A0A087XDG3_POEFO Loading...

receptor protein-tyrosine kinase

Tyrosine-protein kinase that acts as a cell-surface receptor for CSF1 and plays an essential role in the regulation of survival, proliferation and differentiation of hematopoietic precursor cells, especially mononuclear phagocytes, such as macrophages and monocytes. Plays an important role in innate immunity and in inflammatory processes. Plays an important role in the regulation of osteoclast proliferation and differentiation, the regulation of bone resorption, and is required for normal bone development. Promotes reorganization of the actin cytoskeleton, regulates formation of membrane ruffles, cell adhesion and cell migration. Activates several signaling pathways in response to ligand binding.

AlphaFold DB , UniProt , Accession A0A087XDG3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 980 aa.

						>A0A087XDG3_POEFO|A0A087XDG3
MQSYLTLLLVLVASASSETVEWKPIIKVNSKVVTGPEVVVRAGRPLDLRCEGDGPVNWQPRLAKHRRYVSRGNGNVRVLKVERSSAEFTGTYKCFYTAKPSFNNLTSSLHVYVKDPQRVFWTSSTSLRVVRKEGDDFLLPCLLTDPSATDLGLRMDNGTTVPPGMNFTVDRHRGILIHSLHPSFNADYVCTAKVNGVERTSKAFSINVIQKLRFPPYVFLETDEYIRIVGEEIKIRCTTHNPNFNYNVTWKYTTKSKPRIEETVRSNGENRLDIQSILTISAVDLADTGNISCIGTNEAGVNSTTTYLLVVDKPYIRLLPQLSPTLTLNGLSVVVKEGEDLELSLLIEAYPHITEQGWLTPTPPNTSTQEHKFIRYNNRYVATLQLKRMNIQEQGQYTFYAKSDLTNASISFQVQMYQRPNAVVRWENVTTLTCTSFGYPAPRIIWYQCLGIRPTCNENTSGLQLAIPLQAPTVEVQREEYGAVEVESVLTVGPSSQRMTVECVAFNLIGVSRDTLAMEVSDKLFTTTLSGAAGILAILLVLLAILLYKYKQKPRYEIRWKIIEARDGNNYTFIDPTQLPYNEKWEFPRDKLKLGKILGAGAFGKVVEATAYGLGKEDNVMRVAVKMLKASAHSDEREALMSELKILSHLGHHKHIVNLLGACTYGGPVLVITEYCSLGDLLNFLRQKAETFVNFVMNIPEIGENSNDYKNICIQKQFIRSDSGISSFASSSYLEMRPTQLPNTEQSRESDCEETGDWPLDIDDLLRFSLQVAQGLDFLAAKNCIHRDVAARNVLLTSRREAKICDFGLARDIMNDSNYVVKGNARLPVKWMAPESIFDCVYTVQSDVWSYGILLWEIFSLGQSPYPNMAVDTRFYKMVKRGYQMSQPDFAPLDMYVIMKMCWNLEPTKRPTFSKIGQMIEKLLGGHLEDEQVIYQNMQQEVTEADAYDKPKCHDGPCDQSCDHDEEEQPLMKTNNYQFC
					

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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	41.2	Very low	44.9	Very low	223 Å²	223	139.3 Å²	139.3	100%	1.099	72%	0.718	S	S	*	*				0	77.9	0	-77.9	-172.2	-91.9	0	0	109	S3	M1-S3 VanDerWaalsContact C-N 3.34Å
2	Q	45	Very low	44.9	Very low	193 Å²	193	137.4 Å²	137.4	90%	0.902	72%	0.717	S	S	*	*			cis	66.7	13.2	27.4	-125.2	167	3.9	0	0	116.7
3	S	45.8	Very low	44.6	Very low	81 Å²	81	133 Å²	133	57%	0.566	71%	0.713	S	S	*	*	S	Bend	trans	-141.5	6	171	-59.3	0	0	0	0	115.8	M1	M1-S3 VanDerWaalsContact C-N 3.34Å
4	Y	45.7	Very low	44.2	Very low	191 Å²	191	129.6 Å²	129.6	75%	0.749	71%	0.705	S	S	*	*	S	Bend	trans	-125.7	-5.6	-178.7	-79.2	-80.9	0	0	0	115.8
5	L	45.7	Very low	43.9	Very low	149 Å²	149	127 Å²	127	78%	0.78	71%	0.708	S	S	*	*	S	Bend	trans	-93.5	-13.9	175.5	-142.3	76.7	0	0	0	113.3
6	T	48.6	Very low	43.4	Very low	98 Å²	98	125.1 Å²	125.1	60%	0.601	71%	0.706	S	S	*	*	H	α-helix	trans	-86.6	-15.6	176.1	34.6	0	0	0	0	113.5	V10	T6-V10 WeakPolarHBondContact O-CG2 3.38Å
7	L	46	Very low	43.3	Very low	116 Å²	116	123.3 Å²	123.3	61%	0.607	70%	0.703	S	S	*	*	H	α-helix	trans	-85.8	-27.5	179.4	-148.9	78.3	0	0	0	113	L11	L7-L11 PolarHBondContact O-N 2.87Å
8	L	44.5	Very low	42.9	Very low	134 Å²	134	126.7 Å²	126.7	70%	0.702	71%	0.712	S	S	*	*	H	α-helix	trans	-86.2	-19.6	179.1	-108.5	128.6	0	0	0	113.9
9	L	45	Very low	42.9	Very low	127 Å²	127	125 Å²	125	67%	0.665	71%	0.705	S	S	*	*	H	α-helix	trans	-87.3	-17.3	170.5	-89	152.2	0	0	0	113.1	A13	L9-A13 WeakPolarHBondContact O-CB 3.33Å; L9-A13 PolarHBondContact O-N 2.79Å
10	V	46.4	Very low	43	Very low	93 Å²	93	123.6 Å²	123.6	56%	0.564	70%	0.699	S	S	*	*	H	α-helix	trans	-85.1	-22.7	173.6	171.7	0	0	0	0	112.2	T6 S14	T6-V10 WeakPolarHBondContact O-CG2 3.38Å; V10-S14 PolarHBondContact O-OG 2.61Å
11	L	39.9	Very low	43.5	Very low	127 Å²	127	121.8 Å²	121.8	67%	0.665	69%	0.685	S	S	*	*	S	Bend	trans	-84.3	-8.5	174.1	-84.5	159.2	0	0	0	114.5	L7	L7-L11 PolarHBondContact O-N 2.87Å
12	V	45.3	Very low	44.7	Very low	117 Å²	117	119.8 Å²	119.8	71%	0.709	67%	0.665	S	S	*	*	S	Bend	trans	-108.8	-6.7	172.6	-174.8	0	0	0	0	112
13	A	40.8	Very low	46.3	Very low	80 Å²	80	116.2 Å²	116.2	66%	0.661	65%	0.646	S	S	*	*	S	Bend	trans	-105.2	11.7	177.3	0	0	0	0	0	114.5	L9	L9-A13 WeakPolarHBondContact O-CB 3.33Å; L9-A13 PolarHBondContact O-N 2.79Å
14	S	38.1	Very low	48.2	Very low	85 Å²	85	112.4 Å²	112.4	59%	0.594	62%	0.62	S	S	*	*	S	Bend	trans	-115.9	16.4	169.6	54.9	0	0	0	0	113.4	V10 S16	V10-S14 PolarHBondContact O-OG 2.61Å; S14-S16 PolarHBondContact O-N 2.76Å
15	A	39.7	Very low	50.2	Low	91 Å²	91	107.4 Å²	107.4	75%	0.752	61%	0.605	S	S	*	*			trans	-92.7	42.3	160.5	0	0	0	0	0	110.6	S17	A15-S17 VanDerWaalsContact C-N 3.27Å; A15-S17 PolarHBondContact O-N 3.27Å; A15-S17 VanDerWaalsContact O-N 3.08Å
16	S	36.2	Very low	52.2	Low	97 Å²	97	101 Å²	101	68%	0.678	57%	0.572	S	S	*	*			trans	-75.5	89.8	159.9	54.4	0	0	0	0	107.4	S14 E18	S14-S16 PolarHBondContact O-N 2.76Å; S16-E18 PolarHBondContact O-N 3.11Å
17	S	41.6	Very low	54	Low	94 Å²	94	98.6 Å²	98.6	66%	0.657	55%	0.553	S	S	*	*			trans	28.6	74.2	144.3	170.8	0	0	0	0	114.5	A15 T19	A15-S17 VanDerWaalsContact C-N 3.27Å; A15-S17 PolarHBondContact O-N 3.27Å; A15-S17 VanDerWaalsContact O-N 3.08Å; S17-T19 PolarHBondContact O-N 3.28Å
18	E	36.5	Very low	55.9	Low	185 Å²	185	93.6 Å²	93.6	86%	0.864	53%	0.527	S	S	*	.			trans	-65.6	89.3	149.8	-80.9	-171.9	165.6	0	0	105.7	S16 V20	S16-E18 PolarHBondContact O-N 3.11Å; E18-V20 VanDerWaalsContact C-N 3.26Å; E18-V20 PolarHBondContact O-N 3.46Å
19	T	42.5	Very low	57.6	Low	94 Å²	94	90.8 Å²	90.8	58%	0.577	51%	0.513	S	S	*	.			trans	-59.3	101.5	159.8	43.9	0	0	0	0	105.2	S17 E21	S17-T19 PolarHBondContact O-N 3.28Å; T19-E21 PolarHBondContact O-N 3.25Å
20	V	45.1	Very low	59.1	Low	97 Å²	97	88.4 Å²	88.4	59%	0.588	51%	0.507	S	S	*	.			trans	-58	93.9	164.3	177.1	0	0	0	0	105.3	E18 W22	E18-V20 VanDerWaalsContact C-N 3.26Å; E18-V20 PolarHBondContact O-N 3.46Å; V20-W22 HydrophobicContact CG1-CD2 4.49Å; V20-W22 HydrophobicContact CG1-CZ2 4.12Å; V20-W22 PolarHBondContact O-N 3.46Å; V20-W22 PolarHBondContact O-NE1 3.12Å
21	E	54.3	Low	60.8	Low	85 Å²	85	91.8 Å²	91.8	40%	0.397	51%	0.514	S	S	.	.			trans	-74.5	110	-177.9	-80.1	-176.7	173.8	0	0	108.2	T19 F102 L105	T19-E21 PolarHBondContact O-N 3.25Å; E21-F102 WeakPolarHBondContact OE2-CE1 3.35Å; E21-F102 WeakPolarHBondContact OE2-CZ 3.49Å; E21-L105 HydrophobicContact CB-CD1 4.26Å
22	W	66.4	Low	62.6	Low	181 Å²	181	89.8 Å²	89.8	69%	0.686	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-78	147.5	-177.4	-62.8	85.6	0	0	0	110.9	V20 Y96	V20-W22 HydrophobicContact CG1-CD2 4.49Å; V20-W22 HydrophobicContact CG1-CZ2 4.12Å; V20-W22 PolarHBondContact O-N 3.46Å; V20-W22 PolarHBondContact O-NE1 3.12Å; W22-Y96 PolarHBondContact O-OH 3Å; W22-Y96 VanDerWaalsContact O-OH 3.05Å
23	K	78.8	Confident	64.2	Low	118 Å²	118	86 Å²	86	51%	0.513	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-57.4	143.2	168.9	-67	-175	-180	-179.6	0	109.4	I25 L105 S107	K23-I25 PolarHBondContact O-N 3.08Å; K23-L105 HydrophobicContact CG-CB 4.35Å; K23-L105 HydrophobicContact CG-CD2 3.81Å; K23-S107 WeakPolarHBondContact CB-OG 3.44Å
24	P	85.6	Confident	65.5	Low	1 Å²	1	89.2 Å²	89.2	1%	0.006	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-61	137.7	-178.2	25.2	-32.6	0	0	0	110.6	E51 V56 C94 Y96 L105 S107	P24-E51 CarbonylContact C-O 3.54Å; P24-E51 VanDerWaalsContact CA-O 3.31Å; P24-E51 WeakPolarHBondContact CA-O 3.43Å; P24-V56 HydrophobicContact CB-CG1 4.07Å; P24-C94 HydrophobicContact CG-CB 4.38Å; P24-Y96 HydrophobicContact CB-CE2 4.49Å; P24-Y96 HydrophobicContact CG-CE2 4.37Å; P24-L105 WeakPolarHBondContact CD-O 3.46Å; P24-S107 WeakPolarHBondContact O-CB 3.46Å; P24-S107 PolarHBondContact O-OG 2.88Å
25	I	86.8	Confident	67.3	Low	87 Å²	87	86.8 Å²	86.8	45%	0.446	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	133.3	-175.4	-61.5	172	0	0	0	109.4	K23 K27 V32 C50 E51	K23-I25 PolarHBondContact O-N 3.08Å; I25-K27 HydrophobicContact CG2-CG 4.49Å; I25-V32 HydrophobicContact CG2-CG1 3.98Å; I25-V32 HydrophobicContact CG2-CG2 4.43Å; I25-C50 WeakPolarHBondContact O-CA 3.28Å; I25-E51 PolarHBondContact N-O 3.29Å; I25-E51 PolarHBondContact O-N 3.32Å
26	I	88.1	Confident	69.4	Low	14 Å²	14	87 Å²	87	7%	0.072	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.9	174.5	-60.8	173.3	0	0	0	109.4	V33 R49 W58 C94 L109	I26-V33 PolarHBondContact O-N 3.23Å; I26-R49 CarbonylContact C-O 3.55Å; I26-R49 WeakPolarHBondContact CA-O 3.46Å; I26-W58 HydrophobicContact CB-CH2 4.39Å; I26-W58 HydrophobicContact CD1-CH2 3.84Å; I26-W58 HydrophobicContact CD1-CZ3 4.12Å; I26-W58 HydrophobicContact CG1-CH2 3.83Å; I26-W58 HydrophobicContact CG2-CH2 3.72Å; I26-W58 HydrophobicContact CG2-CZ2 4.27Å; I26-C94 HydrophobicContact CD1-CB 4.43Å; I26-C94 HydrophobicContact CG1-CB 4.36Å; I26-L109 HydrophobicContact CD1-CB 3.83Å; I26-L109 HydrophobicContact CG2-CB 4.2Å; I26-L109 HydrophobicContact CG2-CD2 3.63Å
27	K	87.1	Confident	71.9	Confident	48 Å²	48	86.2 Å²	86.2	21%	0.209	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	141	170.9	-59.2	-179.4	-176.2	161.4	0	110.4	I25 K31 V32 L48 R49 E51	I25-K27 HydrophobicContact CG2-CG 4.49Å; K27-K31 CarbonylContact C-O 3.56Å; K27-K31 WeakPolarHBondContact CA-O 3.33Å; K27-K31 WeakPolarHBondContact CB-O 3.16Å; K27-V32 HydrophobicContact CD-CG2 4.18Å; K27-V32 HydrophobicContact CG-CG2 3.95Å; K27-L48 WeakPolarHBondContact O-CA 3Å; K27-R49 HydrophobicContact CB-CB 4.26Å; K27-R49 PolarHBondContact N-O 2.87Å; K27-R49 PolarHBondContact O-N 2.79Å; K27-E51 WeakPolarHBondContact CD-OE1 3.5Å; K27-E51 WeakPolarHBondContact CE-OE1 3.33Å; K27-E51 VanDerWaalsContact CE-OE2 3.27Å; K27-E51 WeakPolarHBondContact CE-OE2 3.39Å; K27-E51 IonicContact NZ-OE1 3.51Å; K27-E51 PolarHBondContact NZ-OE1 3.26Å; K27-E51 IonicContact NZ-OE2 2.74Å; K27-E51 PolarHBondContact NZ-OE2 3.16Å
28	V	84.6	Confident	74.3	Confident	11 Å²	11	83 Å²	83	7%	0.067	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122.4	174.7	-176.2	0	0	0	0	108.2	S30 K31 V33 V38 D47 L48 L109	V28-S30 PolarHBondContact O-N 2.8Å; V28-K31 PolarHBondContact N-O 3.44Å; V28-K31 PolarHBondContact O-N 3.05Å; V28-V33 HydrophobicContact CB-CG2 3.72Å; V28-V33 HydrophobicContact CG2-CB 4.49Å; V28-V33 HydrophobicContact CG2-CG2 3.39Å; V28-V38 HydrophobicContact CG1-CG2 4.24Å; V28-V38 HydrophobicContact CG2-CG1 4.2Å; V28-V38 HydrophobicContact CG2-CG2 4.49Å; V28-D47 CarbonylContact C-O 3.55Å; V28-D47 WeakPolarHBondContact CA-O 3.25Å; V28-L48 HydrophobicContact CB-CD2 4.38Å; V28-L48 HydrophobicContact CG1-CD2 4.19Å; V28-L48 HydrophobicContact CG2-CD2 3.66Å; V28-L109 HydrophobicContact CG2-CD2 3.4Å; V28-L109 VanDerWaalsContact CG2-CD2 3.4Å
29	N	81.6	Confident	76.8	Confident	75 Å²	75	77.8 Å²	77.8	40%	0.401	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	45.9	-177	-62.4	-28.2	0	0	0	112.3	K31 D47	N29-K31 PolarHBondContact O-N 3.04Å; N29-D47 PolarHBondContact N-O 2.82Å; N29-D47 WeakPolarHBondContact OD1-CB 3.4Å; N29-D47 PolarHBondContact OD1-N 2.88Å; N29-D47 VanDerWaalsContact OD1-N 3.15Å
30	S	75.8	Confident	79.1	Confident	77 Å²	77	73.9 Å²	73.9	54%	0.538	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	11	-179.1	-51.9	0	0	0	0	116.4	V28	V28-S30 PolarHBondContact O-N 2.8Å
31	K	81.6	Confident	81.3	Confident	164 Å²	164	78.5 Å²	78.5	71%	0.713	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.8	171.6	-65.5	-174.1	178.4	-174.8	0	110.8	K27 V28 N29 V33	K27-K31 CarbonylContact C-O 3.56Å; K27-K31 WeakPolarHBondContact CA-O 3.33Å; K27-K31 WeakPolarHBondContact CB-O 3.16Å; V28-K31 PolarHBondContact N-O 3.44Å; V28-K31 PolarHBondContact O-N 3.05Å; N29-K31 PolarHBondContact O-N 3.04Å; K31-V33 PolarHBondContact O-N 3.34Å
32	V	77.3	Confident	83	Confident	84 Å²	84	76.1 Å²	76.1	51%	0.509	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	128.1	171.7	-179.9	0	0	0	0	108.4	I25 K27	I25-V32 HydrophobicContact CG2-CG1 3.98Å; I25-V32 HydrophobicContact CG2-CG2 4.43Å; K27-V32 HydrophobicContact CD-CG2 4.18Å; K27-V32 HydrophobicContact CG-CG2 3.95Å
33	V	78.8	Confident	84	Confident	39 Å²	39	69.6 Å²	69.6	24%	0.236	39%	0.387	C	S	.	.			trans	-97.7	120.2	176.3	-178.6	0	0	0	0	108.2	I26 V28 K31 G35 L109	I26-V33 PolarHBondContact O-N 3.23Å; V28-V33 HydrophobicContact CB-CG2 3.72Å; V28-V33 HydrophobicContact CG2-CB 4.49Å; V28-V33 HydrophobicContact CG2-CG2 3.39Å; K31-V33 PolarHBondContact O-N 3.34Å; V33-G35 WeakPolarHBondContact CG1-O 3.37Å; V33-L109 HydrophobicContact CG1-CD1 3.99Å
34	T	69.5	Low	84.5	Confident	146 Å²	146	71.9 Å²	71.9	90%	0.896	39%	0.392	S	S	*	.			trans	-91.2	-16.6	179.1	50.3	0	0	0	0	113
35	G	76.1	Confident	84.7	Confident	34 Å²	34	74.9 Å²	74.9	35%	0.351	41%	0.411	S	S	.	.	S	Bend	trans	-94.3	163.4	177.7	0	0	0	0	0	114.1	V33 E37	V33-G35 WeakPolarHBondContact CG1-O 3.37Å; G35-E37 PolarHBondContact O-N 3.08Å
36	P	83.2	Confident	84.9	Confident	97 Å²	97	70.7 Å²	70.7	63%	0.63	39%	0.39	S	S	*	.	S	Bend	trans	-75.1	-10	179.2	28.8	-32.7	0	0	0	114	H110	P36-H110 PolarHBondContact O-N 3.29Å
37	E	89.1	Confident	85	Confident	79 Å²	79	70.8 Å²	70.8	37%	0.369	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150.8	-170.9	-55	179.4	172.8	0	0	112	G35 H110 Y112 H172	G35-E37 PolarHBondContact O-N 3.08Å; E37-H110 CarbonylContact C-O 3.56Å; E37-H110 VanDerWaalsContact CA-O 3.27Å; E37-H110 WeakPolarHBondContact CA-O 3.41Å; E37-H110 HydrophobicContact CG-CB 4.21Å; E37-Y112 HydrophobicContact CB-CD2 4.49Å; E37-Y112 HydrophobicContact CB-CE2 4.16Å; E37-Y112 HydrophobicContact CG-CE2 4.2Å; E37-Y112 WeakPolarHBondContact OE2-CE2 3.36Å; E37-H172 IonicContact OE1-CD2 2.66Å; E37-H172 IonicContact OE1-CE1 3.05Å; E37-H172 PolarHBondContact OE1-CE1 2.65Å; E37-H172 IonicContact OE1-NE2 2.67Å; E37-H172 PolarHBondContact OE1-NE2 3.41Å
38	V	91.2	Very high	85.3	Confident	28 Å²	28	68.5 Å²	68.5	17%	0.17	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	145.7	172.8	70.8	0	0	0	0	111.1	V28 L109 H110 V111 Y112	V28-V38 HydrophobicContact CG1-CG2 4.24Å; V28-V38 HydrophobicContact CG2-CG1 4.2Å; V28-V38 HydrophobicContact CG2-CG2 4.49Å; V38-L109 HydrophobicContact CB-CD1 4.35Å; V38-L109 HydrophobicContact CG1-CD1 4.28Å; V38-L109 HydrophobicContact CG1-CD2 3.96Å; V38-L109 HydrophobicContact CG1-CG 4.24Å; V38-H110 PolarHBondContact N-O 3.33Å; V38-V111 HydrophobicContact CG1-CB 4.16Å; V38-V111 HydrophobicContact CG1-CG1 4.11Å; V38-V111 HydrophobicContact CG1-CG2 3.78Å; V38-Y112 PolarHBondContact O-N 3.29Å
39	V	90.4	Very high	85.6	Confident	74 Å²	74	71.9 Å²	71.9	45%	0.448	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.3	177.4	-170.3	0	0	0	0	110.4	Y112 K114 P146	V39-Y112 CarbonylContact C-O 3.54Å; V39-Y112 WeakPolarHBondContact CA-O 3.33Å; V39-Y112 HydrophobicContact CG2-CD2 4.43Å; V39-K114 HydrophobicContact CG1-CB 4.04Å; V39-P146 HydrophobicContact CG2-CG 3.54Å
40	V	90.8	Very high	86	Confident	12 Å²	12	68.3 Å²	68.3	7%	0.073	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.7	177.5	-178	0	0	0	0	108.7	R44 L46 V111 Y112 V113 K114	V40-R44 HydrophobicContact CG1-CB 4.23Å; V40-L46 HydrophobicContact CG2-CD1 3.96Å; V40-V111 HydrophobicContact CG2-CG1 4.46Å; V40-Y112 PolarHBondContact N-O 3.24Å; V40-V113 CarbonylContact O-C 3.56Å; V40-V113 VanDerWaalsContact O-CA 3.25Å; V40-V113 WeakPolarHBondContact O-CA 3.33Å; V40-K114 PolarHBondContact O-N 2.96Å
41	R	89.6	Confident	86.6	Confident	194 Å²	194	67.1 Å²	67.1	73%	0.732	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	138.8	175.6	-65.6	-174.1	-176.6	-175.9	1.4	110.4	R44	R41-R44 HydrophobicContact CB-CG 4.27Å; R41-R44 WeakPolarHBondContact O-CB 3.38Å; R41-R44 PolarHBondContact O-N 2.82Å
42	A	90.8	Very high	86.9	Confident	36 Å²	36	59.9 Å²	59.9	30%	0.298	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	143.5	173.4	0	0	0	0	0	111.8	R44 S84 V113 K114 D115	A42-R44 VanDerWaalsContact C-N 3.29Å; A42-R44 PolarHBondContact O-N 2.87Å; A42-S84 CarbonylContact C-O 3.6Å; A42-S84 WeakPolarHBondContact CA-O 3.29Å; A42-V113 HydrophobicContact CB-CG1 4.24Å; A42-K114 PolarHBondContact N-O 3Å; A42-D115 HydrophobicContact CB-CB 4.01Å
43	G	87.4	Confident	87.1	Confident	43 Å²	43	61.6 Å²	61.6	44%	0.443	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-5.9	-176.2	0	0	0	0	0	115.2	S84	G43-S84 PolarHBondContact N-O 3.44Å
44	R	89.4	Confident	87.1	Confident	167 Å²	167	60.5 Å²	60.5	63%	0.63	33%	0.334	S	S	*	.	S	Bend	trans	-90.8	157	173.9	-66.3	-66.8	-175.2	155.6	-1.3	112	V40 R41 A42 S84	V40-R44 HydrophobicContact CG1-CB 4.23Å; R41-R44 HydrophobicContact CB-CG 4.27Å; R41-R44 WeakPolarHBondContact O-CB 3.38Å; R41-R44 PolarHBondContact O-N 2.82Å; A42-R44 VanDerWaalsContact C-N 3.29Å; A42-R44 PolarHBondContact O-N 2.87Å; R44-S84 WeakPolarHBondContact O-CB 3.31Å; R44-S84 PolarHBondContact O-N 2.72Å; R44-S84 PolarHBondContact O-OG 3.21Å
45	P	89.8	Confident	87.9	Confident	63 Å²	63	55.7 Å²	55.7	41%	0.409	31%	0.306	S	S	.	.			trans	-69.4	139.9	175	28.1	-34.1	0	0	0	111.4	V81 E82	P45-V81 CarbonylContact C-O 3.55Å; P45-V81 WeakPolarHBondContact CA-O 3.31Å; P45-E82 VanDerWaalsContact CA-O 3.31Å; P45-E82 WeakPolarHBondContact CA-O 3.13Å
46	L	90.8	Very high	88.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	103.9	173.7	177.6	68.5	0	0	0	107.9	V40 L48 K80 V81 F88 V111	V40-L46 HydrophobicContact CG2-CD1 3.96Å; L46-L48 HydrophobicContact CD1-CD2 3.85Å; L46-L48 HydrophobicContact CD1-CG 4.1Å; L46-L48 HydrophobicContact CG-CD2 4.43Å; L46-L48 HydrophobicContact CG-CG 4.13Å; L46-K80 CarbonylContact O-C 3.43Å; L46-K80 WeakPolarHBondContact O-CA 2.97Å; L46-V81 HydrophobicContact CB-CB 4.29Å; L46-V81 PolarHBondContact N-O 3.04Å; L46-V81 PolarHBondContact O-N 2.98Å; L46-F88 HydrophobicContact CD2-CB 4.17Å; L46-V111 HydrophobicContact CD1-CG1 3.88Å; L46-V111 HydrophobicContact CD2-CG1 4.22Å
47	D	91.2	Very high	88.7	Confident	15 Å²	15	51.8 Å²	51.8	8%	0.08	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	102.5	174.1	-177.4	-11	0	0	0	108.7	V28 N29 R49 V78	V28-D47 CarbonylContact C-O 3.55Å; V28-D47 WeakPolarHBondContact CA-O 3.25Å; N29-D47 PolarHBondContact N-O 2.82Å; N29-D47 WeakPolarHBondContact OD1-CB 3.4Å; N29-D47 PolarHBondContact OD1-N 2.88Å; N29-D47 VanDerWaalsContact OD1-N 3.15Å; D47-R49 VanDerWaalsContact OD1-CG 3.25Å; D47-R49 WeakPolarHBondContact OD1-CG 3.37Å; D47-R49 IonicContact OD1-NE 3.24Å; D47-R49 PolarHBondContact OD1-NE 3.16Å; D47-R49 IonicContact OD2-CZ 3.59Å; D47-R49 IonicContact OD2-NE 3.29Å; D47-R49 PolarHBondContact OD2-NE 2.99Å; D47-R49 IonicContact OD2-NH2 2.96Å; D47-R49 PolarHBondContact OD2-NH2 2.64Å; D47-V78 VanDerWaalsContact OD1-CG1 3.25Å; D47-V78 WeakPolarHBondContact OD1-CG1 3.35Å
48	L	91.4	Very high	88.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	118.7	174.2	-57.4	179.4	0	0	0	109.3	K27 V28 L46 W58 V78 L79 Y92 L109 V111	K27-L48 WeakPolarHBondContact O-CA 3Å; V28-L48 HydrophobicContact CB-CD2 4.38Å; V28-L48 HydrophobicContact CG1-CD2 4.19Å; V28-L48 HydrophobicContact CG2-CD2 3.66Å; L46-L48 HydrophobicContact CD1-CD2 3.85Å; L46-L48 HydrophobicContact CD1-CG 4.1Å; L46-L48 HydrophobicContact CG-CD2 4.43Å; L46-L48 HydrophobicContact CG-CG 4.13Å; L48-W58 HydrophobicContact CB-CH2 4.17Å; L48-W58 HydrophobicContact CB-CZ2 3.73Å; L48-V78 CarbonylContact O-C 3.55Å; L48-V78 WeakPolarHBondContact O-CA 3.16Å; L48-L79 HydrophobicContact CB-CB 4.28Å; L48-L79 HydrophobicContact CD1-CD2 4.37Å; L48-L79 PolarHBondContact N-O 2.67Å; L48-L79 PolarHBondContact O-N 3.03Å; L48-Y92 HydrophobicContact CD1-CD1 4Å; L48-Y92 HydrophobicContact CD1-CD2 4.04Å; L48-Y92 HydrophobicContact CD1-CE1 4.38Å; L48-Y92 HydrophobicContact CD1-CE2 4.43Å; L48-Y92 HydrophobicContact CD1-CG 3.83Å; L48-L109 HydrophobicContact CD2-CD2 4.12Å; L48-V111 HydrophobicContact CD1-CG2 4.13Å; L48-V111 HydrophobicContact CD2-CG2 4.19Å
49	R	91.2	Very high	88.5	Confident	82 Å²	82	51.9 Å²	51.9	31%	0.309	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.3	176.4	-50.1	-169.4	177	-169.4	1	109.5	I26 K27 D47 R77 V78	I26-R49 CarbonylContact C-O 3.55Å; I26-R49 WeakPolarHBondContact CA-O 3.46Å; K27-R49 HydrophobicContact CB-CB 4.26Å; K27-R49 PolarHBondContact N-O 2.87Å; K27-R49 PolarHBondContact O-N 2.79Å; D47-R49 VanDerWaalsContact OD1-CG 3.25Å; D47-R49 WeakPolarHBondContact OD1-CG 3.37Å; D47-R49 IonicContact OD1-NE 3.24Å; D47-R49 PolarHBondContact OD1-NE 3.16Å; D47-R49 IonicContact OD2-CZ 3.59Å; D47-R49 IonicContact OD2-NE 3.29Å; D47-R49 PolarHBondContact OD2-NE 2.99Å; D47-R49 IonicContact OD2-NH2 2.96Å; D47-R49 PolarHBondContact OD2-NH2 2.64Å; R49-R77 WeakPolarHBondContact CA-O 3.37Å; R49-V78 HydrophobicContact CB-CG2 4.48Å; R49-V78 HydrophobicContact CG-CG1 4.25Å; R49-V78 HydrophobicContact CG-CG2 3.99Å
50	C	89.9	Confident	88.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.3	168.3	-179.6	0	0	0	0	109.2	I25 V56 W58 V76 R77 C94	I25-C50 WeakPolarHBondContact O-CA 3.28Å; C50-V56 HydrophobicContact CB-CG2 4.37Å; C50-W58 HydrophobicContact CB-CD2 4.35Å; C50-W58 HydrophobicContact CB-CH2 4.38Å; C50-W58 HydrophobicContact CB-CZ2 3.63Å; C50-V76 CarbonylContact O-C 3.5Å; C50-V76 VanDerWaalsContact O-CA 3.28Å; C50-V76 WeakPolarHBondContact O-CA 3.46Å; C50-R77 PolarHBondContact N-O 3.05Å; C50-R77 PolarHBondContact O-N 3.02Å; C50-C94 HydrophobicContact CB-CB 3.63Å; C50-C94 WeakPolarHBondContact CB-SG 3.4Å; C50-C94 WeakPolarHBondContact SG-CB 3.47Å; C50-C94 CovalentContact SG-SG 1.96Å; C50-C94 PolarHBondContact SG-SG 2.87Å
51	E	89.8	Confident	88	Confident	52 Å²	52	51.6 Å²	51.6	24%	0.243	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.5	-179.3	-58	-178.7	-170.5	0	0	109	P24 I25 K27 N75 V76	P24-E51 CarbonylContact C-O 3.54Å; P24-E51 VanDerWaalsContact CA-O 3.31Å; P24-E51 WeakPolarHBondContact CA-O 3.43Å; I25-E51 PolarHBondContact N-O 3.29Å; I25-E51 PolarHBondContact O-N 3.32Å; K27-E51 WeakPolarHBondContact CD-OE1 3.5Å; K27-E51 WeakPolarHBondContact CE-OE1 3.33Å; K27-E51 VanDerWaalsContact CE-OE2 3.27Å; K27-E51 WeakPolarHBondContact CE-OE2 3.39Å; K27-E51 IonicContact NZ-OE1 3.51Å; K27-E51 PolarHBondContact NZ-OE1 3.26Å; K27-E51 IonicContact NZ-OE2 2.74Å; K27-E51 PolarHBondContact NZ-OE2 3.16Å; E51-N75 WeakPolarHBondContact CA-O 3.29Å; E51-V76 HydrophobicContact CB-CG2 4.41Å; E51-V76 HydrophobicContact CG-CB 4.46Å; E51-V76 HydrophobicContact CG-CG1 3.99Å; E51-V76 HydrophobicContact CG-CG2 3.92Å
52	G	86.5	Confident	87.7	Confident	13 Å²	13	44.3 Å²	44.3	13%	0.134	24%	0.236	C	C	.	.			trans	-149.4	170.8	175.3	0	0	0	0	0	111.8	G54 N75 Y96	G52-G54 PolarHBondContact O-N 2.87Å; G52-N75 PolarHBondContact N-O 3.33Å; G52-N75 WeakPolarHBondContact O-CB 3.47Å; G52-Y96 WeakPolarHBondContact CA-OH 3.41Å
53	D	81.3	Confident	87.3	Confident	120 Å²	120	46.5 Å²	46.5	64%	0.642	25%	0.254	S	S	*	.	S	Bend	trans	-73.8	-11.7	-175.1	-62.1	-34.8	0	0	0	113.1	N75 Y96	D53-N75 PolarHBondContact O-ND2 2.94Å; D53-Y96 PolarHBondContact N-OH 2.79Å; D53-Y96 VanDerWaalsContact N-OH 3.16Å
54	G	80.6	Confident	87.2	Confident	16 Å²	16	49 Å²	49	17%	0.165	25%	0.253	C	S	.	.	S	Bend	trans	-138.9	-174.7	172.6	0	0	0	0	0	112.6	G52 V56 N75	G52-G54 PolarHBondContact O-N 2.87Å; G54-V56 WeakPolarHBondContact O-CG1 3.03Å; G54-V56 PolarHBondContact O-N 3.02Å; G54-V56 VanDerWaalsContact O-N 3.16Å; G54-N75 VanDerWaalsContact C-OD1 3.27Å
55	P	84.8	Confident	87.1	Confident	45 Å²	45	41.1 Å²	41.1	29%	0.292	22%	0.223	S	C	.	.			trans	-61.3	117.3	-174.5	-25.9	35.8	0	0	0	113.1	G74 T97	P55-G74 WeakPolarHBondContact CA-O 3.38Å; P55-T97 WeakPolarHBondContact CB-OG1 3.27Å; P55-T97 PolarHBondContact O-N 3.47Å; P55-T97 PolarHBondContact O-OG1 2.93Å
56	V	87.4	Confident	86.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	162.6	-178.1	-67	0	0	0	0	112.5	P24 C50 G54 G74 N75 R77 F95 Y96	P24-V56 HydrophobicContact CB-CG1 4.07Å; C50-V56 HydrophobicContact CB-CG2 4.37Å; G54-V56 WeakPolarHBondContact O-CG1 3.03Å; G54-V56 PolarHBondContact O-N 3.02Å; G54-V56 VanDerWaalsContact O-N 3.16Å; V56-G74 PolarHBondContact N-O 2.93Å; V56-G74 VanDerWaalsContact N-O 3.11Å; V56-N75 WeakPolarHBondContact CG2-O 2.92Å; V56-R77 HydrophobicContact CG2-CB 4.31Å; V56-R77 HydrophobicContact CG2-CG 4.04Å; V56-R77 WeakPolarHBondContact O-CG 3.4Å; V56-R77 PolarHBondContact O-NE 3.24Å; V56-F95 CarbonylContact C-O 3.42Å; V56-F95 WeakPolarHBondContact CA-O 3.42Å; V56-Y96 HydrophobicContact CG1-CD1 3.55Å; V56-Y96 HydrophobicContact CG1-CE1 3.57Å; V56-Y96 HydrophobicContact CG1-CG 4.39Å
57	N	88.4	Confident	86.7	Confident	49 Å²	49	54.7 Å²	54.7	26%	0.262	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	158.1	170.6	-155.4	4.7	0	0	0	113.5	C94 F95 T97	N57-C94 WeakPolarHBondContact O-CA 2.99Å; N57-C94 PolarHBondContact O-SG 3.37Å; N57-C94 VanDerWaalsContact O-SG 3.34Å; N57-F95 HydrophobicContact CB-CE1 4.17Å; N57-F95 HydrophobicContact CB-CE2 4.36Å; N57-F95 HydrophobicContact CB-CZ 3.91Å; N57-F95 PolarHBondContact N-O 3.08Å; N57-F95 VanDerWaalsContact O-CD1 3.29Å; N57-F95 WeakPolarHBondContact O-CD1 3.41Å; N57-F95 PolarHBondContact O-N 3.46Å; N57-F95 VanDerWaalsContact O-N 3.13Å; N57-T97 HydrophobicContact CB-CG2 3.48Å; N57-T97 VanDerWaalsContact CB-CG2 3.48Å
58	W	89.5	Confident	86.5	Confident	7 Å²	7	57 Å²	57	3%	0.027	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.4	175.2	-80.1	109.7	0	0	0	111	I26 L48 C50 P60 V69 R77 L79 C94	I26-W58 HydrophobicContact CB-CH2 4.39Å; I26-W58 HydrophobicContact CD1-CH2 3.84Å; I26-W58 HydrophobicContact CD1-CZ3 4.12Å; I26-W58 HydrophobicContact CG1-CH2 3.83Å; I26-W58 HydrophobicContact CG2-CH2 3.72Å; I26-W58 HydrophobicContact CG2-CZ2 4.27Å; L48-W58 HydrophobicContact CB-CH2 4.17Å; L48-W58 HydrophobicContact CB-CZ2 3.73Å; C50-W58 HydrophobicContact CB-CD2 4.35Å; C50-W58 HydrophobicContact CB-CH2 4.38Å; C50-W58 HydrophobicContact CB-CZ2 3.63Å; W58-P60 WeakPolarHBondContact O-CD 3.26Å; W58-V69 HydrophobicContact CB-CG1 4.37Å; W58-V69 HydrophobicContact CB-CG2 4.12Å; W58-R77 PolarHBondContact NE1-O 3.21Å; W58-L79 HydrophobicContact CG-CB 4.5Å; W58-C94 HydrophobicContact CE3-CB 4.15Å; W58-C94 HydrophobicContact CH2-CB 4.34Å; W58-C94 HydrophobicContact CZ3-CB 4.05Å
59	Q	88.1	Confident	86.3	Confident	102 Å²	102	58 Å²	58	48%	0.477	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	94.1	159.8	-176.4	179.2	9.4	0	0	107.8	K93 F95	Q59-K93 HydrophobicContact CB-CB 4.23Å; Q59-K93 PolarHBondContact N-O 2.86Å; Q59-K93 PolarHBondContact O-N 3.43Å; Q59-F95 HydrophobicContact CB-CD1 4.18Å; Q59-F95 HydrophobicContact CB-CE1 3.87Å
60	P	86.8	Confident	86.1	Confident	13 Å²	13	56.3 Å²	56.3	8%	0.084	28%	0.281	C	S	.	.			trans	-74.1	159.5	175.7	32.9	-36.1	0	0	0	110.9	W58 L62 H65 R66 L79 Y92	W58-P60 WeakPolarHBondContact O-CD 3.26Å; P60-L62 PolarHBondContact O-N 2.88Å; P60-H65 HydrophobicContact CB-CB 3.79Å; P60-H65 HydrophobicContact CG-CB 4.3Å; P60-R66 HydrophobicContact CG-CG 3.62Å; P60-L79 HydrophobicContact CB-CD1 4.16Å; P60-Y92 HydrophobicContact CB-CD1 4.19Å; P60-Y92 HydrophobicContact CB-CE1 4.13Å
61	R	83.7	Confident	85.6	Confident	67 Å²	67	68.4 Å²	68.4	25%	0.253	33%	0.327	S	S	.	.	S	Bend	trans	-59.5	-46.3	-180	-175.8	179.1	69.9	82.3	-3.2	114	E87 T89 W121	R61-E87 PolarHBondContact NH2-O 3.14Å; R61-T89 PolarHBondContact NE-O 3.08Å; R61-W121 VanDerWaalsContact NH2-CE3 3.3Å
62	L	82.9	Confident	84.7	Confident	40 Å²	40	68.7 Å²	68.7	21%	0.209	34%	0.343	C	S	.	.	S	Bend	trans	-109.9	140	-179.8	-64.3	179.4	0	0	0	110.1	P60 K64 H65 W121	P60-L62 PolarHBondContact O-N 2.88Å; L62-K64 HydrophobicContact CB-CG 3.87Å; L62-K64 HydrophobicContact CD1-CD 4.48Å; L62-K64 HydrophobicContact CD1-CG 4.38Å; L62-K64 PolarHBondContact O-N 3.2Å; L62-H65 WeakPolarHBondContact O-CB 3.21Å; L62-H65 PolarHBondContact O-N 3.15Å; L62-W121 HydrophobicContact CD1-CH2 3.76Å; L62-W121 HydrophobicContact CD1-CZ2 4.06Å
63	A	83.2	Confident	84	Confident	82 Å²	82	74.2 Å²	74.2	68%	0.678	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-54.9	-39.2	177.2	0	0	0	0	0	112.1	H65 R66	A63-H65 PolarHBondContact O-N 2.87Å; A63-H65 VanDerWaalsContact O-N 3.14Å; A63-R66 WeakPolarHBondContact O-CB 3.34Å; A63-R66 WeakPolarHBondContact O-CG 3.31Å; A63-R66 PolarHBondContact O-N 2.83Å; A63-R66 VanDerWaalsContact O-N 3.08Å
64	K	84.6	Confident	83.9	Confident	96 Å²	96	69.5 Å²	69.5	42%	0.417	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59.4	-23.9	175.5	59.3	160.1	177.5	173.8	0	114	L62 R66 R67 E87	L62-K64 HydrophobicContact CB-CG 3.87Å; L62-K64 HydrophobicContact CD1-CD 4.48Å; L62-K64 HydrophobicContact CD1-CG 4.38Å; L62-K64 PolarHBondContact O-N 3.2Å; K64-R66 VanDerWaalsContact C-N 3.26Å; K64-R66 PolarHBondContact O-N 3.23Å; K64-R67 WeakPolarHBondContact O-CD 3.21Å; K64-R67 VanDerWaalsContact O-CG 3.26Å; K64-R67 WeakPolarHBondContact O-CG 3.4Å; K64-E87 IonicContact NZ-OE2 2.88Å; K64-E87 PolarHBondContact NZ-OE2 2.87Å
65	H	87.6	Confident	84.1	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-76.9	-12.9	179.7	-64.1	177.3	0	0	0	112.8	P60 L62 A63 R67 Y68 E87 F88	P60-H65 HydrophobicContact CB-CB 3.79Å; P60-H65 HydrophobicContact CG-CB 4.3Å; L62-H65 WeakPolarHBondContact O-CB 3.21Å; L62-H65 PolarHBondContact O-N 3.15Å; A63-H65 PolarHBondContact O-N 2.87Å; A63-H65 VanDerWaalsContact O-N 3.14Å; H65-R67 PolarHBondContact O-N 3.13Å; H65-R67 VanDerWaalsContact O-N 3.12Å; H65-Y68 HydrophobicContact CB-CD2 4.46Å; H65-Y68 PolarHBondContact O-N 3.34Å; H65-E87 PolarHBondContact CE1-O 2.8Å; H65-F88 AromaticContact CD2-CE1 3.93Å; H65-F88 AromaticContact CE1-CD1 3.82Å; H65-F88 AromaticContact ND1-CD1 3.93Å; H65-F88 AromaticContact NE2-CE1 3.99Å
66	R	85.6	Confident	84.2	Confident	175 Å²	175	73.9 Å²	73.9	66%	0.66	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-57.8	-25.8	174.2	-69.9	-176.7	177.3	-173.3	-0.2	112.8	P60 A63 K64 Y68 V69	P60-R66 HydrophobicContact CG-CG 3.62Å; A63-R66 WeakPolarHBondContact O-CB 3.34Å; A63-R66 WeakPolarHBondContact O-CG 3.31Å; A63-R66 PolarHBondContact O-N 2.83Å; A63-R66 VanDerWaalsContact O-N 3.08Å; K64-R66 VanDerWaalsContact C-N 3.26Å; K64-R66 PolarHBondContact O-N 3.23Å; R66-Y68 PolarHBondContact O-N 3.27Å; R66-V69 WeakPolarHBondContact O-CB 3.4Å; R66-V69 PolarHBondContact O-N 2.79Å; R66-V69 VanDerWaalsContact O-N 3.08Å
67	R	86.3	Confident	84.4	Confident	173 Å²	173	74.6 Å²	74.6	65%	0.653	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-62.9	-22.6	176.6	77.4	-170	179.6	-175.3	-2.3	114.2	K64 H65 V69	K64-R67 WeakPolarHBondContact O-CD 3.21Å; K64-R67 VanDerWaalsContact O-CG 3.26Å; K64-R67 WeakPolarHBondContact O-CG 3.4Å; H65-R67 PolarHBondContact O-N 3.13Å; H65-R67 VanDerWaalsContact O-N 3.12Å; R67-V69 VanDerWaalsContact C-N 3.35Å
68	Y	86.7	Confident	84.4	Confident	64 Å²	64	73.8 Å²	73.8	25%	0.251	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-89.4	-4.2	178.4	-60.7	-75.6	0	0	0	112.8	H65 R66 L79 K80 V81 F88	H65-Y68 HydrophobicContact CB-CD2 4.46Å; H65-Y68 PolarHBondContact O-N 3.34Å; R66-Y68 PolarHBondContact O-N 3.27Å; Y68-L79 WeakPolarHBondContact O-CA 3.49Å; Y68-K80 PolarHBondContact O-N 2.81Å; Y68-V81 HydrophobicContact CD1-CG2 4.02Å; Y68-V81 HydrophobicContact CD2-CG2 4.41Å; Y68-V81 HydrophobicContact CG-CG2 3.96Å; Y68-F88 AromaticContact CD2-CE1 3.86Å; Y68-F88 HydrophobicContact CD2-CE1 3.86Å; Y68-F88 HydrophobicContact CD2-CZ 4.21Å; Y68-F88 AromaticContact CE2-CE1 3.72Å; Y68-F88 HydrophobicContact CE2-CE1 3.72Å; Y68-F88 AromaticContact CE2-CZ 3.63Å; Y68-F88 HydrophobicContact CE2-CZ 3.63Å; Y68-F88 AromaticContact CZ-CZ 3.84Å
69	V	88	Confident	84.5	Confident	21 Å²	21	73.5 Å²	73.5	13%	0.127	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-85.6	132.2	177	-175.7	0	0	0	0	109.3	W58 R66 R67 R71 V78 L79	W58-V69 HydrophobicContact CB-CG1 4.37Å; W58-V69 HydrophobicContact CB-CG2 4.12Å; R66-V69 WeakPolarHBondContact O-CB 3.4Å; R66-V69 PolarHBondContact O-N 2.79Å; R66-V69 VanDerWaalsContact O-N 3.08Å; R67-V69 VanDerWaalsContact C-N 3.35Å; V69-R71 PolarHBondContact O-N 2.83Å; V69-V78 CarbonylContact C-O 3.56Å; V69-V78 WeakPolarHBondContact CA-O 3.25Å; V69-L79 HydrophobicContact CG2-CB 4.27Å; V69-L79 HydrophobicContact CG2-CD1 3.97Å; V69-L79 HydrophobicContact CG2-CG 4.2Å
70	S	86.9	Confident	84.6	Confident	47 Å²	47	74.5 Å²	74.5	33%	0.329	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-56.9	129.8	178	58.9	0	0	0	0	111.9	R77 V78	S70-R77 PolarHBondContact O-NH1 3.01Å; S70-V78 PolarHBondContact N-O 1.96Å; S70-V78 PolarHBondContact OG-N 3.02Å; S70-V78 VanDerWaalsContact OG-N 3.08Å; S70-V78 PolarHBondContact OG-O 3.17Å
71	R	78.7	Confident	84.8	Confident	254 Å²	254	74.1 Å²	74.1	96%	0.958	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-71.1	148.5	173	-62.1	-176.3	-179.5	-173.7	0.2	110.7	V69	V69-R71 PolarHBondContact O-N 2.83Å
72	G	71.9	Confident	85	Confident	57 Å²	57	78.7 Å²	78.7	59%	0.588	39%	0.392	S	S	*	.	S	Bend	trans	138	-167.7	-177.3	0	0	0	0	0	112.2	R77	G72-R77 PolarHBondContact O-NH1 2.9Å; G72-R77 PolarHBondContact O-NH2 2.68Å
73	N	70.2	Confident	85.3	Confident	129 Å²	129	86.7 Å²	86.7	69%	0.69	42%	0.42	S	S	*	.			trans	-147.4	130.7	161.3	-131.2	18.9	0	0	0	107.4	R77	N73-R77 PolarHBondContact OD1-NH2 2.74Å
74	G	80.4	Confident	85.7	Confident	22 Å²	22	83 Å²	83	23%	0.227	39%	0.389	C	S	.	.	S	Bend	trans	173.4	178.6	-174	0	0	0	0	0	113.4	P55 V56 V76	P55-G74 WeakPolarHBondContact CA-O 3.38Å; V56-G74 PolarHBondContact N-O 2.93Å; V56-G74 VanDerWaalsContact N-O 3.11Å; G74-V76 PolarHBondContact O-N 3.43Å
75	N	84.6	Confident	86	Confident	78 Å²	78	80 Å²	80	42%	0.417	38%	0.38	S	S	.	.	S	Bend	trans	-73.9	-9.1	-173.8	-69.6	19.2	0	0	0	113.8	E51 G52 D53 G54 V56	E51-N75 WeakPolarHBondContact CA-O 3.29Å; G52-N75 PolarHBondContact N-O 3.33Å; G52-N75 WeakPolarHBondContact O-CB 3.47Å; D53-N75 PolarHBondContact O-ND2 2.94Å; G54-N75 VanDerWaalsContact C-OD1 3.27Å; V56-N75 WeakPolarHBondContact CG2-O 2.92Å
76	V	87.3	Confident	86	Confident	74 Å²	74	80 Å²	80	45%	0.448	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.8	177.2	-176.2	0	0	0	0	110.4	C50 E51 G74 V78	C50-V76 CarbonylContact O-C 3.5Å; C50-V76 VanDerWaalsContact O-CA 3.28Å; C50-V76 WeakPolarHBondContact O-CA 3.46Å; E51-V76 HydrophobicContact CB-CG2 4.41Å; E51-V76 HydrophobicContact CG-CB 4.46Å; E51-V76 HydrophobicContact CG-CG1 3.99Å; E51-V76 HydrophobicContact CG-CG2 3.92Å; G74-V76 PolarHBondContact O-N 3.43Å; V76-V78 HydrophobicContact CG1-CG2 4.34Å
77	R	90.2	Very high	86.2	Confident	16 Å²	16	73.7 Å²	73.7	6%	0.06	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	135	173	-70.2	-63.4	-160.9	159.1	6	111.9	R49 C50 V56 W58 S70 G72 N73	R49-R77 WeakPolarHBondContact CA-O 3.37Å; C50-R77 PolarHBondContact N-O 3.05Å; C50-R77 PolarHBondContact O-N 3.02Å; V56-R77 HydrophobicContact CG2-CB 4.31Å; V56-R77 HydrophobicContact CG2-CG 4.04Å; V56-R77 WeakPolarHBondContact O-CG 3.4Å; V56-R77 PolarHBondContact O-NE 3.24Å; W58-R77 PolarHBondContact NE1-O 3.21Å; S70-R77 PolarHBondContact O-NH1 3.01Å; G72-R77 PolarHBondContact O-NH1 2.9Å; G72-R77 PolarHBondContact O-NH2 2.68Å; N73-R77 PolarHBondContact OD1-NH2 2.74Å
78	V	90.1	Very high	86.4	Confident	32 Å²	32	65.6 Å²	65.6	19%	0.194	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.8	-175.9	-175.3	0	0	0	0	110.1	D47 L48 R49 V69 S70 V76 K80	D47-V78 VanDerWaalsContact OD1-CG1 3.25Å; D47-V78 WeakPolarHBondContact OD1-CG1 3.35Å; L48-V78 CarbonylContact O-C 3.55Å; L48-V78 WeakPolarHBondContact O-CA 3.16Å; R49-V78 HydrophobicContact CB-CG2 4.48Å; R49-V78 HydrophobicContact CG-CG1 4.25Å; R49-V78 HydrophobicContact CG-CG2 3.99Å; V69-V78 CarbonylContact C-O 3.56Å; V69-V78 WeakPolarHBondContact CA-O 3.25Å; S70-V78 PolarHBondContact N-O 1.96Å; S70-V78 PolarHBondContact OG-N 3.02Å; S70-V78 VanDerWaalsContact OG-N 3.08Å; S70-V78 PolarHBondContact OG-O 3.17Å; V76-V78 HydrophobicContact CG1-CG2 4.34Å; V78-K80 HydrophobicContact CG1-CB 4.2Å
79	L	90.8	Very high	86.6	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	111.9	164.2	-175.8	159.5	0	0	0	107.4	L48 W58 P60 Y68 V69 V81 Y92	L48-L79 HydrophobicContact CB-CB 4.28Å; L48-L79 HydrophobicContact CD1-CD2 4.37Å; L48-L79 PolarHBondContact N-O 2.67Å; L48-L79 PolarHBondContact O-N 3.03Å; W58-L79 HydrophobicContact CG-CB 4.5Å; P60-L79 HydrophobicContact CB-CD1 4.16Å; Y68-L79 WeakPolarHBondContact O-CA 3.49Å; V69-L79 HydrophobicContact CG2-CB 4.27Å; V69-L79 HydrophobicContact CG2-CD1 3.97Å; V69-L79 HydrophobicContact CG2-CG 4.2Å; L79-V81 HydrophobicContact CD2-CG2 3.91Å; L79-Y92 HydrophobicContact CD1-CD1 3.88Å; L79-Y92 HydrophobicContact CD1-CE1 3.73Å
80	K	90.2	Very high	86.7	Confident	124 Å²	124	61.5 Å²	61.5	54%	0.539	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	126.6	-175.7	-168	175	-179	-177.4	0	111.6	L46 Y68 V78	L46-K80 CarbonylContact O-C 3.43Å; L46-K80 WeakPolarHBondContact O-CA 2.97Å; Y68-K80 PolarHBondContact O-N 2.81Å; V78-K80 HydrophobicContact CG1-CB 4.2Å
81	V	91.1	Very high	86.9	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.03	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.3	175.6	-175	0	0	0	0	108.2	P45 L46 Y68 L79 F88	P45-V81 CarbonylContact C-O 3.55Å; P45-V81 WeakPolarHBondContact CA-O 3.31Å; L46-V81 HydrophobicContact CB-CB 4.29Å; L46-V81 PolarHBondContact N-O 3.04Å; L46-V81 PolarHBondContact O-N 2.98Å; Y68-V81 HydrophobicContact CD1-CG2 4.02Å; Y68-V81 HydrophobicContact CD2-CG2 4.41Å; Y68-V81 HydrophobicContact CG-CG2 3.96Å; L79-V81 HydrophobicContact CD2-CG2 3.91Å; V81-F88 HydrophobicContact CB-CE1 4.48Å; V81-F88 HydrophobicContact CB-CZ 4.46Å; V81-F88 HydrophobicContact CG1-CD2 4.33Å; V81-F88 HydrophobicContact CG1-CE1 4.16Å; V81-F88 HydrophobicContact CG1-CE2 3.77Å; V81-F88 HydrophobicContact CG1-CZ 3.67Å; V81-F88 HydrophobicContact CG2-CD1 3.89Å; V81-F88 HydrophobicContact CG2-CE1 3.51Å; V81-F88 HydrophobicContact CG2-CZ 3.9Å
82	E	87.2	Confident	87.4	Confident	162 Å²	162	49.3 Å²	49.3	76%	0.757	26%	0.261	S	S	*	.	S	Bend	trans	-72	-40.3	-177.1	-63.7	-174.8	166.6	0	0	112.9	P45	P45-E82 VanDerWaalsContact CA-O 3.31Å; P45-E82 WeakPolarHBondContact CA-O 3.13Å
83	R	90.1	Very high	88.3	Confident	209 Å²	209	51 Å²	51	79%	0.789	25%	0.252	S	S	*	.	S	Bend	trans	-128.9	97	176.7	-76	-176.8	143.8	-174.5	-4.8	109.7
84	S	90.4	Very high	89.2	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.021	22%	0.22	C	C	.	.			trans	-72.8	135.2	177.2	58.5	0	0	0	0	111.3	A42 G43 R44	A42-S84 CarbonylContact C-O 3.6Å; A42-S84 WeakPolarHBondContact CA-O 3.29Å; G43-S84 PolarHBondContact N-O 3.44Å; R44-S84 WeakPolarHBondContact O-CB 3.31Å; R44-S84 PolarHBondContact O-N 2.72Å; R44-S84 PolarHBondContact O-OG 3.21Å
85	S	90.9	Very high	89.5	Confident	35 Å²	35	46.5 Å²	46.5	25%	0.245	22%	0.221	C	C	.	.			trans	-109.8	170.5	169.7	80.8	0	0	0	0	110.2	E87 F88 V113	S85-E87 PolarHBondContact O-N 2.71Å; S85-E87 WeakPolarHBondContact OG-CG 3.44Å; S85-E87 PolarHBondContact OG-N 3.44Å; S85-E87 PolarHBondContact OG-OE1 3.01Å; S85-F88 PolarHBondContact O-N 3.19Å; S85-V113 WeakPolarHBondContact O-CG1 3.49Å
86	A	89.2	Confident	89.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-49.3	-22.6	174	0	0	0	0	0	114.2	F88 T89 D115 R118 W121 T144	A86-F88 VanDerWaalsContact C-N 3.26Å; A86-F88 PolarHBondContact O-N 2.9Å; A86-T89 VanDerWaalsContact O-CB 3.25Å; A86-T89 WeakPolarHBondContact O-CB 3.16Å; A86-T89 PolarHBondContact O-N 3.38Å; A86-T89 PolarHBondContact O-OG1 3.48Å; A86-T89 VanDerWaalsContact O-OG1 3.05Å; A86-D115 HydrophobicContact CB-CB 4.08Å; A86-R118 HydrophobicContact CB-CB 4.2Å; A86-W121 HydrophobicContact CB-CB 4.42Å; A86-T144 HydrophobicContact CB-CG2 3.86Å
87	E	89.1	Confident	89.1	Confident	43 Å²	43	43.8 Å²	43.8	20%	0.201	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-66.3	-24.6	178.3	86.5	-167.6	127.4	0	0	114.6	R61 K64 H65 S85 T89 W121	R61-E87 PolarHBondContact NH2-O 3.14Å; K64-E87 IonicContact NZ-OE2 2.88Å; K64-E87 PolarHBondContact NZ-OE2 2.87Å; H65-E87 PolarHBondContact CE1-O 2.8Å; S85-E87 PolarHBondContact O-N 2.71Å; S85-E87 WeakPolarHBondContact OG-CG 3.44Å; S85-E87 PolarHBondContact OG-N 3.44Å; S85-E87 PolarHBondContact OG-OE1 3.01Å; E87-T89 PolarHBondContact O-N 2.86Å; E87-W121 HydrophobicContact CB-CD2 4.5Å; E87-W121 HydrophobicContact CB-CZ2 4Å
88	F	90.4	Very high	87.9	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.009	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-81.5	-2.3	179.2	-67.4	-83.4	0	0	0	112.5	L46 H65 Y68 V81 S85 A86 Y92 V113	L46-F88 HydrophobicContact CD2-CB 4.17Å; H65-F88 AromaticContact CD2-CE1 3.93Å; H65-F88 AromaticContact CE1-CD1 3.82Å; H65-F88 AromaticContact ND1-CD1 3.93Å; H65-F88 AromaticContact NE2-CE1 3.99Å; Y68-F88 AromaticContact CD2-CE1 3.86Å; Y68-F88 HydrophobicContact CD2-CE1 3.86Å; Y68-F88 HydrophobicContact CD2-CZ 4.21Å; Y68-F88 AromaticContact CE2-CE1 3.72Å; Y68-F88 HydrophobicContact CE2-CE1 3.72Å; Y68-F88 AromaticContact CE2-CZ 3.63Å; Y68-F88 HydrophobicContact CE2-CZ 3.63Å; Y68-F88 AromaticContact CZ-CZ 3.84Å; V81-F88 HydrophobicContact CB-CE1 4.48Å; V81-F88 HydrophobicContact CB-CZ 4.46Å; V81-F88 HydrophobicContact CG1-CD2 4.33Å; V81-F88 HydrophobicContact CG1-CE1 4.16Å; V81-F88 HydrophobicContact CG1-CE2 3.77Å; V81-F88 HydrophobicContact CG1-CZ 3.67Å; V81-F88 HydrophobicContact CG2-CD1 3.89Å; V81-F88 HydrophobicContact CG2-CE1 3.51Å; V81-F88 HydrophobicContact CG2-CZ 3.9Å; S85-F88 PolarHBondContact O-N 3.19Å; A86-F88 VanDerWaalsContact C-N 3.26Å; A86-F88 PolarHBondContact O-N 2.9Å; F88-Y92 VanDerWaalsContact O-CE2 3.29Å; F88-Y92 WeakPolarHBondContact O-CE2 3.32Å; F88-Y92 PolarHBondContact O-OH 2.84Å; F88-V113 HydrophobicContact CB-CG2 3.96Å
89	T	91.3	Very high	86.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.243	C	C	.	.			trans	-60.9	135.3	170.6	-61	0	0	0	0	111	R61 A86 E87 V111 Y112 V113 L142 L143	R61-T89 PolarHBondContact NE-O 3.08Å; A86-T89 VanDerWaalsContact O-CB 3.25Å; A86-T89 WeakPolarHBondContact O-CB 3.16Å; A86-T89 PolarHBondContact O-N 3.38Å; A86-T89 PolarHBondContact O-OG1 3.48Å; A86-T89 VanDerWaalsContact O-OG1 3.05Å; E87-T89 PolarHBondContact O-N 2.86Å; T89-V111 CarbonylContact C-O 3.54Å; T89-V111 WeakPolarHBondContact CA-O 3.34Å; T89-Y112 HydrophobicContact CG2-CD1 4.34Å; T89-V113 PolarHBondContact OG1-N 2.91Å; T89-L142 HydrophobicContact CG2-CB 4.4Å; T89-L143 VanDerWaalsContact CG2-O 3.27Å; T89-L143 WeakPolarHBondContact CG2-O 3.41Å
90	G	90.6	Very high	84.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	140	-177.4	174.5	0	0	0	0	0	115.4	Y92 H110 V111	G90-Y92 VanDerWaalsContact O-CD2 3.29Å; G90-Y92 WeakPolarHBondContact O-CD2 3.29Å; G90-Y92 WeakPolarHBondContact O-CE2 3.44Å; G90-H110 VanDerWaalsContact CA-CE1 3.44Å; G90-H110 WeakPolarHBondContact CA-CE1 3.47Å; G90-V111 PolarHBondContact N-O 3.42Å; G90-V111 PolarHBondContact O-N 2.78Å
91	T	90.2	Very high	82.6	Confident	44 Å²	44	55 Å²	55	27%	0.27	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.7	-178.1	-46.5	0	0	0	0	112	H110	T91-H110 PolarHBondContact N-ND1 2.56Å; T91-H110 PolarHBondContact OG1-ND1 3.02Å
92	Y	90.3	Very high	80.8	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.9	172.8	-64.9	-99.6	0	0	0	108.8	L48 P60 L79 F88 G90 S108 L109 V111	L48-Y92 HydrophobicContact CD1-CD1 4Å; L48-Y92 HydrophobicContact CD1-CD2 4.04Å; L48-Y92 HydrophobicContact CD1-CE1 4.38Å; L48-Y92 HydrophobicContact CD1-CE2 4.43Å; L48-Y92 HydrophobicContact CD1-CG 3.83Å; P60-Y92 HydrophobicContact CB-CD1 4.19Å; P60-Y92 HydrophobicContact CB-CE1 4.13Å; L79-Y92 HydrophobicContact CD1-CD1 3.88Å; L79-Y92 HydrophobicContact CD1-CE1 3.73Å; F88-Y92 VanDerWaalsContact O-CE2 3.29Å; F88-Y92 WeakPolarHBondContact O-CE2 3.32Å; F88-Y92 PolarHBondContact O-OH 2.84Å; G90-Y92 VanDerWaalsContact O-CD2 3.29Å; G90-Y92 WeakPolarHBondContact O-CD2 3.29Å; G90-Y92 WeakPolarHBondContact O-CE2 3.44Å; Y92-S108 WeakPolarHBondContact O-CA 3.44Å; Y92-L109 PolarHBondContact N-O 3.34Å; Y92-L109 PolarHBondContact O-N 2.66Å; Y92-V111 HydrophobicContact CD2-CB 4.2Å; Y92-V111 HydrophobicContact CD2-CG2 3.72Å; Y92-V111 HydrophobicContact CE2-CB 4Å; Y92-V111 HydrophobicContact CE2-CG2 3.95Å
93	K	90.1	Very high	79.1	Confident	93 Å²	93	55.9 Å²	55.9	40%	0.404	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.6	178.8	-59.8	-176.9	177.6	-175.1	0	110	Q59 S107	Q59-K93 HydrophobicContact CB-CB 4.23Å; Q59-K93 PolarHBondContact N-O 2.86Å; Q59-K93 PolarHBondContact O-N 3.43Å; K93-S107 CarbonylContact C-O 3.57Å; K93-S107 WeakPolarHBondContact CA-O 3.36Å
94	C	88.9	Confident	77.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137.2	167.7	-170.2	0	0	0	0	111.3	P24 I26 C50 N57 W58 T106 S107	P24-C94 HydrophobicContact CG-CB 4.38Å; I26-C94 HydrophobicContact CD1-CB 4.43Å; I26-C94 HydrophobicContact CG1-CB 4.36Å; C50-C94 HydrophobicContact CB-CB 3.63Å; C50-C94 WeakPolarHBondContact CB-SG 3.4Å; C50-C94 WeakPolarHBondContact SG-CB 3.47Å; C50-C94 CovalentContact SG-SG 1.96Å; C50-C94 PolarHBondContact SG-SG 2.87Å; N57-C94 WeakPolarHBondContact O-CA 2.99Å; N57-C94 PolarHBondContact O-SG 3.37Å; N57-C94 VanDerWaalsContact O-SG 3.34Å; W58-C94 HydrophobicContact CE3-CB 4.15Å; W58-C94 HydrophobicContact CH2-CB 4.34Å; W58-C94 HydrophobicContact CZ3-CB 4.05Å; C94-T106 WeakPolarHBondContact O-CA 3.04Å; C94-S107 PolarHBondContact N-O 2.96Å; C94-S107 PolarHBondContact O-N 3.23Å
95	F	87.4	Confident	76.5	Confident	57 Å²	57	54.5 Å²	54.5	25%	0.25	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	157.1	-175.2	66.3	-83.4	0	0	0	111.6	V56 N57 Q59 T97 T106	V56-F95 CarbonylContact C-O 3.42Å; V56-F95 WeakPolarHBondContact CA-O 3.42Å; N57-F95 HydrophobicContact CB-CE1 4.17Å; N57-F95 HydrophobicContact CB-CE2 4.36Å; N57-F95 HydrophobicContact CB-CZ 3.91Å; N57-F95 PolarHBondContact N-O 3.08Å; N57-F95 VanDerWaalsContact O-CD1 3.29Å; N57-F95 WeakPolarHBondContact O-CD1 3.41Å; N57-F95 PolarHBondContact O-N 3.46Å; N57-F95 VanDerWaalsContact O-N 3.13Å; Q59-F95 HydrophobicContact CB-CD1 4.18Å; Q59-F95 HydrophobicContact CB-CE1 3.87Å; F95-T97 HydrophobicContact CE2-CG2 4.13Å; F95-T106 HydrophobicContact CB-CG2 3.76Å
96	Y	85.7	Confident	76	Confident	40 Å²	40	55.1 Å²	55.1	16%	0.157	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	137.4	172.5	-70.6	-69.9	0	0	0	111.4	W22 P24 G52 D53 V56	W22-Y96 PolarHBondContact O-OH 3Å; W22-Y96 VanDerWaalsContact O-OH 3.05Å; P24-Y96 HydrophobicContact CB-CE2 4.49Å; P24-Y96 HydrophobicContact CG-CE2 4.37Å; G52-Y96 WeakPolarHBondContact CA-OH 3.41Å; D53-Y96 PolarHBondContact N-OH 2.79Å; D53-Y96 VanDerWaalsContact N-OH 3.16Å; V56-Y96 HydrophobicContact CG1-CD1 3.55Å; V56-Y96 HydrophobicContact CG1-CE1 3.57Å; V56-Y96 HydrophobicContact CG1-CG 4.39Å
97	T	76	Confident	75.9	Confident	55 Å²	55	56.2 Å²	56.2	34%	0.337	31%	0.312	S	S	.	.	S	Bend	trans	-91.1	-19.4	-176.3	53.2	0	0	0	0	114.3	P55 N57 F95	P55-T97 WeakPolarHBondContact CB-OG1 3.27Å; P55-T97 PolarHBondContact O-N 3.47Å; P55-T97 PolarHBondContact O-OG1 2.93Å; N57-T97 HydrophobicContact CB-CG2 3.48Å; N57-T97 VanDerWaalsContact CB-CG2 3.48Å; F95-T97 HydrophobicContact CE2-CG2 4.13Å
98	A	64.9	Low	75.9	Confident	70 Å²	70	57.4 Å²	57.4	58%	0.579	33%	0.325	S	S	*	.	S	Bend	trans	-87.7	-12.5	-164.6	0	0	0	0	0	115.7
99	K	57.8	Low	76	Confident	119 Å²	119	57.5 Å²	57.5	52%	0.517	33%	0.325	S	S	.	.			trans	-151.4	119.2	-177.6	-69.3	-177.1	-175.4	170.3	0	113	S101 F102	K99-S101 VanDerWaalsContact C-N 3.26Å; K99-S101 PolarHBondContact O-N 2.91Å; K99-F102 HydrophobicContact CB-CD2 3.77Å; K99-F102 HydrophobicContact CB-CE2 4.4Å; K99-F102 HydrophobicContact CD-CD2 4.07Å; K99-F102 HydrophobicContact CD-CE2 3.84Å; K99-F102 PolarHBondContact O-N 2.87Å
100	P	52.6	Low	76	Confident	118 Å²	118	57.7 Å²	57.7	77%	0.766	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-70.8	-14.3	-179.1	24.9	-30.8	0	0	0	114.7	F102	P100-F102 PolarHBondContact O-N 2.78Å
101	S	49.9	Very low	76	Confident	100 Å²	100	57.7 Å²	57.7	70%	0.699	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-70.7	-10.7	173.8	47.7	0	0	0	0	114.1	K99	K99-S101 VanDerWaalsContact C-N 3.26Å; K99-S101 PolarHBondContact O-N 2.91Å
102	F	52.8	Low	76.1	Confident	69 Å²	69	55.7 Å²	55.7	30%	0.303	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-106.4	22.5	-177.8	-74.8	-81.2	0	0	0	114.6	E21 K99 P100 N104 L105	E21-F102 WeakPolarHBondContact OE2-CE1 3.35Å; E21-F102 WeakPolarHBondContact OE2-CZ 3.49Å; K99-F102 HydrophobicContact CB-CD2 3.77Å; K99-F102 HydrophobicContact CB-CE2 4.4Å; K99-F102 HydrophobicContact CD-CD2 4.07Å; K99-F102 HydrophobicContact CD-CE2 3.84Å; K99-F102 PolarHBondContact O-N 2.87Å; P100-F102 PolarHBondContact O-N 2.78Å; F102-N104 PolarHBondContact O-N 2.9Å; F102-L105 HydrophobicContact CD1-CD1 3.59Å; F102-L105 HydrophobicContact CD1-CG 4.29Å; F102-L105 HydrophobicContact CE1-CD1 4.04Å; F102-L105 PolarHBondContact O-N 3.15Å
103	N	51.7	Low	76.3	Confident	116 Å²	116	55.7 Å²	55.7	62%	0.62	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-12.7	174	-86.2	-12.9	0	0	0	114.2
104	N	54.7	Low	76.3	Confident	146 Å²	146	54.7 Å²	54.7	78%	0.781	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-11.7	176.3	-72	-9.7	0	0	0	114.3	F102	F102-N104 PolarHBondContact O-N 2.9Å
105	L	71.6	Confident	76.3	Confident	37 Å²	37	56 Å²	56	19%	0.194	32%	0.317	C	S	.	.			trans	-102.6	52.4	178.6	-64.6	179.2	0	0	0	111.9	E21 K23 P24 F102	E21-L105 HydrophobicContact CB-CD1 4.26Å; K23-L105 HydrophobicContact CG-CB 4.35Å; K23-L105 HydrophobicContact CG-CD2 3.81Å; P24-L105 WeakPolarHBondContact CD-O 3.46Å; F102-L105 HydrophobicContact CD1-CD1 3.59Å; F102-L105 HydrophobicContact CD1-CG 4.29Å; F102-L105 HydrophobicContact CE1-CD1 4.04Å; F102-L105 PolarHBondContact O-N 3.15Å
106	T	81.6	Confident	76.1	Confident	49 Å²	49	58.3 Å²	58.3	30%	0.301	34%	0.337	S	S	.	.			trans	-96.9	139.1	171.5	64.9	0	0	0	0	111.3	C94 F95	C94-T106 WeakPolarHBondContact O-CA 3.04Å; F95-T106 HydrophobicContact CB-CG2 3.76Å
107	S	86.9	Confident	76	Confident	23 Å²	23	64.6 Å²	64.6	16%	0.161	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136.6	167	-69.5	0	0	0	0	109.7	K23 P24 K93 C94	K23-S107 WeakPolarHBondContact CB-OG 3.44Å; P24-S107 WeakPolarHBondContact O-CB 3.46Å; P24-S107 PolarHBondContact O-OG 2.88Å; K93-S107 CarbonylContact C-O 3.57Å; K93-S107 WeakPolarHBondContact CA-O 3.36Å; C94-S107 PolarHBondContact N-O 2.96Å; C94-S107 PolarHBondContact O-N 3.23Å
108	S	89.4	Confident	76.5	Confident	68 Å²	68	68.9 Å²	68.9	48%	0.476	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.4	178.5	57.8	0	0	0	0	110.4	Y92	Y92-S108 WeakPolarHBondContact O-CA 3.44Å
109	L	90.8	Very high	77.6	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.016	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126.4	175.1	176.2	68.6	0	0	0	108.8	I26 V28 V33 V38 L48 Y92 V111	I26-L109 HydrophobicContact CD1-CB 3.83Å; I26-L109 HydrophobicContact CG2-CB 4.2Å; I26-L109 HydrophobicContact CG2-CD2 3.63Å; V28-L109 HydrophobicContact CG2-CD2 3.4Å; V28-L109 VanDerWaalsContact CG2-CD2 3.4Å; V33-L109 HydrophobicContact CG1-CD1 3.99Å; V38-L109 HydrophobicContact CB-CD1 4.35Å; V38-L109 HydrophobicContact CG1-CD1 4.28Å; V38-L109 HydrophobicContact CG1-CD2 3.96Å; V38-L109 HydrophobicContact CG1-CG 4.24Å; L48-L109 HydrophobicContact CD2-CD2 4.12Å; Y92-L109 PolarHBondContact N-O 3.34Å; Y92-L109 PolarHBondContact O-N 2.66Å; L109-V111 HydrophobicContact CD2-CG2 4.22Å; L109-V111 HydrophobicContact CG-CG2 4.3Å
110	H	91.2	Very high	79.2	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.019	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	125.4	169.5	-162.4	90.8	0	0	0	110.4	P36 E37 V38 G90 T91 Y112 H172	P36-H110 PolarHBondContact O-N 3.29Å; E37-H110 CarbonylContact C-O 3.56Å; E37-H110 VanDerWaalsContact CA-O 3.27Å; E37-H110 WeakPolarHBondContact CA-O 3.41Å; E37-H110 HydrophobicContact CG-CB 4.21Å; V38-H110 PolarHBondContact N-O 3.33Å; G90-H110 VanDerWaalsContact CA-CE1 3.44Å; G90-H110 WeakPolarHBondContact CA-CE1 3.47Å; T91-H110 PolarHBondContact N-ND1 2.56Å; T91-H110 PolarHBondContact OG1-ND1 3.02Å; H110-Y112 AromaticContact CD2-CD2 3.79Å; H110-Y112 AromaticContact CD2-CE1 3.75Å; H110-Y112 AromaticContact CD2-CE2 3.46Å; H110-Y112 VanDerWaalsContact CD2-CE2 3.46Å; H110-Y112 WeakPolarHBondContact CD2-CE2 3.44Å; H110-Y112 AromaticContact CD2-CZ 3.45Å; H110-Y112 VanDerWaalsContact CD2-CZ 3.45Å; H110-Y112 AromaticContact NE2-CE1 3.61Å; H110-Y112 AromaticContact NE2-CZ 3.73Å; H110-H172 AromaticContact CD2-CD2 3.8Å; H110-H172 VanDerWaalsContact CE1-CA 3.47Å; H110-H172 WeakPolarHBondContact CE1-CA 3.28Å; H110-H172 AromaticContact CE1-CD2 3.77Å; H110-H172 AromaticContact CE1-CG 3.9Å; H110-H172 PolarHBondContact CE1-O 2.7Å; H110-H172 AromaticContact CG-CD2 3.58Å; H110-H172 AromaticContact CG-CG 3.97Å; H110-H172 AromaticContact ND1-CD2 3.58Å; H110-H172 AromaticContact ND1-CG 3.57Å; H110-H172 AromaticContact NE2-CD2 3.95Å
111	V	92.1	Very high	80.9	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.6	179.1	-178.9	0	0	0	0	108.4	V38 V40 L46 L48 T89 G90 Y92 L109 V113	V38-V111 HydrophobicContact CG1-CB 4.16Å; V38-V111 HydrophobicContact CG1-CG1 4.11Å; V38-V111 HydrophobicContact CG1-CG2 3.78Å; V40-V111 HydrophobicContact CG2-CG1 4.46Å; L46-V111 HydrophobicContact CD1-CG1 3.88Å; L46-V111 HydrophobicContact CD2-CG1 4.22Å; L48-V111 HydrophobicContact CD1-CG2 4.13Å; L48-V111 HydrophobicContact CD2-CG2 4.19Å; T89-V111 CarbonylContact C-O 3.54Å; T89-V111 WeakPolarHBondContact CA-O 3.34Å; G90-V111 PolarHBondContact N-O 3.42Å; G90-V111 PolarHBondContact O-N 2.78Å; Y92-V111 HydrophobicContact CD2-CB 4.2Å; Y92-V111 HydrophobicContact CD2-CG2 3.72Å; Y92-V111 HydrophobicContact CE2-CB 4Å; Y92-V111 HydrophobicContact CE2-CG2 3.95Å; L109-V111 HydrophobicContact CD2-CG2 4.22Å; L109-V111 HydrophobicContact CG-CG2 4.3Å; V111-V113 HydrophobicContact CG1-CG2 4.07Å
112	Y	92.1	Very high	82.6	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	114.7	169.7	-69.3	-78.2	0	0	0	109.7	E37 V38 V39 V40 T89 H110 K114 L143 P146 H172	E37-Y112 HydrophobicContact CB-CD2 4.49Å; E37-Y112 HydrophobicContact CB-CE2 4.16Å; E37-Y112 HydrophobicContact CG-CE2 4.2Å; E37-Y112 WeakPolarHBondContact OE2-CE2 3.36Å; V38-Y112 PolarHBondContact O-N 3.29Å; V39-Y112 CarbonylContact C-O 3.54Å; V39-Y112 WeakPolarHBondContact CA-O 3.33Å; V39-Y112 HydrophobicContact CG2-CD2 4.43Å; V40-Y112 PolarHBondContact N-O 3.24Å; T89-Y112 HydrophobicContact CG2-CD1 4.34Å; H110-Y112 AromaticContact CD2-CD2 3.79Å; H110-Y112 AromaticContact CD2-CE1 3.75Å; H110-Y112 AromaticContact CD2-CE2 3.46Å; H110-Y112 VanDerWaalsContact CD2-CE2 3.46Å; H110-Y112 WeakPolarHBondContact CD2-CE2 3.44Å; H110-Y112 AromaticContact CD2-CZ 3.45Å; H110-Y112 VanDerWaalsContact CD2-CZ 3.45Å; H110-Y112 AromaticContact NE2-CE1 3.61Å; H110-Y112 AromaticContact NE2-CZ 3.73Å; Y112-K114 PolarHBondContact O-N 3.22Å; Y112-L143 WeakPolarHBondContact CD1-O 3.14Å; Y112-L143 WeakPolarHBondContact CE1-O 3.2Å; Y112-P146 HydrophobicContact CD1-CB 4.47Å; Y112-P146 HydrophobicContact CD2-CB 4.05Å; Y112-P146 HydrophobicContact CD2-CG 3.98Å; Y112-P146 HydrophobicContact CE1-CB 4.31Å; Y112-P146 HydrophobicContact CE2-CB 3.85Å; Y112-P146 HydrophobicContact CE2-CG 4.29Å; Y112-P146 HydrophobicContact CG-CB 4.35Å; Y112-P146 HydrophobicContact CG-CG 4.14Å; Y112-H172 PolarHBondContact OH-CD2 3.33Å; Y112-H172 VanDerWaalsContact OH-CD2 3.27Å
113	V	92.9	Very high	83.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	87.8	173.2	-173.7	0	0	0	0	109.2	V40 A42 S85 F88 T89 V111 D115 T144	V40-V113 CarbonylContact O-C 3.56Å; V40-V113 VanDerWaalsContact O-CA 3.25Å; V40-V113 WeakPolarHBondContact O-CA 3.33Å; A42-V113 HydrophobicContact CB-CG1 4.24Å; S85-V113 WeakPolarHBondContact O-CG1 3.49Å; F88-V113 HydrophobicContact CB-CG2 3.96Å; T89-V113 PolarHBondContact OG1-N 2.91Å; V111-V113 HydrophobicContact CG1-CG2 4.07Å; V113-D115 PolarHBondContact O-N 3.05Å; V113-T144 WeakPolarHBondContact O-CB 3.45Å
114	K	91	Very high	84.9	Confident	72 Å²	72	50.2 Å²	50.2	31%	0.313	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	113.1	-174.8	-177	169.5	-178.8	141.5	0	111	V39 V40 A42 Y112 T144 D145	V39-K114 HydrophobicContact CG1-CB 4.04Å; V40-K114 PolarHBondContact O-N 2.96Å; A42-K114 PolarHBondContact N-O 3Å; Y112-K114 PolarHBondContact O-N 3.22Å; K114-T144 WeakPolarHBondContact CA-O 3.18Å; K114-T144 PolarHBondContact N-O 3.01Å; K114-D145 HydrophobicContact CD-CB 4.49Å; K114-D145 WeakPolarHBondContact CD-OD1 3.41Å; K114-D145 VanDerWaalsContact CE-CG 3.45Å; K114-D145 WeakPolarHBondContact CE-OD1 3.25Å; K114-D145 WeakPolarHBondContact CE-OD2 3.36Å; K114-D145 HydrophobicContact CG-CB 4.24Å; K114-D145 IonicContact NZ-OD1 2.75Å; K114-D145 PolarHBondContact NZ-OD1 3.46Å; K114-D145 IonicContact NZ-OD2 2.95Å; K114-D145 PolarHBondContact NZ-OD2 3.09Å
115	D	88.8	Confident	85.5	Confident	29 Å²	29	48.8 Å²	48.8	16%	0.155	27%	0.268	C	S	.	.			trans	-121.5	111.9	176.3	-173.3	-17.6	0	0	0	109.2	A42 A86 V113 Q117 R118	A42-D115 HydrophobicContact CB-CB 4.01Å; A86-D115 HydrophobicContact CB-CB 4.08Å; V113-D115 PolarHBondContact O-N 3.05Å; D115-Q117 PolarHBondContact O-N 2.99Å; D115-Q117 VanDerWaalsContact O-N 3.12Å; D115-Q117 PolarHBondContact OD1-N 2.78Å; D115-R118 HydrophobicContact CB-CB 4.19Å; D115-R118 CarbonylContact O-C 3.55Å; D115-R118 PolarHBondContact O-N 3.26Å
116	P	82.8	Confident	85.3	Confident	105 Å²	105	48.6 Å²	48.6	68%	0.682	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.3	-179.4	-23.1	33.1	0	0	0	114.2
117	Q	84.1	Confident	85.3	Confident	172 Å²	172	48.1 Å²	48.1	80%	0.804	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-14.2	-179.6	-61.1	-62.9	-21.2	0	0	112.7	D115	D115-Q117 PolarHBondContact O-N 2.99Å; D115-Q117 VanDerWaalsContact O-N 3.12Å; D115-Q117 PolarHBondContact OD1-N 2.78Å
118	R	86.4	Confident	85.1	Confident	145 Å²	145	57.3 Å²	57.3	55%	0.547	30%	0.296	S	S	.	.			trans	-140.7	81.4	-174.5	-68.1	-177	177.5	175.6	1.9	110.6	A86 D115 F120 T144	A86-R118 HydrophobicContact CB-CB 4.2Å; D115-R118 HydrophobicContact CB-CB 4.19Å; D115-R118 CarbonylContact O-C 3.55Å; D115-R118 PolarHBondContact O-N 3.26Å; R118-F120 VanDerWaalsContact C-N 3.26Å; R118-F120 PolarHBondContact O-N 2.73Å; R118-T144 VanDerWaalsContact O-CG2 3.28Å; R118-T144 WeakPolarHBondContact O-CG2 3.4Å; R118-T144 PolarHBondContact O-OG1 3Å
119	V	88.4	Confident	84.7	Confident	16 Å²	16	54.4 Å²	54.4	10%	0.097	28%	0.276	C	S	.	.	S	Bend	trans	-65.2	-32	177.7	177.5	0	0	0	0	112.3	L143 T144 V194 R199	V119-L143 HydrophobicContact CG1-CD1 3.78Å; V119-T144 WeakPolarHBondContact CA-OG1 3.35Å; V119-T144 PolarHBondContact O-N 3.05Å; V119-T144 PolarHBondContact O-OG1 3.25Å; V119-T144 VanDerWaalsContact O-OG1 3.13Å; V119-V194 HydrophobicContact CG1-CG2 3.77Å; V119-V194 HydrophobicContact CG2-CG2 4.15Å; V119-R199 HydrophobicContact CB-CB 4.16Å; V119-R199 HydrophobicContact CG1-CB 4.34Å; V119-R199 HydrophobicContact CG2-CB 4.07Å; V119-R199 HydrophobicContact CG2-CG 3.97Å
120	F	90.5	Very high	84.3	Confident	16 Å²	16	58 Å²	58	7%	0.07	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.7	173	-68.4	-75.4	0	0	0	110.9	R118 C141 L142 L143 L151 C190 A192 R199	R118-F120 VanDerWaalsContact C-N 3.26Å; R118-F120 PolarHBondContact O-N 2.73Å; F120-C141 HydrophobicContact CD1-CB 4.08Å; F120-L142 CarbonylContact C-O 3.54Å; F120-L142 WeakPolarHBondContact CA-O 3.48Å; F120-L143 HydrophobicContact CD1-CD1 4.36Å; F120-L143 HydrophobicContact CE1-CD1 3.92Å; F120-L143 HydrophobicContact CZ-CD1 4.21Å; F120-L151 HydrophobicContact CE1-CD1 3.55Å; F120-L151 HydrophobicContact CZ-CD1 3.67Å; F120-C190 HydrophobicContact CD1-CB 4.45Å; F120-C190 HydrophobicContact CE1-CB 4.07Å; F120-C190 WeakPolarHBondContact CE2-O 3.07Å; F120-C190 HydrophobicContact CZ-CB 4.12Å; F120-A192 HydrophobicContact CE2-CB 4Å; F120-A192 HydrophobicContact CZ-CB 3.53Å; F120-R199 WeakPolarHBondContact CE2-O 3.49Å
121	W	89.3	Confident	83.9	Confident	25 Å²	25	63 Å²	63	10%	0.095	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127	165.7	-175.4	84.4	0	0	0	110.5	R61 L62 A86 E87 L142 T144	R61-W121 VanDerWaalsContact NH2-CE3 3.3Å; L62-W121 HydrophobicContact CD1-CH2 3.76Å; L62-W121 HydrophobicContact CD1-CZ2 4.06Å; A86-W121 HydrophobicContact CB-CB 4.42Å; E87-W121 HydrophobicContact CB-CD2 4.5Å; E87-W121 HydrophobicContact CB-CZ2 4Å; W121-L142 HydrophobicContact CE3-CD1 3.97Å; W121-L142 HydrophobicContact CE3-CG 4.5Å; W121-L142 HydrophobicContact CZ3-CD1 4.34Å; W121-L142 PolarHBondContact N-O 2.88Å; W121-L142 PolarHBondContact O-N 3.41Å; W121-T144 HydrophobicContact CB-CG2 4.21Å
122	T	86.3	Confident	83.4	Confident	19 Å²	19	67.3 Å²	67.3	12%	0.117	34%	0.335	C	S	.	.			trans	-132.9	144.1	176.2	60.6	0	0	0	0	110.4	C141 F204	T122-C141 HydrophobicContact CG2-CB 4.1Å; T122-F204 HydrophobicContact CG2-CE1 4.3Å; T122-F204 HydrophobicContact CG2-CE2 3.98Å; T122-F204 HydrophobicContact CG2-CZ 3.4Å
123	S	78.7	Confident	83	Confident	31 Å²	31	68.8 Å²	68.8	22%	0.217	34%	0.342	C	S	.	.			trans	-78.9	138.5	173.5	-170.8	0	0	0	0	110.4	T125 S126	S123-T125 PolarHBondContact O-N 2.8Å; S123-T125 PolarHBondContact OG-OG1 3.45Å; S123-S126 PolarHBondContact O-N 3.4Å; S123-S126 VanDerWaalsContact O-N 3.09Å
124	S	72.9	Confident	82.5	Confident	93 Å²	93	71 Å²	71	65%	0.65	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-61.5	-30.8	176.3	50.5	0	0	0	0	113.1	S126	S124-S126 PolarHBondContact O-N 2.79Å
125	T	67.3	Low	82.4	Confident	116 Å²	116	70.8 Å²	70.8	71%	0.712	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-68.4	-14.5	176.9	54.9	0	0	0	0	113.9	S123	S123-T125 PolarHBondContact O-N 2.8Å; S123-T125 PolarHBondContact OG-OG1 3.45Å
126	S	67.6	Low	82.6	Confident	33 Å²	33	73.4 Å²	73.4	23%	0.231	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-102.5	1.9	-173.9	-59.4	0	0	0	0	113.1	S123 S124 F204	S123-S126 PolarHBondContact O-N 3.4Å; S123-S126 VanDerWaalsContact O-N 3.09Å; S124-S126 PolarHBondContact O-N 2.79Å; S126-F204 VanDerWaalsContact O-CD1 3.28Å; S126-F204 WeakPolarHBondContact O-CD1 3.44Å
127	L	81.2	Confident	83	Confident	39 Å²	39	69.5 Å²	69.5	20%	0.204	35%	0.354	C	S	.	.	S	Bend	trans	-79.5	-20.5	-174.9	-59.2	175	0	0	0	113.5	K202 A203 F204 S205	L127-K202 HydrophobicContact CD1-CD 4.34Å; L127-K202 HydrophobicContact CD2-CB 3.84Å; L127-A203 WeakPolarHBondContact CD2-O 3.41Å; L127-F204 HydrophobicContact CD2-CD1 4.29Å; L127-F204 HydrophobicContact CD2-CE1 4.31Å; L127-F204 CarbonylContact O-C 3.57Å; L127-F204 WeakPolarHBondContact O-CA 3.4Å; L127-S205 PolarHBondContact O-N 2.88Å
128	R	82.8	Confident	83.3	Confident	215 Å²	215	63.9 Å²	63.9	81%	0.811	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.6	172.7	-68.4	-175.1	-178.5	179.5	-0.1	108.9
