3.17Å
766	M	91.4	Very high	87.4	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-36.7	178.2	-71.1	-176.2	71.9	0	0	112.6	I733 F737 I751 I762 V763 L769 N770 M771 I772 F781	I733-M766 HydrophobicContact CD1-CG 4.05Å; I733-M766 HydrophobicContact CG2-CG 4.23Å; F737-M766 HydrophobicContact CE2-CE 4.16Å; F737-M766 HydrophobicContact CZ-CE 3.9Å; I751-M766 HydrophobicContact CD1-SD 3.86Å; I762-M766 HydrophobicContact CG2-CG 4.33Å; I762-M766 HydrophobicContact CG2-SD 3.89Å; I762-M766 WeakPolarHBondContact O-CB 2.95Å; I762-M766 WeakPolarHBondContact O-CG 3.35Å; I762-M766 PolarHBondContact O-N 3.39Å; V763-M766 PolarHBondContact O-N 3.45Å; M766-L769 CarbonylContact O-C 3.51Å; M766-L769 PolarHBondContact O-N 3.43Å; M766-N770 PolarHBondContact O-N 2.75Å; M766-M771 HydrophobicContact CB-CB 4.25Å; M766-M771 HydrophobicContact CE-CB 4.09Å; M766-M771 PolarHBondContact O-N 2.94Å; M766-I772 HydrophobicContact CB-CD1 3.62Å; M766-I772 HydrophobicContact CB-CG1 3.84Å; M766-I772 HydrophobicContact CE-CG1 4.21Å; M766-I772 HydrophobicContact SD-CD1 4.28Å; M766-F781 HydrophobicContact CE-CD1 3.86Å; M766-F781 HydrophobicContact CE-CE1 4.26Å
767	Q	89.8	Confident	86.5	Confident	97 Å²	97	57.8 Å²	57.8	45%	0.453	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-45.7	170.5	-73.7	172.3	-16.2	0	0	111.2	V763 T765 L769 N770 I772	V763-Q767 HydrophobicContact CG1-CG 4.3Å; V763-Q767 WeakPolarHBondContact O-CB 3.46Å; V763-Q767 VanDerWaalsContact O-CG 3.28Å; V763-Q767 WeakPolarHBondContact O-CG 3.31Å; V763-Q767 PolarHBondContact O-N 3.19Å; T765-Q767 PolarHBondContact O-N 3.18Å; Q767-L769 PolarHBondContact O-N 2.7Å; Q767-N770 PolarHBondContact O-N 2.63Å; Q767-I772 HydrophobicContact CG-CB 4.11Å; Q767-I772 HydrophobicContact CG-CG2 4.34Å
768	S	89.1	Confident	85.4	Confident	78 Å²	78	60.8 Å²	60.8	55%	0.545	35%	0.348	S	S	.	.	H	α-helix	trans	-63	-11	175.3	83	0	0	0	0	114.6	E764 T765	E764-S768 WeakPolarHBondContact O-CB 3.45Å; E764-S768 PolarHBondContact O-N 2.96Å; T765-S768 PolarHBondContact O-N 2.96Å; T765-S768 PolarHBondContact O-OG 3.31Å
769	L	88.4	Confident	84.4	Confident	24 Å²	24	64.7 Å²	64.7	13%	0.126	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	3	177.3	-64	168.6	0	0	0	112.9	K730 F734 T765 M766 Q767 M771	K730-L769 HydrophobicContact CD-CD2 3.64Å; K730-L769 HydrophobicContact CG-CD1 4.32Å; K730-L769 HydrophobicContact CG-CD2 3.85Å; F734-L769 HydrophobicContact CD1-CD1 4.37Å; F734-L769 HydrophobicContact CE1-CD1 3.79Å; F734-L769 HydrophobicContact CE1-CD2 4.17Å; F734-L769 HydrophobicContact CE1-CG 4.48Å; F734-L769 HydrophobicContact CZ-CD2 4.07Å; T765-L769 HydrophobicContact CG2-CD1 3.93Å; T765-L769 WeakPolarHBondContact O-CD1 3.29Å; T765-L769 WeakPolarHBondContact O-CG 3.36Å; T765-L769 PolarHBondContact O-N 3.08Å; T765-L769 VanDerWaalsContact O-N 3.17Å; M766-L769 CarbonylContact O-C 3.51Å; M766-L769 PolarHBondContact O-N 3.43Å; Q767-L769 PolarHBondContact O-N 2.7Å; L769-M771 HydrophobicContact CB-CB 4.42Å; L769-M771 HydrophobicContact CB-CG 3.92Å; L769-M771 HydrophobicContact CB-SD 4.1Å; L769-M771 HydrophobicContact CD1-SD 4.21Å; L769-M771 PolarHBondContact O-N 3.19Å
770	N	85.9	Confident	83.5	Confident	121 Å²	121	63.9 Å²	63.9	65%	0.647	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	22.1	-170.3	-56.3	-35.2	0	0	0	113.9	M766 Q767 L773	M766-N770 PolarHBondContact O-N 2.75Å; Q767-N770 PolarHBondContact O-N 2.63Å; N770-L773 HydrophobicContact CB-CD2 4.36Å; N770-L773 WeakPolarHBondContact O-CD2 3.4Å
771	M	85.9	Confident	82.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	34%	0.341	C	S	.	.			trans	-86.5	-9.3	-179.8	-70	-178.9	154	0	0	113.6	F734 F737 M766 L769 F781 V782 D784 I788	F734-M771 HydrophobicContact CD1-CE 4.18Å; F734-M771 HydrophobicContact CE1-CE 3.51Å; F734-M771 HydrophobicContact CE1-SD 3.93Å; F734-M771 HydrophobicContact CZ-CE 4.28Å; F737-M771 HydrophobicContact CE2-SD 4.31Å; M766-M771 HydrophobicContact CB-CB 4.25Å; M766-M771 HydrophobicContact CE-CB 4.09Å; M766-M771 PolarHBondContact O-N 2.94Å; L769-M771 HydrophobicContact CB-CB 4.42Å; L769-M771 HydrophobicContact CB-CG 3.92Å; L769-M771 HydrophobicContact CB-SD 4.1Å; L769-M771 HydrophobicContact CD1-SD 4.21Å; L769-M771 PolarHBondContact O-N 3.19Å; M771-F781 WeakPolarHBondContact O-CA 3.35Å; M771-V782 WeakPolarHBondContact CA-O 3.33Å; M771-V782 WeakPolarHBondContact CB-O 3.46Å; M771-V782 WeakPolarHBondContact CG-O 3.43Å; M771-V782 PolarHBondContact O-N 2.89Å; M771-D784 HydrophobicContact CE-CB 4.18Å; M771-I788 HydrophobicContact CE-CD1 3.87Å; M771-I788 HydrophobicContact CE-CG1 4.05Å
772	I	84.4	Confident	82.3	Confident	16 Å²	16	63.2 Å²	63.2	8%	0.082	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118	167.4	-65.9	171.7	0	0	0	106.7	V763 M766 Q767 L779 F781	V763-I772 HydrophobicContact CB-CD1 4.49Å; V763-I772 HydrophobicContact CG1-CD1 4.24Å; V763-I772 HydrophobicContact CG2-CD1 4.31Å; M766-I772 HydrophobicContact CB-CD1 3.62Å; M766-I772 HydrophobicContact CB-CG1 3.84Å; M766-I772 HydrophobicContact CE-CG1 4.21Å; M766-I772 HydrophobicContact SD-CD1 4.28Å; Q767-I772 HydrophobicContact CG-CB 4.11Å; Q767-I772 HydrophobicContact CG-CG2 4.34Å; I772-L779 HydrophobicContact CG2-CD2 3.87Å; I772-F781 HydrophobicContact CD1-CD1 4.41Å; I772-F781 HydrophobicContact CD1-CE1 3.85Å; I772-F781 HydrophobicContact CG1-CD1 3.78Å; I772-F781 HydrophobicContact CG1-CE1 3.7Å
773	L	76.1	Confident	81.9	Confident	74 Å²	74	64.8 Å²	64.8	39%	0.387	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.1	177.7	-57.9	-179.5	0	0	0	110.1	N770 K780 V782	N770-L773 HydrophobicContact CB-CD2 4.36Å; N770-L773 WeakPolarHBondContact O-CD2 3.4Å; L773-K780 PolarHBondContact N-O 3.44Å; L773-K780 PolarHBondContact O-N 3.33Å; L773-V782 HydrophobicContact CD1-CG2 3.8Å; L773-V782 HydrophobicContact CG-CG2 4.3Å
774	L	70.8	Confident	81.6	Confident	142 Å²	142	66.2 Å²	66.2	74%	0.743	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	115	166.6	-78.2	156.9	0	0	0	108.8	L779	L774-L779 HydrophobicContact CD2-CD2 3.56Å; L774-L779 HydrophobicContact CG-CD2 3.94Å
775	Q	63.8	Low	81.5	Confident	111 Å²	111	65 Å²	65	52%	0.519	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	92.8	173.1	-170	168.8	-5.8	0	0	108.3	S778	Q775-S778 PolarHBondContact N-O 3.04Å; Q775-S778 PolarHBondContact O-N 3.43Å; Q775-S778 PolarHBondContact O-OG 3.34Å
776	G	74.3	Confident	81.4	Confident	63 Å²	63	70 Å²	70	65%	0.649	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	-138	-164.3	0	0	0	0	0	111	S778	G776-S778 PolarHBondContact O-N 3.19Å; G776-S778 VanDerWaalsContact O-N 3.16Å
777	N	74.8	Confident	81.2	Confident	181 Å²	181	71.3 Å²	71.3	97%	0.968	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	17.1	176.7	-65.7	2.7	0	0	0	113.6
778	S	72.2	Confident	81.3	Confident	62 Å²	62	66.7 Å²	66.7	43%	0.434	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.5	-179.4	74.1	0	0	0	0	112.2	Q775 G776	Q775-S778 PolarHBondContact N-O 3.04Å; Q775-S778 PolarHBondContact O-N 3.43Å; Q775-S778 PolarHBondContact O-OG 3.34Å; G776-S778 PolarHBondContact O-N 3.19Å; G776-S778 VanDerWaalsContact O-N 3.16Å
779	L	73.7	Confident	81.4	Confident	103 Å²	103	64.8 Å²	64.8	54%	0.539	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.1	171.7	-66.5	174.6	0	0	0	109.3	I772 L774	I772-L779 HydrophobicContact CG2-CD2 3.87Å; L774-L779 HydrophobicContact CD2-CD2 3.56Å; L774-L779 HydrophobicContact CG-CD2 3.94Å
780	K	76	Confident	81.5	Confident	45 Å²	45	66.1 Å²	66.1	20%	0.196	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.8	175.8	177.9	173.7	170.7	176.5	0	109.8	L773 V782 M1005	L773-K780 PolarHBondContact N-O 3.44Å; L773-K780 PolarHBondContact O-N 3.33Å; K780-V782 HydrophobicContact CD-CG2 4.36Å; K780-V782 HydrophobicContact CG-CG2 4.04Å; K780-M1005 HydrophobicContact CD-SD 4.23Å; K780-M1005 WeakPolarHBondContact CE-SD 3.29Å; K780-M1005 PolarHBondContact NZ-SD 2.97Å
781	F	79.9	Confident	81.6	Confident	35 Å²	35	62.2 Å²	62.2	15%	0.154	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.9	169.6	-63.3	-85.1	0	0	0	109.7	I748 M766 M771 I772	I748-F781 HydrophobicContact CD1-CE1 4.25Å; I748-F781 HydrophobicContact CD1-CZ 4.01Å; I748-F781 HydrophobicContact CG1-CE1 4.33Å; I748-F781 HydrophobicContact CG1-CZ 4.35Å; M766-F781 HydrophobicContact CE-CD1 3.86Å; M766-F781 HydrophobicContact CE-CE1 4.26Å; M771-F781 WeakPolarHBondContact O-CA 3.35Å; I772-F781 HydrophobicContact CD1-CD1 4.41Å; I772-F781 HydrophobicContact CD1-CE1 3.85Å; I772-F781 HydrophobicContact CG1-CD1 3.78Å; I772-F781 HydrophobicContact CG1-CE1 3.7Å