129	V	81.2	Confident	83.5	Confident	8 Å²	8	57 Å²	57	5%	0.048	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.5	-171	-178.3	0	0	0	0	108.1	R131 F137 S205 N207	V129-R131 HydrophobicContact CG1-CG 3.74Å; V129-F137 HydrophobicContact CB-CE1 4.18Å; V129-F137 HydrophobicContact CB-CZ 4.07Å; V129-F137 HydrophobicContact CG1-CD1 4.03Å; V129-F137 HydrophobicContact CG1-CD2 3.9Å; V129-F137 HydrophobicContact CG1-CE1 3.74Å; V129-F137 HydrophobicContact CG1-CE2 3.63Å; V129-F137 HydrophobicContact CG1-CG 4.11Å; V129-F137 HydrophobicContact CG1-CZ 3.55Å; V129-F137 HydrophobicContact CG2-CE1 3.55Å; V129-F137 HydrophobicContact CG2-CE2 4.16Å; V129-F137 HydrophobicContact CG2-CZ 3.32Å; V129-S205 PolarHBondContact N-O 2.84Å; V129-N207 PolarHBondContact O-N 2.86Å
130	V	82.1	Confident	83.5	Confident	79 Å²	79	57.6 Å²	57.6	48%	0.479	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118	171.5	-175.8	0	0	0	0	107.7	N207 I209	V130-N207 VanDerWaalsContact CA-O 3.28Å; V130-N207 WeakPolarHBondContact CA-O 3.4Å; V130-N207 HydrophobicContact CG2-CB 4.46Å; V130-I209 HydrophobicContact CG1-CD1 3.31Å; V130-I209 HydrophobicContact CG1-CG1 3.75Å
131	R	84.6	Confident	83.5	Confident	107 Å²	107	56.9 Å²	56.9	40%	0.404	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	160.3	-176.8	-74.6	-66.1	178.6	-89.5	3.8	110.9	V129 D135 F137 L180 N207 V208 I209	V129-R131 HydrophobicContact CG1-CG 3.74Å; R131-D135 HydrophobicContact CB-CB 4.41Å; R131-F137 HydrophobicContact CG-CD2 4.25Å; R131-L180 HydrophobicContact CB-CD1 3.48Å; R131-L180 VanDerWaalsContact CB-CD1 3.48Å; R131-L180 HydrophobicContact CG-CD1 3.93Å; R131-N207 PolarHBondContact N-O 2.79Å; R131-N207 VanDerWaalsContact N-O 3.1Å; R131-V208 CarbonylContact O-C 3.54Å; R131-V208 VanDerWaalsContact O-CA 3.32Å; R131-V208 WeakPolarHBondContact O-CA 3.29Å; R131-I209 PolarHBondContact O-N 2.89Å
132	K	80.7	Confident	83.5	Confident	92 Å²	92	56.1 Å²	56.1	40%	0.4	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	152.9	177.2	-67.8	-169.5	178.2	-170	0	110.4	G134 D135 I209 E298	K132-G134 PolarHBondContact O-N 2.84Å; K132-D135 PolarHBondContact N-OD2 2.8Å; K132-D135 WeakPolarHBondContact O-CB 3.22Å; K132-D135 PolarHBondContact O-N 2.98Å; K132-D135 VanDerWaalsContact O-N 3.12Å; K132-I209 CarbonylContact C-O 3.59Å; K132-I209 WeakPolarHBondContact CA-O 3.2Å; K132-E298 IonicContact NZ-OE2 2.64Å; K132-E298 PolarHBondContact NZ-OE2 2.78Å
133	E	83.5	Confident	83.7	Confident	32 Å²	32	55.2 Å²	55.2	15%	0.15	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	130.7	168.6	180	-172.4	170.9	0	0	110.4	L180 V208 I209 Q210 K211 R213	E133-L180 CarbonylContact C-O 3.56Å; E133-L180 VanDerWaalsContact CA-O 3.29Å; E133-L180 WeakPolarHBondContact CA-O 3.19Å; E133-V208 HydrophobicContact CB-CG1 4.25Å; E133-I209 PolarHBondContact N-O 3.13Å; E133-Q210 WeakPolarHBondContact OE2-CG 3.31Å; E133-K211 HydrophobicContact CB-CB 4.28Å; E133-K211 PolarHBondContact OE2-N 2.9Å; E133-K211 VanDerWaalsContact OE2-N 3.13Å; E133-R213 IonicContact OE1-NH2 3.79Å; E133-R213 PolarHBondContact OE1-NH2 2.03Å
134	G	83.1	Confident	84.3	Confident	47 Å²	47	53.8 Å²	53.8	49%	0.485	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-9.7	-177.1	0	0	0	0	0	115.5	K132 L180	K132-G134 PolarHBondContact O-N 2.84Å; G134-L180 PolarHBondContact N-O 2.78Å
135	D	89.3	Confident	85.1	Confident	67 Å²	67	49.9 Å²	49.9	36%	0.358	26%	0.258	S	S	.	.			trans	-72.2	144.4	175.2	-71.8	-20.5	0	0	0	111.5	R131 K132 L180	R131-D135 HydrophobicContact CB-CB 4.41Å; K132-D135 PolarHBondContact N-OD2 2.8Å; K132-D135 WeakPolarHBondContact O-CB 3.22Å; K132-D135 PolarHBondContact O-N 2.98Å; K132-D135 VanDerWaalsContact O-N 3.12Å; D135-L180 HydrophobicContact CB-CD1 4.47Å; D135-L180 VanDerWaalsContact O-CB 3.32Å; D135-L180 WeakPolarHBondContact O-CB 3.34Å; D135-L180 WeakPolarHBondContact O-CG 3.4Å; D135-L180 PolarHBondContact O-N 3.13Å
136	D	91.8	Very high	86.1	Confident	85 Å²	85	45.9 Å²	45.9	46%	0.455	23%	0.234	S	C	.	.			trans	-84.7	139.1	166.5	-82	10.2	0	0	0	110.5	L176 I177 H178 S179	D136-L176 HydrophobicContact CB-CD1 4.24Å; D136-I177 WeakPolarHBondContact CA-O 3.48Å; D136-H178 VanDerWaalsContact OD1-CA 3.29Å; D136-H178 WeakPolarHBondContact OD1-CA 3.4Å; D136-H178 IonicContact OD1-ND1 2.74Å; D136-H178 IonicContact OD2-CE1 2.71Å; D136-H178 IonicContact OD2-ND1 3.3Å; D136-H178 PolarHBondContact OD2-ND1 3.06Å; D136-S179 PolarHBondContact OD1-N 3.21Å
137	F	91.1	Very high	87.1	Confident	22 Å²	22	47.4 Å²	47.4	10%	0.096	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.8	-179.5	-176.1	-108.5	0	0	0	114.2	V129 R131 L139 I177 L180	V129-F137 HydrophobicContact CB-CE1 4.18Å; V129-F137 HydrophobicContact CB-CZ 4.07Å; V129-F137 HydrophobicContact CG1-CD1 4.03Å; V129-F137 HydrophobicContact CG1-CD2 3.9Å; V129-F137 HydrophobicContact CG1-CE1 3.74Å; V129-F137 HydrophobicContact CG1-CE2 3.63Å; V129-F137 HydrophobicContact CG1-CG 4.11Å; V129-F137 HydrophobicContact CG1-CZ 3.55Å; V129-F137 HydrophobicContact CG2-CE1 3.55Å; V129-F137 HydrophobicContact CG2-CE2 4.16Å; V129-F137 HydrophobicContact CG2-CZ 3.32Å; R131-F137 HydrophobicContact CG-CD2 4.25Å; F137-L139 HydrophobicContact CD1-CD2 4.19Å; F137-L139 HydrophobicContact CD1-CG 4.25Å; F137-L139 HydrophobicContact CE1-CD2 3.65Å; F137-L139 HydrophobicContact CE1-CG 4.09Å; F137-I177 PolarHBondContact N-O 2.83Å; F137-I177 PolarHBondContact O-N 3.42Å; F137-L180 HydrophobicContact CB-CD1 3.69Å; F137-L180 HydrophobicContact CB-CG 4.34Å
138	L	90.8	Very high	87.4	Confident	54 Å²	54	45.5 Å²	45.5	28%	0.283	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	109.3	175.6	-179.2	67.9	0	0	0	110.7	P140 R173 I175 L176	L138-P140 VanDerWaalsContact O-CD 3.28Å; L138-P140 WeakPolarHBondContact O-CD 3.25Å; L138-R173 HydrophobicContact CD1-CB 4.23Å; L138-R173 HydrophobicContact CD2-CB 4.2Å; L138-I175 CarbonylContact C-O 3.57Å; L138-L176 HydrophobicContact CB-CD1 4.07Å; L138-L176 HydrophobicContact CD1-CB 4.02Å
139	L	90.5	Very high	87.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	113.1	168.2	-71.1	166.6	0	0	0	110	F137 C141 L153 G174 I175 I177 F204 I206	F137-L139 HydrophobicContact CD1-CD2 4.19Å; F137-L139 HydrophobicContact CD1-CG 4.25Å; F137-L139 HydrophobicContact CE1-CD2 3.65Å; F137-L139 HydrophobicContact CE1-CG 4.09Å; L139-C141 PolarHBondContact O-N 2.82Å; L139-L153 HydrophobicContact CD1-CD1 3.48Å; L139-L153 VanDerWaalsContact CD1-CD1 3.48Å; L139-L153 HydrophobicContact CD1-CD2 3.91Å; L139-L153 HydrophobicContact CD1-CG 4.38Å; L139-G174 WeakPolarHBondContact O-CA 3.29Å; L139-I175 HydrophobicContact CB-CB 4.39Å; L139-I175 WeakPolarHBondContact CB-O 3.18Å; L139-I175 HydrophobicContact CD1-CB 4.46Å; L139-I175 PolarHBondContact N-O 2.79Å; L139-I175 PolarHBondContact O-N 2.97Å; L139-I175 VanDerWaalsContact O-N 3.13Å; L139-I177 HydrophobicContact CD1-CD1 3.54Å; L139-I177 HydrophobicContact CD1-CG1 4.18Å; L139-I177 HydrophobicContact CG-CD1 3.99Å; L139-F204 HydrophobicContact CD2-CB 3.65Å; L139-F204 HydrophobicContact CD2-CD1 3.8Å; L139-F204 HydrophobicContact CD2-CD2 3.82Å; L139-F204 HydrophobicContact CD2-CE1 4.32Å; L139-F204 HydrophobicContact CD2-CE2 4.32Å; L139-F204 HydrophobicContact CD2-CG 3.51Å; L139-I206 HydrophobicContact CD2-CD1 4.28Å
140	P	88.4	Confident	87.9	Confident	29 Å²	29	42.9 Å²	42.9	19%	0.188	24%	0.24	C	C	.	.			trans	-84	55.6	-173.7	36	-36.6	0	0	0	111.8	L138 L142 F204	L138-P140 VanDerWaalsContact O-CD 3.28Å; L138-P140 WeakPolarHBondContact O-CD 3.25Å; P140-L142 PolarHBondContact O-N 2.78Å; P140-F204 HydrophobicContact CG-CE1 4.19Å
141	C	89.8	Confident	88.3	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.007	22%	0.223	C	C	.	.			trans	-89.4	82.2	173.2	56	0	0	0	0	110.9	F120 T122 L139 L143 C190 F204	F120-C141 HydrophobicContact CD1-CB 4.08Å; T122-C141 HydrophobicContact CG2-CB 4.1Å; L139-C141 PolarHBondContact O-N 2.82Å; C141-L143 PolarHBondContact O-N 2.83Å; C141-C190 HydrophobicContact CB-CB 3.55Å; C141-C190 WeakPolarHBondContact CB-SG 3.44Å; C141-C190 WeakPolarHBondContact SG-CB 3.27Å; C141-C190 CovalentContact SG-SG 2.03Å; C141-C190 PolarHBondContact SG-SG 3.27Å; C141-F204 HydrophobicContact CB-CE2 4.08Å; C141-F204 HydrophobicContact CB-CZ 4.19Å
142	L	90.3	Very high	88.6	Confident	9 Å²	9	36 Å²	36	5%	0.047	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	124	-177.1	-61.1	179.9	0	0	0	110.5	T89 F120 W121 P140 H172	T89-L142 HydrophobicContact CG2-CB 4.4Å; F120-L142 CarbonylContact C-O 3.54Å; F120-L142 WeakPolarHBondContact CA-O 3.48Å; W121-L142 HydrophobicContact CE3-CD1 3.97Å; W121-L142 HydrophobicContact CE3-CG 4.5Å; W121-L142 HydrophobicContact CZ3-CD1 4.34Å; W121-L142 PolarHBondContact N-O 2.88Å; W121-L142 PolarHBondContact O-N 3.41Å; P140-L142 PolarHBondContact O-N 2.78Å; L142-H172 VanDerWaalsContact CD2-O 3.26Å; L142-H172 WeakPolarHBondContact CD2-O 3.33Å
143	L	91.3	Very high	89.2	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	129.1	176.6	-172	69.7	0	0	0	109.9	T89 Y112 V119 F120 C141 D145 A148 A192	T89-L143 VanDerWaalsContact CG2-O 3.27Å; T89-L143 WeakPolarHBondContact CG2-O 3.41Å; Y112-L143 WeakPolarHBondContact CD1-O 3.14Å; Y112-L143 WeakPolarHBondContact CE1-O 3.2Å; V119-L143 HydrophobicContact CG1-CD1 3.78Å; F120-L143 HydrophobicContact CD1-CD1 4.36Å; F120-L143 HydrophobicContact CE1-CD1 3.92Å; F120-L143 HydrophobicContact CZ-CD1 4.21Å; C141-L143 PolarHBondContact O-N 2.83Å; L143-D145 VanDerWaalsContact CD2-O 3.25Å; L143-D145 WeakPolarHBondContact CD2-O 3.36Å; L143-D145 WeakPolarHBondContact CG-O 3.31Å; L143-A148 HydrophobicContact CD1-CB 3.73Å; L143-A148 HydrophobicContact CD2-CB 3.84Å; L143-A148 HydrophobicContact CG-CB 4.28Å; L143-A192 HydrophobicContact CD1-CB 4.17Å
144	T	91.1	Very high	89.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-91	-14.3	-179.7	65.8	0	0	0	0	113.8	A86 V113 K114 R118 V119 W121	A86-T144 HydrophobicContact CB-CG2 3.86Å; V113-T144 WeakPolarHBondContact O-CB 3.45Å; K114-T144 WeakPolarHBondContact CA-O 3.18Å; K114-T144 PolarHBondContact N-O 3.01Å; R118-T144 VanDerWaalsContact O-CG2 3.28Å; R118-T144 WeakPolarHBondContact O-CG2 3.4Å; R118-T144 PolarHBondContact O-OG1 3Å; V119-T144 WeakPolarHBondContact CA-OG1 3.35Å; V119-T144 PolarHBondContact O-N 3.05Å; V119-T144 PolarHBondContact O-OG1 3.25Å; V119-T144 VanDerWaalsContact O-OG1 3.13Å; W121-T144 HydrophobicContact CB-CG2 4.21Å
145	D	89.4	Confident	90	Very high	12 Å²	12	32.5 Å²	32.5	6%	0.064	18%	0.182	C	C	.	.			trans	-129.2	108.8	-174.4	-169.2	5.2	0	0	0	110.5	K114 L143 S147 A148	K114-D145 HydrophobicContact CD-CB 4.49Å; K114-D145 WeakPolarHBondContact CD-OD1 3.41Å; K114-D145 VanDerWaalsContact CE-CG 3.45Å; K114-D145 WeakPolarHBondContact CE-OD1 3.25Å; K114-D145 WeakPolarHBondContact CE-OD2 3.36Å; K114-D145 HydrophobicContact CG-CB 4.24Å; K114-D145 IonicContact NZ-OD1 2.75Å; K114-D145 PolarHBondContact NZ-OD1 3.46Å; K114-D145 IonicContact NZ-OD2 2.95Å; K114-D145 PolarHBondContact NZ-OD2 3.09Å; L143-D145 VanDerWaalsContact CD2-O 3.25Å; L143-D145 WeakPolarHBondContact CD2-O 3.36Å; L143-D145 WeakPolarHBondContact CG-O 3.31Å; D145-S147 VanDerWaalsContact CG-OG 3.29Å; D145-S147 PolarHBondContact O-N 2.89Å; D145-S147 VanDerWaalsContact O-N 3.14Å; D145-S147 PolarHBondContact OD1-OG 3.17Å; D145-S147 PolarHBondContact OD2-OG 3.05Å; D145-A148 PolarHBondContact O-N 2.9Å
146	P	88.4	Confident	90	Very high	32 Å²	32	33.5 Å²	33.5	21%	0.208	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-12.4	-174.4	28	-34.9	0	0	0	113.6	V39 Y112 A148	V39-P146 HydrophobicContact CG2-CG 3.54Å; Y112-P146 HydrophobicContact CD1-CB 4.47Å; Y112-P146 HydrophobicContact CD2-CB 4.05Å; Y112-P146 HydrophobicContact CD2-CG 3.98Å; Y112-P146 HydrophobicContact CE1-CB 4.31Å; Y112-P146 HydrophobicContact CE2-CB 3.85Å; Y112-P146 HydrophobicContact CE2-CG 4.29Å; Y112-P146 HydrophobicContact CG-CB 4.35Å; Y112-P146 HydrophobicContact CG-CG 4.14Å; P146-A148 PolarHBondContact O-N 2.83Å
147	S	88	Confident	89.7	Confident	64 Å²	64	35 Å²	35	45%	0.448	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-4	174.8	61.4	0	0	0	0	113.9	D145	D145-S147 VanDerWaalsContact CG-OG 3.29Å; D145-S147 PolarHBondContact O-N 2.89Å; D145-S147 VanDerWaalsContact O-N 3.14Å; D145-S147 PolarHBondContact OD1-OG 3.17Å; D145-S147 PolarHBondContact OD2-OG 3.05Å
148	A	87.9	Confident	89.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.214	C	C	.	.			trans	-72.6	136.6	179.3	0	0	0	0	0	112	L143 D145 P146 R171 A192 K193 V194	L143-A148 HydrophobicContact CD1-CB 3.73Å; L143-A148 HydrophobicContact CD2-CB 3.84Å; L143-A148 HydrophobicContact CG-CB 4.28Å; D145-A148 PolarHBondContact O-N 2.9Å; P146-A148 PolarHBondContact O-N 2.83Å; A148-R171 PolarHBondContact O-NH2 3Å; A148-A192 HydrophobicContact CB-CB 3.94Å; A148-K193 CarbonylContact C-O 3.52Å; A148-K193 VanDerWaalsContact CA-O 3.27Å; A148-K193 WeakPolarHBondContact CA-O 3.38Å; A148-V194 HydrophobicContact CB-CG2 3.63Å
149	T	86.6	Confident	89.2	Confident	71 Å²	71	36.9 Å²	36.9	44%	0.436	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	171	178.4	60.8	0	0	0	0	110.7	L151 K193	T149-L151 PolarHBondContact O-N 3.06Å; T149-K193 PolarHBondContact N-O 3.17Å; T149-K193 PolarHBondContact O-N 2.91Å
150	D	87.1	Confident	89.1	Confident	97 Å²	97	42.5 Å²	42.5	52%	0.519	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.2	49.9	177.8	-56.5	-5.8	0	0	0	113.6	G152 K193	D150-G152 PolarHBondContact O-N 2.92Å; D150-K193 HydrophobicContact CB-CD 4.33Å; D150-K193 HydrophobicContact CB-CG 4.33Å; D150-K193 VanDerWaalsContact OD2-CD 3.31Å; D150-K193 WeakPolarHBondContact OD2-CD 3.48Å; D150-K193 VanDerWaalsContact OD2-CE 3.3Å; D150-K193 WeakPolarHBondContact OD2-CE 3Å; D150-K193 IonicContact OD2-NZ 3.87Å; D150-K193 PolarHBondContact OD2-NZ 3.1Å
151	L	89.9	Confident	89.2	Confident	26 Å²	26	42.5 Å²	42.5	14%	0.136	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	118.6	175.7	-177.4	64.5	0	0	0	109.3	F120 T149 V169 R171 T191 A192	F120-L151 HydrophobicContact CE1-CD1 3.55Å; F120-L151 HydrophobicContact CZ-CD1 3.67Å; T149-L151 PolarHBondContact O-N 3.06Å; L151-V169 HydrophobicContact CB-CG1 3.88Å; L151-V169 HydrophobicContact CD2-CG1 3.35Å; L151-V169 HydrophobicContact CG-CG1 3.48Å; L151-V169 VanDerWaalsContact CG-CG1 3.48Å; L151-R171 HydrophobicContact CD2-CG 4.11Å; L151-T191 VanDerWaalsContact CA-O 3.29Å; L151-T191 WeakPolarHBondContact CA-O 3.41Å; L151-T191 WeakPolarHBondContact CD1-O 3.31Å; L151-A192 HydrophobicContact CD1-CB 4.21Å
152	G	91.5	Very high	89.1	Confident	14 Å²	14	43.4 Å²	43.4	14%	0.144	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	-176.4	-175.6	0	0	0	0	0	113.4	D150 I175 C190 T191	D150-G152 PolarHBondContact O-N 2.92Å; G152-I175 VanDerWaalsContact C-CD1 3.46Å; G152-I175 WeakPolarHBondContact O-CD1 3.33Å; G152-C190 CarbonylContact O-C 3.57Å; G152-C190 WeakPolarHBondContact O-CA 3.41Å; G152-T191 PolarHBondContact N-O 2.8Å; G152-T191 PolarHBondContact O-N 2.87Å; G152-T191 PolarHBondContact O-OG1 3.25Å
153	L	93.1	Very high	88.6	Confident	13 Å²	13	47.8 Å²	47.8	7%	0.068	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.4	177.9	-169	67.9	0	0	0	108.8	L139 V161 M165 F167 I175 I177 Y188	L139-L153 HydrophobicContact CD1-CD1 3.48Å; L139-L153 VanDerWaalsContact CD1-CD1 3.48Å; L139-L153 HydrophobicContact CD1-CD2 3.91Å; L139-L153 HydrophobicContact CD1-CG 4.38Å; L153-V161 HydrophobicContact CB-CG1 4.06Å; L153-V161 HydrophobicContact CD2-CG1 3.98Å; L153-V161 HydrophobicContact CG-CG1 3.93Å; L153-M165 HydrophobicContact CD2-SD 4.36Å; L153-F167 HydrophobicContact CB-CD2 4.46Å; L153-F167 HydrophobicContact CB-CE1 4.34Å; L153-F167 HydrophobicContact CB-CE2 4.15Å; L153-F167 HydrophobicContact CB-CZ 4.09Å; L153-I175 HydrophobicContact CB-CD1 3.99Å; L153-I175 HydrophobicContact CB-CG2 4.46Å; L153-I175 HydrophobicContact CD1-CD1 4.3Å; L153-I175 HydrophobicContact CD2-CG2 4.4Å; L153-I177 HydrophobicContact CD2-CD1 4.15Å; L153-I177 HydrophobicContact CD2-CG1 4.21Å; L153-Y188 HydrophobicContact CD2-CD1 4.2Å; L153-Y188 HydrophobicContact CG-CD1 4.25Å
154	R	92.6	Very high	88.1	Confident	54 Å²	54	51.3 Å²	51.3	20%	0.204	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	167.8	169.4	72.8	179.9	167.7	85	-17.2	110.9	Y188 V189 T191 E198 T200	R154-Y188 WeakPolarHBondContact O-CA 3.46Å; R154-V189 HydrophobicContact CG-CG2 3.68Å; R154-V189 PolarHBondContact N-O 3.11Å; R154-V189 PolarHBondContact O-N 2.02Å; R154-T191 HydrophobicContact CB-CG2 4.36Å; R154-T191 HydrophobicContact CG-CG2 3.48Å; R154-T191 VanDerWaalsContact CG-CG2 3.48Å; R154-E198 IonicContact CZ-OE2 2.65Å; R154-E198 IonicContact NE-OE1 2.71Å; R154-E198 PolarHBondContact NE-OE1 2.91Å; R154-E198 IonicContact NE-OE2 3.83Å; R154-E198 IonicContact NH2-OE1 3.33Å; R154-E198 IonicContact NH2-OE2 2.65Å; R154-E198 PolarHBondContact NH2-OE2 3.33Å; R154-T200 VanDerWaalsContact NH2-CG2 3.3Å
155	M	90.3	Very high	88	Confident	31 Å²	31	52 Å²	52	15%	0.153	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	151.2	174.8	-60.2	179.8	92.6	0	0	110.1	N157 G158 T159 T160 P162 A186 Y188	M155-N157 WeakPolarHBondContact CB-OD1 3.42Å; M155-N157 PolarHBondContact O-N 2.76Å; M155-G158 PolarHBondContact O-N 2.85Å; M155-T159 PolarHBondContact N-O 2.76Å; M155-T159 PolarHBondContact SD-OG1 2.81Å; M155-T160 VanDerWaalsContact SD-O 3.33Å; M155-P162 HydrophobicContact CE-CG 4.15Å; M155-P162 HydrophobicContact SD-CG 4.22Å; M155-A186 HydrophobicContact CE-CB 3.28Å; M155-Y188 HydrophobicContact CG-CD1 4.15Å; M155-Y188 HydrophobicContact CG-CE1 3.9Å
156	D	89.9	Confident	88.1	Confident	88 Å²	88	56.6 Å²	56.6	47%	0.471	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-31.2	-176.2	-168.7	49.3	0	0	0	112.5	G158 D187 V189 A203	D156-G158 PolarHBondContact O-N 2.78Å; D156-G158 VanDerWaalsContact O-N 3.14Å; D156-D187 HydrophobicContact CB-CB 3.9Å; D156-D187 PolarHBondContact N-O 3.39Å; D156-V189 HydrophobicContact CB-CG1 4.26Å; D156-V189 VanDerWaalsContact OD1-CG1 3.32Å; D156-V189 WeakPolarHBondContact OD1-CG1 3.47Å; D156-A203 HydrophobicContact CB-CB 4.33Å
157	N	85.7	Confident	88.4	Confident	118 Å²	118	57.7 Å²	57.7	63%	0.631	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-5.1	172.9	67.8	-3.3	0	0	0	114.2	M155 T159	M155-N157 WeakPolarHBondContact CB-OD1 3.42Å; M155-N157 PolarHBondContact O-N 2.76Å; N157-T159 PolarHBondContact ND2-OG1 3.41Å; N157-T159 PolarHBondContact OD1-N 2.53Å; N157-T159 PolarHBondContact OD1-OG1 2.94Å
158	G	82.8	Confident	88.6	Confident	46 Å²	46	57.9 Å²	57.9	47%	0.474	35%	0.353	S	S	.	.	S	Bend	trans	94	-5.8	-179.7	0	0	0	0	0	115.5	M155 D156	M155-G158 PolarHBondContact O-N 2.85Å; D156-G158 PolarHBondContact O-N 2.78Å; D156-G158 VanDerWaalsContact O-N 3.14Å
159	T	87.8	Confident	88.8	Confident	68 Å²	68	61 Å²	61	42%	0.417	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-76.6	159.7	176.8	61.5	0	0	0	0	111.6	M155 N157	M155-T159 PolarHBondContact N-O 2.76Å; M155-T159 PolarHBondContact SD-OG1 2.81Å; N157-T159 PolarHBondContact ND2-OG1 3.41Å; N157-T159 PolarHBondContact OD1-N 2.53Å; N157-T159 PolarHBondContact OD1-OG1 2.94Å
160	T	89.3	Confident	88.9	Confident	119 Å²	119	60.4 Å²	60.4	73%	0.73	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-63.2	161.6	171.2	50.9	0	0	0	0	110.7	M155	M155-T160 VanDerWaalsContact SD-O 3.33Å
161	V	90.6	Very high	88.8	Confident	29 Å²	29	61.3 Å²	61.3	18%	0.176	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-57.6	151.5	173.1	-65.6	0	0	0	0	111.2	L153 M165 F167 Y188	L153-V161 HydrophobicContact CB-CG1 4.06Å; L153-V161 HydrophobicContact CD2-CG1 3.98Å; L153-V161 HydrophobicContact CG-CG1 3.93Å; V161-M165 HydrophobicContact CB-CB 4.43Å; V161-M165 HydrophobicContact CB-SD 3.83Å; V161-M165 HydrophobicContact CG1-SD 4Å; V161-F167 HydrophobicContact CG1-CE1 4.37Å; V161-F167 HydrophobicContact CG2-CE1 3.96Å; V161-Y188 HydrophobicContact CG1-CD1 4.35Å; V161-Y188 HydrophobicContact CG1-CE1 4.24Å
162	P	87.1	Confident	88.7	Confident	20 Å²	20	62.9 Å²	62.9	13%	0.13	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-55.2	147.5	177.1	-26.5	34.9	0	0	0	112.7	M155 M165 F184 Y188	M155-P162 HydrophobicContact CE-CG 4.15Å; M155-P162 HydrophobicContact SD-CG 4.22Å; P162-M165 VanDerWaalsContact O-CB 3.3Å; P162-M165 WeakPolarHBondContact O-CB 3.34Å; P162-M165 PolarHBondContact O-N 3.01Å; P162-F184 HydrophobicContact CB-CD1 4.17Å; P162-F184 HydrophobicContact CG-CD1 4.45Å; P162-Y188 WeakPolarHBondContact CD-OH 3.25Å; P162-Y188 WeakPolarHBondContact CG-OH 3.41Å
163	P	79.5	Confident	88.3	Confident	100 Å²	100	69.4 Å²	69.4	65%	0.649	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	140.9	175.5	24.6	-32.4	0	0	0	110.7	M165	P163-M165 VanDerWaalsContact C-N 3.31Å; P163-M165 PolarHBondContact O-N 2.9Å
164	G	81.4	Confident	88.2	Confident	75 Å²	75	68.8 Å²	68.8	77%	0.773	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	-6.7	-177.5	0	0	0	0	0	115.7	N166	G164-N166 PolarHBondContact O-N 3.33Å; G164-N166 VanDerWaalsContact O-N 3.17Å
165	M	89.7	Confident	88.2	Confident	15 Å²	15	66.2 Å²	66.2	7%	0.074	38%	0.376	C	S	.	.			trans	-75	103.4	175.3	-170.1	179.6	-141.4	0	0	111.2	L153 V161 P162 P163 I177 F184 Y188	L153-M165 HydrophobicContact CD2-SD 4.36Å; V161-M165 HydrophobicContact CB-CB 4.43Å; V161-M165 HydrophobicContact CB-SD 3.83Å; V161-M165 HydrophobicContact CG1-SD 4Å; P162-M165 VanDerWaalsContact O-CB 3.3Å; P162-M165 WeakPolarHBondContact O-CB 3.34Å; P162-M165 PolarHBondContact O-N 3.01Å; P163-M165 VanDerWaalsContact C-N 3.31Å; P163-M165 PolarHBondContact O-N 2.9Å; M165-I177 HydrophobicContact CE-CB 4.49Å; M165-I177 HydrophobicContact CE-CD1 3.6Å; M165-I177 HydrophobicContact CE-CG1 3.99Å; M165-I177 HydrophobicContact CE-CG2 3.7Å; M165-I177 HydrophobicContact CG-CG2 4.26Å; M165-F184 HydrophobicContact CB-CD1 4.21Å; M165-F184 HydrophobicContact CB-CE1 3.83Å; M165-F184 HydrophobicContact CB-CE2 4.32Å; M165-F184 HydrophobicContact CB-CZ 3.9Å; M165-F184 HydrophobicContact CE-CB 3.95Å; M165-F184 HydrophobicContact CE-CD2 4.06Å; M165-F184 HydrophobicContact CE-CG 4.02Å; M165-F184 HydrophobicContact CG-CD1 4.46Å; M165-F184 HydrophobicContact CG-CD2 4.24Å; M165-F184 HydrophobicContact CG-CE1 4.4Å; M165-F184 HydrophobicContact CG-CE2 4.18Å; M165-F184 HydrophobicContact CG-CG 4.41Å; M165-F184 HydrophobicContact CG-CZ 4.27Å; M165-Y188 HydrophobicContact CE-CE1 3.97Å; M165-Y188 HydrophobicContact CE-CE2 4.24Å; M165-Y188 HydrophobicContact SD-CE1 3.77Å
166	N	91.4	Very high	88.3	Confident	108 Å²	108	66.8 Å²	66.8	58%	0.578	38%	0.38	S	S	*	.			trans	-90.2	129.5	174.9	-167.1	6.6	0	0	0	110.9	G164 H178	G164-N166 PolarHBondContact O-N 3.33Å; G164-N166 VanDerWaalsContact O-N 3.17Å; N166-H178 PolarHBondContact O-N 2.97Å
167	F	93.3	Very high	88.5	Confident	56 Å²	56	62.6 Å²	62.6	25%	0.246	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	146.1	177	66.1	-90.1	0	0	0	112	L153 V161 V169 I175 L176 I177	L153-F167 HydrophobicContact CB-CD2 4.46Å; L153-F167 HydrophobicContact CB-CE1 4.34Å; L153-F167 HydrophobicContact CB-CE2 4.15Å; L153-F167 HydrophobicContact CB-CZ 4.09Å; V161-F167 HydrophobicContact CG1-CE1 4.37Å; V161-F167 HydrophobicContact CG2-CE1 3.96Å; F167-V169 HydrophobicContact CD2-CG2 3.79Å; F167-V169 HydrophobicContact CE2-CG2 3.63Å; F167-I175 HydrophobicContact CB-CG2 3.88Å; F167-I175 HydrophobicContact CD2-CG2 3.53Å; F167-I175 HydrophobicContact CE2-CG2 4.39Å; F167-I175 HydrophobicContact CG-CG2 3.98Å; F167-L176 CarbonylContact C-O 3.53Å; F167-L176 WeakPolarHBondContact CA-O 3.16Å; F167-L176 WeakPolarHBondContact CB-O 3.24Å; F167-I177 HydrophobicContact CB-CG1 4.33Å
168	T	93.4	Very high	88.8	Confident	67 Å²	67	59.3 Å²	59.3	41%	0.411	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.3	173.9	49.8	0	0	0	0	110.3	I175 L176 H178	T168-I175 CarbonylContact O-C 3.41Å; T168-I175 WeakPolarHBondContact O-CA 3.42Å; T168-L176 PolarHBondContact N-O 2.86Å; T168-L176 PolarHBondContact O-N 3.24Å; T168-L176 WeakPolarHBondContact OG1-CB 3.29Å; T168-H178 VanDerWaalsContact CG2-NE2 3.33Å; T168-H178 WeakPolarHBondContact CG2-NE2 3.27Å; T168-H178 PolarHBondContact OG1-NE2 3.14Å
169	V	91.5	Very high	89	Confident	65 Å²	65	60.8 Å²	60.8	39%	0.394	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.2	-177.1	179.5	0	0	0	0	109.5	L151 F167 I175	L151-V169 HydrophobicContact CB-CG1 3.88Å; L151-V169 HydrophobicContact CD2-CG1 3.35Å; L151-V169 HydrophobicContact CG-CG1 3.48Å; L151-V169 VanDerWaalsContact CG-CG1 3.48Å; F167-V169 HydrophobicContact CD2-CG2 3.79Å; F167-V169 HydrophobicContact CE2-CG2 3.63Å; V169-I175 HydrophobicContact CG1-CG1 4.49Å; V169-I175 HydrophobicContact CG2-CD1 4.48Å; V169-I175 HydrophobicContact CG2-CG1 4.31Å
170	D	88.4	Confident	89	Confident	60 Å²	60	57.6 Å²	57.6	32%	0.321	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.4	175.5	-178.2	-31.4	0	0	0	109.5	H172 R173 G174	D170-H172 PolarHBondContact O-N 3.38Å; D170-H172 WeakPolarHBondContact OD1-CA 3.28Å; D170-H172 WeakPolarHBondContact OD1-CB 3.44Å; D170-H172 PolarHBondContact OD1-N 3.46Å; D170-R173 HydrophobicContact CB-CB 4.04Å; D170-R173 PolarHBondContact O-N 2.85Å; D170-R173 PolarHBondContact OD1-N 2.65Å; D170-R173 VanDerWaalsContact OD1-N 3.1Å; D170-R173 WeakPolarHBondContact OD2-CD 3.37Å; D170-R173 WeakPolarHBondContact OD2-CG 3.25Å; D170-G174 CarbonylContact C-O 3.53Å; D170-G174 WeakPolarHBondContact CA-O 3.36Å; D170-G174 PolarHBondContact N-O 3.35Å; D170-G174 CarbonylContact O-C 3.59Å; D170-G174 WeakPolarHBondContact O-CA 3.29Å; D170-G174 PolarHBondContact O-N 3.33Å
171	R	86	Confident	88.8	Confident	115 Å²	115	55.6 Å²	55.6	43%	0.434	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.5	-178.8	-73.9	-178.8	154.1	-167.3	-8.5	113.8	A148 L151	A148-R171 PolarHBondContact O-NH2 3Å; L151-R171 HydrophobicContact CD2-CG 4.11Å
172	H	86.4	Confident	88.3	Confident	60 Å²	60	55.9 Å²	55.9	28%	0.278	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-25.5	-179.9	-63	160.3	0	0	0	113.6	E37 H110 Y112 L142 D170	E37-H172 IonicContact OE1-CD2 2.66Å; E37-H172 IonicContact OE1-CE1 3.05Å; E37-H172 PolarHBondContact OE1-CE1 2.65Å; E37-H172 IonicContact OE1-NE2 2.67Å; E37-H172 PolarHBondContact OE1-NE2 3.41Å; H110-H172 AromaticContact CD2-CD2 3.8Å; H110-H172 VanDerWaalsContact CE1-CA 3.47Å; H110-H172 WeakPolarHBondContact CE1-CA 3.28Å; H110-H172 AromaticContact CE1-CD2 3.77Å; H110-H172 AromaticContact CE1-CG 3.9Å; H110-H172 PolarHBondContact CE1-O 2.7Å; H110-H172 AromaticContact CG-CD2 3.58Å; H110-H172 AromaticContact CG-CG 3.97Å; H110-H172 AromaticContact ND1-CD2 3.58Å; H110-H172 AromaticContact ND1-CG 3.57Å; H110-H172 AromaticContact NE2-CD2 3.95Å; Y112-H172 PolarHBondContact OH-CD2 3.33Å; Y112-H172 VanDerWaalsContact OH-CD2 3.27Å; L142-H172 VanDerWaalsContact CD2-O 3.26Å; L142-H172 WeakPolarHBondContact CD2-O 3.33Å; D170-H172 PolarHBondContact O-N 3.38Å; D170-H172 WeakPolarHBondContact OD1-CA 3.28Å; D170-H172 WeakPolarHBondContact OD1-CB 3.44Å; D170-H172 PolarHBondContact OD1-N 3.46Å
173	R	84.6	Confident	88.1	Confident	150 Å²	150	58.2 Å²	58.2	57%	0.566	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-24.6	-171.6	-61	-178.8	67.1	-169.9	-3	113.9	L138 D170	L138-R173 HydrophobicContact CD1-CB 4.23Å; L138-R173 HydrophobicContact CD2-CB 4.2Å; D170-R173 HydrophobicContact CB-CB 4.04Å; D170-R173 PolarHBondContact O-N 2.85Å; D170-R173 PolarHBondContact OD1-N 2.65Å; D170-R173 VanDerWaalsContact OD1-N 3.1Å; D170-R173 WeakPolarHBondContact OD2-CD 3.37Å; D170-R173 WeakPolarHBondContact OD2-CG 3.25Å
174	G	90.1	Very high	88.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	107.7	-149.4	-173	0	0	0	0	0	111.8	L139 D170	L139-G174 WeakPolarHBondContact O-CA 3.29Å; D170-G174 CarbonylContact C-O 3.53Å; D170-G174 WeakPolarHBondContact CA-O 3.36Å; D170-G174 PolarHBondContact N-O 3.35Å; D170-G174 CarbonylContact O-C 3.59Å; D170-G174 WeakPolarHBondContact O-CA 3.29Å; D170-G174 PolarHBondContact O-N 3.33Å
175	I	92.6	Very high	88.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.7	-174.4	-61.2	-179.4	0	0	0	109.3	L138 L139 G152 L153 F167 T168 V169 C190	L138-I175 CarbonylContact C-O 3.57Å; L139-I175 HydrophobicContact CB-CB 4.39Å; L139-I175 WeakPolarHBondContact CB-O 3.18Å; L139-I175 HydrophobicContact CD1-CB 4.46Å; L139-I175 PolarHBondContact N-O 2.79Å; L139-I175 PolarHBondContact O-N 2.97Å; L139-I175 VanDerWaalsContact O-N 3.13Å; G152-I175 VanDerWaalsContact C-CD1 3.46Å; G152-I175 WeakPolarHBondContact O-CD1 3.33Å; L153-I175 HydrophobicContact CB-CD1 3.99Å; L153-I175 HydrophobicContact CB-CG2 4.46Å; L153-I175 HydrophobicContact CD1-CD1 4.3Å; L153-I175 HydrophobicContact CD2-CG2 4.4Å; F167-I175 HydrophobicContact CB-CG2 3.88Å; F167-I175 HydrophobicContact CD2-CG2 3.53Å; F167-I175 HydrophobicContact CE2-CG2 4.39Å; F167-I175 HydrophobicContact CG-CG2 3.98Å; T168-I175 CarbonylContact O-C 3.41Å; T168-I175 WeakPolarHBondContact O-CA 3.42Å; V169-I175 HydrophobicContact CG1-CG1 4.49Å; V169-I175 HydrophobicContact CG2-CD1 4.48Å; V169-I175 HydrophobicContact CG2-CG1 4.31Å; I175-C190 HydrophobicContact CD1-CB 4.23Å
176	L	93.3	Very high	88.7	Confident	44 Å²	44	54.3 Å²	54.3	23%	0.23	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	114.6	178	175.9	65.4	0	0	0	109.4	D136 L138 F167 T168 H178	D136-L176 HydrophobicContact CB-CD1 4.24Å; L138-L176 HydrophobicContact CB-CD1 4.07Å; L138-L176 HydrophobicContact CD1-CB 4.02Å; F167-L176 CarbonylContact C-O 3.53Å; F167-L176 WeakPolarHBondContact CA-O 3.16Å; F167-L176 WeakPolarHBondContact CB-O 3.24Å; T168-L176 PolarHBondContact N-O 2.86Å; T168-L176 PolarHBondContact O-N 3.24Å; T168-L176 WeakPolarHBondContact OG1-CB 3.29Å; L176-H178 WeakPolarHBondContact CD2-CE1 3.35Å
177	I	92.9	Very high	88.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.5	171.7	-59.8	160.7	0	0	0	107.7	D136 F137 L139 L153 M165 F167 L180 I206	D136-I177 WeakPolarHBondContact CA-O 3.48Å; F137-I177 PolarHBondContact N-O 2.83Å; F137-I177 PolarHBondContact O-N 3.42Å; L139-I177 HydrophobicContact CD1-CD1 3.54Å; L139-I177 HydrophobicContact CD1-CG1 4.18Å; L139-I177 HydrophobicContact CG-CD1 3.99Å; L153-I177 HydrophobicContact CD2-CD1 4.15Å; L153-I177 HydrophobicContact CD2-CG1 4.21Å; M165-I177 HydrophobicContact CE-CB 4.49Å; M165-I177 HydrophobicContact CE-CD1 3.6Å; M165-I177 HydrophobicContact CE-CG1 3.99Å; M165-I177 HydrophobicContact CE-CG2 3.7Å; M165-I177 HydrophobicContact CG-CG2 4.26Å; F167-I177 HydrophobicContact CB-CG1 4.33Å; I177-L180 HydrophobicContact CB-CD2 4.36Å; I177-L180 HydrophobicContact CG2-CD2 3.7Å; I177-L180 HydrophobicContact CG2-CG 4.47Å; I177-I206 HydrophobicContact CD1-CD1 3.54Å
178	H	92.2	Very high	88.7	Confident	48 Å²	48	49.9 Å²	49.9	22%	0.222	26%	0.261	C	S	.	.			trans	-94.6	144.3	178.1	-65.6	-68.8	0	0	0	111.3	D136 N166 T168 L176	D136-H178 VanDerWaalsContact OD1-CA 3.29Å; D136-H178 WeakPolarHBondContact OD1-CA 3.4Å; D136-H178 IonicContact OD1-ND1 2.74Å; D136-H178 IonicContact OD2-CE1 2.71Å; D136-H178 IonicContact OD2-ND1 3.3Å; D136-H178 PolarHBondContact OD2-ND1 3.06Å; N166-H178 PolarHBondContact O-N 2.97Å; T168-H178 VanDerWaalsContact CG2-NE2 3.33Å; T168-H178 WeakPolarHBondContact CG2-NE2 3.27Å; T168-H178 PolarHBondContact OG1-NE2 3.14Å; L176-H178 WeakPolarHBondContact CD2-CE1 3.35Å
179	S	87.9	Confident	88.6	Confident	78 Å²	78	46.8 Å²	46.8	55%	0.545	24%	0.242	S	C	.	.	S	Bend	trans	46.6	68.2	170.7	-59.5	0	0	0	0	113.3	D136 H181	D136-S179 PolarHBondContact OD1-N 3.21Å; S179-H181 PolarHBondContact O-N 2.82Å
180	L	88.2	Confident	88.7	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.223	C	C	.	.			trans	-53.5	136.9	-178.5	-76.7	172.3	0	0	0	112.5	R131 E133 G134 D135 F137 I177 F184 I206 V208	R131-L180 HydrophobicContact CB-CD1 3.48Å; R131-L180 VanDerWaalsContact CB-CD1 3.48Å; R131-L180 HydrophobicContact CG-CD1 3.93Å; E133-L180 CarbonylContact C-O 3.56Å; E133-L180 VanDerWaalsContact CA-O 3.29Å; E133-L180 WeakPolarHBondContact CA-O 3.19Å; G134-L180 PolarHBondContact N-O 2.78Å; D135-L180 HydrophobicContact CB-CD1 4.47Å; D135-L180 VanDerWaalsContact O-CB 3.32Å; D135-L180 WeakPolarHBondContact O-CB 3.34Å; D135-L180 WeakPolarHBondContact O-CG 3.4Å; D135-L180 PolarHBondContact O-N 3.13Å; F137-L180 HydrophobicContact CB-CD1 3.69Å; F137-L180 HydrophobicContact CB-CG 4.34Å; I177-L180 HydrophobicContact CB-CD2 4.36Å; I177-L180 HydrophobicContact CG2-CD2 3.7Å; I177-L180 HydrophobicContact CG2-CG 4.47Å; L180-F184 HydrophobicContact CD2-CD2 4.35Å; L180-I206 HydrophobicContact CD2-CG2 4.23Å; L180-V208 HydrophobicContact CB-CG1 4.12Å; L180-V208 HydrophobicContact CB-CG2 3.96Å; L180-V208 HydrophobicContact CD1-CG2 4.43Å; L180-V208 HydrophobicContact CD2-CG2 4.13Å; L180-V208 HydrophobicContact CG-CG2 4.42Å
181	H	84.6	Confident	88.9	Confident	77 Å²	77	41.5 Å²	41.5	36%	0.356	21%	0.212	S	C	.	.			trans	-124.1	147.6	179.7	-172.5	-98.2	0	0	0	110.6	S179 S183 F184	S179-H181 PolarHBondContact O-N 2.82Å; H181-S183 WeakPolarHBondContact ND1-CB 3.37Å; H181-S183 PolarHBondContact ND1-N 2.54Å; H181-S183 PolarHBondContact ND1-OG 2.84Å; H181-S183 PolarHBondContact O-N 3.21Å; H181-S183 VanDerWaalsContact O-N 3.13Å; H181-F184 HydrophobicContact CB-CD1 4.32Å; H181-F184 HydrophobicContact CB-CD2 3.88Å; H181-F184 HydrophobicContact CB-CE1 4.09Å; H181-F184 HydrophobicContact CB-CE2 3.62Å; H181-F184 HydrophobicContact CB-CG 4.2Å; H181-F184 HydrophobicContact CB-CZ 3.73Å; H181-F184 VanDerWaalsContact O-CB 3.27Å; H181-F184 WeakPolarHBondContact O-CB 3.26Å; H181-F184 WeakPolarHBondContact O-CG 3.42Å; H181-F184 PolarHBondContact O-N 2.75Å
182	P	80.6	Confident	89.2	Confident	34 Å²	34	36 Å²	36	22%	0.221	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-55.7	-26.9	179	-29.3	37.1	0	0	0	115.6	F184 N185 V208 Q210	P182-F184 PolarHBondContact O-N 2.96Å; P182-N185 WeakPolarHBondContact O-CB 3.46Å; P182-N185 PolarHBondContact O-N 3.12Å; P182-N185 PolarHBondContact O-ND2 2.82Å; P182-N185 PolarHBondContact O-OD1 2.8Å; P182-V208 HydrophobicContact CG-CG1 4.5Å; P182-Q210 HydrophobicContact CG-CB 4.2Å; P182-Q210 HydrophobicContact CG-CG 4.33Å
183	S	81.6	Confident	89.4	Confident	69 Å²	69	37.1 Å²	37.1	48%	0.483	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-68.5	-13.1	173.5	65.2	0	0	0	0	113.6	H181 N185	H181-S183 WeakPolarHBondContact ND1-CB 3.37Å; H181-S183 PolarHBondContact ND1-N 2.54Å; H181-S183 PolarHBondContact ND1-OG 2.84Å; H181-S183 PolarHBondContact O-N 3.21Å; H181-S183 VanDerWaalsContact O-N 3.13Å; S183-N185 PolarHBondContact O-N 3.02Å
184	F	88.3	Confident	89.6	Confident	10 Å²	10	30.9 Å²	30.9	4%	0.044	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-86.2	15.4	176.2	-51.1	-19.8	0	0	0	112.4	P162 M165 L180 H181 P182 A186 Y188	P162-F184 HydrophobicContact CB-CD1 4.17Å; P162-F184 HydrophobicContact CG-CD1 4.45Å; M165-F184 HydrophobicContact CB-CD1 4.21Å; M165-F184 HydrophobicContact CB-CE1 3.83Å; M165-F184 HydrophobicContact CB-CE2 4.32Å; M165-F184 HydrophobicContact CB-CZ 3.9Å; M165-F184 HydrophobicContact CE-CB 3.95Å; M165-F184 HydrophobicContact CE-CD2 4.06Å; M165-F184 HydrophobicContact CE-CG 4.02Å; M165-F184 HydrophobicContact CG-CD1 4.46Å; M165-F184 HydrophobicContact CG-CD2 4.24Å; M165-F184 HydrophobicContact CG-CE1 4.4Å; M165-F184 HydrophobicContact CG-CE2 4.18Å; M165-F184 HydrophobicContact CG-CG 4.41Å; M165-F184 HydrophobicContact CG-CZ 4.27Å; L180-F184 HydrophobicContact CD2-CD2 4.35Å; H181-F184 HydrophobicContact CB-CD1 4.32Å; H181-F184 HydrophobicContact CB-CD2 3.88Å; H181-F184 HydrophobicContact CB-CE1 4.09Å; H181-F184 HydrophobicContact CB-CE2 3.62Å; H181-F184 HydrophobicContact CB-CG 4.2Å; H181-F184 HydrophobicContact CB-CZ 3.73Å; H181-F184 VanDerWaalsContact O-CB 3.27Å; H181-F184 WeakPolarHBondContact O-CB 3.26Å; H181-F184 WeakPolarHBondContact O-CG 3.42Å; H181-F184 PolarHBondContact O-N 2.75Å; P182-F184 PolarHBondContact O-N 2.96Å; F184-A186 PolarHBondContact O-N 3.12Å; F184-A186 VanDerWaalsContact O-N 3.09Å; F184-Y188 WeakPolarHBondContact CA-OH 3.36Å; F184-Y188 VanDerWaalsContact O-CE2 3.26Å; F184-Y188 WeakPolarHBondContact O-CE2 3.47Å; F184-Y188 PolarHBondContact O-OH 3.06Å; F184-Y188 VanDerWaalsContact O-OH 3.07Å
185	N	86.5	Confident	89.4	Confident	75 Å²	75	38.4 Å²	38.4	40%	0.401	22%	0.215	S	C	.	.			trans	-74.1	98.6	177.3	-74	-5.1	0	0	0	110.5	P182 S183 I206 V208	P182-N185 WeakPolarHBondContact O-CB 3.46Å; P182-N185 PolarHBondContact O-N 3.12Å; P182-N185 PolarHBondContact O-ND2 2.82Å; P182-N185 PolarHBondContact O-OD1 2.8Å; S183-N185 PolarHBondContact O-N 3.02Å; N185-I206 WeakPolarHBondContact CA-O 3.4Å; N185-V208 WeakPolarHBondContact OD1-CA 3.41Å; N185-V208 WeakPolarHBondContact OD1-CB 3.18Å; N185-V208 PolarHBondContact OD1-N 2.82Å
186	A	88.6	Confident	88.9	Confident	24 Å²	24	41.6 Å²	41.6	20%	0.198	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	177.4	179.5	0	0	0	0	0	112.3	M155 F184 Y188 I206	M155-A186 HydrophobicContact CE-CB 3.28Å; F184-A186 PolarHBondContact O-N 3.12Å; F184-A186 VanDerWaalsContact O-N 3.09Å; A186-Y188 HydrophobicContact CB-CD2 4.4Å; A186-Y188 HydrophobicContact CB-CE2 3.75Å; A186-Y188 WeakPolarHBondContact O-CD2 3.29Å; A186-I206 PolarHBondContact N-O 3.02Å; A186-I206 PolarHBondContact O-N 2.94Å
187	D	91.6	Very high	88.6	Confident	71 Å²	71	43.2 Å²	43.2	38%	0.38	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.2	168.7	-69.2	-33.8	0	0	0	110.3	D156 A203 F204 S205	D156-D187 HydrophobicContact CB-CB 3.9Å; D156-D187 PolarHBondContact N-O 3.39Å; D187-A203 HydrophobicContact CB-CB 4.36Å; D187-F204 WeakPolarHBondContact CA-O 3.35Å; D187-S205 WeakPolarHBondContact OD1-CA 3.43Å; D187-S205 WeakPolarHBondContact OD1-CB 3.33Å; D187-S205 PolarHBondContact OD1-OG 2.82Å
188	Y	92.6	Very high	88.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.2	-178.1	-63.6	-89.8	0	0	0	112.6	L153 R154 M155 V161 P162 M165 F184 A186 A203 F204 I206	L153-Y188 HydrophobicContact CD2-CD1 4.2Å; L153-Y188 HydrophobicContact CG-CD1 4.25Å; R154-Y188 WeakPolarHBondContact O-CA 3.46Å; M155-Y188 HydrophobicContact CG-CD1 4.15Å; M155-Y188 HydrophobicContact CG-CE1 3.9Å; V161-Y188 HydrophobicContact CG1-CD1 4.35Å; V161-Y188 HydrophobicContact CG1-CE1 4.24Å; P162-Y188 WeakPolarHBondContact CD-OH 3.25Å; P162-Y188 WeakPolarHBondContact CG-OH 3.41Å; M165-Y188 HydrophobicContact CE-CE1 3.97Å; M165-Y188 HydrophobicContact CE-CE2 4.24Å; M165-Y188 HydrophobicContact SD-CE1 3.77Å; F184-Y188 WeakPolarHBondContact CA-OH 3.36Å; F184-Y188 VanDerWaalsContact O-CE2 3.26Å; F184-Y188 WeakPolarHBondContact O-CE2 3.47Å; F184-Y188 PolarHBondContact O-OH 3.06Å; F184-Y188 VanDerWaalsContact O-OH 3.07Å; A186-Y188 HydrophobicContact CB-CD2 4.4Å; A186-Y188 HydrophobicContact CB-CE2 3.75Å; A186-Y188 WeakPolarHBondContact O-CD2 3.29Å; Y188-A203 CarbonylContact O-C 3.55Å; Y188-A203 WeakPolarHBondContact O-CA 3.49Å; Y188-F204 PolarHBondContact N-O 2.85Å; Y188-F204 PolarHBondContact O-N 3.1Å; Y188-I206 HydrophobicContact CD2-CB 4.27Å; Y188-I206 HydrophobicContact CD2-CD1 3.55Å; Y188-I206 HydrophobicContact CD2-CG1 3.86Å; Y188-I206 HydrophobicContact CE2-CB 4.2Å; Y188-I206 HydrophobicContact CE2-CD1 3.87Å; Y188-I206 HydrophobicContact CE2-CG1 4.24Å; Y188-I206 HydrophobicContact CG-CD1 4.38Å
189	V	93.1	Very high	88.3	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138	174.7	-66.8	0	0	0	0	110.5	R154 D156 T200 A203	R154-V189 HydrophobicContact CG-CG2 3.68Å; R154-V189 PolarHBondContact N-O 3.11Å; R154-V189 PolarHBondContact O-N 2.02Å; D156-V189 HydrophobicContact CB-CG1 4.26Å; D156-V189 VanDerWaalsContact OD1-CG1 3.32Å; D156-V189 WeakPolarHBondContact OD1-CG1 3.47Å; V189-T200 HydrophobicContact CG2-CG2 4.34Å; V189-A203 HydrophobicContact CG1-CB 4.02Å
190	C	93.2	Very high	88.5	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	139.5	169.5	-57.5	0	0	0	0	109.5	F120 C141 G152 I175 T200 S201	F120-C190 HydrophobicContact CD1-CB 4.45Å; F120-C190 HydrophobicContact CE1-CB 4.07Å; F120-C190 WeakPolarHBondContact CE2-O 3.07Å; F120-C190 HydrophobicContact CZ-CB 4.12Å; C141-C190 HydrophobicContact CB-CB 3.55Å; C141-C190 WeakPolarHBondContact CB-SG 3.44Å; C141-C190 WeakPolarHBondContact SG-CB 3.27Å; C141-C190 CovalentContact SG-SG 2.03Å; C141-C190 PolarHBondContact SG-SG 3.27Å; G152-C190 CarbonylContact O-C 3.57Å; G152-C190 WeakPolarHBondContact O-CA 3.41Å; I175-C190 HydrophobicContact CD1-CB 4.23Å; C190-T200 CarbonylContact O-C 3.6Å; C190-T200 VanDerWaalsContact O-CA 3.26Å; C190-T200 WeakPolarHBondContact O-CA 3.48Å; C190-S201 PolarHBondContact N-OG 2.68Å; C190-S201 PolarHBondContact O-N 2.88Å
191	T	92.5	Very high	88.6	Confident	14 Å²	14	51.5 Å²	51.5	9%	0.086	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.1	-176.8	57.8	0	0	0	0	110.5	L151 G152 R154 E198 R199 T200	L151-T191 VanDerWaalsContact CA-O 3.29Å; L151-T191 WeakPolarHBondContact CA-O 3.41Å; L151-T191 WeakPolarHBondContact CD1-O 3.31Å; G152-T191 PolarHBondContact N-O 2.8Å; G152-T191 PolarHBondContact O-N 2.87Å; G152-T191 PolarHBondContact O-OG1 3.25Å; R154-T191 HydrophobicContact CB-CG2 4.36Å; R154-T191 HydrophobicContact CG-CG2 3.48Å; R154-T191 VanDerWaalsContact CG-CG2 3.48Å; T191-E198 WeakPolarHBondContact CG2-OE1 3.38Å; T191-R199 WeakPolarHBondContact CA-O 3Å; T191-T200 HydrophobicContact CG2-CG2 4.2Å
192	A	92.7	Very high	88.9	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	150.6	167	0	0	0	0	0	110.2	F120 L143 A148 L151 R199	F120-A192 HydrophobicContact CE2-CB 4Å; F120-A192 HydrophobicContact CZ-CB 3.53Å; L143-A192 HydrophobicContact CD1-CB 4.17Å; A148-A192 HydrophobicContact CB-CB 3.94Å; L151-A192 HydrophobicContact CD1-CB 4.21Å; A192-R199 PolarHBondContact N-O 2.88Å; A192-R199 PolarHBondContact O-N 3.13Å
193	K	90.3	Very high	89.3	Confident	83 Å²	83	54 Å²	54	36%	0.361	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.9	174.4	-68.8	-176.2	-169.7	154.3	0	110.8	A148 T149 D150 V197	A148-K193 CarbonylContact C-O 3.52Å; A148-K193 VanDerWaalsContact CA-O 3.27Å; A148-K193 WeakPolarHBondContact CA-O 3.38Å; T149-K193 PolarHBondContact N-O 3.17Å; T149-K193 PolarHBondContact O-N 2.91Å; D150-K193 HydrophobicContact CB-CD 4.33Å; D150-K193 HydrophobicContact CB-CG 4.33Å; D150-K193 VanDerWaalsContact OD2-CD 3.31Å; D150-K193 WeakPolarHBondContact OD2-CD 3.48Å; D150-K193 VanDerWaalsContact OD2-CE 3.3Å; D150-K193 WeakPolarHBondContact OD2-CE 3Å; D150-K193 IonicContact OD2-NZ 3.87Å; D150-K193 PolarHBondContact OD2-NZ 3.1Å; K193-V197 WeakPolarHBondContact CA-O 3.34Å
194	V	88.6	Confident	89.8	Confident	19 Å²	19	50.8 Å²	50.8	12%	0.115	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120	172.6	-178.6	0	0	0	0	107.8	V119 A148 G196 V197	V119-V194 HydrophobicContact CG1-CG2 3.77Å; V119-V194 HydrophobicContact CG2-CG2 4.15Å; A148-V194 HydrophobicContact CB-CG2 3.63Å; V194-G196 PolarHBondContact O-N 2.82Å; V194-V197 PolarHBondContact N-O 2.87Å; V194-V197 PolarHBondContact O-N 2.8Å; V194-V197 VanDerWaalsContact O-N 3.08Å
195	N	86	Confident	89.9	Confident	158 Å²	158	52.3 Å²	52.3	85%	0.845	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	38.6	-174.8	-55.6	-25.4	0	0	0	113	V197	N195-V197 PolarHBondContact O-N 3.42Å
196	G	81.2	Confident	90	Very high	67 Å²	67	49 Å²	49	69%	0.691	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-7.5	-178.6	0	0	0	0	0	115.6	V194	V194-G196 PolarHBondContact O-N 2.82Å
197	V	87.4	Confident	89.9	Confident	77 Å²	77	51.8 Å²	51.8	47%	0.467	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125.7	178.4	-177.7	0	0	0	0	110	K193 V194 N195	K193-V197 WeakPolarHBondContact CA-O 3.34Å; V194-V197 PolarHBondContact N-O 2.87Å; V194-V197 PolarHBondContact O-N 2.8Å; V194-V197 VanDerWaalsContact O-N 3.08Å; N195-V197 PolarHBondContact O-N 3.42Å
198	E	88.8	Confident	89.5	Confident	89 Å²	89	48.6 Å²	48.6	42%	0.416	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	132.4	173.4	-166.5	-169.3	-142.4	0	0	110.3	R154 T191	R154-E198 IonicContact CZ-OE2 2.65Å; R154-E198 IonicContact NE-OE1 2.71Å; R154-E198 PolarHBondContact NE-OE1 2.91Å; R154-E198 IonicContact NE-OE2 3.83Å; R154-E198 IonicContact NH2-OE1 3.33Å; R154-E198 IonicContact NH2-OE2 2.65Å; R154-E198 PolarHBondContact NH2-OE2 3.33Å; T191-E198 WeakPolarHBondContact CG2-OE1 3.38Å
199	R	90.3	Very high	88.7	Confident	131 Å²	131	51.8 Å²	51.8	49%	0.494	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.4	174.4	-63.1	-65.2	-170.5	174.5	0.5	108.6	V119 F120 T191 A192	V119-R199 HydrophobicContact CB-CB 4.16Å; V119-R199 HydrophobicContact CG1-CB 4.34Å; V119-R199 HydrophobicContact CG2-CB 4.07Å; V119-R199 HydrophobicContact CG2-CG 3.97Å; F120-R199 WeakPolarHBondContact CE2-O 3.49Å; T191-R199 WeakPolarHBondContact CA-O 3Å; A192-R199 PolarHBondContact N-O 2.88Å; A192-R199 PolarHBondContact O-N 3.13Å
200	T	91.3	Very high	87.7	Confident	69 Å²	69	57.1 Å²	57.1	42%	0.423	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	154.8	-176.8	56.4	0	0	0	0	112.3	R154 V189 C190 T191	R154-T200 VanDerWaalsContact NH2-CG2 3.3Å; V189-T200 HydrophobicContact CG2-CG2 4.34Å; C190-T200 CarbonylContact O-C 3.6Å; C190-T200 VanDerWaalsContact O-CA 3.26Å; C190-T200 WeakPolarHBondContact O-CA 3.48Å; T191-T200 HydrophobicContact CG2-CG2 4.2Å
201	S	91.5	Very high	86.6	Confident	12 Å²	12	63 Å²	63	8%	0.084	34%	0.335	C	S	.	.			trans	-78.9	177.1	168.4	73.8	0	0	0	0	111.7	C190	C190-S201 PolarHBondContact N-OG 2.68Å; C190-S201 PolarHBondContact O-N 2.88Å
202	K	90	Very high	85.6	Confident	134 Å²	134	62.9 Å²	62.9	58%	0.583	33%	0.333	S	S	*	.			trans	-63.9	150.2	161.1	-64.6	-174.2	175.7	-172.3	0	110.2	L127 F204	L127-K202 HydrophobicContact CD1-CD 4.34Å; L127-K202 HydrophobicContact CD2-CB 3.84Å; K202-F204 WeakPolarHBondContact O-CD2 3.19Å
203	A	90.5	Very high	84.5	Confident	31 Å²	31	69.7 Å²	69.7	26%	0.256	36%	0.359	S	S	.	.			trans	-68.3	137.3	177.5	0	0	0	0	0	112.4	L127 D156 D187 Y188 V189	L127-A203 WeakPolarHBondContact CD2-O 3.41Å; D156-A203 HydrophobicContact CB-CB 4.33Å; D187-A203 HydrophobicContact CB-CB 4.36Å; Y188-A203 CarbonylContact O-C 3.55Å; Y188-A203 WeakPolarHBondContact O-CA 3.49Å; V189-A203 HydrophobicContact CG1-CB 4.02Å
204	F	91.5	Very high	83.5	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	110.8	174.2	-64.4	-87.8	0	0	0	108.9	T122 S126 L127 L139 P140 C141 D187 Y188 K202 I206	T122-F204 HydrophobicContact CG2-CE1 4.3Å; T122-F204 HydrophobicContact CG2-CE2 3.98Å; T122-F204 HydrophobicContact CG2-CZ 3.4Å; S126-F204 VanDerWaalsContact O-CD1 3.28Å; S126-F204 WeakPolarHBondContact O-CD1 3.44Å; L127-F204 HydrophobicContact CD2-CD1 4.29Å; L127-F204 HydrophobicContact CD2-CE1 4.31Å; L127-F204 CarbonylContact O-C 3.57Å; L127-F204 WeakPolarHBondContact O-CA 3.4Å; L139-F204 HydrophobicContact CD2-CB 3.65Å; L139-F204 HydrophobicContact CD2-CD1 3.8Å; L139-F204 HydrophobicContact CD2-CD2 3.82Å; L139-F204 HydrophobicContact CD2-CE1 4.32Å; L139-F204 HydrophobicContact CD2-CE2 4.32Å; L139-F204 HydrophobicContact CD2-CG 3.51Å; P140-F204 HydrophobicContact CG-CE1 4.19Å; C141-F204 HydrophobicContact CB-CE2 4.08Å; C141-F204 HydrophobicContact CB-CZ 4.19Å; D187-F204 WeakPolarHBondContact CA-O 3.35Å; Y188-F204 PolarHBondContact N-O 2.85Å; Y188-F204 PolarHBondContact O-N 3.1Å; K202-F204 WeakPolarHBondContact O-CD2 3.19Å; F204-I206 PolarHBondContact O-N 3.14Å
205	S	90	Very high	83.1	Confident	42 Å²	42	74 Å²	74	29%	0.294	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	107.3	173	-50.7	0	0	0	0	109.8	L127 V129 D187	L127-S205 PolarHBondContact O-N 2.88Å; V129-S205 PolarHBondContact N-O 2.84Å; D187-S205 WeakPolarHBondContact OD1-CA 3.43Å; D187-S205 WeakPolarHBondContact OD1-CB 3.33Å; D187-S205 PolarHBondContact OD1-OG 2.82Å
206	I	89.4	Confident	82.9	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.036	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.5	175.9	-56.4	-177.9	0	0	0	108.5	L139 I177 L180 N185 A186 Y188 F204 V208	L139-I206 HydrophobicContact CD2-CD1 4.28Å; I177-I206 HydrophobicContact CD1-CD1 3.54Å; L180-I206 HydrophobicContact CD2-CG2 4.23Å; N185-I206 WeakPolarHBondContact CA-O 3.4Å; A186-I206 PolarHBondContact N-O 3.02Å; A186-I206 PolarHBondContact O-N 2.94Å; Y188-I206 HydrophobicContact CD2-CB 4.27Å; Y188-I206 HydrophobicContact CD2-CD1 3.55Å; Y188-I206 HydrophobicContact CD2-CG1 3.86Å; Y188-I206 HydrophobicContact CE2-CB 4.2Å; Y188-I206 HydrophobicContact CE2-CD1 3.87Å; Y188-I206 HydrophobicContact CE2-CG1 4.24Å; Y188-I206 HydrophobicContact CG-CD1 4.38Å; F204-I206 PolarHBondContact O-N 3.14Å; I206-V208 HydrophobicContact CG2-CG2 3.89Å
207	N	86.1	Confident	82.7	Confident	82 Å²	82	65.2 Å²	65.2	44%	0.439	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	109.9	172	-174.4	-1.3	0	0	0	109	V129 V130 R131	V129-N207 PolarHBondContact O-N 2.86Å; V130-N207 VanDerWaalsContact CA-O 3.28Å; V130-N207 WeakPolarHBondContact CA-O 3.4Å; V130-N207 HydrophobicContact CG2-CB 4.46Å; R131-N207 PolarHBondContact N-O 2.79Å; R131-N207 VanDerWaalsContact N-O 3.1Å
208	V	83.1	Confident	82.6	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.024	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.8	179	-173.3	0	0	0	0	108.4	R131 E133 L180 P182 N185 I206	R131-V208 CarbonylContact O-C 3.54Å; R131-V208 VanDerWaalsContact O-CA 3.32Å; R131-V208 WeakPolarHBondContact O-CA 3.29Å; E133-V208 HydrophobicContact CB-CG1 4.25Å; L180-V208 HydrophobicContact CB-CG1 4.12Å; L180-V208 HydrophobicContact CB-CG2 3.96Å; L180-V208 HydrophobicContact CD1-CG2 4.43Å; L180-V208 HydrophobicContact CD2-CG2 4.13Å; L180-V208 HydrophobicContact CG-CG2 4.42Å; P182-V208 HydrophobicContact CG-CG1 4.5Å; N185-V208 WeakPolarHBondContact OD1-CA 3.41Å; N185-V208 WeakPolarHBondContact OD1-CB 3.18Å; N185-V208 PolarHBondContact OD1-N 2.82Å; I206-V208 HydrophobicContact CG2-CG2 3.89Å
209	I	75.4	Confident	82.2	Confident	66 Å²	66	60.4 Å²	60.4	34%	0.338	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	123.7	173.7	-57.4	177.1	0	0	0	107.9	V130 R131 K132 E133	V130-I209 HydrophobicContact CG1-CD1 3.31Å; V130-I209 HydrophobicContact CG1-CG1 3.75Å; R131-I209 PolarHBondContact O-N 2.89Å; K132-I209 CarbonylContact C-O 3.59Å; K132-I209 WeakPolarHBondContact CA-O 3.2Å; E133-I209 PolarHBondContact N-O 3.13Å
210	Q	71.3	Confident	81.8	Confident	114 Å²	114	54.4 Å²	54.4	53%	0.533	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-59.1	136.6	176	-167.1	175.8	16.3	0	0	110.9	E133 P182	E133-Q210 WeakPolarHBondContact OE2-CG 3.31Å; P182-Q210 HydrophobicContact CG-CB 4.2Å; P182-Q210 HydrophobicContact CG-CG 4.33Å
211	K	71.8	Confident	80.8	Confident	124 Å²	124	56.4 Å²	56.4	54%	0.539	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-75.8	128.5	175.4	-175.8	177.8	178.4	-177.9	0	109.1	E133 R213	E133-K211 HydrophobicContact CB-CB 4.28Å; E133-K211 PolarHBondContact OE2-N 2.9Å; E133-K211 VanDerWaalsContact OE2-N 3.13Å; K211-R213 PolarHBondContact O-N 2.74Å
212	L	70.1	Confident	79.9	Confident	11 Å²	11	57.6 Å²	57.6	6%	0.058	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-69.5	126.7	176.3	-62.7	173.9	0	0	0	109.1	P242 N243 N297 E298 A299	L212-P242 HydrophobicContact CD2-CB 3.82Å; L212-P242 HydrophobicContact CD2-CG 3.71Å; L212-N243 WeakPolarHBondContact CD1-ND2 3.45Å; L212-N297 HydrophobicContact CD1-CB 4Å; L212-E298 HydrophobicContact CB-CG 3.79Å; L212-E298 HydrophobicContact CD1-CG 4.02Å; L212-E298 HydrophobicContact CG-CG 4.25Å; L212-E298 PolarHBondContact N-OE1 2.86Å; L212-A299 HydrophobicContact CB-CB 4.17Å; L212-A299 WeakPolarHBondContact O-CB 3.44Å
213	R	71.1	Confident	79.2	Confident	143 Å²	143	54.9 Å²	54.9	54%	0.54	27%	0.267	S	S	.	.			trans	-103	-19.2	179.8	-60.4	-177.1	-172.5	-178.4	2.5	112.8	E133 K211	E133-R213 IonicContact OE1-NH2 3.79Å; E133-R213 PolarHBondContact OE1-NH2 2.03Å; K211-R213 PolarHBondContact O-N 2.74Å
214	F	69	Low	78.9	Confident	154 Å²	154	55.9 Å²	55.9	68%	0.675	27%	0.267	S	S	*	.	S	Bend	trans	-126.2	146.6	-177.1	-57.5	-72.7	0	0	0	110.5	N297 A299	F214-N297 PolarHBondContact O-ND2 2.82Å; F214-A299 VanDerWaalsContact C-CB 3.5Å; F214-A299 WeakPolarHBondContact O-CB 3.29Å
215	P	79.9	Confident	78.7	Confident	38 Å²	38	56.9 Å²	56.9	25%	0.247	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-60.6	159.9	169.9	30.5	-36.7	0	0	0	110.6	N297 N302	P215-N297 WeakPolarHBondContact CA-OD1 3.41Å; P215-N302 HydrophobicContact CB-CB 3.91Å; P215-N302 HydrophobicContact CG-CB 4.05Å
216	P	81.9	Confident	78.7	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-64.7	144.2	-177.9	29.9	-33.3	0	0	0	109.2	H240 N241 Y246 G295 N297 N302	P216-H240 CarbonylContact C-O 3.54Å; P216-H240 WeakPolarHBondContact CA-O 3.39Å; P216-N241 HydrophobicContact CB-CB 4.12Å; P216-Y246 HydrophobicContact CB-CD2 3.58Å; P216-Y246 HydrophobicContact CB-CE2 4.06Å; P216-Y246 HydrophobicContact CB-CG 4.28Å; P216-Y246 HydrophobicContact CG-CD2 4.06Å; P216-G295 WeakPolarHBondContact CG-O 3.45Å; P216-N297 VanDerWaalsContact CD-CG 3.47Å; P216-N297 HydrophobicContact CG-CB 4.4Å; P216-N302 WeakPolarHBondContact O-CB 3.28Å; P216-N302 PolarHBondContact O-ND2 3.43Å
217	Y	76.7	Confident	78.8	Confident	40 Å²	40	57.5 Å²	57.5	16%	0.157	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	137.9	175.9	-178.9	-105.4	0	0	0	109.5	F219 T239 H240 F695	Y217-F219 HydrophobicContact CE1-CB 3.71Å; Y217-T239 CarbonylContact O-C 3.56Å; Y217-T239 WeakPolarHBondContact O-CA 2.94Å; Y217-T239 WeakPolarHBondContact O-CB 3.25Å; Y217-H240 PolarHBondContact N-O 3.37Å; Y217-H240 PolarHBondContact O-N 3.12Å; Y217-F695 AromaticContact CD1-CE2 3.78Å; Y217-F695 HydrophobicContact CD1-CE2 3.78Å; Y217-F695 HydrophobicContact CD1-CZ 4.04Å; Y217-F695 HydrophobicContact CD2-CD1 4.38Å; Y217-F695 HydrophobicContact CD2-CD2 4.45Å; Y217-F695 AromaticContact CD2-CE1 3.66Å; Y217-F695 HydrophobicContact CD2-CE1 3.66Å; Y217-F695 AromaticContact CD2-CE2 3.72Å; Y217-F695 HydrophobicContact CD2-CE2 3.72Å; Y217-F695 AromaticContact CD2-CZ 3.24Å; Y217-F695 HydrophobicContact CD2-CZ 3.24Å; Y217-F695 AromaticContact CE1-CD2 3.62Å; Y217-F695 HydrophobicContact CE1-CD2 3.62Å; Y217-F695 AromaticContact CE1-CE2 3.17Å; Y217-F695 HydrophobicContact CE1-CE2 3.17Å; Y217-F695 AromaticContact CE1-CZ 3.8Å; Y217-F695 HydrophobicContact CE1-CZ 3.8Å; Y217-F695 AromaticContact CE2-CD1 3.52Å; Y217-F695 HydrophobicContact CE2-CD1 3.52Å; Y217-F695 AromaticContact CE2-CD2 3.48Å; Y217-F695 HydrophobicContact CE2-CD2 3.48Å; Y217-F695 VanDerWaalsContact CE2-CD2 3.48Å; Y217-F695 AromaticContact CE2-CE1 3.22Å; Y217-F695 HydrophobicContact CE2-CE1 3.22Å; Y217-F695 AromaticContact CE2-CE2 3.16Å; Y217-F695 HydrophobicContact CE2-CE2 3.16Å; Y217-F695 AromaticContact CE2-CG 3.6Å; Y217-F695 HydrophobicContact CE2-CG 3.6Å; Y217-F695 AromaticContact CE2-CZ 3Å; Y217-F695 HydrophobicContact CE2-CZ 3Å; Y217-F695 HydrophobicContact CG-CE2 4.04Å; Y217-F695 AromaticContact CG-CZ 3.81Å; Y217-F695 HydrophobicContact CG-CZ 3.81Å; Y217-F695 AromaticContact CZ-CD1 3.94Å; Y217-F695 AromaticContact CZ-CD2 2.99Å; Y217-F695 AromaticContact CZ-CE1 3.87Å; Y217-F695 AromaticContact CZ-CE2 2.88Å; Y217-F695 AromaticContact CZ-CG 3.5Å; Y217-F695 VanDerWaalsContact CZ-CG 3.5Å; Y217-F695 AromaticContact CZ-CZ 3.35Å; Y217-F695 WeakPolarHBondContact OH-CD2 3.41Å; Y217-F695 VanDerWaalsContact OH-CE2 3.25Å; Y217-F695 WeakPolarHBondContact OH-CE2 3.45Å; Y217-F695 WeakPolarHBondContact OH-CG 3.38Å
218	V	84.6	Confident	79.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	134.3	-175.9	-177.9	0	0	0	0	108.5	T239 C293 N302 T304	V218-T239 HydrophobicContact CB-CG2 4.32Å; V218-T239 HydrophobicContact CG1-CG2 4.09Å; V218-T239 HydrophobicContact CG2-CG2 3.96Å; V218-C293 HydrophobicContact CG1-CB 3.95Å; V218-N302 HydrophobicContact CG2-CB 4.33Å; V218-T304 PolarHBondContact O-OG1 2.93Å
219	F	80	Confident	79.5	Confident	65 Å²	65	57.3 Å²	57.3	29%	0.285	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	133.2	-175.9	177.5	-105	0	0	0	111.5	Y217 E221 C237 T238	Y217-F219 HydrophobicContact CE1-CB 3.71Å; F219-E221 HydrophobicContact CE1-CG 4.21Å; F219-C237 CarbonylContact O-C 3.59Å; F219-C237 WeakPolarHBondContact O-CA 3.28Å; F219-T238 WeakPolarHBondContact CB-O 3.04Å; F219-T238 PolarHBondContact N-O 3.01Å; F219-T238 PolarHBondContact O-N 3.2Å
220	L	82	Confident	80.3	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.026	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.6	168.4	-67.9	172.3	0	0	0	109	T222 I235 R236 C237 W250 C293 T304 T306	L220-T222 VanDerWaalsContact C-N 3.26Å; L220-T222 PolarHBondContact O-N 3.14Å; L220-I235 HydrophobicContact CD2-CG2 4.07Å; L220-R236 WeakPolarHBondContact CD2-O 3.46Å; L220-C237 HydrophobicContact CD2-CB 3.7Å; L220-W250 HydrophobicContact CD2-CH2 3.55Å; L220-W250 HydrophobicContact CD2-CZ3 3.89Å; L220-C293 HydrophobicContact CD2-CB 4.05Å; L220-C293 HydrophobicContact CG-CB 4.39Å; L220-T304 HydrophobicContact CB-CG2 4.04Å; L220-T304 HydrophobicContact CD1-CG2 3.91Å; L220-T304 WeakPolarHBondContact CD1-O 3.41Å; L220-T304 HydrophobicContact CG-CG2 3.97Å; L220-T306 HydrophobicContact CD1-CG2 3.95Å
221	E	71	Confident	81.2	Confident	111 Å²	111	54 Å²	54	52%	0.519	26%	0.264	S	S	.	.	S	Bend	trans	-68.7	-22.8	-176.4	-66.9	-179.1	156.6	0	0	113.8	F219 R236	F219-E221 HydrophobicContact CE1-CG 4.21Å; E221-R236 WeakPolarHBondContact OE1-CD 3.32Å; E221-R236 IonicContact OE1-NE 2.84Å; E221-R236 PolarHBondContact OE1-NE 3.29Å; E221-R236 IonicContact OE2-NE 3.04Å
222	T	73.6	Confident	82.3	Confident	38 Å²	38	52.6 Å²	52.6	23%	0.233	26%	0.259	C	S	.	.			trans	-149.9	135.9	-170	-1.5	0	0	0	0	111	L220 Y225 T306	L220-T222 VanDerWaalsContact C-N 3.26Å; L220-T222 PolarHBondContact O-N 3.14Å; T222-Y225 WeakPolarHBondContact OG1-CE2 3.48Å; T222-Y225 PolarHBondContact OG1-OH 3.01Å; T222-T306 VanDerWaalsContact O-CB 3.28Å; T222-T306 WeakPolarHBondContact O-CB 3.45Å; T222-T306 PolarHBondContact O-OG1 3.11Å
223	D	73.9	Confident	83.3	Confident	77 Å²	77	52.1 Å²	52.1	41%	0.412	26%	0.256	S	S	.	.	S	Bend	trans	-81.2	-25.7	-177.1	-54.5	-44.3	0	0	0	113.1	T306 Y307	D223-T306 WeakPolarHBondContact O-CA 3.14Å; D223-T306 PolarHBondContact O-OG1 3.22Å; D223-T306 VanDerWaalsContact O-OG1 3.1Å; D223-Y307 PolarHBondContact O-N 3.09Å
224	E	83.9	Confident	84.3	Confident	51 Å²	51	50.8 Å²	50.8	24%	0.238	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	131.4	179.7	-175.3	179.5	-127.1	0	0	111.3	Y307 N377	E224-Y307 CarbonylContact C-O 3.58Å; E224-Y307 VanDerWaalsContact CA-O 3.3Å; E224-Y307 WeakPolarHBondContact CA-O 3.29Å; E224-Y307 HydrophobicContact CG-CD1 4.41Å; E224-N377 PolarHBondContact O-ND2 2.71Å
225	Y	87.4	Confident	85.3	Confident	22 Å²	22	43.5 Å²	43.5	9%	0.086	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.7	172.5	-69.8	-96.5	0	0	0	109.9	T222 I233 I235 T306 Y307 L309	T222-Y225 WeakPolarHBondContact OG1-CE2 3.48Å; T222-Y225 PolarHBondContact OG1-OH 3.01Å; Y225-I233 HydrophobicContact CD1-CD1 3.67Å; Y225-I233 HydrophobicContact CD1-CG1 4.26Å; Y225-I233 HydrophobicContact CE1-CD1 4.47Å; Y225-I233 HydrophobicContact CG-CD1 3.71Å; Y225-I235 HydrophobicContact CD2-CD1 4.39Å; Y225-I235 HydrophobicContact CD2-CG1 4.45Å; Y225-I235 HydrophobicContact CE2-CD1 4.45Å; Y225-I235 HydrophobicContact CE2-CG1 4.18Å; Y225-I235 HydrophobicContact CE2-CG2 4.01Å; Y225-T306 HydrophobicContact CD2-CG2 4.24Å; Y225-T306 WeakPolarHBondContact CD2-OG1 3.39Å; Y225-T306 HydrophobicContact CE2-CG2 4.16Å; Y225-Y307 PolarHBondContact N-O 3.27Å; Y225-L309 PolarHBondContact O-N 2.86Å
226	I	89.7	Confident	85.8	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.3	172.9	-53.5	178.2	0	0	0	108	L309 V311 Y350 N378	I226-L309 VanDerWaalsContact CA-O 3.31Å; I226-L309 WeakPolarHBondContact CA-O 3.39Å; I226-L309 HydrophobicContact CG1-CB 4.36Å; I226-L309 HydrophobicContact CG1-CD2 4.46Å; I226-V311 HydrophobicContact CG2-CG2 4.43Å; I226-Y350 HydrophobicContact CB-CD2 3.8Å; I226-Y350 HydrophobicContact CB-CE2 4.18Å; I226-Y350 HydrophobicContact CB-CG 4.03Å; I226-Y350 HydrophobicContact CG2-CD1 3.88Å; I226-Y350 HydrophobicContact CG2-CD2 3.88Å; I226-Y350 HydrophobicContact CG2-CE1 4.47Å; I226-Y350 HydrophobicContact CG2-CE2 4.47Å; I226-Y350 HydrophobicContact CG2-CG 3.55Å; I226-Y350 WeakPolarHBondContact O-CE2 3.25Å; I226-Y350 PolarHBondContact O-OH 3.31Å; I226-Y350 VanDerWaalsContact O-OH 3.13Å; I226-N378 HydrophobicContact CD1-CB 3.75Å; I226-N378 WeakPolarHBondContact CD1-ND2 3.27Å; I226-N378 WeakPolarHBondContact CG1-ND2 3.15Å
227	R	91.7	Very high	86.1	Confident	55 Å²	55	45.1 Å²	45.1	21%	0.208	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.7	176.6	-71.9	-68.2	177.8	-85.1	2.5	111.2	E231 E232 I233 V283 L308 L309 V310 V311 Y350	R227-E231 WeakPolarHBondContact CA-OE2 3.38Å; R227-E231 HydrophobicContact CB-CB 4.49Å; R227-E231 VanDerWaalsContact CD-OE2 3.25Å; R227-E231 WeakPolarHBondContact CD-OE2 3.19Å; R227-E232 PolarHBondContact NE-O 3.4Å; R227-I233 HydrophobicContact CG-CB 4.11Å; R227-I233 HydrophobicContact CG-CD1 4.02Å; R227-I233 HydrophobicContact CG-CG1 4.44Å; R227-V283 HydrophobicContact CB-CG2 3.73Å; R227-L308 HydrophobicContact CG-CD1 4.39Å; R227-L309 PolarHBondContact N-O 3.33Å; R227-V310 CarbonylContact O-C 3.57Å; R227-V310 WeakPolarHBondContact O-CA 2.99Å; R227-V311 PolarHBondContact O-N 2.96Å; R227-Y350 WeakPolarHBondContact CD-OH 3.29Å; R227-Y350 PolarHBondContact NH1-OH 2.8Å
228	I	92.2	Very high	86.6	Confident	21 Å²	21	45 Å²	45	11%	0.108	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	145.6	170.6	-62.2	155.9	0	0	0	108.6	G230 E231 V283 V311 P314 Y350 P351 L405	I228-G230 PolarHBondContact O-N 2.95Å; I228-E231 HydrophobicContact CB-CG 4.26Å; I228-E231 PolarHBondContact N-OE2 2.94Å; I228-E231 WeakPolarHBondContact O-CB 3.3Å; I228-E231 WeakPolarHBondContact O-CG 3.28Å; I228-E231 PolarHBondContact O-N 3.36Å; I228-V283 WeakPolarHBondContact O-CG2 3.43Å; I228-V311 WeakPolarHBondContact CA-O 3.45Å; I228-V311 HydrophobicContact CG1-CG2 3.99Å; I228-P314 HydrophobicContact CD1-CB 4.11Å; I228-Y350 HydrophobicContact CD1-CD1 4.01Å; I228-Y350 HydrophobicContact CD1-CE1 3.95Å; I228-Y350 HydrophobicContact CG1-CD1 3.83Å; I228-Y350 HydrophobicContact CG1-CE1 3.79Å; I228-P351 HydrophobicContact CD1-CG 4.11Å; I228-L405 HydrophobicContact CD1-CD1 4.17Å
229	V	93.2	Very high	86.6	Confident	61 Å²	61	45 Å²	45	37%	0.37	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	126.7	175.5	175.8	0	0	0	0	110.9	V283 L285 V310 V311	V229-V283 WeakPolarHBondContact CA-O 3.46Å; V229-L285 HydrophobicContact CG2-CD2 3.77Å; V229-L285 HydrophobicContact CG2-CG 3.68Å; V229-V310 HydrophobicContact CG2-CG1 3.83Å; V229-V311 PolarHBondContact N-O 3.27Å
230	G	90.3	Very high	86.5	Confident	49 Å²	49	43.9 Å²	43.9	51%	0.505	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	-9.1	-179.6	0	0	0	0	0	115.8	I228 V283	I228-G230 PolarHBondContact O-N 2.95Å; G230-V283 PolarHBondContact N-O 3.05Å
231	E	92.1	Very high	86.2	Confident	63 Å²	63	43.7 Å²	43.7	29%	0.294	22%	0.221	S	C	.	.			trans	-76.3	153.5	176.2	-67.7	-176.5	145.7	0	0	113	R227 I228 A282 V283 Y350	R227-E231 WeakPolarHBondContact CA-OE2 3.38Å; R227-E231 HydrophobicContact CB-CB 4.49Å; R227-E231 VanDerWaalsContact CD-OE2 3.25Å; R227-E231 WeakPolarHBondContact CD-OE2 3.19Å; I228-E231 HydrophobicContact CB-CG 4.26Å; I228-E231 PolarHBondContact N-OE2 2.94Å; I228-E231 WeakPolarHBondContact O-CB 3.3Å; I228-E231 WeakPolarHBondContact O-CG 3.28Å; I228-E231 PolarHBondContact O-N 3.36Å; E231-A282 WeakPolarHBondContact O-CA 3.48Å; E231-V283 PolarHBondContact O-N 3.31Å; E231-Y350 PolarHBondContact OE2-OH 3.39Å; E231-Y350 VanDerWaalsContact OE2-OH 3.14Å
232	E	93.1	Very high	86	Confident	94 Å²	94	41.2 Å²	41.2	44%	0.439	22%	0.215	S	C	.	.			trans	-83.1	140.7	170.5	179.1	175.6	-111.3	0	0	110.8	R227 K234 T279 I280 S281	R227-E232 PolarHBondContact NE-O 3.4Å; E232-K234 IonicContact OE1-NZ 3Å; E232-K234 WeakPolarHBondContact OE2-CE 3.09Å; E232-K234 IonicContact OE2-NZ 3.27Å; E232-K234 PolarHBondContact OE2-NZ 2.85Å; E232-T279 HydrophobicContact CG-CG2 4.28Å; E232-I280 WeakPolarHBondContact CA-O 3.33Å; E232-S281 WeakPolarHBondContact CA-O 3.47Å; E232-S281 WeakPolarHBondContact CB-O 3.47Å
233	I	91.9	Very high	85.8	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.2	171	-172.8	170.7	0	0	0	111.7	Y225 R227 I235 T279 I280 V283 L308	Y225-I233 HydrophobicContact CD1-CD1 3.67Å; Y225-I233 HydrophobicContact CD1-CG1 4.26Å; Y225-I233 HydrophobicContact CE1-CD1 4.47Å; Y225-I233 HydrophobicContact CG-CD1 3.71Å; R227-I233 HydrophobicContact CG-CB 4.11Å; R227-I233 HydrophobicContact CG-CD1 4.02Å; R227-I233 HydrophobicContact CG-CG1 4.44Å; I233-I235 HydrophobicContact CD1-CD1 4.18Å; I233-I235 HydrophobicContact CD1-CG1 4.05Å; I233-I235 HydrophobicContact CG1-CG1 4.02Å; I233-T279 CarbonylContact O-C 3.51Å; I233-T279 VanDerWaalsContact O-CA 3.31Å; I233-T279 WeakPolarHBondContact O-CA 3.4Å; I233-I280 HydrophobicContact CG2-CB 3.74Å; I233-I280 HydrophobicContact CG2-CD1 4.24Å; I233-I280 HydrophobicContact CG2-CG1 4.29Å; I233-I280 PolarHBondContact N-O 2.98Å; I233-I280 PolarHBondContact O-N 2.79Å; I233-V283 HydrophobicContact CB-CG1 4.37Å; I233-V283 HydrophobicContact CG2-CG1 3.51Å; I233-L308 HydrophobicContact CD1-CD1 3.6Å
234	K	92.2	Very high	85.4	Confident	115 Å²	115	45.1 Å²	45.1	50%	0.5	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.7	174.3	-66	177.9	-179.8	147.9	0	108.5	E232 I277 L278 T279	E232-K234 IonicContact OE1-NZ 3Å; E232-K234 WeakPolarHBondContact OE2-CE 3.09Å; E232-K234 IonicContact OE2-NZ 3.27Å; E232-K234 PolarHBondContact OE2-NZ 2.85Å; K234-I277 HydrophobicContact CB-CG2 4.29Å; K234-L278 CarbonylContact C-O 3.41Å; K234-L278 WeakPolarHBondContact CA-O 3.35Å; K234-T279 HydrophobicContact CG-CG2 3.84Å
235	I	90.9	Very high	84.8	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.1	179.7	-53.8	-179.9	0	0	0	107.4	L220 Y225 I233 W250 I277 L278 I291 T306	L220-I235 HydrophobicContact CD2-CG2 4.07Å; Y225-I235 HydrophobicContact CD2-CD1 4.39Å; Y225-I235 HydrophobicContact CD2-CG1 4.45Å; Y225-I235 HydrophobicContact CE2-CD1 4.45Å; Y225-I235 HydrophobicContact CE2-CG1 4.18Å; Y225-I235 HydrophobicContact CE2-CG2 4.01Å; I233-I235 HydrophobicContact CD1-CD1 4.18Å; I233-I235 HydrophobicContact CD1-CG1 4.05Å; I233-I235 HydrophobicContact CG1-CG1 4.02Å; I235-W250 HydrophobicContact CB-CH2 4.28Å; I235-W250 HydrophobicContact CG2-CH2 3.77Å; I235-W250 HydrophobicContact CG2-CZ3 4.09Å; I235-I277 CarbonylContact O-C 3.56Å; I235-I277 WeakPolarHBondContact O-CA 3.4Å; I235-L278 HydrophobicContact CB-CB 4.45Å; I235-L278 HydrophobicContact CD1-CD2 4.4Å; I235-L278 PolarHBondContact N-O 3.02Å; I235-L278 PolarHBondContact O-N 2.86Å; I235-I291 HydrophobicContact CD1-CD1 3.49Å; I235-I291 VanDerWaalsContact CD1-CD1 3.49Å; I235-I291 HydrophobicContact CD1-CG2 4.31Å; I235-T306 HydrophobicContact CD1-CG2 4.18Å; I235-T306 HydrophobicContact CG2-CG2 4.05Å
236	R	89.6	Confident	84.5	Confident	74 Å²	74	46.9 Å²	46.9	28%	0.279	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.4	-179	-174.8	-165.8	-62.2	-78	-8.1	110	L220 E221 Q275 I277	L220-R236 WeakPolarHBondContact CD2-O 3.46Å; E221-R236 WeakPolarHBondContact OE1-CD 3.32Å; E221-R236 IonicContact OE1-NE 2.84Å; E221-R236 PolarHBondContact OE1-NE 3.29Å; E221-R236 IonicContact OE2-NE 3.04Å; R236-Q275 VanDerWaalsContact CD-NE2 3.28Å; R236-Q275 HydrophobicContact CG-CG 4.18Å; R236-I277 HydrophobicContact CG-CG1 4.22Å
237	C	88.1	Confident	84.3	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.2	168	-179.8	0	0	0	0	109.8	F219 L220 W250 Q275 S276 C293	F219-C237 CarbonylContact O-C 3.59Å; F219-C237 WeakPolarHBondContact O-CA 3.28Å; L220-C237 HydrophobicContact CD2-CB 3.7Å; C237-W250 HydrophobicContact CB-CH2 3.53Å; C237-W250 HydrophobicContact CB-CZ2 3.28Å; C237-Q275 CarbonylContact O-C 3.53Å; C237-Q275 WeakPolarHBondContact O-CA 3.28Å; C237-S276 PolarHBondContact N-O 2.76Å; C237-S276 PolarHBondContact O-N 2.89Å; C237-C293 HydrophobicContact CB-CB 3.63Å; C237-C293 WeakPolarHBondContact CB-SG 3.43Å; C237-C293 WeakPolarHBondContact SG-CB 3.36Å; C237-C293 CovalentContact SG-SG 2.02Å; C237-C293 PolarHBondContact SG-SG 2.8Å
238	T	86.7	Confident	84.2	Confident	38 Å²	38	48.2 Å²	48.2	23%	0.233	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.8	173	-55.4	0	0	0	0	107.8	F219	F219-T238 WeakPolarHBondContact CB-O 3.04Å; F219-T238 PolarHBondContact N-O 3.01Å; F219-T238 PolarHBondContact O-N 3.2Å
239	T	84.5	Confident	84.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144	177.6	63.4	0	0	0	0	110.4	Y217 V218 Y246 V248 D273 I274	Y217-T239 CarbonylContact O-C 3.56Å; Y217-T239 WeakPolarHBondContact O-CA 2.94Å; Y217-T239 WeakPolarHBondContact O-CB 3.25Å; V218-T239 HydrophobicContact CB-CG2 4.32Å; V218-T239 HydrophobicContact CG1-CG2 4.09Å; V218-T239 HydrophobicContact CG2-CG2 3.96Å; T239-Y246 PolarHBondContact O-OH 3.27Å; T239-Y246 VanDerWaalsContact O-OH 3.11Å; T239-Y246 WeakPolarHBondContact OG1-CE2 3.33Å; T239-V248 HydrophobicContact CG2-CB 4.42Å; T239-V248 HydrophobicContact CG2-CG1 3.83Å; T239-V248 HydrophobicContact CG2-CG2 3.65Å; T239-V248 WeakPolarHBondContact OG1-CG2 3.45Å; T239-D273 CarbonylContact O-C 3.58Å; T239-D273 VanDerWaalsContact O-CA 3.28Å; T239-D273 WeakPolarHBondContact O-CA 3.39Å; T239-I274 PolarHBondContact N-O 3.31Å; T239-I274 PolarHBondContact O-N 2.71Å; T239-I274 WeakPolarHBondContact OG1-CB 3.1Å; T239-I274 PolarHBondContact OG1-O 3.34Å; T239-I274 VanDerWaalsContact OG1-O 3.12Å
240	H	78.8	Confident	84.1	Confident	41 Å²	41	48.6 Å²	48.6	19%	0.19	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.1	179.2	164.7	-93.6	0	0	0	109.8	P216 Y217 R271 D273	P216-H240 CarbonylContact C-O 3.54Å; P216-H240 WeakPolarHBondContact CA-O 3.39Å; Y217-H240 PolarHBondContact N-O 3.37Å; Y217-H240 PolarHBondContact O-N 3.12Å; H240-R271 PolarHBondContact NE2-NE 3.45Å; H240-D273 IonicContact CD2-OD1 2.75Å; H240-D273 PolarHBondContact CD2-OD1 3.44Å; H240-D273 IonicContact CG-OD1 3.42Å
241	N	74.9	Confident	84	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	147.3	171.7	-166.7	58.6	0	0	0	109.7	P216 N243 Y246 L272 N297	P216-N241 HydrophobicContact CB-CB 4.12Å; N241-N243 PolarHBondContact ND2-N 2.8Å; N241-N243 PolarHBondContact ND2-O 3.27Å; N241-N243 PolarHBondContact ND2-OD1 2.89Å; N241-N243 VanDerWaalsContact ND2-OD1 3.14Å; N241-N243 PolarHBondContact O-N 2.84Å; N241-N243 VanDerWaalsContact O-N 3.13Å; N241-Y246 HydrophobicContact CB-CD1 3.24Å; N241-Y246 HydrophobicContact CB-CD2 3.76Å; N241-Y246 HydrophobicContact CB-CE1 3.23Å; N241-Y246 HydrophobicContact CB-CE2 3.72Å; N241-Y246 HydrophobicContact CB-CG 3.49Å; N241-Y246 VanDerWaalsContact CB-CG 3.49Å; N241-Y246 VanDerWaalsContact CB-CZ 3.44Å; N241-Y246 VanDerWaalsContact ND2-CD1 3.31Å; N241-Y246 WeakPolarHBondContact ND2-CD1 3.24Å; N241-L272 PolarHBondContact N-O 3.13Å; N241-N297 PolarHBondContact OD1-ND2 2.85Å
242	P	68	Low	83.8	Confident	59 Å²	59	54.1 Å²	54.1	38%	0.383	26%	0.257	S	S	.	.	S	Bend	trans	-62.4	-15.9	177.4	-24.6	34.2	0	0	0	115.3	L212	L212-P242 HydrophobicContact CD2-CB 3.82Å; L212-P242 HydrophobicContact CD2-CG 3.71Å
243	N	68.3	Low	82.9	Confident	27 Å²	27	54.1 Å²	54.1	14%	0.144	26%	0.264	C	S	.	.	S	Bend	trans	-147.5	175.2	178.3	66.4	42.7	0	0	0	112.5	L212 N241 N245 Y246	L212-N243 WeakPolarHBondContact CD1-ND2 3.45Å; N241-N243 PolarHBondContact ND2-N 2.8Å; N241-N243 PolarHBondContact ND2-O 3.27Å; N241-N243 PolarHBondContact ND2-OD1 2.89Å; N241-N243 VanDerWaalsContact ND2-OD1 3.14Å; N241-N243 PolarHBondContact O-N 2.84Å; N241-N243 VanDerWaalsContact O-N 3.13Å; N243-N245 PolarHBondContact O-N 3.1Å; N243-N245 WeakPolarHBondContact OD1-CA 3.24Å; N243-N245 WeakPolarHBondContact OD1-CB 3.17Å; N243-N245 PolarHBondContact OD1-N 2.76Å; N243-Y246 WeakPolarHBondContact O-CD1 2.98Å; N243-Y246 WeakPolarHBondContact O-CE1 3.46Å
244	F	66.5	Low	81.9	Confident	171 Å²	171	54.9 Å²	54.9	75%	0.75	27%	0.269	S	S	*	.	S	Bend	trans	-72.9	-5.4	-178.4	62.6	-95.6	0	0	0	114.4	Y246 L272	F244-Y246 VanDerWaalsContact C-N 3.33Å; F244-Y246 PolarHBondContact O-N 3.18Å; F244-Y246 VanDerWaalsContact O-N 3.17Å; F244-L272 HydrophobicContact CB-CD1 3.86Å
245	N	71.5	Confident	80.8	Confident	89 Å²	89	58.2 Å²	58.2	48%	0.476	28%	0.283	S	S	.	.			trans	-94.7	62.2	-170.4	-165.6	37	0	0	0	111.7	N243	N243-N245 PolarHBondContact O-N 3.1Å; N243-N245 WeakPolarHBondContact OD1-CA 3.24Å; N243-N245 WeakPolarHBondContact OD1-CB 3.17Å; N243-N245 PolarHBondContact OD1-N 2.76Å
246	Y	80.1	Confident	80.1	Confident	21 Å²	21	59.9 Å²	59.9	8%	0.082	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	156.6	173.4	76.2	-67.4	0	0	0	109.9	P216 T239 N241 N243 F244 V248 L272 I274 T296	P216-Y246 HydrophobicContact CB-CD2 3.58Å; P216-Y246 HydrophobicContact CB-CE2 4.06Å; P216-Y246 HydrophobicContact CB-CG 4.28Å; P216-Y246 HydrophobicContact CG-CD2 4.06Å; T239-Y246 PolarHBondContact O-OH 3.27Å; T239-Y246 VanDerWaalsContact O-OH 3.11Å; T239-Y246 WeakPolarHBondContact OG1-CE2 3.33Å; N241-Y246 HydrophobicContact CB-CD1 3.24Å; N241-Y246 HydrophobicContact CB-CD2 3.76Å; N241-Y246 HydrophobicContact CB-CE1 3.23Å; N241-Y246 HydrophobicContact CB-CE2 3.72Å; N241-Y246 HydrophobicContact CB-CG 3.49Å; N241-Y246 VanDerWaalsContact CB-CG 3.49Å; N241-Y246 VanDerWaalsContact CB-CZ 3.44Å; N241-Y246 VanDerWaalsContact ND2-CD1 3.31Å; N241-Y246 WeakPolarHBondContact ND2-CD1 3.24Å; N243-Y246 WeakPolarHBondContact O-CD1 2.98Å; N243-Y246 WeakPolarHBondContact O-CE1 3.46Å; F244-Y246 VanDerWaalsContact C-N 3.33Å; F244-Y246 PolarHBondContact O-N 3.18Å; F244-Y246 VanDerWaalsContact O-N 3.17Å; Y246-V248 HydrophobicContact CE2-CG2 4.24Å; Y246-L272 PolarHBondContact OH-O 3.02Å; Y246-I274 HydrophobicContact CD1-CD1 4.34Å; Y246-I274 HydrophobicContact CD2-CD1 4.49Å; Y246-I274 HydrophobicContact CE1-CD1 3.76Å; Y246-I274 HydrophobicContact CE1-CG1 4.19Å; Y246-I274 HydrophobicContact CE2-CD1 3.94Å; Y246-I274 HydrophobicContact CE2-CG1 4.4Å; Y246-I274 WeakPolarHBondContact OH-CG1 3.11Å; Y246-I274 PolarHBondContact OH-N 3.3Å; Y246-T296 CarbonylContact C-O 3.49Å; Y246-T296 WeakPolarHBondContact CA-O 3.43Å; Y246-T296 VanDerWaalsContact CB-O 3.24Å; Y246-T296 WeakPolarHBondContact CB-O 3.2Å
247	N	85.6	Confident	79.6	Confident	76 Å²	76	65.9 Å²	65.9	41%	0.406	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	160.2	177.5	69.7	26.6	0	0	0	110.9	G295 T296	N247-G295 CarbonylContact O-C 3.6Å; N247-G295 VanDerWaalsContact O-CA 3.29Å; N247-G295 WeakPolarHBondContact O-CA 3.39Å; N247-T296 PolarHBondContact N-O 3.34Å; N247-T296 PolarHBondContact ND2-OG1 3.13Å; N247-T296 PolarHBondContact O-N 2.88Å; N247-T296 WeakPolarHBondContact OD1-CB 3.41Å; N247-T296 WeakPolarHBondContact OD1-CG2 3.41Å; N247-T296 PolarHBondContact OD1-N 3.08Å; N247-T296 PolarHBondContact OD1-OG1 3.48Å
248	V	90.1	Very high	79.4	Confident	13 Å²	13	66.7 Å²	66.7	8%	0.079	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.5	172.8	-172.4	0	0	0	0	107.7	T239 Y246 I274 C293 I294	T239-V248 HydrophobicContact CG2-CB 4.42Å; T239-V248 HydrophobicContact CG2-CG1 3.83Å; T239-V248 HydrophobicContact CG2-CG2 3.65Å; T239-V248 WeakPolarHBondContact OG1-CG2 3.45Å; Y246-V248 HydrophobicContact CE2-CG2 4.24Å; V248-I274 HydrophobicContact CB-CG2 4.49Å; V248-I274 HydrophobicContact CG2-CB 4.01Å; V248-I274 HydrophobicContact CG2-CD1 4.12Å; V248-I274 HydrophobicContact CG2-CG2 3.83Å; V248-C293 VanDerWaalsContact CG1-SG 3.58Å; V248-I294 CarbonylContact C-O 3.58Å; V248-I294 WeakPolarHBondContact CA-O 3.48Å
249	T	91.2	Very high	79.6	Confident	63 Å²	63	72.8 Å²	72.8	39%	0.387	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	152.6	-179.7	57.2	0	0	0	0	110.2	I294	T249-I294 PolarHBondContact N-O 2.88Å; T249-I294 PolarHBondContact O-N 2.76Å; T249-I294 PolarHBondContact OG1-O 3.04Å
250	W	91	Very high	79.9	Confident	26 Å²	26	76.2 Å²	76.2	10%	0.098	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.5	176.3	-71.2	90.3	0	0	0	110.5	L220 I235 C237 Y252 I260 S276 L278 I291 S292 C293	L220-W250 HydrophobicContact CD2-CH2 3.55Å; L220-W250 HydrophobicContact CD2-CZ3 3.89Å; I235-W250 HydrophobicContact CB-CH2 4.28Å; I235-W250 HydrophobicContact CG2-CH2 3.77Å; I235-W250 HydrophobicContact CG2-CZ3 4.09Å; C237-W250 HydrophobicContact CB-CH2 3.53Å; C237-W250 HydrophobicContact CB-CZ2 3.28Å; W250-Y252 HydrophobicContact CB-CD1 4.11Å; W250-Y252 HydrophobicContact CB-CE1 4.29Å; W250-I260 HydrophobicContact CB-CD1 4.2Å; W250-I260 HydrophobicContact CG-CD1 4.28Å; W250-S276 PolarHBondContact NE1-OG 2.81Å; W250-L278 HydrophobicContact CB-CD1 3.95Å; W250-L278 HydrophobicContact CD2-CB 4.01Å; W250-L278 HydrophobicContact CD2-CD1 3.66Å; W250-L278 HydrophobicContact CD2-CG 4.49Å; W250-L278 HydrophobicContact CE3-CB 4.29Å; W250-L278 HydrophobicContact CE3-CD1 3.71Å; W250-L278 HydrophobicContact CG-CD1 3.81Å; W250-L278 HydrophobicContact CH2-CB 4.12Å; W250-L278 HydrophobicContact CZ2-CB 3.85Å; W250-L278 HydrophobicContact CZ3-CB 4.35Å; W250-L278 HydrophobicContact CZ3-CD1 4.36Å; W250-I291 HydrophobicContact CE3-CG2 3.62Å; W250-I291 HydrophobicContact CZ3-CG2 3.67Å; W250-S292 CarbonylContact C-O 3.59Å; W250-S292 WeakPolarHBondContact CA-O 3.26Å; W250-C293 HydrophobicContact CD2-CB 4.32Å; W250-C293 HydrophobicContact CE3-CB 3.99Å; W250-C293 HydrophobicContact CH2-CB 4.06Å; W250-C293 HydrophobicContact CZ2-CB 4.35Å; W250-C293 HydrophobicContact CZ3-CB 3.85Å
251	K	89.9	Confident	80.4	Confident	142 Å²	142	78.2 Å²	78.2	62%	0.617	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.7	170.6	-178.6	-178.4	-178.9	-177	0	108.5	I291 S292 I294	K251-I291 CarbonylContact O-C 3.54Å; K251-S292 PolarHBondContact N-O 2.98Å; K251-S292 PolarHBondContact O-N 2.93Å; K251-I294 HydrophobicContact CB-CD1 3.71Å; K251-I294 HydrophobicContact CD-CD1 4.31Å
252	Y	87.9	Confident	81	Confident	86 Å²	86	83.4 Å²	83.4	34%	0.337	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	154.7	-178.3	47.9	-92.9	0	0	0	109.7	W250 T254 P258 L278	W250-Y252 HydrophobicContact CB-CD1 4.11Å; W250-Y252 HydrophobicContact CB-CE1 4.29Å; Y252-T254 VanDerWaalsContact CD2-OG1 3.22Å; Y252-T254 WeakPolarHBondContact CD2-OG1 3.44Å; Y252-P258 HydrophobicContact CD1-CG 4.04Å; Y252-P258 HydrophobicContact CD2-CG 4.28Å; Y252-P258 HydrophobicContact CE1-CG 3.53Å; Y252-P258 HydrophobicContact CE2-CG 3.79Å; Y252-P258 HydrophobicContact CG-CG 4.39Å; Y252-P258 VanDerWaalsContact CZ-CD 3.48Å; Y252-L278 HydrophobicContact CD1-CD1 4.05Å
253	T	74.2	Confident	81.7	Confident	95 Å²	95	83.7 Å²	83.7	58%	0.583	40%	0.399	S	S	*	.			trans	-100.6	1.2	-178	44.3	0	0	0	0	112.9	N290	T253-N290 PolarHBondContact OG1-O 2.84Å
254	T	70.5	Confident	82.3	Confident	16 Å²	16	87.4 Å²	87.4	10%	0.098	42%	0.423	C	S	.	.			trans	-72.1	149.3	-173.6	71.5	0	0	0	0	112.4	Y252 S256 I280 D287	Y252-T254 VanDerWaalsContact CD2-OG1 3.22Å; Y252-T254 WeakPolarHBondContact CD2-OG1 3.44Å; T254-S256 PolarHBondContact OG1-O 3.33Å; T254-I280 HydrophobicContact CG2-CD1 4.43Å; T254-D287 VanDerWaalsContact CB-OD1 3.29Å; T254-D287 WeakPolarHBondContact CB-OD1 3.49Å; T254-D287 HydrophobicContact CG2-CB 3.81Å; T254-D287 WeakPolarHBondContact CG2-O 3.36Å
255	K	68.2	Low	82.5	Confident	185 Å²	185	85.9 Å²	85.9	80%	0.804	41%	0.412	S	S	*	.	S	Bend	trans	-83.8	-27.6	170.2	-75.2	-174.5	-180	176.3	0	111.9	D287	K255-D287 PolarHBondContact N-OD1 3.04Å
256	S	76.3	Confident	82	Confident	35 Å²	35	85.9 Å²	85.9	25%	0.245	42%	0.419	C	S	.	.	S	Bend	trans	-62.2	136.1	172	-64.4	0	0	0	0	110.2	T254 P258 D287	T254-S256 PolarHBondContact OG1-O 3.33Å; S256-P258 WeakPolarHBondContact O-CD 3.47Å; S256-D287 VanDerWaalsContact CB-OD1 3.29Å; S256-D287 WeakPolarHBondContact CB-OD1 3.39Å; S256-D287 VanDerWaalsContact CB-OD2 3.31Å; S256-D287 WeakPolarHBondContact CB-OD2 3.36Å; S256-D287 PolarHBondContact N-OD1 3.28Å; S256-D287 VanDerWaalsContact OG-CG 3.23Å; S256-D287 PolarHBondContact OG-OD1 2.99Å; S256-D287 PolarHBondContact OG-OD2 2.9Å
257	K	78.7	Confident	80.7	Confident	200 Å²	200	88.7 Å²	88.7	87%	0.87	44%	0.436	S	S	*	.			trans	-85.4	106.4	175.3	-72.6	-175	179.6	-179.5	0	109.3
258	P	85.6	Confident	79	Confident	18 Å²	18	88.5 Å²	88.5	12%	0.117	45%	0.451	C	S	.	.			trans	-72.4	153	178.9	29.6	-34.3	0	0	0	111.9	Y252 S256 L278 T279 I280	Y252-P258 HydrophobicContact CD1-CG 4.04Å; Y252-P258 HydrophobicContact CD2-CG 4.28Å; Y252-P258 HydrophobicContact CE1-CG 3.53Å; Y252-P258 HydrophobicContact CE2-CG 3.79Å; Y252-P258 HydrophobicContact CG-CG 4.39Å; Y252-P258 VanDerWaalsContact CZ-CD 3.48Å; S256-P258 WeakPolarHBondContact O-CD 3.47Å; P258-L278 HydrophobicContact CB-CD1 4.18Å; P258-L278 HydrophobicContact CB-CD2 3.84Å; P258-L278 HydrophobicContact CB-CG 3.75Å; P258-L278 HydrophobicContact CG-CD1 4.13Å; P258-L278 HydrophobicContact CG-CG 4.26Å; P258-T279 CarbonylContact C-O 3.53Å; P258-T279 WeakPolarHBondContact CA-O 3.32Å; P258-I280 HydrophobicContact CB-CG1 4.02Å
259	R	89.8	Confident	77	Confident	165 Å²	165	96.4 Å²	96.4	62%	0.623	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	130.2	168.1	177.2	177.4	170.7	166.4	-1.3	109	E261 T279	R259-E261 IonicContact CZ-OE1 2.84Å; R259-E261 IonicContact NE-OE1 3.11Å; R259-E261 PolarHBondContact NE-OE1 3.02Å; R259-E261 IonicContact NH2-OE1 3.37Å; R259-E261 PolarHBondContact NH2-OE1 3.36Å; R259-T279 PolarHBondContact N-O 2.99Å; R259-T279 PolarHBondContact O-N 2.8Å
260	I	90.4	Very high	75.2	Confident	72 Å²	72	100.6 Å²	100.6	37%	0.369	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129	-178.7	-59.5	165.5	0	0	0	108.8	W250 E262 S276 I277	W250-I260 HydrophobicContact CB-CD1 4.2Å; W250-I260 HydrophobicContact CG-CD1 4.28Å; I260-E262 HydrophobicContact CG2-CG 4.39Å; I260-S276 WeakPolarHBondContact CG2-OG 3.38Å; I260-I277 WeakPolarHBondContact CA-O 3.25Å
261	E	89.5	Confident	73.4	Confident	83 Å²	83	106.4 Å²	106.4	39%	0.388	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131	177.1	-62.6	-174	167.5	0	0	110.2	R259 S276 I277	R259-E261 IonicContact CZ-OE1 2.84Å; R259-E261 IonicContact NE-OE1 3.11Å; R259-E261 PolarHBondContact NE-OE1 3.02Å; R259-E261 IonicContact NH2-OE1 3.37Å; R259-E261 PolarHBondContact NH2-OE1 3.36Å; E261-S276 CarbonylContact O-C 3.49Å; E261-S276 WeakPolarHBondContact O-CA 3.08Å; E261-I277 PolarHBondContact N-O 2.89Å; E261-I277 PolarHBondContact O-N 2.94Å
262	E	88.3	Confident	72.3	Confident	109 Å²	109	101.5 Å²	101.5	51%	0.509	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.4	-177.6	-64.4	-174.3	159.2	0	0	111.1	I260 Q275 S276	I260-E262 HydrophobicContact CG2-CG 4.39Å; E262-Q275 CarbonylContact C-O 3.5Å; E262-Q275 WeakPolarHBondContact CA-O 3.36Å; E262-S276 PolarHBondContact OE1-OG 2.84Å
263	T	83.4	Confident	71.7	Confident	65 Å²	65	98.4 Å²	98.4	40%	0.399	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	127.8	177.1	53.3	0	0	0	0	109.2	Q275	T263-Q275 PolarHBondContact N-O 2.82Å; T263-Q275 PolarHBondContact O-N 2.91Å; T263-Q275 WeakPolarHBondContact OG1-CB 3.25Å; T263-Q275 PolarHBondContact OG1-O 3.32Å
264	V	79.9	Confident	72.1	Confident	105 Å²	105	95 Å²	95	64%	0.636	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.4	178.7	-174.2	0	0	0	0	108.5	L272 I274	V264-L272 HydrophobicContact CG1-CD2 4.47Å; V264-I274 HydrophobicContact CG2-CG1 4.4Å
265	R	70.6	Confident	72.9	Confident	139 Å²	139	95.2 Å²	95.2	53%	0.525	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.4	173	-61.4	-173.2	-172.8	-156.7	2.9	109.1	D273	R265-D273 PolarHBondContact N-O 2.87Å; R265-D273 PolarHBondContact O-N 3.49Å
266	S	60.9	Low	74	Confident	90 Å²	90	86.4 Å²	86.4	63%	0.629	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	104.8	176.7	-176.8	0	0	0	0	108.1
267	N	52.1	Low	74.8	Confident	80 Å²	80	86.2 Å²	86.2	43%	0.428	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	115.7	169.9	-68.3	-7	0	0	0	105.7	E269	N267-E269 PolarHBondContact O-N 2.83Å
268	G	50.4	Low	75.5	Confident	71 Å²	71	76.8 Å²	76.8	73%	0.732	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	136.1	-173.1	0	0	0	0	0	112.4
269	E	48.1	Very low	75.8	Confident	179 Å²	179	76.4 Å²	76.4	84%	0.836	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	78.9	-170.7	-55.4	-172.7	171.3	0	0	115.3	N267 R271	N267-E269 PolarHBondContact O-N 2.83Å; E269-R271 PolarHBondContact O-N 2.84Å
270	N	52.9	Low	75.9	Confident	151 Å²	151	68.8 Å²	68.8	81%	0.807	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	22.7	160.8	-68.1	-13.3	0	0	0	117.3
271	R	54.1	Low	75.9	Confident	149 Å²	149	69.3 Å²	69.3	56%	0.562	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	120.7	176.6	-63.1	-177.8	85.5	152.8	8.7	110.1	H240 E269	H240-R271 PolarHBondContact NE2-NE 3.45Å; E269-R271 PolarHBondContact O-N 2.84Å
272	L	65.8	Low	75.9	Confident	38 Å²	38	68 Å²	68	20%	0.199	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	120.2	-179.4	-72.3	168.2	0	0	0	109.3	N241 F244 Y246 V264	N241-L272 PolarHBondContact N-O 3.13Å; F244-L272 HydrophobicContact CB-CD1 3.86Å; Y246-L272 PolarHBondContact OH-O 3.02Å; V264-L272 HydrophobicContact CG1-CD2 4.47Å
273	D	75.8	Confident	76.1	Confident	22 Å²	22	63 Å²	63	12%	0.118	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126	179	-61.1	-25.7	0	0	0	109.4	T239 H240 R265	T239-D273 CarbonylContact O-C 3.58Å; T239-D273 VanDerWaalsContact O-CA 3.28Å; T239-D273 WeakPolarHBondContact O-CA 3.39Å; H240-D273 IonicContact CD2-OD1 2.75Å; H240-D273 PolarHBondContact CD2-OD1 3.44Å; H240-D273 IonicContact CG-OD1 3.42Å; R265-D273 PolarHBondContact N-O 2.87Å; R265-D273 PolarHBondContact O-N 3.49Å
274	I	83.8	Confident	76.5	Confident	23 Å²	23	63.7 Å²	63.7	12%	0.118	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.3	168.6	-61	171.2	0	0	0	107.6	T239 Y246 V248 V264	T239-I274 PolarHBondContact N-O 3.31Å; T239-I274 PolarHBondContact O-N 2.71Å; T239-I274 WeakPolarHBondContact OG1-CB 3.1Å; T239-I274 PolarHBondContact OG1-O 3.34Å; T239-I274 VanDerWaalsContact OG1-O 3.12Å; Y246-I274 HydrophobicContact CD1-CD1 4.34Å; Y246-I274 HydrophobicContact CD2-CD1 4.49Å; Y246-I274 HydrophobicContact CE1-CD1 3.76Å; Y246-I274 HydrophobicContact CE1-CG1 4.19Å; Y246-I274 HydrophobicContact CE2-CD1 3.94Å; Y246-I274 HydrophobicContact CE2-CG1 4.4Å; Y246-I274 WeakPolarHBondContact OH-CG1 3.11Å; Y246-I274 PolarHBondContact OH-N 3.3Å; V248-I274 HydrophobicContact CB-CG2 4.49Å; V248-I274 HydrophobicContact CG2-CB 4.01Å; V248-I274 HydrophobicContact CG2-CD1 4.12Å; V248-I274 HydrophobicContact CG2-CG2 3.83Å; V264-I274 HydrophobicContact CG2-CG1 4.4Å
275	Q	87.4	Confident	77	Confident	21 Å²	21	63 Å²	63	10%	0.098	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	108.7	174.1	170.6	164.8	75.5	0	0	108.7	R236 C237 E262 T263 I277	R236-Q275 VanDerWaalsContact CD-NE2 3.28Å; R236-Q275 HydrophobicContact CG-CG 4.18Å; C237-Q275 CarbonylContact O-C 3.53Å; C237-Q275 WeakPolarHBondContact O-CA 3.28Å; E262-Q275 CarbonylContact C-O 3.5Å; E262-Q275 WeakPolarHBondContact CA-O 3.36Å; T263-Q275 PolarHBondContact N-O 2.82Å; T263-Q275 PolarHBondContact O-N 2.91Å; T263-Q275 WeakPolarHBondContact OG1-CB 3.25Å; T263-Q275 PolarHBondContact OG1-O 3.32Å; Q275-I277 HydrophobicContact CG-CG1 4.47Å
276	S	91	Very high	77.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.7	-179.3	-168.6	0	0	0	0	109.9	C237 W250 I260 E261 E262	C237-S276 PolarHBondContact N-O 2.76Å; C237-S276 PolarHBondContact O-N 2.89Å; W250-S276 PolarHBondContact NE1-OG 2.81Å; I260-S276 WeakPolarHBondContact CG2-OG 3.38Å; E261-S276 CarbonylContact O-C 3.49Å; E261-S276 WeakPolarHBondContact O-CA 3.08Å; E262-S276 PolarHBondContact OE1-OG 2.84Å
277	I	92.4	Very high	79.1	Confident	31 Å²	31	54.4 Å²	54.4	16%	0.159	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.5	-177.5	-56.1	176.2	0	0	0	109	K234 I235 R236 I260 E261 Q275	K234-I277 HydrophobicContact CB-CG2 4.29Å; I235-I277 CarbonylContact O-C 3.56Å; I235-I277 WeakPolarHBondContact O-CA 3.4Å; R236-I277 HydrophobicContact CG-CG1 4.22Å; I260-I277 WeakPolarHBondContact CA-O 3.25Å; E261-I277 PolarHBondContact N-O 2.89Å; E261-I277 PolarHBondContact O-N 2.94Å; Q275-I277 HydrophobicContact CG-CG1 4.47Å
278	L	92.7	Very high	80.9	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.1	174.1	-176.8	151.5	0	0	0	109.8	K234 I235 W250 Y252 P258 I280 I291	K234-L278 CarbonylContact C-O 3.41Å; K234-L278 WeakPolarHBondContact CA-O 3.35Å; I235-L278 HydrophobicContact CB-CB 4.45Å; I235-L278 HydrophobicContact CD1-CD2 4.4Å; I235-L278 PolarHBondContact N-O 3.02Å; I235-L278 PolarHBondContact O-N 2.86Å; W250-L278 HydrophobicContact CB-CD1 3.95Å; W250-L278 HydrophobicContact CD2-CB 4.01Å; W250-L278 HydrophobicContact CD2-CD1 3.66Å; W250-L278 HydrophobicContact CD2-CG 4.49Å; W250-L278 HydrophobicContact CE3-CB 4.29Å; W250-L278 HydrophobicContact CE3-CD1 3.71Å; W250-L278 HydrophobicContact CG-CD1 3.81Å; W250-L278 HydrophobicContact CH2-CB 4.12Å; W250-L278 HydrophobicContact CZ2-CB 3.85Å; W250-L278 HydrophobicContact CZ3-CB 4.35Å; W250-L278 HydrophobicContact CZ3-CD1 4.36Å; Y252-L278 HydrophobicContact CD1-CD1 4.05Å; P258-L278 HydrophobicContact CB-CD1 4.18Å; P258-L278 HydrophobicContact CB-CD2 3.84Å; P258-L278 HydrophobicContact CB-CG 3.75Å; P258-L278 HydrophobicContact CG-CD1 4.13Å; P258-L278 HydrophobicContact CG-CG 4.26Å; L278-I280 HydrophobicContact CD2-CD1 4.2Å; L278-I280 HydrophobicContact CD2-CG1 3.97Å; L278-I291 HydrophobicContact CD1-CG2 4.01Å
279	T	92.3	Very high	82.7	Confident	11 Å²	11	49.7 Å²	49.7	7%	0.067	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.6	-179.3	-53.3	0	0	0	0	111.3	E232 I233 K234 P258 R259	E232-T279 HydrophobicContact CG-CG2 4.28Å; I233-T279 CarbonylContact O-C 3.51Å; I233-T279 VanDerWaalsContact O-CA 3.31Å; I233-T279 WeakPolarHBondContact O-CA 3.4Å; K234-T279 HydrophobicContact CG-CG2 3.84Å; P258-T279 CarbonylContact C-O 3.53Å; P258-T279 WeakPolarHBondContact CA-O 3.32Å; R259-T279 PolarHBondContact N-O 2.99Å; R259-T279 PolarHBondContact O-N 2.8Å
280	I	92.3	Very high	84.7	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.5	167.7	-56.5	168.9	0	0	0	106.7	E232 I233 T254 P258 L278 A282 V283 L308	E232-I280 WeakPolarHBondContact CA-O 3.33Å; I233-I280 HydrophobicContact CG2-CB 3.74Å; I233-I280 HydrophobicContact CG2-CD1 4.24Å; I233-I280 HydrophobicContact CG2-CG1 4.29Å; I233-I280 PolarHBondContact N-O 2.98Å; I233-I280 PolarHBondContact O-N 2.79Å; T254-I280 HydrophobicContact CG2-CD1 4.43Å; P258-I280 HydrophobicContact CB-CG1 4.02Å; L278-I280 HydrophobicContact CD2-CD1 4.2Å; L278-I280 HydrophobicContact CD2-CG1 3.97Å; I280-A282 PolarHBondContact O-N 2.83Å; I280-V283 HydrophobicContact CB-CG1 4.27Å; I280-V283 HydrophobicContact CG2-CG1 3.93Å; I280-L308 HydrophobicContact CD1-CD2 4.19Å
281	S	89.4	Confident	86.5	Confident	83 Å²	83	38.2 Å²	38.2	58%	0.58	22%	0.217	S	C	*	.	S	Bend	trans	-70.6	-28.9	-171.5	-59.9	0	0	0	0	114.2	E232	E232-S281 WeakPolarHBondContact CA-O 3.47Å; E232-S281 WeakPolarHBondContact CB-O 3.47Å
282	A	91.2	Very high	88.2	Confident	56 Å²	56	31.9 Å²	31.9	46%	0.463	20%	0.195	S	C	.	.	S	Bend	trans	-148.3	111	174.9	0	0	0	0	0	108.2	E231 I280	E231-A282 WeakPolarHBondContact O-CA 3.48Å; I280-A282 PolarHBondContact O-N 2.83Å
283	V	91.7	Very high	89.4	Confident	3 Å²	3	30 Å²	30	2%	0.018	19%	0.185	C	C	.	.			trans	-76.9	142.6	-178	-62.8	0	0	0	0	112.1	R227 I228 V229 G230 E231 I233 I280 L308 V310	R227-V283 HydrophobicContact CB-CG2 3.73Å; I228-V283 WeakPolarHBondContact O-CG2 3.43Å; V229-V283 WeakPolarHBondContact CA-O 3.46Å; G230-V283 PolarHBondContact N-O 3.05Å; E231-V283 PolarHBondContact O-N 3.31Å; I233-V283 HydrophobicContact CB-CG1 4.37Å; I233-V283 HydrophobicContact CG2-CG1 3.51Å; I280-V283 HydrophobicContact CB-CG1 4.27Å; I280-V283 HydrophobicContact CG2-CG1 3.93Å; V283-L308 HydrophobicContact CG1-CD2 4.47Å; V283-V310 HydrophobicContact CB-CG1 4.25Å; V283-V310 HydrophobicContact CB-CG2 4.03Å; V283-V310 HydrophobicContact CG2-CG1 3.82Å; V283-V310 HydrophobicContact CG2-CG2 4.25Å
284	D	91.3	Very high	90.1	Very high	80 Å²	80	30.5 Å²	30.5	43%	0.428	19%	0.187	S	C	.	.			trans	-113.4	160.3	171.9	-176	27.2	0	0	0	111	A286 D287 V310	D284-A286 PolarHBondContact O-N 2.91Å; D284-A286 VanDerWaalsContact O-N 3.15Å; D284-D287 PolarHBondContact N-OD2 2.95Å; D284-D287 WeakPolarHBondContact O-CB 3.47Å; D284-D287 PolarHBondContact O-N 2.95Å; D284-V310 WeakPolarHBondContact O-CG2 3.47Å
285	L	90	Very high	90.4	Very high	89 Å²	89	29.4 Å²	29.4	47%	0.466	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-54.9	-34.6	176.5	-70	173.7	0	0	0	112	V229 D287 T288 V310 D312	V229-L285 HydrophobicContact CG2-CD2 3.77Å; V229-L285 HydrophobicContact CG2-CG 3.68Å; L285-D287 PolarHBondContact O-N 3.45Å; L285-T288 WeakPolarHBondContact O-CB 3.11Å; L285-T288 PolarHBondContact O-N 2.93Å; L285-T288 PolarHBondContact O-OG1 3.36Å; L285-T288 VanDerWaalsContact O-OG1 3.05Å; L285-V310 HydrophobicContact CD2-CG1 4.39Å; L285-V310 WeakPolarHBondContact CD2-O 3.37Å; L285-D312 HydrophobicContact CD2-CB 4.41Å
286	A	88.1	Confident	90.4	Very high	49 Å²	49	30 Å²	30	41%	0.405	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-68	-12.2	177	0	0	0	0	0	114.3	D284 T288	D284-A286 PolarHBondContact O-N 2.91Å; D284-A286 VanDerWaalsContact O-N 3.15Å; A286-T288 VanDerWaalsContact C-N 3.28Å
287	D	88.8	Confident	90.1	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-86.4	-1.4	176.9	-59.2	-33.1	0	0	0	112.6	T254 K255 S256 D284 L285 G289 L308 V310	T254-D287 VanDerWaalsContact CB-OD1 3.29Å; T254-D287 WeakPolarHBondContact CB-OD1 3.49Å; T254-D287 HydrophobicContact CG2-CB 3.81Å; T254-D287 WeakPolarHBondContact CG2-O 3.36Å; K255-D287 PolarHBondContact N-OD1 3.04Å; S256-D287 VanDerWaalsContact CB-OD1 3.29Å; S256-D287 WeakPolarHBondContact CB-OD1 3.39Å; S256-D287 VanDerWaalsContact CB-OD2 3.31Å; S256-D287 WeakPolarHBondContact CB-OD2 3.36Å; S256-D287 PolarHBondContact N-OD1 3.28Å; S256-D287 VanDerWaalsContact OG-CG 3.23Å; S256-D287 PolarHBondContact OG-OD1 2.99Å; S256-D287 PolarHBondContact OG-OD2 2.9Å; D284-D287 PolarHBondContact N-OD2 2.95Å; D284-D287 WeakPolarHBondContact O-CB 3.47Å; D284-D287 PolarHBondContact O-N 2.95Å; L285-D287 PolarHBondContact O-N 3.45Å; D287-G289 PolarHBondContact O-N 3.35Å; D287-L308 HydrophobicContact CB-CD2 4.48Å; D287-V310 HydrophobicContact CB-CG2 4.44Å
288	T	89.8	Confident	89.6	Confident	44 Å²	44	33.1 Å²	33.1	27%	0.27	20%	0.202	S	C	.	.			trans	-63.2	123.7	173.5	-62.6	0	0	0	0	110.7	L285 A286 Y307 L308 L309 V310	L285-T288 WeakPolarHBondContact O-CB 3.11Å; L285-T288 PolarHBondContact O-N 2.93Å; L285-T288 PolarHBondContact O-OG1 3.36Å; L285-T288 VanDerWaalsContact O-OG1 3.05Å; A286-T288 VanDerWaalsContact C-N 3.28Å; T288-Y307 HydrophobicContact CG2-CE1 4.41Å; T288-L308 CarbonylContact C-O 3.48Å; T288-L308 VanDerWaalsContact CA-O 3.25Å; T288-L308 WeakPolarHBondContact CA-O 3.43Å; T288-L309 HydrophobicContact CG2-CD1 4.04Å; T288-V310 PolarHBondContact OG1-N 3.07Å
289	G	88.4	Confident	88.8	Confident	9 Å²	9	35.1 Å²	35.1	9%	0.093	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.8	-169.7	178.3	0	0	0	0	0	114.8	D287 L308	D287-G289 PolarHBondContact O-N 3.35Å; G289-L308 PolarHBondContact N-O 3.37Å; G289-L308 PolarHBondContact O-N 3.13Å
290	N	89.4	Confident	88.3	Confident	89 Å²	89	35.8 Å²	35.8	48%	0.476	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	134.4	-179.2	-70	-13.8	0	0	0	111.1	T253 T305 Y307	T253-N290 PolarHBondContact OG1-O 2.84Å; N290-T305 HydrophobicContact CB-CG2 3.72Å; N290-Y307 VanDerWaalsContact OD1-CD2 3.24Å; N290-Y307 WeakPolarHBondContact OD1-CD2 3.33Å
291	I	90.2	Very high	88	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	112	172.2	-58.7	175.2	0	0	0	107.5	I235 W250 K251 L278 T305 T306 L308	I235-I291 HydrophobicContact CD1-CD1 3.49Å; I235-I291 VanDerWaalsContact CD1-CD1 3.49Å; I235-I291 HydrophobicContact CD1-CG2 4.31Å; W250-I291 HydrophobicContact CE3-CG2 3.62Å; W250-I291 HydrophobicContact CZ3-CG2 3.67Å; K251-I291 CarbonylContact O-C 3.54Å; L278-I291 HydrophobicContact CD1-CG2 4.01Å; I291-T305 WeakPolarHBondContact O-CA 3.39Å; I291-T306 HydrophobicContact CB-CG2 4.03Å; I291-T306 PolarHBondContact N-O 2.8Å; I291-T306 PolarHBondContact O-N 3.29Å; I291-L308 HydrophobicContact CD1-CB 3.92Å; I291-L308 HydrophobicContact CD1-CD2 4.01Å
292	S	90	Very high	87.6	Confident	15 Å²	15	36.2 Å²	36.2	11%	0.105	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.6	-178.3	-47.4	0	0	0	0	111	W250 K251 T304 T305	W250-S292 CarbonylContact C-O 3.59Å; W250-S292 WeakPolarHBondContact CA-O 3.26Å; K251-S292 PolarHBondContact N-O 2.98Å; K251-S292 PolarHBondContact O-N 2.93Å; S292-T304 CarbonylContact C-O 3.32Å; S292-T304 VanDerWaalsContact CA-O 3.29Å; S292-T304 WeakPolarHBondContact CA-O 3.45Å; S292-T305 WeakPolarHBondContact CB-OG1 3.47Å; S292-T305 WeakPolarHBondContact OG-CG2 3.46Å; S292-T305 PolarHBondContact OG-OG1 2.82Å
293	C	90.9	Very high	87.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.7	164.8	-175.4	0	0	0	0	108.5	V218 L220 C237 V248 W250 S303 T304	V218-C293 HydrophobicContact CG1-CB 3.95Å; L220-C293 HydrophobicContact CD2-CB 4.05Å; L220-C293 HydrophobicContact CG-CB 4.39Å; C237-C293 HydrophobicContact CB-CB 3.63Å; C237-C293 WeakPolarHBondContact CB-SG 3.43Å; C237-C293 WeakPolarHBondContact SG-CB 3.36Å; C237-C293 CovalentContact SG-SG 2.02Å; C237-C293 PolarHBondContact SG-SG 2.8Å; V248-C293 VanDerWaalsContact CG1-SG 3.58Å; W250-C293 HydrophobicContact CD2-CB 4.32Å; W250-C293 HydrophobicContact CE3-CB 3.99Å; W250-C293 HydrophobicContact CH2-CB 4.06Å; W250-C293 HydrophobicContact CZ2-CB 4.35Å; W250-C293 HydrophobicContact CZ3-CB 3.85Å; C293-S303 CarbonylContact O-C 3.51Å; C293-S303 WeakPolarHBondContact O-CA 3.39Å; C293-S303 WeakPolarHBondContact O-CB 3.5Å; C293-T304 PolarHBondContact N-O 2.9Å; C293-T304 PolarHBondContact O-N 2.84Å
294	I	90.5	Very high	86.8	Confident	31 Å²	31	34.5 Å²	34.5	16%	0.159	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119	-171.4	-54.8	168	0	0	0	108.3	V248 T249 K251 T296 V301	V248-I294 CarbonylContact C-O 3.58Å; V248-I294 WeakPolarHBondContact CA-O 3.48Å; T249-I294 PolarHBondContact N-O 2.88Å; T249-I294 PolarHBondContact O-N 2.76Å; T249-I294 PolarHBondContact OG1-O 3.04Å; K251-I294 HydrophobicContact CB-CD1 3.71Å; K251-I294 HydrophobicContact CD-CD1 4.31Å; I294-T296 HydrophobicContact CG2-CG2 3.99Å; I294-V301 HydrophobicContact CG2-CG1 3.47Å; I294-V301 VanDerWaalsContact CG2-CG1 3.47Å
295	G	89.7	Confident	86.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.1	171	0	0	0	0	0	110.6	P216 N247 V301 N302	P216-G295 WeakPolarHBondContact CG-O 3.45Å; N247-G295 CarbonylContact O-C 3.6Å; N247-G295 VanDerWaalsContact O-CA 3.29Å; N247-G295 WeakPolarHBondContact O-CA 3.39Å; G295-V301 WeakPolarHBondContact O-CA 3.29Å; G295-N302 PolarHBondContact N-O 3.49Å; G295-N302 PolarHBondContact O-N 2.98Å; G295-N302 VanDerWaalsContact O-O 3.12Å
296	T	88	Confident	86.3	Confident	35 Å²	35	28.8 Å²	28.8	22%	0.215	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.1	176.3	84.6	0	0	0	0	112.3	Y246 N247 I294 V301	Y246-T296 CarbonylContact C-O 3.49Å; Y246-T296 WeakPolarHBondContact CA-O 3.43Å; Y246-T296 VanDerWaalsContact CB-O 3.24Å; Y246-T296 WeakPolarHBondContact CB-O 3.2Å; N247-T296 PolarHBondContact N-O 3.34Å; N247-T296 PolarHBondContact ND2-OG1 3.13Å; N247-T296 PolarHBondContact O-N 2.88Å; N247-T296 WeakPolarHBondContact OD1-CB 3.41Å; N247-T296 WeakPolarHBondContact OD1-CG2 3.41Å; N247-T296 PolarHBondContact OD1-N 3.08Å; N247-T296 PolarHBondContact OD1-OG1 3.48Å; I294-T296 HydrophobicContact CG2-CG2 3.99Å; T296-V301 HydrophobicContact CG2-CB 4.27Å; T296-V301 HydrophobicContact CG2-CG1 3.93Å; T296-V301 HydrophobicContact CG2-CG2 3.69Å
297	N	85.8	Confident	86.3	Confident	21 Å²	21	30.8 Å²	30.8	11%	0.112	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	-173.5	173	75.3	8.7	0	0	0	110.8	L212 F214 P215 P216 N241 A299 G300	L212-N297 HydrophobicContact CD1-CB 4Å; F214-N297 PolarHBondContact O-ND2 2.82Å; P215-N297 WeakPolarHBondContact CA-OD1 3.41Å; P216-N297 VanDerWaalsContact CD-CG 3.47Å; P216-N297 HydrophobicContact CG-CB 4.4Å; N241-N297 PolarHBondContact OD1-ND2 2.85Å; N297-A299 PolarHBondContact O-N 2.84Å; N297-A299 WeakPolarHBondContact OD1-CA 3.13Å; N297-A299 WeakPolarHBondContact OD1-CB 3.27Å; N297-A299 PolarHBondContact OD1-N 2.88Å; N297-G300 PolarHBondContact N-O 3.14Å; N297-G300 PolarHBondContact O-N 3.42Å; N297-G300 PolarHBondContact OD1-N 3.31Å; N297-G300 PolarHBondContact OD1-O 2.87Å
298	E	80.8	Confident	86.4	Confident	75 Å²	75	30.8 Å²	30.8	35%	0.35	18%	0.18	S	C	.	.	S	Bend	trans	-66.7	-19.6	-179.8	69.1	-177.8	178.5	0	0	114.7	K132 L212	K132-E298 IonicContact NZ-OE2 2.64Å; K132-E298 PolarHBondContact NZ-OE2 2.78Å; L212-E298 HydrophobicContact CB-CG 3.79Å; L212-E298 HydrophobicContact CD1-CG 4.02Å; L212-E298 HydrophobicContact CG-CG 4.25Å; L212-E298 PolarHBondContact N-OE1 2.86Å
299	A	76.6	Confident	86.4	Confident	42 Å²	42	31 Å²	31	35%	0.347	18%	0.179	S	C	.	.	S	Bend	trans	-88.4	-26.4	-180	0	0	0	0	0	112.4	L212 F214 N297	L212-A299 HydrophobicContact CB-CB 4.17Å; L212-A299 WeakPolarHBondContact O-CB 3.44Å; F214-A299 VanDerWaalsContact C-CB 3.5Å; F214-A299 WeakPolarHBondContact O-CB 3.29Å; N297-A299 PolarHBondContact O-N 2.84Å; N297-A299 WeakPolarHBondContact OD1-CA 3.13Å; N297-A299 WeakPolarHBondContact OD1-CB 3.27Å; N297-A299 PolarHBondContact OD1-N 2.88Å
300	G	80.9	Confident	86.5	Confident	25 Å²	25	30.9 Å²	30.9	26%	0.258	18%	0.177	S	C	.	.			trans	161.9	-161.6	176.5	0	0	0	0	0	114	N297	N297-G300 PolarHBondContact N-O 3.14Å; N297-G300 PolarHBondContact O-N 3.42Å; N297-G300 PolarHBondContact OD1-N 3.31Å; N297-G300 PolarHBondContact OD1-O 2.87Å
301	V	86.4	Confident	86.6	Confident	89 Å²	89	27.4 Å²	27.4	54%	0.539	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.5	180	178.5	0	0	0	0	108.6	I294 G295 T296	I294-V301 HydrophobicContact CG2-CG1 3.47Å; I294-V301 VanDerWaalsContact CG2-CG1 3.47Å; G295-V301 WeakPolarHBondContact O-CA 3.29Å; T296-V301 HydrophobicContact CG2-CB 4.27Å; T296-V301 HydrophobicContact CG2-CG1 3.93Å; T296-V301 HydrophobicContact CG2-CG2 3.69Å
302	N	80.9	Confident	86.7	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.043	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	147	168.2	-169.7	15.5	0	0	0	108.8	P215 P216 V218 G295	P215-N302 HydrophobicContact CB-CB 3.91Å; P215-N302 HydrophobicContact CG-CB 4.05Å; P216-N302 WeakPolarHBondContact O-CB 3.28Å; P216-N302 PolarHBondContact O-ND2 3.43Å; V218-N302 HydrophobicContact CG2-CB 4.33Å; G295-N302 PolarHBondContact N-O 3.49Å; G295-N302 PolarHBondContact O-N 2.98Å; G295-N302 VanDerWaalsContact O-O 3.12Å
303	S	86.6	Confident	86.7	Confident	19 Å²	19	38.4 Å²	38.4	13%	0.133	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	132.1	-179.8	69.1	0	0	0	0	114.5	C293 N698 P700	C293-S303 CarbonylContact O-C 3.51Å; C293-S303 WeakPolarHBondContact O-CA 3.39Å; C293-S303 WeakPolarHBondContact O-CB 3.5Å; S303-N698 CarbonylContact C-O 3.6Å; S303-P700 WeakPolarHBondContact O-CD 3.32Å; S303-P700 VanDerWaalsContact O-CG 3.24Å; S303-P700 WeakPolarHBondContact O-CG 3.2Å; S303-P700 WeakPolarHBondContact OG-CG 3.46Å
304	T	80.1	Confident	86.8	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.025	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	141.3	177.7	-52.6	0	0	0	0	109.7	V218 L220 S292 C293 N698	V218-T304 PolarHBondContact O-OG1 2.93Å; L220-T304 HydrophobicContact CB-CG2 4.04Å; L220-T304 HydrophobicContact CD1-CG2 3.91Å; L220-T304 WeakPolarHBondContact CD1-O 3.41Å; L220-T304 HydrophobicContact CG-CG2 3.97Å; S292-T304 CarbonylContact C-O 3.32Å; S292-T304 VanDerWaalsContact CA-O 3.29Å; S292-T304 WeakPolarHBondContact CA-O 3.45Å; C293-T304 PolarHBondContact N-O 2.9Å; C293-T304 PolarHBondContact O-N 2.84Å; T304-N698 HydrophobicContact CG2-CB 3.44Å; T304-N698 VanDerWaalsContact CG2-CB 3.44Å
305	T	85.4	Confident	86.8	Confident	47 Å²	47	40.4 Å²	40.4	29%	0.288	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.1	-176.7	-56.3	0	0	0	0	111.1	N290 I291 S292	N290-T305 HydrophobicContact CB-CG2 3.72Å; I291-T305 WeakPolarHBondContact O-CA 3.39Å; S292-T305 WeakPolarHBondContact CB-OG1 3.47Å; S292-T305 WeakPolarHBondContact OG-CG2 3.46Å; S292-T305 PolarHBondContact OG-OG1 2.82Å
306	T	85.5	Confident	87	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	154.2	170	-171.5	0	0	0	0	110.2	L220 T222 D223 Y225 I235 I291	L220-T306 HydrophobicContact CD1-CG2 3.95Å; T222-T306 VanDerWaalsContact O-CB 3.28Å; T222-T306 WeakPolarHBondContact O-CB 3.45Å; T222-T306 PolarHBondContact O-OG1 3.11Å; D223-T306 WeakPolarHBondContact O-CA 3.14Å; D223-T306 PolarHBondContact O-OG1 3.22Å; D223-T306 VanDerWaalsContact O-OG1 3.1Å; Y225-T306 HydrophobicContact CD2-CG2 4.24Å; Y225-T306 WeakPolarHBondContact CD2-OG1 3.39Å; Y225-T306 HydrophobicContact CE2-CG2 4.16Å; I235-T306 HydrophobicContact CD1-CG2 4.18Å; I235-T306 HydrophobicContact CG2-CG2 4.05Å; I291-T306 HydrophobicContact CB-CG2 4.03Å; I291-T306 PolarHBondContact N-O 2.8Å; I291-T306 PolarHBondContact O-N 3.29Å
307	Y	87.7	Confident	87	Confident	91 Å²	91	46.3 Å²	46.3	36%	0.357	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.2	177.1	-166.7	-102.2	0	0	0	111	D223 E224 Y225 T288 N290 L309	D223-Y307 PolarHBondContact O-N 3.09Å; E224-Y307 CarbonylContact C-O 3.58Å; E224-Y307 VanDerWaalsContact CA-O 3.3Å; E224-Y307 WeakPolarHBondContact CA-O 3.29Å; E224-Y307 HydrophobicContact CG-CD1 4.41Å; Y225-Y307 PolarHBondContact N-O 3.27Å; T288-Y307 HydrophobicContact CG2-CE1 4.41Å; N290-Y307 VanDerWaalsContact OD1-CD2 3.24Å; N290-Y307 WeakPolarHBondContact OD1-CD2 3.33Å; Y307-L309 HydrophobicContact CD1-CB 4.24Å; Y307-L309 HydrophobicContact CE1-CB 4Å; Y307-L309 HydrophobicContact CE1-CD1 4.37Å
308	L	90.5	Very high	87.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	119.8	169.3	176	57.8	0	0	0	109.2	R227 I233 I280 V283 D287 T288 G289 I291 V310	R227-L308 HydrophobicContact CG-CD1 4.39Å; I233-L308 HydrophobicContact CD1-CD1 3.6Å; I280-L308 HydrophobicContact CD1-CD2 4.19Å; V283-L308 HydrophobicContact CG1-CD2 4.47Å; D287-L308 HydrophobicContact CB-CD2 4.48Å; T288-L308 CarbonylContact C-O 3.48Å; T288-L308 VanDerWaalsContact CA-O 3.25Å; T288-L308 WeakPolarHBondContact CA-O 3.43Å; G289-L308 PolarHBondContact N-O 3.37Å; G289-L308 PolarHBondContact O-N 3.13Å; I291-L308 HydrophobicContact CD1-CB 3.92Å; I291-L308 HydrophobicContact CD1-CD2 4.01Å; L308-V310 HydrophobicContact CD1-CG2 4.29Å; L308-V310 HydrophobicContact CD2-CG2 4.19Å; L308-V310 HydrophobicContact CG-CG2 3.95Å
309	L	89.3	Confident	87.6	Confident	48 Å²	48	47 Å²	47	25%	0.251	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	115.4	170.2	-179.8	63	0	0	0	109.9	Y225 I226 R227 T288 Y307 V311	Y225-L309 PolarHBondContact O-N 2.86Å; I226-L309 VanDerWaalsContact CA-O 3.31Å; I226-L309 WeakPolarHBondContact CA-O 3.39Å; I226-L309 HydrophobicContact CG1-CB 4.36Å; I226-L309 HydrophobicContact CG1-CD2 4.46Å; R227-L309 PolarHBondContact N-O 3.33Å; T288-L309 HydrophobicContact CG2-CD1 4.04Å; Y307-L309 HydrophobicContact CD1-CB 4.24Å; Y307-L309 HydrophobicContact CE1-CB 4Å; Y307-L309 HydrophobicContact CE1-CD1 4.37Å; L309-V311 HydrophobicContact CD2-CG1 4.39Å; L309-V311 HydrophobicContact CG-CG1 4.18Å
310	V	91.8	Very high	88	Confident	6 Å²	6	48 Å²	48	4%	0.036	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.6	174.5	-171.5	0	0	0	0	109.5	R227 V229 V283 D284 L285 D287 T288 L308	R227-V310 CarbonylContact O-C 3.57Å; R227-V310 WeakPolarHBondContact O-CA 2.99Å; V229-V310 HydrophobicContact CG2-CG1 3.83Å; V283-V310 HydrophobicContact CB-CG1 4.25Å; V283-V310 HydrophobicContact CB-CG2 4.03Å; V283-V310 HydrophobicContact CG2-CG1 3.82Å; V283-V310 HydrophobicContact CG2-CG2 4.25Å; D284-V310 WeakPolarHBondContact O-CG2 3.47Å; L285-V310 HydrophobicContact CD2-CG1 4.39Å; L285-V310 WeakPolarHBondContact CD2-O 3.37Å; D287-V310 HydrophobicContact CB-CG2 4.44Å; T288-V310 PolarHBondContact OG1-N 3.07Å; L308-V310 HydrophobicContact CD1-CG2 4.29Å; L308-V310 HydrophobicContact CD2-CG2 4.19Å; L308-V310 HydrophobicContact CG-CG2 3.95Å
311	V	91.7	Very high	88	Confident	17 Å²	17	52.4 Å²	52.4	10%	0.103	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	148.4	179.4	-62.6	0	0	0	0	111.3	I226 R227 I228 V229 L309 Y315	I226-V311 HydrophobicContact CG2-CG2 4.43Å; R227-V311 PolarHBondContact O-N 2.96Å; I228-V311 WeakPolarHBondContact CA-O 3.45Å; I228-V311 HydrophobicContact CG1-CG2 3.99Å; V229-V311 PolarHBondContact N-O 3.27Å; L309-V311 HydrophobicContact CD2-CG1 4.39Å; L309-V311 HydrophobicContact CG-CG1 4.18Å; V311-Y315 HydrophobicContact CB-CE1 4.48Å; V311-Y315 HydrophobicContact CG1-CD1 4.48Å; V311-Y315 HydrophobicContact CG1-CE1 3.93Å; V311-Y315 HydrophobicContact CG2-CD1 4.37Å; V311-Y315 HydrophobicContact CG2-CE1 4.21Å
312	D	91.4	Very high	87.3	Confident	104 Å²	104	50.4 Å²	50.4	56%	0.556	25%	0.249	S	C	*	.	S	Bend	trans	-72.9	-33.9	-179.2	65.1	-36.9	0	0	0	112.4	L285	L285-D312 HydrophobicContact CD2-CB 4.41Å
313	K	90.6	Very high	86.5	Confident	141 Å²	141	52.5 Å²	52.5	61%	0.613	26%	0.264	S	S	*	.	S	Bend	trans	-141.7	154.2	-175	-66.9	-178.5	-171.4	176.6	0	112.1
314	P	91.7	Very high	85	Confident	42 Å²	42	57.5 Å²	57.5	27%	0.273	30%	0.296	S	S	.	.			trans	-62.1	146.1	171	28.9	-37.1	0	0	0	110.9	I228 Y350 L405 T406	I228-P314 HydrophobicContact CD1-CB 4.11Å; P314-Y350 CarbonylContact C-O 3.4Å; P314-Y350 VanDerWaalsContact CA-O 3.29Å; P314-Y350 WeakPolarHBondContact CA-O 3.05Å; P314-L405 HydrophobicContact CB-CB 3.78Å; P314-L405 HydrophobicContact CB-CD1 4.06Å; P314-L405 HydrophobicContact CG-CB 3.72Å; P314-L405 HydrophobicContact CG-CD1 4.12Å; P314-T406 HydrophobicContact CB-CG2 4.39Å
315	Y	91.7	Very high	83.8	Confident	32 Å²	32	63.3 Å²	63.3	13%	0.125	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	152.3	-178.3	69.8	-89	0	0	0	112.7	V311 R317 E348 A349 Y350	V311-Y315 HydrophobicContact CB-CE1 4.48Å; V311-Y315 HydrophobicContact CG1-CD1 4.48Å; V311-Y315 HydrophobicContact CG1-CE1 3.93Å; V311-Y315 HydrophobicContact CG2-CD1 4.37Å; V311-Y315 HydrophobicContact CG2-CE1 4.21Å; Y315-R317 HydrophobicContact CD2-CG 3.83Å; Y315-R317 HydrophobicContact CE2-CG 4.33Å; Y315-E348 HydrophobicContact CE2-CB 4.01Å; Y315-E348 WeakPolarHBondContact CE2-O 3.46Å; Y315-A349 WeakPolarHBondContact O-CA 2.73Å; Y315-Y350 PolarHBondContact N-O 3.33Å; Y315-Y350 PolarHBondContact O-N 2.81Å
316	I	92.6	Very high	82.4	Confident	20 Å²	20	63.3 Å²	63.3	10%	0.103	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	113.4	163.7	-63.2	167.1	0	0	0	106.8	L318 I347 E348 A349 A401 T406 A408	I316-L318 HydrophobicContact CG2-CD2 3.89Å; I316-L318 HydrophobicContact CG2-CG 4.27Å; I316-I347 HydrophobicContact CG2-CG2 4.03Å; I316-E348 CarbonylContact C-O 3.56Å; I316-E348 WeakPolarHBondContact CA-O 3.25Å; I316-A349 HydrophobicContact CB-CB 4.41Å; I316-A349 HydrophobicContact CG1-CB 3.85Å; I316-A349 HydrophobicContact CG2-CB 4.39Å; I316-A401 HydrophobicContact CG2-CB 4.34Å; I316-T406 HydrophobicContact CB-CG2 4.46Å; I316-T406 HydrophobicContact CD1-CG2 3.87Å; I316-T406 VanDerWaalsContact CD1-O 3.25Å; I316-T406 WeakPolarHBondContact CD1-O 3.43Å; I316-T406 HydrophobicContact CG1-CG2 3.75Å; I316-A408 HydrophobicContact CB-CB 3.88Å; I316-A408 HydrophobicContact CG2-CB 3.73Å
317	R	89.2	Confident	80.4	Confident	139 Å²	139	68.4 Å²	68.4	53%	0.525	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.7	175.7	-70	170.6	-175.6	174.9	1.7	108.9	Y315 I347 E348	Y315-R317 HydrophobicContact CD2-CG 3.83Å; Y315-R317 HydrophobicContact CE2-CG 4.33Å; R317-I347 VanDerWaalsContact O-CA 3.31Å; R317-I347 WeakPolarHBondContact O-CA 3.31Å; R317-E348 HydrophobicContact CB-CB 4.33Å; R317-E348 PolarHBondContact N-O 2.88Å; R317-E348 IonicContact NH1-OE2 2.78Å; R317-E348 PolarHBondContact O-N 2.81Å
318	L	90.1	Very high	78.6	Confident	28 Å²	28	70.5 Å²	70.5	15%	0.147	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.3	177.9	-56.6	176.5	0	0	0	108.9	I316 I347 F399 A408 I410	I316-L318 HydrophobicContact CG2-CD2 3.89Å; I316-L318 HydrophobicContact CG2-CG 4.27Å; L318-I347 HydrophobicContact CD2-CB 4.29Å; L318-I347 HydrophobicContact CD2-CD1 4.24Å; L318-I347 HydrophobicContact CD2-CG1 3.75Å; L318-I347 HydrophobicContact CD2-CG2 3.78Å; L318-F399 HydrophobicContact CD2-CD1 4.18Å; L318-F399 HydrophobicContact CD2-CE1 4.05Å; L318-A408 HydrophobicContact CD1-CB 3.78Å; L318-A408 HydrophobicContact CG-CB 4.07Å; L318-I410 HydrophobicContact CB-CB 4.4Å; L318-I410 HydrophobicContact CB-CD1 4.49Å; L318-I410 HydrophobicContact CB-CG2 4.25Å; L318-I410 HydrophobicContact CD1-CB 3.98Å; L318-I410 HydrophobicContact CD1-CG2 3.9Å
319	L	88.3	Confident	76.9	Confident	83 Å²	83	77 Å²	77	44%	0.435	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.8	-177.5	-63.6	165.2	0	0	0	109.3	L345 L346	L319-L345 WeakPolarHBondContact O-CA 3.26Å; L319-L346 WeakPolarHBondContact CA-O 3.36Å; L319-L346 HydrophobicContact CB-CB 4.27Å; L319-L346 WeakPolarHBondContact CB-O 3.43Å; L319-L346 HydrophobicContact CD1-CD2 4.35Å; L319-L346 PolarHBondContact N-O 2.96Å; L319-L346 PolarHBondContact O-N 3.13Å
320	P	85.6	Confident	75.6	Confident	63 Å²	63	77.9 Å²	77.9	41%	0.409	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.3	177.6	28.4	-33	0	0	0	111.9	L331 L345 I410 F412	P320-L331 HydrophobicContact CB-CD2 4.19Å; P320-L331 HydrophobicContact CG-CD2 4.22Å; P320-L345 HydrophobicContact CB-CD2 4.31Å; P320-I410 HydrophobicContact CB-CD1 4.47Å; P320-I410 HydrophobicContact CG-CD1 4.27Å; P320-F412 HydrophobicContact CB-CE1 4.01Å; P320-F412 HydrophobicContact CB-CZ 4.13Å
321	Q	80.5	Confident	74.8	Confident	117 Å²	117	80.4 Å²	80.4	55%	0.547	45%	0.446	S	S	.	.			trans	-121.8	73.5	178.7	-167.2	178	-10	0	0	109.2	S344	Q321-S344 PolarHBondContact N-O 3.23Å
322	L	72.1	Confident	74.2	Confident	47 Å²	47	81.3 Å²	81.3	25%	0.246	45%	0.453	C	S	.	.			trans	-85.1	153.3	179.7	-64.4	168.9	0	0	0	111.3	V333 L343 F412	L322-V333 HydrophobicContact CD1-CG2 4.28Å; L322-V333 HydrophobicContact CD2-CG2 4.35Å; L322-L343 HydrophobicContact CD2-CD2 3.91Å; L322-F412 HydrophobicContact CD1-CD1 4.44Å; L322-F412 HydrophobicContact CD1-CE1 4.17Å; L322-F412 HydrophobicContact CD2-CD1 4.36Å; L322-F412 HydrophobicContact CD2-CE1 3.99Å; L322-F412 HydrophobicContact CG-CE1 4.26Å
323	S	63.3	Low	73.7	Confident	51 Å²	51	76.5 Å²	76.5	36%	0.357	43%	0.428	S	S	.	.			trans	-69.7	144.3	179.5	62.2	0	0	0	0	111.9	T325 L326	S323-T325 PolarHBondContact O-N 3.27Å; S323-T325 VanDerWaalsContact O-N 3.09Å; S323-L326 PolarHBondContact O-N 3.08Å; S323-L326 VanDerWaalsContact OG-CD1 3.23Å; S323-L326 WeakPolarHBondContact OG-CD1 3.21Å; S323-L326 WeakPolarHBondContact OG-CG 3.5Å
324	P	55.7	Low	73.3	Confident	124 Å²	124	71.7 Å²	71.7	81%	0.805	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-13.4	-173.2	23.3	-32.2	0	0	0	114.7	L326	P324-L326 VanDerWaalsContact C-N 3.33Å
325	T	54.3	Low	73	Confident	127 Å²	127	69.9 Å²	69.9	78%	0.779	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.7	173.4	45.7	0	0	0	0	113.4	S323	S323-T325 PolarHBondContact O-N 3.27Å; S323-T325 VanDerWaalsContact O-N 3.09Å
326	L	57.8	Low	72.5	Confident	46 Å²	46	73 Å²	73	24%	0.241	41%	0.413	C	S	.	.	S	Bend	trans	-100.2	89.4	177.5	-62.9	171.3	0	0	0	108.4	S323 P324 V333 L341	S323-L326 PolarHBondContact O-N 3.08Å; S323-L326 VanDerWaalsContact OG-CD1 3.23Å; S323-L326 WeakPolarHBondContact OG-CD1 3.21Å; S323-L326 WeakPolarHBondContact OG-CG 3.5Å; P324-L326 VanDerWaalsContact C-N 3.33Å; L326-V333 HydrophobicContact CD1-CG1 3.94Å; L326-V333 HydrophobicContact CD2-CG1 3.94Å; L326-V333 HydrophobicContact CG-CG1 4.37Å; L326-L341 HydrophobicContact CD1-CD1 3.94Å
327	T	43.4	Very low	72	Confident	110 Å²	110	78.6 Å²	78.6	68%	0.675	44%	0.438	S	S	*	.			trans	-126.8	121.2	169	51.7	0	0	0	0	110.9
328	L	50	Low	71.7	Confident	136 Å²	136	74 Å²	74	71%	0.712	43%	0.434	S	S	*	.	S	Bend		-169.1	132.3	104.8	-124.2	78.3	0	0	0	109.9
329	N	53.3	Low	71.4	Confident	137 Å²	137	76.9 Å²	76.9	73%	0.733	45%	0.447	S	S	*	.	S	Bend	trans	74.8	63.7	176.1	-61.1	-11.8	0	0	0	118.1	L331 S332	N329-L331 PolarHBondContact O-N 3.29Å; N329-S332 PolarHBondContact O-N 2.81Å
330	G	62.8	Low	71.3	Confident	66 Å²	66	78.2 Å²	78.2	68%	0.68	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-91.2	157.2	0	0	0	0	0	114.7
331	L	75.7	Confident	71.3	Confident	58 Å²	58	75.4 Å²	75.4	30%	0.304	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	1.2	-173.6	-67.2	168.3	0	0	0	113.5	P320 N329 I410 S411 F412 Q413	P320-L331 HydrophobicContact CB-CD2 4.19Å; P320-L331 HydrophobicContact CG-CD2 4.22Å; N329-L331 PolarHBondContact O-N 3.29Å; L331-I410 HydrophobicContact CD1-CD1 4.46Å; L331-I410 HydrophobicContact CD1-CG1 4.08Å; L331-I410 HydrophobicContact CD2-CD1 3.86Å; L331-I410 HydrophobicContact CD2-CG1 3.97Å; L331-S411 WeakPolarHBondContact CB-O 3.36Å; L331-S411 WeakPolarHBondContact CD1-O 3.28Å; L331-F412 HydrophobicContact CD2-CD1 3.73Å; L331-F412 HydrophobicContact CD2-CE1 3.58Å; L331-F412 HydrophobicContact CD2-CG 4.45Å; L331-F412 HydrophobicContact CD2-CZ 4.18Å; L331-F412 CarbonylContact O-C 3.47Å; L331-F412 VanDerWaalsContact O-CA 3.28Å; L331-F412 WeakPolarHBondContact O-CA 3.32Å; L331-Q413 PolarHBondContact O-N 2.88Å
332	S	77.8	Confident	71.6	Confident	37 Å²	37	74.3 Å²	74.3	26%	0.259	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	130.7	176.2	-52.8	0	0	0	0	111.1	N329 Q413	N329-S332 PolarHBondContact O-N 2.81Å; S332-Q413 CarbonylContact C-O 3.58Å; S332-Q413 VanDerWaalsContact CA-O 3.32Å; S332-Q413 WeakPolarHBondContact CA-O 3.31Å; S332-Q413 PolarHBondContact OG-OE1 3.22Å; S332-Q413 VanDerWaalsContact OG-OE1 3.09Å
333	V	81.8	Confident	72.4	Confident	3 Å²	3	72 Å²	72	2%	0.018	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.6	-174.7	-173.3	0	0	0	0	109.6	L322 L326 V335 L341 L343 Q413 V414 Q415	L322-V333 HydrophobicContact CD1-CG2 4.28Å; L322-V333 HydrophobicContact CD2-CG2 4.35Å; L326-V333 HydrophobicContact CD1-CG1 3.94Å; L326-V333 HydrophobicContact CD2-CG1 3.94Å; L326-V333 HydrophobicContact CG-CG1 4.37Å; V333-V335 HydrophobicContact CG1-CG2 3.98Å; V333-L341 HydrophobicContact CG1-CD1 3.7Å; V333-L341 HydrophobicContact CG1-CD2 4.36Å; V333-L343 HydrophobicContact CG2-CD2 4.22Å; V333-Q413 PolarHBondContact N-O 2.87Å; V333-V414 WeakPolarHBondContact O-CA 3.37Å; V333-Q415 PolarHBondContact O-N 2.85Å
334	V	82.4	Confident	73.6	Confident	40 Å²	40	70.1 Å²	70.1	24%	0.242	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.4	178.6	-166.9	0	0	0	0	110.1	Q415 Y417 Y439	V334-Q415 VanDerWaalsContact CA-O 3.27Å; V334-Q415 WeakPolarHBondContact CA-O 3.35Å; V334-Q415 HydrophobicContact CG2-CB 4.44Å; V334-Y417 HydrophobicContact CB-CE2 4.11Å; V334-Y417 HydrophobicContact CG1-CD1 4.05Å; V334-Y417 HydrophobicContact CG1-CD2 3.78Å; V334-Y417 HydrophobicContact CG1-CE1 3.85Å; V334-Y417 HydrophobicContact CG1-CE2 3.56Å; V334-Y417 HydrophobicContact CG1-CG 4.01Å; V334-Y439 HydrophobicContact CG1-CD1 4.33Å; V334-Y439 HydrophobicContact CG1-CE1 3.92Å; V334-Y439 HydrophobicContact CG2-CE1 4.41Å
335	V	84.3	Confident	75.2	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.024	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	153.9	-172.1	-172.4	0	0	0	0	110.7	V333 E339 L341 M389 Q415 M416 Y417	V333-V335 HydrophobicContact CG1-CG2 3.98Å; V335-E339 HydrophobicContact CG1-CB 3.79Å; V335-L341 HydrophobicContact CG2-CB 4.21Å; V335-L341 HydrophobicContact CG2-CD1 3.92Å; V335-L341 HydrophobicContact CG2-CD2 4.01Å; V335-L341 HydrophobicContact CG2-CG 4.25Å; V335-M389 HydrophobicContact CB-CE 4.39Å; V335-M389 HydrophobicContact CG2-CE 4.39Å; V335-Q415 PolarHBondContact N-O 2.85Å; V335-M416 CarbonylContact O-C 3.58Å; V335-M416 VanDerWaalsContact O-CA 3.23Å; V335-M416 WeakPolarHBondContact O-CA 3.49Å; V335-Y417 PolarHBondContact O-N 3.1Å
336	K	82.7	Confident	76.8	Confident	98 Å²	98	60.5 Å²	60.5	43%	0.426	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	151.3	171.4	-57	178.6	-169.6	154.7	0	111.3	G338 E339 Y417	K336-G338 PolarHBondContact O-N 3.45Å; K336-E339 HydrophobicContact CB-CG 4.02Å; K336-E339 WeakPolarHBondContact CB-OE2 3.13Å; K336-E339 WeakPolarHBondContact CD-OE1 3.41Å; K336-E339 PolarHBondContact N-OE2 2.97Å; K336-E339 VanDerWaalsContact N-OE2 3.17Å; K336-E339 IonicContact NZ-OE1 3.02Å; K336-E339 WeakPolarHBondContact O-CB 3.29Å; K336-E339 PolarHBondContact O-N 3.11Å; K336-E339 VanDerWaalsContact O-N 3.1Å; K336-Y417 HydrophobicContact CG-CD2 3.62Å; K336-Y417 HydrophobicContact CG-CG 4.17Å
337	E	82.1	Confident	78.4	Confident	137 Å²	137	58.3 Å²	58.3	64%	0.64	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	132.7	173.7	-172.4	177.4	-162.2	0	0	111	E339	E337-E339 VanDerWaalsContact C-N 3.27Å; E337-E339 PolarHBondContact O-N 3.35Å
338	G	80.9	Confident	80.6	Confident	43 Å²	43	55 Å²	55	44%	0.443	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-5.7	-178.6	0	0	0	0	0	115.6	K336 M389	K336-G338 PolarHBondContact O-N 3.45Å; G338-M389 PolarHBondContact N-O 3.23Å
339	E	84.3	Confident	82.4	Confident	88 Å²	88	48.5 Å²	48.5	41%	0.411	27%	0.274	S	S	.	.			trans	-77.6	156.3	169	-70.3	179.8	165.9	0	0	111.1	V335 K336 E337 M389	V335-E339 HydrophobicContact CG1-CB 3.79Å; K336-E339 HydrophobicContact CB-CG 4.02Å; K336-E339 WeakPolarHBondContact CB-OE2 3.13Å; K336-E339 WeakPolarHBondContact CD-OE1 3.41Å; K336-E339 PolarHBondContact N-OE2 2.97Å; K336-E339 VanDerWaalsContact N-OE2 3.17Å; K336-E339 IonicContact NZ-OE1 3.02Å; K336-E339 WeakPolarHBondContact O-CB 3.29Å; K336-E339 PolarHBondContact O-N 3.11Å; K336-E339 VanDerWaalsContact O-N 3.1Å; E337-E339 VanDerWaalsContact C-N 3.27Å; E337-E339 PolarHBondContact O-N 3.35Å; E339-M389 WeakPolarHBondContact O-CB 3.5Å; E339-M389 PolarHBondContact O-N 2.75Å; E339-M389 VanDerWaalsContact O-N 3.09Å
340	D	85.8	Confident	84.1	Confident	110 Å²	110	43 Å²	43	59%	0.588	24%	0.243	S	C	*	.			trans	-89.7	138.1	175.9	-62.7	-21.3	0	0	0	109.5	L386 K387 R388	D340-L386 CarbonylContact C-O 3.35Å; D340-L386 WeakPolarHBondContact CA-O 3.39Å; D340-K387 VanDerWaalsContact OD1-CA 3.3Å; D340-K387 WeakPolarHBondContact OD1-CA 3.49Å; D340-R388 PolarHBondContact OD1-N 3.3Å
341	L	86.4	Confident	85.4	Confident	5 Å²	5	40.7 Å²	40.7	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.9	175.6	175.6	61.3	0	0	0	110.8	L326 V333 V335 L343 L386 M389 V414	L326-L341 HydrophobicContact CD1-CD1 3.94Å; V333-L341 HydrophobicContact CG1-CD1 3.7Å; V333-L341 HydrophobicContact CG1-CD2 4.36Å; V335-L341 HydrophobicContact CG2-CB 4.21Å; V335-L341 HydrophobicContact CG2-CD1 3.92Å; V335-L341 HydrophobicContact CG2-CD2 4.01Å; V335-L341 HydrophobicContact CG2-CG 4.25Å; L341-L343 HydrophobicContact CD1-CD2 4.2Å; L341-L343 HydrophobicContact CD2-CD2 4.1Å; L341-L343 HydrophobicContact CD2-CG 4.26Å; L341-L343 HydrophobicContact CG-CD2 4.24Å; L341-L343 HydrophobicContact CG-CG 4.33Å; L341-L386 HydrophobicContact CB-CB 4.37Å; L341-L386 HydrophobicContact CD2-CD1 4.17Å; L341-L386 PolarHBondContact N-O 2.93Å; L341-L386 PolarHBondContact O-N 3.24Å; L341-M389 HydrophobicContact CB-CE 4.05Å; L341-M389 HydrophobicContact CB-CG 4.19Å; L341-M389 HydrophobicContact CB-SD 4.29Å; L341-M389 HydrophobicContact CD2-CE 3.72Å; L341-V414 HydrophobicContact CD2-CB 4.45Å; L341-V414 HydrophobicContact CD2-CG1 3.67Å; L341-V414 HydrophobicContact CD2-CG2 3.83Å
342	E	87.9	Confident	86	Confident	93 Å²	93	42 Å²	42	44%	0.435	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	117.8	172	-175.4	172.6	143.5	0	0	110.6	T383 Q385	E342-T383 HydrophobicContact CG-CG2 3.46Å; E342-T383 VanDerWaalsContact CG-CG2 3.46Å; E342-T383 WeakPolarHBondContact OE1-CG2 3.43Å; E342-Q385 HydrophobicContact CB-CG 4.39Å; E342-Q385 HydrophobicContact CG-CG 3.99Å; E342-Q385 PolarHBondContact OE2-NE2 3.19Å
343	L	88.2	Confident	86.6	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.5	170.4	-59.6	-179.8	0	0	0	108.8	L322 V333 L341 W358 T383 L384 Y397 F412 V414	L322-L343 HydrophobicContact CD2-CD2 3.91Å; V333-L343 HydrophobicContact CG2-CD2 4.22Å; L341-L343 HydrophobicContact CD1-CD2 4.2Å; L341-L343 HydrophobicContact CD2-CD2 4.1Å; L341-L343 HydrophobicContact CD2-CG 4.26Å; L341-L343 HydrophobicContact CG-CD2 4.24Å; L341-L343 HydrophobicContact CG-CG 4.33Å; L343-W358 HydrophobicContact CB-CH2 3.99Å; L343-W358 HydrophobicContact CB-CZ3 4.48Å; L343-W358 HydrophobicContact CD1-CZ3 4.32Å; L343-T383 CarbonylContact O-C 3.59Å; L343-T383 VanDerWaalsContact O-CA 3.31Å; L343-T383 WeakPolarHBondContact O-CA 3.47Å; L343-L384 HydrophobicContact CB-CB 4.38Å; L343-L384 HydrophobicContact CD1-CD2 4.46Å; L343-L384 PolarHBondContact N-O 2.83Å; L343-L384 PolarHBondContact O-N 2.78Å; L343-Y397 HydrophobicContact CD1-CD1 4.46Å; L343-Y397 HydrophobicContact CD1-CG 4.08Å; L343-F412 HydrophobicContact CD1-CB 4.08Å; L343-F412 HydrophobicContact CD1-CD2 4.2Å; L343-F412 HydrophobicContact CD1-CG 4.15Å; L343-F412 HydrophobicContact CD2-CB 4.44Å; L343-F412 HydrophobicContact CD2-CD1 4.17Å; L343-F412 HydrophobicContact CD2-CG 4.23Å; L343-V414 HydrophobicContact CD1-CG2 4.42Å
344	S	87.6	Confident	87	Confident	11 Å²	11	44.3 Å²	44.3	8%	0.077	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	140.6	-176.9	-159.7	0	0	0	0	112.2	Q321 A382 T383	Q321-S344 PolarHBondContact N-O 3.23Å; S344-A382 CarbonylContact C-O 3.55Å; S344-A382 WeakPolarHBondContact CA-O 3.47Å; S344-T383 PolarHBondContact OG-OG1 3.24Å