782	V	82.1	Confident	81.7	Confident	35 Å²	35	63.1 Å²	63.1	21%	0.212	35%	0.349	C	S	.	.			trans	-131	116.8	175.7	-179.6	0	0	0	0	108	M771 L773 K780	M771-V782 WeakPolarHBondContact CA-O 3.33Å; M771-V782 WeakPolarHBondContact CB-O 3.46Å; M771-V782 WeakPolarHBondContact CG-O 3.43Å; M771-V782 PolarHBondContact O-N 2.89Å; L773-V782 HydrophobicContact CD1-CG2 3.8Å; L773-V782 HydrophobicContact CG-CG2 4.3Å; K780-V782 HydrophobicContact CD-CG2 4.36Å; K780-V782 HydrophobicContact CG-CG2 4.04Å
783	I	84.3	Confident	81.9	Confident	33 Å²	33	67.6 Å²	67.6	17%	0.169	37%	0.368	C	S	.	.			trans	-96.1	105.5	179.7	-56.8	172.6	0	0	0	108.4	F737 W785 I788	F737-I783 HydrophobicContact CD1-CD1 3.81Å; F737-I783 HydrophobicContact CD1-CG1 4.45Å; F737-I783 HydrophobicContact CD1-CG2 4.48Å; F737-I783 HydrophobicContact CE1-CD1 3.58Å; F737-I783 HydrophobicContact CE1-CG1 4.12Å; F737-I783 HydrophobicContact CG-CG2 4.34Å; F737-I783 HydrophobicContact CZ-CD1 4.24Å; F737-I783 HydrophobicContact CZ-CG1 4.3Å; I783-W785 VanDerWaalsContact C-N 3.32Å; I783-W785 HydrophobicContact CB-CZ2 4.28Å; I783-W785 HydrophobicContact CD1-CZ2 4.11Å; I783-W785 HydrophobicContact CG2-CD2 3.76Å; I783-W785 HydrophobicContact CG2-CE3 4.07Å; I783-W785 HydrophobicContact CG2-CG 4.31Å; I783-W785 HydrophobicContact CG2-CH2 4.01Å; I783-W785 HydrophobicContact CG2-CZ2 3.71Å; I783-W785 HydrophobicContact CG2-CZ3 4.18Å; I783-W785 PolarHBondContact O-N 2.75Å; I783-I788 HydrophobicContact CG2-CD1 3.52Å
784	D	86.1	Confident	82.4	Confident	71 Å²	71	70.7 Å²	70.7	38%	0.38	37%	0.374	S	S	.	.			trans	-72.7	87.3	171	-175.9	-10.4	0	0	0	110.1	M771 D786 A787 I788	M771-D784 HydrophobicContact CE-CB 4.18Å; D784-D786 VanDerWaalsContact C-N 3.27Å; D784-D786 PolarHBondContact O-N 2.64Å; D784-D786 PolarHBondContact OD1-N 3.16Å; D784-D786 VanDerWaalsContact OD1-N 3.13Å; D784-A787 HydrophobicContact CB-CB 4.03Å; D784-A787 PolarHBondContact O-N 2.81Å; D784-A787 PolarHBondContact OD1-N 2.97Å; D784-A787 WeakPolarHBondContact OD2-CB 3.28Å; D784-I788 WeakPolarHBondContact O-CG1 3.37Å; D784-I788 PolarHBondContact O-N 2.99Å; D784-I788 VanDerWaalsContact O-N 3.13Å
785	W	90.3	Very high	82.9	Confident	67 Å²	67	64.3 Å²	64.3	25%	0.254	34%	0.342	S	S	.	.	H	α-helix	trans	-62.4	-32.2	177	-68.1	112.3	0	0	0	112.6	F737 R741 I783 I788 D789	F737-W785 HydrophobicContact CB-CH2 4.28Å; F737-W785 HydrophobicContact CB-CZ3 4.11Å; F737-W785 WeakPolarHBondContact O-CZ3 3.15Å; R741-W785 HydrophobicContact CB-CH2 4.4Å; R741-W785 HydrophobicContact CG-CH2 4.12Å; R741-W785 HydrophobicContact CG-CZ3 3.8Å; I783-W785 VanDerWaalsContact C-N 3.32Å; I783-W785 HydrophobicContact CB-CZ2 4.28Å; I783-W785 HydrophobicContact CD1-CZ2 4.11Å; I783-W785 HydrophobicContact CG2-CD2 3.76Å; I783-W785 HydrophobicContact CG2-CE3 4.07Å; I783-W785 HydrophobicContact CG2-CG 4.31Å; I783-W785 HydrophobicContact CG2-CH2 4.01Å; I783-W785 HydrophobicContact CG2-CZ2 3.71Å; I783-W785 HydrophobicContact CG2-CZ3 4.18Å; I783-W785 PolarHBondContact O-N 2.75Å; W785-I788 HydrophobicContact CE3-CD1 3.91Å; W785-I788 HydrophobicContact CZ3-CD1 4.12Å; W785-I788 PolarHBondContact O-N 3.36Å; W785-D789 WeakPolarHBondContact O-CB 3.34Å; W785-D789 PolarHBondContact O-N 3.12Å
786	D	89.9	Confident	83.7	Confident	109 Å²	109	67 Å²	67	58%	0.583	35%	0.348	S	S	*	.	H	α-helix	trans	-69.1	-40.7	178.5	-74.2	-54.9	0	0	0	111.2	D784 S790	D784-D786 VanDerWaalsContact C-N 3.27Å; D784-D786 PolarHBondContact O-N 2.64Å; D784-D786 PolarHBondContact OD1-N 3.16Å; D784-D786 VanDerWaalsContact OD1-N 3.13Å; D786-S790 WeakPolarHBondContact O-CB 3.33Å; D786-S790 PolarHBondContact O-N 3.15Å
787	A	88.4	Confident	83.9	Confident	28 Å²	28	70.5 Å²	70.5	23%	0.231	35%	0.351	C	S	.	.	H	α-helix	trans	-65.2	-38	172.6	0	0	0	0	0	112.8	F734 D784 Y791	F734-A787 HydrophobicContact CZ-CB 4.25Å; D784-A787 HydrophobicContact CB-CB 4.03Å; D784-A787 PolarHBondContact O-N 2.81Å; D784-A787 PolarHBondContact OD1-N 2.97Å; D784-A787 WeakPolarHBondContact OD2-CB 3.28Å; A787-Y791 VanDerWaalsContact O-CB 3.28Å; A787-Y791 WeakPolarHBondContact O-CB 3.46Å; A787-Y791 PolarHBondContact O-N 3.46Å
788	I	90.6	Very high	83.8	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.6	-53	173.9	-67.7	161.5	0	0	0	110	F734 F737 D738 M771 I783 D784 W785 S790 Y791 M792	F734-I788 HydrophobicContact CB-CG1 4.42Å; F734-I788 HydrophobicContact CD1-CG1 3.88Å; F734-I788 HydrophobicContact CD2-CG1 4.41Å; F734-I788 HydrophobicContact CE1-CG1 4.14Å; F734-I788 HydrophobicContact CG-CG1 4.01Å; F734-I788 HydrophobicContact CZ-CG1 4.5Å; F737-I788 HydrophobicContact CB-CD1 3.69Å; F737-I788 HydrophobicContact CD2-CD1 4.25Å; F737-I788 HydrophobicContact CG-CD1 4.25Å; D738-I788 HydrophobicContact CB-CG2 4.15Å; M771-I788 HydrophobicContact CE-CD1 3.87Å; M771-I788 HydrophobicContact CE-CG1 4.05Å; I783-I788 HydrophobicContact CG2-CD1 3.52Å; D784-I788 WeakPolarHBondContact O-CG1 3.37Å; D784-I788 PolarHBondContact O-N 2.99Å; D784-I788 VanDerWaalsContact O-N 3.13Å; W785-I788 HydrophobicContact CE3-CD1 3.91Å; W785-I788 HydrophobicContact CZ3-CD1 4.12Å; W785-I788 PolarHBondContact O-N 3.36Å; I788-S790 VanDerWaalsContact C-N 3.33Å; I788-S790 PolarHBondContact O-N 3.17Å; I788-Y791 CarbonylContact O-C 3.46Å; I788-Y791 WeakPolarHBondContact O-CA 3.33Å; I788-Y791 WeakPolarHBondContact O-CB 3.36Å; I788-Y791 PolarHBondContact O-N 2.71Å; I788-M792 HydrophobicContact CG2-CG 4.29Å; I788-M792 WeakPolarHBondContact O-CG 3.45Å; I788-M792 PolarHBondContact O-N 2.95Å
789	D	91.6	Very high	83.5	Confident	39 Å²	39	66 Å²	66	21%	0.209	33%	0.326	C	S	.	.	H	α-helix	trans	-57.1	-47	178.3	-112.9	54	0	0	0	111.5	R741 W785 Y791 M792 K793	R741-D789 IonicContact CZ-OD1 3.57Å; R741-D789 IonicContact NH1-OD1 2.96Å; R741-D789 PolarHBondContact NH1-OD1 2.84Å; R741-D789 IonicContact NH2-OD1 2.7Å; R741-D789 PolarHBondContact NH2-OD1 3.34Å; W785-D789 WeakPolarHBondContact O-CB 3.34Å; W785-D789 PolarHBondContact O-N 3.12Å; D789-Y791 VanDerWaalsContact C-N 3.29Å; D789-Y791 PolarHBondContact O-N 2.87Å; D789-M792 PolarHBondContact O-N 2.73Å; D789-K793 WeakPolarHBondContact O-CB 3.38Å; D789-K793 WeakPolarHBondContact O-CD 3.21Å; D789-K793 WeakPolarHBondContact O-CG 3.32Å; D789-K793 PolarHBondContact O-N 2.96Å; D789-K793 VanDerWaalsContact OD2-CE 3.32Å; D789-K793 WeakPolarHBondContact OD2-CE 3.33Å; D789-K793 IonicContact OD2-NZ 2.62Å; D789-K793 PolarHBondContact OD2-NZ 3.22Å
790	S	90.1	Very high	83.1	Confident	51 Å²	51	65.9 Å²	65.9	36%	0.357	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-37.2	176.4	-173.5	0	0	0	0	111.5	D786 I788 R794	D786-S790 WeakPolarHBondContact O-CB 3.33Å; D786-S790 PolarHBondContact O-N 3.15Å; I788-S790 VanDerWaalsContact C-N 3.33Å; I788-S790 PolarHBondContact O-N 3.17Å; S790-R794 WeakPolarHBondContact O-CG 3.39Å; S790-R794 PolarHBondContact O-N 3.47Å; S790-R794 PolarHBondContact O-NH1 3.2Å; S790-R794 VanDerWaalsContact O-NH1 3.13Å; S790-R794 PolarHBondContact O-NH2 3.31Å; S790-R794 PolarHBondContact OG-NH1 3.31Å
791	Y	88.9	Confident	82.5	Confident	39 Å²	39	65.8 Å²	65.8	15%	0.153	32%	0.32	C	S	.	.	H	α-helix	trans	-71.2	-47.5	172.8	-177.1	-96.3	0	0	0	112.7	R694 S731 F734 A787 I788 D789 K793 R794 A795	R694-Y791 PolarHBondContact NH1-OH 3.4Å; S731-Y791 PolarHBondContact OG-OH 2.92Å; F734-Y791 HydrophobicContact CB-CD1 4.18Å; F734-Y791 AromaticContact CD2-CD1 3.8Å; F734-Y791 HydrophobicContact CD2-CD1 3.8Å; F734-Y791 HydrophobicContact CD2-CD2 4.25Å; F734-Y791 AromaticContact CD2-CG 3.58Å; F734-Y791 HydrophobicContact CD2-CG 3.58Å; F734-Y791 HydrophobicContact CE2-CG 4.16Å; A787-Y791 VanDerWaalsContact O-CB 3.28Å; A787-Y791 WeakPolarHBondContact O-CB 3.46Å; A787-Y791 PolarHBondContact O-N 3.46Å; I788-Y791 CarbonylContact O-C 3.46Å; I788-Y791 WeakPolarHBondContact O-CA 3.33Å; I788-Y791 WeakPolarHBondContact O-CB 3.36Å; I788-Y791 PolarHBondContact O-N 2.71Å; D789-Y791 VanDerWaalsContact C-N 3.29Å; D789-Y791 PolarHBondContact O-N 2.87Å; Y791-K793 VanDerWaalsContact C-N 3.26Å; Y791-K793 PolarHBondContact O-N 3.28Å; Y791-R794 CarbonylContact O-C 3.51Å; Y791-R794 WeakPolarHBondContact O-CA 3.19Å; Y791-R794 WeakPolarHBondContact O-CB 3.5Å; Y791-R794 PolarHBondContact O-N 2.83Å; Y791-A795 HydrophobicContact CD1-CB 4.25Å; Y791-A795 HydrophobicContact CE1-CB 3.86Å; Y791-A795 WeakPolarHBondContact O-CB 3.23Å; Y791-A795 PolarHBondContact O-N 2.64Å
792	M	87.8	Confident	81.1	Confident	22 Å²	22	67.3 Å²	67.3	11%	0.108	34%	0.335	C	S	.	.	H	α-helix	trans	-69.4	-24.3	-177.6	-64.6	-55.9	-84.7	0	0	112.5	E735 D738 I788 D789 R796	E735-M792 HydrophobicContact CG-CE 3.82Å; E735-M792 HydrophobicContact CG-SD 3.98Å; D738-M792 HydrophobicContact CB-CE 4.05Å; D738-M792 HydrophobicContact CB-CG 4.06Å; D738-M792 WeakPolarHBondContact OD2-CE 3.48Å; I788-M792 HydrophobicContact CG2-CG 4.29Å; I788-M792 WeakPolarHBondContact O-CG 3.45Å; I788-M792 PolarHBondContact O-N 2.95Å; D789-M792 PolarHBondContact O-N 2.73Å; M792-R796 WeakPolarHBondContact O-CG 3.35Å; M792-R796 PolarHBondContact O-N 3.47Å; M792-R796 PolarHBondContact O-NE 2.82Å
793	K	88.6	Confident	79.6	Confident	110 Å²	110	71.9 Å²	71.9	48%	0.478	36%	0.358	S	S	.	.	H	α-helix	trans	-67.4	-44.1	165.4	-71.8	160.1	-168.1	160.6	0	111.6	D789 Y791 N797	D789-K793 WeakPolarHBondContact O-CB 3.38Å; D789-K793 WeakPolarHBondContact O-CD 3.21Å; D789-K793 WeakPolarHBondContact O-CG 3.32Å; D789-K793 PolarHBondContact O-N 2.96Å; D789-K793 VanDerWaalsContact OD2-CE 3.32Å; D789-K793 WeakPolarHBondContact OD2-CE 3.33Å; D789-K793 IonicContact OD2-NZ 2.62Å; D789-K793 PolarHBondContact OD2-NZ 3.22Å; Y791-K793 VanDerWaalsContact C-N 3.26Å; Y791-K793 PolarHBondContact O-N 3.28Å; K793-N797 PolarHBondContact O-ND2 3.25Å
794	R	86.5	Confident	78.2	Confident	138 Å²	138	71.1 Å²	71.1	52%	0.521	35%	0.354	S	S	.	.	H	α-helix	trans	-66.8	-42.4	173.8	-74.5	-175.2	-66.3	-82.7	-2.4	113.2	S790 Y791 N797 D798	S790-R794 WeakPolarHBondContact O-CG 3.39Å; S790-R794 PolarHBondContact O-N 3.47Å; S790-R794 PolarHBondContact O-NH1 3.2Å; S790-R794 VanDerWaalsContact O-NH1 3.13Å; S790-R794 PolarHBondContact O-NH2 3.31Å; S790-R794 PolarHBondContact OG-NH1 3.31Å; Y791-R794 CarbonylContact O-C 3.51Å; Y791-R794 WeakPolarHBondContact O-CA 3.19Å; Y791-R794 WeakPolarHBondContact O-CB 3.5Å; Y791-R794 PolarHBondContact O-N 2.83Å; R794-N797 CarbonylContact O-C 3.54Å; R794-N797 PolarHBondContact O-N 2.9Å; R794-N797 VanDerWaalsContact O-N 3.12Å; R794-D798 PolarHBondContact O-N 2.88Å; R794-D798 VanDerWaalsContact O-N 3.14Å
795	A	81.5	Confident	76.2	Confident	9 Å²	9	70 Å²	70	7%	0.074	35%	0.354	C	S	.	.	H	α-helix	trans	-68.6	-38.1	-173.3	0	0	0	0	0	112.5	Y791 N797 D798 R801	Y791-A795 HydrophobicContact CD1-CB 4.25Å; Y791-A795 HydrophobicContact CE1-CB 3.86Å; Y791-A795 WeakPolarHBondContact O-CB 3.23Å; Y791-A795 PolarHBondContact O-N 2.64Å; A795-N797 PolarHBondContact O-N 2.88Å; A795-D798 PolarHBondContact O-N 3.03Å; A795-R801 WeakPolarHBondContact O-CD 3.34Å
796	R	79.9	Confident	73.7	Confident	168 Å²	168	70.8 Å²	70.8	63%	0.634	37%	0.37	S	S	*	.	H	α-helix	trans	-62.9	-29	170.9	-78.2	178.8	-81.6	-166.2	-8.1	112.8	M792	M792-R796 WeakPolarHBondContact O-CG 3.35Å; M792-R796 PolarHBondContact O-N 3.47Å; M792-R796 PolarHBondContact O-NE 2.82Å
797	N	79.2	Confident	71.7	Confident	135 Å²	135	65.8 Å²	65.8	72%	0.722	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	3.8	-176.9	-65.1	-2.5	0	0	0	114	K793 R794 A795 P799	K793-N797 PolarHBondContact O-ND2 3.25Å; R794-N797 CarbonylContact O-C 3.54Å; R794-N797 PolarHBondContact O-N 2.9Å; R794-N797 VanDerWaalsContact O-N 3.12Å; A795-N797 PolarHBondContact O-N 2.88Å; N797-P799 WeakPolarHBondContact O-CD 3.41Å
798	D	72.7	Confident	70.3	Confident	68 Å²	68	67.4 Å²	67.4	36%	0.364	35%	0.347	S	S	.	.			trans	-88.2	112.8	176.1	-172.6	-7.6	0	0	0	110.4	R794 A795 K800 R801 S802	R794-D798 PolarHBondContact O-N 2.88Å; R794-D798 VanDerWaalsContact O-N 3.14Å; A795-D798 PolarHBondContact O-N 3.03Å; D798-K800 PolarHBondContact O-N 3.46Å; D798-K800 PolarHBondContact OD1-N 3.45Å; D798-K800 WeakPolarHBondContact OD1-CG 3.32Å; D798-K800 VanDerWaalsContact OD1-CB 3.3Å; D798-K800 WeakPolarHBondContact OD1-CB 3.05Å; D798-R801 CarbonylContact O-C 3.22Å; D798-R801 WeakPolarHBondContact O-CA 3.18Å; D798-R801 WeakPolarHBondContact O-CB 3.35Å; D798-R801 PolarHBondContact O-N 2.91Å; D798-R801 HydrophobicContact CB-CB 4.02Å; D798-S802 PolarHBondContact O-N 3.4Å
799	P	66.1	Low	68.8	Low	80 Å²	80	68 Å²	68	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-65.6	-21	178.4	27.8	-35.7	0	0	0	113.1	N797 R801 S802 L803	N797-P799 WeakPolarHBondContact O-CD 3.41Å; P799-R801 PolarHBondContact O-N 3.49Å; P799-S802 WeakPolarHBondContact CA-OG 3.39Å; P799-S802 PolarHBondContact O-OG 3.43Å; P799-L803 WeakPolarHBondContact O-CB 3.29Å; P799-L803 PolarHBondContact O-N 2.83Å; P799-L803 WeakPolarHBondContact O-CG 3.22Å; P799-L803 VanDerWaalsContact O-CG 3.3Å; P799-L803 WeakPolarHBondContact O-CD1 3.4Å
800	K	65.3	Low	67.5	Low	102 Å²	102	71.9 Å²	71.9	44%	0.443	37%	0.367	S	S	.	.	H	α-helix	trans	-69.5	-25.9	169.9	-56.2	-176.7	-176.1	-169.2	0	111.8	N689 D798	N689-K800 WeakPolarHBondContact O-CE 3.4Å; N689-K800 PolarHBondContact O-NZ 3.32Å; D798-K800 PolarHBondContact O-N 3.46Å; D798-K800 PolarHBondContact OD1-N 3.45Å; D798-K800 WeakPolarHBondContact OD1-CG 3.32Å; D798-K800 VanDerWaalsContact OD1-CB 3.3Å; D798-K800 WeakPolarHBondContact OD1-CB 3.05Å
801	R	63.8	Low	66.3	Low	42 Å²	42	73.7 Å²	73.7	16%	0.158	37%	0.369	C	S	.	.	H	α-helix	trans	-83.1	-42.7	174.2	-170.1	171.3	-177.3	144.2	13.2	110.8	R694 S731 E735 A795 D798 P799 L803 L804 A805	R694-R801 VanDerWaalsContact NH2-NH1 3.18Å; S731-R801 PolarHBondContact OG-NH1 3.13Å; E735-R801 IonicContact OE1-CZ 3.67Å; E735-R801 VanDerWaalsContact OE1-CZ 3.31Å; E735-R801 IonicContact OE1-NH1 2.78Å; E735-R801 PolarHBondContact OE1-NH1 3.37Å; E735-R801 IonicContact OE1-NH2 3.37Å; E735-R801 PolarHBondContact OE1-NH2 2.69Å; E735-R801 IonicContact OE2-CZ 3.27Å; E735-R801 IonicContact OE2-NH1 2.68Å; E735-R801 IonicContact OE2-NH2 3.92Å; E735-R801 PolarHBondContact OE2-NH2 3.13Å; A795-R801 WeakPolarHBondContact O-CD 3.34Å; D798-R801 CarbonylContact O-C 3.22Å; D798-R801 WeakPolarHBondContact O-CA 3.18Å; D798-R801 WeakPolarHBondContact O-CB 3.35Å; D798-R801 PolarHBondContact O-N 2.91Å; D798-R801 HydrophobicContact CB-CB 4.02Å; P799-R801 PolarHBondContact O-N 3.49Å; R801-L803 PolarHBondContact O-N 2.82Å; R801-L804 CarbonylContact O-C 3.55Å; R801-L804 PolarHBondContact O-N 2.85Å; R801-A805 PolarHBondContact O-N 3.17Å; R801-A805 WeakPolarHBondContact O-CA 3.49Å; R801-A805 HydrophobicContact CG-CB 4.25Å; R801-A805 WeakPolarHBondContact O-CB 3.37Å
802	S	50.2	Low	65.2	Low	67 Å²	67	79.7 Å²	79.7	47%	0.469	40%	0.399	S	S	.	.	H	α-helix	trans	-59.6	-45.7	178	63.4	0	0	0	0	112.3	D798 P799 L804 A805	D798-S802 PolarHBondContact O-N 3.4Å; P799-S802 WeakPolarHBondContact CA-OG 3.39Å; P799-S802 PolarHBondContact O-OG 3.43Å; S802-L804 PolarHBondContact O-N 3.08Å; S802-A805 PolarHBondContact O-N 2.88Å
803	L	49.3	Very low	64.1	Low	132 Å²	132	81.7 Å²	81.7	69%	0.691	41%	0.408	S	S	*	.	H	α-helix	trans	-59.9	-9.6	174.8	-73.3	171.1	0	0	0	115.2	P799 R801 S807	P799-L803 WeakPolarHBondContact O-CB 3.29Å; P799-L803 PolarHBondContact O-N 2.83Å; P799-L803 WeakPolarHBondContact O-CG 3.22Å; P799-L803 VanDerWaalsContact O-CG 3.3Å; P799-L803 WeakPolarHBondContact O-CD1 3.4Å; R801-L803 PolarHBondContact O-N 2.82Å; L803-S807 PolarHBondContact O-OG 3.38Å
804	L	55.2	Low	63.1	Low	16 Å²	16	76.7 Å²	76.7	8%	0.084	39%	0.387	C	S	.	.	H	α-helix	trans	-133.3	-1.1	-178.6	-68.4	174.7	0	0	0	113.6	L610 F692 L695 R801 S802 S807 L808	L610-L804 HydrophobicContact CD1-CD2 3.9Å; F692-L804 HydrophobicContact CD1-CD2 4.43Å; F692-L804 HydrophobicContact CE1-CD2 4.39Å; L695-L804 HydrophobicContact CB-CD2 4.43Å; L695-L804 HydrophobicContact CD2-CD2 4.07Å; R801-L804 CarbonylContact O-C 3.55Å; R801-L804 PolarHBondContact O-N 2.85Å; S802-L804 PolarHBondContact O-N 3.08Å; L804-S807 CarbonylContact O-C 3.57Å; L804-S807 PolarHBondContact O-N 2.95Å; L804-L808 WeakPolarHBondContact O-CG 3.26Å; L804-L808 PolarHBondContact O-N 3.38Å