345	L	89.2	Confident	87.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.7	-177.9	-69	169.7	0	0	0	109.9	L319 P320 I347 W358 V381 A382 F399 I410 F412	L319-L345 WeakPolarHBondContact O-CA 3.26Å; P320-L345 HydrophobicContact CB-CD2 4.31Å; L345-I347 HydrophobicContact CB-CG1 4.25Å; L345-W358 HydrophobicContact CD1-CH2 3.77Å; L345-W358 HydrophobicContact CD1-CZ2 3.84Å; L345-W358 HydrophobicContact CG-CH2 4.26Å; L345-W358 HydrophobicContact CG-CZ2 4.38Å; L345-V381 WeakPolarHBondContact O-CA 3.33Å; L345-A382 HydrophobicContact CB-CB 4.3Å; L345-A382 PolarHBondContact N-O 2.75Å; L345-A382 PolarHBondContact O-N 2.76Å; L345-F399 HydrophobicContact CD1-CB 3.37Å; L345-F399 HydrophobicContact CD1-CD1 3.35Å; L345-F399 HydrophobicContact CD1-CD2 4.15Å; L345-F399 HydrophobicContact CD1-CE1 4.15Å; L345-F399 HydrophobicContact CD1-CG 3.34Å; L345-I410 HydrophobicContact CD1-CG2 3.68Å; L345-I410 HydrophobicContact CD2-CD1 4.21Å; L345-I410 HydrophobicContact CD2-CG2 3.66Å; L345-I410 HydrophobicContact CG-CG2 4.36Å; L345-F412 HydrophobicContact CD1-CE2 4.28Å; L345-F412 HydrophobicContact CD2-CE2 3.95Å; L345-F412 HydrophobicContact CD2-CZ 3.58Å; L345-F412 HydrophobicContact CG-CE2 4.21Å; L345-F412 HydrophobicContact CG-CZ 4.12Å
346	L	89.4	Confident	87.8	Confident	49 Å²	49	49.8 Å²	49.8	26%	0.257	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.9	162.1	179.8	67.3	0	0	0	108.6	L319 V381	L319-L346 WeakPolarHBondContact CA-O 3.36Å; L319-L346 HydrophobicContact CB-CB 4.27Å; L319-L346 WeakPolarHBondContact CB-O 3.43Å; L319-L346 HydrophobicContact CD1-CD2 4.35Å; L319-L346 PolarHBondContact N-O 2.96Å; L319-L346 PolarHBondContact O-N 3.13Å; L346-V381 HydrophobicContact CD1-CG2 4.26Å
347	I	89.6	Confident	88.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.3	-174.3	-51.3	163.6	0	0	0	108.9	I316 R317 L318 L345 A349 I353 F373 R379 Y380 A382 F399	I316-I347 HydrophobicContact CG2-CG2 4.03Å; R317-I347 VanDerWaalsContact O-CA 3.31Å; R317-I347 WeakPolarHBondContact O-CA 3.31Å; L318-I347 HydrophobicContact CD2-CB 4.29Å; L318-I347 HydrophobicContact CD2-CD1 4.24Å; L318-I347 HydrophobicContact CD2-CG1 3.75Å; L318-I347 HydrophobicContact CD2-CG2 3.78Å; L345-I347 HydrophobicContact CB-CG1 4.25Å; I347-A349 HydrophobicContact CG2-CB 4.37Å; I347-I353 HydrophobicContact CG2-CD1 3.68Å; I347-F373 HydrophobicContact CD1-CE2 3.93Å; I347-R379 CarbonylContact O-C 3.56Å; I347-R379 VanDerWaalsContact O-CA 3.29Å; I347-R379 WeakPolarHBondContact O-CA 3.49Å; I347-Y380 HydrophobicContact CG2-CD2 4.43Å; I347-Y380 PolarHBondContact N-O 3.27Å; I347-Y380 PolarHBondContact O-N 2.83Å; I347-A382 HydrophobicContact CD1-CB 3.75Å; I347-F399 HydrophobicContact CD1-CD1 4.43Å; I347-F399 HydrophobicContact CD1-CE1 3.4Å; I347-F399 VanDerWaalsContact CD1-CE1 3.4Å; I347-F399 HydrophobicContact CD1-CZ 3.6Å; I347-F399 HydrophobicContact CG1-CE1 4.36Å
348	E	89.6	Confident	88.4	Confident	39 Å²	39	40.2 Å²	40.2	18%	0.182	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.5	170.2	-55.5	-173.7	148.3	0	0	108.3	Y315 I316 R317 R379	Y315-E348 HydrophobicContact CE2-CB 4.01Å; Y315-E348 WeakPolarHBondContact CE2-O 3.46Å; I316-E348 CarbonylContact C-O 3.56Å; I316-E348 WeakPolarHBondContact CA-O 3.25Å; R317-E348 HydrophobicContact CB-CB 4.33Å; R317-E348 PolarHBondContact N-O 2.88Å; R317-E348 IonicContact NH1-OE2 2.78Å; R317-E348 PolarHBondContact O-N 2.81Å; E348-R379 HydrophobicContact CG-CG 4.32Å; E348-R379 IonicContact OE1-CZ 3.64Å; E348-R379 IonicContact OE1-NE 2.86Å; E348-R379 PolarHBondContact OE1-NE 2.75Å
349	A	89.1	Confident	88.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	131	-174.6	0	0	0	0	0	112.2	Y315 I316 I347 P351 I353 N378 Y380	Y315-A349 WeakPolarHBondContact O-CA 2.73Å; I316-A349 HydrophobicContact CB-CB 4.41Å; I316-A349 HydrophobicContact CG1-CB 3.85Å; I316-A349 HydrophobicContact CG2-CB 4.39Å; I347-A349 HydrophobicContact CG2-CB 4.37Å; A349-P351 CarbonylContact C-O 3.59Å; A349-I353 HydrophobicContact CB-CD1 3.86Å; A349-I353 HydrophobicContact CB-CG1 3.66Å; A349-N378 PolarHBondContact N-O 3.27Å; A349-Y380 HydrophobicContact CB-CD2 4.33Å; A349-Y380 HydrophobicContact CB-CE2 3.96Å
350	Y	89.2	Confident	88.9	Confident	23 Å²	23	40.1 Å²	40.1	9%	0.09	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	123.1	169.5	-166.8	-94.1	0	0	0	110.3	I226 R227 I228 E231 P314 Y315	I226-Y350 HydrophobicContact CB-CD2 3.8Å; I226-Y350 HydrophobicContact CB-CE2 4.18Å; I226-Y350 HydrophobicContact CB-CG 4.03Å; I226-Y350 HydrophobicContact CG2-CD1 3.88Å; I226-Y350 HydrophobicContact CG2-CD2 3.88Å; I226-Y350 HydrophobicContact CG2-CE1 4.47Å; I226-Y350 HydrophobicContact CG2-CE2 4.47Å; I226-Y350 HydrophobicContact CG2-CG 3.55Å; I226-Y350 WeakPolarHBondContact O-CE2 3.25Å; I226-Y350 PolarHBondContact O-OH 3.31Å; I226-Y350 VanDerWaalsContact O-OH 3.13Å; R227-Y350 WeakPolarHBondContact CD-OH 3.29Å; R227-Y350 PolarHBondContact NH1-OH 2.8Å; I228-Y350 HydrophobicContact CD1-CD1 4.01Å; I228-Y350 HydrophobicContact CD1-CE1 3.95Å; I228-Y350 HydrophobicContact CG1-CD1 3.83Å; I228-Y350 HydrophobicContact CG1-CE1 3.79Å; E231-Y350 PolarHBondContact OE2-OH 3.39Å; E231-Y350 VanDerWaalsContact OE2-OH 3.14Å; P314-Y350 CarbonylContact C-O 3.4Å; P314-Y350 VanDerWaalsContact CA-O 3.29Å; P314-Y350 WeakPolarHBondContact CA-O 3.05Å; Y315-Y350 PolarHBondContact N-O 3.33Å; Y315-Y350 PolarHBondContact O-N 2.81Å
351	P	88.9	Confident	88.6	Confident	16 Å²	16	37.6 Å²	37.6	10%	0.104	20%	0.195	C	C	.	.	S	Bend	cis	-66	176.4	-1.2	-21.2	35	0	0	0	113.7	I228 A349 L405	I228-P351 HydrophobicContact CD1-CG 4.11Å; A349-P351 CarbonylContact C-O 3.59Å; P351-L405 HydrophobicContact CG-CD1 3.85Å; P351-L405 HydrophobicContact CG-CG 4.34Å
352	H	88.9	Confident	88.1	Confident	85 Å²	85	39.1 Å²	39.1	39%	0.394	21%	0.205	S	C	.	.			trans	-59.3	152.2	-177.7	67.1	-76.4	0	0	0	113	Y380 S403	H352-Y380 VanDerWaalsContact CA-OH 3.31Å; H352-Y380 WeakPolarHBondContact CA-OH 3.41Å; H352-Y380 WeakPolarHBondContact CB-OH 3.36Å; H352-S403 WeakPolarHBondContact O-CB 3.49Å
353	I	90.6	Very high	87.1	Confident	18 Å²	18	40.1 Å²	40.1	9%	0.092	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.9	-179.8	-63.8	169.7	0	0	0	108.7	I347 A349 E355 Q356 F373 Y380 A401 K402	I347-I353 HydrophobicContact CG2-CD1 3.68Å; A349-I353 HydrophobicContact CB-CD1 3.86Å; A349-I353 HydrophobicContact CB-CG1 3.66Å; I353-E355 WeakPolarHBondContact CG2-O 3.43Å; I353-Q356 HydrophobicContact CG2-CB 4.14Å; I353-F373 HydrophobicContact CD1-CZ 4.06Å; I353-F373 HydrophobicContact CG2-CZ 4.34Å; I353-Y380 HydrophobicContact CB-CE1 4.43Å; I353-Y380 HydrophobicContact CD1-CD1 4.29Å; I353-Y380 HydrophobicContact CD1-CD2 3.76Å; I353-Y380 HydrophobicContact CD1-CE1 4.48Å; I353-Y380 HydrophobicContact CD1-CE2 4.04Å; I353-Y380 HydrophobicContact CD1-CG 3.95Å; I353-Y380 HydrophobicContact CG1-CD2 4.47Å; I353-Y380 HydrophobicContact CG1-CE2 4.25Å; I353-A401 HydrophobicContact CD1-CB 4.12Å; I353-A401 HydrophobicContact CG2-CB 4.24Å; I353-K402 CarbonylContact C-O 3.51Å; I353-K402 WeakPolarHBondContact CA-O 3.35Å; I353-K402 WeakPolarHBondContact CG2-O 3.35Å
354	T	90.1	Very high	85.9	Confident	71 Å²	71	44.4 Å²	44.4	44%	0.436	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-27.9	178.4	51	0	0	0	0	113.3	K402 D404	T354-K402 PolarHBondContact N-O 2.85Å; T354-K402 PolarHBondContact OG1-O 2.75Å; T354-D404 VanDerWaalsContact CG2-OD1 3.25Å; T354-D404 WeakPolarHBondContact CG2-OD1 3.28Å
355	E	90.8	Very high	84.7	Confident	88 Å²	88	48.4 Å²	48.4	41%	0.411	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	134.3	-178.1	-177.8	-179	-174.8	0	0	110.2	I353 Y400 A401 K402	I353-E355 WeakPolarHBondContact CG2-O 3.43Å; E355-Y400 HydrophobicContact CG-CE2 4.26Å; E355-A401 CarbonylContact O-C 3.58Å; E355-A401 WeakPolarHBondContact O-CA 3.47Å; E355-K402 HydrophobicContact CB-CB 4.2Å; E355-K402 PolarHBondContact N-O 2.91Å; E355-K402 VanDerWaalsContact N-O 3.08Å; E355-K402 PolarHBondContact O-N 3.18Å; E355-K402 WeakPolarHBondContact OE2-CD 3.37Å; E355-K402 IonicContact OE2-NZ 3.89Å; E355-K402 PolarHBondContact OE2-NZ 3.44Å
356	Q	92.3	Very high	83.2	Confident	72 Å²	72	54.9 Å²	54.9	34%	0.336	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	155.2	-179.7	67.5	85.4	24.5	0	0	112	I353 F373 F399 Y400	I353-Q356 HydrophobicContact CG2-CB 4.14Å; Q356-F373 HydrophobicContact CB-CE2 4.39Å; Q356-F373 HydrophobicContact CG-CD1 4.27Å; Q356-F373 HydrophobicContact CG-CD2 4.04Å; Q356-F373 HydrophobicContact CG-CE1 4.2Å; Q356-F373 HydrophobicContact CG-CE2 4Å; Q356-F373 HydrophobicContact CG-CG 4.18Å; Q356-F373 HydrophobicContact CG-CZ 4.07Å; Q356-F399 HydrophobicContact CB-CE2 4.42Å; Q356-F399 HydrophobicContact CB-CZ 4.14Å; Q356-Y400 VanDerWaalsContact CA-O 3.27Å; Q356-Y400 WeakPolarHBondContact CA-O 3.39Å
357	G	89.3	Confident	81.6	Confident	10 Å²	10	57.1 Å²	57.1	10%	0.103	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.1	169.9	171.5	0	0	0	0	0	114.1	F399 Y400	G357-F399 WeakPolarHBondContact O-CA 3.46Å; G357-F399 WeakPolarHBondContact O-CD2 3.27Å; G357-Y400 VanDerWaalsContact C-CE1 3.5Å; G357-Y400 PolarHBondContact N-O 3.45Å; G357-Y400 WeakPolarHBondContact O-CD1 3.49Å; G357-Y400 WeakPolarHBondContact O-CE1 3.41Å; G357-Y400 PolarHBondContact O-N 3.06Å
358	W	89.3	Confident	80.2	Confident	23 Å²	23	59 Å²	59	9%	0.087	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.8	170.8	-73.1	94.9	0	0	0	109.6	L343 L345 L384 T398 F399 F412	L343-W358 HydrophobicContact CB-CH2 3.99Å; L343-W358 HydrophobicContact CB-CZ3 4.48Å; L343-W358 HydrophobicContact CD1-CZ3 4.32Å; L345-W358 HydrophobicContact CD1-CH2 3.77Å; L345-W358 HydrophobicContact CD1-CZ2 3.84Å; L345-W358 HydrophobicContact CG-CH2 4.26Å; L345-W358 HydrophobicContact CG-CZ2 4.38Å; W358-L384 HydrophobicContact CB-CD2 4.39Å; W358-L384 HydrophobicContact CD2-CB 3.91Å; W358-L384 HydrophobicContact CD2-CD2 3.91Å; W358-L384 HydrophobicContact CD2-CG 4.46Å; W358-L384 HydrophobicContact CE3-CB 4.4Å; W358-L384 HydrophobicContact CE3-CD2 3.87Å; W358-L384 HydrophobicContact CG-CB 4.27Å; W358-L384 HydrophobicContact CG-CD2 4.16Å; W358-L384 HydrophobicContact CH2-CB 4.41Å; W358-L384 HydrophobicContact CZ2-CB 3.94Å; W358-L384 HydrophobicContact CZ3-CD2 4.41Å; W358-T398 CarbonylContact C-O 3.55Å; W358-T398 WeakPolarHBondContact CA-O 3.48Å; W358-F399 AromaticContact CD1-CD2 3.89Å; W358-F399 HydrophobicContact CD2-CB 4Å; W358-F399 AromaticContact CD2-CD2 3.81Å; W358-F399 HydrophobicContact CD2-CD2 3.81Å; W358-F399 HydrophobicContact CD2-CG 4.39Å; W358-F399 AromaticContact CE2-CD2 3.48Å; W358-F399 VanDerWaalsContact CE2-CD2 3.48Å; W358-F399 HydrophobicContact CE3-CB 3.8Å; W358-F399 HydrophobicContact CE3-CD2 4.48Å; W358-F399 HydrophobicContact CG-CD2 4.07Å; W358-F399 HydrophobicContact CH2-CB 3.84Å; W358-F399 HydrophobicContact CZ2-CB 4Å; W358-F399 AromaticContact CZ2-CD2 3.92Å; W358-F399 HydrophobicContact CZ2-CD2 3.92Å; W358-F399 HydrophobicContact CZ2-CG 4.21Å; W358-F399 HydrophobicContact CZ3-CB 3.73Å; W358-F399 AromaticContact NE1-CD2 3.52Å; W358-F399 AromaticContact NE1-CE2 3.97Å; W358-F412 HydrophobicContact CH2-CD2 4.07Å; W358-F412 AromaticContact CH2-CE2 3.64Å; W358-F412 HydrophobicContact CH2-CE2 3.64Å; W358-F412 AromaticContact CZ3-CD2 3.83Å; W358-F412 HydrophobicContact CZ3-CD2 3.83Å; W358-F412 AromaticContact CZ3-CE2 3.85Å; W358-F412 HydrophobicContact CZ3-CE2 3.85Å
359	L	88.4	Confident	79.3	Confident	99 Å²	99	58 Å²	58	52%	0.518	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.9	167.5	-59.6	174.1	0	0	0	107.4	Y397 T398 Y400	L359-Y397 WeakPolarHBondContact O-CA 3.4Å; L359-T398 PolarHBondContact N-O 3.3Å; L359-T398 PolarHBondContact O-N 2.9Å; L359-Y400 HydrophobicContact CD1-CD1 4.28Å; L359-Y400 HydrophobicContact CD2-CD1 4.48Å; L359-Y400 HydrophobicContact CD2-CE1 4.08Å; L359-Y400 HydrophobicContact CG-CD1 3.99Å; L359-Y400 HydrophobicContact CG-CE1 4.07Å
360	T	86.1	Confident	78.6	Confident	30 Å²	30	62.7 Å²	62.7	18%	0.184	36%	0.356	C	S	.	.			trans	-104.9	153.5	-179.5	51.7	0	0	0	0	110.6	T362 L384 Y397	T360-T362 VanDerWaalsContact C-N 3.29Å; T360-T362 WeakPolarHBondContact CB-O 3.44Å; T360-T362 PolarHBondContact O-N 2.93Å; T360-T362 PolarHBondContact OG1-O 3.27Å; T360-L384 HydrophobicContact CG2-CD2 4.34Å; T360-Y397 HydrophobicContact CG2-CD1 3.85Å; T360-Y397 HydrophobicContact CG2-CE1 3.79Å
361	P	80.5	Confident	78.3	Confident	57 Å²	57	66.2 Å²	66.2	37%	0.37	37%	0.373	S	S	.	.	S	Bend	trans	-63.2	-36.4	178.5	-19.3	30.1	0	0	0	112.9	Y397	P361-Y397 HydrophobicContact CG-CD2 4.2Å; P361-Y397 HydrophobicContact CG-CE2 3.87Å
362	T	75.3	Confident	78	Confident	38 Å²	38	71.2 Å²	71.2	23%	0.233	39%	0.393	C	S	.	.	S	Bend	trans	-107	153.4	176.7	51.6	0	0	0	0	110.4	T360 Q392	T360-T362 VanDerWaalsContact C-N 3.29Å; T360-T362 WeakPolarHBondContact CB-O 3.44Å; T360-T362 PolarHBondContact O-N 2.93Å; T360-T362 PolarHBondContact OG1-O 3.27Å; T362-Q392 VanDerWaalsContact CG2-O 3.31Å; T362-Q392 WeakPolarHBondContact CG2-O 3.42Å
363	P	67.5	Low	77.9	Confident	113 Å²	113	70.4 Å²	70.4	73%	0.734	39%	0.389	S	S	*	.			trans	-59.2	143.7	176.2	-12	22.1	0	0	0	110.7	N365	P363-N365 PolarHBondContact O-N 2.96Å; P363-N365 VanDerWaalsContact O-N 3.11Å
364	P	62.3	Low	77.5	Confident	91 Å²	91	71.4 Å²	71.4	59%	0.591	39%	0.394	S	S	*	.			trans	-63.7	115.7	-174.4	24.3	-33	0	0	0	111
365	N	62.7	Low	76.9	Confident	94 Å²	94	74.4 Å²	74.4	50%	0.503	40%	0.398	S	S	.	.			trans	-94.2	107.1	168.8	-161.1	-5.8	0	0	0	108.1	P363 S367 T368 Q369	P363-N365 PolarHBondContact O-N 2.96Å; P363-N365 VanDerWaalsContact O-N 3.11Å; N365-S367 PolarHBondContact O-N 3.17Å; N365-S367 PolarHBondContact OD1-OG 3.44Å; N365-T368 PolarHBondContact O-N 3.41Å; N365-T368 VanDerWaalsContact O-N 3.15Å; N365-T368 PolarHBondContact O-OG1 3.11Å; N365-Q369 PolarHBondContact O-N 2.77Å
366	T	56.3	Low	76.1	Confident	136 Å²	136	76.8 Å²	76.8	83%	0.834	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-4.6	-170.4	42.1	0	0	0	0	115.1
367	S	57.2	Low	75.2	Confident	96 Å²	96	77 Å²	77	67%	0.671	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-21.1	177	60.1	0	0	0	0	114.2	N365	N365-S367 PolarHBondContact O-N 3.17Å; N365-S367 PolarHBondContact OD1-OG 3.44Å
368	T	59.8	Low	74.3	Confident	40 Å²	40	77.3 Å²	77.3	25%	0.245	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-14.8	-174.9	56.1	0	0	0	0	113.9	N365 K387	N365-T368 PolarHBondContact O-N 3.41Å; N365-T368 VanDerWaalsContact O-N 3.15Å; N365-T368 PolarHBondContact O-OG1 3.11Å; T368-K387 PolarHBondContact O-N 3.46Å
369	Q	71.4	Confident	74	Confident	18 Å²	18	81.3 Å²	81.3	8%	0.084	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.9	-177	-55.3	-176.2	-15.3	0	0	111	N365 Q385 L386	N365-Q369 PolarHBondContact O-N 2.77Å; Q369-Q385 WeakPolarHBondContact CA-O 3.34Å; Q369-L386 HydrophobicContact CB-CD2 4.43Å; Q369-L386 HydrophobicContact CG-CD2 3.78Å
370	E	74.3	Confident	73.9	Confident	99 Å²	99	76.8 Å²	76.8	46%	0.463	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.6	176.9	-173.5	173.8	175.4	0	0	109.9	Q385 K387	E370-Q385 HydrophobicContact CB-CB 4.27Å; E370-Q385 PolarHBondContact N-O 3.46Å; E370-Q385 PolarHBondContact O-N 3.13Å; E370-K387 IonicContact OE2-NZ 3.77Å; E370-K387 PolarHBondContact OE2-NZ 3.05Å
371	H	81.8	Confident	74	Confident	97 Å²	97	76.7 Å²	76.7	45%	0.449	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124	-175.5	-66.4	-148.6	0	0	0	108.7	L384	H371-L384 WeakPolarHBondContact NE2-CD1 3.46Å
372	K	83.5	Confident	74.4	Confident	120 Å²	120	74 Å²	74	52%	0.522	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.8	177.2	-157.1	-176.4	-170.5	-169.4	0	109.5	I374 A382 T383	K372-I374 HydrophobicContact CD-CD1 3.74Å; K372-I374 HydrophobicContact CD-CG1 4.06Å; K372-I374 HydrophobicContact CG-CD1 4.12Å; K372-I374 HydrophobicContact CG-CG1 3.85Å; K372-A382 CarbonylContact O-C 3.59Å; K372-A382 WeakPolarHBondContact O-CA 3.23Å; K372-T383 PolarHBondContact N-O 2.75Å; K372-T383 PolarHBondContact O-N 3.14Å
373	F	86.1	Confident	75.1	Confident	68 Å²	68	72.6 Å²	72.6	30%	0.298	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	109.3	172.7	-171.1	-100.4	0	0	0	108.2	I347 I353 Q356 Y380 V381 A382 F399	I347-F373 HydrophobicContact CD1-CE2 3.93Å; I353-F373 HydrophobicContact CD1-CZ 4.06Å; I353-F373 HydrophobicContact CG2-CZ 4.34Å; Q356-F373 HydrophobicContact CB-CE2 4.39Å; Q356-F373 HydrophobicContact CG-CD1 4.27Å; Q356-F373 HydrophobicContact CG-CD2 4.04Å; Q356-F373 HydrophobicContact CG-CE1 4.2Å; Q356-F373 HydrophobicContact CG-CE2 4Å; Q356-F373 HydrophobicContact CG-CG 4.18Å; Q356-F373 HydrophobicContact CG-CZ 4.07Å; F373-Y380 AromaticContact CE1-CD1 3.63Å; F373-Y380 HydrophobicContact CE1-CD1 3.63Å; F373-Y380 HydrophobicContact CE1-CE1 4.29Å; F373-Y380 HydrophobicContact CE1-CG 4.47Å; F373-Y380 HydrophobicContact CE2-CD1 4.49Å; F373-Y380 AromaticContact CZ-CD1 3.49Å; F373-Y380 HydrophobicContact CZ-CD1 3.49Å; F373-Y380 VanDerWaalsContact CZ-CD1 3.49Å; F373-Y380 HydrophobicContact CZ-CE1 4.32Å; F373-Y380 AromaticContact CZ-CG 3.93Å; F373-Y380 HydrophobicContact CZ-CG 3.93Å; F373-V381 WeakPolarHBondContact CA-O 3.44Å; F373-A382 HydrophobicContact CD2-CB 3.79Å; F373-A382 HydrophobicContact CE2-CB 4.2Å; F373-F399 HydrophobicContact CD2-CZ 4.38Å; F373-F399 HydrophobicContact CE2-CZ 4.05Å
374	I	81.9	Confident	76.1	Confident	40 Å²	40	67.2 Å²	67.2	21%	0.205	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.5	-175.4	-42.6	173.6	0	0	0	108.9	K372 Y376 Y380 V381	K372-I374 HydrophobicContact CD-CD1 3.74Å; K372-I374 HydrophobicContact CD-CG1 4.06Å; K372-I374 HydrophobicContact CG-CD1 4.12Å; K372-I374 HydrophobicContact CG-CG1 3.85Å; I374-Y376 HydrophobicContact CB-CE2 3.86Å; I374-Y376 HydrophobicContact CD1-CE2 4.37Å; I374-Y376 HydrophobicContact CG2-CD2 4.16Å; I374-Y376 HydrophobicContact CG2-CE1 4.12Å; I374-Y376 HydrophobicContact CG2-CE2 3.52Å; I374-Y380 CarbonylContact O-C 3.6Å; I374-Y380 VanDerWaalsContact O-CA 3.23Å; I374-Y380 WeakPolarHBondContact O-CA 3.34Å; I374-V381 PolarHBondContact N-O 2.83Å; I374-V381 PolarHBondContact O-N 2.89Å
375	R	79.3	Confident	77.3	Confident	134 Å²	134	65.8 Å²	65.8	51%	0.506	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130	173.5	-178.7	-179.9	179.8	-173.9	-1.9	110.3	N377 Y380	R375-N377 WeakPolarHBondContact CG-O 3.44Å; R375-N377 PolarHBondContact NE-O 2.97Å; R375-Y380 HydrophobicContact CB-CD1 3.8Å; R375-Y380 HydrophobicContact CB-CE1 3.9Å; R375-Y380 HydrophobicContact CG-CD1 3.82Å; R375-Y380 HydrophobicContact CG-CE1 3.5Å; R375-Y380 VanDerWaalsContact CG-CE1 3.5Å
376	Y	73.6	Confident	78.5	Confident	138 Å²	138	61.4 Å²	61.4	54%	0.541	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	90.5	170.9	-60.5	-78.3	0	0	0	108.5	I374 N378 R379 V381	I374-Y376 HydrophobicContact CB-CE2 3.86Å; I374-Y376 HydrophobicContact CD1-CE2 4.37Å; I374-Y376 HydrophobicContact CG2-CD2 4.16Å; I374-Y376 HydrophobicContact CG2-CE1 4.12Å; I374-Y376 HydrophobicContact CG2-CE2 3.52Å; Y376-N378 PolarHBondContact O-N 3.35Å; Y376-N378 VanDerWaalsContact O-N 3.11Å; Y376-R379 CarbonylContact C-O 3.6Å; Y376-R379 WeakPolarHBondContact CA-O 3.12Å; Y376-R379 PolarHBondContact N-O 2.85Å; Y376-R379 PolarHBondContact O-N 2.97Å; Y376-R379 VanDerWaalsContact O-O 3.09Å; Y376-V381 HydrophobicContact CD2-CG2 4.18Å; Y376-V381 HydrophobicContact CE2-CG2 4Å
377	N	72.5	Confident	79.9	Confident	75 Å²	75	59.2 Å²	59.2	40%	0.401	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	-109.4	-173.9	-167.4	16.3	0	0	0	112.6	E224 R375	E224-N377 PolarHBondContact O-ND2 2.71Å; R375-N377 WeakPolarHBondContact CG-O 3.44Å; R375-N377 PolarHBondContact NE-O 2.97Å
378	N	70.9	Confident	81.1	Confident	18 Å²	18	64.2 Å²	64.2	10%	0.096	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	5.2	176.3	-63.7	-34.5	0	0	0	113.6	I226 A349 Y376	I226-N378 HydrophobicContact CD1-CB 3.75Å; I226-N378 WeakPolarHBondContact CD1-ND2 3.27Å; I226-N378 WeakPolarHBondContact CG1-ND2 3.15Å; A349-N378 PolarHBondContact N-O 3.27Å; Y376-N378 PolarHBondContact O-N 3.35Å; Y376-N378 VanDerWaalsContact O-N 3.11Å
379	R	83.2	Confident	82.3	Confident	106 Å²	106	62.3 Å²	62.3	40%	0.4	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.9	174.5	-59.7	-171.2	-177.3	156.9	9.8	109.9	I347 E348 Y376	I347-R379 CarbonylContact O-C 3.56Å; I347-R379 VanDerWaalsContact O-CA 3.29Å; I347-R379 WeakPolarHBondContact O-CA 3.49Å; E348-R379 HydrophobicContact CG-CG 4.32Å; E348-R379 IonicContact OE1-CZ 3.64Å; E348-R379 IonicContact OE1-NE 2.86Å; E348-R379 PolarHBondContact OE1-NE 2.75Å; Y376-R379 CarbonylContact C-O 3.6Å; Y376-R379 WeakPolarHBondContact CA-O 3.12Å; Y376-R379 PolarHBondContact N-O 2.85Å; Y376-R379 PolarHBondContact O-N 2.97Å; Y376-R379 VanDerWaalsContact O-O 3.09Å
380	Y	86.5	Confident	82.9	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.6	179.9	-46.8	-109.2	0	0	0	109.4	I347 A349 H352 I353 F373 I374 R375	I347-Y380 HydrophobicContact CG2-CD2 4.43Å; I347-Y380 PolarHBondContact N-O 3.27Å; I347-Y380 PolarHBondContact O-N 2.83Å; A349-Y380 HydrophobicContact CB-CD2 4.33Å; A349-Y380 HydrophobicContact CB-CE2 3.96Å; H352-Y380 VanDerWaalsContact CA-OH 3.31Å; H352-Y380 WeakPolarHBondContact CA-OH 3.41Å; H352-Y380 WeakPolarHBondContact CB-OH 3.36Å; I353-Y380 HydrophobicContact CB-CE1 4.43Å; I353-Y380 HydrophobicContact CD1-CD1 4.29Å; I353-Y380 HydrophobicContact CD1-CD2 3.76Å; I353-Y380 HydrophobicContact CD1-CE1 4.48Å; I353-Y380 HydrophobicContact CD1-CE2 4.04Å; I353-Y380 HydrophobicContact CD1-CG 3.95Å; I353-Y380 HydrophobicContact CG1-CD2 4.47Å; I353-Y380 HydrophobicContact CG1-CE2 4.25Å; F373-Y380 AromaticContact CE1-CD1 3.63Å; F373-Y380 HydrophobicContact CE1-CD1 3.63Å; F373-Y380 HydrophobicContact CE1-CE1 4.29Å; F373-Y380 HydrophobicContact CE1-CG 4.47Å; F373-Y380 HydrophobicContact CE2-CD1 4.49Å; F373-Y380 AromaticContact CZ-CD1 3.49Å; F373-Y380 HydrophobicContact CZ-CD1 3.49Å; F373-Y380 VanDerWaalsContact CZ-CD1 3.49Å; F373-Y380 HydrophobicContact CZ-CE1 4.32Å; F373-Y380 AromaticContact CZ-CG 3.93Å; F373-Y380 HydrophobicContact CZ-CG 3.93Å; I374-Y380 CarbonylContact O-C 3.6Å; I374-Y380 VanDerWaalsContact O-CA 3.23Å; I374-Y380 WeakPolarHBondContact O-CA 3.34Å; R375-Y380 HydrophobicContact CB-CD1 3.8Å; R375-Y380 HydrophobicContact CB-CE1 3.9Å; R375-Y380 HydrophobicContact CG-CD1 3.82Å; R375-Y380 HydrophobicContact CG-CE1 3.5Å; R375-Y380 VanDerWaalsContact CG-CE1 3.5Å
381	V	88.3	Confident	83.1	Confident	28 Å²	28	62.4 Å²	62.4	17%	0.17	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.4	171.6	179.7	0	0	0	0	107.5	L345 L346 F373 I374 Y376	L345-V381 WeakPolarHBondContact O-CA 3.33Å; L346-V381 HydrophobicContact CD1-CG2 4.26Å; F373-V381 WeakPolarHBondContact CA-O 3.44Å; I374-V381 PolarHBondContact N-O 2.83Å; I374-V381 PolarHBondContact O-N 2.89Å; Y376-V381 HydrophobicContact CD2-CG2 4.18Å; Y376-V381 HydrophobicContact CE2-CG2 4Å
382	A	88.9	Confident	83.1	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.1	174.3	0	0	0	0	0	109.1	S344 L345 I347 K372 F373 F399	S344-A382 CarbonylContact C-O 3.55Å; S344-A382 WeakPolarHBondContact CA-O 3.47Å; L345-A382 HydrophobicContact CB-CB 4.3Å; L345-A382 PolarHBondContact N-O 2.75Å; L345-A382 PolarHBondContact O-N 2.76Å; I347-A382 HydrophobicContact CD1-CB 3.75Å; K372-A382 CarbonylContact O-C 3.59Å; K372-A382 WeakPolarHBondContact O-CA 3.23Å; F373-A382 HydrophobicContact CD2-CB 3.79Å; F373-A382 HydrophobicContact CE2-CB 4.2Å; A382-F399 HydrophobicContact CB-CD2 4.18Å; A382-F399 HydrophobicContact CB-CE1 4.29Å; A382-F399 HydrophobicContact CB-CE2 3.54Å; A382-F399 HydrophobicContact CB-CZ 3.6Å
383	T	89	Confident	83	Confident	9 Å²	9	59.8 Å²	59.8	6%	0.055	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.3	-178.7	-47.8	0	0	0	0	109.9	E342 L343 S344 K372 Q385	E342-T383 HydrophobicContact CG-CG2 3.46Å; E342-T383 VanDerWaalsContact CG-CG2 3.46Å; E342-T383 WeakPolarHBondContact OE1-CG2 3.43Å; L343-T383 CarbonylContact O-C 3.59Å; L343-T383 VanDerWaalsContact O-CA 3.31Å; L343-T383 WeakPolarHBondContact O-CA 3.47Å; S344-T383 PolarHBondContact OG-OG1 3.24Å; K372-T383 PolarHBondContact N-O 2.75Å; K372-T383 PolarHBondContact O-N 3.14Å; T383-Q385 HydrophobicContact CG2-CG 4.12Å
384	L	89.1	Confident	83	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	113.1	169.6	177.2	64.1	0	0	0	108.3	L343 W358 T360 H371 L386 Y397	L343-L384 HydrophobicContact CB-CB 4.38Å; L343-L384 HydrophobicContact CD1-CD2 4.46Å; L343-L384 PolarHBondContact N-O 2.83Å; L343-L384 PolarHBondContact O-N 2.78Å; W358-L384 HydrophobicContact CB-CD2 4.39Å; W358-L384 HydrophobicContact CD2-CB 3.91Å; W358-L384 HydrophobicContact CD2-CD2 3.91Å; W358-L384 HydrophobicContact CD2-CG 4.46Å; W358-L384 HydrophobicContact CE3-CB 4.4Å; W358-L384 HydrophobicContact CE3-CD2 3.87Å; W358-L384 HydrophobicContact CG-CB 4.27Å; W358-L384 HydrophobicContact CG-CD2 4.16Å; W358-L384 HydrophobicContact CH2-CB 4.41Å; W358-L384 HydrophobicContact CZ2-CB 3.94Å; W358-L384 HydrophobicContact CZ3-CD2 4.41Å; T360-L384 HydrophobicContact CG2-CD2 4.34Å; H371-L384 WeakPolarHBondContact NE2-CD1 3.46Å; L384-L386 HydrophobicContact CD1-CD2 4.17Å; L384-L386 HydrophobicContact CD2-CD1 4.47Å; L384-L386 HydrophobicContact CD2-CD2 4.23Å; L384-L386 HydrophobicContact CD2-CG 4.47Å; L384-L386 HydrophobicContact CG-CD2 4.05Å; L384-L386 HydrophobicContact CG-CG 4.18Å; L384-Y397 HydrophobicContact CD2-CD1 3.6Å; L384-Y397 HydrophobicContact CD2-CE1 4.05Å
385	Q	88.1	Confident	83.2	Confident	61 Å²	61	57 Å²	57	29%	0.285	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.1	174.3	-71.1	-174	-15.8	0	0	109.9	E342 Q369 E370 T383	E342-Q385 HydrophobicContact CB-CG 4.39Å; E342-Q385 HydrophobicContact CG-CG 3.99Å; E342-Q385 PolarHBondContact OE2-NE2 3.19Å; Q369-Q385 WeakPolarHBondContact CA-O 3.34Å; E370-Q385 HydrophobicContact CB-CB 4.27Å; E370-Q385 PolarHBondContact N-O 3.46Å; E370-Q385 PolarHBondContact O-N 3.13Å; T383-Q385 HydrophobicContact CG2-CG 4.12Å
386	L	86.8	Confident	83.7	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	111.2	178.9	-57.2	168.7	0	0	0	107.4	D340 L341 Q369 L384 M389 Y397	D340-L386 CarbonylContact C-O 3.35Å; D340-L386 WeakPolarHBondContact CA-O 3.39Å; L341-L386 HydrophobicContact CB-CB 4.37Å; L341-L386 HydrophobicContact CD2-CD1 4.17Å; L341-L386 PolarHBondContact N-O 2.93Å; L341-L386 PolarHBondContact O-N 3.24Å; Q369-L386 HydrophobicContact CB-CD2 4.43Å; Q369-L386 HydrophobicContact CG-CD2 3.78Å; L384-L386 HydrophobicContact CD1-CD2 4.17Å; L384-L386 HydrophobicContact CD2-CD1 4.47Å; L384-L386 HydrophobicContact CD2-CD2 4.23Å; L384-L386 HydrophobicContact CD2-CG 4.47Å; L384-L386 HydrophobicContact CG-CD2 4.05Å; L384-L386 HydrophobicContact CG-CG 4.18Å; L386-M389 HydrophobicContact CB-CG 3.83Å; L386-M389 HydrophobicContact CB-SD 3.59Å; L386-M389 VanDerWaalsContact CB-SD 3.59Å; L386-M389 HydrophobicContact CD1-CE 4.49Å; L386-M389 HydrophobicContact CD1-SD 3.55Å; L386-M389 VanDerWaalsContact CD1-SD 3.55Å; L386-M389 HydrophobicContact CG-SD 4.16Å; L386-Y397 HydrophobicContact CD1-CD1 4.34Å; L386-Y397 HydrophobicContact CD1-CE1 3.62Å; L386-Y397 HydrophobicContact CD1-CE2 4.43Å; L386-Y397 HydrophobicContact CD2-CE1 4.14Å
387	K	85.3	Confident	84.4	Confident	89 Å²	89	48.2 Å²	48.2	39%	0.387	22%	0.221	S	C	.	.			trans	-94.8	132.3	-176.6	-71.1	172.3	-176.8	154.8	0	110.6	D340 T368 E370	D340-K387 VanDerWaalsContact OD1-CA 3.3Å; D340-K387 WeakPolarHBondContact OD1-CA 3.49Å; T368-K387 PolarHBondContact O-N 3.46Å; E370-K387 IonicContact OE2-NZ 3.77Å; E370-K387 PolarHBondContact OE2-NZ 3.05Å
388	R	83.9	Confident	85.3	Confident	201 Å²	201	45.7 Å²	45.7	76%	0.758	21%	0.208	S	C	*	.	S	Bend	trans	49.6	60.7	178.4	-60.2	-179.5	177.4	-175.5	-1.5	112.4	D340 N390	D340-R388 PolarHBondContact OD1-N 3.3Å; R388-N390 PolarHBondContact O-N 2.74Å
389	M	84.2	Confident	86.4	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	20%	0.203	C	C	.	.			trans	-53.8	135	-176.8	-77.2	-105.1	-70.7	0	0	112.6	V335 G338 E339 L341 L386 V414 M416	V335-M389 HydrophobicContact CB-CE 4.39Å; V335-M389 HydrophobicContact CG2-CE 4.39Å; G338-M389 PolarHBondContact N-O 3.23Å; E339-M389 WeakPolarHBondContact O-CB 3.5Å; E339-M389 PolarHBondContact O-N 2.75Å; E339-M389 VanDerWaalsContact O-N 3.09Å; L341-M389 HydrophobicContact CB-CE 4.05Å; L341-M389 HydrophobicContact CB-CG 4.19Å; L341-M389 HydrophobicContact CB-SD 4.29Å; L341-M389 HydrophobicContact CD2-CE 3.72Å; L386-M389 HydrophobicContact CB-CG 3.83Å; L386-M389 HydrophobicContact CB-SD 3.59Å; L386-M389 VanDerWaalsContact CB-SD 3.59Å; L386-M389 HydrophobicContact CD1-CE 4.49Å; L386-M389 HydrophobicContact CD1-SD 3.55Å; L386-M389 VanDerWaalsContact CD1-SD 3.55Å; L386-M389 HydrophobicContact CG-SD 4.16Å; M389-V414 HydrophobicContact CE-CG1 3.47Å; M389-V414 VanDerWaalsContact CE-CG1 3.47Å; M389-M416 HydrophobicContact CB-CE 3.74Å; M389-M416 HydrophobicContact CE-CE 3.53Å; M389-M416 HydrophobicContact SD-CE 4.14Å
390	N	84	Confident	86.9	Confident	60 Å²	60	43.5 Å²	43.5	32%	0.321	20%	0.199	S	C	.	.			trans	-111.4	158.9	178	75	59.5	0	0	0	112.6	R388 Q392 E393 M416	R388-N390 PolarHBondContact O-N 2.74Å; N390-Q392 PolarHBondContact O-N 3.21Å; N390-Q392 WeakPolarHBondContact OD1-CA 3.37Å; N390-Q392 VanDerWaalsContact OD1-CB 3.28Å; N390-Q392 WeakPolarHBondContact OD1-CB 3.23Å; N390-Q392 PolarHBondContact OD1-N 3.04Å; N390-E393 PolarHBondContact N-OE2 3.12Å; N390-E393 WeakPolarHBondContact ND2-CG 3.3Å; N390-E393 PolarHBondContact ND2-OE1 2.89Å; N390-E393 PolarHBondContact ND2-OE2 3.48Å; N390-E393 VanDerWaalsContact ND2-OE2 3.11Å; N390-E393 WeakPolarHBondContact O-CB 3.3Å; N390-E393 PolarHBondContact O-N 2.95Å; N390-E393 WeakPolarHBondContact OD1-CG 3.31Å; N390-E393 PolarHBondContact OD1-N 3.42Å; N390-E393 VanDerWaalsContact OD1-N 3.13Å; N390-M416 VanDerWaalsContact C-SD 3.58Å; N390-M416 WeakPolarHBondContact O-CE 3.42Å
391	I	78.8	Confident	87.2	Confident	58 Å²	58	43.4 Å²	43.4	30%	0.297	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-60.1	-24.4	-174.8	-156.4	161.6	0	0	0	114.8	E393 Q394 Q418	I391-E393 VanDerWaalsContact C-N 3.29Å; I391-Q394 VanDerWaalsContact O-CG 3.24Å; I391-Q394 WeakPolarHBondContact O-CG 3.22Å; I391-Q418 HydrophobicContact CD1-CG 4.08Å
392	Q	80.6	Confident	87.4	Confident	148 Å²	148	46.4 Å²	46.4	69%	0.692	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-78.4	-14.7	177.6	-56.8	-64.7	-38.1	0	0	112.5	T362 N390 Q394	T362-Q392 VanDerWaalsContact CG2-O 3.31Å; T362-Q392 WeakPolarHBondContact CG2-O 3.42Å; N390-Q392 PolarHBondContact O-N 3.21Å; N390-Q392 WeakPolarHBondContact OD1-CA 3.37Å; N390-Q392 VanDerWaalsContact OD1-CB 3.28Å; N390-Q392 WeakPolarHBondContact OD1-CB 3.23Å; N390-Q392 PolarHBondContact OD1-N 3.04Å; Q392-Q394 VanDerWaalsContact C-N 3.35Å
393	E	81.4	Confident	87.6	Confident	15 Å²	15	46.5 Å²	46.5	7%	0.07	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-89.1	0.5	177.3	-67.8	168.5	153.6	0	0	112.4	N390 I391 Y397	N390-E393 PolarHBondContact N-OE2 3.12Å; N390-E393 WeakPolarHBondContact ND2-CG 3.3Å; N390-E393 PolarHBondContact ND2-OE1 2.89Å; N390-E393 PolarHBondContact ND2-OE2 3.48Å; N390-E393 VanDerWaalsContact ND2-OE2 3.11Å; N390-E393 WeakPolarHBondContact O-CB 3.3Å; N390-E393 PolarHBondContact O-N 2.95Å; N390-E393 WeakPolarHBondContact OD1-CG 3.31Å; N390-E393 PolarHBondContact OD1-N 3.42Å; N390-E393 VanDerWaalsContact OD1-N 3.13Å; I391-E393 VanDerWaalsContact C-N 3.29Å; E393-Y397 PolarHBondContact O-OH 3.21Å
394	Q	85.9	Confident	87.5	Confident	43 Å²	43	51.3 Å²	51.3	20%	0.201	24%	0.236	C	C	.	.			trans	-65.7	145.8	172.2	75.9	-172.1	-2.7	0	0	111.4	I391 Q392 M416 Y481	I391-Q394 VanDerWaalsContact O-CG 3.24Å; I391-Q394 WeakPolarHBondContact O-CG 3.22Å; Q392-Q394 VanDerWaalsContact C-N 3.35Å; Q394-M416 HydrophobicContact CB-CG 4.46Å; Q394-Y481 PolarHBondContact OE1-O 3.39Å
395	G	86.6	Confident	87.5	Confident	5 Å²	5	56.5 Å²	56.5	5%	0.052	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.5	-158.3	178.5	0	0	0	0	0	114.2	V414	G395-V414 PolarHBondContact N-O 3.47Å; G395-V414 PolarHBondContact O-N 2.81Å
396	Q	89.4	Confident	87.7	Confident	88 Å²	88	55.7 Å²	55.7	41%	0.411	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.1	-176.3	-167.3	177.3	34.5	0	0	112.3	F412	Q396-F412 CarbonylContact C-O 3.55Å; Q396-F412 WeakPolarHBondContact CA-O 3.44Å
397	Y	90.1	Very high	88	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116.2	178.6	-72.6	-98.6	0	0	0	109.8	L343 L359 T360 P361 L384 L386 E393 S411 F412 V414	L343-Y397 HydrophobicContact CD1-CD1 4.46Å; L343-Y397 HydrophobicContact CD1-CG 4.08Å; L359-Y397 WeakPolarHBondContact O-CA 3.4Å; T360-Y397 HydrophobicContact CG2-CD1 3.85Å; T360-Y397 HydrophobicContact CG2-CE1 3.79Å; P361-Y397 HydrophobicContact CG-CD2 4.2Å; P361-Y397 HydrophobicContact CG-CE2 3.87Å; L384-Y397 HydrophobicContact CD2-CD1 3.6Å; L384-Y397 HydrophobicContact CD2-CE1 4.05Å; L386-Y397 HydrophobicContact CD1-CD1 4.34Å; L386-Y397 HydrophobicContact CD1-CE1 3.62Å; L386-Y397 HydrophobicContact CD1-CE2 4.43Å; L386-Y397 HydrophobicContact CD2-CE1 4.14Å; E393-Y397 PolarHBondContact O-OH 3.21Å; Y397-S411 CarbonylContact O-C 3.59Å; Y397-S411 WeakPolarHBondContact O-CA 3.47Å; Y397-F412 PolarHBondContact N-O 3.06Å; Y397-F412 PolarHBondContact O-N 3.23Å; Y397-V414 HydrophobicContact CD2-CB 3.99Å; Y397-V414 HydrophobicContact CD2-CG2 3.5Å; Y397-V414 HydrophobicContact CE2-CB 3.89Å; Y397-V414 HydrophobicContact CE2-CG2 3.8Å; Y397-V414 HydrophobicContact CG-CG2 4.43Å
398	T	91.1	Very high	88.4	Confident	22 Å²	22	58.2 Å²	58.2	14%	0.135	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.6	-176.3	-58	0	0	0	0	111.3	W358 L359 I410 S411	W358-T398 CarbonylContact C-O 3.55Å; W358-T398 WeakPolarHBondContact CA-O 3.48Å; L359-T398 PolarHBondContact N-O 3.3Å; L359-T398 PolarHBondContact O-N 2.9Å; T398-I410 CarbonylContact C-O 3.5Å; T398-I410 WeakPolarHBondContact CA-O 3.24Å; T398-S411 WeakPolarHBondContact CG2-OG 3.5Å; T398-S411 WeakPolarHBondContact OG1-CB 3.16Å; T398-S411 PolarHBondContact OG1-OG 3.37Å
399	F	92.9	Very high	88.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.6	167.5	-178.1	-102.1	0	0	0	109.8	L318 L345 I347 Q356 G357 W358 F373 A382 A401 S409 I410	L318-F399 HydrophobicContact CD2-CD1 4.18Å; L318-F399 HydrophobicContact CD2-CE1 4.05Å; L345-F399 HydrophobicContact CD1-CB 3.37Å; L345-F399 HydrophobicContact CD1-CD1 3.35Å; L345-F399 HydrophobicContact CD1-CD2 4.15Å; L345-F399 HydrophobicContact CD1-CE1 4.15Å; L345-F399 HydrophobicContact CD1-CG 3.34Å; I347-F399 HydrophobicContact CD1-CD1 4.43Å; I347-F399 HydrophobicContact CD1-CE1 3.4Å; I347-F399 VanDerWaalsContact CD1-CE1 3.4Å; I347-F399 HydrophobicContact CD1-CZ 3.6Å; I347-F399 HydrophobicContact CG1-CE1 4.36Å; Q356-F399 HydrophobicContact CB-CE2 4.42Å; Q356-F399 HydrophobicContact CB-CZ 4.14Å; G357-F399 WeakPolarHBondContact O-CA 3.46Å; G357-F399 WeakPolarHBondContact O-CD2 3.27Å; W358-F399 AromaticContact CD1-CD2 3.89Å; W358-F399 HydrophobicContact CD2-CB 4Å; W358-F399 AromaticContact CD2-CD2 3.81Å; W358-F399 HydrophobicContact CD2-CD2 3.81Å; W358-F399 HydrophobicContact CD2-CG 4.39Å; W358-F399 AromaticContact CE2-CD2 3.48Å; W358-F399 VanDerWaalsContact CE2-CD2 3.48Å; W358-F399 HydrophobicContact CE3-CB 3.8Å; W358-F399 HydrophobicContact CE3-CD2 4.48Å; W358-F399 HydrophobicContact CG-CD2 4.07Å; W358-F399 HydrophobicContact CH2-CB 3.84Å; W358-F399 HydrophobicContact CZ2-CB 4Å; W358-F399 AromaticContact CZ2-CD2 3.92Å; W358-F399 HydrophobicContact CZ2-CD2 3.92Å; W358-F399 HydrophobicContact CZ2-CG 4.21Å; W358-F399 HydrophobicContact CZ3-CB 3.73Å; W358-F399 AromaticContact NE1-CD2 3.52Å; W358-F399 AromaticContact NE1-CE2 3.97Å; F373-F399 HydrophobicContact CD2-CZ 4.38Å; F373-F399 HydrophobicContact CE2-CZ 4.05Å; A382-F399 HydrophobicContact CB-CD2 4.18Å; A382-F399 HydrophobicContact CB-CE1 4.29Å; A382-F399 HydrophobicContact CB-CE2 3.54Å; A382-F399 HydrophobicContact CB-CZ 3.6Å; F399-A401 HydrophobicContact CE1-CB 3.76Å; F399-A401 HydrophobicContact CZ-CB 4.25Å; F399-S409 CarbonylContact O-C 3.53Å; F399-S409 WeakPolarHBondContact O-CA 3.47Å; F399-S409 WeakPolarHBondContact O-CB 3.5Å; F399-I410 HydrophobicContact CB-CG2 4.08Å; F399-I410 PolarHBondContact N-O 2.84Å; F399-I410 PolarHBondContact O-N 3.46Å
400	Y	93.6	Very high	89.2	Confident	78 Å²	78	53.6 Å²	53.6	31%	0.306	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.6	171.4	69.9	-85.6	0	0	0	110.4	E355 Q356 G357 L359	E355-Y400 HydrophobicContact CG-CE2 4.26Å; Q356-Y400 VanDerWaalsContact CA-O 3.27Å; Q356-Y400 WeakPolarHBondContact CA-O 3.39Å; G357-Y400 VanDerWaalsContact C-CE1 3.5Å; G357-Y400 PolarHBondContact N-O 3.45Å; G357-Y400 WeakPolarHBondContact O-CD1 3.49Å; G357-Y400 WeakPolarHBondContact O-CE1 3.41Å; G357-Y400 PolarHBondContact O-N 3.06Å; L359-Y400 HydrophobicContact CD1-CD1 4.28Å; L359-Y400 HydrophobicContact CD2-CD1 4.48Å; L359-Y400 HydrophobicContact CD2-CE1 4.08Å; L359-Y400 HydrophobicContact CG-CD1 3.99Å; L359-Y400 HydrophobicContact CG-CE1 4.07Å
401	A	94.1	Very high	89.5	Confident	2 Å²	2	52.4 Å²	52.4	2%	0.017	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.3	173.9	0	0	0	0	0	110.1	I316 I353 E355 F399 N407 A408	I316-A401 HydrophobicContact CG2-CB 4.34Å; I353-A401 HydrophobicContact CD1-CB 4.12Å; I353-A401 HydrophobicContact CG2-CB 4.24Å; E355-A401 CarbonylContact O-C 3.58Å; E355-A401 WeakPolarHBondContact O-CA 3.47Å; F399-A401 HydrophobicContact CE1-CB 3.76Å; F399-A401 HydrophobicContact CZ-CB 4.25Å; A401-N407 CarbonylContact O-C 3.59Å; A401-N407 WeakPolarHBondContact O-CA 3.43Å; A401-A408 PolarHBondContact N-O 3.16Å; A401-A408 PolarHBondContact O-N 3.09Å; A401-A408 VanDerWaalsContact O-O 3.07Å
402	K	92.5	Very high	90	Very high	91 Å²	91	49.7 Å²	49.7	40%	0.396	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	137.3	-178	175.6	178.3	161.7	-153.5	0	109.7	I353 T354 E355 N407	I353-K402 CarbonylContact C-O 3.51Å; I353-K402 WeakPolarHBondContact CA-O 3.35Å; I353-K402 WeakPolarHBondContact CG2-O 3.35Å; T354-K402 PolarHBondContact N-O 2.85Å; T354-K402 PolarHBondContact OG1-O 2.75Å; E355-K402 HydrophobicContact CB-CB 4.2Å; E355-K402 PolarHBondContact N-O 2.91Å; E355-K402 VanDerWaalsContact N-O 3.08Å; E355-K402 PolarHBondContact O-N 3.18Å; E355-K402 WeakPolarHBondContact OE2-CD 3.37Å; E355-K402 IonicContact OE2-NZ 3.89Å; E355-K402 PolarHBondContact OE2-NZ 3.44Å; K402-N407 HydrophobicContact CB-CB 4.14Å; K402-N407 HydrophobicContact CG-CB 4.21Å
403	S	91.7	Very high	90.3	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	175.8	170.9	66	0	0	0	0	108.6	H352 L405 T406	H352-S403 WeakPolarHBondContact O-CB 3.49Å; S403-L405 PolarHBondContact O-N 2.83Å; S403-L405 VanDerWaalsContact O-N 3.13Å; S403-L405 PolarHBondContact OG-N 2.75Å; S403-T406 PolarHBondContact N-O 2.97Å; S403-T406 WeakPolarHBondContact OG-CG2 3.17Å; S403-T406 PolarHBondContact OG-N 2.8Å; S403-T406 PolarHBondContact OG-O 2.87Å
404	D	86.9	Confident	90.6	Very high	110 Å²	110	45.4 Å²	45.4	59%	0.588	24%	0.243	S	C	*	.	S	Bend	trans	-58.6	-25.8	176.8	-64.6	-30.4	0	0	0	113.7	T354	T354-D404 VanDerWaalsContact CG2-OD1 3.25Å; T354-D404 WeakPolarHBondContact CG2-OD1 3.28Å
405	L	89.1	Confident	90.5	Very high	109 Å²	109	45 Å²	45	57%	0.571	24%	0.241	S	C	*	.	S	Bend	trans	-118.9	-15.9	-171.8	-59	179.7	0	0	0	114.8	I228 P314 P351 S403	I228-L405 HydrophobicContact CD1-CD1 4.17Å; P314-L405 HydrophobicContact CB-CB 3.78Å; P314-L405 HydrophobicContact CB-CD1 4.06Å; P314-L405 HydrophobicContact CG-CB 3.72Å; P314-L405 HydrophobicContact CG-CD1 4.12Å; P351-L405 HydrophobicContact CG-CD1 3.85Å; P351-L405 HydrophobicContact CG-CG 4.34Å; S403-L405 PolarHBondContact O-N 2.83Å; S403-L405 VanDerWaalsContact O-N 3.13Å; S403-L405 PolarHBondContact OG-N 2.75Å
406	T	92	Very high	90.5	Very high	44 Å²	44	45 Å²	45	27%	0.27	24%	0.239	S	C	.	.			trans	-155.7	157.9	-178.5	-169.9	0	0	0	0	112.2	P314 I316 S403	P314-T406 HydrophobicContact CB-CG2 4.39Å; I316-T406 HydrophobicContact CB-CG2 4.46Å; I316-T406 HydrophobicContact CD1-CG2 3.87Å; I316-T406 VanDerWaalsContact CD1-O 3.25Å; I316-T406 WeakPolarHBondContact CD1-O 3.43Å; I316-T406 HydrophobicContact CG1-CG2 3.75Å; S403-T406 PolarHBondContact N-O 2.97Å; S403-T406 WeakPolarHBondContact OG-CG2 3.17Å; S403-T406 PolarHBondContact OG-N 2.8Å; S403-T406 PolarHBondContact OG-O 2.87Å
407	N	93.9	Very high	90.3	Very high	119 Å²	119	44.3 Å²	44.3	64%	0.636	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126	159	173.2	61.7	9.4	0	0	0	111.5	A401 K402	A401-N407 CarbonylContact O-C 3.59Å; A401-N407 WeakPolarHBondContact O-CA 3.43Å; K402-N407 HydrophobicContact CB-CB 4.14Å; K402-N407 HydrophobicContact CG-CB 4.21Å
408	A	93.7	Very high	90.1	Very high	26 Å²	26	46 Å²	46	22%	0.215	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	151.7	174.4	0	0	0	0	0	110.4	I316 L318 A401	I316-A408 HydrophobicContact CB-CB 3.88Å; I316-A408 HydrophobicContact CG2-CB 3.73Å; L318-A408 HydrophobicContact CD1-CB 3.78Å; L318-A408 HydrophobicContact CG-CB 4.07Å; A401-A408 PolarHBondContact N-O 3.16Å; A401-A408 PolarHBondContact O-N 3.09Å; A401-A408 VanDerWaalsContact O-O 3.07Å
409	S	94.3	Very high	89.9	Confident	82 Å²	82	52.5 Å²	52.5	57%	0.573	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.9	153.8	174.7	59.2	0	0	0	0	112	F399	F399-S409 CarbonylContact O-C 3.53Å; F399-S409 WeakPolarHBondContact O-CA 3.47Å; F399-S409 WeakPolarHBondContact O-CB 3.5Å
410	I	90.8	Very high	89.7	Confident	22 Å²	22	52.7 Å²	52.7	11%	0.113	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	139.3	177.5	-168	169.1	0	0	0	110.2	L318 P320 L331 L345 T398 F399 F412	L318-I410 HydrophobicContact CB-CB 4.4Å; L318-I410 HydrophobicContact CB-CD1 4.49Å; L318-I410 HydrophobicContact CB-CG2 4.25Å; L318-I410 HydrophobicContact CD1-CB 3.98Å; L318-I410 HydrophobicContact CD1-CG2 3.9Å; P320-I410 HydrophobicContact CB-CD1 4.47Å; P320-I410 HydrophobicContact CG-CD1 4.27Å; L331-I410 HydrophobicContact CD1-CD1 4.46Å; L331-I410 HydrophobicContact CD1-CG1 4.08Å; L331-I410 HydrophobicContact CD2-CD1 3.86Å; L331-I410 HydrophobicContact CD2-CG1 3.97Å; L345-I410 HydrophobicContact CD1-CG2 3.68Å; L345-I410 HydrophobicContact CD2-CD1 4.21Å; L345-I410 HydrophobicContact CD2-CG2 3.66Å; L345-I410 HydrophobicContact CG-CG2 4.36Å; T398-I410 CarbonylContact C-O 3.5Å; T398-I410 WeakPolarHBondContact CA-O 3.24Å; F399-I410 HydrophobicContact CB-CG2 4.08Å; F399-I410 PolarHBondContact N-O 2.84Å; F399-I410 PolarHBondContact O-N 3.46Å; I410-F412 HydrophobicContact CG2-CE2 4.23Å
411	S	90.4	Very high	89.5	Confident	36 Å²	36	53.6 Å²	53.6	25%	0.252	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.2	-173	-55.4	0	0	0	0	112.4	L331 Y397 T398	L331-S411 WeakPolarHBondContact CB-O 3.36Å; L331-S411 WeakPolarHBondContact CD1-O 3.28Å; Y397-S411 CarbonylContact O-C 3.59Å; Y397-S411 WeakPolarHBondContact O-CA 3.47Å; T398-S411 WeakPolarHBondContact CG2-OG 3.5Å; T398-S411 WeakPolarHBondContact OG1-CB 3.16Å; T398-S411 PolarHBondContact OG1-OG 3.37Å
412	F	88.6	Confident	89.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.8	174.8	-59.3	-91.4	0	0	0	110.5	P320 L322 L331 L343 L345 W358 Q396 Y397 I410	P320-F412 HydrophobicContact CB-CE1 4.01Å; P320-F412 HydrophobicContact CB-CZ 4.13Å; L322-F412 HydrophobicContact CD1-CD1 4.44Å; L322-F412 HydrophobicContact CD1-CE1 4.17Å; L322-F412 HydrophobicContact CD2-CD1 4.36Å; L322-F412 HydrophobicContact CD2-CE1 3.99Å; L322-F412 HydrophobicContact CG-CE1 4.26Å; L331-F412 HydrophobicContact CD2-CD1 3.73Å; L331-F412 HydrophobicContact CD2-CE1 3.58Å; L331-F412 HydrophobicContact CD2-CG 4.45Å; L331-F412 HydrophobicContact CD2-CZ 4.18Å; L331-F412 CarbonylContact O-C 3.47Å; L331-F412 VanDerWaalsContact O-CA 3.28Å; L331-F412 WeakPolarHBondContact O-CA 3.32Å; L343-F412 HydrophobicContact CD1-CB 4.08Å; L343-F412 HydrophobicContact CD1-CD2 4.2Å; L343-F412 HydrophobicContact CD1-CG 4.15Å; L343-F412 HydrophobicContact CD2-CB 4.44Å; L343-F412 HydrophobicContact CD2-CD1 4.17Å; L343-F412 HydrophobicContact CD2-CG 4.23Å; L345-F412 HydrophobicContact CD1-CE2 4.28Å; L345-F412 HydrophobicContact CD2-CE2 3.95Å; L345-F412 HydrophobicContact CD2-CZ 3.58Å; L345-F412 HydrophobicContact CG-CE2 4.21Å; L345-F412 HydrophobicContact CG-CZ 4.12Å; W358-F412 HydrophobicContact CH2-CD2 4.07Å; W358-F412 AromaticContact CH2-CE2 3.64Å; W358-F412 HydrophobicContact CH2-CE2 3.64Å; W358-F412 AromaticContact CZ3-CD2 3.83Å; W358-F412 HydrophobicContact CZ3-CD2 3.83Å; W358-F412 AromaticContact CZ3-CE2 3.85Å; W358-F412 HydrophobicContact CZ3-CE2 3.85Å; Q396-F412 CarbonylContact C-O 3.55Å; Q396-F412 WeakPolarHBondContact CA-O 3.44Å; Y397-F412 PolarHBondContact N-O 3.06Å; Y397-F412 PolarHBondContact O-N 3.23Å; I410-F412 HydrophobicContact CG2-CE2 4.23Å
413	Q	87.1	Confident	89.2	Confident	73 Å²	73	51.2 Å²	51.2	34%	0.341	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	116.3	175.1	-67.2	178.9	-19.6	0	0	109.1	L331 S332 V333 Y481	L331-Q413 PolarHBondContact O-N 2.88Å; S332-Q413 CarbonylContact C-O 3.58Å; S332-Q413 VanDerWaalsContact CA-O 3.32Å; S332-Q413 WeakPolarHBondContact CA-O 3.31Å; S332-Q413 PolarHBondContact OG-OE1 3.22Å; S332-Q413 VanDerWaalsContact OG-OE1 3.09Å; V333-Q413 PolarHBondContact N-O 2.87Å; Q413-Y481 HydrophobicContact CG-CE1 4.41Å
414	V	87	Confident	89.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.5	-176.4	-176.2	0	0	0	0	110	V333 L341 L343 M389 G395 Y397	V333-V414 WeakPolarHBondContact O-CA 3.37Å; L341-V414 HydrophobicContact CD2-CB 4.45Å; L341-V414 HydrophobicContact CD2-CG1 3.67Å; L341-V414 HydrophobicContact CD2-CG2 3.83Å; L343-V414 HydrophobicContact CD1-CG2 4.42Å; M389-V414 HydrophobicContact CE-CG1 3.47Å; M389-V414 VanDerWaalsContact CE-CG1 3.47Å; G395-V414 PolarHBondContact N-O 3.47Å; G395-V414 PolarHBondContact O-N 2.81Å; Y397-V414 HydrophobicContact CD2-CB 3.99Å; Y397-V414 HydrophobicContact CD2-CG2 3.5Å; Y397-V414 HydrophobicContact CE2-CB 3.89Å; Y397-V414 HydrophobicContact CE2-CG2 3.8Å; Y397-V414 HydrophobicContact CG-CG2 4.43Å
415	Q	85.1	Confident	89.1	Confident	36 Å²	36	54.2 Å²	54.2	17%	0.168	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	154.4	178.9	-66.4	177.5	-32.5	0	0	110.3	V333 V334 V335 Y439	V333-Q415 PolarHBondContact O-N 2.85Å; V334-Q415 VanDerWaalsContact CA-O 3.27Å; V334-Q415 WeakPolarHBondContact CA-O 3.35Å; V334-Q415 HydrophobicContact CG2-CB 4.44Å; V335-Q415 PolarHBondContact N-O 2.85Å; Q415-Y439 HydrophobicContact CB-CE1 4.28Å; Q415-Y439 PolarHBondContact OE1-OH 3.4Å
416	M	85.4	Confident	88.7	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	142.4	179.1	-64.5	-163.9	-168.8	0	0	113.5	V335 M389 N390 Q394 Q418 Y439	V335-M416 CarbonylContact O-C 3.58Å; V335-M416 VanDerWaalsContact O-CA 3.23Å; V335-M416 WeakPolarHBondContact O-CA 3.49Å; M389-M416 HydrophobicContact CB-CE 3.74Å; M389-M416 HydrophobicContact CE-CE 3.53Å; M389-M416 HydrophobicContact SD-CE 4.14Å; N390-M416 VanDerWaalsContact C-SD 3.58Å; N390-M416 WeakPolarHBondContact O-CE 3.42Å; Q394-M416 HydrophobicContact CB-CG 4.46Å; M416-Q418 PolarHBondContact O-N 3.26Å; M416-Y439 WeakPolarHBondContact O-CD1 3.49Å
417	Y	85.9	Confident	88	Confident	74 Å²	74	57.5 Å²	57.5	29%	0.29	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	124.1	169	-80.8	-59	0	0	0	110.5	V334 V335 K336 P440 I509	V334-Y417 HydrophobicContact CB-CE2 4.11Å; V334-Y417 HydrophobicContact CG1-CD1 4.05Å; V334-Y417 HydrophobicContact CG1-CD2 3.78Å; V334-Y417 HydrophobicContact CG1-CE1 3.85Å; V334-Y417 HydrophobicContact CG1-CE2 3.56Å; V334-Y417 HydrophobicContact CG1-CG 4.01Å; V335-Y417 PolarHBondContact O-N 3.1Å; K336-Y417 HydrophobicContact CG-CD2 3.62Å; K336-Y417 HydrophobicContact CG-CG 4.17Å; Y417-P440 HydrophobicContact CE1-CG 4.14Å; Y417-I509 HydrophobicContact CD1-CD1 3.47Å; Y417-I509 VanDerWaalsContact CD1-CD1 3.47Å; Y417-I509 HydrophobicContact CD1-CG1 3.58Å; Y417-I509 HydrophobicContact CD2-CD1 4.12Å; Y417-I509 HydrophobicContact CE1-CD1 4.13Å; Y417-I509 HydrophobicContact CE1-CG1 4.45Å; Y417-I509 HydrophobicContact CG-CD1 3.47Å; Y417-I509 VanDerWaalsContact CG-CD1 3.47Å; Y417-I509 HydrophobicContact CG-CG1 3.87Å
418	Q	85.3	Confident	87	Confident	36 Å²	36	57.2 Å²	57.2	17%	0.168	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.4	179.8	-59.9	-174.3	41.4	0	0	109.9	I391 M416 Y439 N507	I391-Q418 HydrophobicContact CD1-CG 4.08Å; M416-Q418 PolarHBondContact O-N 3.26Å; Q418-Y439 PolarHBondContact N-O 2.86Å; Q418-Y439 PolarHBondContact O-N 2.83Å; Q418-Y439 VanDerWaalsContact O-O 3.07Å; Q418-N507 PolarHBondContact O-ND2 3.23Å
419	R	87.2	Confident	85.8	Confident	159 Å²	159	62.4 Å²	62.4	60%	0.6	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	140.6	176	-171.4	-179.3	178	174.7	-0.8	109.2	N421 I509 V511	R419-N421 PolarHBondContact O-N 3.24Å; R419-I509 HydrophobicContact CB-CG2 4.27Å; R419-V511 PolarHBondContact NE-O 3.45Å; R419-V511 PolarHBondContact NH2-O 3Å
420	P	89.6	Confident	84.8	Confident	4 Å²	4	61.8 Å²	61.8	3%	0.026	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	141.5	174.8	21.2	-33.1	0	0	0	110.3	F437 P442 A505 N507 G510 S512	P420-F437 CarbonylContact C-O 3.59Å; P420-F437 VanDerWaalsContact CA-O 3.25Å; P420-F437 WeakPolarHBondContact CA-O 3.41Å; P420-P442 HydrophobicContact CB-CB 3.79Å; P420-P442 HydrophobicContact CB-CG 4.28Å; P420-A505 HydrophobicContact CB-CB 3.92Å; P420-A505 WeakPolarHBondContact CG-O 3.45Å; P420-N507 VanDerWaalsContact CD-CG 3.4Å; P420-N507 WeakPolarHBondContact CD-OD1 3.38Å; P420-G510 VanDerWaalsContact CG-O 3.29Å; P420-G510 WeakPolarHBondContact CG-O 3.46Å; P420-S512 WeakPolarHBondContact O-CB 3.45Å
421	N	89.8	Confident	84.5	Confident	96 Å²	96	61.6 Å²	61.6	51%	0.513	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	103.3	164.2	-172.8	21.1	0	0	0	108.3	R419 S436 F437	R419-N421 PolarHBondContact O-N 3.24Å; N421-S436 VanDerWaalsContact C-OG 3.26Å; N421-S436 PolarHBondContact N-OG 2.99Å; N421-S436 WeakPolarHBondContact O-CA 3.45Å; N421-S436 WeakPolarHBondContact O-CB 3.47Å; N421-S436 PolarHBondContact O-OG 3.01Å; N421-F437 PolarHBondContact N-O 3.49Å
422	A	89.7	Confident	84.3	Confident	4 Å²	4	59.9 Å²	59.9	3%	0.033	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	132.2	178	0	0	0	0	0	109.2	A505 S512 D514	A422-A505 HydrophobicContact CB-CB 3.73Å; A422-S512 PolarHBondContact N-OG 2.96Å; A422-S512 VanDerWaalsContact N-OG 3.09Å; A422-D514 HydrophobicContact CB-CB 4.47Å; A422-D514 WeakPolarHBondContact O-CB 3.4Å
423	V	90.1	Very high	84.4	Confident	39 Å²	39	60.4 Å²	60.4	24%	0.236	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	121.4	173.6	-178.3	0	0	0	0	108.2	R425 C434 T435	V423-R425 HydrophobicContact CG1-CG 4.12Å; V423-C434 WeakPolarHBondContact O-CA 3.41Å; V423-T435 PolarHBondContact N-O 3.08Å; V423-T435 PolarHBondContact O-N 2.8Å; V423-T435 PolarHBondContact O-OG1 3.28Å
424	V	88.8	Confident	84.6	Confident	13 Å²	13	56.9 Å²	56.9	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.6	176.1	177.8	0	0	0	0	109.3	L432 T433 C434 W446 C503 D514 L516	V424-L432 HydrophobicContact CG1-CB 4.4Å; V424-L432 HydrophobicContact CG1-CD2 4.21Å; V424-T433 CarbonylContact C-O 3.53Å; V424-T433 WeakPolarHBondContact CA-O 3.48Å; V424-C434 HydrophobicContact CG2-CB 4.08Å; V424-W446 HydrophobicContact CG1-CH2 3.88Å; V424-W446 HydrophobicContact CG1-CZ3 4Å; V424-W446 HydrophobicContact CG2-CH2 3.91Å; V424-W446 HydrophobicContact CG2-CZ3 3.85Å; V424-C503 HydrophobicContact CG2-CB 3.15Å; V424-D514 HydrophobicContact CG2-CB 4.11Å; V424-D514 PolarHBondContact N-OD2 3.09Å; V424-L516 HydrophobicContact CG1-CB 4.22Å
425	R	88.1	Confident	84.8	Confident	164 Å²	164	57.9 Å²	57.9	62%	0.619	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	151	176.9	-60.5	-177.3	-178.9	176.7	2.5	110.2	V423 L432 T433	V423-R425 HydrophobicContact CG1-CG 4.12Å; R425-L432 WeakPolarHBondContact O-CA 3.35Å; R425-T433 PolarHBondContact N-O 3.12Å; R425-T433 PolarHBondContact O-N 3.03Å
426	W	80.1	Confident	85.1	Confident	110 Å²	110	56.2 Å²	56.2	42%	0.417	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	125.4	165	-74.1	106.5	0	0	0	109	V429 L432 L516 M518	W426-V429 VanDerWaalsContact CZ3-O 3.27Å; W426-V429 WeakPolarHBondContact CZ3-O 3.46Å; W426-L432 HydrophobicContact CD2-CD2 3.45Å; W426-L432 VanDerWaalsContact CD2-CD2 3.45Å; W426-L432 HydrophobicContact CE3-CD2 3.34Å; W426-L432 HydrophobicContact CE3-CG 4.1Å; W426-L432 HydrophobicContact CG-CD2 4.1Å; W426-L432 HydrophobicContact CH2-CD2 3.9Å; W426-L432 HydrophobicContact CH2-CG 4.34Å; W426-L432 HydrophobicContact CZ2-CD2 3.96Å; W426-L432 HydrophobicContact CZ3-CD2 3.6Å; W426-L432 HydrophobicContact CZ3-CG 3.97Å; W426-L516 HydrophobicContact CD2-CD2 4.28Å; W426-L516 VanDerWaalsContact CE2-CD2 3.49Å; W426-L516 HydrophobicContact CZ2-CD2 3.65Å; W426-M518 HydrophobicContact CH2-CE 4.12Å; W426-M518 HydrophobicContact CZ2-CE 4.42Å
427	E	77.1	Confident	85.3	Confident	111 Å²	111	60.2 Å²	60.2	52%	0.519	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-44.1	168.7	-170.9	177.3	-156.3	0	0	110	T431 T433	E427-T431 PolarHBondContact N-O 2.84Å; E427-T433 PolarHBondContact OE2-OG1 3.36Å
428	N	72.3	Confident	85.4	Confident	113 Å²	113	56.7 Å²	56.7	60%	0.604	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	-178.3	169.2	-65.9	-46.6	0	0	0	110	T430 T431	N428-T430 PolarHBondContact O-N 2.98Å; N428-T431 WeakPolarHBondContact CB-OG1 3.42Å; N428-T431 PolarHBondContact N-O 3.23Å; N428-T431 PolarHBondContact N-OG1 2.92Å; N428-T431 VanDerWaalsContact N-OG1 3.14Å; N428-T431 PolarHBondContact O-N 3.09Å
429	V	68.1	Low	85.4	Confident	136 Å²	136	57.5 Å²	57.5	82%	0.824	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-20	-178.3	-172.1	0	0	0	0	113.9	W426	W426-V429 VanDerWaalsContact CZ3-O 3.27Å; W426-V429 WeakPolarHBondContact CZ3-O 3.46Å
430	T	74.4	Confident	85.4	Confident	68 Å²	68	51.6 Å²	51.6	42%	0.417	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-0.4	-176.8	57.5	0	0	0	0	113.9	N428 T491 V492	N428-T430 PolarHBondContact O-N 2.98Å; T430-T491 CarbonylContact O-C 3.57Å; T430-T491 WeakPolarHBondContact O-CA 3.3Å; T430-T491 WeakPolarHBondContact O-CG2 3.5Å; T430-V492 PolarHBondContact O-N 3.37Å
431	T	84.3	Confident	85.3	Confident	19 Å²	19	53.5 Å²	53.5	12%	0.117	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.2	-176.9	45.5	0	0	0	0	111.7	E427 N428 T491	E427-T431 PolarHBondContact N-O 2.84Å; N428-T431 WeakPolarHBondContact CB-OG1 3.42Å; N428-T431 PolarHBondContact N-O 3.23Å; N428-T431 PolarHBondContact N-OG1 2.92Å; N428-T431 VanDerWaalsContact N-OG1 3.14Å; N428-T431 PolarHBondContact O-N 3.09Å; T431-T491 HydrophobicContact CG2-CG2 4.04Å
432	L	86.7	Confident	85.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.5	176.2	-65	177.4	0	0	0	109.6	V424 R425 W426 W446 V489 L490 V492 V501 L516	V424-L432 HydrophobicContact CG1-CB 4.4Å; V424-L432 HydrophobicContact CG1-CD2 4.21Å; R425-L432 WeakPolarHBondContact O-CA 3.35Å; W426-L432 HydrophobicContact CD2-CD2 3.45Å; W426-L432 VanDerWaalsContact CD2-CD2 3.45Å; W426-L432 HydrophobicContact CE3-CD2 3.34Å; W426-L432 HydrophobicContact CE3-CG 4.1Å; W426-L432 HydrophobicContact CG-CD2 4.1Å; W426-L432 HydrophobicContact CH2-CD2 3.9Å; W426-L432 HydrophobicContact CH2-CG 4.34Å; W426-L432 HydrophobicContact CZ2-CD2 3.96Å; W426-L432 HydrophobicContact CZ3-CD2 3.6Å; W426-L432 HydrophobicContact CZ3-CG 3.97Å; L432-W446 HydrophobicContact CB-CH2 3.81Å; L432-W446 HydrophobicContact CB-CZ3 4.26Å; L432-W446 HydrophobicContact CD1-CZ3 4.38Å; L432-V489 CarbonylContact O-C 3.29Å; L432-V489 WeakPolarHBondContact O-CA 3.26Å; L432-L490 PolarHBondContact N-O 3.41Å; L432-L490 PolarHBondContact O-N 3.29Å; L432-V492 HydrophobicContact CD1-CG2 3.67Å; L432-V492 HydrophobicContact CG-CG2 4.17Å; L432-V501 HydrophobicContact CD1-CB 3.97Å; L432-V501 HydrophobicContact CD1-CG1 3.81Å; L432-V501 HydrophobicContact CD1-CG2 4.17Å; L432-L516 HydrophobicContact CD1-CD2 4.13Å; L432-L516 HydrophobicContact CD2-CD2 3.29Å; L432-L516 HydrophobicContact CG-CD2 4.37Å
433	T	90.3	Very high	85.3	Confident	10 Å²	10	57 Å²	57	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.5	177.2	-61.4	0	0	0	0	108.1	V424 R425 E427 T435 E487 V489	V424-T433 CarbonylContact C-O 3.53Å; V424-T433 WeakPolarHBondContact CA-O 3.48Å; R425-T433 PolarHBondContact N-O 3.12Å; R425-T433 PolarHBondContact O-N 3.03Å; E427-T433 PolarHBondContact OE2-OG1 3.36Å; T433-T435 HydrophobicContact CG2-CG2 4.33Å; T433-E487 HydrophobicContact CG2-CG 3.66Å; T433-E487 WeakPolarHBondContact CG2-OE1 3.47Å; T433-V489 HydrophobicContact CG2-CG2 4.11Å
434	C	90.5	Very high	85.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.6	173.2	-173	0	0	0	0	109.4	V423 V424 I444 W446 E487 S488 C503	V423-C434 WeakPolarHBondContact O-CA 3.41Å; V424-C434 HydrophobicContact CG2-CB 4.08Å; C434-I444 HydrophobicContact CB-CD1 4.35Å; C434-I444 HydrophobicContact CB-CG2 4.29Å; C434-I444 VanDerWaalsContact O-CD1 3.29Å; C434-I444 WeakPolarHBondContact O-CD1 3.33Å; C434-W446 HydrophobicContact CB-CH2 3.52Å; C434-W446 HydrophobicContact CB-CZ2 3.22Å; C434-W446 HydrophobicContact CB-CZ3 4.44Å; C434-E487 CarbonylContact O-C 3.4Å; C434-E487 WeakPolarHBondContact O-CA 3.31Å; C434-S488 PolarHBondContact N-O 3.41Å; C434-S488 PolarHBondContact O-N 2.81Å; C434-C503 HydrophobicContact CB-CB 3.7Å; C434-C503 WeakPolarHBondContact CB-SG 3.2Å; C434-C503 WeakPolarHBondContact SG-CB 3.43Å; C434-C503 CovalentContact SG-SG 2.02Å; C434-C503 PolarHBondContact SG-SG 3.24Å
435	T	92.4	Very high	85.2	Confident	21 Å²	21	57.7 Å²	57.7	13%	0.129	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.5	173.6	54	0	0	0	0	109	V423 T433 V486 E487	V423-T435 PolarHBondContact N-O 3.08Å; V423-T435 PolarHBondContact O-N 2.8Å; V423-T435 PolarHBondContact O-OG1 3.28Å; T433-T435 HydrophobicContact CG2-CG2 4.33Å; T435-V486 CarbonylContact C-O 3.5Å; T435-V486 WeakPolarHBondContact CA-O 3.41Å; T435-E487 HydrophobicContact CG2-CG 4.17Å
436	S	91.4	Very high	85.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.7	173.5	-162	0	0	0	0	113.8	N421 E485 V486 A505	N421-S436 VanDerWaalsContact C-OG 3.26Å; N421-S436 PolarHBondContact N-OG 2.99Å; N421-S436 WeakPolarHBondContact O-CA 3.45Å; N421-S436 WeakPolarHBondContact O-CB 3.47Å; N421-S436 PolarHBondContact O-OG 3.01Å; S436-E485 WeakPolarHBondContact O-CA 3.35Å; S436-V486 PolarHBondContact N-O 3.1Å; S436-V486 WeakPolarHBondContact O-CG2 3.48Å; S436-V486 PolarHBondContact O-N 3.39Å; S436-A505 VanDerWaalsContact OG-CB 3.23Å; S436-A505 WeakPolarHBondContact OG-CB 3.15Å
437	F	90.3	Very high	85.4	Confident	87 Å²	87	48 Å²	48	38%	0.382	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.2	177.1	-62.6	-95.3	0	0	0	109.7	P420 N421 E485	P420-F437 CarbonylContact C-O 3.59Å; P420-F437 VanDerWaalsContact CA-O 3.25Å; P420-F437 WeakPolarHBondContact CA-O 3.41Å; N421-F437 PolarHBondContact N-O 3.49Å; F437-E485 HydrophobicContact CD1-CB 3.64Å; F437-E485 HydrophobicContact CD1-CG 3.78Å; F437-E485 HydrophobicContact CE1-CB 3.48Å; F437-E485 VanDerWaalsContact CE1-CB 3.48Å; F437-E485 HydrophobicContact CE1-CG 3.32Å; F437-E485 VanDerWaalsContact CE1-OE2 3.29Å; F437-E485 WeakPolarHBondContact CE1-OE2 3.5Å; F437-E485 HydrophobicContact CE2-CG 4.18Å; F437-E485 HydrophobicContact CG-CG 4.41Å; F437-E485 HydrophobicContact CZ-CB 4.24Å; F437-E485 HydrophobicContact CZ-CG 3.54Å; F437-E485 WeakPolarHBondContact CZ-OE1 3.44Å
438	G	87.6	Confident	85.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177	169.5	173.1	0	0	0	0	0	114.3	V484	G438-V484 PolarHBondContact N-O 2.87Å; G438-V484 PolarHBondContact O-N 3.02Å
439	Y	85.8	Confident	86	Confident	53 Å²	53	40.7 Å²	40.7	21%	0.208	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	127.8	176.3	-169.4	-100.4	0	0	0	111.6	V334 Q415 M416 Q418 V484 N507	V334-Y439 HydrophobicContact CG1-CD1 4.33Å; V334-Y439 HydrophobicContact CG1-CE1 3.92Å; V334-Y439 HydrophobicContact CG2-CE1 4.41Å; Q415-Y439 HydrophobicContact CB-CE1 4.28Å; Q415-Y439 PolarHBondContact OE1-OH 3.4Å; M416-Y439 WeakPolarHBondContact O-CD1 3.49Å; Q418-Y439 PolarHBondContact N-O 2.86Å; Q418-Y439 PolarHBondContact O-N 2.83Å; Q418-Y439 VanDerWaalsContact O-O 3.07Å; Y439-V484 HydrophobicContact CD2-CG2 4.39Å; Y439-N507 PolarHBondContact O-ND2 2.73Å
440	P	86.8	Confident	86.4	Confident	36 Å²	36	36.8 Å²	36.8	23%	0.234	18%	0.182	C	C	.	.	S	Bend	cis	-61	163.7	-5.9	-26.4	38.9	0	0	0	112.7	Y417 N507 L508	Y417-P440 HydrophobicContact CE1-CG 4.14Å; P440-N507 WeakPolarHBondContact O-CB 3.4Å; P440-N507 PolarHBondContact O-ND2 3.35Å; P440-L508 HydrophobicContact CG-CD1 4.21Å
441	A	87.1	Confident	86.3	Confident	43 Å²	43	34.9 Å²	34.9	36%	0.355	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-48.1	122.7	-174.2	0	0	0	0	0	111.9	V484	A441-V484 HydrophobicContact CB-CB 3.8Å; A441-V484 HydrophobicContact CB-CG1 3.81Å; A441-V484 HydrophobicContact CB-CG2 4.07Å
442	P	89.4	Confident	85.7	Confident	4 Å²	4	37 Å²	37	3%	0.026	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-77.3	158.4	-176.4	28.8	-29.5	0	0	0	112	P420 V486 F506 N507	P420-P442 HydrophobicContact CB-CB 3.79Å; P420-P442 HydrophobicContact CB-CG 4.28Å; P442-V486 HydrophobicContact CG-CG2 3.75Å; P442-V486 WeakPolarHBondContact O-CG2 3.42Å; P442-F506 WeakPolarHBondContact CA-O 3.47Å; P442-N507 HydrophobicContact CB-CB 4.26Å
443	R	89	Confident	85	Confident	170 Å²	170	42 Å²	42	64%	0.642	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	137.5	174.4	-64.2	-176.7	69.9	-175.3	1.7	109.4	A505 F506	R443-A505 CarbonylContact O-C 3.52Å; R443-A505 VanDerWaalsContact O-CA 3.3Å; R443-A505 WeakPolarHBondContact O-CA 2.9Å; R443-F506 HydrophobicContact CB-CE1 4Å; R443-F506 HydrophobicContact CB-CE2 4.42Å; R443-F506 HydrophobicContact CB-CZ 3.94Å; R443-F506 PolarHBondContact N-O 3.26Å; R443-F506 VanDerWaalsContact O-CD1 3.31Å; R443-F506 WeakPolarHBondContact O-CD1 3.31Å; R443-F506 PolarHBondContact O-N 3.03Å