805	A	44.7	Very low	62.3	Low	47 Å²	47	74 Å²	74	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-89.7	-31.6	179.8	0	0	0	0	0	111.4	R801 S802	R801-A805 PolarHBondContact O-N 3.17Å; R801-A805 WeakPolarHBondContact O-CA 3.49Å; R801-A805 HydrophobicContact CG-CB 4.25Å; R801-A805 WeakPolarHBondContact O-CB 3.37Å; S802-A805 PolarHBondContact O-N 2.88Å
806	C	37	Very low	61.3	Low	85 Å²	85	74 Å²	74	57%	0.574	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-37.3	158.4	-58	0	0	0	0	110.3	K607	K607-C806 WeakPolarHBondContact CD-O 3.32Å; K607-C806 WeakPolarHBondContact CE-O 3.24Å; K607-C806 PolarHBondContact NZ-O 3.33Å
807	S	48.2	Very low	59.8	Low	4 Å²	4	69.6 Å²	69.6	3%	0.028	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	12.3	-176.9	-29	0	0	0	0	115.3	Y605 L695 L803 L804 P809	Y605-S807 PolarHBondContact OH-O 3.19Å; L695-S807 WeakPolarHBondContact CD1-O 3.49Å; L803-S807 PolarHBondContact O-OG 3.38Å; L804-S807 CarbonylContact O-C 3.57Å; L804-S807 PolarHBondContact O-N 2.95Å; S807-P809 WeakPolarHBondContact O-CD 3.46Å
808	L	58.9	Low	58.3	Low	61 Å²	61	65.8 Å²	65.8	32%	0.319	38%	0.376	S	S	.	.	S	Bend	trans	-76.8	115.7	164.4	-77.5	-179.5	0	0	0	106.5	A698 L804	A698-L808 HydrophobicContact CB-CD2 3.66Å; L804-L808 WeakPolarHBondContact O-CG 3.26Å; L804-L808 PolarHBondContact O-N 3.38Å
809	P	59.8	Low	56.8	Low	14 Å²	14	65.8 Å²	65.8	9%	0.091	38%	0.376	C	S	.	.			trans	-68.9	141.3	-178.2	-5.5	18.4	0	0	0	110	Y605 F699 L702 S807 V814	Y605-P809 HydrophobicContact CD1-CG 4.47Å; Y605-P809 HydrophobicContact CD2-CB 3.75Å; Y605-P809 HydrophobicContact CD2-CG 4.09Å; Y605-P809 HydrophobicContact CE1-CG 4.15Å; Y605-P809 HydrophobicContact CE2-CB 3.39Å; Y605-P809 HydrophobicContact CE2-CG 3.77Å; Y605-P809 HydrophobicContact CG-CG 4.4Å; F699-P809 HydrophobicContact CD2-CG 3.66Å; F699-P809 HydrophobicContact CE2-CG 3.88Å; L702-P809 HydrophobicContact CD2-CB 3.49Å; L702-P809 VanDerWaalsContact CD2-CB 3.49Å; L702-P809 HydrophobicContact CD2-CG 3.71Å; S807-P809 WeakPolarHBondContact O-CD 3.46Å; P809-V814 HydrophobicContact CB-CG2 3.86Å
810	K	63.1	Low	55.7	Low	120 Å²	120	64.7 Å²	64.7	52%	0.522	37%	0.37	S	S	.	.			trans	-76.3	158.7	160.1	-58.9	177.4	175.7	-177.3	0	109.5	E812 E813	K810-E812 HydrophobicContact CB-CB 4.29Å; K810-E812 WeakPolarHBondContact CD-OE2 3.32Å; K810-E812 IonicContact NZ-OE2 2.72Å; K810-E812 PolarHBondContact O-N 3.16Å; K810-E813 HydrophobicContact CB-CB 4.43Å; K810-E813 HydrophobicContact CB-CG 4.07Å; K810-E813 HydrophobicContact CG-CG 4.46Å; K810-E813 PolarHBondContact O-N 2.86Å
811	E	65.3	Low	54.7	Low	89 Å²	89	61.7 Å²	61.7	42%	0.416	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-57.9	-32.5	171.2	-84.2	120.4	-128.3	0	0	112	L702 R705 E813	L702-E811 HydrophobicContact CD1-CB 4.44Å; L702-E811 HydrophobicContact CD1-CG 3.69Å; R705-E811 IonicContact CZ-OE1 2.67Å; R705-E811 IonicContact NE-OE1 3.26Å; R705-E811 PolarHBondContact NE-OE1 3.23Å; R705-E811 IonicContact NH2-OE1 3.05Å; R705-E811 PolarHBondContact NH2-OE1 3.42Å; E811-E813 PolarHBondContact O-N 2.9Å; E811-E813 VanDerWaalsContact C-N 3.33Å
812	E	65.3	Low	53.4	Low	165 Å²	165	62 Å²	62	77%	0.771	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-64.6	-27.6	172.4	-59	165.4	170.8	0	0	114.2	K810	K810-E812 HydrophobicContact CB-CB 4.29Å; K810-E812 WeakPolarHBondContact CD-OE2 3.32Å; K810-E812 IonicContact NZ-OE2 2.72Å; K810-E812 PolarHBondContact O-N 3.16Å
813	E	65.4	Low	52.7	Low	64 Å²	64	63.9 Å²	63.9	30%	0.299	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-87.9	-5.7	-174.5	-71.4	178.2	-174.5	0	0	113.1	Y605 K607 K810 E811	Y605-E813 HydrophobicContact CD2-CB 4.29Å; Y605-E813 HydrophobicContact CE2-CB 4.06Å; K607-E813 IonicContact NZ-OE1 3.92Å; K607-E813 PolarHBondContact NZ-OE1 3.2Å; K607-E813 IonicContact NZ-OE2 2.82Å; K607-E813 PolarHBondContact NZ-OE2 3.25Å; K810-E813 HydrophobicContact CB-CB 4.43Å; K810-E813 HydrophobicContact CB-CG 4.07Å; K810-E813 HydrophobicContact CG-CG 4.46Å; K810-E813 PolarHBondContact O-N 2.86Å; E811-E813 PolarHBondContact O-N 2.9Å; E811-E813 VanDerWaalsContact C-N 3.33Å
814	V	68.7	Low	52.1	Low	5 Å²	5	61.8 Å²	61.8	3%	0.03	36%	0.361	C	S	.	.			trans	-107.4	121.5	-177.2	174.9	0	0	0	0	111	I604 Y605 F699 L702 L703 K706 P809 A816	I604-V814 HydrophobicContact CD1-CG1 4.4Å; I604-V814 CarbonylContact O-C 3.46Å; I604-V814 WeakPolarHBondContact O-CA 3.41Å; Y605-V814 HydrophobicContact CD2-CG2 4.19Å; F699-V814 HydrophobicContact CE2-CG2 3.93Å; F699-V814 HydrophobicContact CZ-CG1 4.15Å; F699-V814 HydrophobicContact CZ-CG2 4Å; L702-V814 HydrophobicContact CD2-CG2 3.54Å; L703-V814 HydrophobicContact CD2-CG1 4.5Å; K706-V814 PolarHBondContact NZ-O 3.37Å; P809-V814 HydrophobicContact CB-CG2 3.86Å; V814-A816 HydrophobicContact CG1-CB 3.9Å; V814-A816 PolarHBondContact O-N 2.69Å
815	A	68.9	Low	51.2	Low	80 Å²	80	65.4 Å²	65.4	66%	0.661	38%	0.38	S	S	*	.			trans	-77.5	-17.2	-175.6	0	0	0	0	0	114.6	I604 S817	I604-A815 PolarHBondContact O-N 3.34Å; A815-S817 PolarHBondContact O-N 2.84Å
816	A	61.1	Low	50.7	Low	11 Å²	11	71.2 Å²	71.2	9%	0.091	39%	0.392	C	S	.	.			trans	-50.7	127.5	-174.9	0	0	0	0	0	112.9	I604 L703 K706 V814	I604-A816 HydrophobicContact CB-CB 4.16Å; I604-A816 HydrophobicContact CD1-CB 4.1Å; I604-A816 HydrophobicContact CG2-CB 3.98Å; L703-A816 HydrophobicContact CD2-CB 4.38Å; K706-A816 WeakPolarHBondContact CE-O 3.43Å; K706-A816 PolarHBondContact NZ-O 2.96Å; V814-A816 HydrophobicContact CG1-CB 3.9Å; V814-A816 PolarHBondContact O-N 2.69Å
817	S	48.1	Very low	50.7	Low	74 Å²	74	73.9 Å²	73.9	52%	0.517	40%	0.396	S	S	.	.			trans	-79.2	126.3	-179.9	41.7	0	0	0	0	111.6	A815 D819 S820	A815-S817 PolarHBondContact O-N 2.84Å; S817-D819 PolarHBondContact O-N 2.93Å; S817-D819 VanDerWaalsContact O-N 3.08Å; S817-S820 PolarHBondContact O-N 3.19Å; S817-S820 PolarHBondContact O-OG 3.37Å; S817-S820 PolarHBondContact OG-OG 3.08Å
818	A	46.4	Very low	50.2	Low	55 Å²	55	80 Å²	80	46%	0.455	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-13.2	172.2	0	0	0	0	0	113.3	S822	A818-S822 PolarHBondContact O-OG 3.18Å
819	D	42.3	Very low	49.1	Very low	69 Å²	69	83.2 Å²	83.2	37%	0.369	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-19.6	-179.8	-102.2	16.7	0	0	0	114.3	S817 S821 S822 Q823	S817-D819 PolarHBondContact O-N 2.93Å; S817-D819 VanDerWaalsContact O-N 3.08Å; D819-S821 VanDerWaalsContact C-N 3.25Å; D819-S821 PolarHBondContact O-N 3.34Å; D819-S822 PolarHBondContact O-N 3.45Å; D819-Q823 HydrophobicContact CB-CG 3.93Å; D819-Q823 PolarHBondContact OD2-NE2 2.72Å; D819-Q823 PolarHBondContact O-N 2.98Å; D819-Q823 WeakPolarHBondContact O-CG 3.24Å
820	S	42.4	Very low	48.1	Very low	57 Å²	57	90.7 Å²	90.7	40%	0.399	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.8	-173.2	-57.8	0	0	0	0	113.9	S817	S817-S820 PolarHBondContact O-N 3.19Å; S817-S820 PolarHBondContact O-OG 3.37Å; S817-S820 PolarHBondContact OG-OG 3.08Å
821	S	44.7	Very low	46.7	Very low	38 Å²	38	89.1 Å²	89.1	27%	0.266	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-14.3	173.8	-50.3	0	0	0	0	113	D819	D819-S821 VanDerWaalsContact C-N 3.25Å; D819-S821 PolarHBondContact O-N 3.34Å
822	S	36.9	Very low	45.1	Very low	49 Å²	49	91.9 Å²	91.9	34%	0.343	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-28	-168.9	-52.8	0	0	0	0	113.2	A818 D819	A818-S822 PolarHBondContact O-OG 3.18Å; D819-S822 PolarHBondContact O-N 3.45Å
823	Q	34.2	Very low	43.7	Very low	107 Å²	107	88.1 Å²	88.1	50%	0.5	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-32.7	-177.1	-73.1	-176.2	-0.6	0	0	113.3	D819 R826	D819-Q823 HydrophobicContact CB-CG 3.93Å; D819-Q823 PolarHBondContact OD2-NE2 2.72Å; D819-Q823 PolarHBondContact O-N 2.98Å; D819-Q823 WeakPolarHBondContact O-CG 3.24Å; Q823-R826 PolarHBondContact O-N 2.67Å
824	L	37.1	Very low	42.2	Very low	87 Å²	87	90.5 Å²	90.5	46%	0.455	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-42.4	179.5	-79.2	167.9	0	0	0	112.7	Y671 R826 Q827 E828	Y671-L824 WeakPolarHBondContact OH-CB 3.18Å; Y671-L824 WeakPolarHBondContact OH-CD1 3.48Å; L824-R826 PolarHBondContact O-N 3.05Å; L824-Q827 PolarHBondContact O-N 3.26Å; L824-E828 PolarHBondContact O-N 3.36Å
825	L	37.2	Very low	40.6	Very low	92 Å²	92	98 Å²	98	48%	0.482	56%	0.556	S	S	.	*	H	α-helix	trans	-57.3	-39.2	174.8	-74.4	163.7	0	0	0	111.7	Q827 E828 D829	L825-Q827 PolarHBondContact O-N 2.72Å; L825-E828 PolarHBondContact O-N 2.62Å; L825-D829 PolarHBondContact O-N 2.75Å
826	R	33.8	Very low	38.7	Very low	169 Å²	169	102.5 Å²	102.5	64%	0.638	57%	0.569	S	S	*	*	H	α-helix	trans	-69.5	-6.8	175.9	-70.3	-179.5	175.8	155.3	1.5	114.9	Q823 L824	Q823-R826 PolarHBondContact O-N 2.67Å; L824-R826 PolarHBondContact O-N 3.05Å
827	Q	37.3	Very low	37.5	Very low	141 Å²	141	106.4 Å²	106.4	66%	0.659	60%	0.601	S	S	*	*	H	α-helix	trans	-102	-20.4	176.9	-68.3	-170.5	-62.3	0	0	113.5	L824 L825	L824-Q827 PolarHBondContact O-N 3.26Å; L825-Q827 PolarHBondContact O-N 2.72Å
828	E	38	Very low	36.8	Very low	134 Å²	134	108.3 Å²	108.3	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-90.4	-27.9	178.5	-62.4	-173.4	141.7	0	0	112.5	L824 L825 H830 N832	L824-E828 PolarHBondContact O-N 3.36Å; L825-E828 PolarHBondContact O-N 2.62Å; E828-H830 PolarHBondContact O-N 2.97Å; E828-N832 PolarHBondContact O-ND2 2.83Å
829	D	35.8	Very low	36.2	Very low	128 Å²	128	110.6 Å²	110.6	68%	0.684	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	1.2	177.5	-74.6	-23.1	0	0	0	114.9	L825	L825-D829 PolarHBondContact O-N 2.75Å
830	H	37.5	Very low	35.9	Very low	170 Å²	170	112.4 Å²	112.4	79%	0.787	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	13.2	-175.2	-73.7	-17.2	0	0	0	115.1	E828	E828-H830 PolarHBondContact O-N 2.97Å
831	S	33.7	Very low	35.4	Very low	88 Å²	88	116.6 Å²	116.6	62%	0.615	68%	0.676	S	S	*	*	S	Bend	trans	-123.1	-7	174.6	55.3	0	0	0	0	114.7
832	N	32.5	Very low	35	Very low	146 Å²	146	124.5 Å²	124.5	78%	0.781	70%	0.7	S	S	*	*			trans	-113.6	63.7	-176	-68.8	-68.7	0	0	0	112.4	E828	E828-N832 PolarHBondContact O-ND2 2.83Å
833	A	34.7	Very low	34.7	Very low	86 Å²	86	130.3 Å²	130.3	71%	0.711	73%	0.726	S	S	*	*			trans	-132.9	117.2	174.4	0	0	0	0	0	111.1
834	S	34.1	Very low	34.7	Very low	114 Å²	114	132 Å²	132	80%	0.797	74%	0.743	S	S	*	*			trans	51.6	112.8	173.5	58.3	0	0	0	0	118.1
835	I	35.5	Very low	34.7	Very low	164 Å²	164	133 Å²	133	84%	0.841	76%	0.755	S	S	*	*				-165	114.2	118.9	-92.1	146.6	0	0	0	107.5
836	D	30.3	Very low	34.4	Very low	174 Å²	174	134.9 Å²	134.9	93%	0.93	77%	0.773	S	S	*	*			trans	-98.7	116.7	159.5	-98.1	-47.7	0	0	0	107.3
837	A	35.4	Very low	34.1	Very low	92 Å²	92	133.3 Å²	133.3	76%	0.76	79%	0.786	S	S	*	*			trans	-162.8	135.6	161.8	0	0	0	0	0	111.3
838	S	32.7	Very low	33.7	Very low	115 Å²	115	131.2 Å²	131.2	80%	0.804	79%	0.787	S	S	*	*			trans	-84	159.3	174.7	55.8	0	0	0	0	113.2
839	A	34.6	Very low	33.3	Very low	103 Å²	103	129.9 Å²	129.9	85%	0.851	79%	0.793	S	S	*	*			trans	75.8	94.5	159.1	0	0	0	0	0	118.6
840	A	34.7	Very low	33.1	Very low	107 Å²	107	133.1 Å²	133.1	88%	0.884	80%	0.803	S	S	*	*			trans	-144.8	128.6	139.9	0	0	0	0	0	109.4
841	D	33.9	Very low	32.7	Very low	144 Å²	144	130.2 Å²	130.2	77%	0.77	80%	0.803	S	S	*	*			trans	-95.2	170.4	172.5	175.1	36.5	0	0	0	109.9
842	R	35.6	Very low	32.7	Very low	205 Å²	205	130.4 Å²	130.4	77%	0.774	81%	0.809	S	S	*	*			trans	88.9	98.1	167.8	-51.9	177.5	178.6	-170.5	-2.9	118.8
843	L	30.1	Very low	32.6	Very low	170 Å²	170	129.4 Å²	129.4	89%	0.89	81%	0.808	S	S	*	*				41	112	116.9	-61.7	169.7	0	0	0	119.5
844	V	34.4	Very low	32.6	Very low	142 Å²	142	132 Å²	132	86%	0.861	81%	0.81	S	S	*	*			trans	-135.1	138.8	148.8	-179.9	0	0	0	0	108.1
845	P	36.7	Very low	32.6	Very low	110 Å²	110	134 Å²	134	71%	0.714	81%	0.812	S	S	*	*			trans	-101.2	171.6	-156.1	39.2	-36.6	0	0	0	115.6
846	P	30.4	Very low	32.5	Very low	130 Å²	130	129.8 Å²	129.8	84%	0.844	81%	0.808	S	S	*	*			trans	-69.5	154.2	172.1	30.7	-37.2	0	0	0	112.5
847	C	28.3	Very low	32.9	Very low	136 Å²	136	127.7 Å²	127.7	92%	0.919	80%	0.804	S	S	*	*			trans	-115.5	132.4	179.2	-171	0	0	0	0	111.5
848	S	29.7	Very low	32.9	Very low	98 Å²	98	129.4 Å²	129.4	69%	0.685	81%	0.808	S	S	*	*			trans	-145	134.9	179.2	56.1	0	0	0	0	110.4
849	S	28.8	Very low	32.8	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	81%	0.805	S	S	*	*			trans	50.6	123.1	163.7	58.6	0	0	0	0	119.1
850	E	31.7	Very low	32.6	Very low	195 Å²	195	132.2 Å²	132.2	91%	0.911	81%	0.807	S	S	*	*				-164.7	174.9	102.3	-105	-178.1	148.5	0	0	113.1
851	S	29.9	Very low	32.2	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	80%	0.804	S	S	*	*			trans	-92.1	151.1	-160.1	54.5	0	0	0	0	116.6
852	A	33.3	Very low	32	Very low	91 Å²	91	138.5 Å²	138.5	75%	0.752	80%	0.804	S	S	*	*				-177.2	115.4	125.1	0	0	0	0	0	115.2
853	T	30.2	Very low	31.7	Very low	125 Å²	125	138 Å²	138	77%	0.767	81%	0.81	S	S	*	*			trans	11.6	122.9	141.6	-1.4	0	0	0	0	119.7
854	L	33.9	Very low	31.6	Very low	142 Å²	142	137.6 Å²	137.6	74%	0.743	81%	0.809	S	S	*	*				-176	141.2	81.7	-91.9	156.8	0	0	0	113.3
855	N	33.9	Very low	31.5	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	81%	0.807	S	S	*	*			trans	29.7	129.8	151.7	-49.3	-18	0	0	0	120.7
856	G	33.6	Very low	31.2	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	81%	0.811	S	S	*	*			cis	136.6	172.2	7.6	0	0	0	0	0	110.6
857	P	38.4	Very low	31.2	Very low	131 Å²	131	142.7 Å²	142.7	85%	0.851	80%	0.803	S	S	*	*			cis	-122.8	176.3	-17	40.6	-24.9	0	0	0	114.3
858	P	35.6	Very low	31.2	Very low	128 Å²	128	143.6 Å²	143.6	83%	0.831	79%	0.793	S	S	*	*			trans	-125	176.1	-162.3	43	-31.6	0	0	0	117.2
859	S	32.3	Very low	31.2	Very low	108 Å²	108	143.1 Å²	143.1	76%	0.755	80%	0.795	S	S	*	*			trans	-154.3	109.1	144.7	68.8	0	0	0	0	116.5
860	L	28.4	Very low	31.4	Very low	168 Å²	168	144.4 Å²	144.4	88%	0.88	79%	0.794	S	S	*	*			trans	54.5	102.4	138.5	-54.4	176.6	0	0	0	121.5
861	R	28.2	Very low	31.4	Very low	221 Å²	221	143.2 Å²	143.2	83%	0.834	79%	0.788	S	S	*	*			trans	-142.7	141.7	137.4	-85.2	-164.7	-178.5	-171.6	9	112.2
862	E	28.8	Very low	31.4	Very low	162 Å²	162	144.3 Å²	144.3	76%	0.757	79%	0.79	S	S	*	*			trans	46.3	109.6	145.1	-66.8	158.9	154.7	0	0	118.8
863	Q	28.9	Very low	31.2	Very low	195 Å²	195	150.9 Å²	150.9	91%	0.911	80%	0.797	S	S	*	*			trans	-130.2	148.4	151.8	-74.6	-174	-87.5	0	0	108.8
864	D	29.1	Very low	31.3	Very low	162 Å²	162	149.9 Å²	149.9	87%	0.866	80%	0.801	S	S	*	*			trans	-98.4	154.3	174.8	-61.4	-80.9	0	0	0	111.2
865	E	32.1	Very low	31	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	81%	0.806	S	S	*	*			trans	-155.1	129	159.7	-99.2	160.3	-154.6	0	0	104.4
866	E	30.5	Very low	31	Very low	171 Å²	171	148.1 Å²	148.1	80%	0.799	81%	0.805	S	S	*	*				64.2	138.7	62.3	-66.7	-157.9	146.3	0	0	113
867	E	29.5	Very low	31	Very low	142 Å²	142	151.4 Å²	151.4	66%	0.664	81%	0.81	S	S	*	*			cis	-151	-156.4	-6.3	-135.9	-146.9	151.7	0	0	112.7
868	Q	28.3	Very low	30.7	Very low	155 Å²	155	152 Å²	152	72%	0.724	81%	0.812	S	S	*	*			trans	-50	150.5	169.8	-49.6	168.7	37.8	0	0	113.8
869	A	31	Very low	30.9	Very low	87 Å²	87	151.4 Å²	151.4	72%	0.719	81%	0.808	S	S	*	*				169.7	148	120.2	0	0	0	0	0	114.2
870	N	31.9	Very low	31.1	Very low	133 Å²	133	152.4 Å²	152.4	71%	0.711	81%	0.81	S	S	*	*			trans	41.5	115.9	147.4	-61.1	-21.4	0	0	0	120.7
871	Q	30.8	Very low	31.3	Very low	171 Å²	171	150.1 Å²	150.1	80%	0.799	80%	0.803	S	S	*	*				79	143.4	59.3	-70.1	-174.7	24.1	0	0	115.6
872	T	31.5	Very low	31.8	Very low	132 Å²	132	149.2 Å²	149.2	81%	0.81	81%	0.805	S	S	*	*			trans	91.2	133.4	158.8	-46.6	0	0	0	0	118.6
873	Y	29.3	Very low	32.1	Very low	230 Å²	230	151.5 Å²	151.5	90%	0.902	81%	0.812	S	S	*	*			trans	-82.3	151.7	178.6	-71.5	-120.6	0	0	0	111.8
874	A	32.2	Very low	32.4	Very low	103 Å²	103	146.2 Å²	146.2	85%	0.851	81%	0.81	S	S	*	*			trans	-154.5	136	146.4	0	0	0	0	0	111.9
875	T	27.5	Very low	32.6	Very low	138 Å²	138	142.7 Å²	142.7	85%	0.847	81%	0.812	S	S	*	*			trans	-96.9	160.6	165.5	27.8	0	0	0	0	110.7
876	P	32.8	Very low	32.8	Very low	123 Å²	123	137.9 Å²	137.9	80%	0.799	81%	0.81	S	S	*	*			trans	-93.4	156.4	-159.6	35.9	-37.2	0	0	0	115.6
877	T	34.2	Very low	33	Very low	143 Å²	143	141.4 Å²	141.4	88%	0.877	82%	0.816	S	S	*	*			trans	-134.9	159.3	165.6	43.9	0	0	0	0	112
878	T	31.5	Very low	33.3	Very low	144 Å²	144	145.7 Å²	145.7	88%	0.883	83%	0.826	S	S	*	*			trans	-103.9	171.2	-159.1	27.2	0	0	0	0	115.3
879	P	39.8	Very low	33.5	Very low	115 Å²	115	149.4 Å²	149.4	75%	0.747	83%	0.833	S	S	*	*			trans	-116.5	174.8	-153.9	43.2	-36.5	0	0	0	116.7
880	T	35.8	Very low	33.8	Very low	130 Å²	130	154.7 Å²	154.7	80%	0.798	84%	0.84	S	S	*	*			trans	-141.3	104.1	165.8	46.9	0	0	0	0	116.1
881	T	34	Very low	33.8	Very low	120 Å²	120	159.8 Å²	159.8	74%	0.736	85%	0.849	S	S	*	*			trans	40.8	126.6	134.5	62.4	0	0	0	0	123.8