444	I	89.9	Confident	84.1	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.036	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.8	-178.1	-64.9	173.7	0	0	0	110.1	C434 T473 V486 C503 V504 A505	C434-I444 HydrophobicContact CB-CD1 4.35Å; C434-I444 HydrophobicContact CB-CG2 4.29Å; C434-I444 VanDerWaalsContact O-CD1 3.29Å; C434-I444 WeakPolarHBondContact O-CD1 3.33Å; I444-T473 HydrophobicContact CB-CG2 4.34Å; I444-T473 HydrophobicContact CD1-CG2 4.46Å; I444-T473 HydrophobicContact CG1-CG2 4.31Å; I444-T473 PolarHBondContact N-OG1 3.16Å; I444-T473 VanDerWaalsContact N-OG1 3.1Å; I444-T473 PolarHBondContact O-OG1 3.32Å; I444-V486 HydrophobicContact CD1-CG2 3.86Å; I444-V486 HydrophobicContact CG1-CG2 4.14Å; I444-C503 WeakPolarHBondContact CG2-SG 3.31Å; I444-V504 WeakPolarHBondContact CA-O 3.34Å; I444-A505 HydrophobicContact CG1-CB 4.04Å
445	I	87.6	Confident	83.3	Confident	59 Å²	59	48.5 Å²	48.5	30%	0.303	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.4	170.5	-63.6	174	0	0	0	108.5	Y447 V504 F506	I445-Y447 HydrophobicContact CB-CE2 4.33Å; I445-Y447 HydrophobicContact CG2-CD2 4.34Å; I445-Y447 HydrophobicContact CG2-CE1 4.46Å; I445-Y447 HydrophobicContact CG2-CE2 3.71Å; I445-V504 PolarHBondContact N-O 3.45Å; I445-V504 PolarHBondContact O-N 3.01Å; I445-F506 HydrophobicContact CD1-CE1 3.44Å; I445-F506 VanDerWaalsContact CD1-CE1 3.44Å; I445-F506 HydrophobicContact CD1-CZ 3.92Å; I445-F506 HydrophobicContact CG1-CE1 3.84Å
446	W	87.3	Confident	82.4	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	140.9	178.2	-69	93.9	0	0	0	111.6	V424 L432 C434 P468 L469 S488 L490 V501 E502 C503	V424-W446 HydrophobicContact CG1-CH2 3.88Å; V424-W446 HydrophobicContact CG1-CZ3 4Å; V424-W446 HydrophobicContact CG2-CH2 3.91Å; V424-W446 HydrophobicContact CG2-CZ3 3.85Å; L432-W446 HydrophobicContact CB-CH2 3.81Å; L432-W446 HydrophobicContact CB-CZ3 4.26Å; L432-W446 HydrophobicContact CD1-CZ3 4.38Å; C434-W446 HydrophobicContact CB-CH2 3.52Å; C434-W446 HydrophobicContact CB-CZ2 3.22Å; C434-W446 HydrophobicContact CB-CZ3 4.44Å; W446-P468 WeakPolarHBondContact O-CA 3.14Å; W446-L469 HydrophobicContact CB-CB 3.87Å; W446-L469 PolarHBondContact O-N 3.43Å; W446-S488 WeakPolarHBondContact CZ2-O 3.23Å; W446-S488 PolarHBondContact NE1-OG 2.89Å; W446-L490 HydrophobicContact CB-CD2 4.02Å; W446-L490 HydrophobicContact CD2-CB 4.04Å; W446-L490 HydrophobicContact CD2-CD2 3.65Å; W446-L490 HydrophobicContact CD2-CG 4.43Å; W446-L490 HydrophobicContact CE3-CD2 3.68Å; W446-L490 HydrophobicContact CG-CB 4.35Å; W446-L490 HydrophobicContact CG-CD2 3.85Å; W446-L490 HydrophobicContact CH2-CB 4.45Å; W446-L490 HydrophobicContact CZ2-CB 3.94Å; W446-L490 HydrophobicContact CZ3-CD2 4.25Å; W446-V501 HydrophobicContact CE3-CG1 3.61Å; W446-V501 HydrophobicContact CZ3-CG1 3.79Å; W446-E502 CarbonylContact C-O 3.52Å; W446-E502 WeakPolarHBondContact CA-O 3.44Å; W446-C503 HydrophobicContact CD2-CB 4.29Å; W446-C503 HydrophobicContact CE3-CB 3.85Å; W446-C503 HydrophobicContact CH2-CB 4.11Å; W446-C503 HydrophobicContact CZ3-CB 3.75Å
447	Y	85.2	Confident	81.1	Confident	70 Å²	70	54.5 Å²	54.5	28%	0.275	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.2	172.9	-64.2	-83.8	0	0	0	111.1	I445 A466 I467 P468 V501 E502 V504	I445-Y447 HydrophobicContact CB-CE2 4.33Å; I445-Y447 HydrophobicContact CG2-CD2 4.34Å; I445-Y447 HydrophobicContact CG2-CE1 4.46Å; I445-Y447 HydrophobicContact CG2-CE2 3.71Å; Y447-A466 HydrophobicContact CD1-CB 3.96Å; Y447-I467 WeakPolarHBondContact CA-O 3.4Å; Y447-P468 HydrophobicContact CD1-CB 4.41Å; Y447-P468 HydrophobicContact CE1-CB 4.25Å; Y447-V501 WeakPolarHBondContact O-CA 3.36Å; Y447-E502 PolarHBondContact N-O 2.83Å; Y447-E502 PolarHBondContact O-N 3.35Å; Y447-V504 HydrophobicContact CD2-CB 4.3Å; Y447-V504 HydrophobicContact CD2-CG2 3.56Å; Y447-V504 HydrophobicContact CE2-CB 4.05Å; Y447-V504 HydrophobicContact CE2-CG2 3.68Å
448	Q	82.4	Confident	79.4	Confident	59 Å²	59	56.9 Å²	56.9	28%	0.276	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.3	176.2	143.3	-179.8	-1.5	0	0	109.9	A466 I467 L469 M499	Q448-A466 WeakPolarHBondContact O-CA 3.33Å; Q448-I467 HydrophobicContact CB-CB 4.39Å; Q448-I467 HydrophobicContact CG-CB 4.3Å; Q448-I467 HydrophobicContact CG-CD1 4.42Å; Q448-I467 PolarHBondContact N-O 2.65Å; Q448-I467 PolarHBondContact O-N 3.13Å; Q448-L469 HydrophobicContact CB-CD1 3.92Å; Q448-L469 HydrophobicContact CB-CG 4.35Å; Q448-M499 HydrophobicContact CG-SD 4.45Å
449	C	80.3	Confident	77.9	Confident	13 Å²	13	64.9 Å²	64.9	9%	0.088	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	154.2	172.6	57	0	0	0	0	112.8	C456 M499 T500	C449-C456 HydrophobicContact CB-CB 3.6Å; C449-C456 WeakPolarHBondContact CB-SG 3.39Å; C449-C456 PolarHBondContact N-SG 3.36Å; C449-C456 WeakPolarHBondContact SG-CA 3.46Å; C449-C456 WeakPolarHBondContact SG-CB 3.38Å; C449-C456 CovalentContact SG-SG 2.05Å; C449-C456 PolarHBondContact SG-SG 3.13Å; C449-M499 WeakPolarHBondContact O-CA 3.4Å; C449-T500 PolarHBondContact N-O 2.77Å; C449-T500 PolarHBondContact O-N 2.72Å
450	L	75.4	Confident	75.8	Confident	54 Å²	54	67.7 Å²	67.7	28%	0.283	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	141.5	179.2	-74.3	166.3	0	0	0	111.8	R453 Q464 Q497	L450-R453 PolarHBondContact O-NE 3.26Å; L450-Q464 VanDerWaalsContact CD1-CD 3.42Å; L450-Q464 HydrophobicContact CD1-CG 3.96Å; L450-Q464 VanDerWaalsContact CD1-NE2 3.29Å; L450-Q497 HydrophobicContact CD2-CB 4.25Å; L450-Q497 VanDerWaalsContact CD2-OE1 3.32Å
451	G	73	Confident	73.7	Confident	27 Å²	27	71.7 Å²	71.7	28%	0.278	39%	0.385	S	S	.	.	S	Bend	trans	88	169.6	-172.8	0	0	0	0	0	113.2	R498 M499 T500	G451-R498 VanDerWaalsContact CA-O 3.31Å; G451-R498 WeakPolarHBondContact CA-O 3.43Å; G451-R498 PolarHBondContact N-O 3.36Å; G451-M499 CarbonylContact O-C 3.4Å; G451-T500 PolarHBondContact O-N 2.88Å; G451-T500 PolarHBondContact O-OG1 3.01Å
452	I	72.3	Confident	71.9	Confident	65 Å²	65	73.2 Å²	73.2	33%	0.333	41%	0.405	S	S	.	.			trans	-85.7	110.7	167.4	-60.7	-170.6	0	0	0	107.4	R498 T500 A517 E519	I452-R498 HydrophobicContact CG1-CB 4.19Å; I452-T500 WeakPolarHBondContact CA-OG1 3.5Å; I452-A517 HydrophobicContact CD1-CB 4.19Å; I452-A517 HydrophobicContact CG1-CB 4.2Å; I452-A517 HydrophobicContact CG2-CB 3.84Å; I452-E519 HydrophobicContact CD1-CB 4.18Å; I452-E519 HydrophobicContact CD1-CG 3.47Å; I452-E519 VanDerWaalsContact CD1-CG 3.47Å; I452-E519 WeakPolarHBondContact CD1-OE1 3.47Å
453	R	71.8	Confident	70	Confident	105 Å²	105	80.6 Å²	80.6	40%	0.396	44%	0.443	S	S	.	.			trans	-126.5	145.6	179	-59.1	-174.7	-175.8	-139.6	-0.7	108.5	L450 T455 T500	L450-R453 PolarHBondContact O-NE 3.26Å; R453-T455 VanDerWaalsContact CB-O 3.29Å; R453-T455 WeakPolarHBondContact CB-O 3.17Å; R453-T455 PolarHBondContact O-N 3Å; R453-T500 PolarHBondContact N-OG1 3.45Å; R453-T500 WeakPolarHBondContact O-CG2 3.43Å
454	P	71.2	Confident	68.1	Low	97 Å²	97	78.7 Å²	78.7	63%	0.63	44%	0.442	S	S	*	.	S	Bend	trans	-64.5	-30.7	175.2	25.6	-32.7	0	0	0	111.8	T515	P454-T515 VanDerWaalsContact O-CG2 3.26Å; P454-T515 WeakPolarHBondContact O-CG2 3.3Å; P454-T515 PolarHBondContact O-OG1 2.67Å
455	T	73.5	Confident	66.5	Low	48 Å²	48	85.7 Å²	85.7	29%	0.294	48%	0.478	S	S	.	.	S	Bend	trans	-146.5	158.1	172.5	63.7	0	0	0	0	109.6	R453 N457 E502	R453-T455 VanDerWaalsContact CB-O 3.29Å; R453-T455 WeakPolarHBondContact CB-O 3.17Å; R453-T455 PolarHBondContact O-N 3Å; T455-N457 PolarHBondContact O-N 2.77Å; T455-E502 WeakPolarHBondContact CB-OE1 3.39Å
456	C	72.3	Confident	65.2	Low	12 Å²	12	84.2 Å²	84.2	8%	0.081	48%	0.475	C	S	.	.	S	Bend	trans	-80.9	12.3	178	-70.8	0	0	0	0	113.9	C449 A466 E502	C449-C456 HydrophobicContact CB-CB 3.6Å; C449-C456 WeakPolarHBondContact CB-SG 3.39Å; C449-C456 PolarHBondContact N-SG 3.36Å; C449-C456 WeakPolarHBondContact SG-CA 3.46Å; C449-C456 WeakPolarHBondContact SG-CB 3.38Å; C449-C456 CovalentContact SG-SG 2.05Å; C449-C456 PolarHBondContact SG-SG 3.13Å; C456-A466 HydrophobicContact CB-CB 3.95Å; C456-E502 WeakPolarHBondContact CB-OE2 3.33Å; C456-E502 PolarHBondContact N-OE2 3.2Å
457	N	65.1	Low	64.3	Low	136 Å²	136	88.3 Å²	88.3	73%	0.727	50%	0.496	S	S	*	.			trans	-136.4	75.6	-170.8	-149.2	19.7	0	0	0	113	T455	T455-N457 PolarHBondContact O-N 2.77Å
458	E	55.3	Low	63.8	Low	136 Å²	136	89 Å²	89	64%	0.636	51%	0.509	S	S	*	.			trans	-126.7	118.7	162.8	-82.8	-170.5	161.7	0	0	110.7	T460	E458-T460 PolarHBondContact O-N 3.36Å
459	N	55.5	Low	63.6	Low	169 Å²	169	88.3 Å²	88.3	90%	0.904	51%	0.507	S	S	*	.			trans	-64.1	96.4	173.9	-94	-19.5	0	0	0	110.5
460	T	42.5	Very low	63.1	Low	111 Å²	111	97.1 Å²	97.1	68%	0.681	55%	0.547	S	S	*	.			trans	-139.4	111.8	154.6	26	0	0	0	0	109.2	E458	E458-T460 PolarHBondContact O-N 3.36Å
461	S	41.8	Very low	63.3	Low	120 Å²	120	95.5 Å²	95.5	84%	0.839	54%	0.541	S	S	*	.	S	Bend	trans	47.2	84.1	156	-50.4	0	0	0	0	117.3	L463	S461-L463 PolarHBondContact O-N 2.91Å
462	G	50.2	Low	63.8	Low	75 Å²	75	99 Å²	99	77%	0.773	56%	0.559	S	S	*	*	S	Bend	trans	38.4	75.6	146.5	0	0	0	0	0	118.2
463	L	48.6	Very low	64.4	Low	160 Å²	160	98.2 Å²	98.2	84%	0.838	56%	0.557	S	S	*	*	S	Bend		179.6	141.3	124.5	-114.4	92.5	0	0	0	108.5	S461	S461-L463 PolarHBondContact O-N 2.91Å
464	Q	50	Low	65.1	Low	130 Å²	130	97.3 Å²	97.3	61%	0.607	56%	0.563	S	S	*	*			trans	85.6	95.1	-177.3	-112.6	101.8	21.8	0	0	118	L450	L450-Q464 VanDerWaalsContact CD1-CD 3.42Å; L450-Q464 HydrophobicContact CD1-CG 3.96Å; L450-Q464 VanDerWaalsContact CD1-NE2 3.29Å
465	L	55.4	Low	65.8	Low	154 Å²	154	96.9 Å²	96.9	81%	0.806	55%	0.553	S	S	*	*			trans	-66.9	138.7	161.8	-85.7	84.4	0	0	0	110.1	I467	L465-I467 PolarHBondContact O-N 3.42Å
466	A	60.6	Low	66.3	Low	27 Å²	27	98.1 Å²	98.1	22%	0.223	56%	0.56	C	S	.	*			trans	-52.4	123.6	161.9	0	0	0	0	0	109.3	Y447 Q448 C456 P468	Y447-A466 HydrophobicContact CD1-CB 3.96Å; Q448-A466 WeakPolarHBondContact O-CA 3.33Å; C456-A466 HydrophobicContact CB-CB 3.95Å; A466-P468 WeakPolarHBondContact O-CD 3.45Å
467	I	68.6	Low	66.9	Low	86 Å²	86	103.4 Å²	103.4	44%	0.441	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87	115.5	-179.2	-58.9	173.2	0	0	0	107.4	Y447 Q448 L465 L469	Y447-I467 WeakPolarHBondContact CA-O 3.4Å; Q448-I467 HydrophobicContact CB-CB 4.39Å; Q448-I467 HydrophobicContact CG-CB 4.3Å; Q448-I467 HydrophobicContact CG-CD1 4.42Å; Q448-I467 PolarHBondContact N-O 2.65Å; Q448-I467 PolarHBondContact O-N 3.13Å; L465-I467 PolarHBondContact O-N 3.42Å; I467-L469 HydrophobicContact CG2-CD2 4.44Å; I467-L469 PolarHBondContact O-N 2.96Å
468	P	74.6	Confident	67.6	Low	86 Å²	86	104.6 Å²	104.6	56%	0.558	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71	127.7	174.2	29.1	-32.5	0	0	0	109.4	W446 Y447 A466	W446-P468 WeakPolarHBondContact O-CA 3.14Å; Y447-P468 HydrophobicContact CD1-CB 4.41Å; Y447-P468 HydrophobicContact CE1-CB 4.25Å; A466-P468 WeakPolarHBondContact O-CD 3.45Å
469	L	77.3	Confident	68.7	Low	43 Å²	43	103 Å²	103	23%	0.225	57%	0.57	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.3	134	176.6	-61.4	170.8	0	0	0	109.1	W446 Q448 I467 L490	W446-L469 HydrophobicContact CB-CB 3.87Å; W446-L469 PolarHBondContact O-N 3.43Å; Q448-L469 HydrophobicContact CB-CD1 3.92Å; Q448-L469 HydrophobicContact CB-CG 4.35Å; I467-L469 HydrophobicContact CG2-CD2 4.44Å; I467-L469 PolarHBondContact O-N 2.96Å; L469-L490 HydrophobicContact CB-CD1 3.86Å; L469-L490 HydrophobicContact CB-CD2 4.46Å; L469-L490 HydrophobicContact CD1-CD1 4Å; L469-L490 HydrophobicContact CD1-CD2 3.55Å; L469-L490 HydrophobicContact CD1-CG 4.35Å; L469-L490 HydrophobicContact CG-CD1 4.49Å
470	Q	69.9	Low	69.3	Low	199 Å²	199	102.7 Å²	102.7	93%	0.93	56%	0.564	S	S	*	*			trans	-88.8	111.3	-178.7	-67.3	-173.7	-10.5	0	0	110
471	A	80.4	Confident	70.6	Confident	20 Å²	20	100.1 Å²	100.1	17%	0.165	54%	0.542	C	S	.	.			trans	-135.4	138.7	168.4	0	0	0	0	0	108.9	S488 V489	A471-S488 WeakPolarHBondContact CB-OG 3.31Å; A471-V489 WeakPolarHBondContact CB-O 3.39Å
472	P	82.2	Confident	72.1	Confident	99 Å²	99	94.6 Å²	94.6	64%	0.643	50%	0.504	S	S	*	.			trans	-67	146.8	176.5	28.1	-32.9	0	0	0	110.5	S488	P472-S488 WeakPolarHBondContact O-CB 3.27Å; P472-S488 PolarHBondContact O-OG 3.48Å
473	T	85	Confident	73.6	Confident	49 Å²	49	91.3 Å²	91.3	30%	0.301	47%	0.47	S	S	.	.			trans	-97.6	125.6	165.7	-51.4	0	0	0	0	107.6	I444 V486 E487	I444-T473 HydrophobicContact CB-CG2 4.34Å; I444-T473 HydrophobicContact CD1-CG2 4.46Å; I444-T473 HydrophobicContact CG1-CG2 4.31Å; I444-T473 PolarHBondContact N-OG1 3.16Å; I444-T473 VanDerWaalsContact N-OG1 3.1Å; I444-T473 PolarHBondContact O-OG1 3.32Å; T473-V486 HydrophobicContact CG2-CB 3.62Å; T473-V486 HydrophobicContact CG2-CG1 4.26Å; T473-V486 HydrophobicContact CG2-CG2 3.76Å; T473-E487 WeakPolarHBondContact CA-O 3.23Å
474	V	87.3	Confident	75.5	Confident	86 Å²	86	83.9 Å²	83.9	52%	0.521	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.6	179.6	-177.8	0	0	0	0	108.6	V476 V486 E487	V474-V476 PolarHBondContact O-N 3.11Å; V474-V486 CarbonylContact O-C 3.43Å; V474-V486 VanDerWaalsContact O-CA 3.25Å; V474-V486 WeakPolarHBondContact O-CA 3.38Å; V474-E487 PolarHBondContact N-O 3.4Å; V474-E487 PolarHBondContact O-N 3.2Å
475	E	85.9	Confident	77.4	Confident	88 Å²	88	79.4 Å²	79.4	41%	0.411	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.5	171.1	-178.8	169.7	169.1	0	0	108.7	R478 V484	E475-R478 WeakPolarHBondContact OE1-CB 3.42Å; E475-R478 IonicContact OE1-CZ 3.92Å; E475-R478 VanDerWaalsContact OE1-CZ 3.27Å; E475-R478 IonicContact OE1-NE 3.66Å; E475-R478 PolarHBondContact OE1-NE 2.82Å; E475-R478 IonicContact OE1-NH2 2.88Å; E475-R478 PolarHBondContact OE1-NH2 2.86Å; E475-R478 IonicContact OE2-NH2 3.78Å; E475-R478 PolarHBondContact OE2-NH2 3.37Å; E475-V484 VanDerWaalsContact CD-CG1 3.48Å; E475-V484 HydrophobicContact CG-CG1 3.55Å; E475-V484 WeakPolarHBondContact OE1-CG1 3.37Å
476	V	84	Confident	79.1	Confident	74 Å²	74	72.3 Å²	72.3	45%	0.448	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-50.9	-176.3	179.9	0	0	0	0	109.8	V474 E485 E487	V474-V476 PolarHBondContact O-N 3.11Å; V476-E485 HydrophobicContact CB-CB 4.48Å; V476-E485 HydrophobicContact CB-CG 4.21Å; V476-E485 PolarHBondContact N-O 2.89Å; V476-E487 HydrophobicContact CG2-CB 3.43Å; V476-E487 VanDerWaalsContact CG2-CB 3.43Å
477	Q	83.6	Confident	80.6	Confident	124 Å²	124	74.2 Å²	74.2	58%	0.579	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.3	143.2	-175.6	-169	171.6	15.6	0	0	110.6	E485	Q477-E485 HydrophobicContact CB-CB 4.25Å; Q477-E485 PolarHBondContact N-O 2.94Å; Q477-E485 PolarHBondContact O-N 2.9Å
478	R	81.2	Confident	81.6	Confident	160 Å²	160	70.2 Å²	70.2	60%	0.604	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.2	173.1	-179.3	174.6	-62.7	-159.1	1.9	110	E475 V484	E475-R478 WeakPolarHBondContact OE1-CB 3.42Å; E475-R478 IonicContact OE1-CZ 3.92Å; E475-R478 VanDerWaalsContact OE1-CZ 3.27Å; E475-R478 IonicContact OE1-NE 3.66Å; E475-R478 PolarHBondContact OE1-NE 2.82Å; E475-R478 IonicContact OE1-NH2 2.88Å; E475-R478 PolarHBondContact OE1-NH2 2.86Å; E475-R478 IonicContact OE2-NH2 3.78Å; E475-R478 PolarHBondContact OE2-NH2 3.37Å; R478-V484 HydrophobicContact CG-CG2 4.22Å
479	E	78.1	Confident	82.3	Confident	103 Å²	103	69 Å²	69	48%	0.481	35%	0.348	S	S	.	.			trans	-77	143.9	167.9	-64.5	-178.9	161.3	0	0	110.5	Y481 G482 A483	E479-Y481 PolarHBondContact O-N 2.91Å; E479-G482 PolarHBondContact O-N 3.18Å; E479-G482 WeakPolarHBondContact OE2-CA 3.48Å; E479-A483 PolarHBondContact N-O 3.04Å; E479-A483 PolarHBondContact OE2-N 3.41Å; E479-A483 VanDerWaalsContact OE2-N 3.15Å
480	E	68.9	Low	82.7	Confident	162 Å²	162	67.7 Å²	67.7	76%	0.757	34%	0.341	S	S	*	.	S	Bend	trans	-59.2	-31.8	-172.9	-164.9	170	-170.5	0	0	113.5
481	Y	69.2	Low	83.3	Confident	57 Å²	57	63.1 Å²	63.1	22%	0.224	33%	0.327	C	S	.	.	S	Bend	trans	-133.1	7.8	175.7	-53.5	-71.6	0	0	0	113.7	Q394 Q413 E479	Q394-Y481 PolarHBondContact OE1-O 3.39Å; Q413-Y481 HydrophobicContact CG-CE1 4.41Å; E479-Y481 PolarHBondContact O-N 2.91Å
482	G	73.8	Confident	83.1	Confident	4 Å²	4	62.9 Å²	62.9	4%	0.041	32%	0.323	C	S	.	.	S	Bend	trans	-117.9	-153.6	-165.7	0	0	0	0	0	114.5	E479	E479-G482 PolarHBondContact O-N 3.18Å; E479-G482 WeakPolarHBondContact OE2-CA 3.48Å
483	A	80.5	Confident	82.4	Confident	7 Å²	7	60.4 Å²	60.4	6%	0.058	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-73.5	154.7	-176.5	0	0	0	0	0	111.9	E479	E479-A483 PolarHBondContact N-O 3.04Å; E479-A483 PolarHBondContact OE2-N 3.41Å; E479-A483 VanDerWaalsContact OE2-N 3.15Å
484	V	87.9	Confident	81.3	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125	169.4	-176.6	0	0	0	0	107.9	G438 Y439 A441 E475 R478 V486	G438-V484 PolarHBondContact N-O 2.87Å; G438-V484 PolarHBondContact O-N 3.02Å; Y439-V484 HydrophobicContact CD2-CG2 4.39Å; A441-V484 HydrophobicContact CB-CB 3.8Å; A441-V484 HydrophobicContact CB-CG1 3.81Å; A441-V484 HydrophobicContact CB-CG2 4.07Å; E475-V484 VanDerWaalsContact CD-CG1 3.48Å; E475-V484 HydrophobicContact CG-CG1 3.55Å; E475-V484 WeakPolarHBondContact OE1-CG1 3.37Å; R478-V484 HydrophobicContact CG-CG2 4.22Å; V484-V486 HydrophobicContact CG1-CG1 4.17Å
485	E	89.9	Confident	80	Confident	37 Å²	37	62.9 Å²	62.9	17%	0.173	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	128.3	171.7	-173.8	175.1	-170.3	0	0	109.6	S436 F437 V476 Q477	S436-E485 WeakPolarHBondContact O-CA 3.35Å; F437-E485 HydrophobicContact CD1-CB 3.64Å; F437-E485 HydrophobicContact CD1-CG 3.78Å; F437-E485 HydrophobicContact CE1-CB 3.48Å; F437-E485 VanDerWaalsContact CE1-CB 3.48Å; F437-E485 HydrophobicContact CE1-CG 3.32Å; F437-E485 VanDerWaalsContact CE1-OE2 3.29Å; F437-E485 WeakPolarHBondContact CE1-OE2 3.5Å; F437-E485 HydrophobicContact CE2-CG 4.18Å; F437-E485 HydrophobicContact CG-CG 4.41Å; F437-E485 HydrophobicContact CZ-CB 4.24Å; F437-E485 HydrophobicContact CZ-CG 3.54Å; F437-E485 WeakPolarHBondContact CZ-OE1 3.44Å; V476-E485 HydrophobicContact CB-CB 4.48Å; V476-E485 HydrophobicContact CB-CG 4.21Å; V476-E485 PolarHBondContact N-O 2.89Å; Q477-E485 HydrophobicContact CB-CB 4.25Å; Q477-E485 PolarHBondContact N-O 2.94Å; Q477-E485 PolarHBondContact O-N 2.9Å
486	V	91.8	Very high	78.7	Confident	5 Å²	5	64.4 Å²	64.4	3%	0.03	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	149.5	175.3	-55	0	0	0	0	110.6	T435 S436 P442 I444 T473 V474 V484	T435-V486 CarbonylContact C-O 3.5Å; T435-V486 WeakPolarHBondContact CA-O 3.41Å; S436-V486 PolarHBondContact N-O 3.1Å; S436-V486 WeakPolarHBondContact O-CG2 3.48Å; S436-V486 PolarHBondContact O-N 3.39Å; P442-V486 HydrophobicContact CG-CG2 3.75Å; P442-V486 WeakPolarHBondContact O-CG2 3.42Å; I444-V486 HydrophobicContact CD1-CG2 3.86Å; I444-V486 HydrophobicContact CG1-CG2 4.14Å; T473-V486 HydrophobicContact CG2-CB 3.62Å; T473-V486 HydrophobicContact CG2-CG1 4.26Å; T473-V486 HydrophobicContact CG2-CG2 3.76Å; V474-V486 CarbonylContact O-C 3.43Å; V474-V486 VanDerWaalsContact O-CA 3.25Å; V474-V486 WeakPolarHBondContact O-CA 3.38Å; V484-V486 HydrophobicContact CG1-CG1 4.17Å
487	E	91.8	Very high	77.8	Confident	67 Å²	67	66.4 Å²	66.4	31%	0.313	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.8	-178.8	-176.4	176.1	-133.9	0	0	110.8	T433 C434 T435 T473 V474 V476 V489	T433-E487 HydrophobicContact CG2-CG 3.66Å; T433-E487 WeakPolarHBondContact CG2-OE1 3.47Å; C434-E487 CarbonylContact O-C 3.4Å; C434-E487 WeakPolarHBondContact O-CA 3.31Å; T435-E487 HydrophobicContact CG2-CG 4.17Å; T473-E487 WeakPolarHBondContact CA-O 3.23Å; V474-E487 PolarHBondContact N-O 3.4Å; V474-E487 PolarHBondContact O-N 3.2Å; V476-E487 HydrophobicContact CG2-CB 3.43Å; V476-E487 VanDerWaalsContact CG2-CB 3.43Å; E487-V489 HydrophobicContact CG-CG2 4.46Å
488	S	90.8	Very high	77.4	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.014	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	128.6	172.7	-169.5	0	0	0	0	110.2	C434 W446 A471 P472	C434-S488 PolarHBondContact N-O 3.41Å; C434-S488 PolarHBondContact O-N 2.81Å; W446-S488 WeakPolarHBondContact CZ2-O 3.23Å; W446-S488 PolarHBondContact NE1-OG 2.89Å; A471-S488 WeakPolarHBondContact CB-OG 3.31Å; P472-S488 WeakPolarHBondContact O-CB 3.27Å; P472-S488 PolarHBondContact O-OG 3.48Å
489	V	88.9	Confident	77.2	Confident	61 Å²	61	58.2 Å²	58.2	37%	0.37	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.8	-177.4	-176.4	0	0	0	0	109.9	L432 T433 A471 E487	L432-V489 CarbonylContact O-C 3.29Å; L432-V489 WeakPolarHBondContact O-CA 3.26Å; T433-V489 HydrophobicContact CG2-CG2 4.11Å; A471-V489 WeakPolarHBondContact CB-O 3.39Å; E487-V489 HydrophobicContact CG-CG2 4.46Å
490	L	86.6	Confident	77.5	Confident	14 Å²	14	53.3 Å²	53.3	7%	0.073	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.4	-178.4	177.6	71	0	0	0	110.5	L432 W446 L469 V492 V501	L432-L490 PolarHBondContact N-O 3.41Å; L432-L490 PolarHBondContact O-N 3.29Å; W446-L490 HydrophobicContact CB-CD2 4.02Å; W446-L490 HydrophobicContact CD2-CB 4.04Å; W446-L490 HydrophobicContact CD2-CD2 3.65Å; W446-L490 HydrophobicContact CD2-CG 4.43Å; W446-L490 HydrophobicContact CE3-CD2 3.68Å; W446-L490 HydrophobicContact CG-CB 4.35Å; W446-L490 HydrophobicContact CG-CD2 3.85Å; W446-L490 HydrophobicContact CH2-CB 4.45Å; W446-L490 HydrophobicContact CZ2-CB 3.94Å; W446-L490 HydrophobicContact CZ3-CD2 4.25Å; L469-L490 HydrophobicContact CB-CD1 3.86Å; L469-L490 HydrophobicContact CB-CD2 4.46Å; L469-L490 HydrophobicContact CD1-CD1 4Å; L469-L490 HydrophobicContact CD1-CD2 3.55Å; L469-L490 HydrophobicContact CD1-CG 4.35Å; L469-L490 HydrophobicContact CG-CD1 4.49Å; L490-V492 HydrophobicContact CD2-CG2 4.02Å; L490-V492 HydrophobicContact CG-CG2 4.15Å; L490-V501 HydrophobicContact CD2-CG1 3.92Å
491	T	81.9	Confident	78.3	Confident	103 Å²	103	45.6 Å²	45.6	63%	0.632	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	126.8	173	-51	0	0	0	0	110.2	T430 T431	T430-T491 CarbonylContact O-C 3.57Å; T430-T491 WeakPolarHBondContact O-CA 3.3Å; T430-T491 WeakPolarHBondContact O-CG2 3.5Å; T431-T491 HydrophobicContact CG2-CG2 4.04Å
492	V	75.5	Confident	79.2	Confident	15 Å²	15	43.2 Å²	43.2	9%	0.091	26%	0.257	C	S	.	.			trans	-114.5	129	-179	-171.8	0	0	0	0	109.7	T430 L432 L490 M499 V501 M518	T430-V492 PolarHBondContact O-N 3.37Å; L432-V492 HydrophobicContact CD1-CG2 3.67Å; L432-V492 HydrophobicContact CG-CG2 4.17Å; L490-V492 HydrophobicContact CD2-CG2 4.02Å; L490-V492 HydrophobicContact CG-CG2 4.15Å; V492-M499 HydrophobicContact CG1-CE 4Å; V492-M499 HydrophobicContact CG1-SD 4.41Å; V492-V501 HydrophobicContact CG2-CG2 4.4Å; V492-M518 HydrophobicContact CG1-SD 4.3Å
493	G	68.4	Low	80	Confident	48 Å²	48	43 Å²	43	50%	0.495	26%	0.255	S	S	.	.			trans	-74.9	159.9	177.6	0	0	0	0	0	113.2	S495	G493-S495 PolarHBondContact O-N 2.9Å
494	P	60.4	Low	80.4	Confident	135 Å²	135	43.3 Å²	43.3	88%	0.877	26%	0.256	S	S	*	.			trans	-62.9	124.4	177.4	25	-32	0	0	0	110.8
495	S	61.1	Low	80.5	Confident	52 Å²	52	43.1 Å²	43.1	36%	0.364	26%	0.255	S	S	.	.			trans	-113.7	134.4	178.8	176.7	0	0	0	0	110.8	G493 Q497	G493-S495 PolarHBondContact O-N 2.9Å; S495-Q497 VanDerWaalsContact C-N 3.29Å; S495-Q497 PolarHBondContact OG-N 3.45Å; S495-Q497 PolarHBondContact OG-O 3.49Å
496	S	58.2	Low	80.5	Confident	119 Å²	119	44.5 Å²	44.5	83%	0.832	26%	0.261	S	S	*	.	S	Bend	trans	-85	-2.7	173.3	53	0	0	0	0	113.2
497	Q	66.2	Low	80.3	Confident	117 Å²	117	45.4 Å²	45.4	55%	0.547	27%	0.265	S	S	.	.	S	Bend	trans	-116.7	142.3	-179.7	-63.7	-177.7	-11.2	0	0	110.1	L450 S495 M499	L450-Q497 HydrophobicContact CD2-CB 4.25Å; L450-Q497 VanDerWaalsContact CD2-OE1 3.32Å; S495-Q497 VanDerWaalsContact C-N 3.29Å; S495-Q497 PolarHBondContact OG-N 3.45Å; S495-Q497 PolarHBondContact OG-O 3.49Å; Q497-M499 PolarHBondContact O-N 3.44Å
498	R	73.3	Confident	79.9	Confident	98 Å²	98	49.4 Å²	49.4	37%	0.37	29%	0.288	S	S	.	.			trans	-56.6	123.2	171.7	-66.1	177.9	94.4	167.6	9.3	108	G451 I452 M518 E519	G451-R498 VanDerWaalsContact CA-O 3.31Å; G451-R498 WeakPolarHBondContact CA-O 3.43Å; G451-R498 PolarHBondContact N-O 3.36Å; I452-R498 HydrophobicContact CG1-CB 4.19Å; R498-M518 WeakPolarHBondContact CA-O 3.36Å; R498-E519 IonicContact CZ-OE1 4Å; R498-E519 IonicContact NH2-OE1 2.84Å; R498-E519 PolarHBondContact NH2-OE1 3.27Å
499	M	77.9	Confident	79.6	Confident	13 Å²	13	52.2 Å²	52.2	6%	0.064	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	157.1	176.9	99	164.4	87.4	0	0	109.9	Q448 C449 G451 V492 Q497 V501 M518	Q448-M499 HydrophobicContact CG-SD 4.45Å; C449-M499 WeakPolarHBondContact O-CA 3.4Å; G451-M499 CarbonylContact O-C 3.4Å; V492-M499 HydrophobicContact CG1-CE 4Å; V492-M499 HydrophobicContact CG1-SD 4.41Å; Q497-M499 PolarHBondContact O-N 3.44Å; M499-V501 HydrophobicContact CG-CG2 4.24Å; M499-V501 HydrophobicContact SD-CG2 3.91Å; M499-M518 HydrophobicContact CE-SD 3.9Å; M499-M518 HydrophobicContact CG-CB 4.34Å; M499-M518 HydrophobicContact CG-CG 4.15Å; M499-M518 HydrophobicContact CG-SD 3.65Å; M499-M518 WeakPolarHBondContact O-CB 3.44Å; M499-M518 PolarHBondContact O-N 3.09Å; M499-M518 HydrophobicContact SD-SD 4.14Å
500	T	84.1	Confident	79.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.4	169.2	-53.5	0	0	0	0	108.5	C449 G451 I452 R453 T515	C449-T500 PolarHBondContact N-O 2.77Å; C449-T500 PolarHBondContact O-N 2.72Å; G451-T500 PolarHBondContact O-N 2.88Å; G451-T500 PolarHBondContact O-OG1 3.01Å; I452-T500 WeakPolarHBondContact CA-OG1 3.5Å; R453-T500 PolarHBondContact N-OG1 3.45Å; R453-T500 WeakPolarHBondContact O-CG2 3.43Å; T500-T515 HydrophobicContact CG2-CG2 4.05Å
501	V	86.4	Confident	79.5	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.6	168.7	-177.3	0	0	0	0	107.6	L432 W446 Y447 L490 V492 M499 T515 L516	L432-V501 HydrophobicContact CD1-CB 3.97Å; L432-V501 HydrophobicContact CD1-CG1 3.81Å; L432-V501 HydrophobicContact CD1-CG2 4.17Å; W446-V501 HydrophobicContact CE3-CG1 3.61Å; W446-V501 HydrophobicContact CZ3-CG1 3.79Å; Y447-V501 WeakPolarHBondContact O-CA 3.36Å; L490-V501 HydrophobicContact CD2-CG1 3.92Å; V492-V501 HydrophobicContact CG2-CG2 4.4Å; M499-V501 HydrophobicContact CG-CG2 4.24Å; M499-V501 HydrophobicContact SD-CG2 3.91Å; V501-T515 WeakPolarHBondContact O-CA 3.32Å; V501-L516 PolarHBondContact N-O 3.46Å; V501-L516 PolarHBondContact O-N 2.98Å
502	E	88.1	Confident	79.9	Confident	7 Å²	7	47.5 Å²	47.5	3%	0.033	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.8	-176.8	-178.5	171.9	-146.2	0	0	109.4	W446 Y447 T455 C456 V504 R513 T515	W446-E502 CarbonylContact C-O 3.52Å; W446-E502 WeakPolarHBondContact CA-O 3.44Å; Y447-E502 PolarHBondContact N-O 2.83Å; Y447-E502 PolarHBondContact O-N 3.35Å; T455-E502 WeakPolarHBondContact CB-OE1 3.39Å; C456-E502 WeakPolarHBondContact CB-OE2 3.33Å; C456-E502 PolarHBondContact N-OE2 3.2Å; E502-V504 HydrophobicContact CG-CG2 3.78Å; E502-R513 WeakPolarHBondContact OE1-CD 3.48Å; E502-T515 HydrophobicContact CB-CG2 3.72Å; E502-T515 HydrophobicContact CG-CG2 3.58Å
503	C	89.6	Confident	80.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.4	165.3	176.8	0	0	0	0	109.2	V424 C434 I444 W446 R513 D514	V424-C503 HydrophobicContact CG2-CB 3.15Å; C434-C503 HydrophobicContact CB-CB 3.7Å; C434-C503 WeakPolarHBondContact CB-SG 3.2Å; C434-C503 WeakPolarHBondContact SG-CB 3.43Å; C434-C503 CovalentContact SG-SG 2.02Å; C434-C503 PolarHBondContact SG-SG 3.24Å; I444-C503 WeakPolarHBondContact CG2-SG 3.31Å; W446-C503 HydrophobicContact CD2-CB 4.29Å; W446-C503 HydrophobicContact CE3-CB 3.85Å; W446-C503 HydrophobicContact CH2-CB 4.11Å; W446-C503 HydrophobicContact CZ3-CB 3.75Å; C503-R513 VanDerWaalsContact O-CA 3.27Å; C503-R513 WeakPolarHBondContact O-CA 3.49Å; C503-D514 PolarHBondContact N-O 3Å; C503-D514 PolarHBondContact O-N 2.75Å
504	V	89.2	Confident	81.5	Confident	12 Å²	12	53.4 Å²	53.4	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	106.5	177.6	-177.9	0	0	0	0	108.4	I444 I445 Y447 E502 V511 R513	I444-V504 WeakPolarHBondContact CA-O 3.34Å; I445-V504 PolarHBondContact N-O 3.45Å; I445-V504 PolarHBondContact O-N 3.01Å; Y447-V504 HydrophobicContact CD2-CB 4.3Å; Y447-V504 HydrophobicContact CD2-CG2 3.56Å; Y447-V504 HydrophobicContact CE2-CB 4.05Å; Y447-V504 HydrophobicContact CE2-CG2 3.68Å; E502-V504 HydrophobicContact CG-CG2 3.78Å; V504-V511 HydrophobicContact CG1-CG1 3.4Å; V504-R513 HydrophobicContact CB-CG 4.48Å; V504-R513 HydrophobicContact CG1-CG 4.17Å; V504-R513 HydrophobicContact CG2-CG 3.99Å
505	A	90.5	Very high	82.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.4	169.9	0	0	0	0	0	109.8	P420 A422 S436 R443 I444 V511 S512	P420-A505 HydrophobicContact CB-CB 3.92Å; P420-A505 WeakPolarHBondContact CG-O 3.45Å; A422-A505 HydrophobicContact CB-CB 3.73Å; S436-A505 VanDerWaalsContact OG-CB 3.23Å; S436-A505 WeakPolarHBondContact OG-CB 3.15Å; R443-A505 CarbonylContact O-C 3.52Å; R443-A505 VanDerWaalsContact O-CA 3.3Å; R443-A505 WeakPolarHBondContact O-CA 2.9Å; I444-A505 HydrophobicContact CG1-CB 4.04Å; A505-V511 CarbonylContact O-C 3.52Å; A505-V511 WeakPolarHBondContact O-CA 3.48Å; A505-S512 PolarHBondContact N-O 2.91Å; A505-S512 PolarHBondContact O-N 2.95Å; A505-S512 VanDerWaalsContact O-O 3.06Å
506	F	88.9	Confident	83.9	Confident	66 Å²	66	48.4 Å²	48.4	29%	0.289	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.2	178.8	65.8	-80.4	0	0	0	112.5	P442 R443 I445 G510 V511	P442-F506 WeakPolarHBondContact CA-O 3.47Å; R443-F506 HydrophobicContact CB-CE1 4Å; R443-F506 HydrophobicContact CB-CE2 4.42Å; R443-F506 HydrophobicContact CB-CZ 3.94Å; R443-F506 PolarHBondContact N-O 3.26Å; R443-F506 VanDerWaalsContact O-CD1 3.31Å; R443-F506 WeakPolarHBondContact O-CD1 3.31Å; R443-F506 PolarHBondContact O-N 3.03Å; I445-F506 HydrophobicContact CD1-CE1 3.44Å; I445-F506 VanDerWaalsContact CD1-CE1 3.44Å; I445-F506 HydrophobicContact CD1-CZ 3.92Å; I445-F506 HydrophobicContact CG1-CE1 3.84Å; F506-G510 WeakPolarHBondContact CA-O 3.43Å; F506-V511 HydrophobicContact CB-CB 4.29Å; F506-V511 HydrophobicContact CB-CG1 4.19Å; F506-V511 HydrophobicContact CB-CG2 3.8Å
507	N	88.4	Confident	84.8	Confident	23 Å²	23	44.7 Å²	44.7	12%	0.123	23%	0.228	C	C	.	.			trans	-136.8	-169.5	167.2	73.8	1.8	0	0	0	110.1	Q418 P420 Y439 P440 P442 I509 G510	Q418-N507 PolarHBondContact O-ND2 3.23Å; P420-N507 VanDerWaalsContact CD-CG 3.4Å; P420-N507 WeakPolarHBondContact CD-OD1 3.38Å; Y439-N507 PolarHBondContact O-ND2 2.73Å; P440-N507 WeakPolarHBondContact O-CB 3.4Å; P440-N507 PolarHBondContact O-ND2 3.35Å; P442-N507 HydrophobicContact CB-CB 4.26Å; N507-I509 PolarHBondContact O-N 3.34Å; N507-I509 WeakPolarHBondContact OD1-CA 3.22Å; N507-I509 WeakPolarHBondContact OD1-CB 3.38Å; N507-I509 PolarHBondContact OD1-N 3.12Å; N507-G510 PolarHBondContact N-O 3.22Å; N507-G510 PolarHBondContact O-N 3.47Å; N507-G510 PolarHBondContact OD1-N 3.03Å; N507-G510 VanDerWaalsContact OD1-N 3.08Å; N507-G510 PolarHBondContact OD1-O 2.91Å
508	L	82.8	Confident	85	Confident	151 Å²	151	41.3 Å²	41.3	79%	0.791	21%	0.212	S	C	*	.	S	Bend	trans	-64	-18.6	-179.8	-69.4	170.7	0	0	0	114.3	P440	P440-L508 HydrophobicContact CG-CD1 4.21Å
509	I	85.3	Confident	84.6	Confident	62 Å²	62	42.4 Å²	42.4	32%	0.318	22%	0.222	S	C	.	.	S	Bend	trans	-97.2	-30.2	-175.3	-59.3	-64.4	0	0	0	111.8	Y417 R419 N507	Y417-I509 HydrophobicContact CD1-CD1 3.47Å; Y417-I509 VanDerWaalsContact CD1-CD1 3.47Å; Y417-I509 HydrophobicContact CD1-CG1 3.58Å; Y417-I509 HydrophobicContact CD2-CD1 4.12Å; Y417-I509 HydrophobicContact CE1-CD1 4.13Å; Y417-I509 HydrophobicContact CE1-CG1 4.45Å; Y417-I509 HydrophobicContact CG-CD1 3.47Å; Y417-I509 VanDerWaalsContact CG-CD1 3.47Å; Y417-I509 HydrophobicContact CG-CG1 3.87Å; R419-I509 HydrophobicContact CB-CG2 4.27Å; N507-I509 PolarHBondContact O-N 3.34Å; N507-I509 WeakPolarHBondContact OD1-CA 3.22Å; N507-I509 WeakPolarHBondContact OD1-CB 3.38Å; N507-I509 PolarHBondContact OD1-N 3.12Å
510	G	84.7	Confident	83.6	Confident	17 Å²	17	46.6 Å²	46.6	18%	0.175	25%	0.248	C	C	.	.			trans	175.5	-169.8	173.3	0	0	0	0	0	114.1	P420 F506 N507	P420-G510 VanDerWaalsContact CG-O 3.29Å; P420-G510 WeakPolarHBondContact CG-O 3.46Å; F506-G510 WeakPolarHBondContact CA-O 3.43Å; N507-G510 PolarHBondContact N-O 3.22Å; N507-G510 PolarHBondContact O-N 3.47Å; N507-G510 PolarHBondContact OD1-N 3.03Å; N507-G510 VanDerWaalsContact OD1-N 3.08Å; N507-G510 PolarHBondContact OD1-O 2.91Å
511	V	88.4	Confident	81.7	Confident	41 Å²	41	51.2 Å²	51.2	25%	0.248	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135	-179.3	-173.4	0	0	0	0	108	R419 V504 A505 F506 R513	R419-V511 PolarHBondContact NE-O 3.45Å; R419-V511 PolarHBondContact NH2-O 3Å; V504-V511 HydrophobicContact CG1-CG1 3.4Å; A505-V511 CarbonylContact O-C 3.52Å; A505-V511 WeakPolarHBondContact O-CA 3.48Å; F506-V511 HydrophobicContact CB-CB 4.29Å; F506-V511 HydrophobicContact CB-CG1 4.19Å; F506-V511 HydrophobicContact CB-CG2 3.8Å; V511-R513 HydrophobicContact CG1-CG 4.06Å
512	S	89.9	Confident	79.2	Confident	21 Å²	21	57 Å²	57	15%	0.147	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.5	165	177.6	0	0	0	0	109	P420 A422 A505	P420-S512 WeakPolarHBondContact O-CB 3.45Å; A422-S512 PolarHBondContact N-OG 2.96Å; A422-S512 VanDerWaalsContact N-OG 3.09Å; A505-S512 PolarHBondContact N-O 2.91Å; A505-S512 PolarHBondContact O-N 2.95Å; A505-S512 VanDerWaalsContact O-O 3.06Å
513	R	89.1	Confident	76.7	Confident	135 Å²	135	66.2 Å²	66.2	51%	0.509	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137.8	-175.9	-53.1	-171.4	-178.6	73.6	-0.6	106.9	E502 C503 V504 V511	E502-R513 WeakPolarHBondContact OE1-CD 3.48Å; C503-R513 VanDerWaalsContact O-CA 3.27Å; C503-R513 WeakPolarHBondContact O-CA 3.49Å; V504-R513 HydrophobicContact CB-CG 4.48Å; V504-R513 HydrophobicContact CG1-CG 4.17Å; V504-R513 HydrophobicContact CG2-CG 3.99Å; V511-R513 HydrophobicContact CG1-CG 4.06Å
514	D	88.8	Confident	74.3	Confident	52 Å²	52	73.7 Å²	73.7	28%	0.278	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.9	169	-168.6	24.2	0	0	0	108.2	A422 V424 C503	A422-D514 HydrophobicContact CB-CB 4.47Å; A422-D514 WeakPolarHBondContact O-CB 3.4Å; V424-D514 HydrophobicContact CG2-CB 4.11Å; V424-D514 PolarHBondContact N-OD2 3.09Å; C503-D514 PolarHBondContact N-O 3Å; C503-D514 PolarHBondContact O-N 2.75Å
515	T	86.4	Confident	71.6	Confident	45 Å²	45	82.9 Å²	82.9	28%	0.276	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133	-175.5	50.1	0	0	0	0	109.5	P454 T500 V501 E502	P454-T515 VanDerWaalsContact O-CG2 3.26Å; P454-T515 WeakPolarHBondContact O-CG2 3.3Å; P454-T515 PolarHBondContact O-OG1 2.67Å; T500-T515 HydrophobicContact CG2-CG2 4.05Å; V501-T515 WeakPolarHBondContact O-CA 3.32Å; E502-T515 HydrophobicContact CB-CG2 3.72Å; E502-T515 HydrophobicContact CG-CG2 3.58Å
516	L	84.7	Confident	69.4	Low	37 Å²	37	87.6 Å²	87.6	19%	0.194	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	111.2	172	-171.9	78.3	0	0	0	108.4	V424 W426 L432 V501	V424-L516 HydrophobicContact CG1-CB 4.22Å; W426-L516 HydrophobicContact CD2-CD2 4.28Å; W426-L516 VanDerWaalsContact CE2-CD2 3.49Å; W426-L516 HydrophobicContact CZ2-CD2 3.65Å; L432-L516 HydrophobicContact CD1-CD2 4.13Å; L432-L516 HydrophobicContact CD2-CD2 3.29Å; L432-L516 HydrophobicContact CG-CD2 4.37Å; V501-L516 PolarHBondContact N-O 3.46Å; V501-L516 PolarHBondContact O-N 2.98Å
517	A	77.1	Confident	67.2	Low	41 Å²	41	91.5 Å²	91.5	34%	0.339	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.9	173.2	0	0	0	0	0	110	I452 E519	I452-A517 HydrophobicContact CD1-CB 4.19Å; I452-A517 HydrophobicContact CG1-CB 4.2Å; I452-A517 HydrophobicContact CG2-CB 3.84Å; A517-E519 HydrophobicContact CB-CG 4.5Å; A517-E519 PolarHBondContact O-N 2.99Å
518	M	71.1	Confident	65.3	Low	46 Å²	46	97 Å²	97	23%	0.227	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	95	169.1	-58.7	-174.9	73.2	0	0	107.5	W426 V492 R498 M499	W426-M518 HydrophobicContact CH2-CE 4.12Å; W426-M518 HydrophobicContact CZ2-CE 4.42Å; V492-M518 HydrophobicContact CG1-SD 4.3Å; R498-M518 WeakPolarHBondContact CA-O 3.36Å; M499-M518 HydrophobicContact CE-SD 3.9Å; M499-M518 HydrophobicContact CG-CB 4.34Å; M499-M518 HydrophobicContact CG-CG 4.15Å; M499-M518 HydrophobicContact CG-SD 3.65Å; M499-M518 WeakPolarHBondContact O-CB 3.44Å; M499-M518 PolarHBondContact O-N 3.09Å; M499-M518 HydrophobicContact SD-SD 4.14Å
519	E	64.1	Low	63.7	Low	121 Å²	121	98.1 Å²	98.1	57%	0.565	53%	0.528	S	S	*	.			trans	-82.5	143.1	-179.8	-57.1	-138.5	103.5	0	0	112.8	I452 R498 A517	I452-E519 HydrophobicContact CD1-CB 4.18Å; I452-E519 HydrophobicContact CD1-CG 3.47Å; I452-E519 VanDerWaalsContact CD1-CG 3.47Å; I452-E519 WeakPolarHBondContact CD1-OE1 3.47Å; R498-E519 IonicContact CZ-OE1 4Å; R498-E519 IonicContact NH2-OE1 2.84Å; R498-E519 PolarHBondContact NH2-OE1 3.27Å; A517-E519 HydrophobicContact CB-CG 4.5Å; A517-E519 PolarHBondContact O-N 2.99Å
520	V	57	Low	62.1	Low	101 Å²	101	100.7 Å²	100.7	61%	0.612	55%	0.552	S	S	*	*			trans	-104.9	125.7	144.2	-179.3	0	0	0	0	105.3	D522	V520-D522 PolarHBondContact O-N 3.06Å
521	S	45.3	Very low	60.7	Low	96 Å²	96	102.6 Å²	102.6	67%	0.671	57%	0.571	S	S	*	*			trans	-44.4	125.2	-169.6	-169.4	0	0	0	0	114.4
522	D	34.7	Very low	59.2	Low	123 Å²	123	104.9 Å²	104.9	66%	0.658	59%	0.594	S	S	*	*				174.7	161.1	115.8	-92.6	-7.5	0	0	0	114.7	V520	V520-D522 PolarHBondContact O-N 3.06Å
523	K	34.9	Very low	57.7	Low	201 Å²	201	107.8 Å²	107.8	87%	0.874	62%	0.62	S	S	*	*			trans	-72.4	157.2	-146.2	-73.7	167.3	172.1	170.2	0	120.7
524	L	38.2	Very low	56.5	Low	156 Å²	156	103.4 Å²	103.4	82%	0.817	62%	0.616	S	S	*	*			trans	-55.9	156.7	171.3	-77.2	133.8	0	0	0	118.1
525	F	32.4	Very low	55.4	Low	205 Å²	205	106.2 Å²	106.2	90%	0.899	63%	0.63	S	S	*	*			trans	-159.8	148.1	136.1	-129.6	-93.4	0	0	0	114.9
526	T	45.5	Very low	54.5	Low	100 Å²	100	109.8 Å²	109.8	61%	0.613	65%	0.647	S	S	*	*			trans	-103.8	159	-167.2	46.8	0	0	0	0	115
527	T	42.8	Very low	53.8	Low	148 Å²	148	110.8 Å²	110.8	91%	0.908	66%	0.661	S	S	*	*			trans	-153.7	102.7	153.8	15.3	0	0	0	0	113.7
528	T	48.3	Very low	53.7	Low	138 Å²	138	114 Å²	114	85%	0.847	67%	0.671	S	S	*	*			trans	-101	101	166.9	44.2	0	0	0	0	109.8
529	L	49.3	Very low	53.7	Low	175 Å²	175	116.9 Å²	116.9	92%	0.916	69%	0.687	S	S	*	*			trans	-156.4	59.8	168	-155.2	78.8	0	0	0	111.9
530	S	51.6	Low	54.2	Low	116 Å²	116	116.6 Å²	116.6	81%	0.811	69%	0.689	S	S	*	*	S	Bend	trans	-143.3	-0.1	171.8	59.6	0	0	0	0	115
531	G	55.7	Low	55.3	Low	56 Å²	56	116 Å²	116	58%	0.577	69%	0.685	S	S	*	*	S	Bend	trans	-82.4	-17.2	-173.4	0	0	0	0	0	116.3
532	A	56.7	Low	56.8	Low	89 Å²	89	115.9 Å²	115.9	74%	0.736	68%	0.676	S	S	*	*	H	α-helix	trans	-79.8	-23.9	-168.5	0	0	0	0	0	114.5
533	A	57	Low	58.7	Low	83 Å²	83	114.9 Å²	114.9	69%	0.686	67%	0.67	S	S	*	*	H	α-helix	trans	-82.3	-28.6	-176.8	0	0	0	0	0	113.7
534	G	63.8	Low	60.6	Low	42 Å²	42	108.1 Å²	108.1	43%	0.433	65%	0.652	S	S	.	*	H	α-helix	trans	-71.5	-31.8	-177.8	0	0	0	0	0	113.8	L536 A537 I538	G534-L536 VanDerWaalsContact C-N 3.32Å; G534-L536 PolarHBondContact O-N 3.42Å; G534-A537 PolarHBondContact O-N 3.13Å; G534-I538 WeakPolarHBondContact O-CG1 3.38Å; G534-I538 PolarHBondContact O-N 3.07Å
535	I	67.3	Low	62.3	Low	112 Å²	112	104.9 Å²	104.9	57%	0.574	64%	0.635	S	S	*	*	H	α-helix	trans	-69.1	-32.7	-175.5	-61.6	173.2	0	0	0	111.3	L539	I535-L539 HydrophobicContact CG2-CD1 4.31Å; I535-L539 PolarHBondContact O-N 3.29Å
536	L	65.9	Low	63.9	Low	119 Å²	119	100.8 Å²	100.8	62%	0.623	62%	0.622	S	S	*	*	H	α-helix	trans	-73	-33.9	-178.5	-168.3	63.9	0	0	0	112.7	G534 L540	G534-L536 VanDerWaalsContact C-N 3.32Å; G534-L536 PolarHBondContact O-N 3.42Å; L536-L540 PolarHBondContact O-N 3.43Å
537	A	70.9	Confident	64.9	Low	59 Å²	59	101.4 Å²	101.4	49%	0.488	62%	0.62	S	S	.	*	H	α-helix	trans	-70.1	-37.2	177.3	0	0	0	0	0	112.2	G534 L540 V541	G534-A537 PolarHBondContact O-N 3.13Å; A537-L540 PolarHBondContact O-N 2.73Å; A537-V541 WeakPolarHBondContact O-CG2 3.36Å; A537-V541 PolarHBondContact O-N 3.01Å
538	I	74.4	Confident	66.2	Low	109 Å²	109	101.8 Å²	101.8	56%	0.559	61%	0.606	S	S	*	*	H	α-helix	trans	-67.7	-38	179.9	-65.3	168.9	0	0	0	111.1	G534 L540 V541 L542	G534-I538 WeakPolarHBondContact O-CG1 3.38Å; G534-I538 PolarHBondContact O-N 3.07Å; I538-L540 PolarHBondContact O-N 3.01Å; I538-V541 PolarHBondContact O-N 3.01Å; I538-L542 HydrophobicContact CG2-CD1 4.1Å; I538-L542 WeakPolarHBondContact O-CG 3.24Å; I538-L542 PolarHBondContact O-N 3.43Å; I538-L542 VanDerWaalsContact O-N 3.1Å
539	L	71.6	Confident	66.4	Low	106 Å²	106	101.6 Å²	101.6	56%	0.555	59%	0.594	S	S	*	*	H	α-helix	trans	-65.8	-35.7	178.3	-78.9	164.7	0	0	0	113	I535 L543	I535-L539 HydrophobicContact CG2-CD1 4.31Å; I535-L539 PolarHBondContact O-N 3.29Å; L539-L543 PolarHBondContact O-N 3.16Å
540	L	75.2	Confident	66.6	Low	115 Å²	115	101.3 Å²	101.3	60%	0.602	58%	0.582	S	S	*	*	H	α-helix	trans	-71.7	-35.7	177.7	-72.3	171	0	0	0	112.7	L536 A537 I538 L543 A544	L536-L540 PolarHBondContact O-N 3.43Å; A537-L540 PolarHBondContact O-N 2.73Å; I538-L540 PolarHBondContact O-N 3.01Å; L540-L543 PolarHBondContact O-N 3.25Å; L540-A544 PolarHBondContact O-N 3.04Å
541	V	79	Confident	66.7	Low	89 Å²	89	104.7 Å²	104.7	54%	0.539	58%	0.582	S	S	.	*	H	α-helix	trans	-68.1	-39.5	174.9	173.9	0	0	0	0	111.2	A537 I538 L543 A544 I545	A537-V541 WeakPolarHBondContact O-CG2 3.36Å; A537-V541 PolarHBondContact O-N 3.01Å; I538-V541 PolarHBondContact O-N 3.01Å; V541-L543 VanDerWaalsContact C-N 3.32Å; V541-L543 PolarHBondContact O-N 2.71Å; V541-A544 PolarHBondContact O-N 2.82Å; V541-I545 HydrophobicContact CG1-CD1 3.95Å; V541-I545 WeakPolarHBondContact O-CG1 3.36Å; V541-I545 PolarHBondContact O-N 3.11Å; V541-I545 VanDerWaalsContact O-N 3.07Å
542	L	76.4	Confident	66.3	Low	92 Å²	92	106.6 Å²	106.6	48%	0.482	58%	0.576	S	S	.	*	H	α-helix	trans	-62.6	-37.7	175.3	-77.3	166.3	0	0	0	112.5	I538 I545 L546	I538-L542 HydrophobicContact CG2-CD1 4.1Å; I538-L542 WeakPolarHBondContact O-CG 3.24Å; I538-L542 PolarHBondContact O-N 3.43Å; I538-L542 VanDerWaalsContact O-N 3.1Å; L542-I545 PolarHBondContact O-N 3Å; L542-L546 WeakPolarHBondContact O-CG 3.38Å; L542-L546 PolarHBondContact O-N 2.99Å
543	L	74.9	Confident	65.7	Low	102 Å²	102	109.4 Å²	109.4	53%	0.534	57%	0.571	S	S	.	*	H	α-helix	trans	-65.1	-40.9	176.5	-164.5	79.2	0	0	0	112	L539 L540 V541 L546 L547	L539-L543 PolarHBondContact O-N 3.16Å; L540-L543 PolarHBondContact O-N 3.25Å; V541-L543 VanDerWaalsContact C-N 3.32Å; V541-L543 PolarHBondContact O-N 2.71Å; L543-L546 PolarHBondContact O-N 3.46Å; L543-L547 WeakPolarHBondContact O-CG 3.29Å; L543-L547 PolarHBondContact O-N 3.47Å; L543-L547 VanDerWaalsContact O-N 3.07Å
544	A	75.6	Confident	65	Low	60 Å²	60	107.2 Å²	107.2	50%	0.496	55%	0.55	S	S	.	*	H	α-helix	trans	-65.9	-38.3	176.2	0	0	0	0	0	112.4	L540 V541 L547 Y548	L540-A544 PolarHBondContact O-N 3.04Å; V541-A544 PolarHBondContact O-N 2.82Å; A544-L547 PolarHBondContact O-N 2.99Å; A544-Y548 WeakPolarHBondContact O-CB 2.89Å; A544-Y548 PolarHBondContact O-N 3.38Å
545	I	73.4	Confident	64.4	Low	88 Å²	88	114.9 Å²	114.9	45%	0.451	57%	0.566	S	S	.	*	H	α-helix	trans	-66.1	-39.2	175.2	-67.2	167.5	0	0	0	111.2	V541 L542 Y548 K549	V541-I545 HydrophobicContact CG1-CD1 3.95Å; V541-I545 WeakPolarHBondContact O-CG1 3.36Å; V541-I545 PolarHBondContact O-N 3.11Å; V541-I545 VanDerWaalsContact O-N 3.07Å; L542-I545 PolarHBondContact O-N 3Å; I545-Y548 PolarHBondContact O-N 3.11Å; I545-K549 WeakPolarHBondContact O-CB 3.4Å; I545-K549 WeakPolarHBondContact O-CG 3.21Å; I545-K549 PolarHBondContact O-N 3.09Å
546	L	67.1	Low	63.3	Low	119 Å²	119	110.5 Å²	110.5	62%	0.623	54%	0.542	S	S	*	.	H	α-helix	trans	-63.2	-42.3	175.2	-79.8	165.6	0	0	0	112	L542 L543 K549 Y550	L542-L546 WeakPolarHBondContact O-CG 3.38Å; L542-L546 PolarHBondContact O-N 2.99Å; L543-L546 PolarHBondContact O-N 3.46Å; L546-K549 PolarHBondContact O-N 3.37Å; L546-Y550 WeakPolarHBondContact O-CB 3.5Å; L546-Y550 PolarHBondContact O-N 3.42Å
547	L	66.6	Low	62.4	Low	112 Å²	112	112.1 Å²	112.1	59%	0.586	55%	0.547	S	S	*	.	H	α-helix	trans	-67.6	-35.7	175.9	-70.5	170.5	0	0	0	112.4	L543 A544 Y550 K551	L543-L547 WeakPolarHBondContact O-CG 3.29Å; L543-L547 PolarHBondContact O-N 3.47Å; L543-L547 VanDerWaalsContact O-N 3.07Å; A544-L547 PolarHBondContact O-N 2.99Å; L547-Y550 PolarHBondContact O-N 2.79Å; L547-K551 PolarHBondContact O-N 2.92Å
548	Y	68.4	Low	61.3	Low	156 Å²	156	110.5 Å²	110.5	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-64.8	-44.8	172.7	179.1	-100.2	0	0	0	112.1	A544 I545 Y550 K551 Q552	A544-Y548 WeakPolarHBondContact O-CB 2.89Å; A544-Y548 PolarHBondContact O-N 3.38Å; I545-Y548 PolarHBondContact O-N 3.11Å; Y548-Y550 VanDerWaalsContact C-N 3.31Å; Y548-Y550 PolarHBondContact O-N 3.13Å; Y548-K551 PolarHBondContact O-N 2.82Å; Y548-Q552 PolarHBondContact OH-NE2 2.79Å
549	K	53.4	Low	60.3	Low	135 Å²	135	107.3 Å²	107.3	59%	0.587	51%	0.51	S	S	*	.	H	α-helix	trans	-64.4	-32.6	174.6	-79.1	-89.5	-179.7	174.6	0	112.7	I545 L546 K551 Q552	I545-K549 WeakPolarHBondContact O-CB 3.4Å; I545-K549 WeakPolarHBondContact O-CG 3.21Å; I545-K549 PolarHBondContact O-N 3.09Å; L546-K549 PolarHBondContact O-N 3.37Å; K549-K551 VanDerWaalsContact C-N 3.32Å; K549-K551 PolarHBondContact O-N 2.95Å; K549-Q552 PolarHBondContact O-N 2.75Å
550	Y	53.7	Low	58.9	Low	169 Å²	169	102.8 Å²	102.8	66%	0.663	49%	0.486	S	S	*	.	H	α-helix	trans	-66.1	-31.7	178.4	-170.9	-99.3	0	0	0	113	L546 L547 Y548 Q552	L546-Y550 WeakPolarHBondContact O-CB 3.5Å; L546-Y550 PolarHBondContact O-N 3.42Å; L547-Y550 PolarHBondContact O-N 2.79Å; Y548-Y550 VanDerWaalsContact C-N 3.31Å; Y548-Y550 PolarHBondContact O-N 3.13Å; Y550-Q552 VanDerWaalsContact C-N 3.34Å
551	K	53.2	Low	57.8	Low	187 Å²	187	100.7 Å²	100.7	81%	0.813	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-7.7	176.7	-75	-115.6	178.8	177.9	0	114.7	L547 Y548 K549	L547-K551 PolarHBondContact O-N 2.92Å; Y548-K551 PolarHBondContact O-N 2.82Å; K549-K551 VanDerWaalsContact C-N 3.32Å; K549-K551 PolarHBondContact O-N 2.95Å
552	Q	48.1	Very low	56.4	Low	96 Å²	96	96.9 Å²	96.9	45%	0.449	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	11.8	-179.8	-75	-170.2	-11.5	0	0	114.7	Y548 K549 Y550	Y548-Q552 PolarHBondContact OH-NE2 2.79Å; K549-Q552 PolarHBondContact O-N 2.75Å; Y550-Q552 VanDerWaalsContact C-N 3.34Å
553	K	43.8	Very low	55.1	Low	148 Å²	148	93.7 Å²	93.7	64%	0.643	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-69.7	128.3	176	-78.1	-171.7	175.9	-176.5	0	110.9
554	P	42.8	Very low	53.5	Low	37 Å²	37	95.6 Å²	95.6	24%	0.24	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-70.6	143.2	179.3	28.3	-31.8	0	0	0	111.2	M814	P554-M814 HydrophobicContact CG-CE 3.74Å; P554-M814 HydrophobicContact CG-SD 3.31Å; P554-M814 WeakPolarHBondContact CG-SD 3.19Å
555	R	50.9	Low	51.5	Low	202 Å²	202	95.1 Å²	95.1	76%	0.762	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-95.2	144.3	178.9	-66.6	178	172.6	168.8	-6.8	110.3
556	Y	44	Very low	49.8	Very low	21 Å²	21	100.6 Å²	100.6	8%	0.082	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-85.3	120.8	175.9	178.3	-100.7	0	0	0	109.9	F603 A639 L809	Y556-F603 AromaticContact CD2-CD2 3.73Å; Y556-F603 HydrophobicContact CD2-CD2 3.73Å; Y556-F603 HydrophobicContact CD2-CE2 4.07Å; Y556-F603 HydrophobicContact CD2-CG 4.11Å; Y556-F603 HydrophobicContact CE2-CD2 4.45Å; Y556-F603 HydrophobicContact CG-CD2 4.31Å; Y556-F603 HydrophobicContact CG-CG 4.25Å; Y556-A639 HydrophobicContact CD1-CB 3.37Å; Y556-A639 HydrophobicContact CE1-CB 3.26Å; Y556-L809 HydrophobicContact CD1-CD2 3.84Å; Y556-L809 HydrophobicContact CD2-CD2 4.37Å; Y556-L809 HydrophobicContact CE1-CD1 4.49Å; Y556-L809 HydrophobicContact CE1-CD2 3.28Å; Y556-L809 HydrophobicContact CE1-CG 3.83Å; Y556-L809 HydrophobicContact CE2-CD2 3.9Å; Y556-L809 HydrophobicContact CE2-CG 4.14Å; Y556-L809 HydrophobicContact CG-CD2 4.38Å; Y556-L809 VanDerWaalsContact CZ-CG 3.5Å; Y556-L809 WeakPolarHBondContact OH-CG 3.41Å
557	E	47	Very low	48	Very low	152 Å²	152	101.7 Å²	101.7	71%	0.71	46%	0.456	S	S	*	.			trans	-129	143.1	173.1	-76	-178.5	-175.4	0	0	109.6
558	I	47.3	Very low	47.3	Very low	26 Å²	26	99.2 Å²	99.2	13%	0.133	46%	0.457	C	S	.	.			trans	-67.6	143.1	179.1	-51.2	168.3	0	0	0	110.4	W560 A639 S642 I646	I558-W560 HydrophobicContact CG2-CB 4.29Å; I558-A639 HydrophobicContact CD1-CB 4.34Å; I558-A639 WeakPolarHBondContact CD1-O 3.39Å; I558-A639 HydrophobicContact CG1-CB 3.75Å; I558-A639 WeakPolarHBondContact CG1-O 2.99Å; I558-S642 VanDerWaalsContact CD1-OG 3.29Å; I558-S642 WeakPolarHBondContact CD1-OG 3.37Å; I558-I646 HydrophobicContact CG2-CD1 4.27Å
559	R	53.1	Low	45.7	Very low	41 Å²	41	99.5 Å²	99.5	16%	0.155	47%	0.469	C	S	.	.			trans	-90.4	-20.6	-178.6	-65.4	-173.1	173.7	-160.9	-3.5	114.9	R787 D788 R826	R559-R787 HydrophobicContact CB-CB 4.4Å; R559-R787 WeakPolarHBondContact O-CD 3.23Å; R559-R787 WeakPolarHBondContact O-CG 3.39Å; R559-R787 PolarHBondContact O-NE 3.35Å; R559-D788 IonicContact CZ-OD2 3.2Å; R559-D788 IonicContact NH1-OD1 3.61Å; R559-D788 PolarHBondContact NH1-OD1 2.79Å; R559-D788 IonicContact NH1-OD2 2.67Å; R559-D788 PolarHBondContact NH1-OD2 2.67Å; R559-R826 PolarHBondContact NH2-O 3.44Å
560	W	42.5	Very low	44.8	Very low	12 Å²	12	99.4 Å²	99.4	5%	0.045	48%	0.475	C	S	.	.			trans	-79	127.6	-178.5	-66.5	42.1	0	0	0	109.3	I558 I646 L650 L779 H786 D806	I558-W560 HydrophobicContact CG2-CB 4.29Å; W560-I646 HydrophobicContact CB-CD1 3.87Å; W560-I646 HydrophobicContact CB-CG2 4.3Å; W560-I646 HydrophobicContact CD2-CG2 4.46Å; W560-I646 HydrophobicContact CE3-CG2 3.73Å; W560-L650 HydrophobicContact CE3-CD1 3.75Å; W560-L650 HydrophobicContact CZ3-CD1 3.36Å; W560-L779 HydrophobicContact CH2-CD1 4.11Å; W560-L779 HydrophobicContact CH2-CD2 4.23Å; W560-L779 HydrophobicContact CZ3-CD1 4.28Å; W560-L779 HydrophobicContact CZ3-CD2 3.78Å; W560-H786 AromaticContact CZ2-CD2 3.71Å; W560-H786 AromaticContact CZ2-NE2 3.76Å; W560-H786 AromaticContact NE1-CE1 3.94Å; W560-H786 AromaticContact NE1-ND1 3.96Å; W560-D806 HydrophobicContact CZ2-CB 4.22Å; W560-D806 VanDerWaalsContact NE1-CB 3.32Å; W560-D806 PolarHBondContact NE1-OD2 3.02Å
561	K	53.3	Low	44.3	Very low	71 Å²	71	94.9 Å²	94.9	31%	0.309	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	135.3	172.4	-57.4	-156.9	-172.5	-174.7	0	110	F573 I785 R787	K561-F573 HydrophobicContact CB-CB 4.25Å; K561-F573 HydrophobicContact CB-CD1 3.48Å; K561-F573 VanDerWaalsContact CB-CD1 3.48Å; K561-F573 HydrophobicContact CB-CE1 4.12Å; K561-F573 HydrophobicContact CB-CG 4.04Å; K561-F573 HydrophobicContact CD-CB 4.06Å; K561-F573 HydrophobicContact CD-CD1 4.04Å; K561-F573 HydrophobicContact CD-CD2 4.23Å; K561-F573 HydrophobicContact CD-CG 3.83Å; K561-F573 HydrophobicContact CG-CD1 4.37Å; K561-I785 PolarHBondContact N-O 2.88Å; K561-I785 PolarHBondContact O-N 2.88Å; K561-R787 VanDerWaalsContact CE-NH1 3.3Å
562	I	49.8	Very low	43.8	Very low	9 Å²	9	89.2 Å²	89.2	5%	0.046	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.1	177.4	-58.3	171.7	0	0	0	107.9	F573 I574 L579 I646	I562-F573 CarbonylContact O-C 3.49Å; I562-F573 WeakPolarHBondContact O-CA 3.49Å; I562-I574 HydrophobicContact CB-CB 4.42Å; I562-I574 HydrophobicContact CB-CD1 4.34Å; I562-I574 HydrophobicContact CG2-CD1 3.84Å; I562-I574 HydrophobicContact CG2-CG1 4.44Å; I562-I574 PolarHBondContact O-N 2.78Å; I562-L579 HydrophobicContact CD1-CD1 4.04Å; I562-I646 HydrophobicContact CD1-CG1 4.4Å
563	I	48.2	Very low	44	Very low	25 Å²	25	88 Å²	88	13%	0.128	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.4	178.5	-58.8	161.7	0	0	0	109.9	Y571 F573 N783 I785	I563-Y571 HydrophobicContact CD1-CD1 3.8Å; I563-Y571 HydrophobicContact CD1-CE1 4.18Å; I563-Y571 HydrophobicContact CG1-CD1 4.26Å; I563-Y571 HydrophobicContact CG2-CD1 4.18Å; I563-F573 HydrophobicContact CG1-CD1 4.26Å; I563-F573 HydrophobicContact CG1-CE1 4.11Å; I563-N783 HydrophobicContact CB-CB 4.25Å; I563-N783 PolarHBondContact N-O 2.76Å; I563-N783 VanDerWaalsContact N-O 3.08Å; I563-I785 HydrophobicContact CD1-CD1 3.62Å; I563-I785 HydrophobicContact CD1-CG1 4.19Å; I563-I785 HydrophobicContact CG1-CD1 4.05Å
564	E	40.5	Very low	44.5	Very low	141 Å²	141	82.8 Å²	82.8	66%	0.659	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	-41.3	-179.8	-163.6	176.3	-165.7	0	0	113.1	T572 I574	E564-T572 PolarHBondContact N-O 3.34Å; E564-I574 HydrophobicContact CB-CD1 4.31Å; E564-I574 HydrophobicContact CB-CG1 3.69Å; E564-I574 HydrophobicContact CG-CD1 4.37Å; E564-I574 HydrophobicContact CG-CG1 4.05Å
565	A	34.6	Very low	45.1	Very low	51 Å²	51	84.4 Å²	84.4	42%	0.421	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.1	-179.4	0	0	0	0	0	112.5	T572	A565-T572 PolarHBondContact N-OG1 2.82Å
566	R	36.7	Very low	45.5	Very low	203 Å²	203	75.8 Å²	75.8	77%	0.766	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	84.2	-178.9	-169.7	-175.3	-164.7	-175.7	4.9	109.9
567	D	30.4	Very low	46.2	Very low	142 Å²	142	77 Å²	77	76%	0.759	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	92.6	168.5	-91.6	-14.7	0	0	0	109.9	N569 N570	D567-N569 PolarHBondContact O-N 3.38Å; D567-N570 PolarHBondContact O-N 2.91Å
568	G	50.9	Low	46.9	Very low	60 Å²	60	77 Å²	77	62%	0.619	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	-126	176.9	0	0	0	0	0	114
569	N	34.7	Very low	47.9	Very low	161 Å²	161	76.6 Å²	76.6	86%	0.861	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	1	-178.1	-72.4	-20.1	0	0	0	114.1	D567	D567-N569 PolarHBondContact O-N 3.38Å
570	N	34.8	Very low	48.8	Very low	134 Å²	134	80 Å²	80	72%	0.717	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.6	177.8	-95.8	-9.3	0	0	0	110.5	D567	D567-N570 PolarHBondContact O-N 2.91Å
571	Y	43.1	Very low	50.5	Low	73 Å²	73	81.6 Å²	81.6	29%	0.286	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.6	172.5	-63.2	-90.3	0	0	0	109.1	I563 T843	I563-Y571 HydrophobicContact CD1-CD1 3.8Å; I563-Y571 HydrophobicContact CD1-CE1 4.18Å; I563-Y571 HydrophobicContact CG1-CD1 4.26Å; I563-Y571 HydrophobicContact CG2-CD1 4.18Å; Y571-T843 HydrophobicContact CD2-CG2 4.48Å; Y571-T843 HydrophobicContact CE1-CG2 4.3Å; Y571-T843 HydrophobicContact CE2-CG2 3.67Å; Y571-T843 WeakPolarHBondContact OH-CG2 3.36Å
572	T	42.8	Very low	51.8	Low	69 Å²	69	81.5 Å²	81.5	42%	0.423	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.7	166.1	52.6	0	0	0	0	108.7	E564 A565	E564-T572 PolarHBondContact N-O 3.34Å; A565-T572 PolarHBondContact N-OG1 2.82Å
573	F	52.4	Low	53.4	Low	71 Å²	71	87.5 Å²	87.5	31%	0.311	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.2	177.5	-60	-74.4	0	0	0	109.3	K561 I562 I563 D575 I785 R787	K561-F573 HydrophobicContact CB-CB 4.25Å; K561-F573 HydrophobicContact CB-CD1 3.48Å; K561-F573 VanDerWaalsContact CB-CD1 3.48Å; K561-F573 HydrophobicContact CB-CE1 4.12Å; K561-F573 HydrophobicContact CB-CG 4.04Å; K561-F573 HydrophobicContact CD-CB 4.06Å; K561-F573 HydrophobicContact CD-CD1 4.04Å; K561-F573 HydrophobicContact CD-CD2 4.23Å; K561-F573 HydrophobicContact CD-CG 3.83Å; K561-F573 HydrophobicContact CG-CD1 4.37Å; I562-F573 CarbonylContact O-C 3.49Å; I562-F573 WeakPolarHBondContact O-CA 3.49Å; I563-F573 HydrophobicContact CG1-CD1 4.26Å; I563-F573 HydrophobicContact CG1-CE1 4.11Å; F573-D575 PolarHBondContact O-N 2.95Å; F573-I785 HydrophobicContact CE1-CD1 4.08Å; F573-R787 VanDerWaalsContact CZ-NH2 3.26Å
574	I	54	Low	55.1	Low	37 Å²	37	93.2 Å²	93.2	19%	0.19	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	123.9	169	-57.9	-179.7	0	0	0	107.2	I562 E564 P576 L579	I562-I574 HydrophobicContact CB-CB 4.42Å; I562-I574 HydrophobicContact CB-CD1 4.34Å; I562-I574 HydrophobicContact CG2-CD1 3.84Å; I562-I574 HydrophobicContact CG2-CG1 4.44Å; I562-I574 PolarHBondContact O-N 2.78Å; E564-I574 HydrophobicContact CB-CD1 4.31Å; E564-I574 HydrophobicContact CB-CG1 3.69Å; E564-I574 HydrophobicContact CG-CD1 4.37Å; E564-I574 HydrophobicContact CG-CG1 4.05Å; I574-P576 WeakPolarHBondContact O-CD 3.37Å; I574-L579 HydrophobicContact CG2-CD2 4.03Å; I574-L579 HydrophobicContact CG2-CG 4.12Å
575	D	56.8	Low	57.4	Low	71 Å²	71	89.1 Å²	89.1	38%	0.38	46%	0.462	S	S	.	.			trans	-66.1	114.2	169.6	-175.4	-8.5	0	0	0	108.4	F573 T577 Q578	F573-D575 PolarHBondContact O-N 2.95Å; D575-T577 PolarHBondContact O-N 3.2Å; D575-T577 WeakPolarHBondContact OD1-CB 3.5Å; D575-T577 WeakPolarHBondContact OD1-CG2 3.39Å; D575-T577 PolarHBondContact OD1-N 2.89Å; D575-T577 VanDerWaalsContact OD1-N 3.09Å; D575-T577 PolarHBondContact OD1-OG1 2.83Å; D575-T577 PolarHBondContact OD2-OG1 3.01Å; D575-Q578 HydrophobicContact CB-CG 3.99Å; D575-Q578 WeakPolarHBondContact O-CB 3.34Å; D575-Q578 PolarHBondContact O-N 3.34Å
576	P	58.2	Low	60.1	Low	22 Å²	22	89.2 Å²	89.2	14%	0.143	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-59.2	-21	-177.5	-26.9	39	0	0	0	113.6	I574 Q578 L579 K645 I646	I574-P576 WeakPolarHBondContact O-CD 3.37Å; P576-Q578 PolarHBondContact O-N 3.47Å; P576-L579 PolarHBondContact O-N 3.15Å; P576-K645 WeakPolarHBondContact O-CD 3.39Å; P576-I646 HydrophobicContact CB-CD1 4.12Å; P576-I646 HydrophobicContact CB-CG1 4.39Å; P576-I646 HydrophobicContact CG-CD1 4.06Å
577	T	59.4	Low	62.7	Low	47 Å²	47	80.3 Å²	80.3	29%	0.288	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-63.8	-29.1	174.3	67	0	0	0	0	111.8	D575 E638 K645	D575-T577 PolarHBondContact O-N 3.2Å; D575-T577 WeakPolarHBondContact OD1-CB 3.5Å; D575-T577 WeakPolarHBondContact OD1-CG2 3.39Å; D575-T577 PolarHBondContact OD1-N 2.89Å; D575-T577 VanDerWaalsContact OD1-N 3.09Å; D575-T577 PolarHBondContact OD1-OG1 2.83Å; D575-T577 PolarHBondContact OD2-OG1 3.01Å; T577-E638 HydrophobicContact CG2-CG 4Å; T577-E638 WeakPolarHBondContact CG2-OE1 3.49Å; T577-K645 PolarHBondContact O-NZ 3.12Å
578	Q	61.3	Low	65.5	Low	151 Å²	151	76.3 Å²	76.3	71%	0.706	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-85.4	-11.3	-178	-57.7	-177.7	12.1	0	0	113.6	D575 P576	D575-Q578 HydrophobicContact CB-CG 3.99Å; D575-Q578 WeakPolarHBondContact O-CB 3.34Å; D575-Q578 PolarHBondContact O-N 3.34Å; P576-Q578 PolarHBondContact O-N 3.47Å
579	L	68.4	Low	67.3	Low	18 Å²	18	77 Å²	77	9%	0.094	39%	0.386	C	S	.	.	S	Bend	trans	-69	134.2	174.2	-69.9	170.4	0	0	0	110.6	I562 I574 P576 K645 I646	I562-L579 HydrophobicContact CD1-CD1 4.04Å; I574-L579 HydrophobicContact CG2-CD2 4.03Å; I574-L579 HydrophobicContact CG2-CG 4.12Å; P576-L579 PolarHBondContact O-N 3.15Å; L579-K645 HydrophobicContact CB-CB 4.04Å; L579-K645 HydrophobicContact CB-CD 4.19Å; L579-K645 HydrophobicContact CD1-CB 4.4Å; L579-K645 WeakPolarHBondContact O-CD 3.47Å; L579-K645 WeakPolarHBondContact O-CE 3.45Å; L579-K645 PolarHBondContact O-NZ 3.26Å; L579-I646 HydrophobicContact CD1-CG1 4.34Å
580	P	72.7	Confident	69.9	Low	112 Å²	112	75.8 Å²	75.8	73%	0.727	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-72	137.5	175.8	28.3	-32.8	0	0	0	110.9
581	Y	78.3	Confident	72.5	Confident	45 Å²	45	74 Å²	74	18%	0.176	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-76.8	135	168.1	174.9	-116.5	0	0	0	109.4	W585 E586 L644 T664	Y581-W585 HydrophobicContact CE2-CB 4.29Å; Y581-E586 WeakPolarHBondContact CE1-OE2 3.27Å; Y581-E586 PolarHBondContact OH-N 3.41Å; Y581-E586 PolarHBondContact OH-OE2 2.92Å; Y581-L644 HydrophobicContact CD2-CD2 3.95Å; Y581-L644 HydrophobicContact CD2-CG 4.17Å; Y581-L644 HydrophobicContact CE2-CD1 4.26Å; Y581-L644 HydrophobicContact CE2-CD2 3.57Å; Y581-L644 HydrophobicContact CE2-CG 3.94Å; Y581-T664 HydrophobicContact CE1-CG2 3.98Å; Y581-T664 HydrophobicContact CE2-CG2 4.28Å
582	N	79.9	Confident	74.8	Confident	69 Å²	69	71.3 Å²	71.3	37%	0.369	36%	0.357	S	S	.	.			trans	-97.6	113.2	178.5	-169.7	-28	0	0	0	109.9	K584 W585	N582-K584 HydrophobicContact CB-CG 4.32Å; N582-K584 WeakPolarHBondContact ND2-CD 3.36Å; N582-K584 VanDerWaalsContact ND2-CE 3.33Å; N582-K584 WeakPolarHBondContact ND2-CE 3.33Å; N582-K584 PolarHBondContact O-N 3.34Å; N582-K584 WeakPolarHBondContact OD1-CB 3.42Å; N582-K584 WeakPolarHBondContact OD1-CD 3.45Å; N582-K584 WeakPolarHBondContact OD1-CG 3.25Å; N582-K584 PolarHBondContact OD1-N 3.02Å; N582-K584 VanDerWaalsContact OD1-N 3.12Å; N582-W585 PolarHBondContact O-N 3.43Å; N582-W585 VanDerWaalsContact O-N 3.12Å
583	E	83.1	Confident	77.1	Confident	135 Å²	135	74.5 Å²	74.5	63%	0.631	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-59.8	-16.2	-177.6	-65.4	-172.8	173.4	0	0	113.8	W585 E586 Y665	E583-W585 PolarHBondContact O-N 3.48Å; E583-W585 VanDerWaalsContact O-N 3.11Å; E583-E586 VanDerWaalsContact O-CB 3.22Å; E583-E586 WeakPolarHBondContact O-CB 3.44Å; E583-E586 PolarHBondContact O-N 3.03Å; E583-Y665 PolarHBondContact OE1-OH 3.23Å
584	K	84.3	Confident	78.8	Confident	145 Å²	145	75.2 Å²	75.2	63%	0.63	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-58.9	-22.8	173.4	80.2	-174.6	176.8	175.5	0	113.8	N582 E586	N582-K584 HydrophobicContact CB-CG 4.32Å; N582-K584 WeakPolarHBondContact ND2-CD 3.36Å; N582-K584 VanDerWaalsContact ND2-CE 3.33Å; N582-K584 WeakPolarHBondContact ND2-CE 3.33Å; N582-K584 PolarHBondContact O-N 3.34Å; N582-K584 WeakPolarHBondContact OD1-CB 3.42Å; N582-K584 WeakPolarHBondContact OD1-CD 3.45Å; N582-K584 WeakPolarHBondContact OD1-CG 3.25Å; N582-K584 PolarHBondContact OD1-N 3.02Å; N582-K584 VanDerWaalsContact OD1-N 3.12Å; K584-E586 VanDerWaalsContact C-N 3.32Å
585	W	88.4	Confident	80.4	Confident	56 Å²	56	75.8 Å²	75.8	21%	0.212	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-86.1	-6.7	178.1	-64.7	113.4	0	0	0	112.6	Y581 N582 E583 F587 S648 L659 G661 A662	Y581-W585 HydrophobicContact CE2-CB 4.29Å; N582-W585 PolarHBondContact O-N 3.43Å; N582-W585 VanDerWaalsContact O-N 3.12Å; E583-W585 PolarHBondContact O-N 3.48Å; E583-W585 VanDerWaalsContact O-N 3.11Å; W585-F587 PolarHBondContact O-N 3.47Å; W585-S648 VanDerWaalsContact CD1-OG 3.27Å; W585-S648 PolarHBondContact NE1-OG 3.4Å; W585-L659 HydrophobicContact CD2-CD2 3.73Å; W585-L659 HydrophobicContact CD2-CG 4.33Å; W585-L659 HydrophobicContact CE3-CD2 4.01Å; W585-L659 HydrophobicContact CE3-CG 4.09Å; W585-L659 HydrophobicContact CG-CD2 3.99Å; W585-L659 HydrophobicContact CZ2-CD2 4.39Å; W585-L659 HydrophobicContact CZ3-CD2 4.44Å; W585-L659 HydrophobicContact CZ3-CG 4.3Å; W585-L659 WeakPolarHBondContact CZ3-O 3.48Å; W585-G661 CarbonylContact O-C 3.47Å; W585-G661 VanDerWaalsContact O-CA 3.23Å; W585-G661 WeakPolarHBondContact O-CA 3.38Å; W585-A662 PolarHBondContact O-N 3.09Å
586	E	91.6	Very high	81.6	Confident	52 Å²	52	76.1 Å²	76.1	24%	0.243	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-68.7	124.7	-179	-164	67.4	-159.9	0	0	110.6	Y581 E583 K584 A662 C663 T664 Y665	Y581-E586 WeakPolarHBondContact CE1-OE2 3.27Å; Y581-E586 PolarHBondContact OH-N 3.41Å; Y581-E586 PolarHBondContact OH-OE2 2.92Å; E583-E586 VanDerWaalsContact O-CB 3.22Å; E583-E586 WeakPolarHBondContact O-CB 3.44Å; E583-E586 PolarHBondContact O-N 3.03Å; K584-E586 VanDerWaalsContact C-N 3.32Å; E586-A662 CarbonylContact C-O 3.58Å; E586-A662 WeakPolarHBondContact CA-O 3.28Å; E586-C663 WeakPolarHBondContact OE1-CA 3.25Å; E586-T664 PolarHBondContact OE1-N 3.23Å; E586-T664 PolarHBondContact OE1-OG1 3.41Å; E586-T664 PolarHBondContact OE2-N 2.88Å; E586-T664 PolarHBondContact OE2-OG1 3.03Å; E586-Y665 HydrophobicContact CG-CD2 3.7Å; E586-Y665 HydrophobicContact CG-CE2 3.83Å; E586-Y665 VanDerWaalsContact OE1-CD2 3.27Å; E586-Y665 WeakPolarHBondContact OE1-CD2 3.49Å; E586-Y665 PolarHBondContact OE1-N 2.68Å