882	K	37.7	Very low	34	Very low	202 Å²	202	163.6 Å²	163.6	88%	0.878	86%	0.856	S	S	*	*				161.1	150.6	126.1	-88.3	161.9	-174.1	176.8	0	110.6
883	K	35.1	Very low	34.2	Very low	210 Å²	210	167.6 Å²	167.6	91%	0.913	86%	0.862	S	S	*	*			cis	-165.5	137.4	-31	-153.2	-179.3	-173.3	-176.3	0	109.9
884	G	36	Very low	34.3	Very low	84 Å²	84	160.4 Å²	160.4	87%	0.866	86%	0.858	S	S	*	*			trans	91.9	150.9	168.4	0	0	0	0	0	116.6
885	G	34	Very low	34.3	Very low	87 Å²	87	161.9 Å²	161.9	90%	0.897	85%	0.845	S	S	*	*			cis	172.4	140.1	-13	0	0	0	0	0	114.6
886	G	34.6	Very low	34.6	Very low	76 Å²	76	162.9 Å²	162.9	78%	0.784	84%	0.844	S	S	*	*			trans	147.8	115	166.4	0	0	0	0	0	118.1
887	R	35.9	Very low	34.3	Very low	245 Å²	245	168.5 Å²	168.5	93%	0.925	85%	0.849	S	S	*	*			trans	30.3	138.9	142.1	-59	174.2	176.4	-177.5	-1.7	119.5
888	R	35	Very low	34.3	Very low	231 Å²	231	166.3 Å²	166.3	87%	0.872	84%	0.839	S	S	*	*			cis	-164.8	131.6	16.2	-144.9	174.3	-177.9	179.8	-0.7	112.6
889	R	33.4	Very low	34.1	Very low	234 Å²	234	167.6 Å²	167.6	88%	0.883	84%	0.836	S	S	*	*			trans	6.8	135.7	158.7	-57.7	173.8	167.2	170.7	-5.5	120
890	K	35.9	Very low	33.6	Very low	197 Å²	197	167.3 Å²	167.3	86%	0.857	83%	0.831	S	S	*	*				-176.7	156	80.9	-110.5	171.5	-178.8	173.7	0	114.5
891	R	33.8	Very low	33.2	Very low	241 Å²	241	168.8 Å²	168.8	91%	0.909	83%	0.829	S	S	*	*			trans	62.6	115.3	169.4	-70.2	179.2	164	169.8	-5.6	116.7
892	R	35	Very low	32.8	Very low	250 Å²	250	168 Å²	168	94%	0.943	83%	0.828	S	S	*	*			cis	83.4	95.7	45.3	-82.7	-166	164.3	-176.7	-3.9	116.8
893	K	33.9	Very low	32.3	Very low	217 Å²	217	168.9 Å²	168.9	94%	0.943	83%	0.826	S	S	*	*				-169.4	157.6	125.3	-109.8	-177.4	178.7	-177.4	0	110
894	G	31.3	Very low	31.9	Very low	79 Å²	79	165.2 Å²	165.2	81%	0.814	82%	0.816	S	S	*	*			trans	-172.1	170.4	177	0	0	0	0	0	112.4
895	K	32.9	Very low	31.7	Very low	134 Å²	134	169.4 Å²	169.4	58%	0.583	82%	0.818	S	S	*	*			trans	-150.6	102.6	169.4	-149.5	175.3	178.6	-170.4	0	105.1	E408 K409	E408-K895 PolarHBondContact O-NZ 3.23Å; E408-K895 VanDerWaalsContact O-NZ 3.08Å; K409-K895 HydrophobicContact CD-CD 4.36Å
896	I	33.7	Very low	31.4	Very low	158 Å²	158	171.4 Å²	171.4	81%	0.81	81%	0.813	S	S	*	*				72.3	134.3	105.7	-64.9	169.4	0	0	0	113.5
897	R	27.6	Very low	31.1	Very low	242 Å²	242	174.6 Å²	174.6	91%	0.913	81%	0.811	S	S	*	*			trans	-140.3	131	178.4	178.1	-173.6	-175.9	-172.6	1.4	108.4
898	S	32.7	Very low	30.7	Very low	96 Å²	96	170.9 Å²	170.9	67%	0.671	80%	0.804	S	S	*	*			trans	-141.5	151.5	161.2	63.5	0	0	0	0	105.4
899	E	28	Very low	30.3	Very low	172 Å²	172	163.1 Å²	163.1	80%	0.804	79%	0.786	S	S	*	*			cis	65.8	131.8	44.2	-61.3	-171.2	140.3	0	0	111.3
900	V	28.6	Very low	30	Very low	108 Å²	108	160.7 Å²	160.7	66%	0.655	78%	0.782	S	S	*	*			cis	-155.6	157.2	13.1	94.2	0	0	0	0	113.3
901	Q	27.6	Very low	29.9	Very low	162 Å²	162	158.6 Å²	158.6	76%	0.757	78%	0.78	S	S	*	*			trans	55.5	123.7	152.9	-75.5	164.4	19	0	0	124.2
902	S	25.4	Very low	29.6	Very low	102 Å²	102	152.5 Å²	152.5	71%	0.713	77%	0.774	S	S	*	*				77.3	153.5	114.3	-55.6	0	0	0	0	124
903	R	27.8	Very low	29.5	Very low	222 Å²	222	148.6 Å²	148.6	84%	0.838	77%	0.772	S	S	*	*			trans	72.3	113.5	160	-72.3	-170.8	147.4	129.3	-3.2	116.4
904	D	26.9	Very low	29.3	Very low	132 Å²	132	143.4 Å²	143.4	71%	0.706	76%	0.763	S	S	*	*				80.6	98	67.6	-69.1	-16.6	0	0	0	111.3
905	L	32.4	Very low	29.4	Very low	172 Å²	172	147.3 Å²	147.3	90%	0.901	77%	0.766	S	S	*	*			trans	-144.6	90.9	149.2	-83.4	-171.5	0	0	0	109.5
906	T	26.3	Very low	29.2	Very low	130 Å²	130	145.5 Å²	145.5	80%	0.798	77%	0.769	S	S	*	*			trans	-86.6	124.2	158	45.8	0	0	0	0	109.4
907	L	29.7	Very low	29.3	Very low	142 Å²	142	144 Å²	144	74%	0.743	77%	0.773	S	S	*	*			trans	-143.7	129.5	150.5	-106.4	103.1	0	0	0	104.7
908	E	26.6	Very low	29.5	Very low	167 Å²	167	139.7 Å²	139.7	78%	0.78	76%	0.763	S	S	*	*				65.9	134.2	61.8	-63.4	-173.6	165.4	0	0	111.8
909	S	26.8	Very low	29.6	Very low	69 Å²	69	142.1 Å²	142.1	48%	0.483	77%	0.773	S	S	.	*			cis	-169.2	178	2	32.1	0	0	0	0	110.4
910	F	28.3	Very low	29.6	Very low	183 Å²	183	143.8 Å²	143.8	80%	0.803	77%	0.772	S	S	*	*			trans	70.3	149.4	169	-41	-59	0	0	0	115.7
911	D	33.3	Very low	29.9	Very low	153 Å²	153	145.8 Å²	145.8	82%	0.818	79%	0.785	S	S	*	*			cis	-122.3	162.9	3.6	-101.2	-51	0	0	0	113.6
912	S	26.2	Very low	30.2	Very low	112 Å²	112	150 Å²	150	78%	0.783	79%	0.794	S	S	*	*			trans	-96.1	153.4	176.2	-57.4	0	0	0	0	111.3
913	D	34.3	Very low	30.4	Very low	169 Å²	169	149.9 Å²	149.9	90%	0.904	80%	0.799	S	S	*	*			trans	-154.3	146.3	136.7	-127.5	-23.9	0	0	0	111.8
914	S	28.2	Very low	30.7	Very low	107 Å²	107	151.4 Å²	151.4	75%	0.748	81%	0.805	S	S	*	*			trans	-123.7	144.5	-163.3	61.2	0	0	0	0	113.6
915	D	34.5	Very low	31	Very low	162 Å²	162	154 Å²	154	87%	0.866	81%	0.81	S	S	*	*			trans	-150.3	158.4	142.5	-148.4	-15.6	0	0	0	111.4
916	S	29.3	Very low	31	Very low	95 Å²	95	157.4 Å²	157.4	66%	0.664	81%	0.81	S	S	*	*			trans	-141.9	149.8	-156.5	71.1	0	0	0	0	115.4
917	S	34.1	Very low	31.3	Very low	126 Å²	126	159.1 Å²	159.1	88%	0.881	81%	0.81	S	S	*	*			trans	-157.1	133.2	158.7	-41.1	0	0	0	0	111.5
918	H	33.2	Very low	31.3	Very low	153 Å²	153	157.6 Å²	157.6	71%	0.708	81%	0.811	S	S	*	*			trans	-68.5	149.2	-176.4	-72.3	-121.5	0	0	0	115
919	V	33.5	Very low	31.5	Very low	146 Å²	146	155.2 Å²	155.2	89%	0.885	81%	0.811	S	S	*	*				-147.6	150.6	106.2	171.6	0	0	0	0	108.2
920	R	28.7	Very low	31.8	Very low	208 Å²	208	160.1 Å²	160.1	79%	0.785	83%	0.826	S	S	*	*			trans	-112.7	141	-177.4	-67.5	170.7	167.2	163.5	-6.1	112.3
921	T	35.3	Very low	31.9	Very low	150 Å²	150	159.4 Å²	159.4	92%	0.92	83%	0.825	S	S	*	*			trans	-157.3	148.8	132.5	12.9	0	0	0	0	113.3
922	R	32.9	Very low	31.7	Very low	250 Å²	250	156 Å²	156	94%	0.943	82%	0.818	S	S	*	*			trans	-65.4	153.7	-165.1	-67.5	165.7	165.4	157.8	-5.9	115.9
923	A	30.2	Very low	32	Very low	99 Å²	99	157.8 Å²	157.8	82%	0.818	82%	0.824	S	S	*	*			trans	-96.1	163	162.7	0	0	0	0	0	112.5
924	R	34	Very low	31.7	Very low	255 Å²	255	159.5 Å²	159.5	96%	0.962	82%	0.818	S	S	*	*			trans	-153	166.3	155.5	-114.1	175.3	-174.3	-168.4	0.3	111.6
925	K	32.7	Very low	32.1	Very low	186 Å²	186	161 Å²	161	81%	0.809	81%	0.813	S	S	*	*			trans	-142.2	123.5	-159.6	-178.3	-174.5	-177.3	-176.1	0	110.9
926	R	33.2	Very low	31.9	Very low	243 Å²	243	163.8 Å²	163.8	92%	0.917	81%	0.811	S	S	*	*			trans	-176.3	136.8	168.9	-98.9	164.1	-176.2	-162.8	-1.6	106.4
927	Q	31.5	Very low	32	Very low	167 Å²	167	164.5 Å²	164.5	78%	0.78	82%	0.816	S	S	*	*			cis	87.2	112.1	9	-157.4	173.1	-0.7	0	0	117
928	S	31.5	Very low	31.8	Very low	109 Å²	109	168.9 Å²	168.9	76%	0.762	82%	0.82	S	S	*	*			trans	68.4	137.6	168.3	-141.3	0	0	0	0	116.3
929	C	30.2	Very low	31.6	Very low	118 Å²	118	165.2 Å²	165.2	80%	0.797	82%	0.823	S	S	*	*			cis	-152.8	172.6	43	-75.5	0	0	0	0	114.5
930	H	31.9	Very low	31.6	Very low	171 Å²	171	161.7 Å²	161.7	79%	0.792	82%	0.816	S	S	*	*			trans	-70.5	156.5	155	-97.8	-130.4	0	0	0	111.2
931	E	31.3	Very low	31.8	Very low	169 Å²	169	157.2 Å²	157.2	79%	0.79	82%	0.817	S	S	*	*				-167.2	163.5	106.8	-156	43.4	-115	0	0	111.1
932	A	28.3	Very low	31.7	Very low	81 Å²	81	155.6 Å²	155.6	67%	0.669	81%	0.812	S	S	*	*			trans	-136.2	134.3	-178	0	0	0	0	0	113.7
933	V	33	Very low	32.2	Very low	149 Å²	149	148.6 Å²	148.6	90%	0.903	80%	0.799	S	S	*	*			trans	-134.6	147.3	170	-175.7	0	0	0	0	110.1
934	R	29.2	Very low	32.4	Very low	205 Å²	205	150.9 Å²	150.9	77%	0.774	80%	0.797	S	S	*	*			trans	-99.7	153.9	-175.6	-54	160.8	177.1	164.9	-4.1	110.4
935	H	35.7	Very low	32.5	Very low	140 Å²	140	144 Å²	144	65%	0.648	79%	0.788	S	S	*	*				164.5	136.8	106.9	-92	-63.3	0	0	0	116.9
936	R	31	Very low	32.7	Very low	220 Å²	220	140 Å²	140	83%	0.83	78%	0.784	S	S	*	*			trans	74.2	166.2	141.4	-67.9	170.7	-172.5	-93	3.6	119.6
937	S	29.8	Very low	32.8	Very low	109 Å²	109	134.8 Å²	134.8	76%	0.762	77%	0.774	S	S	*	*			trans	-129.6	-160.3	-158.6	-39.8	0	0	0	0	111.6
938	F	31.8	Very low	33.1	Very low	218 Å²	218	131 Å²	131	96%	0.956	77%	0.766	S	S	*	*			trans	89.5	141.5	-174.4	-59.1	-75.2	0	0	0	114.5
939	G	28.8	Very low	33.2	Very low	76 Å²	76	130.7 Å²	130.7	78%	0.784	76%	0.764	S	S	*	*			cis	159.6	121.3	-14.5	0	0	0	0	0	115.8
940	G	31.7	Very low	33.5	Very low	72 Å²	72	133.5 Å²	133.5	74%	0.742	76%	0.763	S	S	*	*			trans	92	171.4	167.5	0	0	0	0	0	117.4
941	S	34.4	Very low	33.6	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	76%	0.759	S	S	*	*			cis	-174.3	123.3	-21.1	-85	0	0	0	0	112.5
942	S	32.3	Very low	33.8	Very low	117 Å²	117	132.8 Å²	132.8	82%	0.818	76%	0.761	S	S	*	*			trans	57.8	175.6	144.7	-64.9	0	0	0	0	121.7
943	P	44.5	Very low	34	Very low	103 Å²	103	132.1 Å²	132.1	67%	0.669	76%	0.762	S	S	*	*			cis	-135	-151.8	-44.8	37.9	-17.9	0	0	0	114
944	D	34.2	Very low	34.3	Very low	146 Å²	146	130.9 Å²	130.9	78%	0.781	76%	0.758	S	S	*	*			trans	76.5	145	165.1	-57.5	-23.2	0	0	0	118.1
945	S	35.2	Very low	34.3	Very low	110 Å²	110	126 Å²	126	77%	0.769	76%	0.755	S	S	*	*			cis	142.8	148.4	-7.8	70.1	0	0	0	0	107
946	S	37	Very low	34.2	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	76%	0.764	S	S	*	*			cis	-126	-137	-17.2	45.6	0	0	0	0	108.5
947	D	36.5	Very low	34.1	Very low	135 Å²	135	126.9 Å²	126.9	72%	0.722	76%	0.763	S	S	*	*			cis	-168.5	176.9	-6.5	-126.7	-50.2	0	0	0	107.1
948	S	36.4	Very low	34.3	Very low	88 Å²	88	128.3 Å²	128.3	62%	0.615	77%	0.767	S	S	*	*			cis	-158.7	152	-7.2	-147	0	0	0	0	114
949	S	34.4	Very low	34.2	Very low	101 Å²	101	125 Å²	125	71%	0.706	76%	0.759	S	S	*	*			trans	36	117.8	137.2	-50.5	0	0	0	0	125
950	K	36.4	Very low	34.5	Very low	178 Å²	178	125.2 Å²	125.2	77%	0.774	76%	0.761	S	S	*	*				166.2	126.9	113.2	-90.2	-179.1	176.1	175.8	0	113.1
951	Q	34.2	Very low	34.5	Very low	152 Å²	152	128.8 Å²	128.8	71%	0.71	77%	0.769	S	S	*	*				58.3	138.8	101.4	-60.8	179.1	-51.7	0	0	115.8
952	M	34.2	Very low	34.4	Very low	172 Å²	172	126.8 Å²	126.8	85%	0.847	77%	0.766	S	S	*	*			cis	-167.9	172.2	-8.3	-107	157.9	62	0	0	106.9
953	G	32.8	Very low	34.3	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	77%	0.77	S	S	*	*			cis	-174.2	-175.2	3.6	0	0	0	0	0	111.2
954	P	39.3	Very low	33.8	Very low	123 Å²	123	134 Å²	134	80%	0.799	78%	0.78	S	S	*	*			trans	-118.7	174.2	-161.7	42.1	-33.7	0	0	0	117.3
955	S	29.8	Very low	33.6	Very low	102 Å²	102	132.4 Å²	132.4	71%	0.713	78%	0.779	S	S	*	*			trans	117.8	154.8	171.2	-64.4	0	0	0	0	113.7
956	K	33.9	Very low	33.5	Very low	194 Å²	194	130.8 Å²	130.8	84%	0.843	78%	0.78	S	S	*	*			cis	-155.5	176.1	0.9	-124.6	160.8	-165.4	171.6	0	112.2
957	K	29.4	Very low	33.3	Very low	185 Å²	185	130.4 Å²	130.4	80%	0.804	78%	0.784	S	S	*	*			trans	-55	164.9	173.9	-50.3	174.4	174.6	-174.4	0	114.7
958	V	33.8	Very low	33.3	Very low	139 Å²	139	132.8 Å²	132.8	84%	0.842	79%	0.79	S	S	*	*				-174.6	149.5	108.1	146.1	0	0	0	0	111.7
959	D	29.5	Very low	33.2	Very low	148 Å²	148	134 Å²	134	79%	0.791	79%	0.794	S	S	*	*			trans	-79	166.4	-178.3	-49.3	-99.3	0	0	0	114.3
960	G	34.8	Very low	33.1	Very low	81 Å²	81	134 Å²	134	84%	0.835	79%	0.794	S	S	*	*			trans	-164.8	98.8	175.2	0	0	0	0	0	114.8
961	T	30.6	Very low	33.1	Very low	148 Å²	148	130.3 Å²	130.3	91%	0.908	80%	0.797	S	S	*	*			trans	-109	135.4	-176.9	55.4	0	0	0	0	114
962	G	34	Very low	33.1	Very low	72 Å²	72	128.5 Å²	128.5	74%	0.742	80%	0.801	S	S	*	*			trans	179.1	121.3	165.4	0	0	0	0	0	109.6
963	K	30.2	Very low	33.3	Very low	207 Å²	207	123.9 Å²	123.9	90%	0.9	79%	0.79	S	S	*	*			cis	77.2	102.5	19.2	-153.2	-173.3	-172.1	-176.9	0	114.6
964	L	33.3	Very low	33.3	Very low	165 Å²	165	128.2 Å²	128.2	86%	0.864	80%	0.798	S	S	*	*			trans	170.2	120.7	158.1	-90.2	160	0	0	0	104.6
965	S	30	Very low	33.2	Very low	111 Å²	111	127.1 Å²	127.1	78%	0.776	79%	0.793	S	S	*	*			cis	96.9	120.6	20.8	83.4	0	0	0	0	115.4
966	G	33.2	Very low	33.4	Very low	76 Å²	76	126.7 Å²	126.7	78%	0.784	80%	0.796	S	S	*	*			trans	144.6	106.3	179	0	0	0	0	0	110.5
967	A	32.7	Very low	33.4	Very low	95 Å²	95	121.9 Å²	121.9	79%	0.785	79%	0.786	S	S	*	*			cis	106.3	153.4	14.9	0	0	0	0	0	114.5
968	Q	36.7	Very low	33.7	Very low	184 Å²	184	122.3 Å²	122.3	86%	0.86	79%	0.788	S	S	*	*			trans	68.1	148.9	-171.2	-59.2	-162.5	89.8	0	0	113.8
969	T	34.1	Very low	33.9	Very low	114 Å²	114	120.4 Å²	120.4	70%	0.699	78%	0.781	S	S	*	*			cis	-162.5	179.5	-9.8	23.4	0	0	0	0	106.3
970	S	33.2	Very low	34.1	Very low	100 Å²	100	118.7 Å²	118.7	70%	0.699	78%	0.776	S	S	*	*				171.1	157.3	-50.7	66.4	0	0	0	0	108.2
971	A	36	Very low	34.2	Very low	101 Å²	101	121.1 Å²	121.1	84%	0.835	77%	0.77	S	S	*	*			trans	80.3	156.5	165.1	0	0	0	0	0	119.8
972	S	33.9	Very low	34.3	Very low	114 Å²	114	123.5 Å²	123.5	80%	0.797	77%	0.767	S	S	*	*			cis	-172.1	178.3	-38	-157.6	0	0	0	0	110.9
973	A	37.6	Very low	34.2	Very low	76 Å²	76	124.1 Å²	124.1	63%	0.628	77%	0.766	S	S	*	*			trans	69.9	119.5	160.1	0	0	0	0	0	117.5
974	N	33.8	Very low	34.3	Very low	158 Å²	158	126.1 Å²	126.1	85%	0.845	77%	0.768	S	S	*	*				91.5	146.3	68	-75.4	-14.4	0	0	0	112.4
975	S	36.3	Very low	34	Very low	100 Å²	100	122.5 Å²	122.5	70%	0.699	77%	0.77	S	S	*	*			cis	-171.3	161.8	-2.1	44.2	0	0	0	0	111.9
976	A	34.1	Very low	34.1	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	78%	0.775	S	S	*	*			trans	54.8	152.1	139	0	0	0	0	0	121.9
977	S	34.4	Very low	34	Very low	92 Å²	92	122.6 Å²	122.6	64%	0.643	77%	0.772	S	S	*	*			cis	-174.9	169.4	-11.5	55.2	0	0	0	0	112.5
978	K	35.8	Very low	33.9	Very low	195 Å²	195	124.1 Å²	124.1	85%	0.848	77%	0.772	S	S	*	*			trans	68.9	157.1	155.3	-74.7	165.4	-177.6	176.1	0	117
979	S	37	Very low	33.6	Very low	98 Å²	98	123.2 Å²	123.2	69%	0.685	77%	0.768	S	S	*	*			cis	-170.9	157.5	-8.1	45.2	0	0	0	0	106.9
980	T	34.7	Very low	33.2	Very low	113 Å²	113	122.3 Å²	122.3	69%	0.693	77%	0.765	S	S	*	*			cis	169.1	165.7	8.9	28.6	0	0	0	0	107.8
981	N	37.1	Very low	33.1	Very low	132 Å²	132	128.2 Å²	128.2	71%	0.706	77%	0.772	S	S	*	*			trans	72.3	130.8	160.7	-66.4	-26.8	0	0	0	118.1
982	K	32.5	Very low	32.8	Very low	197 Å²	197	129.9 Å²	129.9	86%	0.857	77%	0.771	S	S	*	*				82.2	134.8	54.2	-83.2	-173.3	173.6	176.1	0	112.8
983	A	32.8	Very low	32.7	Very low	86 Å²	86	129.3 Å²	129.3	71%	0.711	77%	0.774	S	S	*	*			cis	-166.7	174.8	-4.7	0	0	0	0	0	113.3
984	R	30.9	Very low	32.1	Very low	249 Å²	249	135.6 Å²	135.6	94%	0.94	79%	0.787	S	S	*	*			trans	65	115.9	156.1	-77.8	-176.7	168.2	-179.8	-3.8	121.2
985	G	28.3	Very low	31.9	Very low	88 Å²	88	132.8 Å²	132.8	91%	0.907	79%	0.785	S	S	*	*				93.1	139.6	118	0	0	0	0	0	118.9
986	G	31.4	Very low	31.5	Very low	86 Å²	86	134 Å²	134	89%	0.887	79%	0.791	S	S	*	*			trans	148.8	112.9	172.3	0	0	0	0	0	113.5
987	S	30.5	Very low	31.2	Very low	103 Å²	103	138.7 Å²	138.7	72%	0.72	80%	0.797	S	S	*	*			trans	-96.7	140.7	-176.2	50.2	0	0	0	0	113.5
988	T	30	Very low	30.8	Very low	128 Å²	128	141.5 Å²	141.5	79%	0.785	80%	0.8	S	S	*	*			trans	58.9	152.8	149.6	55.6	0	0	0	0	118.1
989	Q	31	Very low	30.4	Very low	164 Å²	164	141.1 Å²	141.1	77%	0.766	80%	0.801	S	S	*	*			cis	-162.8	163.9	14.6	-141.2	-178.2	40.5	0	0	109.8
990	C	25.1	Very low	30	Very low	96 Å²	96	139.5 Å²	139.5	65%	0.649	80%	0.8	S	S	*	*			trans	66	158.8	159	-68.7	0	0	0	0	117.7
991	R	32	Very low	29.7	Very low	224 Å²	224	138.7 Å²	138.7	85%	0.845	80%	0.799	S	S	*	*			cis	-152.4	133.3	-7.3	-126.8	170.2	-174.1	179.4	1.7	111.7
992	V	28.9	Very low	29.6	Very low	135 Å²	135	142.8 Å²	142.8	82%	0.818	80%	0.804	S	S	*	*			trans	38.2	118.3	143	-177.5	0	0	0	0	121.1
993	A	31.8	Very low	29.4	Very low	102 Å²	102	137.6 Å²	137.6	84%	0.843	79%	0.79	S	S	*	*			trans	-147.5	159.2	136	0	0	0	0	0	109.5
994	K	26.8	Very low	29.5	Very low	209 Å²	209	137.2 Å²	137.2	91%	0.909	78%	0.778	S	S	*	*			trans	-111.9	132.5	-176.2	-75.2	-179.7	177.3	175.9	0	112.9
995	A	27.9	Very low	29.4	Very low	98 Å²	98	131.1 Å²	131.1	81%	0.81	76%	0.762	S	S	*	*			trans	-157.9	143.4	147.8	0	0	0	0	0	109.4
996	P	28.1	Very low	29.7	Very low	127 Å²	127	129.9 Å²	129.9	83%	0.825	73%	0.731	S	S	*	*			trans	-105.8	124.9	179.1	35.5	-27.2	0	0	0	112.8
997	Q	28.6	Very low	29.6	Very low	191 Å²	191	133.8 Å²	133.8	89%	0.893	73%	0.731	S	S	*	*			trans	-153.4	173.9	163.2	-133.7	167.8	-13.8	0	0	113.2
998	E	26	Very low	30	Very low	151 Å²	151	134.4 Å²	134.4	71%	0.706	73%	0.73	S	S	*	*			trans	-88.5	-175.8	-152.6	-52.4	173.5	105.3	0	0	116.5
999	Q	26.3	Very low	30.3	Very low	186 Å²	186	131.3 Å²	131.3	87%	0.869	72%	0.724	S	S	*	*			trans	76.7	152.6	160.1	-59.3	171.7	34.5	0	0	117.2
1000	G	29.7	Very low	30.3	Very low	64 Å²	64	134.2 Å²	134.2	66%	0.66	73%	0.734	S	S	*	*			trans	158.2	1.9	175.4	0	0	0	0	0	120.4	R1002	G1000-R1002 PolarHBondContact O-N 3.3Å