587	F	90.9	Very high	82.8	Confident	17 Å²	17	78.7 Å²	78.7	8%	0.075	40%	0.396	C	S	.	.			trans	-113.9	134.3	-177.8	-174.3	-104.8	0	0	0	110.8	W585 R589 K591 L592 A611 Y612 L614 A662 C663 I672	W585-F587 PolarHBondContact O-N 3.47Å; F587-R589 PolarHBondContact O-N 2.95Å; F587-R589 VanDerWaalsContact O-N 3.17Å; F587-K591 HydrophobicContact CE1-CB 3.87Å; F587-K591 WeakPolarHBondContact CE1-O 3.46Å; F587-K591 HydrophobicContact CZ-CB 3.67Å; F587-L592 HydrophobicContact CD1-CB 4.16Å; F587-L592 HydrophobicContact CE1-CB 3.87Å; F587-L592 HydrophobicContact CE1-CD1 4.29Å; F587-A611 HydrophobicContact CE1-CB 4.18Å; F587-A611 HydrophobicContact CZ-CB 4.02Å; F587-Y612 WeakPolarHBondContact CZ-O 3.48Å; F587-L614 HydrophobicContact CD2-CD1 3.47Å; F587-L614 VanDerWaalsContact CD2-CD1 3.47Å; F587-L614 HydrophobicContact CE2-CB 4.09Å; F587-L614 HydrophobicContact CE2-CD1 3.59Å; F587-L614 HydrophobicContact CE2-CG 4.45Å; F587-L614 HydrophobicContact CG-CD1 4.24Å; F587-L614 HydrophobicContact CZ-CD1 4.42Å; F587-A662 PolarHBondContact N-O 3.35Å; F587-C663 PolarHBondContact O-SG 2.77Å; F587-I672 HydrophobicContact CB-CD1 3.82Å; F587-I672 HydrophobicContact CD1-CD1 3.68Å; F587-I672 HydrophobicContact CG-CD1 3.94Å
588	P	88.8	Confident	83.8	Confident	58 Å²	58	77.1 Å²	77.1	38%	0.377	39%	0.386	S	S	.	.			trans	-59.1	119.1	178.2	-22.8	33.1	0	0	0	111.8	D590 K591	P588-D590 WeakPolarHBondContact CB-OD1 3.36Å; P588-D590 PolarHBondContact O-N 2.86Å; P588-K591 HydrophobicContact CB-CB 4.35Å; P588-K591 HydrophobicContact CB-CD 4.3Å; P588-K591 HydrophobicContact CB-CG 4.16Å; P588-K591 HydrophobicContact CG-CD 4.36Å; P588-K591 PolarHBondContact O-N 2.85Å
589	R	90.2	Very high	84.4	Confident	73 Å²	73	70 Å²	70	28%	0.275	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-61.1	-33.2	-175.5	-174.7	-176.6	-63.3	-83.7	-1.3	112.6	F587 K591 L592 Y665 P668 L670	F587-R589 PolarHBondContact O-N 2.95Å; F587-R589 VanDerWaalsContact O-N 3.17Å; R589-K591 PolarHBondContact O-N 3.45Å; R589-L592 PolarHBondContact O-N 3Å; R589-L592 VanDerWaalsContact O-N 3.17Å; R589-Y665 PolarHBondContact NH2-O 3.16Å; R589-P668 PolarHBondContact NH1-O 2.87Å; R589-P668 PolarHBondContact NH2-O 3.17Å; R589-L670 VanDerWaalsContact NH1-CD1 3.32Å
590	D	88.2	Confident	84.5	Confident	137 Å²	137	69.5 Å²	69.5	73%	0.733	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24.3	176.8	59.2	-57.9	0	0	0	113	P588 L592	P588-D590 WeakPolarHBondContact CB-OD1 3.36Å; P588-D590 PolarHBondContact O-N 2.86Å; D590-L592 VanDerWaalsContact C-N 3.34Å
591	K	89.2	Confident	84.1	Confident	97 Å²	97	64.2 Å²	64.2	42%	0.422	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-90.9	6.9	175.4	-63	-170.1	179.1	-174.2	0	113.6	F587 P588 R589 Y612	F587-K591 HydrophobicContact CE1-CB 3.87Å; F587-K591 WeakPolarHBondContact CE1-O 3.46Å; F587-K591 HydrophobicContact CZ-CB 3.67Å; P588-K591 HydrophobicContact CB-CB 4.35Å; P588-K591 HydrophobicContact CB-CD 4.3Å; P588-K591 HydrophobicContact CB-CG 4.16Å; P588-K591 HydrophobicContact CG-CD 4.36Å; P588-K591 PolarHBondContact O-N 2.85Å; R589-K591 PolarHBondContact O-N 3.45Å; K591-Y612 WeakPolarHBondContact CB-O 3.3Å; K591-Y612 WeakPolarHBondContact CD-O 3.3Å; K591-Y612 WeakPolarHBondContact O-CD2 3.41Å; K591-Y612 PolarHBondContact O-N 3.5Å
592	L	91.4	Very high	83.1	Confident	16 Å²	16	63.7 Å²	63.7	8%	0.084	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	110.4	178.2	-170.2	67.4	0	0	0	111	F587 R589 D590 L594 A609 A611 V623 V625 L670 I672	F587-L592 HydrophobicContact CD1-CB 4.16Å; F587-L592 HydrophobicContact CE1-CB 3.87Å; F587-L592 HydrophobicContact CE1-CD1 4.29Å; R589-L592 PolarHBondContact O-N 3Å; R589-L592 VanDerWaalsContact O-N 3.17Å; D590-L592 VanDerWaalsContact C-N 3.34Å; L592-L594 HydrophobicContact CD2-CD2 4.13Å; L592-L594 HydrophobicContact CG-CD2 4.26Å; L592-A609 HydrophobicContact CD1-CB 4.06Å; L592-A609 HydrophobicContact CG-CB 4.49Å; L592-A611 HydrophobicContact CD1-CB 3.96Å; L592-V623 HydrophobicContact CD1-CG2 4.12Å; L592-V625 HydrophobicContact CD1-CG2 4.18Å; L592-V625 HydrophobicContact CD2-CG1 4.45Å; L592-V625 HydrophobicContact CD2-CG2 4.06Å; L592-V625 HydrophobicContact CG-CG2 4.5Å; L592-L670 HydrophobicContact CD2-CD1 3.77Å; L592-I672 HydrophobicContact CD1-CD1 4.09Å; L592-I672 HydrophobicContact CD2-CD1 3.9Å; L592-I672 HydrophobicContact CD2-CG1 4.13Å
593	K	90.9	Very high	82.3	Confident	135 Å²	135	61.5 Å²	61.5	59%	0.587	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	108.7	177.4	-171.3	176.9	-179.5	-179.2	0	110.8	A609 T610 Y612	K593-A609 CarbonylContact O-C 3.56Å; K593-A609 WeakPolarHBondContact O-CA 3.41Å; K593-A609 VanDerWaalsContact O-CB 3.31Å; K593-A609 WeakPolarHBondContact O-CB 3.48Å; K593-T610 PolarHBondContact N-O 3.19Å; K593-T610 PolarHBondContact O-N 2.84Å; K593-Y612 HydrophobicContact CB-CE2 4.06Å
594	L	88.5	Confident	81.8	Confident	86 Å²	86	55 Å²	55	45%	0.45	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	138.6	177.4	-54.8	177.7	0	0	0	111.1	L592 V607 A609 V625 M627	L592-L594 HydrophobicContact CD2-CD2 4.13Å; L592-L594 HydrophobicContact CG-CD2 4.26Å; L594-V607 HydrophobicContact CB-CG2 4.39Å; L594-V607 HydrophobicContact CD2-CG2 3.89Å; L594-A609 HydrophobicContact CD2-CB 3.96Å; L594-V625 HydrophobicContact CD2-CB 4.11Å; L594-V625 HydrophobicContact CD2-CG1 4.07Å; L594-V625 HydrophobicContact CD2-CG2 4.08Å; L594-M627 HydrophobicContact CD1-CE 3.56Å; L594-M627 HydrophobicContact CD1-SD 4.5Å; L594-M627 HydrophobicContact CD2-CE 3.82Å; L594-M627 HydrophobicContact CG-CE 4.31Å
595	G	87.1	Confident	81.8	Confident	50 Å²	50	51.5 Å²	51.5	52%	0.515	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-141	179.7	0	0	0	0	0	112.4	E608	G595-E608 CarbonylContact C-O 3.19Å; G595-E608 VanDerWaalsContact CA-O 3.24Å; G595-E608 WeakPolarHBondContact CA-O 3.3Å; G595-E608 PolarHBondContact N-O 2.97Å
596	K	83.4	Confident	81.7	Confident	78 Å²	78	49 Å²	49	34%	0.339	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	156.7	-175.2	63.5	170.1	-177.8	155.6	0	112.9	L598 V607 E608 T739	K596-L598 PolarHBondContact O-N 3.31Å; K596-V607 CarbonylContact O-C 3.59Å; K596-V607 VanDerWaalsContact O-CA 3.27Å; K596-V607 WeakPolarHBondContact O-CA 3.48Å; K596-V607 WeakPolarHBondContact O-CB 3.35Å; K596-E608 WeakPolarHBondContact CE-OE2 3.49Å; K596-E608 HydrophobicContact CG-CB 4.1Å; K596-E608 WeakPolarHBondContact CG-OE2 3.42Å; K596-E608 PolarHBondContact O-N 3.06Å; K596-T739 HydrophobicContact CD-CG2 4.42Å; K596-T739 WeakPolarHBondContact CE-OG1 3.43Å; K596-T739 PolarHBondContact NZ-OG1 3.08Å
597	I	83.3	Confident	81.5	Confident	76 Å²	76	46.7 Å²	46.7	39%	0.39	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.6	172.7	-58.2	174.9	0	0	0	108.7	A600 K605 V607 L734	I597-A600 HydrophobicContact CG2-CB 4.07Å; I597-K605 HydrophobicContact CD1-CD 4.24Å; I597-K605 HydrophobicContact CG1-CD 4.41Å; I597-V607 HydrophobicContact CG1-CG1 4.06Å; I597-L734 HydrophobicContact CG2-CD1 4.28Å
598	L	80.5	Confident	81.5	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.073	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-42.5	173.9	-65.3	173.4	0	0	0	110.5	K596 V606 E608 A624 Y675 M736 R737	K596-L598 PolarHBondContact O-N 3.31Å; L598-V606 HydrophobicContact CB-CG1 4.37Å; L598-V606 HydrophobicContact CD1-CG1 4.32Å; L598-V606 PolarHBondContact N-O 3.46Å; L598-E608 HydrophobicContact CD1-CB 4.05Å; L598-E608 HydrophobicContact CD2-CB 4.06Å; L598-E608 HydrophobicContact CG-CB 4.01Å; L598-A624 HydrophobicContact CD1-CB 4.3Å; L598-Y675 HydrophobicContact CD1-CD2 3.85Å; L598-Y675 HydrophobicContact CD1-CE2 3.62Å; L598-Y675 HydrophobicContact CD2-CE2 3.88Å; L598-Y675 HydrophobicContact CG-CE2 4.41Å; L598-M736 VanDerWaalsContact O-CA 3.24Å; L598-M736 WeakPolarHBondContact O-CA 3.37Å; L598-R737 PolarHBondContact O-N 2.84Å
599	G	72.9	Confident	81.6	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	151.3	172.5	0	0	0	0	0	111.7	K605 V606 L734	G599-K605 CarbonylContact O-C 3.5Å; G599-K605 WeakPolarHBondContact O-CA 3.45Å; G599-V606 PolarHBondContact N-O 2.88Å; G599-V606 PolarHBondContact O-N 3.37Å; G599-L734 CarbonylContact C-O 3.45Å; G599-L734 WeakPolarHBondContact CA-O 3.47Å
600	A	70.8	Confident	81.6	Confident	7 Å²	7	42.8 Å²	42.8	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	128.7	179.6	0	0	0	0	0	112.2	I597 K605 Y733 L734 A810	I597-A600 HydrophobicContact CG2-CB 4.07Å; A600-K605 HydrophobicContact CB-CB 3.89Å; A600-Y733 WeakPolarHBondContact O-CD2 3.37Å; A600-L734 HydrophobicContact CB-CB 4.07Å; A600-L734 HydrophobicContact CB-CD1 4.43Å; A600-L734 PolarHBondContact N-O 3.13Å; A600-L734 PolarHBondContact O-N 2.91Å; A600-A810 CarbonylContact C-O 3.59Å
601	G	65.5	Low	81.7	Confident	2 Å²	2	36.2 Å²	36.2	2%	0.021	19%	0.192	C	C	.	.			trans	-111.6	-166.3	-176.1	0	0	0	0	0	113.5	F603 G604 K629 A810 R811	G601-F603 VanDerWaalsContact C-N 3.33Å; G601-G604 PolarHBondContact N-O 3.42Å; G601-K629 WeakPolarHBondContact O-CE 3.44Å; G601-K629 PolarHBondContact O-NZ 3.15Å; G601-A810 VanDerWaalsContact CA-O 3.22Å; G601-A810 WeakPolarHBondContact CA-O 3.41Å; G601-A810 VanDerWaalsContact N-C 3.31Å; G601-A810 PolarHBondContact N-O 2.99Å; G601-R811 WeakPolarHBondContact CA-O 3.3Å
602	A	57.2	Low	81.8	Confident	33 Å²	33	36.3 Å²	36.3	27%	0.273	19%	0.19	S	C	.	.	S	Bend	trans	-64.5	-39.7	175.7	0	0	0	0	0	111.7	R811	A602-R811 PolarHBondContact N-O 2.86Å
603	F	61.8	Low	81.4	Confident	23 Å²	23	36.6 Å²	36.6	10%	0.101	20%	0.198	C	C	.	.	S	Bend	trans	-103.1	-28.6	-166.2	-50.1	-68.3	0	0	0	113.8	Y556 G601 L628 K629 E636 L809 I813	Y556-F603 AromaticContact CD2-CD2 3.73Å; Y556-F603 HydrophobicContact CD2-CD2 3.73Å; Y556-F603 HydrophobicContact CD2-CE2 4.07Å; Y556-F603 HydrophobicContact CD2-CG 4.11Å; Y556-F603 HydrophobicContact CE2-CD2 4.45Å; Y556-F603 HydrophobicContact CG-CD2 4.31Å; Y556-F603 HydrophobicContact CG-CG 4.25Å; G601-F603 VanDerWaalsContact C-N 3.33Å; F603-L628 WeakPolarHBondContact O-CD2 2.86Å; F603-K629 PolarHBondContact O-N 3.05Å; F603-E636 HydrophobicContact CD1-CG 4.44Å; F603-E636 VanDerWaalsContact CD1-OE1 3.28Å; F603-E636 WeakPolarHBondContact CD1-OE1 3.49Å; F603-L809 HydrophobicContact CB-CD2 3.91Å; F603-I813 HydrophobicContact CE2-CB 4.45Å; F603-I813 HydrophobicContact CE2-CD1 4.04Å; F603-I813 HydrophobicContact CE2-CG1 4.33Å
604	G	73.9	Confident	80.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	-172.5	-177.6	0	0	0	0	0	113.9	G601 M627 L809	G601-G604 PolarHBondContact N-O 3.42Å; G604-M627 CarbonylContact C-O 3.57Å; G604-M627 VanDerWaalsContact CA-O 3.29Å; G604-M627 WeakPolarHBondContact CA-O 3.48Å; G604-L809 WeakPolarHBondContact CA-O 3.24Å; G604-L809 PolarHBondContact N-O 2.94Å
605	K	83	Confident	80	Confident	71 Å²	71	30.9 Å²	30.9	31%	0.309	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	153.1	174.9	65.6	-179.5	-177.5	179.2	0	110.8	I597 G599 A600 V607 M627	I597-K605 HydrophobicContact CD1-CD 4.24Å; I597-K605 HydrophobicContact CG1-CD 4.41Å; G599-K605 CarbonylContact O-C 3.5Å; G599-K605 WeakPolarHBondContact O-CA 3.45Å; A600-K605 HydrophobicContact CB-CB 3.89Å; K605-V607 HydrophobicContact CD-CG1 4.18Å; K605-V607 HydrophobicContact CG-CG1 4.26Å; K605-M627 HydrophobicContact CD-CG 4.49Å; K605-M627 HydrophobicContact CD-SD 4.44Å; K605-M627 WeakPolarHBondContact CE-SD 3.28Å; K605-M627 HydrophobicContact CG-CG 3.69Å; K605-M627 HydrophobicContact CG-SD 4.24Å; K605-M627 PolarHBondContact N-O 2.88Å; K605-M627 PolarHBondContact O-N 3.42Å
606	V	86.1	Confident	79.3	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.3	173.2	178.2	0	0	0	0	106.7	L598 G599 A624 V625 K626 F807 A810	L598-V606 HydrophobicContact CB-CG1 4.37Å; L598-V606 HydrophobicContact CD1-CG1 4.32Å; L598-V606 PolarHBondContact N-O 3.46Å; G599-V606 PolarHBondContact N-O 2.88Å; G599-V606 PolarHBondContact O-N 3.37Å; V606-A624 HydrophobicContact CG1-CB 4.26Å; V606-V625 CarbonylContact C-O 3.57Å; V606-V625 WeakPolarHBondContact CA-O 3.29Å; V606-K626 HydrophobicContact CG2-CB 4.39Å; V606-K626 HydrophobicContact CG2-CG 4.02Å; V606-F807 HydrophobicContact CB-CE1 4.21Å; V606-F807 HydrophobicContact CG1-CE1 3.98Å; V606-F807 HydrophobicContact CG2-CD1 3.68Å; V606-F807 HydrophobicContact CG2-CE1 3.5Å; V606-A810 HydrophobicContact CG2-CB 3.74Å
607	V	88.1	Confident	78.5	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	149.8	-179.2	-54	0	0	0	0	110	L594 K596 I597 K605 A624 V625 M627	L594-V607 HydrophobicContact CB-CG2 4.39Å; L594-V607 HydrophobicContact CD2-CG2 3.89Å; K596-V607 CarbonylContact O-C 3.59Å; K596-V607 VanDerWaalsContact O-CA 3.27Å; K596-V607 WeakPolarHBondContact O-CA 3.48Å; K596-V607 WeakPolarHBondContact O-CB 3.35Å; I597-V607 HydrophobicContact CG1-CG1 4.06Å; K605-V607 HydrophobicContact CD-CG1 4.18Å; K605-V607 HydrophobicContact CG-CG1 4.26Å; V607-A624 CarbonylContact O-C 3.54Å; V607-A624 WeakPolarHBondContact O-CA 3.36Å; V607-V625 HydrophobicContact CG2-CB 3.92Å; V607-V625 PolarHBondContact N-O 3.18Å; V607-V625 PolarHBondContact O-N 3.06Å; V607-M627 HydrophobicContact CG1-CE 4.49Å; V607-M627 HydrophobicContact CG2-CE 3.58Å
608	E	90.5	Very high	77.8	Confident	26 Å²	26	45.9 Å²	45.9	12%	0.121	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	143.5	164.4	-175.3	174.2	-170.1	0	0	108.3	G595 K596 L598 R622 Y675	G595-E608 CarbonylContact C-O 3.19Å; G595-E608 VanDerWaalsContact CA-O 3.24Å; G595-E608 WeakPolarHBondContact CA-O 3.3Å; G595-E608 PolarHBondContact N-O 2.97Å; K596-E608 WeakPolarHBondContact CE-OE2 3.49Å; K596-E608 HydrophobicContact CG-CB 4.1Å; K596-E608 WeakPolarHBondContact CG-OE2 3.42Å; K596-E608 PolarHBondContact O-N 3.06Å; L598-E608 HydrophobicContact CD1-CB 4.05Å; L598-E608 HydrophobicContact CD2-CB 4.06Å; L598-E608 HydrophobicContact CG-CB 4.01Å; E608-R622 IonicContact OE1-CZ 3.97Å; E608-R622 VanDerWaalsContact OE1-CZ 3.3Å; E608-R622 IonicContact OE1-NE 3.57Å; E608-R622 PolarHBondContact OE1-NE 3.35Å; E608-R622 IonicContact OE1-NH2 2.9Å; E608-R622 PolarHBondContact OE1-NH2 3.14Å; E608-Y675 HydrophobicContact CG-CE2 4.44Å
609	A	90.5	Very high	77.7	Confident	1 Å²	1	48 Å²	48	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	163.3	173.6	0	0	0	0	0	111.4	L592 K593 L594 V623 V625	L592-A609 HydrophobicContact CD1-CB 4.06Å; L592-A609 HydrophobicContact CG-CB 4.49Å; K593-A609 CarbonylContact O-C 3.56Å; K593-A609 WeakPolarHBondContact O-CA 3.41Å; K593-A609 VanDerWaalsContact O-CB 3.31Å; K593-A609 WeakPolarHBondContact O-CB 3.48Å; L594-A609 HydrophobicContact CD2-CB 3.96Å; A609-V623 HydrophobicContact CB-CG2 3.93Å; A609-V623 PolarHBondContact N-O 3.11Å; A609-V623 WeakPolarHBondContact O-CG2 3.27Å; A609-V623 PolarHBondContact O-N 2.96Å; A609-V625 HydrophobicContact CB-CB 4.45Å; A609-V625 HydrophobicContact CB-CG2 3.48Å; A609-V625 VanDerWaalsContact CB-CG2 3.48Å
610	T	91.3	Very high	78.4	Confident	39 Å²	39	52.1 Å²	52.1	24%	0.239	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.7	172.4	-50.5	0	0	0	0	108.4	K593 Y612 V620 M621	K593-T610 PolarHBondContact N-O 3.19Å; K593-T610 PolarHBondContact O-N 2.84Å; T610-Y612 HydrophobicContact CG2-CE1 4.34Å; T610-Y612 HydrophobicContact CG2-CE2 4.09Å; T610-V620 HydrophobicContact CG2-CG1 3.43Å; T610-V620 VanDerWaalsContact CG2-CG1 3.43Å; T610-M621 WeakPolarHBondContact CA-O 3.42Å
611	A	90.7	Very high	79.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.9	176.5	0	0	0	0	0	109.9	F587 L592 L614 M621 V623	F587-A611 HydrophobicContact CE1-CB 4.18Å; F587-A611 HydrophobicContact CZ-CB 4.02Å; L592-A611 HydrophobicContact CD1-CB 3.96Å; A611-L614 HydrophobicContact CB-CB 4.01Å; A611-L614 HydrophobicContact CB-CD2 3.86Å; A611-L614 HydrophobicContact CB-CG 4.49Å; A611-M621 PolarHBondContact N-O 3.45Å; A611-M621 PolarHBondContact O-N 2.83Å; A611-V623 HydrophobicContact CB-CG1 4.23Å; A611-V623 HydrophobicContact CB-CG2 4.11Å
612	Y	89.9	Confident	80.2	Confident	98 Å²	98	59.8 Å²	59.8	38%	0.384	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.2	179.7	-61.5	-88.7	0	0	0	110.4	F587 K591 K593 T610 V620	F587-Y612 WeakPolarHBondContact CZ-O 3.48Å; K591-Y612 WeakPolarHBondContact CB-O 3.3Å; K591-Y612 WeakPolarHBondContact CD-O 3.3Å; K591-Y612 WeakPolarHBondContact O-CD2 3.41Å; K591-Y612 PolarHBondContact O-N 3.5Å; K593-Y612 HydrophobicContact CB-CE2 4.06Å; T610-Y612 HydrophobicContact CG2-CE1 4.34Å; T610-Y612 HydrophobicContact CG2-CE2 4.09Å; Y612-V620 HydrophobicContact CD1-CG1 4.2Å; Y612-V620 HydrophobicContact CD1-CG2 3.83Å; Y612-V620 HydrophobicContact CE1-CG1 3.96Å; Y612-V620 HydrophobicContact CE1-CG2 4.09Å
613	G	82.4	Confident	81.9	Confident	23 Å²	23	58.2 Å²	58.2	24%	0.237	31%	0.306	C	S	.	.	S	Bend	trans	76.5	20.5	-179.5	0	0	0	0	0	114.3	G615 K616 N619	G613-G615 PolarHBondContact O-N 2.88Å; G613-K616 CarbonylContact C-O 3.5Å; G613-K616 VanDerWaalsContact CA-O 3.31Å; G613-K616 WeakPolarHBondContact CA-O 3.32Å; G613-N619 PolarHBondContact N-O 3.15Å
614	L	80.4	Confident	83.3	Confident	17 Å²	17	57.4 Å²	57.4	9%	0.089	30%	0.304	C	S	.	.	S	Bend	trans	-79.8	113.1	176.8	-165.8	68.9	0	0	0	109.6	F587 A611 K616 N619 M621 V623 L660	F587-L614 HydrophobicContact CD2-CD1 3.47Å; F587-L614 VanDerWaalsContact CD2-CD1 3.47Å; F587-L614 HydrophobicContact CE2-CB 4.09Å; F587-L614 HydrophobicContact CE2-CD1 3.59Å; F587-L614 HydrophobicContact CE2-CG 4.45Å; F587-L614 HydrophobicContact CG-CD1 4.24Å; F587-L614 HydrophobicContact CZ-CD1 4.42Å; A611-L614 HydrophobicContact CB-CB 4.01Å; A611-L614 HydrophobicContact CB-CD2 3.86Å; A611-L614 HydrophobicContact CB-CG 4.49Å; L614-K616 PolarHBondContact O-N 3.18Å; L614-N619 PolarHBondContact O-ND2 3.23Å; L614-M621 HydrophobicContact CD2-SD 4.19Å; L614-V623 HydrophobicContact CD2-CG1 3.96Å; L614-L660 HydrophobicContact CD2-CB 3.87Å; L614-L660 HydrophobicContact CD2-CD1 4.19Å
615	G	70.8	Confident	84.2	Confident	83 Å²	83	57.4 Å²	57.4	86%	0.856	30%	0.304	S	S	*	.	S	Bend	trans	89.1	-50.5	-178.1	0	0	0	0	0	115	G613	G613-G615 PolarHBondContact O-N 2.88Å
616	K	72.7	Confident	84.5	Confident	169 Å²	169	54.4 Å²	54.4	74%	0.735	29%	0.29	S	S	*	.	S	Bend	trans	-131.7	149.1	173.6	-64.6	-177.8	-179.2	179.6	0	109.7	G613 L614 D618 N619	G613-K616 CarbonylContact C-O 3.5Å; G613-K616 VanDerWaalsContact CA-O 3.31Å; G613-K616 WeakPolarHBondContact CA-O 3.32Å; L614-K616 PolarHBondContact O-N 3.18Å; K616-D618 VanDerWaalsContact C-N 3.28Å; K616-D618 PolarHBondContact O-N 2.92Å; K616-D618 VanDerWaalsContact O-N 3.17Å; K616-N619 HydrophobicContact CB-CB 4.3Å; K616-N619 WeakPolarHBondContact O-CB 3.5Å; K616-N619 PolarHBondContact O-N 3.38Å
617	E	65.5	Low	84.5	Confident	188 Å²	188	55 Å²	55	88%	0.879	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-35.2	-171.1	-72.6	-170.1	146.5	0	0	114.4
618	D	68.9	Low	84.3	Confident	162 Å²	162	56.1 Å²	56.1	87%	0.866	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	6.1	-179.1	-64.9	-35.9	0	0	0	114.8	K616	K616-D618 VanDerWaalsContact C-N 3.28Å; K616-D618 PolarHBondContact O-N 2.92Å; K616-D618 VanDerWaalsContact O-N 3.17Å
619	N	79.4	Confident	83.7	Confident	59 Å²	59	57.7 Å²	57.7	32%	0.316	31%	0.305	S	S	.	.			trans	-81.5	132.2	-172.5	-168	25.2	0	0	0	112.4	G613 L614 K616	G613-N619 PolarHBondContact N-O 3.15Å; L614-N619 PolarHBondContact O-ND2 3.23Å; K616-N619 HydrophobicContact CB-CB 4.3Å; K616-N619 WeakPolarHBondContact O-CB 3.5Å; K616-N619 PolarHBondContact O-N 3.38Å
620	V	86.1	Confident	83	Confident	87 Å²	87	63.3 Å²	63.3	53%	0.527	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	112.9	171.6	-175.8	0	0	0	0	108.2	T610 Y612	T610-V620 HydrophobicContact CG2-CG1 3.43Å; T610-V620 VanDerWaalsContact CG2-CG1 3.43Å; Y612-V620 HydrophobicContact CD1-CG1 4.2Å; Y612-V620 HydrophobicContact CD1-CG2 3.83Å; Y612-V620 HydrophobicContact CE1-CG1 3.96Å; Y612-V620 HydrophobicContact CE1-CG2 4.09Å
621	M	85.9	Confident	82	Confident	66 Å²	66	66.1 Å²	66.1	33%	0.325	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.5	-174.8	-172.2	176.8	-72	0	0	111.6	T610 A611 L614 V623 L660	T610-M621 WeakPolarHBondContact CA-O 3.42Å; A611-M621 PolarHBondContact N-O 3.45Å; A611-M621 PolarHBondContact O-N 2.83Å; L614-M621 HydrophobicContact CD2-SD 4.19Å; M621-V623 HydrophobicContact CB-CG1 4.33Å; M621-V623 HydrophobicContact CG-CG1 3.9Å; M621-V623 HydrophobicContact SD-CG1 4.17Å; M621-L660 HydrophobicContact SD-CD1 3.83Å
622	R	88.9	Confident	80.9	Confident	105 Å²	105	67.6 Å²	67.6	40%	0.396	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	126.7	167.5	-70.8	175.6	68.1	-165.5	3.1	109.4	E608	E608-R622 IonicContact OE1-CZ 3.97Å; E608-R622 VanDerWaalsContact OE1-CZ 3.3Å; E608-R622 IonicContact OE1-NE 3.57Å; E608-R622 PolarHBondContact OE1-NE 3.35Å; E608-R622 IonicContact OE1-NH2 2.9Å; E608-R622 PolarHBondContact OE1-NH2 3.14Å
623	V	93	Very high	80.1	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	160.9	-173.7	-60.2	0	0	0	0	110.7	L592 A609 A611 L614 M621 V625 L660 I672	L592-V623 HydrophobicContact CD1-CG2 4.12Å; A609-V623 HydrophobicContact CB-CG2 3.93Å; A609-V623 PolarHBondContact N-O 3.11Å; A609-V623 WeakPolarHBondContact O-CG2 3.27Å; A609-V623 PolarHBondContact O-N 2.96Å; A611-V623 HydrophobicContact CB-CG1 4.23Å; A611-V623 HydrophobicContact CB-CG2 4.11Å; L614-V623 HydrophobicContact CD2-CG1 3.96Å; M621-V623 HydrophobicContact CB-CG1 4.33Å; M621-V623 HydrophobicContact CG-CG1 3.9Å; M621-V623 HydrophobicContact SD-CG1 4.17Å; V623-V625 HydrophobicContact CG2-CG2 4.2Å; V623-L660 HydrophobicContact CB-CD1 4.46Å; V623-L660 HydrophobicContact CG1-CD1 3.68Å; V623-I672 HydrophobicContact CB-CG2 3.72Å; V623-I672 HydrophobicContact CG1-CG2 4.05Å; V623-I672 HydrophobicContact CG2-CG2 3.61Å
624	A	92.1	Very high	79.5	Confident	6 Å²	6	72.4 Å²	72.4	5%	0.05	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	137.6	168.2	0	0	0	0	0	109.3	L598 V606 V607 T673	L598-A624 HydrophobicContact CD1-CB 4.3Å; V606-A624 HydrophobicContact CG1-CB 4.26Å; V607-A624 CarbonylContact O-C 3.54Å; V607-A624 WeakPolarHBondContact O-CA 3.36Å; A624-T673 PolarHBondContact N-O 3.48Å; A624-T673 PolarHBondContact O-N 3.33Å
625	V	91.7	Very high	78.8	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	119.1	-179.5	-177.6	0	0	0	0	109.7	L592 L594 V606 V607 A609 V623 M627 L670 V671 I672	L592-V625 HydrophobicContact CD1-CG2 4.18Å; L592-V625 HydrophobicContact CD2-CG1 4.45Å; L592-V625 HydrophobicContact CD2-CG2 4.06Å; L592-V625 HydrophobicContact CG-CG2 4.5Å; L594-V625 HydrophobicContact CD2-CB 4.11Å; L594-V625 HydrophobicContact CD2-CG1 4.07Å; L594-V625 HydrophobicContact CD2-CG2 4.08Å; V606-V625 CarbonylContact C-O 3.57Å; V606-V625 WeakPolarHBondContact CA-O 3.29Å; V607-V625 HydrophobicContact CG2-CB 3.92Å; V607-V625 PolarHBondContact N-O 3.18Å; V607-V625 PolarHBondContact O-N 3.06Å; A609-V625 HydrophobicContact CB-CB 4.45Å; A609-V625 HydrophobicContact CB-CG2 3.48Å; A609-V625 VanDerWaalsContact CB-CG2 3.48Å; V623-V625 HydrophobicContact CG2-CG2 4.2Å; V625-M627 HydrophobicContact CB-CE 4.4Å; V625-M627 HydrophobicContact CG1-CE 3.76Å; V625-L670 HydrophobicContact CG1-CB 3.81Å; V625-L670 HydrophobicContact CG1-CD1 4.41Å; V625-L670 HydrophobicContact CG1-CD2 4.14Å; V625-L670 HydrophobicContact CG1-CG 4.34Å; V625-V671 CarbonylContact C-O 3.59Å; V625-V671 WeakPolarHBondContact CA-O 3.27Å; V625-I672 HydrophobicContact CG2-CG1 4.34Å; V625-I672 HydrophobicContact CG2-CG2 4.45Å
626	K	89	Confident	78.8	Confident	8 Å²	8	72.8 Å²	72.8	4%	0.035	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.5	175.9	-162	177.2	-158.8	-174.1	0	109.9	V606 L640 E643 V671 D806 L809	V606-K626 HydrophobicContact CG2-CB 4.39Å; V606-K626 HydrophobicContact CG2-CG 4.02Å; K626-L640 HydrophobicContact CB-CD1 4.49Å; K626-L640 HydrophobicContact CD-CD1 4Å; K626-L640 HydrophobicContact CG-CD1 4.09Å; K626-E643 IonicContact NZ-OE1 2.63Å; K626-E643 PolarHBondContact NZ-OE1 2.92Å; K626-E643 IonicContact NZ-OE2 2.63Å; K626-E643 PolarHBondContact NZ-OE2 3.34Å; K626-V671 HydrophobicContact CB-CB 4.25Å; K626-V671 PolarHBondContact N-O 3.16Å; K626-V671 PolarHBondContact O-N 3.47Å; K626-D806 PolarHBondContact NZ-O 3.38Å; K626-L809 HydrophobicContact CD-CD1 3.93Å; K626-L809 VanDerWaalsContact CE-CD1 3.44Å; K626-L809 HydrophobicContact CG-CD1 4.26Å
627	M	86.9	Confident	78.9	Confident	14 Å²	14	71.5 Å²	71.5	7%	0.069	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	157.2	-178.4	63.6	-178.3	66.2	0	0	112.2	L594 G604 K605 V607 V625 L670	L594-M627 HydrophobicContact CD1-CE 3.56Å; L594-M627 HydrophobicContact CD1-SD 4.5Å; L594-M627 HydrophobicContact CD2-CE 3.82Å; L594-M627 HydrophobicContact CG-CE 4.31Å; G604-M627 CarbonylContact C-O 3.57Å; G604-M627 VanDerWaalsContact CA-O 3.29Å; G604-M627 WeakPolarHBondContact CA-O 3.48Å; K605-M627 HydrophobicContact CD-CG 4.49Å; K605-M627 HydrophobicContact CD-SD 4.44Å; K605-M627 WeakPolarHBondContact CE-SD 3.28Å; K605-M627 HydrophobicContact CG-CG 3.69Å; K605-M627 HydrophobicContact CG-SD 4.24Å; K605-M627 PolarHBondContact N-O 2.88Å; K605-M627 PolarHBondContact O-N 3.42Å; V607-M627 HydrophobicContact CG1-CE 4.49Å; V607-M627 HydrophobicContact CG2-CE 3.58Å; V625-M627 HydrophobicContact CB-CE 4.4Å; V625-M627 HydrophobicContact CG1-CE 3.76Å; M627-L670 HydrophobicContact CB-CD2 3.66Å; M627-L670 HydrophobicContact CE-CD2 3.59Å; M627-L670 HydrophobicContact SD-CD2 4.35Å
628	L	83.8	Confident	79.4	Confident	28 Å²	28	67.4 Å²	67.4	15%	0.147	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	161	176.5	-65	173.6	0	0	0	112.5	F603 A632 E636 R637 L640 L809	F603-L628 WeakPolarHBondContact O-CD2 2.86Å; L628-A632 HydrophobicContact CB-CB 3.71Å; L628-A632 HydrophobicContact CD1-CB 4.09Å; L628-A632 HydrophobicContact CG-CB 4.32Å; L628-E636 HydrophobicContact CD1-CB 4.31Å; L628-E636 HydrophobicContact CD2-CB 4.25Å; L628-R637 HydrophobicContact CD1-CB 3.94Å; L628-L640 HydrophobicContact CD1-CB 4.32Å; L628-L640 HydrophobicContact CD1-CD2 4.31Å; L628-L640 HydrophobicContact CG-CB 4.4Å; L628-L640 HydrophobicContact CG-CD2 3.89Å; L628-L809 HydrophobicContact CD2-CD2 3.72Å
629	K	78.8	Confident	79.5	Confident	58 Å²	58	60 Å²	60	25%	0.252	33%	0.329	S	S	.	.			trans	-72.6	157.6	169.9	-70.4	-177.8	178.8	174.9	0	110.6	G601 F603 S631 A632	G601-K629 WeakPolarHBondContact O-CE 3.44Å; G601-K629 PolarHBondContact O-NZ 3.15Å; F603-K629 PolarHBondContact O-N 3.05Å; K629-S631 PolarHBondContact O-N 2.87Å; K629-S631 VanDerWaalsContact O-N 3.13Å; K629-A632 WeakPolarHBondContact O-CB 3.01Å; K629-A632 PolarHBondContact O-N 3.36Å
630	A	74.5	Confident	79.5	Confident	119 Å²	119	57.2 Å²	57.2	98%	0.983	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.7	179	0	0	0	0	0	113.5	A632	A630-A632 VanDerWaalsContact C-N 3.33Å
631	S	71.2	Confident	79.2	Confident	98 Å²	98	55 Å²	55	69%	0.685	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	9.6	178.2	61.2	0	0	0	0	114.2	K629	K629-S631 PolarHBondContact O-N 2.87Å; K629-S631 VanDerWaalsContact O-N 3.13Å
632	A	67.4	Low	78.8	Confident	32 Å²	32	52.2 Å²	52.2	26%	0.264	29%	0.286	S	S	.	.			trans	-72.3	142	-171.2	0	0	0	0	0	113.3	L628 K629 A630 E636	L628-A632 HydrophobicContact CB-CB 3.71Å; L628-A632 HydrophobicContact CD1-CB 4.09Å; L628-A632 HydrophobicContact CG-CB 4.32Å; K629-A632 WeakPolarHBondContact O-CB 3.01Å; K629-A632 PolarHBondContact O-N 3.36Å; A630-A632 VanDerWaalsContact C-N 3.33Å; A632-E636 WeakPolarHBondContact CA-OE2 3.46Å; A632-E636 HydrophobicContact CB-CB 4.42Å; A632-E636 WeakPolarHBondContact CB-OE2 3.42Å
633	H	71.7	Confident	78.3	Confident	132 Å²	132	48.3 Å²	48.3	61%	0.611	27%	0.272	S	S	*	.			trans	-81.3	165.1	180	-69.5	-63.3	0	0	0	112.5	D635 E636 R637	H633-D635 PolarHBondContact O-N 3.24Å; H633-E636 PolarHBondContact N-OE2 3.17Å; H633-E636 PolarHBondContact O-N 3.13Å; H633-R637 PolarHBondContact O-N 3.04Å
634	S	70.6	Confident	77.9	Confident	90 Å²	90	48.3 Å²	48.3	63%	0.629	27%	0.272	S	S	*	.	H	α-helix	trans	-53.4	-42	177	46.2	0	0	0	0	112.6	E636 R637 E638	S634-E636 VanDerWaalsContact C-N 3.31Å; S634-E636 PolarHBondContact O-N 3.11Å; S634-R637 WeakPolarHBondContact O-CB 3.42Å; S634-R637 PolarHBondContact O-N 3.22Å; S634-E638 PolarHBondContact O-N 3.06Å
635	D	66	Low	77.4	Confident	81 Å²	81	49.6 Å²	49.6	43%	0.433	28%	0.276	S	S	.	.	H	α-helix	trans	-68.2	-33.8	-175.3	-49.5	-3.5	0	0	0	110.8	H633 E638 A639	H633-D635 PolarHBondContact O-N 3.24Å; D635-E638 PolarHBondContact O-N 3.05Å; D635-A639 WeakPolarHBondContact O-CB 3.48Å; D635-A639 PolarHBondContact O-N 3.4Å
636	E	69.8	Low	76.9	Confident	27 Å²	27	49.8 Å²	49.8	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-71.1	-35.6	175.6	-64.7	167.7	171.6	0	0	111.5	F603 L628 A632 H633 S634 A639 L640	F603-E636 HydrophobicContact CD1-CG 4.44Å; F603-E636 VanDerWaalsContact CD1-OE1 3.28Å; F603-E636 WeakPolarHBondContact CD1-OE1 3.49Å; L628-E636 HydrophobicContact CD1-CB 4.31Å; L628-E636 HydrophobicContact CD2-CB 4.25Å; A632-E636 WeakPolarHBondContact CA-OE2 3.46Å; A632-E636 HydrophobicContact CB-CB 4.42Å; A632-E636 WeakPolarHBondContact CB-OE2 3.42Å; H633-E636 PolarHBondContact N-OE2 3.17Å; H633-E636 PolarHBondContact O-N 3.13Å; S634-E636 VanDerWaalsContact C-N 3.31Å; S634-E636 PolarHBondContact O-N 3.11Å; E636-A639 PolarHBondContact O-N 3.19Å; E636-L640 PolarHBondContact O-N 2.97Å
637	R	76.6	Confident	76.6	Confident	142 Å²	142	50.4 Å²	50.4	54%	0.536	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-44.4	172.3	-177.2	-178.3	174.9	174.6	-0.7	111.7	L628 H633 S634 A639 L640 M641 V669	L628-R637 HydrophobicContact CD1-CB 3.94Å; H633-R637 PolarHBondContact O-N 3.04Å; S634-R637 WeakPolarHBondContact O-CB 3.42Å; S634-R637 PolarHBondContact O-N 3.22Å; R637-A639 VanDerWaalsContact C-N 3.29Å; R637-A639 PolarHBondContact O-N 3.44Å; R637-L640 PolarHBondContact O-N 3.3Å; R637-M641 WeakPolarHBondContact O-CB 3.43Å; R637-M641 WeakPolarHBondContact O-CG 3.25Å; R637-M641 PolarHBondContact O-N 2.95Å; R637-V669 HydrophobicContact CG-CG2 4.41Å
638	E	74.4	Confident	76.5	Confident	101 Å²	101	50.6 Å²	50.6	47%	0.472	28%	0.283	S	S	.	.	H	α-helix	trans	-60.3	-43.3	174.9	-173.6	163.2	-149.7	0	0	110.6	T577 S634 D635 L640 M641 S642	T577-E638 HydrophobicContact CG2-CG 4Å; T577-E638 WeakPolarHBondContact CG2-OE1 3.49Å; S634-E638 PolarHBondContact O-N 3.06Å; D635-E638 PolarHBondContact O-N 3.05Å; E638-L640 PolarHBondContact O-N 2.78Å; E638-M641 CarbonylContact O-C 3.48Å; E638-M641 WeakPolarHBondContact O-CA 3.48Å; E638-M641 WeakPolarHBondContact O-CB 3.49Å; E638-M641 PolarHBondContact O-N 3.48Å; E638-M641 VanDerWaalsContact O-N 3.1Å; E638-S642 PolarHBondContact O-N 3.5Å; E638-S642 PolarHBondContact O-OG 3.32Å
639	A	70.9	Confident	76.3	Confident	7 Å²	7	54.4 Å²	54.4	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-35.8	178.3	0	0	0	0	0	114	Y556 I558 D635 E636 R637 M641 E643	Y556-A639 HydrophobicContact CD1-CB 3.37Å; Y556-A639 HydrophobicContact CE1-CB 3.26Å; I558-A639 HydrophobicContact CD1-CB 4.34Å; I558-A639 WeakPolarHBondContact CD1-O 3.39Å; I558-A639 HydrophobicContact CG1-CB 3.75Å; I558-A639 WeakPolarHBondContact CG1-O 2.99Å; D635-A639 WeakPolarHBondContact O-CB 3.48Å; D635-A639 PolarHBondContact O-N 3.4Å; E636-A639 PolarHBondContact O-N 3.19Å; R637-A639 VanDerWaalsContact C-N 3.29Å; R637-A639 PolarHBondContact O-N 3.44Å; A639-M641 VanDerWaalsContact C-N 3.35Å; A639-E643 PolarHBondContact O-N 3.17Å
640	L	80.4	Confident	76.4	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-37.2	170.6	179.2	63	0	0	0	111.6	K626 L628 E636 R637 E638 E643 L644 V669 V671 L809	K626-L640 HydrophobicContact CB-CD1 4.49Å; K626-L640 HydrophobicContact CD-CD1 4Å; K626-L640 HydrophobicContact CG-CD1 4.09Å; L628-L640 HydrophobicContact CD1-CB 4.32Å; L628-L640 HydrophobicContact CD1-CD2 4.31Å; L628-L640 HydrophobicContact CG-CB 4.4Å; L628-L640 HydrophobicContact CG-CD2 3.89Å; E636-L640 PolarHBondContact O-N 2.97Å; R637-L640 PolarHBondContact O-N 3.3Å; E638-L640 PolarHBondContact O-N 2.78Å; L640-E643 PolarHBondContact O-N 3.07Å; L640-L644 PolarHBondContact O-N 2.87Å; L640-V669 HydrophobicContact CD2-CB 4.09Å; L640-V669 HydrophobicContact CD2-CG1 3.96Å; L640-V669 HydrophobicContact CG-CG1 4.2Å; L640-V671 HydrophobicContact CD1-CB 4.42Å; L640-V671 HydrophobicContact CD1-CG2 3.66Å; L640-V671 HydrophobicContact CG-CG2 4.02Å; L640-L809 HydrophobicContact CB-CD1 4.1Å; L640-L809 HydrophobicContact CD1-CD1 3.52Å; L640-L809 HydrophobicContact CG-CD1 4.34Å
641	M	80.6	Confident	76.7	Confident	41 Å²	41	48.1 Å²	48.1	20%	0.202	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-39.8	177.6	-78.4	-63.7	-61.5	0	0	112.4	R637 E638 A639 L644 K645 T664 V669	R637-M641 WeakPolarHBondContact O-CB 3.43Å; R637-M641 WeakPolarHBondContact O-CG 3.25Å; R637-M641 PolarHBondContact O-N 2.95Å; E638-M641 CarbonylContact O-C 3.48Å; E638-M641 WeakPolarHBondContact O-CA 3.48Å; E638-M641 WeakPolarHBondContact O-CB 3.49Å; E638-M641 PolarHBondContact O-N 3.48Å; E638-M641 VanDerWaalsContact O-N 3.1Å; A639-M641 VanDerWaalsContact C-N 3.35Å; M641-L644 WeakPolarHBondContact O-CB 3.41Å; M641-L644 PolarHBondContact O-N 3.29Å; M641-L644 HydrophobicContact SD-CD2 4.3Å; M641-K645 WeakPolarHBondContact O-CG 3.49Å; M641-K645 PolarHBondContact O-N 3Å; M641-T664 HydrophobicContact CE-CG2 4.38Å; M641-T664 HydrophobicContact SD-CG2 4.25Å; M641-V669 HydrophobicContact CG-CG2 4.26Å; M641-V669 HydrophobicContact SD-CB 4.37Å; M641-V669 HydrophobicContact SD-CG1 3.67Å; M641-V669 HydrophobicContact SD-CG2 3.74Å
642	S	75.9	Confident	77.4	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-75	-25.3	178	-1.3	0	0	0	0	113.3	I558 E638 K645 I646	I558-S642 VanDerWaalsContact CD1-OG 3.29Å; I558-S642 WeakPolarHBondContact CD1-OG 3.37Å; E638-S642 PolarHBondContact O-N 3.5Å; E638-S642 PolarHBondContact O-OG 3.32Å; S642-K645 PolarHBondContact O-N 2.85Å; S642-I646 WeakPolarHBondContact O-CB 3.49Å; S642-I646 WeakPolarHBondContact O-CD1 3.5Å; S642-I646 WeakPolarHBondContact O-CG1 3.44Å; S642-I646 PolarHBondContact O-N 3.39Å
643	E	79	Confident	78.6	Confident	23 Å²	23	50.3 Å²	50.3	11%	0.107	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-45.3	168.3	-176.2	-178.4	161	0	0	111.2	K626 A639 L640 K645 I646 L647	K626-E643 IonicContact NZ-OE1 2.63Å; K626-E643 PolarHBondContact NZ-OE1 2.92Å; K626-E643 IonicContact NZ-OE2 2.63Å; K626-E643 PolarHBondContact NZ-OE2 3.34Å; A639-E643 PolarHBondContact O-N 3.17Å; L640-E643 PolarHBondContact O-N 3.07Å; E643-K645 VanDerWaalsContact C-N 3.34Å; E643-K645 PolarHBondContact O-N 3.06Å; E643-I646 PolarHBondContact O-N 3.15Å; E643-L647 HydrophobicContact CG-CD1 4.22Å; E643-L647 WeakPolarHBondContact O-CG 3.33Å; E643-L647 PolarHBondContact O-N 3.34Å
644	L	84.4	Confident	79.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.1	-46.5	173.7	171.3	60.2	0	0	0	111.9	Y581 L640 M641 L647 S648 L659 A662 T664 V671	Y581-L644 HydrophobicContact CD2-CD2 3.95Å; Y581-L644 HydrophobicContact CD2-CG 4.17Å; Y581-L644 HydrophobicContact CE2-CD1 4.26Å; Y581-L644 HydrophobicContact CE2-CD2 3.57Å; Y581-L644 HydrophobicContact CE2-CG 3.94Å; L640-L644 PolarHBondContact O-N 2.87Å; M641-L644 WeakPolarHBondContact O-CB 3.41Å; M641-L644 PolarHBondContact O-N 3.29Å; M641-L644 HydrophobicContact SD-CD2 4.3Å; L644-L647 PolarHBondContact O-N 3.16Å; L644-S648 VanDerWaalsContact O-CB 3.31Å; L644-S648 WeakPolarHBondContact O-CB 3.34Å; L644-S648 PolarHBondContact O-N 2.74Å; L644-L659 HydrophobicContact CD1-CD1 3.62Å; L644-L659 HydrophobicContact CD1-CD2 3.71Å; L644-L659 HydrophobicContact CD1-CG 4.33Å; L644-A662 HydrophobicContact CD1-CB 3.58Å; L644-A662 HydrophobicContact CD2-CB 3.61Å; L644-A662 HydrophobicContact CG-CB 4.25Å; L644-T664 HydrophobicContact CD2-CG2 3.84Å; L644-V671 HydrophobicContact CB-CG2 3.97Å; L644-V671 HydrophobicContact CD1-CG1 4.3Å; L644-V671 HydrophobicContact CD1-CG2 4.47Å
645	K	82.8	Confident	80.7	Confident	34 Å²	34	45.3 Å²	45.3	15%	0.148	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-41.5	178.7	-70	169.6	173.6	-158.9	0	112.1	P576 T577 L579 M641 S642 E643 S648 H649	P576-K645 WeakPolarHBondContact O-CD 3.39Å; T577-K645 PolarHBondContact O-NZ 3.12Å; L579-K645 HydrophobicContact CB-CB 4.04Å; L579-K645 HydrophobicContact CB-CD 4.19Å; L579-K645 HydrophobicContact CD1-CB 4.4Å; L579-K645 WeakPolarHBondContact O-CD 3.47Å; L579-K645 WeakPolarHBondContact O-CE 3.45Å; L579-K645 PolarHBondContact O-NZ 3.26Å; M641-K645 WeakPolarHBondContact O-CG 3.49Å; M641-K645 PolarHBondContact O-N 3Å; S642-K645 PolarHBondContact O-N 2.85Å; E643-K645 VanDerWaalsContact C-N 3.34Å; E643-K645 PolarHBondContact O-N 3.06Å; K645-S648 PolarHBondContact O-N 3.06Å; K645-H649 WeakPolarHBondContact O-CB 3.38Å; K645-H649 PolarHBondContact O-N 3.11Å
646	I	79.4	Confident	81.9	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-50.4	177.2	-70.7	166	0	0	0	110.4	I558 W560 I562 P576 L579 S642 E643 S648 H649 L650	I558-I646 HydrophobicContact CG2-CD1 4.27Å; W560-I646 HydrophobicContact CB-CD1 3.87Å; W560-I646 HydrophobicContact CB-CG2 4.3Å; W560-I646 HydrophobicContact CD2-CG2 4.46Å; W560-I646 HydrophobicContact CE3-CG2 3.73Å; I562-I646 HydrophobicContact CD1-CG1 4.4Å; P576-I646 HydrophobicContact CB-CD1 4.12Å; P576-I646 HydrophobicContact CB-CG1 4.39Å; P576-I646 HydrophobicContact CG-CD1 4.06Å; L579-I646 HydrophobicContact CD1-CG1 4.34Å; S642-I646 WeakPolarHBondContact O-CB 3.49Å; S642-I646 WeakPolarHBondContact O-CD1 3.5Å; S642-I646 WeakPolarHBondContact O-CG1 3.44Å; S642-I646 PolarHBondContact O-N 3.39Å; E643-I646 PolarHBondContact O-N 3.15Å; I646-S648 VanDerWaalsContact C-N 3.29Å; I646-S648 PolarHBondContact O-N 2.89Å; I646-H649 PolarHBondContact O-N 2.91Å; I646-L650 HydrophobicContact CG2-CD1 3.7Å; I646-L650 HydrophobicContact CG2-CG 4.24Å; I646-L650 VanDerWaalsContact O-CG 3.3Å; I646-L650 WeakPolarHBondContact O-CG 3.48Å; I646-L650 PolarHBondContact O-N 3.12Å
647	L	83.9	Confident	82.9	Confident	21 Å²	21	40.8 Å²	40.8	11%	0.11	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-37.8	178.4	-68.5	172.4	0	0	0	112.2	E643 L644 H649 L659	E643-L647 HydrophobicContact CG-CD1 4.22Å; E643-L647 WeakPolarHBondContact O-CG 3.33Å; E643-L647 PolarHBondContact O-N 3.34Å; L644-L647 PolarHBondContact O-N 3.16Å; L647-H649 VanDerWaalsContact C-N 3.3Å; L647-H649 PolarHBondContact O-N 3.37Å; L647-L659 HydrophobicContact CB-CB 3.97Å; L647-L659 HydrophobicContact CB-CD2 4.36Å
648	S	83.5	Confident	83.6	Confident	18 Å²	18	34.3 Å²	34.3	13%	0.126	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-36.2	173.1	169	0	0	0	0	112.5	W585 L644 K645 I646	W585-S648 VanDerWaalsContact CD1-OG 3.27Å; W585-S648 PolarHBondContact NE1-OG 3.4Å; L644-S648 VanDerWaalsContact O-CB 3.31Å; L644-S648 WeakPolarHBondContact O-CB 3.34Å; L644-S648 PolarHBondContact O-N 2.74Å; K645-S648 PolarHBondContact O-N 3.06Å; I646-S648 VanDerWaalsContact C-N 3.29Å; I646-S648 PolarHBondContact O-N 2.89Å
649	H	80.1	Confident	84.4	Confident	109 Å²	109	30.1 Å²	30.1	51%	0.505	16%	0.155	S	C	.	.	H	α-helix	trans	-79.2	-35.9	-178.3	-172.8	82.1	0	0	0	113	K645 I646 L647	K645-H649 WeakPolarHBondContact O-CB 3.38Å; K645-H649 PolarHBondContact O-N 3.11Å; I646-H649 PolarHBondContact O-N 2.91Å; L647-H649 VanDerWaalsContact C-N 3.3Å; L647-H649 PolarHBondContact O-N 3.37Å
650	L	81.8	Confident	85.3	Confident	6 Å²	6	31.9 Å²	31.9	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-65.7	-39.6	-177.5	-72.3	167.2	0	0	0	113.1	W560 I646 F778 L779 K782 C784	W560-L650 HydrophobicContact CE3-CD1 3.75Å; W560-L650 HydrophobicContact CZ3-CD1 3.36Å; I646-L650 HydrophobicContact CG2-CD1 3.7Å; I646-L650 HydrophobicContact CG2-CG 4.24Å; I646-L650 VanDerWaalsContact O-CG 3.3Å; I646-L650 WeakPolarHBondContact O-CG 3.48Å; I646-L650 PolarHBondContact O-N 3.12Å; L650-F778 WeakPolarHBondContact O-CZ 3.49Å; L650-L779 HydrophobicContact CD1-CD2 4.06Å; L650-L779 HydrophobicContact CD2-CD2 4.12Å; L650-K782 HydrophobicContact CD2-CB 3.8Å; L650-K782 HydrophobicContact CD2-CG 4.3Å; L650-C784 HydrophobicContact CD2-CB 3.72Å
651	G	80.3	Confident	85.9	Confident	39 Å²	39	31.9 Å²	31.9	40%	0.402	16%	0.164	S	C	.	.			trans	89.2	-165.6	-174.9	0	0	0	0	0	113.2
652	H	86.4	Confident	86.5	Confident	134 Å²	134	30 Å²	30	62%	0.62	15%	0.154	S	C	*	.			trans	-93.5	136.4	-174.2	-178.6	85.9	0	0	0	112	N658 E674	H652-N658 VanDerWaalsContact CA-OD1 3.31Å; H652-N658 WeakPolarHBondContact CA-OD1 3.31Å; H652-N658 PolarHBondContact CE1-ND2 3.25Å; H652-N658 PolarHBondContact ND1-ND2 3.32Å; H652-N658 PolarHBondContact ND1-OD1 3.3Å; H652-E674 IonicContact CE1-OE1 3.89Å
653	H	91.8	Very high	87.2	Confident	41 Å²	41	29.7 Å²	29.7	19%	0.19	15%	0.152	C	C	.	.			trans	-146.2	145.4	170.5	-174	-99.5	0	0	0	111.7	H655 I656 N658 F778	H653-H655 VanDerWaalsContact C-N 3.29Å; H653-H655 PolarHBondContact ND1-N 3.05Å; H653-H655 VanDerWaalsContact ND1-N 3.14Å; H653-H655 PolarHBondContact O-N 2.94Å; H653-I656 HydrophobicContact CB-CB 4.23Å; H653-I656 HydrophobicContact CB-CG1 3.94Å; H653-I656 PolarHBondContact O-N 2.79Å; H653-N658 PolarHBondContact N-OD1 3.38Å; H653-N658 PolarHBondContact O-ND2 3.14Å; H653-N658 PolarHBondContact O-OD1 3.49Å; H653-F778 HydrophobicContact CB-CD1 3.65Å; H653-F778 HydrophobicContact CB-CD2 4.15Å; H653-F778 HydrophobicContact CB-CE1 3.7Å; H653-F778 HydrophobicContact CB-CE2 4.19Å; H653-F778 HydrophobicContact CB-CG 3.88Å; H653-F778 HydrophobicContact CB-CZ 3.96Å; H653-F778 AromaticContact CD2-CD2 3.67Å; H653-F778 AromaticContact CD2-CG 3.59Å; H653-F778 AromaticContact CG-CD1 3.84Å; H653-F778 AromaticContact CG-CG 3.64Å
654	K	91.3	Very high	87.7	Confident	110 Å²	110	29.6 Å²	29.6	48%	0.478	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-41.3	-176.3	-171.6	176.5	179.6	-178.4	0	112.8	E801 K803	K654-E801 WeakPolarHBondContact CE-OE1 3.39Å; K654-E801 IonicContact NZ-OE1 3.95Å; K654-E801 PolarHBondContact NZ-OE1 3.23Å; K654-E801 VanDerWaalsContact NZ-OE1 3.11Å; K654-K803 WeakPolarHBondContact O-CE 3.34Å; K654-K803 PolarHBondContact O-NZ 2.99Å
655	H	94.9	Very high	87.6	Confident	8 Å²	8	35.7 Å²	35.7	4%	0.037	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	18.8	-174.2	-59.6	-56.7	0	0	0	114.6	H653 Q771 Q774 A802 K803 I804	H653-H655 VanDerWaalsContact C-N 3.29Å; H653-H655 PolarHBondContact ND1-N 3.05Å; H653-H655 VanDerWaalsContact ND1-N 3.14Å; H653-H655 PolarHBondContact O-N 2.94Å; H655-Q771 WeakPolarHBondContact CB-O 3.4Å; H655-Q771 WeakPolarHBondContact CE1-CG 3.3Å; H655-Q771 VanDerWaalsContact CG-O 3.27Å; H655-Q774 PolarHBondContact CD2-OE1 2.97Å; H655-Q774 PolarHBondContact NE2-OE1 3.1Å; H655-A802 PolarHBondContact ND1-O 3.45Å; H655-K803 WeakPolarHBondContact O-CA 3.35Å; H655-I804 PolarHBondContact O-N 3.23Å
656	I	91.6	Very high	87.1	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-115.6	145.1	167.1	-57.3	-60.3	0	0	0	107.5	H653 N658 F778 L779 I804	H653-I656 HydrophobicContact CB-CB 4.23Å; H653-I656 HydrophobicContact CB-CG1 3.94Å; H653-I656 PolarHBondContact O-N 2.79Å; I656-N658 PolarHBondContact O-N 2.9Å; I656-N658 VanDerWaalsContact O-N 3.17Å; I656-N658 PolarHBondContact O-ND2 3.01Å; I656-N658 VanDerWaalsContact O-ND2 3.12Å; I656-F778 HydrophobicContact CG1-CD1 3.96Å; I656-F778 HydrophobicContact CG1-CE1 4.36Å; I656-L779 HydrophobicContact CD1-CD1 3.9Å; I656-L779 HydrophobicContact CD1-CD2 4.08Å; I656-L779 HydrophobicContact CD1-CG 3.84Å; I656-L779 HydrophobicContact CG1-CD2 4.46Å; I656-I804 HydrophobicContact CD1-CB 3.86Å; I656-I804 HydrophobicContact CD1-CD1 3.92Å; I656-I804 HydrophobicContact CD1-CG1 4.39Å
657	V	91	Very high	87.3	Confident	9 Å²	9	39.7 Å²	39.7	6%	0.055	23%	0.229	C	C	.	.			trans	-69.4	109.8	170.2	173.3	0	0	0	0	108.4	T673 L795 K803 I804 C805	V657-T673 HydrophobicContact CG1-CG2 4.43Å; V657-L795 HydrophobicContact CG2-CD1 4.34Å; V657-K803 HydrophobicContact CG2-CB 3.68Å; V657-I804 PolarHBondContact N-O 3.34Å; V657-C805 HydrophobicContact CB-CB 4.03Å; V657-C805 HydrophobicContact CG2-CB 3.67Å
658	N	90.5	Very high	87.4	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.027	25%	0.25	C	S	.	.			trans	-81.8	145.3	-171.1	-61	-70.6	0	0	0	112.7	H652 H653 I656 T673 E674	H652-N658 VanDerWaalsContact CA-OD1 3.31Å; H652-N658 WeakPolarHBondContact CA-OD1 3.31Å; H652-N658 PolarHBondContact CE1-ND2 3.25Å; H652-N658 PolarHBondContact ND1-ND2 3.32Å; H652-N658 PolarHBondContact ND1-OD1 3.3Å; H653-N658 PolarHBondContact N-OD1 3.38Å; H653-N658 PolarHBondContact O-ND2 3.14Å; H653-N658 PolarHBondContact O-OD1 3.49Å; I656-N658 PolarHBondContact O-N 2.9Å; I656-N658 VanDerWaalsContact O-N 3.17Å; I656-N658 PolarHBondContact O-ND2 3.01Å; I656-N658 VanDerWaalsContact O-ND2 3.12Å; N658-T673 VanDerWaalsContact O-CA 3.29Å; N658-T673 WeakPolarHBondContact O-CA 3.19Å; N658-T673 WeakPolarHBondContact O-CB 3.44Å; N658-E674 HydrophobicContact CB-CG 4.1Å; N658-E674 PolarHBondContact N-OE2 2.84Å; N658-E674 VanDerWaalsContact N-OE2 3.16Å; N658-E674 VanDerWaalsContact ND2-CD 3.3Å; N658-E674 PolarHBondContact ND2-OE1 3.39Å; N658-E674 PolarHBondContact ND2-OE2 2.97Å; N658-E674 PolarHBondContact O-N 3.1Å; N658-E674 VanDerWaalsContact O-N 3.13Å
659	L	91.6	Very high	87.5	Confident	13 Å²	13	42.2 Å²	42.2	7%	0.068	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.8	166.7	-179	70.9	0	0	0	109.4	W585 L644 L647 G661 V671	W585-L659 HydrophobicContact CD2-CD2 3.73Å; W585-L659 HydrophobicContact CD2-CG 4.33Å; W585-L659 HydrophobicContact CE3-CD2 4.01Å; W585-L659 HydrophobicContact CE3-CG 4.09Å; W585-L659 HydrophobicContact CG-CD2 3.99Å; W585-L659 HydrophobicContact CZ2-CD2 4.39Å; W585-L659 HydrophobicContact CZ3-CD2 4.44Å; W585-L659 HydrophobicContact CZ3-CG 4.3Å; W585-L659 WeakPolarHBondContact CZ3-O 3.48Å; L644-L659 HydrophobicContact CD1-CD1 3.62Å; L644-L659 HydrophobicContact CD1-CD2 3.71Å; L644-L659 HydrophobicContact CD1-CG 4.33Å; L647-L659 HydrophobicContact CB-CB 3.97Å; L647-L659 HydrophobicContact CB-CD2 4.36Å; L659-G661 WeakPolarHBondContact CD1-O 3.47Å; L659-V671 HydrophobicContact CD1-CG1 3.68Å
660	L	91.1	Very high	88	Confident	44 Å²	44	37.3 Å²	37.3	23%	0.23	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-27.4	175.8	-55.9	178.3	0	0	0	112	L614 M621 V623 I672 E674	L614-L660 HydrophobicContact CD2-CB 3.87Å; L614-L660 HydrophobicContact CD2-CD1 4.19Å; M621-L660 HydrophobicContact SD-CD1 3.83Å; V623-L660 HydrophobicContact CB-CD1 4.46Å; V623-L660 HydrophobicContact CG1-CD1 3.68Å; L660-I672 HydrophobicContact CB-CG2 4.39Å; L660-I672 PolarHBondContact N-O 2.92Å; L660-E674 HydrophobicContact CD1-CG 4.16Å; L660-E674 HydrophobicContact CD2-CG 3.95Å; L660-E674 HydrophobicContact CG-CG 4.17Å
661	G	91.1	Very high	88.5	Confident	2 Å²	2	37 Å²	37	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.5	-178.5	176.8	0	0	0	0	0	112.4	W585 L659 I672	W585-G661 CarbonylContact O-C 3.47Å; W585-G661 VanDerWaalsContact O-CA 3.23Å; W585-G661 WeakPolarHBondContact O-CA 3.38Å; L659-G661 WeakPolarHBondContact CD1-O 3.47Å; G661-I672 PolarHBondContact N-O 3.17Å; G661-I672 WeakPolarHBondContact O-CA 3.38Å; G661-I672 VanDerWaalsContact O-CB 3.24Å; G661-I672 WeakPolarHBondContact O-CB 2.96Å; G661-I672 PolarHBondContact O-N 2.91Å
662	A	93.3	Very high	89.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	153.1	175.9	0	0	0	0	0	111.6	W585 E586 F587 L644 T664 L670	W585-A662 PolarHBondContact O-N 3.09Å; E586-A662 CarbonylContact C-O 3.58Å; E586-A662 WeakPolarHBondContact CA-O 3.28Å; F587-A662 PolarHBondContact N-O 3.35Å; L644-A662 HydrophobicContact CD1-CB 3.58Å; L644-A662 HydrophobicContact CD2-CB 3.61Å; L644-A662 HydrophobicContact CG-CB 4.25Å; A662-T664 HydrophobicContact CB-CG2 4.32Å; A662-L670 CarbonylContact C-O 3.58Å; A662-L670 WeakPolarHBondContact CA-O 3.5Å; A662-L670 WeakPolarHBondContact CB-O 3.4Å
663	C	91.6	Very high	89.3	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	104	168.7	-51.4	0	0	0	0	108.2	E586 F587 V669 L670	E586-C663 WeakPolarHBondContact OE1-CA 3.25Å; F587-C663 PolarHBondContact O-SG 2.77Å; C663-V669 WeakPolarHBondContact O-CA 3.49Å; C663-L670 HydrophobicContact CB-CB 3.98Å; C663-L670 HydrophobicContact CB-CD1 4.21Å; C663-L670 HydrophobicContact CB-CG 4.22Å; C663-L670 PolarHBondContact N-O 3.24Å; C663-L670 PolarHBondContact O-N 3.48Å
664	T	89.1	Confident	89.3	Confident	20 Å²	20	29.2 Å²	29.2	12%	0.123	18%	0.176	C	C	.	.			trans	-104.4	-25.1	-178.4	67.7	0	0	0	0	112.4	Y581 E586 M641 L644 A662	Y581-T664 HydrophobicContact CE1-CG2 3.98Å; Y581-T664 HydrophobicContact CE2-CG2 4.28Å; E586-T664 PolarHBondContact OE1-N 3.23Å; E586-T664 PolarHBondContact OE1-OG1 3.41Å; E586-T664 PolarHBondContact OE2-N 2.88Å; E586-T664 PolarHBondContact OE2-OG1 3.03Å; M641-T664 HydrophobicContact CE-CG2 4.38Å; M641-T664 HydrophobicContact SD-CG2 4.25Å; L644-T664 HydrophobicContact CD2-CG2 3.84Å; A662-T664 HydrophobicContact CB-CG2 4.32Å
665	Y	82.6	Confident	89.2	Confident	128 Å²	128	25.7 Å²	25.7	50%	0.502	16%	0.16	S	C	.	.	S	Bend	trans	-91.8	155.8	177.6	-54.4	-73.1	0	0	0	113.4	E583 E586 R589 G667	E583-Y665 PolarHBondContact OE1-OH 3.23Å; E586-Y665 HydrophobicContact CG-CD2 3.7Å; E586-Y665 HydrophobicContact CG-CE2 3.83Å; E586-Y665 VanDerWaalsContact OE1-CD2 3.27Å; E586-Y665 WeakPolarHBondContact OE1-CD2 3.49Å; E586-Y665 PolarHBondContact OE1-N 2.68Å; R589-Y665 PolarHBondContact NH2-O 3.16Å; Y665-G667 VanDerWaalsContact C-N 3.29Å; Y665-G667 PolarHBondContact O-N 2.98Å; Y665-G667 VanDerWaalsContact O-N 3.16Å
666	G	72.9	Confident	89	Confident	85 Å²	85	25.8 Å²	25.8	88%	0.876	16%	0.162	S	C	*	.	S	Bend	trans	64.1	22.1	166.8	0	0	0	0	0	116.3
667	G	83.3	Confident	88.6	Confident	37 Å²	37	26.9 Å²	26.9	38%	0.381	17%	0.17	S	C	.	.	S	Bend	trans	165.8	-165.5	179.9	0	0	0	0	0	113.8	Y665	Y665-G667 VanDerWaalsContact C-N 3.29Å; Y665-G667 PolarHBondContact O-N 2.98Å; Y665-G667 VanDerWaalsContact O-N 3.16Å
668	P	85.6	Confident	88.3	Confident	86 Å²	86	28.2 Å²	28.2	56%	0.558	18%	0.176	S	C	*	.	S	Bend	trans	-64.4	148.9	174.4	28.2	-34.3	0	0	0	110.7	R589 L670	R589-P668 PolarHBondContact NH1-O 2.87Å; R589-P668 PolarHBondContact NH2-O 3.17Å; P668-L670 PolarHBondContact O-N 3.43Å
669	V	86.1	Confident	88.1	Confident	6 Å²	6	28.2 Å²	28.2	4%	0.036	18%	0.178	C	C	.	.			trans	-64.9	123.6	177	178.7	0	0	0	0	109.2	R637 L640 M641 C663 V671	R637-V669 HydrophobicContact CG-CG2 4.41Å; L640-V669 HydrophobicContact CD2-CB 4.09Å; L640-V669 HydrophobicContact CD2-CG1 3.96Å; L640-V669 HydrophobicContact CG-CG1 4.2Å; M641-V669 HydrophobicContact CG-CG2 4.26Å; M641-V669 HydrophobicContact SD-CB 4.37Å; M641-V669 HydrophobicContact SD-CG1 3.67Å; M641-V669 HydrophobicContact SD-CG2 3.74Å; C663-V669 WeakPolarHBondContact O-CA 3.49Å; V669-V671 HydrophobicContact CG1-CG2 4.42Å
670	L	91.2	Very high	88	Confident	5 Å²	5	28.1 Å²	28.1	3%	0.026	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.6	175.6	-55.4	-174.5	0	0	0	108.8	R589 L592 V625 M627 A662 C663 P668	R589-L670 VanDerWaalsContact NH1-CD1 3.32Å; L592-L670 HydrophobicContact CD2-CD1 3.77Å; V625-L670 HydrophobicContact CG1-CB 3.81Å; V625-L670 HydrophobicContact CG1-CD1 4.41Å; V625-L670 HydrophobicContact CG1-CD2 4.14Å; V625-L670 HydrophobicContact CG1-CG 4.34Å; M627-L670 HydrophobicContact CB-CD2 3.66Å; M627-L670 HydrophobicContact CE-CD2 3.59Å; M627-L670 HydrophobicContact SD-CD2 4.35Å; A662-L670 CarbonylContact C-O 3.58Å; A662-L670 WeakPolarHBondContact CA-O 3.5Å; A662-L670 WeakPolarHBondContact CB-O 3.4Å; C663-L670 HydrophobicContact CB-CB 3.98Å; C663-L670 HydrophobicContact CB-CD1 4.21Å; C663-L670 HydrophobicContact CB-CG 4.22Å; C663-L670 PolarHBondContact N-O 3.24Å; C663-L670 PolarHBondContact O-N 3.48Å; P668-L670 PolarHBondContact O-N 3.43Å
671	V	90.8	Very high	88	Confident	0 Å²	0	26 Å²	26	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.6	173.4	-178.3	0	0	0	0	108.1	V625 K626 L640 L644 L659 V669 T673	V625-V671 CarbonylContact C-O 3.59Å; V625-V671 WeakPolarHBondContact CA-O 3.27Å; K626-V671 HydrophobicContact CB-CB 4.25Å; K626-V671 PolarHBondContact N-O 3.16Å; K626-V671 PolarHBondContact O-N 3.47Å; L640-V671 HydrophobicContact CD1-CB 4.42Å; L640-V671 HydrophobicContact CD1-CG2 3.66Å; L640-V671 HydrophobicContact CG-CG2 4.02Å; L644-V671 HydrophobicContact CB-CG2 3.97Å; L644-V671 HydrophobicContact CD1-CG1 4.3Å; L644-V671 HydrophobicContact CD1-CG2 4.47Å; L659-V671 HydrophobicContact CD1-CG1 3.68Å; V669-V671 HydrophobicContact CG1-CG2 4.42Å; V671-T673 HydrophobicContact CG1-CG2 4.17Å
672	I	92.6	Very high	87.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.3	-174.5	-48.4	170.6	0	0	0	108.7	F587 L592 V623 V625 L660 G661	F587-I672 HydrophobicContact CB-CD1 3.82Å; F587-I672 HydrophobicContact CD1-CD1 3.68Å; F587-I672 HydrophobicContact CG-CD1 3.94Å; L592-I672 HydrophobicContact CD1-CD1 4.09Å; L592-I672 HydrophobicContact CD2-CD1 3.9Å; L592-I672 HydrophobicContact CD2-CG1 4.13Å; V623-I672 HydrophobicContact CB-CG2 3.72Å; V623-I672 HydrophobicContact CG1-CG2 4.05Å; V623-I672 HydrophobicContact CG2-CG2 3.61Å; V625-I672 HydrophobicContact CG2-CG1 4.34Å; V625-I672 HydrophobicContact CG2-CG2 4.45Å; L660-I672 HydrophobicContact CB-CG2 4.39Å; L660-I672 PolarHBondContact N-O 2.92Å; G661-I672 PolarHBondContact N-O 3.17Å; G661-I672 WeakPolarHBondContact O-CA 3.38Å; G661-I672 VanDerWaalsContact O-CB 3.24Å; G661-I672 WeakPolarHBondContact O-CB 2.96Å; G661-I672 PolarHBondContact O-N 2.91Å
673	T	92.4	Very high	87.4	Confident	13 Å²	13	29.2 Å²	29.2	8%	0.08	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	168.8	-178	65.9	0	0	0	0	111.7	A624 V657 N658 V671	A624-T673 PolarHBondContact N-O 3.48Å; A624-T673 PolarHBondContact O-N 3.33Å; V657-T673 HydrophobicContact CG1-CG2 4.43Å; N658-T673 VanDerWaalsContact O-CA 3.29Å; N658-T673 WeakPolarHBondContact O-CA 3.19Å; N658-T673 WeakPolarHBondContact O-CB 3.44Å; V671-T673 HydrophobicContact CG1-CG2 4.17Å
674	E	91	Very high	87.3	Confident	38 Å²	38	29.5 Å²	29.5	18%	0.178	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55	142.2	171.1	-66.1	175.1	151.4	0	0	112	H652 N658 L660 K803	H652-E674 IonicContact CE1-OE1 3.89Å; N658-E674 HydrophobicContact CB-CG 4.1Å; N658-E674 PolarHBondContact N-OE2 2.84Å; N658-E674 VanDerWaalsContact N-OE2 3.16Å; N658-E674 VanDerWaalsContact ND2-CD 3.3Å; N658-E674 PolarHBondContact ND2-OE1 3.39Å; N658-E674 PolarHBondContact ND2-OE2 2.97Å; N658-E674 PolarHBondContact O-N 3.1Å; N658-E674 VanDerWaalsContact O-N 3.13Å; L660-E674 HydrophobicContact CD1-CG 4.16Å; L660-E674 HydrophobicContact CD2-CG 3.95Å; L660-E674 HydrophobicContact CG-CG 4.17Å; E674-K803 IonicContact OE1-NZ 3.45Å; E674-K803 WeakPolarHBondContact OE2-CE 3.24Å; E674-K803 IonicContact OE2-NZ 2.73Å; E674-K803 PolarHBondContact OE2-NZ 2.78Å
675	Y	89.9	Confident	87.3	Confident	35 Å²	35	28.6 Å²	28.6	14%	0.137	18%	0.178	C	C	.	.			trans	-89.6	125.2	174.8	177.2	-110	0	0	0	110.9	L598 E608 T739	L598-Y675 HydrophobicContact CD1-CD2 3.85Å; L598-Y675 HydrophobicContact CD1-CE2 3.62Å; L598-Y675 HydrophobicContact CD2-CE2 3.88Å; L598-Y675 HydrophobicContact CG-CE2 4.41Å; E608-Y675 HydrophobicContact CG-CE2 4.44Å; Y675-T739 PolarHBondContact OH-OG1 3.05Å; Y675-T739 VanDerWaalsContact OH-OG1 3.11Å
676	C	89.3	Confident	87.5	Confident	11 Å²	11	27.7 Å²	27.7	7%	0.074	17%	0.174	C	C	.	.			trans	-107.9	105.5	175.8	-63.8	0	0	0	0	109.5	L678 G679 L795 L796	C676-L678 PolarHBondContact O-N 2.93Å; C676-G679 PolarHBondContact O-N 3.3Å; C676-L795 HydrophobicContact CB-CB 3.53Å; C676-L795 HydrophobicContact CB-CD1 3.73Å; C676-L795 HydrophobicContact CB-CG 4.31Å; C676-L796 CarbonylContact C-O 3.52Å; C676-L796 WeakPolarHBondContact CB-O 3.23Å
677	S	84.3	Confident	87.9	Confident	27 Å²	27	29.6 Å²	29.6	19%	0.189	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-21.6	-165.9	60.6	0	0	0	0	115.4	P738 L796 S798	S677-P738 VanDerWaalsContact O-CB 3.22Å; S677-P738 WeakPolarHBondContact O-CB 3.44Å; S677-L796 PolarHBondContact N-O 3.45Å; S677-S798 WeakPolarHBondContact OG-CA 3.48Å; S677-S798 WeakPolarHBondContact OG-CB 3.48Å; S677-S798 PolarHBondContact OG-N 3.2Å
678	L	84	Confident	87.8	Confident	36 Å²	36	29.1 Å²	29.1	19%	0.188	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	0.5	-177.9	-63.5	-178.1	0	0	0	113.3	C676 F684 L796 T797 R800	C676-L678 PolarHBondContact O-N 2.93Å; L678-F684 HydrophobicContact CB-CD2 4.38Å; L678-F684 HydrophobicContact CD1-CE2 4.01Å; L678-L796 HydrophobicContact CB-CB 3.68Å; L678-L796 WeakPolarHBondContact CB-O 3.31Å; L678-L796 HydrophobicContact CD1-CB 4.2Å; L678-L796 HydrophobicContact CG-CB 4.48Å; L678-L796 PolarHBondContact N-O 2.89Å; L678-T797 WeakPolarHBondContact CD1-O 3.32Å; L678-T797 WeakPolarHBondContact CG-O 3.44Å; L678-R800 HydrophobicContact CD1-CG 4Å
679	G	87.2	Confident	87.4	Confident	6 Å²	6	25.4 Å²	25.4	6%	0.062	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.8	-155.5	-179.5	0	0	0	0	0	112.9	C676 L795 L796	C676-G679 PolarHBondContact O-N 3.3Å; G679-L795 CarbonylContact O-C 3.58Å; G679-L795 VanDerWaalsContact O-CA 3.3Å; G679-L795 WeakPolarHBondContact O-CA 3.21Å; G679-L796 PolarHBondContact O-N 2.81Å
680	D	88.3	Confident	86.5	Confident	10 Å²	10	31.8 Å²	31.8	5%	0.053	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	149.3	179.2	69	94.7	0	0	0	113.2	L682 N683 F684 V794 L795	D680-L682 VanDerWaalsContact C-N 3.29Å; D680-L682 PolarHBondContact O-N 2.85Å; D680-L682 WeakPolarHBondContact OD1-CB 3.37Å; D680-L682 PolarHBondContact OD1-N 2.82Å; D680-N683 PolarHBondContact O-N 3.36Å; D680-N683 PolarHBondContact OD1-N 3.26Å; D680-N683 PolarHBondContact OD1-ND2 3.06Å; D680-N683 PolarHBondContact OD2-ND2 3.07Å; D680-F684 WeakPolarHBondContact O-CB 3.31Å; D680-F684 PolarHBondContact O-N 3.36Å; D680-V794 CarbonylContact C-O 3.56Å; D680-V794 WeakPolarHBondContact CA-O 3.45Å; D680-L795 HydrophobicContact CB-CD2 3.85Å
681	L	91.3	Very high	85.4	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-35	-175.7	178.8	61.8	0	0	0	112	F684 L685 F768 V794 L796 I858	L681-F684 HydrophobicContact CD1-CD1 4.43Å; L681-F684 PolarHBondContact O-N 3.32Å; L681-L685 HydrophobicContact CD1-CD1 4.05Å; L681-L685 HydrophobicContact CD1-CD2 4.3Å; L681-L685 HydrophobicContact CD1-CG 3.89Å; L681-L685 HydrophobicContact CG-CD1 3.89Å; L681-L685 HydrophobicContact CG-CG 4.21Å; L681-L685 WeakPolarHBondContact O-CB 3.42Å; L681-L685 WeakPolarHBondContact O-CG 3.27Å; L681-L685 PolarHBondContact O-N 3.16Å; L681-F768 HydrophobicContact CD1-CD2 3.63Å; L681-F768 HydrophobicContact CD1-CE2 3.89Å; L681-F768 HydrophobicContact CD1-CG 4.13Å; L681-F768 HydrophobicContact CD2-CB 4.46Å; L681-V794 HydrophobicContact CB-CB 4.01Å; L681-V794 HydrophobicContact CB-CG1 4.18Å; L681-V794 WeakPolarHBondContact CB-O 3.4Å; L681-V794 HydrophobicContact CD2-CB 4.14Å; L681-V794 HydrophobicContact CD2-CG1 3.98Å; L681-V794 PolarHBondContact N-O 3.01Å; L681-L796 HydrophobicContact CD1-CD1 3.81Å; L681-L796 HydrophobicContact CD1-CD2 4.42Å; L681-L796 HydrophobicContact CD1-CG 4.32Å; L681-I858 HydrophobicContact CD2-CD1 4.09Å; L681-I858 HydrophobicContact CD2-CG1 3.98Å
682	L	88.9	Confident	84.4	Confident	13 Å²	13	34.3 Å²	34.3	7%	0.068	17%	0.169	C	C	.	.	H	α-helix	trans	-61.5	-50.7	179.4	176.9	64.5	0	0	0	111.5	D680 L685 R686 A791 R792 G862	D680-L682 VanDerWaalsContact C-N 3.29Å; D680-L682 PolarHBondContact O-N 2.85Å; D680-L682 WeakPolarHBondContact OD1-CB 3.37Å; D680-L682 PolarHBondContact OD1-N 2.82Å; L682-L685 PolarHBondContact O-N 3.19Å; L682-R686 WeakPolarHBondContact O-CG 3.24Å; L682-R686 PolarHBondContact O-N 3.46Å; L682-R686 VanDerWaalsContact O-N 3.1Å; L682-A791 HydrophobicContact CB-CB 3.88Å; L682-A791 HydrophobicContact CD1-CB 4.39Å; L682-A791 PolarHBondContact N-O 3.06Å; L682-R792 HydrophobicContact CD2-CB 4.21Å; L682-G862 WeakPolarHBondContact CD1-O 3.31Å
683	N	83.9	Confident	83	Confident	56 Å²	56	36.6 Å²	36.6	30%	0.299	18%	0.183	S	C	.	.	H	α-helix	trans	-68.3	-38.1	178.6	-75.1	-38.9	0	0	0	112.1	D680 R686 Q687	D680-N683 PolarHBondContact O-N 3.36Å; D680-N683 PolarHBondContact OD1-N 3.26Å; D680-N683 PolarHBondContact OD1-ND2 3.06Å; D680-N683 PolarHBondContact OD2-ND2 3.07Å; N683-R686 PolarHBondContact O-N 3.31Å; N683-Q687 WeakPolarHBondContact O-CB 3.5Å; N683-Q687 PolarHBondContact O-N 2.91Å
684	F	88.2	Confident	81.3	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.035	20%	0.198	C	C	.	.	H	α-helix	trans	-58.9	-46.9	174.9	179.5	-96.6	0	0	0	112.1	L678 D680 L681 Q687 K688 L760 F768 L796	L678-F684 HydrophobicContact CB-CD2 4.38Å; L678-F684 HydrophobicContact CD1-CE2 4.01Å; D680-F684 WeakPolarHBondContact O-CB 3.31Å; D680-F684 PolarHBondContact O-N 3.36Å; L681-F684 HydrophobicContact CD1-CD1 4.43Å; L681-F684 PolarHBondContact O-N 3.32Å; F684-Q687 PolarHBondContact O-N 2.79Å; F684-K688 HydrophobicContact CE2-CG 4.44Å; F684-K688 HydrophobicContact CZ-CG 4.32Å; F684-K688 WeakPolarHBondContact O-CG 3.29Å; F684-K688 PolarHBondContact O-N 3.29Å; F684-K688 VanDerWaalsContact O-N 3.09Å; F684-L760 HydrophobicContact CE1-CD1 4.01Å; F684-F768 HydrophobicContact CD1-CE2 4.46Å; F684-F768 HydrophobicContact CE1-CE2 4.05Å; F684-F768 AromaticContact CE1-CZ 3.97Å; F684-F768 HydrophobicContact CE1-CZ 3.97Å; F684-L796 HydrophobicContact CB-CD1 3.87Å; F684-L796 HydrophobicContact CD1-CD1 3.36Å; F684-L796 HydrophobicContact CD2-CD1 4.01Å; F684-L796 HydrophobicContact CE1-CD1 3.8Å; F684-L796 HydrophobicContact CE2-CD1 4.4Å; F684-L796 HydrophobicContact CG-CD1 3.47Å; F684-L796 VanDerWaalsContact CG-CD1 3.47Å; F684-L796 HydrophobicContact CZ-CD1 4.31Å
685	L	88.9	Confident	79.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-47.1	177.2	-71.3	169.6	0	0	0	111.6	L681 L682 Q687 K688 A689 L760 L765 I858	L681-L685 HydrophobicContact CD1-CD1 4.05Å; L681-L685 HydrophobicContact CD1-CD2 4.3Å; L681-L685 HydrophobicContact CD1-CG 3.89Å; L681-L685 HydrophobicContact CG-CD1 3.89Å; L681-L685 HydrophobicContact CG-CG 4.21Å; L681-L685 WeakPolarHBondContact O-CB 3.42Å; L681-L685 WeakPolarHBondContact O-CG 3.27Å; L681-L685 PolarHBondContact O-N 3.16Å; L682-L685 PolarHBondContact O-N 3.19Å; L685-Q687 VanDerWaalsContact C-N 3.32Å; L685-Q687 PolarHBondContact O-N 3.27Å; L685-K688 CarbonylContact O-C 3.56Å; L685-K688 PolarHBondContact O-N 3.1Å; L685-K688 VanDerWaalsContact O-N 3.16Å; L685-A689 WeakPolarHBondContact O-CA 3.39Å; L685-A689 WeakPolarHBondContact O-CB 3.38Å; L685-A689 PolarHBondContact O-N 2.88Å; L685-L760 HydrophobicContact CD2-CD2 3.81Å; L685-L765 HydrophobicContact CD2-CD2 3.61Å; L685-I858 HydrophobicContact CD1-CG1 4.39Å
686	R	86.5	Confident	77.6	Confident	110 Å²	110	38.2 Å²	38.2	42%	0.415	20%	0.195	S	C	.	.	H	α-helix	trans	-60.5	-40.8	177.8	-74.2	175.4	175.6	174	-0.7	112.5	L682 N683 K688 A689 G862	L682-R686 WeakPolarHBondContact O-CG 3.24Å; L682-R686 PolarHBondContact O-N 3.46Å; L682-R686 VanDerWaalsContact O-N 3.1Å; N683-R686 PolarHBondContact O-N 3.31Å; R686-K688 VanDerWaalsContact C-N 3.3Å; R686-K688 PolarHBondContact O-N 2.91Å; R686-A689 WeakPolarHBondContact O-CB 3.41Å; R686-A689 PolarHBondContact O-N 2.95Å; R686-G862 PolarHBondContact NE-O 2.86Å; R686-G862 PolarHBondContact NH2-O 2.79Å
687	Q	83.1	Confident	75.3	Confident	124 Å²	124	42 Å²	42	58%	0.579	21%	0.213	S	C	*	.	H	α-helix	trans	-65.3	-35.1	178	-172.5	-179.1	19.1	0	0	111.9	N683 F684 L685	N683-Q687 WeakPolarHBondContact O-CB 3.5Å; N683-Q687 PolarHBondContact O-N 2.91Å; F684-Q687 PolarHBondContact O-N 2.79Å; L685-Q687 VanDerWaalsContact C-N 3.32Å; L685-Q687 PolarHBondContact O-N 3.27Å
688	K	80.6	Confident	73.3	Confident	27 Å²	27	42.5 Å²	42.5	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-93.2	-3.5	-179.2	-65.3	-69.3	-177.2	172.5	0	113.5	F684 L685 R686 E690 T691 F692 L760	F684-K688 HydrophobicContact CE2-CG 4.44Å; F684-K688 HydrophobicContact CZ-CG 4.32Å; F684-K688 WeakPolarHBondContact O-CG 3.29Å; F684-K688 PolarHBondContact O-N 3.29Å; F684-K688 VanDerWaalsContact O-N 3.09Å; L685-K688 CarbonylContact O-C 3.56Å; L685-K688 PolarHBondContact O-N 3.1Å; L685-K688 VanDerWaalsContact O-N 3.16Å; R686-K688 VanDerWaalsContact C-N 3.3Å; R686-K688 PolarHBondContact O-N 2.91Å; K688-E690 PolarHBondContact O-N 3.21Å; K688-T691 PolarHBondContact O-N 3.49Å; K688-F692 WeakPolarHBondContact O-CB 3.31Å; K688-F692 PolarHBondContact O-N 3.3Å; K688-L760 HydrophobicContact CB-CB 3.95Å; K688-L760 HydrophobicContact CB-CD2 3.96Å; K688-L760 HydrophobicContact CG-CB 4.46Å
689	A	78	Confident	71.2	Confident	8 Å²	8	44.8 Å²	44.8	7%	0.066	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-46.1	-173.6	0	0	0	0	0	112.8	L685 R686 T691 F692 V693 L861	L685-A689 WeakPolarHBondContact O-CA 3.39Å; L685-A689 WeakPolarHBondContact O-CB 3.38Å; L685-A689 PolarHBondContact O-N 2.88Å; R686-A689 WeakPolarHBondContact O-CB 3.41Å; R686-A689 PolarHBondContact O-N 2.95Å; A689-T691 PolarHBondContact O-N 3.19Å; A689-F692 PolarHBondContact O-N 3.2Å; A689-V693 WeakPolarHBondContact O-CG2 3.45Å; A689-V693 PolarHBondContact O-N 2.88Å; A689-L861 HydrophobicContact CB-CB 3.9Å; A689-L861 HydrophobicContact CB-CD1 4.15Å
690	E	65.9	Low	68.7	Low	141 Å²	141	47.4 Å²	47.4	66%	0.659	24%	0.241	S	C	*	.	H	α-helix	trans	-62.5	-42.7	178.6	-66	-174.1	169.7	0	0	111.7	K688 F692 N694	K688-E690 PolarHBondContact O-N 3.21Å; E690-F692 VanDerWaalsContact C-N 3.33Å; E690-F692 PolarHBondContact O-N 3.08Å; E690-N694 WeakPolarHBondContact O-CB 3.42Å; E690-N694 VanDerWaalsContact O-CG 3.27Å; E690-N694 PolarHBondContact O-N 3.46Å; E690-N694 VanDerWaalsContact O-N 3.13Å
691	T	67.5	Low	66.1	Low	58 Å²	58	56.1 Å²	56.1	36%	0.356	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176.5	-43.1	0	0	0	0	111.6	K688 A689 F695 P759	K688-T691 PolarHBondContact O-N 3.49Å; A689-T691 PolarHBondContact O-N 3.19Å; T691-F695 VanDerWaalsContact O-CB 3.25Å; T691-F695 WeakPolarHBondContact O-CB 3.47Å; T691-F695 PolarHBondContact O-N 3.47Å; T691-F695 VanDerWaalsContact O-N 3.11Å; T691-P759 HydrophobicContact CG2-CB 4.34Å
692	F	71.5	Confident	63.2	Low	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-71.4	-41.5	179.3	-173.8	-78.8	0	0	0	112.7	K688 A689 E690 F695 V696 L760 I762 L765 L861 F890	K688-F692 WeakPolarHBondContact O-CB 3.31Å; K688-F692 PolarHBondContact O-N 3.3Å; A689-F692 PolarHBondContact O-N 3.2Å; E690-F692 VanDerWaalsContact C-N 3.33Å; E690-F692 PolarHBondContact O-N 3.08Å; F692-F695 VanDerWaalsContact O-CB 3.29Å; F692-F695 WeakPolarHBondContact O-CB 3.23Å; F692-F695 PolarHBondContact O-N 3.15Å; F692-V696 HydrophobicContact CD1-CG2 3.84Å; F692-V696 HydrophobicContact CE1-CB 4.5Å; F692-V696 HydrophobicContact CE1-CG2 3.46Å; F692-V696 VanDerWaalsContact CE1-CG2 3.46Å; F692-V696 HydrophobicContact CZ-CG2 3.92Å; F692-V696 WeakPolarHBondContact O-CG2 3.22Å; F692-V696 PolarHBondContact O-N 3.32Å; F692-L760 HydrophobicContact CD2-CB 4.01Å; F692-L760 HydrophobicContact CD2-CD2 3.96Å; F692-L760 HydrophobicContact CD2-CG 3.79Å; F692-L760 VanDerWaalsContact CD2-O 3.23Å; F692-L760 WeakPolarHBondContact CD2-O 3.29Å; F692-L760 HydrophobicContact CE2-CG 4.29Å; F692-I762 HydrophobicContact CE2-CG1 4.41Å; F692-I762 HydrophobicContact CZ-CG1 3.84Å; F692-L765 HydrophobicContact CE2-CD1 3.96Å; F692-L765 HydrophobicContact CE2-CG 4.37Å; F692-L765 HydrophobicContact CZ-CD1 3.75Å; F692-L861 HydrophobicContact CB-CD1 4Å; F692-L861 HydrophobicContact CD1-CD1 3.42Å; F692-L861 VanDerWaalsContact CD1-CD1 3.42Å; F692-L861 HydrophobicContact CD1-CD2 3.91Å; F692-L861 HydrophobicContact CD1-CG 4.23Å; F692-L861 HydrophobicContact CD2-CD2 4.32Å; F692-L861 HydrophobicContact CE1-CD1 4.12Å; F692-L861 HydrophobicContact CE1-CD2 4.12Å; F692-L861 HydrophobicContact CG-CD1 3.9Å; F692-L861 HydrophobicContact CG-CD2 4.01Å; F692-L861 HydrophobicContact CZ-CD2 4.43Å; F692-F890 HydrophobicContact CD1-CD1 4.28Å; F692-F890 HydrophobicContact CD1-CD2 4.48Å; F692-F890 HydrophobicContact CD1-CE1 4.31Å; F692-F890 HydrophobicContact CD1-CG 4.35Å; F692-F890 HydrophobicContact CD1-CZ 4.45Å; F692-F890 HydrophobicContact CE1-CB 3.96Å; F692-F890 AromaticContact CE1-CD1 3.61Å; F692-F890 HydrophobicContact CE1-CD1 3.61Å; F692-F890 HydrophobicContact CE1-CD2 4.07Å; F692-F890 HydrophobicContact CE1-CE1 4.08Å; F692-F890 AromaticContact CE1-CG 3.59Å; F692-F890 HydrophobicContact CE1-CG 3.59Å; F692-F890 HydrophobicContact CZ-CB 4.38Å; F692-F890 HydrophobicContact CZ-CG 4.46Å
693	V	62	Low	60.4	Low	47 Å²	47	66.1 Å²	66.1	29%	0.285	35%	0.349	S	S	.	.	H	α-helix	trans	-66.8	-41.8	178.9	176.3	0	0	0	0	110.4	A689 F695 V696 M697 L861 F890	A689-V693 WeakPolarHBondContact O-CG2 3.45Å; A689-V693 PolarHBondContact O-N 2.88Å; V693-F695 PolarHBondContact O-N 2.8Å; V693-V696 PolarHBondContact O-N 3.28Å; V693-M697 HydrophobicContact CG1-CE 4.13Å; V693-M697 HydrophobicContact CG1-CG 3.77Å; V693-M697 WeakPolarHBondContact O-CB 3.4Å; V693-M697 WeakPolarHBondContact O-CG 3.38Å; V693-M697 PolarHBondContact O-N 3.33Å; V693-L861 HydrophobicContact CG2-CD1 3.91Å; V693-F890 HydrophobicContact CB-CZ 4.48Å; V693-F890 HydrophobicContact CG2-CE2 4.17Å; V693-F890 HydrophobicContact CG2-CZ 3.6Å
694	N	56.3	Low	58.1	Low	75 Å²	75	72.2 Å²	72.2	40%	0.401	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-30	174.3	-67.7	-5.3	0	0	0	112.1	E690 N698	E690-N694 WeakPolarHBondContact O-CB 3.42Å; E690-N694 VanDerWaalsContact O-CG 3.27Å; E690-N694 PolarHBondContact O-N 3.46Å; E690-N694 VanDerWaalsContact O-N 3.13Å; N694-N698 PolarHBondContact O-ND2 3.07Å
695	F	54.5	Low	55.3	Low	13 Å²	13	79.8 Å²	79.8	6%	0.057	42%	0.416	C	S	.	.	H	α-helix	trans	-68.8	-44.4	173.4	175.8	-65.2	0	0	0	112	Y217 T691 F692 V693 P759 D761	Y217-F695 AromaticContact CD1-CE2 3.78Å; Y217-F695 HydrophobicContact CD1-CE2 3.78Å; Y217-F695 HydrophobicContact CD1-CZ 4.04Å; Y217-F695 HydrophobicContact CD2-CD1 4.38Å; Y217-F695 HydrophobicContact CD2-CD2 4.45Å; Y217-F695 AromaticContact CD2-CE1 3.66Å; Y217-F695 HydrophobicContact CD2-CE1 3.66Å; Y217-F695 AromaticContact CD2-CE2 3.72Å; Y217-F695 HydrophobicContact CD2-CE2 3.72Å; Y217-F695 AromaticContact CD2-CZ 3.24Å; Y217-F695 HydrophobicContact CD2-CZ 3.24Å; Y217-F695 AromaticContact CE1-CD2 3.62Å; Y217-F695 HydrophobicContact CE1-CD2 3.62Å; Y217-F695 AromaticContact CE1-CE2 3.17Å; Y217-F695 HydrophobicContact CE1-CE2 3.17Å; Y217-F695 AromaticContact CE1-CZ 3.8Å; Y217-F695 HydrophobicContact CE1-CZ 3.8Å; Y217-F695 AromaticContact CE2-CD1 3.52Å; Y217-F695 HydrophobicContact CE2-CD1 3.52Å; Y217-F695 AromaticContact CE2-CD2 3.48Å; Y217-F695 HydrophobicContact CE2-CD2 3.48Å; Y217-F695 VanDerWaalsContact CE2-CD2 3.48Å; Y217-F695 AromaticContact CE2-CE1 3.22Å; Y217-F695 HydrophobicContact CE2-CE1 3.22Å; Y217-F695 AromaticContact CE2-CE2 3.16Å; Y217-F695 HydrophobicContact CE2-CE2 3.16Å; Y217-F695 AromaticContact CE2-CG 3.6Å; Y217-F695 HydrophobicContact CE2-CG 3.6Å; Y217-F695 AromaticContact CE2-CZ 3Å; Y217-F695 HydrophobicContact CE2-CZ 3Å; Y217-F695 HydrophobicContact CG-CE2 4.04Å; Y217-F695 AromaticContact CG-CZ 3.81Å; Y217-F695 HydrophobicContact CG-CZ 3.81Å; Y217-F695 AromaticContact CZ-CD1 3.94Å; Y217-F695 AromaticContact CZ-CD2 2.99Å; Y217-F695 AromaticContact CZ-CE1 3.87Å; Y217-F695 AromaticContact CZ-CE2 2.88Å; Y217-F695 AromaticContact CZ-CG 3.5Å; Y217-F695 VanDerWaalsContact CZ-CG 3.5Å; Y217-F695 AromaticContact CZ-CZ 3.35Å; Y217-F695 WeakPolarHBondContact OH-CD2 3.41Å; Y217-F695 VanDerWaalsContact OH-CE2 3.25Å; Y217-F695 WeakPolarHBondContact OH-CE2 3.45Å; Y217-F695 WeakPolarHBondContact OH-CG 3.38Å; T691-F695 VanDerWaalsContact O-CB 3.25Å; T691-F695 WeakPolarHBondContact O-CB 3.47Å; T691-F695 PolarHBondContact O-N 3.47Å; T691-F695 VanDerWaalsContact O-N 3.11Å; F692-F695 VanDerWaalsContact O-CB 3.29Å; F692-F695 WeakPolarHBondContact O-CB 3.23Å; F692-F695 PolarHBondContact O-N 3.15Å; V693-F695 PolarHBondContact O-N 2.8Å; F695-P759 HydrophobicContact CD2-CB 4.37Å; F695-D761 HydrophobicContact CZ-CB 4.22Å
696	V	49	Very low	52.4	Low	32 Å²	32	84.2 Å²	84.2	19%	0.194	45%	0.447	C	S	.	.	H	α-helix	trans	-83.4	-36.2	-175	175.9	0	0	0	0	113.5	F692 V693 N698 I699 F890	F692-V696 HydrophobicContact CD1-CG2 3.84Å; F692-V696 HydrophobicContact CE1-CB 4.5Å; F692-V696 HydrophobicContact CE1-CG2 3.46Å; F692-V696 VanDerWaalsContact CE1-CG2 3.46Å; F692-V696 HydrophobicContact CZ-CG2 3.92Å; F692-V696 WeakPolarHBondContact O-CG2 3.22Å; F692-V696 PolarHBondContact O-N 3.32Å; V693-V696 PolarHBondContact O-N 3.28Å; V696-N698 PolarHBondContact O-N 3.07Å; V696-I699 PolarHBondContact O-N 3.42Å; V696-F890 HydrophobicContact CB-CD1 4.39Å; V696-F890 HydrophobicContact CB-CE1 4.2Å; V696-F890 HydrophobicContact CG1-CD1 4.03Å; V696-F890 HydrophobicContact CG1-CE1 4.07Å; V696-F890 HydrophobicContact CG2-CD1 4.4Å
697	M	41.8	Very low	49.9	Very low	92 Å²	92	86.7 Å²	86.7	45%	0.453	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.1	-179.2	-66.1	-61.2	156.9	0	0	114	V693 I712 F890	V693-M697 HydrophobicContact CG1-CE 4.13Å; V693-M697 HydrophobicContact CG1-CG 3.77Å; V693-M697 WeakPolarHBondContact O-CB 3.4Å; V693-M697 WeakPolarHBondContact O-CG 3.38Å; V693-M697 PolarHBondContact O-N 3.33Å; M697-I712 HydrophobicContact CE-CD1 3.15Å; M697-I712 HydrophobicContact SD-CD1 3.88Å; M697-F890 HydrophobicContact CE-CE1 4.1Å; M697-F890 HydrophobicContact CE-CZ 4.42Å
698	N	42.8	Very low	47.6	Very low	36 Å²	36	88 Å²	88	19%	0.193	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	17.4	-178.8	-84.5	-40.9	0	0	0	113.6	S303 T304 N694 V696	S303-N698 CarbonylContact C-O 3.6Å; T304-N698 HydrophobicContact CG2-CB 3.44Å; T304-N698 VanDerWaalsContact CG2-CB 3.44Å; N694-N698 PolarHBondContact O-ND2 3.07Å; V696-N698 PolarHBondContact O-N 3.07Å
699	I	38.4	Very low	45.3	Very low	85 Å²	85	94.8 Å²	94.8	44%	0.436	51%	0.505	S	S	.	.			trans	-94.6	117.6	172.4	-58.2	172.7	0	0	0	109	V696	V696-I699 PolarHBondContact O-N 3.42Å
700	P	34.7	Very low	43.1	Very low	61 Å²	61	103.7 Å²	103.7	40%	0.396	54%	0.543	S	S	.	.			trans	-87.6	122.2	174.7	17.1	-1.9	0	0	0	111.2	S303	S303-P700 WeakPolarHBondContact O-CD 3.32Å; S303-P700 VanDerWaalsContact O-CG 3.24Å; S303-P700 WeakPolarHBondContact O-CG 3.2Å; S303-P700 WeakPolarHBondContact OG-CG 3.46Å
701	E	33.4	Very low	41.5	Very low	192 Å²	192	104.5 Å²	104.5	90%	0.897	55%	0.552	S	S	*	*			trans	35.9	100.5	155.6	-65.6	-176.8	166.5	0	0	118.1
702	I	31.7	Very low	39.7	Very low	160 Å²	160	106.2 Å²	106.2	82%	0.821	56%	0.557	S	S	*	*			trans	-87	118.6	148.2	-65.6	176.1	0	0	0	107.2	E704	I702-E704 PolarHBondContact O-N 3.02Å
703	G	29.2	Very low	37.7	Very low	64 Å²	64	111.6 Å²	111.6	66%	0.66	59%	0.594	S	S	*	*			trans	-55.4	130.9	-177.1	0	0	0	0	0	114.1
704	E	35	Very low	36.3	Very low	183 Å²	183	115.8 Å²	115.8	86%	0.855	61%	0.613	S	S	*	*	S	Bend	trans	32.6	87	149.2	-64.1	-174.7	162.5	0	0	117.6	I702	I702-E704 PolarHBondContact O-N 3.02Å
705	N	30.3	Very low	35	Very low	168 Å²	168	118.9 Å²	118.9	90%	0.898	63%	0.625	S	S	*	*	S	Bend		-168.8	60.2	122	-96.2	-20.7	0	0	0	112
706	S	28.5	Very low	34	Very low	92 Å²	92	126.5 Å²	126.5	64%	0.643	66%	0.659	S	S	*	*			trans	-168.6	100	150.3	49.2	0	0	0	0	109.1	D708	S706-D708 PolarHBondContact O-N 3.28Å; S706-D708 VanDerWaalsContact O-N 3.11Å
707	N	34.2	Very low	33	Very low	162 Å²	162	131.2 Å²	131.2	87%	0.866	68%	0.678	S	S	*	*			trans	-61.8	109.5	162.2	-73.8	-34.7	0	0	0	107.3
708	D	33.5	Very low	32.5	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	69%	0.693	S	S	*	*			trans	179.1	36.6	149.4	-89	-13.4	0	0	0	115.1	S706	S706-D708 PolarHBondContact O-N 3.28Å; S706-D708 VanDerWaalsContact O-N 3.11Å
709	Y	33.6	Very low	31.8	Very low	168 Å²	168	138.3 Å²	138.3	66%	0.659	71%	0.709	S	S	*	*			trans	-113.9	12.3	170.8	-66.5	-72.4	0	0	0	114.9	N711	Y709-N711 PolarHBondContact O-N 3.01Å
710	K	30.8	Very low	31.5	Very low	196 Å²	196	145.6 Å²	145.6	85%	0.852	73%	0.731	S	S	*	*			trans	-94	93.7	170.1	-75.3	-175.6	178.3	175.4	0	109.3
711	N	31.8	Very low	31.2	Very low	158 Å²	158	146.4 Å²	146.4	85%	0.845	74%	0.738	S	S	*	*			trans	154	66.6	142.9	-74.8	-32.1	0	0	0	110.7	Y709 C713	Y709-N711 PolarHBondContact O-N 3.01Å; N711-C713 PolarHBondContact O-N 3.05Å; N711-C713 VanDerWaalsContact O-N 3.12Å
712	I	31.5	Very low	30.9	Very low	93 Å²	93	141.4 Å²	141.4	48%	0.477	72%	0.718	S	S	.	*			trans	-76.8	98.1	161.4	-68.5	178.2	0	0	0	107	M697 I714	M697-I712 HydrophobicContact CE-CD1 3.15Å; M697-I712 HydrophobicContact SD-CD1 3.88Å; I712-I714 PolarHBondContact O-N 2.88Å
713	C	27.6	Very low	30.7	Very low	113 Å²	113	138.5 Å²	138.5	76%	0.764	71%	0.711	S	S	*	*			trans	-69.5	108.4	163.6	-168.2	0	0	0	0	106.6	N711 Q715	N711-C713 PolarHBondContact O-N 3.05Å; N711-C713 VanDerWaalsContact O-N 3.12Å; C713-Q715 PolarHBondContact O-N 2.86Å
714	I	32.5	Very low	30.7	Very low	135 Å²	135	139.3 Å²	139.3	69%	0.692	72%	0.72	S	S	*	*			trans	-66	89.9	170.2	-56.6	173.3	0	0	0	106.3	I712 K716	I712-I714 PolarHBondContact O-N 2.88Å; I714-K716 HydrophobicContact CG2-CG 3.89Å; I714-K716 PolarHBondContact O-N 2.93Å
715	Q	30.3	Very low	30.3	Very low	141 Å²	141	137.6 Å²	137.6	66%	0.659	72%	0.715	S	S	*	*			trans	-72.2	81.3	167.3	-156.4	161.6	0.7	0	0	106.6	C713 Q717	C713-Q715 PolarHBondContact O-N 2.86Å; Q715-Q717 PolarHBondContact O-N 2.89Å
716	K	32.6	Very low	30.2	Very low	173 Å²	173	134.9 Å²	134.9	75%	0.752	71%	0.71	S	S	*	*			trans	-57.5	92.4	162.3	-82	-175.8	174.8	177.4	0	107.3	I714	I714-K716 HydrophobicContact CG2-CG 3.89Å; I714-K716 PolarHBondContact O-N 2.93Å
717	Q	29	Very low	30	Very low	131 Å²	131	133.7 Å²	133.7	61%	0.612	70%	0.701	S	S	*	*			trans	177.5	90	152.6	-101.2	170.7	-10	0	0	107.9	Q715 I719	Q715-Q717 PolarHBondContact O-N 2.89Å; Q717-I719 HydrophobicContact CB-CB 4.18Å; Q717-I719 HydrophobicContact CB-CG1 4.32Å; Q717-I719 HydrophobicContact CG-CB 4.03Å; Q717-I719 HydrophobicContact CG-CD1 3.63Å; Q717-I719 HydrophobicContact CG-CG1 3.74Å; Q717-I719 PolarHBondContact O-N 3.42Å
718	F	30.7	Very low	29.7	Very low	175 Å²	175	135.1 Å²	135.1	77%	0.768	70%	0.7	S	S	*	*			trans	-75.1	48.5	145.1	-71.7	-74.1	0	0	0	108.8
719	I	27.9	Very low	29.5	Very low	102 Å²	102	132.2 Å²	132.2	52%	0.523	70%	0.697	S	S	.	*	S	Bend	trans	-81.3	130.2	156.6	-71.3	-179	0	0	0	104.7	Q717 S721	Q717-I719 HydrophobicContact CB-CB 4.18Å; Q717-I719 HydrophobicContact CB-CG1 4.32Å; Q717-I719 HydrophobicContact CG-CB 4.03Å; Q717-I719 HydrophobicContact CG-CD1 3.63Å; Q717-I719 HydrophobicContact CG-CG1 3.74Å; Q717-I719 PolarHBondContact O-N 3.42Å; I719-S721 VanDerWaalsContact C-N 3.34Å; I719-S721 PolarHBondContact O-N 3.45Å; I719-S721 PolarHBondContact O-OG 3.31Å
720	R	32.4	Very low	29.4	Very low	237 Å²	237	127 Å²	127	89%	0.894	69%	0.685	S	S	*	*			trans	-46.4	95.8	165.5	-167.6	-177.4	-165.7	129.1	2.2	109.9
721	S	28.1	Very low	29.7	Very low	78 Å²	78	124 Å²	124	55%	0.545	69%	0.689	S	S	.	*			trans	-144.8	117	167	52	0	0	0	0	105.1	I719	I719-S721 VanDerWaalsContact C-N 3.34Å; I719-S721 PolarHBondContact O-N 3.45Å; I719-S721 PolarHBondContact O-OG 3.31Å
722	D	26.9	Very low	30	Very low	88 Å²	88	119 Å²	119	47%	0.471	67%	0.667	S	S	.	*	S	Bend		-143.8	128.5	53	-56.1	-42.6	0	0	0	109.7
723	S	28	Very low	30.3	Very low	98 Å²	98	118.7 Å²	118.7	69%	0.685	66%	0.66	S	S	*	*				-161.5	141.2	73.6	-56.3	0	0	0	0	109.2	I725	S723-I725 PolarHBondContact O-N 2.83Å
724	G	29.4	Very low	31.1	Very low	82 Å²	82	117.9 Å²	117.9	85%	0.845	65%	0.647	S	S	*	*			trans	-56.3	105.5	172.9	0	0	0	0	0	111.7
725	I	26.5	Very low	32	Very low	146 Å²	146	114.9 Å²	114.9	75%	0.749	63%	0.631	S	S	*	*			trans	-165.9	118.8	140.3	-85.5	147.8	0	0	0	102.7	S723 S727	S723-I725 PolarHBondContact O-N 2.83Å; I725-S727 VanDerWaalsContact C-N 3.3Å; I725-S727 PolarHBondContact O-N 2.86Å
726	S	27.5	Very low	32.4	Very low	112 Å²	112	109.5 Å²	109.5	78%	0.783	61%	0.606	S	S	*	*			trans	-59.7	92.3	165.7	51.6	0	0	0	0	108.8
727	S	25.4	Very low	33.2	Very low	66 Å²	66	109.1 Å²	109.1	46%	0.462	60%	0.6	S	S	.	*			trans	-89.9	111.5	162.3	56.6	0	0	0	0	107.3	I725 A729	I725-S727 VanDerWaalsContact C-N 3.3Å; I725-S727 PolarHBondContact O-N 2.86Å; S727-A729 PolarHBondContact O-N 2.71Å
728	F	28.1	Very low	33.8	Very low	192 Å²	192	105.4 Å²	105.4	84%	0.842	59%	0.587	S	S	*	*			trans	-38.6	111.3	162.4	-66.3	-94.4	0	0	0	108.1	S730	F728-S730 PolarHBondContact O-N 2.8Å
729	A	28.8	Very low	34.2	Very low	92 Å²	92	100 Å²	100	76%	0.76	57%	0.568	S	S	*	*			trans	-55.6	110.2	169.9	0	0	0	0	0	106.1	S727 S731	S727-A729 PolarHBondContact O-N 2.71Å; A729-S731 PolarHBondContact O-N 3.21Å
730	S	32.7	Very low	34.5	Very low	59 Å²	59	103.3 Å²	103.3	41%	0.413	58%	0.581	S	S	.	*			trans	-52	128.2	167.9	-178.8	0	0	0	0	106.3	F728 S732 Y733	F728-S730 PolarHBondContact O-N 2.8Å; S730-S732 PolarHBondContact O-N 2.79Å; S730-S732 PolarHBondContact OG-OG 2.89Å; S730-Y733 PolarHBondContact O-N 2.83Å
731	S	36.8	Very low	34.2	Very low	134 Å²	134	99.5 Å²	99.5	94%	0.937	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	12.1	-178.8	69.1	0	0	0	0	114.3	A729	A729-S731 PolarHBondContact O-N 3.21Å
732	S	36.8	Very low	34.2	Very low	52 Å²	52	100.9 Å²	100.9	36%	0.364	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.1	-4.6	-174.4	66.1	0	0	0	0	115.5	S730	S730-S732 PolarHBondContact O-N 2.79Å; S730-S732 PolarHBondContact OG-OG 2.89Å
733	Y	39.4	Very low	34.4	Very low	87 Å²	87	104.9 Å²	104.9	34%	0.341	61%	0.606	S	S	.	*			trans	-93.9	127.9	-179.5	178.3	-113.5	0	0	0	111.4	A600 S730 E735 D812	A600-Y733 WeakPolarHBondContact O-CD2 3.37Å; S730-Y733 PolarHBondContact O-N 2.83Å; Y733-E735 HydrophobicContact CE1-CG 3.62Å; Y733-D812 HydrophobicContact CD2-CB 3.44Å; Y733-D812 VanDerWaalsContact CD2-CB 3.44Å; Y733-D812 HydrophobicContact CE2-CB 3.91Å; Y733-D812 HydrophobicContact CG-CB 4.06Å
734	L	42.5	Very low	34.3	Very low	95 Å²	95	106.3 Å²	106.3	50%	0.497	61%	0.611	S	S	.	*	B	Isolated β-bridge	trans	-129.8	119.4	177	-81.4	155.8	0	0	0	109.7	I597 G599 A600	I597-L734 HydrophobicContact CG2-CD1 4.28Å; G599-L734 CarbonylContact C-O 3.45Å; G599-L734 WeakPolarHBondContact CA-O 3.47Å; A600-L734 HydrophobicContact CB-CB 4.07Å; A600-L734 HydrophobicContact CB-CD1 4.43Å; A600-L734 PolarHBondContact N-O 3.13Å; A600-L734 PolarHBondContact O-N 2.91Å
735	E	51.4	Low	34.4	Very low	73 Å²	73	110.9 Å²	110.9	34%	0.341	61%	0.611	S	S	.	*			trans	-69.3	156	174.7	-66.7	169.1	161.6	0	0	111.7	Y733 R737	Y733-E735 HydrophobicContact CE1-CG 3.62Å; E735-R737 PolarHBondContact O-N 3.38Å; E735-R737 IonicContact OE2-NH2 3.27Å; E735-R737 PolarHBondContact OE2-NH2 2.82Å
736	M	39.9	Very low	34.5	Very low	27 Å²	27	112.8 Å²	112.8	13%	0.133	62%	0.616	C	S	.	*			trans	-68.3	121.5	173.5	-88.4	-144.4	-70.3	0	0	111.6	L598 L795 F807	L598-M736 VanDerWaalsContact O-CA 3.24Å; L598-M736 WeakPolarHBondContact O-CA 3.37Å; M736-L795 HydrophobicContact CE-CD1 4.14Å; M736-L795 HydrophobicContact CE-CD2 3.38Å; M736-L795 HydrophobicContact CE-CG 4.38Å; M736-F807 HydrophobicContact CE-CB 4.49Å; M736-F807 HydrophobicContact CE-CD1 3.9Å; M736-F807 HydrophobicContact CE-CD2 3.51Å; M736-F807 HydrophobicContact CE-CE1 3.95Å; M736-F807 HydrophobicContact CE-CE2 3.6Å; M736-F807 HydrophobicContact CE-CG 3.67Å; M736-F807 HydrophobicContact CE-CZ 3.81Å; M736-F807 HydrophobicContact SD-CD1 4.25Å; M736-F807 HydrophobicContact SD-CE1 3.99Å; M736-F807 HydrophobicContact SD-CZ 4.13Å
737	R	49.2	Very low	34.3	Very low	166 Å²	166	113 Å²	113	63%	0.626	62%	0.618	S	S	*	*			trans	-130.9	142.4	-179.2	-66.6	-174.6	-178.7	-178.6	1.2	113.2	L598 E735	L598-R737 PolarHBondContact O-N 2.84Å; E735-R737 PolarHBondContact O-N 3.38Å; E735-R737 IonicContact OE2-NH2 3.27Å; E735-R737 PolarHBondContact OE2-NH2 2.82Å
738	P	41.7	Very low	34.4	Very low	53 Å²	53	121.4 Å²	121.4	34%	0.344	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-66.7	162.9	170.3	29.5	-34.8	0	0	0	111.7	S677	S677-P738 VanDerWaalsContact O-CB 3.22Å; S677-P738 WeakPolarHBondContact O-CB 3.44Å
739	T	39.3	Very low	34.2	Very low	62 Å²	62	121.1 Å²	121.1	38%	0.38	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-80.2	117	178.9	-33.9	0	0	0	0	110.6	K596 Y675	K596-T739 HydrophobicContact CD-CG2 4.42Å; K596-T739 WeakPolarHBondContact CE-OG1 3.43Å; K596-T739 PolarHBondContact NZ-OG1 3.08Å; Y675-T739 PolarHBondContact OH-OG1 3.05Å; Y675-T739 VanDerWaalsContact OH-OG1 3.11Å
740	Q	34.3	Very low	34.1	Very low	170 Å²	170	122 Å²	122	79%	0.794	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-91	130.6	162.1	-68.7	-176.6	-9.1	0	0	108.6
741	L	26.6	Very low	33.6	Very low	157 Å²	157	126.8 Å²	126.8	82%	0.822	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-66.8	138.6	171.6	-94.2	95	0	0	0	109.6
742	P	28.1	Very low	33.1	Very low	107 Å²	107	126.5 Å²	126.5	70%	0.695	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-68.2	133.4	164	27.4	-28.1	0	0	0	109.2	T744	P742-T744 PolarHBondContact O-N 2.81Å
743	N	30.6	Very low	32.7	Very low	172 Å²	172	131.6 Å²	131.6	92%	0.92	68%	0.677	S	S	*	*			trans	-56.9	110.2	167.8	-83.2	-15.3	0	0	0	109.1
744	T	25.6	Very low	32.4	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	70%	0.702	S	S	*	*			trans	-145.5	128.3	161.7	-49.9	0	0	0	0	108.8	P742	P742-T744 PolarHBondContact O-N 2.81Å
745	E	31	Very low	32.1	Very low	179 Å²	179	137.4 Å²	137.4	84%	0.836	71%	0.713	S	S	*	*			trans	-67.7	138.3	-173.2	-62.3	178.5	146.9	0	0	112.8
746	Q	28.1	Very low	31.5	Very low	186 Å²	186	135.5 Å²	135.5	87%	0.869	71%	0.713	S	S	*	*			trans	58.4	113.6	154.9	-65.9	179.5	1.3	0	0	120.9
747	S	24.3	Very low	31.8	Very low	117 Å²	117	140.9 Å²	140.9	82%	0.818	74%	0.742	S	S	*	*				175.1	119.3	98.4	61.5	0	0	0	0	113.8
748	R	27.8	Very low	32	Very low	242 Å²	242	140.1 Å²	140.1	91%	0.913	74%	0.739	S	S	*	*			trans	30.7	130.6	148.5	-62.7	-176.9	178.9	170	0.6	123
749	E	22.8	Very low	33.1	Very low	185 Å²	185	140.1 Å²	140.1	86%	0.864	74%	0.739	S	S	*	*			trans	104.8	114.4	149.7	-77.9	176.7	-179.9	0	0	120.7
750	S	27.7	Very low	34.8	Very low	110 Å²	110	137.2 Å²	137.2	77%	0.769	72%	0.722	S	S	*	*	S	Bend	trans	52.3	90.9	152.3	68.1	0	0	0	0	121.1
751	D	22.9	Very low	36.8	Very low	161 Å²	161	131.8 Å²	131.8	86%	0.861	70%	0.698	S	S	*	*				178.9	115.4	104	-113.5	-12.9	0	0	0	107.1	E753	D751-E753 PolarHBondContact O-N 3.17Å
752	C	25	Very low	39.4	Very low	127 Å²	127	127.2 Å²	127.2	86%	0.858	67%	0.674	S	S	*	*			trans	-88.5	93.6	-172.4	-52.4	0	0	0	0	109.3	E754	C752-E754 PolarHBondContact O-N 2.89Å
753	E	29.4	Very low	41.8	Very low	159 Å²	159	125.1 Å²	125.1	74%	0.743	66%	0.656	S	S	*	*			trans	-61.3	119.3	160.5	-72.9	-172.8	158.5	0	0	108.5	D751 T755	D751-E753 PolarHBondContact O-N 3.17Å; E753-T755 PolarHBondContact O-N 3.25Å
754	E	32.3	Very low	44.5	Very low	188 Å²	188	118.1 Å²	118.1	88%	0.879	62%	0.619	S	S	*	*			trans	-56.5	109.7	176	-72	-178.9	151.5	0	0	110.6	C752 G756	C752-E754 PolarHBondContact O-N 2.89Å; E754-G756 PolarHBondContact O-N 2.95Å
755	T	36	Very low	47.7	Very low	117 Å²	117	112 Å²	112	72%	0.718	58%	0.582	S	S	*	*			trans	-71.2	123.8	176.3	44	0	0	0	0	110.7	E753 D757	E753-T755 PolarHBondContact O-N 3.25Å; T755-D757 PolarHBondContact O-N 3.4Å
756	G	38.8	Very low	50.5	Low	33 Å²	33	104 Å²	104	34%	0.34	55%	0.545	S	S	.	.			trans	-71.7	48.4	-175.1	0	0	0	0	0	116.6	E754 W758 R800	E754-G756 PolarHBondContact O-N 2.95Å; G756-W758 VanDerWaalsContact C-N 3.29Å; G756-W758 PolarHBondContact O-N 3.24Å; G756-R800 PolarHBondContact O-NH2 2.86Å
757	D	45.8	Very low	53.4	Low	139 Å²	139	99.9 Å²	99.9	74%	0.743	52%	0.521	S	S	*	.			trans	-83.7	3.9	-173.1	-140.4	13	0	0	0	114.8	T755	T755-D757 PolarHBondContact O-N 3.4Å
758	W	53.6	Low	56.8	Low	150 Å²	150	94.3 Å²	94.3	57%	0.568	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-68.1	150.5	-178	-58.1	101.8	0	0	0	113.2	G756 R800	G756-W758 VanDerWaalsContact C-N 3.29Å; G756-W758 PolarHBondContact O-N 3.24Å; W758-R800 PolarHBondContact O-NH2 2.83Å
759	P	64.9	Low	60.1	Low	54 Å²	54	82.8 Å²	82.8	35%	0.351	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-61.5	154.1	172.7	25.4	-31.8	0	0	0	111.1	T691 F695 R800	T691-P759 HydrophobicContact CG2-CB 4.34Å; F695-P759 HydrophobicContact CD2-CB 4.37Å; P759-R800 PolarHBondContact O-NH1 2.76Å; P759-R800 VanDerWaalsContact O-NH1 3.14Å
760	L	75.3	Confident	63.6	Low	1 Å²	1	75 Å²	75	1%	0.005	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-81.3	139.2	172.1	179.7	68.6	0	0	0	108.1	F684 L685 K688 F692 D764 L765 F768 L861	F684-L760 HydrophobicContact CE1-CD1 4.01Å; L685-L760 HydrophobicContact CD2-CD2 3.81Å; K688-L760 HydrophobicContact CB-CB 3.95Å; K688-L760 HydrophobicContact CB-CD2 3.96Å; K688-L760 HydrophobicContact CG-CB 4.46Å; F692-L760 HydrophobicContact CD2-CB 4.01Å; F692-L760 HydrophobicContact CD2-CD2 3.96Å; F692-L760 HydrophobicContact CD2-CG 3.79Å; F692-L760 VanDerWaalsContact CD2-O 3.23Å; F692-L760 WeakPolarHBondContact CD2-O 3.29Å; F692-L760 HydrophobicContact CE2-CG 4.29Å; L760-D764 HydrophobicContact CD1-CB 3.71Å; L760-L765 HydrophobicContact CD1-CD2 4.25Å; L760-L765 HydrophobicContact CD2-CD2 4.05Å; L760-L765 HydrophobicContact CG-CD2 4.31Å; L760-F768 HydrophobicContact CD1-CE2 3.89Å; L760-F768 HydrophobicContact CD1-CZ 4.46Å; L760-L861 HydrophobicContact CD2-CD2 4.2Å
761	D	77.4	Confident	66.8	Low	56 Å²	56	71.1 Å²	71.1	30%	0.299	37%	0.373	S	S	.	.			trans	-129.6	164.1	177.8	-170.2	9.9	0	0	0	111	F695 D763 D764 L765	F695-D761 HydrophobicContact CZ-CB 4.22Å; D761-D763 PolarHBondContact O-N 2.98Å; D761-D764 WeakPolarHBondContact O-CB 3.23Å; D761-D764 PolarHBondContact O-N 3.28Å; D761-L765 PolarHBondContact O-N 3.19Å
762	I	79.4	Confident	70.4	Confident	60 Å²	60	63.5 Å²	63.5	31%	0.308	33%	0.332	S	S	.	.	H	α-helix	trans	-54.8	-37.6	178.6	-68.5	176.9	0	0	0	110.8	F692 D764 L765 L766	F692-I762 HydrophobicContact CE2-CG1 4.41Å; F692-I762 HydrophobicContact CZ-CG1 3.84Å; I762-D764 VanDerWaalsContact C-N 3.26Å; I762-D764 PolarHBondContact O-N 3.15Å; I762-L765 WeakPolarHBondContact O-CB 3.15Å; I762-L765 PolarHBondContact O-N 3.42Å; I762-L765 VanDerWaalsContact O-N 3.1Å; I762-L766 HydrophobicContact CG2-CD1 4.15Å; I762-L766 HydrophobicContact CG2-CG 4.42Å; I762-L766 WeakPolarHBondContact O-CG 3.35Å; I762-L766 PolarHBondContact O-N 2.74Å
763	D	80	Confident	73.8	Confident	63 Å²	63	57.5 Å²	57.5	34%	0.337	29%	0.291	S	S	.	.	H	α-helix	trans	-57.8	-38.1	176	-117	35.2	0	0	0	112.2	D761 R767	D761-D763 PolarHBondContact O-N 2.98Å; D763-R767 WeakPolarHBondContact O-CB 2.91Å; D763-R767 VanDerWaalsContact O-CG 3.28Å; D763-R767 WeakPolarHBondContact O-CG 3.33Å; D763-R767 PolarHBondContact O-N 3.16Å; D763-R767 IonicContact OD2-CZ 3.02Å; D763-R767 IonicContact OD2-NH1 3.28Å; D763-R767 IonicContact OD2-NH2 3.92Å; D763-R767 PolarHBondContact OD2-NH2 3.2Å
764	D	86.5	Confident	77	Confident	25 Å²	25	53 Å²	53	13%	0.134	27%	0.271	C	S	.	.	H	α-helix	trans	-70.5	-39.6	174.7	-69.5	-22.6	0	0	0	111.3	L760 D761 I762 L766 R767 F768 R800	L760-D764 HydrophobicContact CD1-CB 3.71Å; D761-D764 WeakPolarHBondContact O-CB 3.23Å; D761-D764 PolarHBondContact O-N 3.28Å; I762-D764 VanDerWaalsContact C-N 3.26Å; I762-D764 PolarHBondContact O-N 3.15Å; D764-L766 VanDerWaalsContact C-N 3.33Å; D764-L766 PolarHBondContact O-N 3.32Å; D764-R767 PolarHBondContact O-N 3.49Å; D764-R767 IonicContact OD1-NH1 3.82Å; D764-R767 PolarHBondContact OD1-NH1 2.94Å; D764-F768 HydrophobicContact CB-CE2 4.21Å; D764-F768 HydrophobicContact CB-CZ 4.22Å; D764-F768 VanDerWaalsContact O-CD2 3.24Å; D764-F768 WeakPolarHBondContact O-CD2 3.19Å; D764-F768 WeakPolarHBondContact O-CG 3.5Å; D764-F768 PolarHBondContact O-N 3.44Å; D764-R800 IonicContact OD2-NH1 3.33Å; D764-R800 PolarHBondContact OD2-NH1 3.25Å
765	L	92.1	Very high	79.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-42.2	175.2	-57.1	-175.8	0	0	0	111.7	L685 F692 L760 D761 I762 S769 I858 F859 L861	L685-L765 HydrophobicContact CD2-CD2 3.61Å; F692-L765 HydrophobicContact CE2-CD1 3.96Å; F692-L765 HydrophobicContact CE2-CG 4.37Å; F692-L765 HydrophobicContact CZ-CD1 3.75Å; L760-L765 HydrophobicContact CD1-CD2 4.25Å; L760-L765 HydrophobicContact CD2-CD2 4.05Å; L760-L765 HydrophobicContact CG-CD2 4.31Å; D761-L765 PolarHBondContact O-N 3.19Å; I762-L765 WeakPolarHBondContact O-CB 3.15Å; I762-L765 PolarHBondContact O-N 3.42Å; I762-L765 VanDerWaalsContact O-N 3.1Å; L765-S769 WeakPolarHBondContact O-CB 3.29Å; L765-S769 PolarHBondContact O-N 2.96Å; L765-S769 PolarHBondContact O-OG 3.19Å; L765-I858 HydrophobicContact CB-CG2 3.83Å; L765-I858 HydrophobicContact CD2-CG2 3.85Å; L765-I858 HydrophobicContact CG-CG2 4.34Å; L765-F859 HydrophobicContact CB-CD1 4.35Å; L765-F859 HydrophobicContact CB-CE1 3.82Å; L765-F859 HydrophobicContact CB-CZ 3.96Å; L765-F859 HydrophobicContact CD1-CD1 3.95Å; L765-F859 HydrophobicContact CD1-CE1 4.13Å; L765-L861 HydrophobicContact CD1-CD2 4.19Å; L765-L861 HydrophobicContact CD2-CD2 4.35Å
766	L	89.6	Confident	82.7	Confident	11 Å²	11	38.6 Å²	38.6	6%	0.058	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-42.5	175	-71.9	170.7	0	0	0	111.6	I762 D764 S769 L770 F859 M895 I920 L923 L924	I762-L766 HydrophobicContact CG2-CD1 4.15Å; I762-L766 HydrophobicContact CG2-CG 4.42Å; I762-L766 WeakPolarHBondContact O-CG 3.35Å; I762-L766 PolarHBondContact O-N 2.74Å; D764-L766 VanDerWaalsContact C-N 3.33Å; D764-L766 PolarHBondContact O-N 3.32Å; L766-S769 WeakPolarHBondContact O-CB 3.42Å; L766-S769 PolarHBondContact O-N 3.34Å; L766-L770 WeakPolarHBondContact O-CB 3.44Å; L766-L770 PolarHBondContact O-N 2.91Å; L766-F859 HydrophobicContact CD2-CZ 3.98Å; L766-F859 HydrophobicContact CG-CZ 4.36Å; L766-M895 HydrophobicContact CD2-CE 3.5Å; L766-I920 HydrophobicContact CD2-CG2 4.47Å; L766-L923 HydrophobicContact CD2-CB 4.45Å; L766-L923 HydrophobicContact CD2-CD1 4.44Å; L766-L924 HydrophobicContact CB-CD1 4.28Å; L766-L924 HydrophobicContact CB-CD2 3.62Å; L766-L924 HydrophobicContact CB-CG 3.97Å; L766-L924 HydrophobicContact CD1-CD2 4.11Å
767	R	89.9	Confident	85.4	Confident	99 Å²	99	39.8 Å²	39.8	37%	0.374	19%	0.193	S	C	.	.	H	α-helix	trans	-63.1	-45.3	175.5	-74.6	177.9	-167	101.5	15.6	112.1	D763 D764 S769 L770 Q771 L924	D763-R767 WeakPolarHBondContact O-CB 2.91Å; D763-R767 VanDerWaalsContact O-CG 3.28Å; D763-R767 WeakPolarHBondContact O-CG 3.33Å; D763-R767 PolarHBondContact O-N 3.16Å; D763-R767 IonicContact OD2-CZ 3.02Å; D763-R767 IonicContact OD2-NH1 3.28Å; D763-R767 IonicContact OD2-NH2 3.92Å; D763-R767 PolarHBondContact OD2-NH2 3.2Å; D764-R767 PolarHBondContact O-N 3.49Å; D764-R767 IonicContact OD1-NH1 3.82Å; D764-R767 PolarHBondContact OD1-NH1 2.94Å; R767-S769 VanDerWaalsContact C-N 3.29Å; R767-S769 PolarHBondContact O-N 2.85Å; R767-L770 PolarHBondContact O-N 2.73Å; R767-Q771 WeakPolarHBondContact O-CB 3.48Å; R767-Q771 WeakPolarHBondContact O-CG 3.49Å; R767-Q771 PolarHBondContact O-N 3.02Å; R767-L924 HydrophobicContact CG-CD2 4.35Å
768	F	95.5	Very high	87.6	Confident	1 Å²	1	35 Å²	35	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-59.2	-44	175.6	-60.7	-29.8	0	0	0	111.4	L681 F684 L760 D764 Q771 V772 L796 R800 A802	L681-F768 HydrophobicContact CD1-CD2 3.63Å; L681-F768 HydrophobicContact CD1-CE2 3.89Å; L681-F768 HydrophobicContact CD1-CG 4.13Å; L681-F768 HydrophobicContact CD2-CB 4.46Å; F684-F768 HydrophobicContact CD1-CE2 4.46Å; F684-F768 HydrophobicContact CE1-CE2 4.05Å; F684-F768 AromaticContact CE1-CZ 3.97Å; F684-F768 HydrophobicContact CE1-CZ 3.97Å; L760-F768 HydrophobicContact CD1-CE2 3.89Å; L760-F768 HydrophobicContact CD1-CZ 4.46Å; D764-F768 HydrophobicContact CB-CE2 4.21Å; D764-F768 HydrophobicContact CB-CZ 4.22Å; D764-F768 VanDerWaalsContact O-CD2 3.24Å; D764-F768 WeakPolarHBondContact O-CD2 3.19Å; D764-F768 WeakPolarHBondContact O-CG 3.5Å; D764-F768 PolarHBondContact O-N 3.44Å; F768-Q771 PolarHBondContact O-N 3.31Å; F768-V772 VanDerWaalsContact O-CG2 3.29Å; F768-V772 WeakPolarHBondContact O-CG2 2.99Å; F768-V772 PolarHBondContact O-N 3.48Å; F768-L796 HydrophobicContact CD1-CD2 3.82Å; F768-L796 HydrophobicContact CE1-CD1 4.38Å; F768-L796 HydrophobicContact CE1-CD2 3.54Å; F768-L796 HydrophobicContact CZ-CD1 4.09Å; F768-L796 HydrophobicContact CZ-CD2 4.09Å; F768-R800 HydrophobicContact CE1-CB 4.09Å; F768-R800 WeakPolarHBondContact CE1-O 3.48Å; F768-R800 HydrophobicContact CZ-CB 4.44Å; F768-A802 HydrophobicContact CD1-CB 4.41Å
769	S	96.9	Very high	89.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.6	-50.8	176.8	-57.5	0	0	0	0	111.1	L765 L766 R767 Q771 V772 A773 Y851 L855 F859	L765-S769 WeakPolarHBondContact O-CB 3.29Å; L765-S769 PolarHBondContact O-N 2.96Å; L765-S769 PolarHBondContact O-OG 3.19Å; L766-S769 WeakPolarHBondContact O-CB 3.42Å; L766-S769 PolarHBondContact O-N 3.34Å; R767-S769 VanDerWaalsContact C-N 3.29Å; R767-S769 PolarHBondContact O-N 2.85Å; S769-Q771 PolarHBondContact O-N 2.9Å; S769-V772 PolarHBondContact O-N 3.31Å; S769-A773 PolarHBondContact O-N 2.98Å; S769-Y851 PolarHBondContact O-OH 3.1Å; S769-L855 WeakPolarHBondContact OG-CD2 3.48Å; S769-F859 WeakPolarHBondContact OG-CE2 3.49Å
770	L	96.4	Very high	90.2	Very high	22 Å²	22	26.3 Å²	26.3	12%	0.115	13%	0.13	C	C	.	.	H	α-helix	trans	-60.7	-48.1	178.8	177.8	57.4	0	0	0	112.6	L766 R767 V772 A773 Q774 I920 E921 L924	L766-L770 WeakPolarHBondContact O-CB 3.44Å; L766-L770 PolarHBondContact O-N 2.91Å; R767-L770 PolarHBondContact O-N 2.73Å; L770-V772 VanDerWaalsContact C-N 3.32Å; L770-V772 PolarHBondContact O-N 3.28Å; L770-A773 WeakPolarHBondContact O-CB 3.07Å; L770-A773 PolarHBondContact O-N 3.14Å; L770-A773 VanDerWaalsContact O-N 3.15Å; L770-Q774 HydrophobicContact CD1-CG 4.24Å; L770-Q774 WeakPolarHBondContact O-CG 3.38Å; L770-Q774 PolarHBondContact O-N 3.26Å; L770-I920 HydrophobicContact CB-CG2 3.89Å; L770-I920 HydrophobicContact CD1-CB 4.48Å; L770-E921 HydrophobicContact CD1-CG 3.63Å; L770-E921 HydrophobicContact CD2-CG 3.57Å; L770-E921 HydrophobicContact CG-CG 4.26Å; L770-L924 HydrophobicContact CB-CD1 4.17Å; L770-L924 HydrophobicContact CD2-CD1 3.67Å
771	Q	95.9	Very high	90.7	Very high	28 Å²	28	30.1 Å²	30.1	13%	0.131	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-41	-178.2	-72.4	174.5	-5.4	0	0	111.7	H655 R767 F768 S769 Q774 G775 A802	H655-Q771 WeakPolarHBondContact CB-O 3.4Å; H655-Q771 WeakPolarHBondContact CE1-CG 3.3Å; H655-Q771 VanDerWaalsContact CG-O 3.27Å; R767-Q771 WeakPolarHBondContact O-CB 3.48Å; R767-Q771 WeakPolarHBondContact O-CG 3.49Å; R767-Q771 PolarHBondContact O-N 3.02Å; F768-Q771 PolarHBondContact O-N 3.31Å; S769-Q771 PolarHBondContact O-N 2.9Å; Q771-Q774 PolarHBondContact O-N 3.29Å; Q771-G775 PolarHBondContact O-N 3.13Å; Q771-A802 HydrophobicContact CB-CB 3.97Å
772	V	97.2	Very high	90.8	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-68.2	-39.6	175	178	0	0	0	0	111.3	F768 S769 L770 Q774 G775 L776 V794 A802 I804 Y851 L854	F768-V772 VanDerWaalsContact O-CG2 3.29Å; F768-V772 WeakPolarHBondContact O-CG2 2.99Å; F768-V772 PolarHBondContact O-N 3.48Å; S769-V772 PolarHBondContact O-N 3.31Å; L770-V772 VanDerWaalsContact C-N 3.32Å; L770-V772 PolarHBondContact O-N 3.28Å; V772-Q774 VanDerWaalsContact C-N 3.32Å; V772-Q774 PolarHBondContact O-N 2.85Å; V772-G775 PolarHBondContact O-N 2.9Å; V772-L776 HydrophobicContact CG1-CD1 3.9Å; V772-L776 HydrophobicContact CG1-CG 4.26Å; V772-L776 WeakPolarHBondContact O-CG 3.31Å; V772-L776 PolarHBondContact O-N 2.92Å; V772-V794 HydrophobicContact CG1-CG2 4.42Å; V772-V794 HydrophobicContact CG2-CB 4.47Å; V772-V794 HydrophobicContact CG2-CG1 3.71Å; V772-V794 HydrophobicContact CG2-CG2 3.88Å; V772-A802 HydrophobicContact CG2-CB 3.96Å; V772-I804 HydrophobicContact CG1-CD1 3.95Å; V772-I804 HydrophobicContact CG1-CG1 4.02Å; V772-Y851 HydrophobicContact CB-CE2 4.2Å; V772-Y851 HydrophobicContact CG1-CD2 4.09Å; V772-Y851 HydrophobicContact CG1-CE2 3.95Å; V772-L854 HydrophobicContact CB-CD2 4.25Å; V772-L854 HydrophobicContact CG1-CD2 3.52Å; V772-L854 HydrophobicContact CG2-CD2 4.43Å
773	A	97.4	Very high	90.6	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-58.2	-44.6	173.9	0	0	0	0	0	111.8	S769 L770 G775 L776 D777 Y851	S769-A773 PolarHBondContact O-N 2.98Å; L770-A773 WeakPolarHBondContact O-CB 3.07Å; L770-A773 PolarHBondContact O-N 3.14Å; L770-A773 VanDerWaalsContact O-N 3.15Å; A773-G775 PolarHBondContact O-N 2.95Å; A773-L776 PolarHBondContact O-N 3.48Å; A773-D777 WeakPolarHBondContact O-CB 3.4Å; A773-D777 PolarHBondContact O-N 3.01Å; A773-Y851 HydrophobicContact CB-CE2 4.24Å
774	Q	96.4	Very high	90.5	Very high	65 Å²	65	30.7 Å²	30.7	30%	0.304	16%	0.161	S	C	.	.	H	α-helix	trans	-62.5	-41	176.9	-70.4	171.6	-17.6	0	0	111.9	H655 L770 Q771 V772 D777 F778 E921	H655-Q774 PolarHBondContact CD2-OE1 2.97Å; H655-Q774 PolarHBondContact NE2-OE1 3.1Å; L770-Q774 HydrophobicContact CD1-CG 4.24Å; L770-Q774 WeakPolarHBondContact O-CG 3.38Å; L770-Q774 PolarHBondContact O-N 3.26Å; Q771-Q774 PolarHBondContact O-N 3.29Å; V772-Q774 VanDerWaalsContact C-N 3.32Å; V772-Q774 PolarHBondContact O-N 2.85Å; Q774-D777 PolarHBondContact O-N 2.82Å; Q774-F778 PolarHBondContact O-N 2.85Å; Q774-F778 VanDerWaalsContact O-N 3.16Å; Q774-E921 PolarHBondContact NE2-OE1 2.91Å
775	G	93.8	Very high	90.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.9	-41.7	174.7	0	0	0	0	0	113.4	Q771 V772 A773 F778 L779	Q771-G775 PolarHBondContact O-N 3.13Å; V772-G775 PolarHBondContact O-N 2.9Å; A773-G775 PolarHBondContact O-N 2.95Å; G775-F778 WeakPolarHBondContact O-CB 3.43Å; G775-F778 PolarHBondContact O-N 3.47Å; G775-L779 PolarHBondContact O-N 3.09Å
776	L	94.3	Very high	89.7	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-71.8	-32.2	177.7	-68.8	171.4	0	0	0	112.6	V772 A773 F778 L779 A780 V789 I804 Y851 F913	V772-L776 HydrophobicContact CG1-CD1 3.9Å; V772-L776 HydrophobicContact CG1-CG 4.26Å; V772-L776 WeakPolarHBondContact O-CG 3.31Å; V772-L776 PolarHBondContact O-N 2.92Å; A773-L776 PolarHBondContact O-N 3.48Å; L776-F778 VanDerWaalsContact C-N 3.34Å; L776-L779 HydrophobicContact CD2-CD1 4.33Å; L776-L779 PolarHBondContact O-N 3.3Å; L776-A780 WeakPolarHBondContact O-CB 3.32Å; L776-A780 PolarHBondContact O-N 3.41Å; L776-V789 HydrophobicContact CD1-CG1 3.83Å; L776-V789 HydrophobicContact CD1-CG2 4.31Å; L776-V789 HydrophobicContact CD2-CG1 4.49Å; L776-V789 HydrophobicContact CD2-CG2 3.71Å; L776-I804 HydrophobicContact CD2-CD1 3.89Å; L776-I804 HydrophobicContact CG-CD1 3.69Å; L776-Y851 HydrophobicContact CD1-CD2 3.47Å; L776-Y851 VanDerWaalsContact CD1-CD2 3.47Å; L776-Y851 HydrophobicContact CD1-CE2 4.3Å; L776-Y851 HydrophobicContact CD1-CG 4.06Å; L776-F913 HydrophobicContact CB-CD1 3.69Å; L776-F913 HydrophobicContact CB-CD2 3.75Å; L776-F913 HydrophobicContact CB-CE1 3.66Å; L776-F913 HydrophobicContact CB-CE2 3.71Å; L776-F913 HydrophobicContact CB-CG 3.74Å; L776-F913 HydrophobicContact CB-CZ 3.66Å; L776-F913 HydrophobicContact CD1-CD1 4.11Å; L776-F913 HydrophobicContact CD1-CE1 3.42Å; L776-F913 VanDerWaalsContact CD1-CE1 3.42Å; L776-F913 HydrophobicContact CD1-CZ 3.68Å; L776-F913 HydrophobicContact CG-CE1 4.14Å; L776-F913 HydrophobicContact CG-CZ 4.15Å
777	D	94.9	Very high	89.3	Confident	57 Å²	57	30.4 Å²	30.4	31%	0.305	16%	0.157	S	C	.	.	H	α-helix	trans	-62.6	-42.4	173	-160.4	50.1	0	0	0	111.3	A773 Q774 A780 A781 F913 S914	A773-D777 WeakPolarHBondContact O-CB 3.4Å; A773-D777 PolarHBondContact O-N 3.01Å; Q774-D777 PolarHBondContact O-N 2.82Å; D777-A780 PolarHBondContact O-N 3.08Å; D777-A781 WeakPolarHBondContact O-CB 3.41Å; D777-A781 PolarHBondContact O-N 3.36Å; D777-F913 HydrophobicContact CB-CB 3.65Å; D777-S914 WeakPolarHBondContact OD1-CB 3.43Å; D777-S914 PolarHBondContact OD1-N 3.39Å; D777-S914 WeakPolarHBondContact OD2-CB 3.41Å
778	F	93	Very high	89	Confident	38 Å²	38	25.8 Å²	25.8	17%	0.167	14%	0.14	C	C	.	.	H	α-helix	trans	-60.1	-45.5	172.8	170.7	-98.6	0	0	0	112.6	L650 H653 I656 Q774 G775 L776 A780 A781 K782	L650-F778 WeakPolarHBondContact O-CZ 3.49Å; H653-F778 HydrophobicContact CB-CD1 3.65Å; H653-F778 HydrophobicContact CB-CD2 4.15Å; H653-F778 HydrophobicContact CB-CE1 3.7Å; H653-F778 HydrophobicContact CB-CE2 4.19Å; H653-F778 HydrophobicContact CB-CG 3.88Å; H653-F778 HydrophobicContact CB-CZ 3.96Å; H653-F778 AromaticContact CD2-CD2 3.67Å; H653-F778 AromaticContact CD2-CG 3.59Å; H653-F778 AromaticContact CG-CD1 3.84Å; H653-F778 AromaticContact CG-CG 3.64Å; I656-F778 HydrophobicContact CG1-CD1 3.96Å; I656-F778 HydrophobicContact CG1-CE1 4.36Å; Q774-F778 PolarHBondContact O-N 2.85Å; Q774-F778 VanDerWaalsContact O-N 3.16Å; G775-F778 WeakPolarHBondContact O-CB 3.43Å; G775-F778 PolarHBondContact O-N 3.47Å; L776-F778 VanDerWaalsContact C-N 3.34Å; F778-A780 VanDerWaalsContact C-N 3.34Å; F778-A780 PolarHBondContact O-N 2.91Å; F778-A781 PolarHBondContact O-N 2.98Å; F778-K782 HydrophobicContact CE1-CG 4.44Å; F778-K782 HydrophobicContact CE2-CG 4.25Å; F778-K782 HydrophobicContact CZ-CG 4.14Å; F778-K782 WeakPolarHBondContact O-CG 3.38Å; F778-K782 PolarHBondContact O-N 2.86Å; F778-K782 VanDerWaalsContact O-N 3.15Å
779	L	86.4	Confident	88.9	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-41.7	176.9	-68	-179.4	0	0	0	111.7	W560 L650 I656 G775 L776 A781 K782 N783 C784	W560-L779 HydrophobicContact CH2-CD1 4.11Å; W560-L779 HydrophobicContact CH2-CD2 4.23Å; W560-L779 HydrophobicContact CZ3-CD1 4.28Å; W560-L779 HydrophobicContact CZ3-CD2 3.78Å; L650-L779 HydrophobicContact CD1-CD2 4.06Å; L650-L779 HydrophobicContact CD2-CD2 4.12Å; I656-L779 HydrophobicContact CD1-CD1 3.9Å; I656-L779 HydrophobicContact CD1-CD2 4.08Å; I656-L779 HydrophobicContact CD1-CG 3.84Å; I656-L779 HydrophobicContact CG1-CD2 4.46Å; G775-L779 PolarHBondContact O-N 3.09Å; L776-L779 HydrophobicContact CD2-CD1 4.33Å; L776-L779 PolarHBondContact O-N 3.3Å; L779-A781 PolarHBondContact O-N 3.45Å; L779-K782 CarbonylContact O-C 3.59Å; L779-K782 PolarHBondContact O-N 2.94Å; L779-K782 VanDerWaalsContact O-N 3.13Å; L779-N783 PolarHBondContact O-N 3.44Å; L779-C784 CarbonylContact C-O 3.55Å; L779-C784 HydrophobicContact CB-CB 4.31Å; L779-C784 HydrophobicContact CD2-CB 4.33Å; L779-C784 WeakPolarHBondContact O-CB 3.42Å; L779-C784 PolarHBondContact O-N 2.97Å
780	A	85.5	Confident	88.6	Confident	20 Å²	20	26 Å²	26	17%	0.165	14%	0.141	C	C	.	.	H	α-helix	trans	-60.8	-43.2	175.9	0	0	0	0	0	111.9	L776 D777 F778 K782 N783 V844 F913	L776-A780 WeakPolarHBondContact O-CB 3.32Å; L776-A780 PolarHBondContact O-N 3.41Å; D777-A780 PolarHBondContact O-N 3.08Å; F778-A780 VanDerWaalsContact C-N 3.34Å; F778-A780 PolarHBondContact O-N 2.91Å; A780-K782 PolarHBondContact O-N 2.79Å; A780-N783 PolarHBondContact O-N 3.23Å; A780-V844 HydrophobicContact CB-CG1 3.64Å; A780-V844 HydrophobicContact CB-CG2 4.07Å; A780-F913 HydrophobicContact CB-CD2 4.21Å
781	A	85.6	Confident	88.4	Confident	81 Å²	81	24.9 Å²	24.9	67%	0.669	14%	0.136	S	C	*	.	H	α-helix	trans	-63.9	-25.3	176.1	0	0	0	0	0	113.2	D777 F778 L779 N783	D777-A781 WeakPolarHBondContact O-CB 3.41Å; D777-A781 PolarHBondContact O-N 3.36Å; F778-A781 PolarHBondContact O-N 2.98Å; L779-A781 PolarHBondContact O-N 3.45Å; A781-N783 VanDerWaalsContact C-N 3.33Å
782	K	80.6	Confident	88	Confident	101 Å²	101	24 Å²	24	44%	0.439	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	11.4	173.1	-65.3	-65.1	-173.3	177.5	0	113.5	L650 F778 L779 A780 C784	L650-K782 HydrophobicContact CD2-CB 3.8Å; L650-K782 HydrophobicContact CD2-CG 4.3Å; F778-K782 HydrophobicContact CE1-CG 4.44Å; F778-K782 HydrophobicContact CE2-CG 4.25Å; F778-K782 HydrophobicContact CZ-CG 4.14Å; F778-K782 WeakPolarHBondContact O-CG 3.38Å; F778-K782 PolarHBondContact O-N 2.86Å; F778-K782 VanDerWaalsContact O-N 3.15Å; L779-K782 CarbonylContact O-C 3.59Å; L779-K782 PolarHBondContact O-N 2.94Å; L779-K782 VanDerWaalsContact O-N 3.13Å; A780-K782 PolarHBondContact O-N 2.79Å; K782-C784 PolarHBondContact O-N 2.02Å
783	N	75.7	Confident	87.6	Confident	90 Å²	90	24 Å²	24	48%	0.481	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	32.4	-175.8	-65.2	-43.4	0	0	0	113.2	I563 L779 A780 A781	I563-N783 HydrophobicContact CB-CB 4.25Å; I563-N783 PolarHBondContact N-O 2.76Å; I563-N783 VanDerWaalsContact N-O 3.08Å; L779-N783 PolarHBondContact O-N 3.44Å; A780-N783 PolarHBondContact O-N 3.23Å; A781-N783 VanDerWaalsContact C-N 3.33Å
784	C	76.7	Confident	87.4	Confident	1 Å²	1	24 Å²	24	1%	0.007	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.2	-179.9	-175.8	0	0	0	0	110.1	L650 L779 K782	L650-C784 HydrophobicContact CD2-CB 3.72Å; L779-C784 CarbonylContact C-O 3.55Å; L779-C784 HydrophobicContact CB-CB 4.31Å; L779-C784 HydrophobicContact CD2-CB 4.33Å; L779-C784 WeakPolarHBondContact O-CB 3.42Å; L779-C784 PolarHBondContact O-N 2.97Å; K782-C784 PolarHBondContact O-N 2.02Å
785	I	78.3	Confident	87.2	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.6	176.4	-55.5	161.1	0	0	0	108.6	K561 I563 F573 R787 Y842 V844 D847	K561-I785 PolarHBondContact N-O 2.88Å; K561-I785 PolarHBondContact O-N 2.88Å; I563-I785 HydrophobicContact CD1-CD1 3.62Å; I563-I785 HydrophobicContact CD1-CG1 4.19Å; I563-I785 HydrophobicContact CG1-CD1 4.05Å; F573-I785 HydrophobicContact CE1-CD1 4.08Å; I785-R787 HydrophobicContact CB-CG 4.41Å; I785-R787 HydrophobicContact CG2-CG 3.64Å; I785-Y842 WeakPolarHBondContact CD1-O 3.35Å; I785-V844 HydrophobicContact CG1-CG2 4.47Å; I785-D847 WeakPolarHBondContact CA-OD2 3.21Å; I785-D847 WeakPolarHBondContact CG2-OD2 3.41Å
786	H	84.8	Confident	87.1	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.			trans	-80.2	-42.3	-175.7	-171.1	-49	0	0	0	113.1	W560 D788 V789 I804 C805 D847	W560-H786 AromaticContact CZ2-CD2 3.71Å; W560-H786 AromaticContact CZ2-NE2 3.76Å; W560-H786 AromaticContact NE1-CE1 3.94Å; W560-H786 AromaticContact NE1-ND1 3.96Å; H786-D788 PolarHBondContact ND1-N 3.33Å; H786-D788 PolarHBondContact O-N 3Å; H786-D788 VanDerWaalsContact O-N 3.1Å; H786-V789 HydrophobicContact CB-CG2 3.87Å; H786-I804 VanDerWaalsContact CD2-CG2 3.41Å; H786-I804 WeakPolarHBondContact CD2-CG2 3.37Å; H786-I804 VanDerWaalsContact NE2-CG2 3.32Å; H786-I804 WeakPolarHBondContact NE2-CG2 3.37Å; H786-C805 PolarHBondContact NE2-O 2.66Å; H786-D847 PolarHBondContact N-OD2 2.79Å
787	R	81.2	Confident	86.8	Confident	29 Å²	29	21.9 Å²	21.9	11%	0.109	12%	0.123	C	C	.	.	S	Bend	trans	64.7	3.4	177.7	-45.3	-172.3	-173.8	-160	-16.9	117.6	R559 K561 F573 I785 Y842 D847	R559-R787 HydrophobicContact CB-CB 4.4Å; R559-R787 WeakPolarHBondContact O-CD 3.23Å; R559-R787 WeakPolarHBondContact O-CG 3.39Å; R559-R787 PolarHBondContact O-NE 3.35Å; K561-R787 VanDerWaalsContact CE-NH1 3.3Å; F573-R787 VanDerWaalsContact CZ-NH2 3.26Å; I785-R787 HydrophobicContact CB-CG 4.41Å; I785-R787 HydrophobicContact CG2-CG 3.64Å; R787-Y842 HydrophobicContact CB-CD1 4.06Å; R787-Y842 HydrophobicContact CB-CE1 4.36Å; R787-Y842 HydrophobicContact CG-CD1 3.82Å; R787-Y842 HydrophobicContact CG-CG 4.26Å; R787-D847 WeakPolarHBondContact CA-OD1 3.07Å; R787-D847 PolarHBondContact N-OD1 2.81Å
788	D	83.4	Confident	86	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.011	13%	0.133	C	C	.	.			trans	-149.6	41.5	177.7	-161.3	27	0	0	0	111.2	R559 H786 A790 R792 N793 Y819 P828	R559-D788 IonicContact CZ-OD2 3.2Å; R559-D788 IonicContact NH1-OD1 3.61Å; R559-D788 PolarHBondContact NH1-OD1 2.79Å; R559-D788 IonicContact NH1-OD2 2.67Å; R559-D788 PolarHBondContact NH1-OD2 2.67Å; H786-D788 PolarHBondContact ND1-N 3.33Å; H786-D788 PolarHBondContact O-N 3Å; H786-D788 VanDerWaalsContact O-N 3.1Å; D788-A790 PolarHBondContact O-N 3.23Å; D788-R792 IonicContact OD1-CZ 3.93Å; D788-R792 IonicContact OD1-NH2 2.96Å; D788-R792 PolarHBondContact OD1-NH2 3.22Å; D788-N793 PolarHBondContact O-ND2 3.15Å; D788-N793 PolarHBondContact OD2-ND2 3.21Å; D788-Y819 PolarHBondContact OD2-OH 2.91Å; D788-P828 WeakPolarHBondContact OD1-CB 3.49Å; D788-P828 WeakPolarHBondContact OD1-CG 3.36Å
789	V	91.8	Very high	85.4	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.024	16%	0.162	C	C	.	.			trans	-66.9	116.6	175.9	-178.5	0	0	0	0	108.9	L776 H786 D847 L854	L776-V789 HydrophobicContact CD1-CG1 3.83Å; L776-V789 HydrophobicContact CD1-CG2 4.31Å; L776-V789 HydrophobicContact CD2-CG1 4.49Å; L776-V789 HydrophobicContact CD2-CG2 3.71Å; H786-V789 HydrophobicContact CB-CG2 3.87Å; V789-D847 HydrophobicContact CG2-CB 4.18Å; V789-L854 HydrophobicContact CG1-CB 4.43Å; V789-L854 HydrophobicContact CG1-CD2 4.01Å
790	A	91.6	Very high	85.2	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.168	C	C	.	.	S	Bend	trans	-164	160.1	-177.9	0	0	0	0	0	110.4	D788 R792 N793 W831	D788-A790 PolarHBondContact O-N 3.23Å; A790-R792 HydrophobicContact CB-CG 3.91Å; A790-R792 VanDerWaalsContact CB-CZ 3.46Å; A790-R792 PolarHBondContact O-N 2.79Å; A790-R792 VanDerWaalsContact O-N 3.16Å; A790-N793 PolarHBondContact O-N 2.92Å; A790-W831 HydrophobicContact CB-CD2 4.36Å; A790-W831 HydrophobicContact CB-CG 4.17Å
791	A	91.6	Very high	85.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-60	-33	-175.7	0	0	0	0	0	112.6	L682 N793 V794 L854 E857	L682-A791 HydrophobicContact CB-CB 3.88Å; L682-A791 HydrophobicContact CD1-CB 4.39Å; L682-A791 PolarHBondContact N-O 3.06Å; A791-N793 PolarHBondContact O-N 3.11Å; A791-V794 PolarHBondContact O-N 3.36Å; A791-L854 HydrophobicContact CB-CD1 3.72Å; A791-E857 HydrophobicContact CB-CB 4.03Å; A791-E857 PolarHBondContact N-OE2 3.45Å
792	R	87.3	Confident	85.8	Confident	8 Å²	8	29.6 Å²	29.6	3%	0.03	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-60.3	-26.7	174.3	64.7	-178.9	176.1	-85.5	-7.1	113.5	L682 D788 A790 R811 Y819 W831	L682-R792 HydrophobicContact CD2-CB 4.21Å; D788-R792 IonicContact OD1-CZ 3.93Å; D788-R792 IonicContact OD1-NH2 2.96Å; D788-R792 PolarHBondContact OD1-NH2 3.22Å; A790-R792 HydrophobicContact CB-CG 3.91Å; A790-R792 VanDerWaalsContact CB-CZ 3.46Å; A790-R792 PolarHBondContact O-N 2.79Å; A790-R792 VanDerWaalsContact O-N 3.16Å; R792-R811 VanDerWaalsContact CD-NH1 3.29Å; R792-R811 PolarHBondContact O-NH2 2.97Å; R792-Y819 PolarHBondContact NE-OH 3.03Å; R792-Y819 VanDerWaalsContact NE-OH 3.16Å; R792-W831 VanDerWaalsContact NH1-CE2 3.32Å; R792-W831 VanDerWaalsContact NH1-CH2 3.27Å
793	N	89.9	Confident	86.4	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-100.4	16.8	-177.3	-74.9	-15.8	0	0	0	112.7	D788 A790 A791 C805 R811	D788-N793 PolarHBondContact O-ND2 3.15Å; D788-N793 PolarHBondContact OD2-ND2 3.21Å; A790-N793 PolarHBondContact O-N 2.92Å; A791-N793 PolarHBondContact O-N 3.11Å; N793-C805 VanDerWaalsContact C-SG 3.51Å; N793-C805 WeakPolarHBondContact CB-O 3.23Å; N793-C805 PolarHBondContact O-N 2.88Å; N793-C805 PolarHBondContact O-SG 3.17Å; N793-R811 VanDerWaalsContact OD1-CZ 3.23Å; N793-R811 PolarHBondContact OD1-NH1 2.8Å; N793-R811 PolarHBondContact OD1-NH2 2.74Å
794	V	93.3	Very high	87.2	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.012	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.7	172	-179.7	0	0	0	0	107.5	D680 L681 V772 A791 A802 K803 L854	D680-V794 CarbonylContact C-O 3.56Å; D680-V794 WeakPolarHBondContact CA-O 3.45Å; L681-V794 HydrophobicContact CB-CB 4.01Å; L681-V794 HydrophobicContact CB-CG1 4.18Å; L681-V794 WeakPolarHBondContact CB-O 3.4Å; L681-V794 HydrophobicContact CD2-CB 4.14Å; L681-V794 HydrophobicContact CD2-CG1 3.98Å; L681-V794 PolarHBondContact N-O 3.01Å; V772-V794 HydrophobicContact CG1-CG2 4.42Å; V772-V794 HydrophobicContact CG2-CB 4.47Å; V772-V794 HydrophobicContact CG2-CG1 3.71Å; V772-V794 HydrophobicContact CG2-CG2 3.88Å; A791-V794 PolarHBondContact O-N 3.36Å; V794-A802 HydrophobicContact CG1-CB 3.75Å; V794-K803 CarbonylContact C-O 3.53Å; V794-L854 HydrophobicContact CG2-CD1 4.45Å; V794-L854 HydrophobicContact CG2-CD2 4.37Å
795	L	91.9	Very high	87.7	Confident	7 Å²	7	21.5 Å²	21.5	4%	0.037	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	157.8	175.2	-56.1	-165.2	0	0	0	112	V657 C676 G679 D680 M736 A802 K803 F807	V657-L795 HydrophobicContact CG2-CD1 4.34Å; C676-L795 HydrophobicContact CB-CB 3.53Å; C676-L795 HydrophobicContact CB-CD1 3.73Å; C676-L795 HydrophobicContact CB-CG 4.31Å; G679-L795 CarbonylContact O-C 3.58Å; G679-L795 VanDerWaalsContact O-CA 3.3Å; G679-L795 WeakPolarHBondContact O-CA 3.21Å; D680-L795 HydrophobicContact CB-CD2 3.85Å; M736-L795 HydrophobicContact CE-CD1 4.14Å; M736-L795 HydrophobicContact CE-CD2 3.38Å; M736-L795 HydrophobicContact CE-CG 4.38Å; L795-A802 CarbonylContact O-C 3.58Å; L795-A802 WeakPolarHBondContact O-CA 3.38Å; L795-K803 PolarHBondContact N-O 3.19Å; L795-K803 PolarHBondContact O-N 2.98Å; L795-F807 HydrophobicContact CD1-CD2 4.48Å; L795-F807 HydrophobicContact CD1-CE2 3.42Å; L795-F807 VanDerWaalsContact CD1-CE2 3.42Å; L795-F807 HydrophobicContact CD1-CZ 3.73Å; L795-F807 HydrophobicContact CD2-CD2 4.34Å; L795-F807 HydrophobicContact CD2-CE2 4Å; L795-F807 HydrophobicContact CG-CE2 3.86Å
796	L	91.4	Very high	87.5	Confident	0 Å²	0	22 Å²	22	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.1	178.1	-68.7	176.6	0	0	0	111.8	C676 S677 L678 G679 L681 F684 F768 E801 A802	C676-L796 CarbonylContact C-O 3.52Å; C676-L796 WeakPolarHBondContact CB-O 3.23Å; S677-L796 PolarHBondContact N-O 3.45Å; L678-L796 HydrophobicContact CB-CB 3.68Å; L678-L796 WeakPolarHBondContact CB-O 3.31Å; L678-L796 HydrophobicContact CD1-CB 4.2Å; L678-L796 HydrophobicContact CG-CB 4.48Å; L678-L796 PolarHBondContact N-O 2.89Å; G679-L796 PolarHBondContact O-N 2.81Å; L681-L796 HydrophobicContact CD1-CD1 3.81Å; L681-L796 HydrophobicContact CD1-CD2 4.42Å; L681-L796 HydrophobicContact CD1-CG 4.32Å; F684-L796 HydrophobicContact CB-CD1 3.87Å; F684-L796 HydrophobicContact CD1-CD1 3.36Å; F684-L796 HydrophobicContact CD2-CD1 4.01Å; F684-L796 HydrophobicContact CE1-CD1 3.8Å; F684-L796 HydrophobicContact CE2-CD1 4.4Å; F684-L796 HydrophobicContact CG-CD1 3.47Å; F684-L796 VanDerWaalsContact CG-CD1 3.47Å; F684-L796 HydrophobicContact CZ-CD1 4.31Å; F768-L796 HydrophobicContact CD1-CD2 3.82Å; F768-L796 HydrophobicContact CE1-CD1 4.38Å; F768-L796 HydrophobicContact CE1-CD2 3.54Å; F768-L796 HydrophobicContact CZ-CD1 4.09Å; F768-L796 HydrophobicContact CZ-CD2 4.09Å; L796-E801 WeakPolarHBondContact CA-O 3.48Å; L796-A802 HydrophobicContact CD2-CB 4.11Å
797	T	87.6	Confident	86.1	Confident	16 Å²	16	22.6 Å²	22.6	10%	0.098	11%	0.105	C	C	.	.			trans	-77.9	171.9	171.3	71.2	0	0	0	0	111.4	L678 R799 R800 E801 K803	L678-T797 WeakPolarHBondContact CD1-O 3.32Å; L678-T797 WeakPolarHBondContact CG-O 3.44Å; T797-R799 PolarHBondContact O-N 3.35Å; T797-R799 VanDerWaalsContact O-N 3.16Å; T797-R799 PolarHBondContact OG1-N 3.46Å; T797-R800 PolarHBondContact O-N 2.82Å; T797-E801 HydrophobicContact CG2-CB 4.29Å; T797-E801 PolarHBondContact N-O 3.1Å; T797-E801 VanDerWaalsContact N-O 3.09Å; T797-E801 WeakPolarHBondContact OG1-CB 3.41Å; T797-E801 PolarHBondContact OG1-N 3.21Å; T797-K803 HydrophobicContact CG2-CD 3.72Å; T797-K803 HydrophobicContact CG2-CG 4.45Å
798	S	79	Confident	84.9	Confident	74 Å²	74	21.6 Å²	21.6	52%	0.517	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.1	175.3	50.3	0	0	0	0	112.9	S677 R800	S677-S798 WeakPolarHBondContact OG-CA 3.48Å; S677-S798 WeakPolarHBondContact OG-CB 3.48Å; S677-S798 PolarHBondContact OG-N 3.2Å; S798-R800 VanDerWaalsContact C-N 3.28Å; S798-R800 PolarHBondContact O-N 2.87Å
799	R	79.6	Confident	83.3	Confident	206 Å²	206	21.5 Å²	21.5	78%	0.777	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	13.3	176.8	-60.8	-176	-179	-177.3	-0.8	113.8	T797 E801	T797-R799 PolarHBondContact O-N 3.35Å; T797-R799 VanDerWaalsContact O-N 3.16Å; T797-R799 PolarHBondContact OG1-N 3.46Å; R799-E801 HydrophobicContact CB-CG 4.23Å; R799-E801 PolarHBondContact O-N 3Å
800	R	83	Confident	80.8	Confident	35 Å²	35	21.6 Å²	21.6	13%	0.132	10%	0.104	C	C	.	.			trans	55.7	37.9	-175.7	-59	-176.8	179.9	-167.1	-2.8	112.8	L678 G756 W758 P759 D764 F768 T797 S798	L678-R800 HydrophobicContact CD1-CG 4Å; G756-R800 PolarHBondContact O-NH2 2.86Å; W758-R800 PolarHBondContact O-NH2 2.83Å; P759-R800 PolarHBondContact O-NH1 2.76Å; P759-R800 VanDerWaalsContact O-NH1 3.14Å; D764-R800 IonicContact OD2-NH1 3.33Å; D764-R800 PolarHBondContact OD2-NH1 3.25Å; F768-R800 HydrophobicContact CE1-CB 4.09Å; F768-R800 WeakPolarHBondContact CE1-O 3.48Å; F768-R800 HydrophobicContact CZ-CB 4.44Å; T797-R800 PolarHBondContact O-N 2.82Å; S798-R800 VanDerWaalsContact C-N 3.28Å; S798-R800 PolarHBondContact O-N 2.87Å
801	E	88.6	Confident	78.8	Confident	44 Å²	44	22.7 Å²	22.7	21%	0.206	11%	0.108	C	C	.	.			trans	-92.2	126.4	171.3	-58.6	-179.5	132.9	0	0	109.8	K654 L796 T797 R799	K654-E801 WeakPolarHBondContact CE-OE1 3.39Å; K654-E801 IonicContact NZ-OE1 3.95Å; K654-E801 PolarHBondContact NZ-OE1 3.23Å; K654-E801 VanDerWaalsContact NZ-OE1 3.11Å; L796-E801 WeakPolarHBondContact CA-O 3.48Å; T797-E801 HydrophobicContact CG2-CB 4.29Å; T797-E801 PolarHBondContact N-O 3.1Å; T797-E801 VanDerWaalsContact N-O 3.09Å; T797-E801 WeakPolarHBondContact OG1-CB 3.41Å; T797-E801 PolarHBondContact OG1-N 3.21Å; R799-E801 HydrophobicContact CB-CG 4.23Å; R799-E801 PolarHBondContact O-N 3Å
802	A	94.6	Very high	76.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	129.9	176.4	0	0	0	0	0	111.3	H655 F768 Q771 V772 V794 L795 L796	H655-A802 PolarHBondContact ND1-O 3.45Å; F768-A802 HydrophobicContact CD1-CB 4.41Å; Q771-A802 HydrophobicContact CB-CB 3.97Å; V772-A802 HydrophobicContact CG2-CB 3.96Å; V794-A802 HydrophobicContact CG1-CB 3.75Å; L795-A802 CarbonylContact O-C 3.58Å; L795-A802 WeakPolarHBondContact O-CA 3.38Å; L796-A802 HydrophobicContact CD2-CB 4.11Å
803	K	94.3	Very high	75	Confident	13 Å²	13	24.1 Å²	24.1	6%	0.057	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	122.5	179	-71	177.7	172.2	-83.7	0	110.7	K654 H655 V657 E674 V794 L795 T797	K654-K803 WeakPolarHBondContact O-CE 3.34Å; K654-K803 PolarHBondContact O-NZ 2.99Å; H655-K803 WeakPolarHBondContact O-CA 3.35Å; V657-K803 HydrophobicContact CG2-CB 3.68Å; E674-K803 IonicContact OE1-NZ 3.45Å; E674-K803 WeakPolarHBondContact OE2-CE 3.24Å; E674-K803 IonicContact OE2-NZ 2.73Å; E674-K803 PolarHBondContact OE2-NZ 2.78Å; V794-K803 CarbonylContact C-O 3.53Å; L795-K803 PolarHBondContact N-O 3.19Å; L795-K803 PolarHBondContact O-N 2.98Å; T797-K803 HydrophobicContact CG2-CD 3.72Å; T797-K803 HydrophobicContact CG2-CG 4.45Å
804	I	92.1	Very high	72.9	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	143.8	-179.6	-53.2	159.7	0	0	0	110.1	H655 I656 V657 V772 L776 H786	H655-I804 PolarHBondContact O-N 3.23Å; I656-I804 HydrophobicContact CD1-CB 3.86Å; I656-I804 HydrophobicContact CD1-CD1 3.92Å; I656-I804 HydrophobicContact CD1-CG1 4.39Å; V657-I804 PolarHBondContact N-O 3.34Å; V772-I804 HydrophobicContact CG1-CD1 3.95Å; V772-I804 HydrophobicContact CG1-CG1 4.02Å; L776-I804 HydrophobicContact CD2-CD1 3.89Å; L776-I804 HydrophobicContact CG-CD1 3.69Å; H786-I804 VanDerWaalsContact CD2-CG2 3.41Å; H786-I804 WeakPolarHBondContact CD2-CG2 3.37Å; H786-I804 VanDerWaalsContact NE2-CG2 3.32Å; H786-I804 WeakPolarHBondContact NE2-CG2 3.37Å
805	C	85.9	Confident	70.7	Confident	8 Å²	8	31.3 Å²	31.3	5%	0.054	15%	0.152	C	C	.	.			trans	-155.2	171.2	-175.2	60.4	0	0	0	0	112.1	V657 H786 N793 F807	V657-C805 HydrophobicContact CB-CB 4.03Å; V657-C805 HydrophobicContact CG2-CB 3.67Å; H786-C805 PolarHBondContact NE2-O 2.66Å; N793-C805 VanDerWaalsContact C-SG 3.51Å; N793-C805 WeakPolarHBondContact CB-O 3.23Å; N793-C805 PolarHBondContact O-N 2.88Å; N793-C805 PolarHBondContact O-SG 3.17Å; C805-F807 HydrophobicContact CB-CD2 3.95Å; C805-F807 HydrophobicContact CB-CE2 3.62Å; C805-F807 WeakPolarHBondContact SG-CD2 3.33Å; C805-F807 WeakPolarHBondContact SG-CE2 3.06Å
806	D	73.8	Confident	68.7	Low	10 Å²	10	32.2 Å²	32.2	5%	0.053	16%	0.157	C	C	.	.			trans	-125	97.3	171.6	-168.6	-9.5	0	0	0	112.1	W560 K626 G808	W560-D806 HydrophobicContact CZ2-CB 4.22Å; W560-D806 VanDerWaalsContact NE1-CB 3.32Å; W560-D806 PolarHBondContact NE1-OD2 3.02Å; K626-D806 PolarHBondContact NZ-O 3.38Å; D806-G808 VanDerWaalsContact C-N 3.33Å; D806-G808 PolarHBondContact O-N 3.26Å; D806-G808 PolarHBondContact OD1-N 2.95Å; D806-G808 VanDerWaalsContact OD1-N 3.07Å
807	F	56.7	Low	66.9	Low	13 Å²	13	36.3 Å²	36.3	6%	0.057	19%	0.186	C	C	.	.			trans	-91	23	177.9	-78.5	-80.7	0	0	0	114.4	V606 M736 L795 C805 L809 A810	V606-F807 HydrophobicContact CB-CE1 4.21Å; V606-F807 HydrophobicContact CG1-CE1 3.98Å; V606-F807 HydrophobicContact CG2-CD1 3.68Å; V606-F807 HydrophobicContact CG2-CE1 3.5Å; M736-F807 HydrophobicContact CE-CB 4.49Å; M736-F807 HydrophobicContact CE-CD1 3.9Å; M736-F807 HydrophobicContact CE-CD2 3.51Å; M736-F807 HydrophobicContact CE-CE1 3.95Å; M736-F807 HydrophobicContact CE-CE2 3.6Å; M736-F807 HydrophobicContact CE-CG 3.67Å; M736-F807 HydrophobicContact CE-CZ 3.81Å; M736-F807 HydrophobicContact SD-CD1 4.25Å; M736-F807 HydrophobicContact SD-CE1 3.99Å; M736-F807 HydrophobicContact SD-CZ 4.13Å; L795-F807 HydrophobicContact CD1-CD2 4.48Å; L795-F807 HydrophobicContact CD1-CE2 3.42Å; L795-F807 VanDerWaalsContact CD1-CE2 3.42Å; L795-F807 HydrophobicContact CD1-CZ 3.73Å; L795-F807 HydrophobicContact CD2-CD2 4.34Å; L795-F807 HydrophobicContact CD2-CE2 4Å; L795-F807 HydrophobicContact CG-CE2 3.86Å; C805-F807 HydrophobicContact CB-CD2 3.95Å; C805-F807 HydrophobicContact CB-CE2 3.62Å; C805-F807 WeakPolarHBondContact SG-CD2 3.33Å; C805-F807 WeakPolarHBondContact SG-CE2 3.06Å; F807-L809 PolarHBondContact O-N 2.85Å; F807-A810 HydrophobicContact CD1-CB 4.12Å; F807-A810 PolarHBondContact O-N 3.01Å