1001	S	28.8	Very low	30.8	Very low	96 Å²	96	132.8 Å²	132.8	67%	0.671	74%	0.736	S	S	*	*			trans	-68.8	109	176.3	-168.9	0	0	0	0	110.5	T1003	S1001-T1003 PolarHBondContact O-N 3.38Å
1002	R	33	Very low	30.8	Very low	218 Å²	218	130 Å²	130	82%	0.823	74%	0.737	S	S	*	*			trans	-76.6	88	-167.7	-75.4	-176.7	170	-177.9	-3.8	112.3	G1000 V1004	G1000-R1002 PolarHBondContact O-N 3.3Å; R1002-V1004 PolarHBondContact O-N 3.21Å
1003	T	30.2	Very low	31	Very low	89 Å²	89	131.7 Å²	131.7	55%	0.546	74%	0.74	S	S	.	*			trans	-67.3	111.4	167.5	-62.4	0	0	0	0	110.2	S1001 M1005	S1001-T1003 PolarHBondContact O-N 3.38Å; T1003-M1005 HydrophobicContact CG2-CG 4.14Å
1004	V	34.9	Very low	31.1	Very low	78 Å²	78	133.8 Å²	133.8	47%	0.473	74%	0.737	S	S	.	*			trans	-93.3	121.3	167.1	-173.7	0	0	0	0	108.1	R1002 F1006	R1002-V1004 PolarHBondContact O-N 3.21Å; V1004-F1006 HydrophobicContact CG1-CZ 3.4Å; V1004-F1006 VanDerWaalsContact CG1-CZ 3.4Å; V1004-F1006 HydrophobicContact CG1-CE2 3.86Å; V1004-F1006 HydrophobicContact CG1-CE1 3.72Å; V1004-F1006 HydrophobicContact CG1-CD1 4.45Å; V1004-F1006 HydrophobicContact CB-CZ 4.39Å; V1004-F1006 HydrophobicContact CB-CE2 4.45Å
1005	M	27.7	Very low	31.3	Very low	121 Å²	121	129 Å²	129	60%	0.596	73%	0.727	S	S	*	*			trans	-94	131.2	177.7	-64.4	-135.1	-60.5	0	0	111.1	K780 T1003	K780-M1005 HydrophobicContact CD-SD 4.23Å; K780-M1005 WeakPolarHBondContact CE-SD 3.29Å; K780-M1005 PolarHBondContact NZ-SD 2.97Å; T1003-M1005 HydrophobicContact CG2-CG 4.14Å
1006	F	34.1	Very low	31.6	Very low	61 Å²	61	131.4 Å²	131.4	27%	0.268	73%	0.731	S	S	.	*			trans	-120.1	116.3	170	-60.7	-58.2	0	0	0	109.8	K744 V1004	K744-F1006 VanDerWaalsContact O-CD1 3.29Å; K744-F1006 WeakPolarHBondContact O-CD1 2.95Å; K744-F1006 WeakPolarHBondContact O-CE1 3.37Å; V1004-F1006 HydrophobicContact CG1-CZ 3.4Å; V1004-F1006 VanDerWaalsContact CG1-CZ 3.4Å; V1004-F1006 HydrophobicContact CG1-CE2 3.86Å; V1004-F1006 HydrophobicContact CG1-CE1 3.72Å; V1004-F1006 HydrophobicContact CG1-CD1 4.45Å; V1004-F1006 HydrophobicContact CB-CZ 4.39Å; V1004-F1006 HydrophobicContact CB-CE2 4.45Å
1007	L	30.9	Very low	31.9	Very low	169 Å²	169	131.5 Å²	131.5	89%	0.885	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-89.6	116.6	169.1	-77.4	164.3	0	0	0	108.4
1008	V	38.6	Very low	32.1	Very low	115 Å²	115	126.5 Å²	126.5	70%	0.697	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-87.5	122.5	172.1	-179.2	0	0	0	0	108.5
1009	G	35	Very low	32.4	Very low	64 Å²	64	124.7 Å²	124.7	66%	0.66	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-66	154.8	178.1	0	0	0	0	0	112.8	G1011	G1009-G1011 PolarHBondContact O-N 3.23Å
1010	K	32.4	Very low	32.7	Very low	225 Å²	225	125.9 Å²	125.9	98%	0.978	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-63.7	118.2	179.6	-63.4	176.4	-178.9	177	0	110.5
1011	G	35.5	Very low	32.8	Very low	66 Å²	66	130.1 Å²	130.1	68%	0.68	73%	0.734	S	S	*	*			trans	-146.9	128.1	172	0	0	0	0	0	109.6	G1009 L1013	G1009-G1011 PolarHBondContact O-N 3.23Å; G1011-L1013 PolarHBondContact O-N 3.06Å
1012	L	32.1	Very low	33.1	Very low	165 Å²	165	130.5 Å²	130.5	86%	0.864	73%	0.732	S	S	*	*			trans	-20	110	-167.6	-81.9	63.1	0	0	0	116.9
1013	L	32.3	Very low	33	Very low	171 Å²	171	126.3 Å²	126.3	90%	0.895	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-83.9	122.7	150.6	-84.6	161.5	0	0	0	108.5	G1011	G1011-L1013 PolarHBondContact O-N 3.06Å
1014	L	33.5	Very low	33	Very low	146 Å²	146	130.2 Å²	130.2	76%	0.764	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-101.6	134.9	158.3	-92.4	156	0	0	0	107.8
1015	P	32.5	Very low	33	Very low	108 Å²	108	131.9 Å²	131.9	70%	0.701	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-81.1	133	-171.3	31.4	-33.6	0	0	0	111.9
1016	V	33.7	Very low	33.1	Very low	148 Å²	148	131.2 Å²	131.2	90%	0.897	76%	0.756	S	S	*	*			trans	-116.5	53.6	159.9	-166.9	0	0	0	0	108.8
1017	V	33.5	Very low	33.1	Very low	129 Å²	129	134.8 Å²	134.8	78%	0.782	78%	0.777	S	S	*	*			trans	-140.3	143.4	168.1	-174.7	0	0	0	0	105.8
1018	A	32.5	Very low	33.2	Very low	86 Å²	86	133.2 Å²	133.2	71%	0.711	77%	0.77	S	S	*	*			trans	75.6	76.8	-174.7	0	0	0	0	0	116.7
1019	S	33.9	Very low	33	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	77%	0.772	S	S	*	*			trans	-151	133.5	140.2	-75.3	0	0	0	0	106.8
1020	F	32.3	Very low	32.9	Very low	210 Å²	210	135.5 Å²	135.5	92%	0.921	78%	0.776	S	S	*	*	P	Polyproline II helix	cis	-98.3	138.1	9.9	-75.4	-105.9	0	0	0	113.1
1021	L	32	Very low	33	Very low	154 Å²	154	130.9 Å²	130.9	81%	0.806	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-84.2	142.3	165.6	-150.8	154.3	0	0	0	108.4	V1023	L1021-V1023 PolarHBondContact O-N 3.24Å
1022	V	34.4	Very low	32.9	Very low	104 Å²	104	135.4 Å²	135.4	63%	0.63	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-64.8	124.4	-180	173.8	0	0	0	0	110.6	F1024	V1022-F1024 HydrophobicContact CG1-CB 4.29Å; V1022-F1024 HydrophobicContact CG1-CD2 3.79Å; V1022-F1024 PolarHBondContact O-N 3.17Å
1023	V	30	Very low	32.8	Very low	129 Å²	129	134.6 Å²	134.6	78%	0.782	77%	0.77	S	S	*	*			trans	-74.8	102.2	161.7	179.1	0	0	0	0	107.7	L1021 V1025	L1021-V1023 PolarHBondContact O-N 3.24Å; V1023-V1025 HydrophobicContact CG1-CG2 4.35Å
1024	F	31.4	Very low	33	Very low	172 Å²	172	131.3 Å²	131.3	75%	0.754	76%	0.758	S	S	*	*			trans	-122.2	103.2	158.9	-118.9	-81.6	0	0	0	108.2	V1022 C1026	V1022-F1024 HydrophobicContact CG1-CB 4.29Å; V1022-F1024 HydrophobicContact CG1-CD2 3.79Å; V1022-F1024 PolarHBondContact O-N 3.17Å; F1024-C1026 PolarHBondContact O-N 3.16Å
1025	V	33.8	Very low	32.9	Very low	112 Å²	112	133.6 Å²	133.6	68%	0.679	77%	0.765	S	S	*	*			trans	-78.3	112.3	165.4	177.5	0	0	0	0	106.6	V1023 L1027	V1023-V1025 HydrophobicContact CG1-CG2 4.35Å; V1025-L1027 HydrophobicContact CG1-CG 4.47Å
1026	C	30.2	Very low	33	Very low	108 Å²	108	132 Å²	132	73%	0.73	77%	0.768	S	S	*	*			trans	-125.1	105.3	159.7	-76.7	0	0	0	0	107.1	F1024	F1024-C1026 PolarHBondContact O-N 3.16Å
1027	L	35.3	Very low	32.9	Very low	135 Å²	135	129.2 Å²	129.2	71%	0.707	76%	0.76	S	S	*	*			trans	-75.1	154.3	164.2	-77.6	160.8	0	0	0	109.3	V1025	V1025-L1027 HydrophobicContact CG1-CG 4.47Å
1028	D	31.8	Very low	33	Very low	136 Å²	136	130.9 Å²	130.9	73%	0.727	77%	0.765	S	S	*	*			trans	45.3	108.1	154.7	-46	-31.2	0	0	0	117
1029	S	34.4	Very low	33.1	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	77%	0.765	S	S	*	*				-171.6	133.7	71	-66.6	0	0	0	0	113.8
1030	T	33.4	Very low	32.9	Very low	122 Å²	122	137.5 Å²	137.5	75%	0.748	77%	0.773	S	S	*	*			trans	20.9	115.7	144.2	59.5	0	0	0	0	120.7
1031	T	33.8	Very low	32.9	Very low	127 Å²	127	137 Å²	137	78%	0.779	77%	0.77	S	S	*	*				174.2	139.8	99.5	33.6	0	0	0	0	115.3
1032	L	34	Very low	32.9	Very low	161 Å²	161	145 Å²	145	84%	0.843	79%	0.79	S	S	*	*			trans	56.3	85.1	142.3	-59.2	170.6	0	0	0	122.5
1033	I	30.7	Very low	32.9	Very low	149 Å²	149	147.1 Å²	147.1	76%	0.764	80%	0.798	S	S	*	*				-13	147.1	115.2	-70.9	162.6	0	0	0	114.7
1034	P	35.8	Very low	33	Very low	101 Å²	101	148.1 Å²	148.1	66%	0.656	80%	0.799	S	S	*	*			cis	-144.8	163	33.9	23.4	3.4	0	0	0	121.1
1035	Q	30.9	Very low	33.1	Very low	195 Å²	195	146.7 Å²	146.7	91%	0.911	80%	0.801	S	S	*	*			trans	55.4	156.3	132.7	-59.1	167	-0.3	0	0	123.9
1036	G	35	Very low	33.1	Very low	74 Å²	74	148.8 Å²	148.8	76%	0.763	81%	0.808	S	S	*	*			trans	124.3	68.5	179.7	0	0	0	0	0	112.3
1037	A	31.5	Very low	33.2	Very low	89 Å²	89	151.3 Å²	151.3	74%	0.736	81%	0.813	S	S	*	*			cis	76.4	113.6	49.1	0	0	0	0	0	114.6
1038	D	34.8	Very low	33.1	Very low	164 Å²	164	152.4 Å²	152.4	88%	0.877	82%	0.82	S	S	*	*			trans	72.3	154.2	157.3	-65.4	-43.7	0	0	0	123.8
1039	A	34.8	Very low	33.2	Very low	86 Å²	86	153.6 Å²	153.6	71%	0.711	83%	0.827	S	S	*	*			trans	72.5	132.4	162.5	0	0	0	0	0	120
1040	W	30.6	Very low	33.1	Very low	254 Å²	254	157.2 Å²	157.2	96%	0.962	83%	0.833	S	S	*	*			cis	-156.4	168.6	1.3	-129	44.8	0	0	0	111.2
1041	K	32.2	Very low	33.1	Very low	198 Å²	198	160.2 Å²	160.2	86%	0.861	84%	0.84	S	S	*	*			trans	-74.5	133.4	-170.9	-62.5	166.4	-179.7	168.4	0	114.5
1042	R	32.9	Very low	33	Very low	324 Å²	324	163.2 Å²	163.2	100%	1.223	85%	0.846	S	S	*	*				-142.9	0	128.4	-79.5	-159.7	-178.7	-178.5	2.1	109.6

Retrieved 1,042 of 1,042 residues in 588 ms (Link to these results)

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