808	G	56.3	Low	65.1	Low	7 Å²	7	37.2 Å²	37.2	7%	0.072	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-47.4	-36.9	178.1	0	0	0	0	0	114.9	D806	D806-G808 VanDerWaalsContact C-N 3.33Å; D806-G808 PolarHBondContact O-N 3.26Å; D806-G808 PolarHBondContact OD1-N 2.95Å; D806-G808 VanDerWaalsContact OD1-N 3.07Å
809	L	50.1	Low	64	Low	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-68.1	-30.2	176.9	-75.1	169.4	0	0	0	115.1	Y556 F603 G604 K626 L628 L640 F807	Y556-L809 HydrophobicContact CD1-CD2 3.84Å; Y556-L809 HydrophobicContact CD2-CD2 4.37Å; Y556-L809 HydrophobicContact CE1-CD1 4.49Å; Y556-L809 HydrophobicContact CE1-CD2 3.28Å; Y556-L809 HydrophobicContact CE1-CG 3.83Å; Y556-L809 HydrophobicContact CE2-CD2 3.9Å; Y556-L809 HydrophobicContact CE2-CG 4.14Å; Y556-L809 HydrophobicContact CG-CD2 4.38Å; Y556-L809 VanDerWaalsContact CZ-CG 3.5Å; Y556-L809 WeakPolarHBondContact OH-CG 3.41Å; F603-L809 HydrophobicContact CB-CD2 3.91Å; G604-L809 WeakPolarHBondContact CA-O 3.24Å; G604-L809 PolarHBondContact N-O 2.94Å; K626-L809 HydrophobicContact CD-CD1 3.93Å; K626-L809 VanDerWaalsContact CE-CD1 3.44Å; K626-L809 HydrophobicContact CG-CD1 4.26Å; L628-L809 HydrophobicContact CD2-CD2 3.72Å; L640-L809 HydrophobicContact CB-CD1 4.1Å; L640-L809 HydrophobicContact CD1-CD1 3.52Å; L640-L809 HydrophobicContact CG-CD1 4.34Å; F807-L809 PolarHBondContact O-N 2.85Å
810	A	37.4	Very low	63	Low	6 Å²	6	26.2 Å²	26.2	5%	0.05	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-94.8	9.3	-175.1	0	0	0	0	0	112.9	A600 G601 V606 F807	A600-A810 CarbonylContact C-O 3.59Å; G601-A810 VanDerWaalsContact CA-O 3.22Å; G601-A810 WeakPolarHBondContact CA-O 3.41Å; G601-A810 VanDerWaalsContact N-C 3.31Å; G601-A810 PolarHBondContact N-O 2.99Å; V606-A810 HydrophobicContact CG2-CB 3.74Å; F807-A810 HydrophobicContact CD1-CB 4.12Å; F807-A810 PolarHBondContact O-N 3.01Å
811	R	51.5	Low	61.7	Low	24 Å²	24	28.8 Å²	28.8	9%	0.091	16%	0.161	C	C	.	.	S	Bend	trans	-112.2	147.5	176	-65.3	-167.4	-174.2	124.1	12.1	113.2	G601 A602 R792 N793 I813	G601-R811 WeakPolarHBondContact CA-O 3.3Å; A602-R811 PolarHBondContact N-O 2.86Å; R792-R811 VanDerWaalsContact CD-NH1 3.29Å; R792-R811 PolarHBondContact O-NH2 2.97Å; N793-R811 VanDerWaalsContact OD1-CZ 3.23Å; N793-R811 PolarHBondContact OD1-NH1 2.8Å; N793-R811 PolarHBondContact OD1-NH2 2.74Å; R811-I813 HydrophobicContact CB-CG1 4.47Å; R811-I813 PolarHBondContact O-N 3.21Å
812	D	50.3	Low	59.7	Low	17 Å²	17	28.9 Å²	28.9	9%	0.091	16%	0.161	C	C	.	.			trans	-86.9	81	168.1	-174.2	8.4	0	0	0	109.5	Y733 M814 N815 D816	Y733-D812 HydrophobicContact CD2-CB 3.44Å; Y733-D812 VanDerWaalsContact CD2-CB 3.44Å; Y733-D812 HydrophobicContact CE2-CB 3.91Å; Y733-D812 HydrophobicContact CG-CB 4.06Å; D812-M814 PolarHBondContact O-N 2.85Å; D812-M814 WeakPolarHBondContact OD1-CB 3.41Å; D812-M814 PolarHBondContact OD1-N 2.72Å; D812-M814 VanDerWaalsContact OD1-N 3.08Å; D812-N815 PolarHBondContact O-N 2.88Å; D812-N815 PolarHBondContact OD2-ND2 3.23Å; D812-D816 PolarHBondContact O-N 3.06Å
813	I	48.3	Very low	57.8	Low	21 Å²	21	31.5 Å²	31.5	11%	0.108	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-16.3	177	-54.5	176.5	0	0	0	110.7	F603 R811 N815 Y819 R826	F603-I813 HydrophobicContact CE2-CB 4.45Å; F603-I813 HydrophobicContact CE2-CD1 4.04Å; F603-I813 HydrophobicContact CE2-CG1 4.33Å; R811-I813 HydrophobicContact CB-CG1 4.47Å; R811-I813 PolarHBondContact O-N 3.21Å; I813-N815 VanDerWaalsContact C-N 3.35Å; I813-Y819 HydrophobicContact CG2-CD1 4.5Å; I813-Y819 HydrophobicContact CG2-CG 4.2Å; I813-R826 HydrophobicContact CG2-CB 3.56Å; I813-R826 HydrophobicContact CG2-CG 4.11Å; I813-R826 WeakPolarHBondContact O-CD 3.37Å; I813-R826 PolarHBondContact O-NE 3.44Å; I813-R826 PolarHBondContact O-NH1 3.4Å; I813-R826 VanDerWaalsContact O-NH1 3.09Å
814	M	45.2	Very low	55.4	Low	76 Å²	76	36.2 Å²	36.2	37%	0.374	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-29.3	176.5	-54.8	-69.8	-102.1	0	0	114.3	P554 D812 R826	P554-M814 HydrophobicContact CG-CE 3.74Å; P554-M814 HydrophobicContact CG-SD 3.31Å; P554-M814 WeakPolarHBondContact CG-SD 3.19Å; D812-M814 PolarHBondContact O-N 2.85Å; D812-M814 WeakPolarHBondContact OD1-CB 3.41Å; D812-M814 PolarHBondContact OD1-N 2.72Å; D812-M814 VanDerWaalsContact OD1-N 3.08Å; M814-R826 VanDerWaalsContact CA-NH1 3.3Å; M814-R826 PolarHBondContact O-NH2 2.67Å; M814-R826 PolarHBondContact SD-NH1 2.82Å
815	N	46.9	Very low	53.4	Low	77 Å²	77	38.1 Å²	38.1	41%	0.412	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	2.1	-173.2	-72.9	-39.3	0	0	0	113.8	D812 I813	D812-N815 PolarHBondContact O-N 2.88Å; D812-N815 PolarHBondContact OD2-ND2 3.23Å; I813-N815 VanDerWaalsContact C-N 3.35Å
816	D	50.7	Low	52.2	Low	26 Å²	26	40.2 Å²	40.2	14%	0.139	24%	0.236	C	C	.	.			trans	-82.7	114.8	178.8	-169.4	-18.9	0	0	0	111.1	D812 N818 Y819	D812-D816 PolarHBondContact O-N 3.06Å; D816-N818 PolarHBondContact O-N 2.92Å; D816-N818 VanDerWaalsContact OD1-CB 3.23Å; D816-N818 WeakPolarHBondContact OD1-CB 3.2Å; D816-N818 PolarHBondContact OD1-N 2.87Å; D816-N818 PolarHBondContact OD1-ND2 2.82Å; D816-Y819 HydrophobicContact CB-CD2 3.87Å; D816-Y819 HydrophobicContact CB-CE2 4.46Å; D816-Y819 PolarHBondContact O-N 3.01Å; D816-Y819 WeakPolarHBondContact OD2-CE2 3.37Å
817	S	53.1	Low	51.9	Low	87 Å²	87	41.5 Å²	41.5	61%	0.608	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.5	179.9	56.6	0	0	0	0	113.9	Y819	S817-Y819 PolarHBondContact O-N 3.25Å
818	N	50.2	Low	53.1	Low	35 Å²	35	41 Å²	41	19%	0.187	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-12	174.7	-61.6	-56	0	0	0	113.3	D816 W831	D816-N818 PolarHBondContact O-N 2.92Å; D816-N818 VanDerWaalsContact OD1-CB 3.23Å; D816-N818 WeakPolarHBondContact OD1-CB 3.2Å; D816-N818 PolarHBondContact OD1-N 2.87Å; D816-N818 PolarHBondContact OD1-ND2 2.82Å; N818-W831 HydrophobicContact CB-CH2 4.05Å; N818-W831 HydrophobicContact CB-CZ3 3.83Å; N818-W831 WeakPolarHBondContact OD1-CH2 3.46Å
819	Y	56.6	Low	54.3	Low	13 Å²	13	40.9 Å²	40.9	5%	0.051	24%	0.238	C	C	.	.			trans	-114.2	128.5	-178.1	-67.1	-89.6	0	0	0	111.9	D788 R792 I813 D816 S817 L827 P828	D788-Y819 PolarHBondContact OD2-OH 2.91Å; R792-Y819 PolarHBondContact NE-OH 3.03Å; R792-Y819 VanDerWaalsContact NE-OH 3.16Å; I813-Y819 HydrophobicContact CG2-CD1 4.5Å; I813-Y819 HydrophobicContact CG2-CG 4.2Å; D816-Y819 HydrophobicContact CB-CD2 3.87Å; D816-Y819 HydrophobicContact CB-CE2 4.46Å; D816-Y819 PolarHBondContact O-N 3.01Å; D816-Y819 WeakPolarHBondContact OD2-CE2 3.37Å; S817-Y819 PolarHBondContact O-N 3.25Å; Y819-L827 WeakPolarHBondContact CA-O 3.47Å; Y819-P828 HydrophobicContact CD1-CB 4.06Å; Y819-P828 HydrophobicContact CE1-CB 3.66Å; Y819-P828 HydrophobicContact CE1-CG 4.21Å
820	V	58.1	Low	56.1	Low	35 Å²	35	42 Å²	42	21%	0.212	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.4	178.3	-177	0	0	0	0	109.8	K822 R826 L827 V829 V871	V820-K822 PolarHBondContact O-N 3.46Å; V820-R826 WeakPolarHBondContact O-CA 3.45Å; V820-L827 PolarHBondContact N-O 3.07Å; V820-L827 PolarHBondContact O-N 2.94Å; V820-V829 HydrophobicContact CB-CG2 3.85Å; V820-V829 HydrophobicContact CG2-CB 4.29Å; V820-V829 HydrophobicContact CG2-CG2 4.18Å; V820-V871 HydrophobicContact CG2-CB 3.76Å; V820-V871 HydrophobicContact CG2-CG1 3.74Å; V820-V871 HydrophobicContact CG2-CG2 4.08Å
821	V	54.4	Low	58.7	Low	89 Å²	89	41.9 Å²	41.9	54%	0.539	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	117.1	173.6	-176.2	0	0	0	0	108.6	R826	V821-R826 HydrophobicContact CG2-CG 3.85Å; V821-R826 VanDerWaalsContact CG2-NE 3.33Å
822	K	46.4	Very low	60.4	Low	47 Å²	47	41 Å²	41	20%	0.204	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	110.4	172	-166	174.8	174.9	-176.8	0	107.9	V820 N824 A825 L827 I837 C980	V820-K822 PolarHBondContact O-N 3.46Å; K822-N824 PolarHBondContact O-N 2.63Å; K822-A825 PolarHBondContact N-O 2.74Å; K822-A825 PolarHBondContact O-N 2.63Å; K822-L827 HydrophobicContact CB-CD1 4.25Å; K822-L827 HydrophobicContact CD-CD1 4.49Å; K822-I837 PolarHBondContact NZ-O 3.35Å; K822-C980 WeakPolarHBondContact CE-OXT 3.46Å
823	G	56.2	Low	62.3	Low	54 Å²	54	40.2 Å²	40.2	56%	0.557	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	-129.8	-168.6	0	0	0	0	0	112.2
824	N	43.8	Very low	64.2	Low	112 Å²	112	39.8 Å²	39.8	60%	0.599	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	3.6	178.2	-68.2	-20.6	0	0	0	113.8	K822	K822-N824 PolarHBondContact O-N 2.63Å
825	A	49.9	Very low	66.1	Low	42 Å²	42	37 Å²	37	35%	0.347	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	152.2	-174.9	0	0	0	0	0	112.2	K822	K822-A825 PolarHBondContact N-O 2.74Å; K822-A825 PolarHBondContact O-N 2.63Å
826	R	60.6	Low	67.9	Low	53 Å²	53	33.4 Å²	33.4	20%	0.2	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.4	171.9	-84.6	-131.1	-170.4	68.9	-5.5	110.7	R559 I813 M814 V820 V821	R559-R826 PolarHBondContact NH2-O 3.44Å; I813-R826 HydrophobicContact CG2-CB 3.56Å; I813-R826 HydrophobicContact CG2-CG 4.11Å; I813-R826 WeakPolarHBondContact O-CD 3.37Å; I813-R826 PolarHBondContact O-NE 3.44Å; I813-R826 PolarHBondContact O-NH1 3.4Å; I813-R826 VanDerWaalsContact O-NH1 3.09Å; M814-R826 VanDerWaalsContact CA-NH1 3.3Å; M814-R826 PolarHBondContact O-NH2 2.67Å; M814-R826 PolarHBondContact SD-NH1 2.82Å; V820-R826 WeakPolarHBondContact O-CA 3.45Å; V821-R826 HydrophobicContact CG2-CG 3.85Å; V821-R826 VanDerWaalsContact CG2-NE 3.33Å
827	L	67.9	Low	69.2	Low	37 Å²	37	32.4 Å²	32.4	19%	0.194	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141.7	-169.5	-62.8	177.3	0	0	0	111.7	Y819 V820 K822 V829 M832	Y819-L827 WeakPolarHBondContact CA-O 3.47Å; V820-L827 PolarHBondContact N-O 3.07Å; V820-L827 PolarHBondContact O-N 2.94Å; K822-L827 HydrophobicContact CB-CD1 4.25Å; K822-L827 HydrophobicContact CD-CD1 4.49Å; L827-V829 HydrophobicContact CB-CG2 4.02Å; L827-V829 PolarHBondContact O-N 2.95Å; L827-M832 HydrophobicContact CB-SD 3.75Å; L827-M832 HydrophobicContact CD1-CE 4.32Å; L827-M832 HydrophobicContact CD1-SD 4.43Å; L827-M832 HydrophobicContact CG-SD 4.49Å
828	P	81.1	Confident	70.5	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.019	18%	0.177	C	C	.	.			trans	-79.4	61.8	178.9	36	-36.6	0	0	0	110.4	D788 Y819 K830 W831 M832	D788-P828 WeakPolarHBondContact OD1-CB 3.49Å; D788-P828 WeakPolarHBondContact OD1-CG 3.36Å; Y819-P828 HydrophobicContact CD1-CB 4.06Å; Y819-P828 HydrophobicContact CE1-CB 3.66Å; Y819-P828 HydrophobicContact CE1-CG 4.21Å; P828-K830 PolarHBondContact O-N 3.06Å; P828-W831 HydrophobicContact CB-CE3 4.25Å; P828-W831 PolarHBondContact O-N 3.18Å; P828-M832 HydrophobicContact CG-CG 4.07Å; P828-M832 HydrophobicContact CG-SD 4.29Å; P828-M832 WeakPolarHBondContact O-CG 3.44Å; P828-M832 PolarHBondContact O-N 3.03Å
829	V	82.7	Confident	71.7	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.018	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-33.9	-163.3	174.4	0	0	0	0	113.7	V820 L827 W831 M832 I837 V871 F875 Y876	V820-V829 HydrophobicContact CB-CG2 3.85Å; V820-V829 HydrophobicContact CG2-CB 4.29Å; V820-V829 HydrophobicContact CG2-CG2 4.18Å; L827-V829 HydrophobicContact CB-CG2 4.02Å; L827-V829 PolarHBondContact O-N 2.95Å; V829-W831 PolarHBondContact O-N 2.96Å; V829-M832 PolarHBondContact O-N 3.09Å; V829-I837 HydrophobicContact CG1-CD1 4.21Å; V829-V871 HydrophobicContact CB-CG1 4.14Å; V829-V871 HydrophobicContact CG1-CG1 3.69Å; V829-F875 HydrophobicContact CG1-CD1 4.33Å; V829-F875 HydrophobicContact CG1-CE1 3.71Å; V829-Y876 HydrophobicContact CG1-CE1 3.74Å
830	K	87.4	Confident	72.3	Confident	26 Å²	26	36.9 Å²	36.9	11%	0.113	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.6	177.5	-68.5	-174.6	169.7	-159.7	0	114.3	P828 S864 P865 Y866 M869 V871 F875	P828-K830 PolarHBondContact O-N 3.06Å; K830-S864 PolarHBondContact NZ-OG 3.02Å; K830-P865 HydrophobicContact CB-CB 4.49Å; K830-P865 WeakPolarHBondContact CD-O 3.05Å; K830-P865 PolarHBondContact NZ-O 3.08Å; K830-Y866 HydrophobicContact CB-CD2 4.12Å; K830-Y866 HydrophobicContact CB-CE2 4.41Å; K830-Y866 HydrophobicContact CG-CD2 4.21Å; K830-Y866 VanDerWaalsContact O-CE2 3.28Å; K830-Y866 WeakPolarHBondContact O-CE2 3.34Å; K830-M869 PolarHBondContact NZ-O 2.98Å; K830-V871 HydrophobicContact CD-CG2 4.34Å; K830-V871 HydrophobicContact CG-CG2 3.8Å; K830-F875 HydrophobicContact CG-CE2 4.31Å; K830-F875 HydrophobicContact CG-CZ 4.24Å
831	W	91.7	Very high	72.9	Confident	2 Å²	2	38 Å²	38	1%	0.008	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-15	177.8	-70.3	-100.9	0	0	0	112.7	A790 R792 N818 P828 V829 S850 I853 E857 P865	A790-W831 HydrophobicContact CB-CD2 4.36Å; A790-W831 HydrophobicContact CB-CG 4.17Å; R792-W831 VanDerWaalsContact NH1-CE2 3.32Å; R792-W831 VanDerWaalsContact NH1-CH2 3.27Å; N818-W831 HydrophobicContact CB-CH2 4.05Å; N818-W831 HydrophobicContact CB-CZ3 3.83Å; N818-W831 WeakPolarHBondContact OD1-CH2 3.46Å; P828-W831 HydrophobicContact CB-CE3 4.25Å; P828-W831 PolarHBondContact O-N 3.18Å; V829-W831 PolarHBondContact O-N 2.96Å; W831-S850 WeakPolarHBondContact O-CA 3.5Å; W831-S850 PolarHBondContact O-OG 3.25Å; W831-I853 VanDerWaalsContact CD1-CG2 3.43Å; W831-I853 HydrophobicContact CD2-CG2 4.4Å; W831-I853 HydrophobicContact CG-CB 4.47Å; W831-I853 HydrophobicContact CG-CG2 3.95Å; W831-E857 WeakPolarHBondContact CZ2-OE1 3.32Å; W831-E857 VanDerWaalsContact NE1-CD 3.32Å; W831-E857 PolarHBondContact NE1-OE2 2.93Å; W831-P865 HydrophobicContact CH2-CG 4.18Å; W831-P865 HydrophobicContact CZ2-CG 3.55Å
832	M	87.3	Confident	74	Confident	7 Å²	7	35.6 Å²	35.6	3%	0.034	20%	0.203	C	C	.	.	S	Bend	trans	-78.9	144.5	-171.1	-68.3	174.3	64.7	0	0	112.9	L827 P828 V829 S836 I837 Y842 W849	L827-M832 HydrophobicContact CB-SD 3.75Å; L827-M832 HydrophobicContact CD1-CE 4.32Å; L827-M832 HydrophobicContact CD1-SD 4.43Å; L827-M832 HydrophobicContact CG-SD 4.49Å; P828-M832 HydrophobicContact CG-CG 4.07Å; P828-M832 HydrophobicContact CG-SD 4.29Å; P828-M832 WeakPolarHBondContact O-CG 3.44Å; P828-M832 PolarHBondContact O-N 3.03Å; V829-M832 PolarHBondContact O-N 3.09Å; M832-S836 WeakPolarHBondContact CE-O 3.25Å; M832-I837 HydrophobicContact CB-CD1 3.98Å; M832-I837 HydrophobicContact CB-CG1 3.56Å; M832-I837 HydrophobicContact CE-CG1 4.22Å; M832-I837 WeakPolarHBondContact O-CD1 3.47Å; M832-Y842 HydrophobicContact CE-CE1 4.04Å; M832-Y842 WeakPolarHBondContact CE-OH 3.07Å; M832-W849 PolarHBondContact O-NE1 2.8Å
833	A	89.3	Confident	75.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.196	C	C	.	.			trans	-69.9	154.1	172.5	0	0	0	0	0	111.8	E835 S836 I837 W849	A833-E835 VanDerWaalsContact C-N 3.31Å; A833-E835 VanDerWaalsContact CB-CD 3.45Å; A833-E835 VanDerWaalsContact CB-OE1 3.31Å; A833-E835 WeakPolarHBondContact CB-OE1 3.48Å; A833-E835 WeakPolarHBondContact CB-OE2 3.27Å; A833-E835 PolarHBondContact O-N 3.04Å; A833-S836 WeakPolarHBondContact O-CA 3.35Å; A833-S836 WeakPolarHBondContact O-CB 3.42Å; A833-S836 PolarHBondContact O-N 3.23Å; A833-I837 WeakPolarHBondContact O-CG1 3.4Å; A833-I837 PolarHBondContact O-N 3.08Å; A833-W849 HydrophobicContact CB-CB 3.69Å; A833-W849 HydrophobicContact CB-CD2 4.06Å; A833-W849 HydrophobicContact CB-CG 3.68Å
834	P	88	Confident	77.1	Confident	12 Å²	12	32.9 Å²	32.9	8%	0.078	18%	0.179	C	C	.	.	H	α-helix	trans	-53.9	-44.8	179.3	-25.5	33.6	0	0	0	113.1	S836 I837 F838 W849 V879 L905	P834-S836 PolarHBondContact O-N 3.17Å; P834-I837 PolarHBondContact O-N 3Å; P834-I837 VanDerWaalsContact O-N 3.12Å; P834-F838 HydrophobicContact CB-CD2 4.15Å; P834-F838 HydrophobicContact CB-CE2 4.22Å; P834-F838 WeakPolarHBondContact O-CD2 3.47Å; P834-F838 PolarHBondContact O-N 3.31Å; P834-W849 HydrophobicContact CG-CE3 4.43Å; P834-W849 HydrophobicContact CG-CH2 3.67Å; P834-W849 HydrophobicContact CG-CZ2 4.1Å; P834-W849 HydrophobicContact CG-CZ3 3.84Å; P834-V879 HydrophobicContact CB-CG1 4.45Å; P834-V879 HydrophobicContact CG-CG1 4Å; P834-L905 HydrophobicContact CG-CD2 3.9Å
835	E	85.9	Confident	79.4	Confident	16 Å²	16	29.5 Å²	29.5	8%	0.075	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-28.7	178	70.9	-80.8	-170	0	0	112.5	A833 D839 C840 V841 P907 R910	A833-E835 VanDerWaalsContact C-N 3.31Å; A833-E835 VanDerWaalsContact CB-CD 3.45Å; A833-E835 VanDerWaalsContact CB-OE1 3.31Å; A833-E835 WeakPolarHBondContact CB-OE1 3.48Å; A833-E835 WeakPolarHBondContact CB-OE2 3.27Å; A833-E835 PolarHBondContact O-N 3.04Å; E835-D839 CarbonylContact O-C 3.46Å; E835-D839 VanDerWaalsContact O-C 3.29Å; E835-D839 WeakPolarHBondContact O-CA 3.27Å; E835-D839 WeakPolarHBondContact O-CB 3.4Å; E835-D839 PolarHBondContact O-N 2.85Å; E835-C840 PolarHBondContact O-N 3.49Å; E835-V841 HydrophobicContact CB-CB 4.26Å; E835-V841 HydrophobicContact CG-CB 4.18Å; E835-V841 HydrophobicContact CG-CG1 4.35Å; E835-V841 PolarHBondContact O-N 2.8Å; E835-P907 HydrophobicContact CG-CG 4.28Å; E835-R910 IonicContact OE1-CZ 3.45Å; E835-R910 IonicContact OE1-NH1 3.52Å; E835-R910 PolarHBondContact OE1-NH1 3.25Å; E835-R910 IonicContact OE1-NH2 3.36Å; E835-R910 PolarHBondContact OE1-NH2 2.76Å; E835-R910 IonicContact OE2-CZ 3.68Å; E835-R910 IonicContact OE2-NH1 2.75Å; E835-R910 IonicContact OE2-NH2 2.82Å; E835-R910 PolarHBondContact OE2-NH2 3.5Å
836	S	83.8	Confident	81.2	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-76.7	-32.1	174.3	-51.8	0	0	0	0	112.1	M832 A833 P834 V841 S846	M832-S836 WeakPolarHBondContact CE-O 3.25Å; A833-S836 WeakPolarHBondContact O-CA 3.35Å; A833-S836 WeakPolarHBondContact O-CB 3.42Å; A833-S836 PolarHBondContact O-N 3.23Å; P834-S836 PolarHBondContact O-N 3.17Å; S836-V841 VanDerWaalsContact CA-O 3.25Å; S836-V841 WeakPolarHBondContact CA-O 3.45Å; S836-V841 WeakPolarHBondContact CB-O 3.21Å; S836-V841 PolarHBondContact N-O 2.94Å; S836-V841 PolarHBondContact OG-O 2.94Å; S836-S846 VanDerWaalsContact OG-CB 3.28Å; S836-S846 WeakPolarHBondContact OG-CB 3.28Å
837	I	79.3	Confident	82.7	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-77.3	-44.1	179.7	-66.1	169.4	0	0	0	111.6	K822 V829 M832 A833 P834 Y876 V879	K822-I837 PolarHBondContact NZ-O 3.35Å; V829-I837 HydrophobicContact CG1-CD1 4.21Å; M832-I837 HydrophobicContact CB-CD1 3.98Å; M832-I837 HydrophobicContact CB-CG1 3.56Å; M832-I837 HydrophobicContact CE-CG1 4.22Å; M832-I837 WeakPolarHBondContact O-CD1 3.47Å; A833-I837 WeakPolarHBondContact O-CG1 3.4Å; A833-I837 PolarHBondContact O-N 3.08Å; P834-I837 PolarHBondContact O-N 3Å; P834-I837 VanDerWaalsContact O-N 3.12Å; I837-Y876 HydrophobicContact CG2-CD1 3.74Å; I837-Y876 HydrophobicContact CG2-CE1 3.66Å; I837-V879 HydrophobicContact CD1-CG1 4.2Å
838	F	80.3	Confident	84	Confident	52 Å²	52	23.5 Å²	23.5	23%	0.228	13%	0.126	C	C	.	.	H	α-helix	trans	-99.3	-37.5	-170	-58.8	-61.6	0	0	0	113	P834 Y876 V879 K880	P834-F838 HydrophobicContact CB-CD2 4.15Å; P834-F838 HydrophobicContact CB-CE2 4.22Å; P834-F838 WeakPolarHBondContact O-CD2 3.47Å; P834-F838 PolarHBondContact O-N 3.31Å; F838-Y876 HydrophobicContact CE1-CD1 4.05Å; F838-Y876 HydrophobicContact CZ-CD1 4.23Å; F838-Y876 WeakPolarHBondContact CZ-O 3.47Å; F838-V879 HydrophobicContact CE2-CG1 4.46Å; F838-K880 HydrophobicContact CE2-CB 3.82Å; F838-K880 HydrophobicContact CE2-CG 4.24Å; F838-K880 HydrophobicContact CZ-CB 3.88Å
839	D	74.2	Confident	84.7	Confident	113 Å²	113	23.5 Å²	23.5	60%	0.604	13%	0.126	S	C	*	.	S	Bend	trans	-112	0.2	-172.2	-47.4	-48.8	0	0	0	112.3	E835 V841	E835-D839 CarbonylContact O-C 3.46Å; E835-D839 VanDerWaalsContact O-C 3.29Å; E835-D839 WeakPolarHBondContact O-CA 3.27Å; E835-D839 WeakPolarHBondContact O-CB 3.4Å; E835-D839 PolarHBondContact O-N 2.85Å; D839-V841 HydrophobicContact CB-CG2 4.02Å; D839-V841 PolarHBondContact O-N 3.25Å
840	C	68.9	Low	85.3	Confident	63 Å²	63	23.6 Å²	23.6	43%	0.426	13%	0.127	S	C	.	.			trans	55.5	27.2	-177.2	-70.9	0	0	0	0	114.2	E835 Y842 C980	E835-C840 PolarHBondContact O-N 3.49Å; C840-Y842 WeakPolarHBondContact O-CD2 3.44Å; C840-C980 PolarHBondContact SG-SG 2.93Å
841	V	72.7	Confident	85.8	Confident	58 Å²	58	22.4 Å²	22.4	35%	0.352	12%	0.122	S	C	.	.			trans	-89.7	121.7	178.9	176.9	0	0	0	0	109.7	E835 S836 D839 T843	E835-V841 HydrophobicContact CB-CB 4.26Å; E835-V841 HydrophobicContact CG-CB 4.18Å; E835-V841 HydrophobicContact CG-CG1 4.35Å; E835-V841 PolarHBondContact O-N 2.8Å; S836-V841 VanDerWaalsContact CA-O 3.25Å; S836-V841 WeakPolarHBondContact CA-O 3.45Å; S836-V841 WeakPolarHBondContact CB-O 3.21Å; S836-V841 PolarHBondContact N-O 2.94Å; S836-V841 PolarHBondContact OG-O 2.94Å; D839-V841 HydrophobicContact CB-CG2 4.02Å; D839-V841 PolarHBondContact O-N 3.25Å; V841-T843 HydrophobicContact CG1-CG2 3.86Å
842	Y	76.2	Confident	86.1	Confident	40 Å²	40	22.3 Å²	22.3	16%	0.157	12%	0.121	C	C	.	.			trans	-117.7	124.9	175.8	-63.1	-90.5	0	0	0	109.4	I785 R787 M832 C840	I785-Y842 WeakPolarHBondContact CD1-O 3.35Å; R787-Y842 HydrophobicContact CB-CD1 4.06Å; R787-Y842 HydrophobicContact CB-CE1 4.36Å; R787-Y842 HydrophobicContact CG-CD1 3.82Å; R787-Y842 HydrophobicContact CG-CG 4.26Å; M832-Y842 HydrophobicContact CE-CE1 4.04Å; M832-Y842 WeakPolarHBondContact CE-OH 3.07Å; C840-Y842 WeakPolarHBondContact O-CD2 3.44Å
843	T	82.4	Confident	86.5	Confident	10 Å²	10	22 Å²	22	6%	0.061	12%	0.12	C	C	.	.			trans	-143.5	171	-177.7	65.1	0	0	0	0	110.5	Y571 V841 Q845 S846 D847	Y571-T843 HydrophobicContact CD2-CG2 4.48Å; Y571-T843 HydrophobicContact CE1-CG2 4.3Å; Y571-T843 HydrophobicContact CE2-CG2 3.67Å; Y571-T843 WeakPolarHBondContact OH-CG2 3.36Å; V841-T843 HydrophobicContact CG1-CG2 3.86Å; T843-Q845 PolarHBondContact O-N 3.43Å; T843-Q845 PolarHBondContact OG1-N 2.81Å; T843-S846 PolarHBondContact N-OG 2.98Å; T843-S846 PolarHBondContact O-N 2.63Å; T843-S846 PolarHBondContact O-OG 2.99Å; T843-S846 PolarHBondContact OG1-N 2.76Å; T843-D847 PolarHBondContact O-N 2.72Å
844	V	85.6	Confident	86.8	Confident	34 Å²	34	22 Å²	22	21%	0.206	12%	0.12	C	C	.	.	H	α-helix	trans	-53.5	-36.9	167.9	176.7	0	0	0	0	110.9	A780 I785 S846 D847 V848 F913	A780-V844 HydrophobicContact CB-CG1 3.64Å; A780-V844 HydrophobicContact CB-CG2 4.07Å; I785-V844 HydrophobicContact CG1-CG2 4.47Å; V844-S846 VanDerWaalsContact C-N 3.3Å; V844-S846 PolarHBondContact O-N 3.21Å; V844-D847 WeakPolarHBondContact O-CB 3.33Å; V844-D847 PolarHBondContact O-N 3.42Å; V844-D847 VanDerWaalsContact O-N 3.08Å; V844-V848 WeakPolarHBondContact O-CG2 3.33Å; V844-V848 PolarHBondContact O-N 3.32Å; V844-F913 HydrophobicContact CG1-CD2 4.17Å; V844-F913 HydrophobicContact CG1-CE2 3.94Å
845	Q	92.1	Very high	87.2	Confident	40 Å²	40	21.4 Å²	21.4	19%	0.187	12%	0.116	C	C	.	.	H	α-helix	trans	-68.4	-27.6	178.5	-57.6	-56.3	95.3	0	0	112.9	T843 V848 W849 P907 R910	T843-Q845 PolarHBondContact O-N 3.43Å; T843-Q845 PolarHBondContact OG1-N 2.81Å; Q845-V848 WeakPolarHBondContact O-CB 3.14Å; Q845-V848 PolarHBondContact O-N 3.3Å; Q845-W849 PolarHBondContact O-N 2.88Å; Q845-P907 HydrophobicContact CB-CB 3.88Å; Q845-P907 HydrophobicContact CG-CB 4.41Å; Q845-P907 WeakPolarHBondContact CG-O 3.19Å; Q845-P907 PolarHBondContact NE2-O 2.87Å; Q845-R910 VanDerWaalsContact C-NH1 3.35Å; Q845-R910 PolarHBondContact NE2-O 2.98Å; Q845-R910 WeakPolarHBondContact O-CD 3.34Å; Q845-R910 PolarHBondContact O-NH1 3.28Å
846	S	87.9	Confident	87.7	Confident	3 Å²	3	20.9 Å²	20.9	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-72.8	-30	171.3	66.4	0	0	0	0	112.6	S836 T843 V844 W849 S850	S836-S846 VanDerWaalsContact OG-CB 3.28Å; S836-S846 WeakPolarHBondContact OG-CB 3.28Å; T843-S846 PolarHBondContact N-OG 2.98Å; T843-S846 PolarHBondContact O-N 2.63Å; T843-S846 PolarHBondContact O-OG 2.99Å; T843-S846 PolarHBondContact OG1-N 2.76Å; V844-S846 VanDerWaalsContact C-N 3.3Å; V844-S846 PolarHBondContact O-N 3.21Å; S846-W849 WeakPolarHBondContact O-CB 3.44Å; S846-W849 PolarHBondContact O-N 3.12Å; S846-S850 PolarHBondContact O-N 2.82Å; S846-S850 VanDerWaalsContact O-N 3.16Å; S846-S850 PolarHBondContact O-OG 3.03Å
847	D	91.2	Very high	88.2	Confident	4 Å²	4	20.8 Å²	20.8	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-70.7	-34.2	170.1	-73.9	-20	0	0	0	111.1	I785 H786 R787 V789 T843 V844 W849 S850 Y851 F913	I785-D847 WeakPolarHBondContact CA-OD2 3.21Å; I785-D847 WeakPolarHBondContact CG2-OD2 3.41Å; H786-D847 PolarHBondContact N-OD2 2.79Å; R787-D847 WeakPolarHBondContact CA-OD1 3.07Å; R787-D847 PolarHBondContact N-OD1 2.81Å; V789-D847 HydrophobicContact CG2-CB 4.18Å; T843-D847 PolarHBondContact O-N 2.72Å; V844-D847 WeakPolarHBondContact O-CB 3.33Å; V844-D847 PolarHBondContact O-N 3.42Å; V844-D847 VanDerWaalsContact O-N 3.08Å; D847-W849 VanDerWaalsContact C-N 3.32Å; D847-W849 PolarHBondContact O-N 2.97Å; D847-S850 CarbonylContact O-C 3.54Å; D847-S850 WeakPolarHBondContact O-CB 3.22Å; D847-S850 PolarHBondContact O-N 2.89Å; D847-Y851 WeakPolarHBondContact O-CB 3.41Å; D847-Y851 PolarHBondContact O-N 2.97Å; D847-F913 HydrophobicContact CB-CE2 4.27Å; D847-F913 HydrophobicContact CB-CZ 4Å
848	V	96.7	Very high	89	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.4	-42.1	172.7	173.7	0	0	0	0	111.1	V844 Q845 Y851 G852 C902 R910 P911 F913 I916	V844-V848 WeakPolarHBondContact O-CG2 3.33Å; V844-V848 PolarHBondContact O-N 3.32Å; Q845-V848 WeakPolarHBondContact O-CB 3.14Å; Q845-V848 PolarHBondContact O-N 3.3Å; V848-Y851 WeakPolarHBondContact O-CB 3.17Å; V848-Y851 PolarHBondContact O-N 2.93Å; V848-G852 PolarHBondContact O-N 3.17Å; V848-C902 HydrophobicContact CG1-CB 4.08Å; V848-C902 WeakPolarHBondContact O-CB 3.35Å; V848-R910 HydrophobicContact CG1-CB 3.9Å; V848-P911 WeakPolarHBondContact CG1-O 3.39Å; V848-F913 HydrophobicContact CB-CZ 4.34Å; V848-F913 HydrophobicContact CG2-CD1 4.42Å; V848-F913 HydrophobicContact CG2-CD2 4.27Å; V848-F913 HydrophobicContact CG2-CE1 3.98Å; V848-F913 HydrophobicContact CG2-CE2 3.82Å; V848-F913 HydrophobicContact CG2-CZ 3.66Å; V848-I916 HydrophobicContact CG1-CD1 4.04Å
849	W	95.6	Very high	89.6	Confident	2 Å²	2	18.1 Å²	18.1	1%	0.008	10%	0.101	C	C	.	.	H	α-helix	trans	-58.6	-49.2	172.9	178.2	-74.5	0	0	0	111.4	M832 A833 P834 Q845 S846 D847 Y851 G852 I853 W903	M832-W849 PolarHBondContact O-NE1 2.8Å; A833-W849 HydrophobicContact CB-CB 3.69Å; A833-W849 HydrophobicContact CB-CD2 4.06Å; A833-W849 HydrophobicContact CB-CG 3.68Å; P834-W849 HydrophobicContact CG-CE3 4.43Å; P834-W849 HydrophobicContact CG-CH2 3.67Å; P834-W849 HydrophobicContact CG-CZ2 4.1Å; P834-W849 HydrophobicContact CG-CZ3 3.84Å; Q845-W849 PolarHBondContact O-N 2.88Å; S846-W849 WeakPolarHBondContact O-CB 3.44Å; S846-W849 PolarHBondContact O-N 3.12Å; D847-W849 VanDerWaalsContact C-N 3.32Å; D847-W849 PolarHBondContact O-N 2.97Å; W849-Y851 VanDerWaalsContact C-N 3.26Å; W849-Y851 PolarHBondContact O-N 3.24Å; W849-G852 PolarHBondContact O-N 3.18Å; W849-I853 PolarHBondContact O-N 2.93Å; W849-W903 AromaticContact CD2-CD1 3.97Å; W849-W903 HydrophobicContact CE3-CB 4.28Å; W849-W903 HydrophobicContact CH2-CB 4.18Å; W849-W903 HydrophobicContact CZ3-CB 4.03Å; W849-W903 WeakPolarHBondContact CZ3-O 3.41Å
850	S	95.4	Very high	90.3	Very high	6 Å²	6	12.9 Å²	12.9	4%	0.042	7%	0.073	C	C	.	.	H	α-helix	trans	-60.6	-37.3	179.5	-53.4	0	0	0	0	111.6	W831 S846 D847 I853 L854	W831-S850 WeakPolarHBondContact O-CA 3.5Å; W831-S850 PolarHBondContact O-OG 3.25Å; S846-S850 PolarHBondContact O-N 2.82Å; S846-S850 VanDerWaalsContact O-N 3.16Å; S846-S850 PolarHBondContact O-OG 3.03Å; D847-S850 CarbonylContact O-C 3.54Å; D847-S850 WeakPolarHBondContact O-CB 3.22Å; D847-S850 PolarHBondContact O-N 2.89Å; S850-I853 WeakPolarHBondContact O-CB 3.5Å; S850-I853 PolarHBondContact O-N 3.35Å; S850-I853 VanDerWaalsContact O-N 3.15Å; S850-L854 PolarHBondContact O-N 3.34Å
851	Y	97.8	Very high	91.2	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63.9	-38.2	173.6	177.6	-96.8	0	0	0	112.5	S769 V772 A773 L776 D847 V848 W849 I853 L854 L855 F913 I916 I920	S769-Y851 PolarHBondContact O-OH 3.1Å; V772-Y851 HydrophobicContact CB-CE2 4.2Å; V772-Y851 HydrophobicContact CG1-CD2 4.09Å; V772-Y851 HydrophobicContact CG1-CE2 3.95Å; A773-Y851 HydrophobicContact CB-CE2 4.24Å; L776-Y851 HydrophobicContact CD1-CD2 3.47Å; L776-Y851 VanDerWaalsContact CD1-CD2 3.47Å; L776-Y851 HydrophobicContact CD1-CE2 4.3Å; L776-Y851 HydrophobicContact CD1-CG 4.06Å; D847-Y851 WeakPolarHBondContact O-CB 3.41Å; D847-Y851 PolarHBondContact O-N 2.97Å; V848-Y851 WeakPolarHBondContact O-CB 3.17Å; V848-Y851 PolarHBondContact O-N 2.93Å; W849-Y851 VanDerWaalsContact C-N 3.26Å; W849-Y851 PolarHBondContact O-N 3.24Å; Y851-I853 VanDerWaalsContact C-N 3.27Å; Y851-I853 PolarHBondContact O-N 3.19Å; Y851-L854 HydrophobicContact CD2-CD2 3.98Å; Y851-L854 HydrophobicContact CE2-CD2 4.29Å; Y851-L854 WeakPolarHBondContact O-CB 3.29Å; Y851-L854 PolarHBondContact O-N 3.45Å; Y851-L855 HydrophobicContact CD1-CD1 4.1Å; Y851-L855 HydrophobicContact CD1-CG 4.19Å; Y851-L855 HydrophobicContact CE1-CD1 3.52Å; Y851-L855 HydrophobicContact CE1-CD2 4.03Å; Y851-L855 HydrophobicContact CE1-CG 3.69Å; Y851-L855 HydrophobicContact CE2-CD2 4.42Å; Y851-L855 WeakPolarHBondContact O-CG 3.41Å; Y851-L855 PolarHBondContact O-N 2.86Å; Y851-F913 HydrophobicContact CD1-CE1 4.3Å; Y851-F913 HydrophobicContact CD2-CE1 4.3Å; Y851-F913 AromaticContact CG-CE1 3.85Å; Y851-F913 HydrophobicContact CG-CE1 3.85Å; Y851-I916 HydrophobicContact CD1-CD1 4.18Å; Y851-I916 HydrophobicContact CD1-CG2 4.48Å; Y851-I916 HydrophobicContact CE1-CD1 4.35Å; Y851-I916 HydrophobicContact CE1-CG2 3.61Å; Y851-I920 VanDerWaalsContact OH-CD1 3.26Å; Y851-I920 WeakPolarHBondContact OH-CD1 3.44Å
852	G	96.8	Very high	91.9	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-59.6	-37.9	171.2	0	0	0	0	0	112.7	V848 W849 L855 W856 W903	V848-G852 PolarHBondContact O-N 3.17Å; W849-G852 PolarHBondContact O-N 3.18Å; G852-L855 PolarHBondContact O-N 2.97Å; G852-W856 PolarHBondContact O-N 3.03Å; G852-W903 VanDerWaalsContact O-CZ2 3.27Å; G852-W903 WeakPolarHBondContact O-CZ2 3.35Å
853	I	95.9	Very high	92.3	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-68.5	-42	174.1	-53.9	-66.8	0	0	0	110.9	W831 W849 S850 Y851 L855 W856 E857 P865 Y866 M885 W903	W831-I853 VanDerWaalsContact CD1-CG2 3.43Å; W831-I853 HydrophobicContact CD2-CG2 4.4Å; W831-I853 HydrophobicContact CG-CB 4.47Å; W831-I853 HydrophobicContact CG-CG2 3.95Å; W849-I853 PolarHBondContact O-N 2.93Å; S850-I853 WeakPolarHBondContact O-CB 3.5Å; S850-I853 PolarHBondContact O-N 3.35Å; S850-I853 VanDerWaalsContact O-N 3.15Å; Y851-I853 VanDerWaalsContact C-N 3.27Å; Y851-I853 PolarHBondContact O-N 3.19Å; I853-L855 VanDerWaalsContact C-N 3.34Å; I853-L855 PolarHBondContact O-N 2.78Å; I853-W856 WeakPolarHBondContact O-CA 3.31Å; I853-W856 WeakPolarHBondContact O-CB 3.33Å; I853-W856 PolarHBondContact O-N 3.12Å; I853-W856 VanDerWaalsContact O-N 3.11Å; I853-E857 PolarHBondContact O-N 3.44Å; I853-P865 HydrophobicContact CG2-CB 3.73Å; I853-P865 HydrophobicContact CG2-CG 3.53Å; I853-Y866 HydrophobicContact CD1-CE2 4.08Å; I853-M885 HydrophobicContact CD1-CE 3.38Å; I853-M885 HydrophobicContact CG2-CE 4.5Å; I853-W903 HydrophobicContact CD1-CZ2 3.85Å; I853-W903 VanDerWaalsContact CD1-NE1 3.31Å
854	L	96.7	Very high	92.4	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-57.8	-45	173.8	167.4	70.2	0	0	0	111.7	V772 V789 A791 V794 S850 Y851 W856 E857 I858	V772-L854 HydrophobicContact CB-CD2 4.25Å; V772-L854 HydrophobicContact CG1-CD2 3.52Å; V772-L854 HydrophobicContact CG2-CD2 4.43Å; V789-L854 HydrophobicContact CG1-CB 4.43Å; V789-L854 HydrophobicContact CG1-CD2 4.01Å; A791-L854 HydrophobicContact CB-CD1 3.72Å; V794-L854 HydrophobicContact CG2-CD1 4.45Å; V794-L854 HydrophobicContact CG2-CD2 4.37Å; S850-L854 PolarHBondContact O-N 3.34Å; Y851-L854 HydrophobicContact CD2-CD2 3.98Å; Y851-L854 HydrophobicContact CE2-CD2 4.29Å; Y851-L854 WeakPolarHBondContact O-CB 3.29Å; Y851-L854 PolarHBondContact O-N 3.45Å; L854-W856 PolarHBondContact O-N 2.95Å; L854-E857 WeakPolarHBondContact O-CA 3.43Å; L854-E857 WeakPolarHBondContact O-CB 3.28Å; L854-E857 PolarHBondContact O-N 3.11Å; L854-E857 VanDerWaalsContact O-N 3.08Å; L854-I858 HydrophobicContact CD1-CD1 4.17Å; L854-I858 HydrophobicContact CD1-CG1 4.25Å; L854-I858 HydrophobicContact CG-CD1 4.02Å; L854-I858 HydrophobicContact CG-CG1 4.48Å; L854-I858 WeakPolarHBondContact O-CG1 2.96Å; L854-I858 PolarHBondContact O-N 3.46Å
855	L	97	Very high	92.5	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-57.8	-42	175.3	-72.7	-178.8	0	0	0	110.9	S769 Y851 G852 I853 E857 I858 F859 M895 I898 M899	S769-L855 WeakPolarHBondContact OG-CD2 3.48Å; Y851-L855 HydrophobicContact CD1-CD1 4.1Å; Y851-L855 HydrophobicContact CD1-CG 4.19Å; Y851-L855 HydrophobicContact CE1-CD1 3.52Å; Y851-L855 HydrophobicContact CE1-CD2 4.03Å; Y851-L855 HydrophobicContact CE1-CG 3.69Å; Y851-L855 HydrophobicContact CE2-CD2 4.42Å; Y851-L855 WeakPolarHBondContact O-CG 3.41Å; Y851-L855 PolarHBondContact O-N 2.86Å; G852-L855 PolarHBondContact O-N 2.97Å; I853-L855 VanDerWaalsContact C-N 3.34Å; I853-L855 PolarHBondContact O-N 2.78Å; L855-E857 VanDerWaalsContact C-N 3.34Å; L855-E857 PolarHBondContact O-N 3.12Å; L855-I858 PolarHBondContact O-N 3.44Å; L855-F859 VanDerWaalsContact O-CD2 3.31Å; L855-F859 WeakPolarHBondContact O-CD2 3.19Å; L855-F859 PolarHBondContact O-N 3.27Å; L855-M895 HydrophobicContact CD1-SD 3.82Å; L855-M895 HydrophobicContact CD2-SD 3.97Å; L855-M895 HydrophobicContact CG-SD 4.42Å; L855-I898 HydrophobicContact CD1-CG2 3.89Å; L855-M899 HydrophobicContact CB-CE 3.81Å; L855-M899 HydrophobicContact CB-CG 3.83Å; L855-M899 HydrophobicContact CB-SD 4.32Å; L855-M899 HydrophobicContact CD1-CG 4.05Å
856	W	95.1	Very high	92	Very high	5 Å²	5	7.3 Å²	7.3	2%	0.019	4%	0.041	C	C	.	.	H	α-helix	trans	-61	-41.6	174.6	-168.2	95.8	0	0	0	112	G852 I853 L854 S860 Q863 S864 P865 P867 M885 S886 P888 M899 W903	G852-W856 PolarHBondContact O-N 3.03Å; I853-W856 WeakPolarHBondContact O-CA 3.31Å; I853-W856 WeakPolarHBondContact O-CB 3.33Å; I853-W856 PolarHBondContact O-N 3.12Å; I853-W856 VanDerWaalsContact O-N 3.11Å; L854-W856 PolarHBondContact O-N 2.95Å; W856-S860 VanDerWaalsContact CZ3-OG 3.31Å; W856-S860 WeakPolarHBondContact CZ3-OG 3.18Å; W856-S860 VanDerWaalsContact O-CB 3.23Å; W856-S860 WeakPolarHBondContact O-CB 3.44Å; W856-S860 PolarHBondContact O-N 3.44Å; W856-S860 PolarHBondContact O-OG 3.35Å; W856-Q863 HydrophobicContact CH2-CB 4Å; W856-Q863 HydrophobicContact CZ3-CB 3.94Å; W856-S864 WeakPolarHBondContact CZ3-O 3.39Å; W856-P865 HydrophobicContact CE3-CB 4.49Å; W856-P865 HydrophobicContact CE3-CG 4.45Å; W856-P867 HydrophobicContact CH2-CG 4.16Å; W856-P867 HydrophobicContact CZ2-CG 4.22Å; W856-M885 HydrophobicContact CB-CE 4.11Å; W856-M885 HydrophobicContact CD2-CE 4.16Å; W856-M885 HydrophobicContact CD2-SD 4.08Å; W856-M885 HydrophobicContact CG-CE 3.85Å; W856-M885 HydrophobicContact CG-SD 4.33Å; W856-S886 PolarHBondContact NE1-O 3.13Å; W856-P888 HydrophobicContact CD2-CB 4.45Å; W856-P888 HydrophobicContact CG-CB 4.34Å; W856-P888 HydrophobicContact CG-CG 4.31Å; W856-M899 HydrophobicContact CB-SD 4.17Å; W856-W903 HydrophobicContact CB-CH2 4.2Å; W856-W903 HydrophobicContact CB-CZ2 4.13Å; W856-W903 AromaticContact CD1-CH2 3.94Å; W856-W903 HydrophobicContact CG-CH2 4.34Å
857	E	95	Very high	91.3	Very high	2 Å²	2	9.9 Å²	9.9	1%	0.009	6%	0.057	C	C	.	.	H	α-helix	trans	-60.5	-43.4	173.1	-65.9	-179.2	99.4	0	0	112.1	A791 W831 I853 L854 L855 S860 L861 G862 P865	A791-E857 HydrophobicContact CB-CB 4.03Å; A791-E857 PolarHBondContact N-OE2 3.45Å; W831-E857 WeakPolarHBondContact CZ2-OE1 3.32Å; W831-E857 VanDerWaalsContact NE1-CD 3.32Å; W831-E857 PolarHBondContact NE1-OE2 2.93Å; I853-E857 PolarHBondContact O-N 3.44Å; L854-E857 WeakPolarHBondContact O-CA 3.43Å; L854-E857 WeakPolarHBondContact O-CB 3.28Å; L854-E857 PolarHBondContact O-N 3.11Å; L854-E857 VanDerWaalsContact O-N 3.08Å; L855-E857 VanDerWaalsContact C-N 3.34Å; L855-E857 PolarHBondContact O-N 3.12Å; E857-S860 WeakPolarHBondContact CA-OG 3.43Å; E857-S860 PolarHBondContact O-N 2.91Å; E857-S860 PolarHBondContact O-OG 3.2Å; E857-L861 PolarHBondContact O-N 3.05Å; E857-G862 PolarHBondContact O-N 3.29Å; E857-P865 HydrophobicContact CG-CG 3.75Å
858	I	95	Very high	90.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.5	-51.4	179.9	-68.9	170.9	0	0	0	110.5	L681 L685 L765 L854 L855 S860 L861	L681-I858 HydrophobicContact CD2-CD1 4.09Å; L681-I858 HydrophobicContact CD2-CG1 3.98Å; L685-I858 HydrophobicContact CD1-CG1 4.39Å; L765-I858 HydrophobicContact CB-CG2 3.83Å; L765-I858 HydrophobicContact CD2-CG2 3.85Å; L765-I858 HydrophobicContact CG-CG2 4.34Å; L854-I858 HydrophobicContact CD1-CD1 4.17Å; L854-I858 HydrophobicContact CD1-CG1 4.25Å; L854-I858 HydrophobicContact CG-CD1 4.02Å; L854-I858 HydrophobicContact CG-CG1 4.48Å; L854-I858 WeakPolarHBondContact O-CG1 2.96Å; L854-I858 PolarHBondContact O-N 3.46Å; L855-I858 PolarHBondContact O-N 3.44Å; I858-S860 VanDerWaalsContact C-N 3.32Å; I858-S860 PolarHBondContact O-N 3Å; I858-L861 PolarHBondContact O-N 3.37Å
859	F	93.4	Very high	89.3	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-84.4	-3.2	-175	-73	-81.8	0	0	0	114.6	L765 L766 S769 L855 P888 F890 A891 M895 M899	L765-F859 HydrophobicContact CB-CD1 4.35Å; L765-F859 HydrophobicContact CB-CE1 3.82Å; L765-F859 HydrophobicContact CB-CZ 3.96Å; L765-F859 HydrophobicContact CD1-CD1 3.95Å; L765-F859 HydrophobicContact CD1-CE1 4.13Å; L766-F859 HydrophobicContact CD2-CZ 3.98Å; L766-F859 HydrophobicContact CG-CZ 4.36Å; S769-F859 WeakPolarHBondContact OG-CE2 3.49Å; L855-F859 VanDerWaalsContact O-CD2 3.31Å; L855-F859 WeakPolarHBondContact O-CD2 3.19Å; L855-F859 PolarHBondContact O-N 3.27Å; F859-P888 HydrophobicContact CB-CB 4.28Å; F859-P888 HydrophobicContact CB-CG 3.73Å; F859-F890 WeakPolarHBondContact CD1-O 3.48Å; F859-F890 WeakPolarHBondContact O-CB 3.27Å; F859-F890 WeakPolarHBondContact O-CD2 3.16Å; F859-F890 PolarHBondContact O-N 3.07Å; F859-A891 HydrophobicContact CB-CB 3.73Å; F859-A891 HydrophobicContact CD1-CB 4.09Å; F859-A891 HydrophobicContact CG-CB 3.89Å; F859-M895 HydrophobicContact CD2-CG 3.76Å; F859-M895 HydrophobicContact CE1-CG 4.48Å; F859-M895 HydrophobicContact CE2-CE 3.78Å; F859-M895 HydrophobicContact CE2-CG 3.42Å; F859-M895 VanDerWaalsContact CE2-CG 3.42Å; F859-M895 HydrophobicContact CE2-SD 3.86Å; F859-M895 HydrophobicContact CG-CG 4.46Å; F859-M895 HydrophobicContact CZ-CE 3.82Å; F859-M895 HydrophobicContact CZ-CG 3.83Å; F859-M895 HydrophobicContact CZ-SD 4.41Å; F859-M899 HydrophobicContact CB-CE 4.15Å; F859-M899 HydrophobicContact CD2-CE 3.79Å; F859-M899 HydrophobicContact CG-CE 4.24Å
860	S	88.3	Confident	88.3	Confident	3 Å²	3	20 Å²	20	2%	0.021	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	8.5	165.8	62.7	0	0	0	0	112.4	W856 E857 I858 G862 Q863	W856-S860 VanDerWaalsContact CZ3-OG 3.31Å; W856-S860 WeakPolarHBondContact CZ3-OG 3.18Å; W856-S860 VanDerWaalsContact O-CB 3.23Å; W856-S860 WeakPolarHBondContact O-CB 3.44Å; W856-S860 PolarHBondContact O-N 3.44Å; W856-S860 PolarHBondContact O-OG 3.35Å; E857-S860 WeakPolarHBondContact CA-OG 3.43Å; E857-S860 PolarHBondContact O-N 2.91Å; E857-S860 PolarHBondContact O-OG 3.2Å; I858-S860 VanDerWaalsContact C-N 3.32Å; I858-S860 PolarHBondContact O-N 3Å; S860-G862 VanDerWaalsContact C-N 3.29Å; S860-G862 PolarHBondContact O-N 2.92Å; S860-Q863 WeakPolarHBondContact O-CG 3.45Å; S860-Q863 PolarHBondContact O-N 3.01Å
861	L	88.9	Confident	87.3	Confident	7 Å²	7	21.5 Å²	21.5	4%	0.037	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	39.4	-179.8	-50.6	174.7	0	0	0	113.5	A689 F692 V693 L760 L765 E857 I858 F890	A689-L861 HydrophobicContact CB-CB 3.9Å; A689-L861 HydrophobicContact CB-CD1 4.15Å; F692-L861 HydrophobicContact CB-CD1 4Å; F692-L861 HydrophobicContact CD1-CD1 3.42Å; F692-L861 VanDerWaalsContact CD1-CD1 3.42Å; F692-L861 HydrophobicContact CD1-CD2 3.91Å; F692-L861 HydrophobicContact CD1-CG 4.23Å; F692-L861 HydrophobicContact CD2-CD2 4.32Å; F692-L861 HydrophobicContact CE1-CD1 4.12Å; F692-L861 HydrophobicContact CE1-CD2 4.12Å; F692-L861 HydrophobicContact CG-CD1 3.9Å; F692-L861 HydrophobicContact CG-CD2 4.01Å; F692-L861 HydrophobicContact CZ-CD2 4.43Å; V693-L861 HydrophobicContact CG2-CD1 3.91Å; L760-L861 HydrophobicContact CD2-CD2 4.2Å; L765-L861 HydrophobicContact CD1-CD2 4.19Å; L765-L861 HydrophobicContact CD2-CD2 4.35Å; E857-L861 PolarHBondContact O-N 3.05Å; I858-L861 PolarHBondContact O-N 3.37Å; L861-F890 HydrophobicContact CD1-CD2 3.67Å; L861-F890 HydrophobicContact CD1-CE2 3.3Å; L861-F890 HydrophobicContact CD1-CZ 3.97Å; L861-F890 HydrophobicContact CD2-CD2 4.41Å; L861-F890 HydrophobicContact CG-CD2 3.69Å; L861-F890 HydrophobicContact CG-CE2 3.77Å
862	G	87.3	Confident	86.3	Confident	2 Å²	2	25.1 Å²	25.1	2%	0.021	15%	0.147	C	C	.	.	S	Bend	trans	84.4	21.7	174.8	0	0	0	0	0	114.9	L682 R686 E857 S860	L682-G862 WeakPolarHBondContact CD1-O 3.31Å; R686-G862 PolarHBondContact NE-O 2.86Å; R686-G862 PolarHBondContact NH2-O 2.79Å; E857-G862 PolarHBondContact O-N 3.29Å; S860-G862 VanDerWaalsContact C-N 3.29Å; S860-G862 PolarHBondContact O-N 2.92Å
863	Q	85.4	Confident	85.2	Confident	70 Å²	70	30 Å²	30	33%	0.327	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-62.1	154.9	166.2	-71.9	-179.8	26.8	0	0	111	W856 S860	W856-Q863 HydrophobicContact CH2-CB 4Å; W856-Q863 HydrophobicContact CZ3-CB 3.94Å; S860-Q863 WeakPolarHBondContact O-CG 3.45Å; S860-Q863 PolarHBondContact O-N 3.01Å
864	S	83.5	Confident	84.1	Confident	44 Å²	44	38.2 Å²	38.2	31%	0.308	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-68.9	131.6	173.1	171.1	0	0	0	0	109.8	K830 W856	K830-S864 PolarHBondContact NZ-OG 3.02Å; W856-S864 WeakPolarHBondContact CZ3-O 3.39Å
865	P	87.1	Confident	83.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	-54.4	149.6	169.8	-26.7	36	0	0	0	112	K830 W831 I853 W856 E857 M885	K830-P865 HydrophobicContact CB-CB 4.49Å; K830-P865 WeakPolarHBondContact CD-O 3.05Å; K830-P865 PolarHBondContact NZ-O 3.08Å; W831-P865 HydrophobicContact CH2-CG 4.18Å; W831-P865 HydrophobicContact CZ2-CG 3.55Å; I853-P865 HydrophobicContact CG2-CB 3.73Å; I853-P865 HydrophobicContact CG2-CG 3.53Å; W856-P865 HydrophobicContact CE3-CB 4.49Å; W856-P865 HydrophobicContact CE3-CG 4.45Å; E857-P865 HydrophobicContact CG-CG 3.75Å; P865-M885 HydrophobicContact CB-CE 4.4Å; P865-M885 HydrophobicContact CB-SD 4.14Å
866	Y	81.5	Confident	82.3	Confident	6 Å²	6	40.5 Å²	40.5	2%	0.024	22%	0.217	C	C	.	.	S	Bend	trans	51.3	66.9	-173.7	-54.2	-89.9	0	0	0	110.9	K830 I853 M869 F875 Y883 M885	K830-Y866 HydrophobicContact CB-CD2 4.12Å; K830-Y866 HydrophobicContact CB-CE2 4.41Å; K830-Y866 HydrophobicContact CG-CD2 4.21Å; K830-Y866 VanDerWaalsContact O-CE2 3.28Å; K830-Y866 WeakPolarHBondContact O-CE2 3.34Å; I853-Y866 HydrophobicContact CD1-CE2 4.08Å; Y866-M869 WeakPolarHBondContact O-CB 3.4Å; Y866-M869 PolarHBondContact O-N 3.35Å; Y866-F875 AromaticContact CD1-CE2 3.93Å; Y866-F875 HydrophobicContact CD1-CE2 3.93Å; Y866-F875 AromaticContact CD2-CE2 3.73Å; Y866-F875 HydrophobicContact CD2-CE2 3.73Å; Y866-F875 HydrophobicContact CD2-CZ 4.14Å; Y866-F875 HydrophobicContact CE1-CE2 4.29Å; Y866-F875 HydrophobicContact CE2-CE2 4.11Å; Y866-F875 HydrophobicContact CE2-CZ 4.13Å; Y866-F875 AromaticContact CG-CE2 3.64Å; Y866-F875 HydrophobicContact CG-CE2 3.64Å; Y866-F875 HydrophobicContact CG-CZ 4.45Å; Y866-Y883 HydrophobicContact CD1-CD1 4.24Å; Y866-Y883 HydrophobicContact CD1-CE1 4.01Å; Y866-Y883 HydrophobicContact CE1-CD1 4.03Å; Y866-Y883 HydrophobicContact CE1-CE1 4.18Å; Y866-M885 HydrophobicContact CD1-CG 3.71Å; Y866-M885 HydrophobicContact CD1-SD 3.97Å; Y866-M885 HydrophobicContact CD2-SD 3.91Å; Y866-M885 HydrophobicContact CE1-CG 3.73Å; Y866-M885 HydrophobicContact CE1-SD 4.14Å; Y866-M885 HydrophobicContact CE2-CE 4.2Å; Y866-M885 HydrophobicContact CE2-SD 4.07Å; Y866-M885 HydrophobicContact CG-CG 4.21Å; Y866-M885 HydrophobicContact CG-SD 3.86Å; Y866-M885 PolarHBondContact N-SD 3.39Å
867	P	74.6	Confident	81.2	Confident	57 Å²	57	46.3 Å²	46.3	37%	0.37	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	142.2	-175.5	24.9	-33.9	0	0	0	110.8	W856 M869	W856-P867 HydrophobicContact CH2-CG 4.16Å; W856-P867 HydrophobicContact CZ2-CG 4.22Å; P867-M869 PolarHBondContact O-N 2.87Å; P867-M869 VanDerWaalsContact O-N 3.17Å
868	N	74.4	Confident	80.4	Confident	126 Å²	126	48 Å²	48	67%	0.674	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	20.2	-178.5	-51.7	-50.5	0	0	0	114.9
869	M	70.8	Confident	79.7	Confident	34 Å²	34	48 Å²	48	17%	0.167	25%	0.251	C	S	.	.			trans	-121.1	116.1	178.7	-162.2	176.3	-61.4	0	0	111.3	K830 Y866 P867 F875 M878 Y883	K830-M869 PolarHBondContact NZ-O 2.98Å; Y866-M869 WeakPolarHBondContact O-CB 3.4Å; Y866-M869 PolarHBondContact O-N 3.35Å; P867-M869 PolarHBondContact O-N 2.87Å; P867-M869 VanDerWaalsContact O-N 3.17Å; M869-F875 HydrophobicContact CG-CD2 4.14Å; M869-F875 HydrophobicContact SD-CB 4.44Å; M869-F875 HydrophobicContact SD-CD2 3.72Å; M869-M878 HydrophobicContact CE-CE 3.55Å; M869-M878 HydrophobicContact CE-SD 3.76Å; M869-M878 HydrophobicContact SD-CE 4.3Å; M869-M878 HydrophobicContact SD-SD 4.01Å; M869-Y883 HydrophobicContact CE-CE1 4.39Å
870	A	73.9	Confident	78.8	Confident	59 Å²	59	54.9 Å²	54.9	49%	0.488	28%	0.281	S	S	.	.			trans	-73.9	148.1	169.7	0	0	0	0	0	110.5	D872	A870-D872 VanDerWaalsContact C-N 3.34Å; A870-D872 PolarHBondContact O-N 2.94Å
871	V	75.7	Confident	78.2	Confident	36 Å²	36	64.8 Å²	64.8	22%	0.218	32%	0.318	C	S	.	.	S	Bend	trans	-80.9	84.1	177.3	-174	0	0	0	0	109.6	V820 V829 K830 F875 Y876	V820-V871 HydrophobicContact CG2-CB 3.76Å; V820-V871 HydrophobicContact CG2-CG1 3.74Å; V820-V871 HydrophobicContact CG2-CG2 4.08Å; V829-V871 HydrophobicContact CB-CG1 4.14Å; V829-V871 HydrophobicContact CG1-CG1 3.69Å; K830-V871 HydrophobicContact CD-CG2 4.34Å; K830-V871 HydrophobicContact CG-CG2 3.8Å; V871-F875 HydrophobicContact CG1-CD1 3.8Å; V871-F875 HydrophobicContact CG1-CE1 4.23Å; V871-F875 HydrophobicContact CG1-CG 4.24Å; V871-Y876 HydrophobicContact CG1-CE2 4.15Å
872	D	76.9	Confident	77.4	Confident	76 Å²	76	65.6 Å²	65.6	41%	0.406	33%	0.328	S	S	.	.	S	Bend	trans	-122.2	-172.3	-179.7	68.8	4.9	0	0	0	111.7	A870 R874 F875 Y876	A870-D872 VanDerWaalsContact C-N 3.34Å; A870-D872 PolarHBondContact O-N 2.94Å; D872-R874 PolarHBondContact O-N 2.94Å; D872-R874 VanDerWaalsContact O-N 3.15Å; D872-R874 WeakPolarHBondContact OD1-CA 3.39Å; D872-R874 WeakPolarHBondContact OD1-CB 3.48Å; D872-R874 PolarHBondContact OD1-N 3.48Å; D872-F875 WeakPolarHBondContact O-CB 3.26Å; D872-F875 PolarHBondContact O-N 3.49Å; D872-F875 VanDerWaalsContact O-N 3.11Å; D872-F875 PolarHBondContact OD1-N 3.18Å; D872-Y876 WeakPolarHBondContact O-CD2 3.22Å; D872-Y876 PolarHBondContact O-N 3.32Å
873	T	73.4	Confident	76.8	Confident	103 Å²	103	69.9 Å²	69.9	63%	0.632	34%	0.344	S	S	*	.	H	α-helix	trans	-57.9	-28.3	177.6	-46.2	0	0	0	0	112.9	K877	T873-K877 WeakPolarHBondContact O-CG 3.35Å; T873-K877 PolarHBondContact O-N 3.01Å
874	R	72.6	Confident	76.4	Confident	172 Å²	172	69.7 Å²	69.7	65%	0.649	34%	0.343	S	S	*	.	H	α-helix	trans	-72	-43.9	176.8	-180	-175.1	177.3	178.5	0.3	110.3	D872 Y876 K877 M878	D872-R874 PolarHBondContact O-N 2.94Å; D872-R874 VanDerWaalsContact O-N 3.15Å; D872-R874 WeakPolarHBondContact OD1-CA 3.39Å; D872-R874 WeakPolarHBondContact OD1-CB 3.48Å; D872-R874 PolarHBondContact OD1-N 3.48Å; R874-Y876 PolarHBondContact O-N 3.29Å; R874-K877 PolarHBondContact O-N 2.84Å; R874-M878 HydrophobicContact CG-SD 4.18Å; R874-M878 WeakPolarHBondContact O-CG 3.32Å; R874-M878 PolarHBondContact O-N 3.21Å
875	F	77.1	Confident	76.5	Confident	1 Å²	1	67.8 Å²	67.8	0%	0.004	33%	0.329	C	S	.	.	H	α-helix	trans	-53.4	-52	174	178.6	-87.5	0	0	0	111.6	V829 K830 Y866 M869 V871 D872 K877 M878 V879	V829-F875 HydrophobicContact CG1-CD1 4.33Å; V829-F875 HydrophobicContact CG1-CE1 3.71Å; K830-F875 HydrophobicContact CG-CE2 4.31Å; K830-F875 HydrophobicContact CG-CZ 4.24Å; Y866-F875 AromaticContact CD1-CE2 3.93Å; Y866-F875 HydrophobicContact CD1-CE2 3.93Å; Y866-F875 AromaticContact CD2-CE2 3.73Å; Y866-F875 HydrophobicContact CD2-CE2 3.73Å; Y866-F875 HydrophobicContact CD2-CZ 4.14Å; Y866-F875 HydrophobicContact CE1-CE2 4.29Å; Y866-F875 HydrophobicContact CE2-CE2 4.11Å; Y866-F875 HydrophobicContact CE2-CZ 4.13Å; Y866-F875 AromaticContact CG-CE2 3.64Å; Y866-F875 HydrophobicContact CG-CE2 3.64Å; Y866-F875 HydrophobicContact CG-CZ 4.45Å; M869-F875 HydrophobicContact CG-CD2 4.14Å; M869-F875 HydrophobicContact SD-CB 4.44Å; M869-F875 HydrophobicContact SD-CD2 3.72Å; V871-F875 HydrophobicContact CG1-CD1 3.8Å; V871-F875 HydrophobicContact CG1-CE1 4.23Å; V871-F875 HydrophobicContact CG1-CG 4.24Å; D872-F875 WeakPolarHBondContact O-CB 3.26Å; D872-F875 PolarHBondContact O-N 3.49Å; D872-F875 VanDerWaalsContact O-N 3.11Å; D872-F875 PolarHBondContact OD1-N 3.18Å; F875-K877 VanDerWaalsContact C-N 3.34Å; F875-K877 PolarHBondContact O-N 3.01Å; F875-M878 PolarHBondContact O-N 3.01Å; F875-M878 VanDerWaalsContact O-N 3.1Å; F875-V879 HydrophobicContact CD1-CG2 4.11Å; F875-V879 HydrophobicContact CE1-CG2 3.63Å; F875-V879 HydrophobicContact CE2-CG2 4.27Å; F875-V879 HydrophobicContact CZ-CG2 3.72Å; F875-V879 WeakPolarHBondContact O-CG2 3.49Å; F875-V879 PolarHBondContact O-N 2.9Å
876	Y	77.4	Confident	76.1	Confident	47 Å²	47	71.5 Å²	71.5	18%	0.184	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-41.1	179.8	-68.1	-69.4	0	0	0	112.8	V829 I837 F838 V871 D872 R874 M878 K880	V829-Y876 HydrophobicContact CG1-CE1 3.74Å; I837-Y876 HydrophobicContact CG2-CD1 3.74Å; I837-Y876 HydrophobicContact CG2-CE1 3.66Å; F838-Y876 HydrophobicContact CE1-CD1 4.05Å; F838-Y876 HydrophobicContact CZ-CD1 4.23Å; F838-Y876 WeakPolarHBondContact CZ-O 3.47Å; V871-Y876 HydrophobicContact CG1-CE2 4.15Å; D872-Y876 WeakPolarHBondContact O-CD2 3.22Å; D872-Y876 PolarHBondContact O-N 3.32Å; R874-Y876 PolarHBondContact O-N 3.29Å; Y876-M878 VanDerWaalsContact C-N 3.31Å; Y876-M878 PolarHBondContact O-N 3.46Å; Y876-K880 VanDerWaalsContact O-CB 3.32Å; Y876-K880 WeakPolarHBondContact O-CB 2.9Å; Y876-K880 PolarHBondContact O-N 3.02Å
877	K	72.8	Confident	76.1	Confident	127 Å²	127	74.2 Å²	74.2	55%	0.552	37%	0.368	S	S	*	.	H	α-helix	trans	-63.8	-36.8	176.2	-76.6	176.7	-179.5	177	0	112.1	T873 R874 F875 R881	T873-K877 WeakPolarHBondContact O-CG 3.35Å; T873-K877 PolarHBondContact O-N 3.01Å; R874-K877 PolarHBondContact O-N 2.84Å; F875-K877 VanDerWaalsContact C-N 3.34Å; F875-K877 PolarHBondContact O-N 3.01Å; K877-R881 WeakPolarHBondContact O-CB 3.45Å; K877-R881 WeakPolarHBondContact O-CD 3.05Å; K877-R881 VanDerWaalsContact O-CG 3.23Å; K877-R881 WeakPolarHBondContact O-CG 3.05Å; K877-R881 PolarHBondContact O-N 2.05Å
878	M	79.1	Confident	76.5	Confident	37 Å²	37	71.7 Å²	71.7	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-69.8	-47.9	178.6	-73.3	-178.3	61.1	0	0	111.7	M869 R874 F875 Y876 K880 R881 G882 Y883	M869-M878 HydrophobicContact CE-CE 3.55Å; M869-M878 HydrophobicContact CE-SD 3.76Å; M869-M878 HydrophobicContact SD-CE 4.3Å; M869-M878 HydrophobicContact SD-SD 4.01Å; R874-M878 HydrophobicContact CG-SD 4.18Å; R874-M878 WeakPolarHBondContact O-CG 3.32Å; R874-M878 PolarHBondContact O-N 3.21Å; F875-M878 PolarHBondContact O-N 3.01Å; F875-M878 VanDerWaalsContact O-N 3.1Å; Y876-M878 VanDerWaalsContact C-N 3.31Å; Y876-M878 PolarHBondContact O-N 3.46Å; M878-K880 VanDerWaalsContact C-N 3.32Å; M878-K880 PolarHBondContact O-N 2.93Å; M878-R881 CarbonylContact O-C 3.53Å; M878-R881 PolarHBondContact O-N 2.82Å; M878-R881 VanDerWaalsContact O-N 3.07Å; M878-G882 PolarHBondContact O-N 3.39Å; M878-Y883 HydrophobicContact CB-CG 4.31Å; M878-Y883 HydrophobicContact CE-CD1 3.69Å; M878-Y883 HydrophobicContact CE-CD2 3.34Å; M878-Y883 HydrophobicContact CE-CE1 3.87Å; M878-Y883 HydrophobicContact CE-CE2 3.53Å; M878-Y883 HydrophobicContact CE-CG 3.42Å; M878-Y883 VanDerWaalsContact CE-CG 3.42Å; M878-Y883 VanDerWaalsContact O-CB 3.27Å; M878-Y883 WeakPolarHBondContact O-CB 3.44Å; M878-Y883 PolarHBondContact O-N 3.16Å
879	V	78.9	Confident	76.5	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-59.6	-44.2	176.6	175.1	0	0	0	0	110.8	P834 I837 F838 F875 R881 G882	P834-V879 HydrophobicContact CB-CG1 4.45Å; P834-V879 HydrophobicContact CG-CG1 4Å; I837-V879 HydrophobicContact CD1-CG1 4.2Å; F838-V879 HydrophobicContact CE2-CG1 4.46Å; F875-V879 HydrophobicContact CD1-CG2 4.11Å; F875-V879 HydrophobicContact CE1-CG2 3.63Å; F875-V879 HydrophobicContact CE2-CG2 4.27Å; F875-V879 HydrophobicContact CZ-CG2 3.72Å; F875-V879 WeakPolarHBondContact O-CG2 3.49Å; F875-V879 PolarHBondContact O-N 2.9Å; V879-R881 PolarHBondContact O-N 3.19Å; V879-G882 PolarHBondContact O-N 3.38Å
880	K	76	Confident	77.1	Confident	144 Å²	144	69.1 Å²	69.1	63%	0.626	34%	0.338	S	S	*	.	H	α-helix	trans	-62.5	-26.8	176.7	-167.5	168.5	-175.6	170.9	0	113.5	F838 Y876 M878 G882	F838-K880 HydrophobicContact CE2-CB 3.82Å; F838-K880 HydrophobicContact CE2-CG 4.24Å; F838-K880 HydrophobicContact CZ-CB 3.88Å; Y876-K880 VanDerWaalsContact O-CB 3.32Å; Y876-K880 WeakPolarHBondContact O-CB 2.9Å; Y876-K880 PolarHBondContact O-N 3.02Å; M878-K880 VanDerWaalsContact C-N 3.32Å; M878-K880 PolarHBondContact O-N 2.93Å; K880-G882 VanDerWaalsContact C-N 3.32Å
881	R	74	Confident	77.5	Confident	211 Å²	211	66.4 Å²	66.4	80%	0.796	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	2.9	176.3	-73.1	173.7	177.6	-176.4	-2.4	113.4	K877 M878 V879	K877-R881 WeakPolarHBondContact O-CB 3.45Å; K877-R881 WeakPolarHBondContact O-CD 3.05Å; K877-R881 VanDerWaalsContact O-CG 3.23Å; K877-R881 WeakPolarHBondContact O-CG 3.05Å; K877-R881 PolarHBondContact O-N 2.05Å; M878-R881 CarbonylContact O-C 3.53Å; M878-R881 PolarHBondContact O-N 2.82Å; M878-R881 VanDerWaalsContact O-N 3.07Å; V879-R881 PolarHBondContact O-N 3.19Å
882	G	72.3	Confident	77.8	Confident	24 Å²	24	66.9 Å²	66.9	25%	0.247	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	28.2	179.9	0	0	0	0	0	114.3	M878 V879 K880 Q884	M878-G882 PolarHBondContact O-N 3.39Å; V879-G882 PolarHBondContact O-N 3.38Å; K880-G882 VanDerWaalsContact C-N 3.32Å; G882-Q884 PolarHBondContact O-N 2.73Å
883	Y	76.1	Confident	77.7	Confident	92 Å²	92	68.6 Å²	68.6	36%	0.361	33%	0.328	S	S	.	.			trans	-59.8	126.7	171.7	177.4	-98.4	0	0	0	110.8	Y866 M869 M878	Y866-Y883 HydrophobicContact CD1-CD1 4.24Å; Y866-Y883 HydrophobicContact CD1-CE1 4.01Å; Y866-Y883 HydrophobicContact CE1-CD1 4.03Å; Y866-Y883 HydrophobicContact CE1-CE1 4.18Å; M869-Y883 HydrophobicContact CE-CE1 4.39Å; M878-Y883 HydrophobicContact CB-CG 4.31Å; M878-Y883 HydrophobicContact CE-CD1 3.69Å; M878-Y883 HydrophobicContact CE-CD2 3.34Å; M878-Y883 HydrophobicContact CE-CE1 3.87Å; M878-Y883 HydrophobicContact CE-CE2 3.53Å; M878-Y883 HydrophobicContact CE-CG 3.42Å; M878-Y883 VanDerWaalsContact CE-CG 3.42Å; M878-Y883 VanDerWaalsContact O-CB 3.27Å; M878-Y883 WeakPolarHBondContact O-CB 3.44Å; M878-Y883 PolarHBondContact O-N 3.16Å
884	Q	76.8	Confident	78.3	Confident	66 Å²	66	68.2 Å²	68.2	31%	0.308	32%	0.322	S	S	.	.			trans	-112.3	141.8	175.5	-66.1	-178.3	-18.8	0	0	109.1	G882 K900 W903	G882-Q884 PolarHBondContact O-N 2.73Å; Q884-K900 PolarHBondContact NE2-O 2.66Å; Q884-W903 HydrophobicContact CB-CE3 3.98Å; Q884-W903 HydrophobicContact CB-CZ3 4.45Å; Q884-W903 HydrophobicContact CG-CB 4.15Å; Q884-W903 HydrophobicContact CG-CE3 4.15Å; Q884-W903 PolarHBondContact NE2-O 2.67Å
885	M	84.8	Confident	79.1	Confident	3 Å²	3	60 Å²	60	2%	0.015	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-67	153.1	177.2	-68.3	178.1	-70.1	0	0	110.7	I853 W856 P865 Y866 Y896 W903	I853-M885 HydrophobicContact CD1-CE 3.38Å; I853-M885 HydrophobicContact CG2-CE 4.5Å; W856-M885 HydrophobicContact CB-CE 4.11Å; W856-M885 HydrophobicContact CD2-CE 4.16Å; W856-M885 HydrophobicContact CD2-SD 4.08Å; W856-M885 HydrophobicContact CG-CE 3.85Å; W856-M885 HydrophobicContact CG-SD 4.33Å; P865-M885 HydrophobicContact CB-CE 4.4Å; P865-M885 HydrophobicContact CB-SD 4.14Å; Y866-M885 HydrophobicContact CD1-CG 3.71Å; Y866-M885 HydrophobicContact CD1-SD 3.97Å; Y866-M885 HydrophobicContact CD2-SD 3.91Å; Y866-M885 HydrophobicContact CE1-CG 3.73Å; Y866-M885 HydrophobicContact CE1-SD 4.14Å; Y866-M885 HydrophobicContact CE2-CE 4.2Å; Y866-M885 HydrophobicContact CE2-SD 4.07Å; Y866-M885 HydrophobicContact CG-CG 4.21Å; Y866-M885 HydrophobicContact CG-SD 3.86Å; Y866-M885 PolarHBondContact N-SD 3.39Å; M885-Y896 PolarHBondContact O-OH 2.87Å; M885-W903 HydrophobicContact CB-CH2 4.13Å; M885-W903 HydrophobicContact CB-CZ3 4.27Å; M885-W903 HydrophobicContact CE-CH2 3.67Å; M885-W903 HydrophobicContact CE-CZ2 3.5Å; M885-W903 VanDerWaalsContact CE-CZ2 3.5Å
886	S	78	Confident	79.7	Confident	78 Å²	78	61.4 Å²	61.4	55%	0.545	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-62.2	157.4	170.7	53	0	0	0	0	110.9	W856	W856-S886 PolarHBondContact NE1-O 3.13Å
887	Q	81.7	Confident	80.3	Confident	63 Å²	63	61.9 Å²	61.9	29%	0.294	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-53.3	128.2	171.9	-179	170.5	0.2	0	0	109.7	A891 Y896	Q887-A891 HydrophobicContact CG-CB 4.33Å; Q887-A891 PolarHBondContact NE2-O 3.17Å; Q887-Y896 VanDerWaalsContact CA-CE2 3.45Å; Q887-Y896 HydrophobicContact CB-CD1 3.78Å; Q887-Y896 HydrophobicContact CB-CD2 3.85Å; Q887-Y896 HydrophobicContact CB-CE1 3.93Å; Q887-Y896 HydrophobicContact CB-CE2 4Å; Q887-Y896 HydrophobicContact CB-CG 3.74Å; Q887-Y896 HydrophobicContact CG-CD1 4.15Å; Q887-Y896 HydrophobicContact CG-CD2 4.17Å; Q887-Y896 HydrophobicContact CG-CG 3.81Å
888	P	82.9	Confident	81.3	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.032	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-72.6	152.4	176.3	30.2	-32.5	0	0	0	110.3	W856 F859 F890 A891 M899	W856-P888 HydrophobicContact CD2-CB 4.45Å; W856-P888 HydrophobicContact CG-CB 4.34Å; W856-P888 HydrophobicContact CG-CG 4.31Å; F859-P888 HydrophobicContact CB-CB 4.28Å; F859-P888 HydrophobicContact CB-CG 3.73Å; P888-F890 PolarHBondContact O-N 2.9Å; P888-A891 HydrophobicContact CG-CB 3.6Å; P888-A891 PolarHBondContact O-N 3.19Å; P888-A891 VanDerWaalsContact O-N 3.08Å; P888-M899 HydrophobicContact CG-CE 3.81Å; P888-M899 HydrophobicContact CG-SD 4.1Å
889	D	75.9	Confident	82.1	Confident	83 Å²	83	54.1 Å²	54.1	44%	0.444	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-33.5	-163.9	-57.1	-45.9	0	0	0	114.5
890	F	83	Confident	82.7	Confident	23 Å²	23	57.9 Å²	57.9	10%	0.101	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	5.2	-173.3	-49.5	-70.9	0	0	0	114	F692 V693 V696 M697 F859 L861 P888 P892	F692-F890 HydrophobicContact CD1-CD1 4.28Å; F692-F890 HydrophobicContact CD1-CD2 4.48Å; F692-F890 HydrophobicContact CD1-CE1 4.31Å; F692-F890 HydrophobicContact CD1-CG 4.35Å; F692-F890 HydrophobicContact CD1-CZ 4.45Å; F692-F890 HydrophobicContact CE1-CB 3.96Å; F692-F890 AromaticContact CE1-CD1 3.61Å; F692-F890 HydrophobicContact CE1-CD1 3.61Å; F692-F890 HydrophobicContact CE1-CD2 4.07Å; F692-F890 HydrophobicContact CE1-CE1 4.08Å; F692-F890 AromaticContact CE1-CG 3.59Å; F692-F890 HydrophobicContact CE1-CG 3.59Å; F692-F890 HydrophobicContact CZ-CB 4.38Å; F692-F890 HydrophobicContact CZ-CG 4.46Å; V693-F890 HydrophobicContact CB-CZ 4.48Å; V693-F890 HydrophobicContact CG2-CE2 4.17Å; V693-F890 HydrophobicContact CG2-CZ 3.6Å; V696-F890 HydrophobicContact CB-CD1 4.39Å; V696-F890 HydrophobicContact CB-CE1 4.2Å; V696-F890 HydrophobicContact CG1-CD1 4.03Å; V696-F890 HydrophobicContact CG1-CE1 4.07Å; V696-F890 HydrophobicContact CG2-CD1 4.4Å; M697-F890 HydrophobicContact CE-CE1 4.1Å; M697-F890 HydrophobicContact CE-CZ 4.42Å; F859-F890 WeakPolarHBondContact CD1-O 3.48Å; F859-F890 WeakPolarHBondContact O-CB 3.27Å; F859-F890 WeakPolarHBondContact O-CD2 3.16Å; F859-F890 PolarHBondContact O-N 3.07Å; L861-F890 HydrophobicContact CD1-CD2 3.67Å; L861-F890 HydrophobicContact CD1-CE2 3.3Å; L861-F890 HydrophobicContact CD1-CZ 3.97Å; L861-F890 HydrophobicContact CD2-CD2 4.41Å; L861-F890 HydrophobicContact CG-CD2 3.69Å; L861-F890 HydrophobicContact CG-CE2 3.77Å; P888-F890 PolarHBondContact O-N 2.9Å; F890-P892 WeakPolarHBondContact O-CD 3.16Å
891	A	82.9	Confident	83.6	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.017	27%	0.273	C	S	.	.			trans	-77.2	129.1	178.4	0	0	0	0	0	111.7	F859 Q887 P888 M895 M899	F859-A891 HydrophobicContact CB-CB 3.73Å; F859-A891 HydrophobicContact CD1-CB 4.09Å; F859-A891 HydrophobicContact CG-CB 3.89Å; Q887-A891 HydrophobicContact CG-CB 4.33Å; Q887-A891 PolarHBondContact NE2-O 3.17Å; P888-A891 HydrophobicContact CG-CB 3.6Å; P888-A891 PolarHBondContact O-N 3.19Å; P888-A891 VanDerWaalsContact O-N 3.08Å; A891-M895 HydrophobicContact CB-CB 4.5Å; A891-M899 HydrophobicContact CB-CE 3.98Å
892	P	81.8	Confident	84.6	Confident	45 Å²	45	44.4 Å²	44.4	29%	0.292	24%	0.235	S	C	.	.			trans	-57.6	151.8	162.4	-22.6	33.4	0	0	0	111.4	F890 D894 M895 Y896	F890-P892 WeakPolarHBondContact O-CD 3.16Å; P892-D894 VanDerWaalsContact C-N 3.26Å; P892-D894 PolarHBondContact O-N 2.99Å; P892-M895 HydrophobicContact CB-CB 4.44Å; P892-M895 WeakPolarHBondContact O-CA 3.04Å; P892-M895 WeakPolarHBondContact O-CB 3.48Å; P892-M895 PolarHBondContact O-N 3.1Å; P892-Y896 PolarHBondContact O-N 3.49Å
893	L	74.6	Confident	85.7	Confident	113 Å²	113	43.5 Å²	43.5	59%	0.592	22%	0.224	S	C	*	.	H	α-helix	trans	-56.3	-42	-179.6	-176.7	63.7	0	0	0	111.9	M895 Y896 V897	L893-M895 VanDerWaalsContact C-N 3.28Å; L893-M895 PolarHBondContact O-N 3.45Å; L893-Y896 PolarHBondContact O-N 3.36Å; L893-Y896 VanDerWaalsContact O-N 3.13Å; L893-V897 WeakPolarHBondContact O-CG2 3.38Å; L893-V897 PolarHBondContact O-N 3.42Å
894	D	84.9	Confident	86.5	Confident	94 Å²	94	41.7 Å²	41.7	50%	0.503	22%	0.221	S	C	.	.	H	α-helix	trans	-61.3	-37.2	177.8	-62.4	-50.8	0	0	0	112.2	P892 V897 I898 L923	P892-D894 VanDerWaalsContact C-N 3.26Å; P892-D894 PolarHBondContact O-N 2.99Å; D894-V897 WeakPolarHBondContact O-CB 3.36Å; D894-V897 PolarHBondContact O-N 3.41Å; D894-I898 WeakPolarHBondContact O-CG1 3.5Å; D894-I898 PolarHBondContact O-N 2.95Å; D894-I898 VanDerWaalsContact O-N 3.13Å; D894-L923 HydrophobicContact CB-CD1 3.91Å; D894-L923 HydrophobicContact CB-CD2 3.53Å; D894-L923 HydrophobicContact CB-CG 4.33Å
895	M	90.4	Very high	87.1	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-68.2	-40.5	175.2	-175.4	58.3	69.5	0	0	111.3	L766 L855 F859 A891 P892 L893 V897 I898 M899 I920 L923	L766-M895 HydrophobicContact CD2-CE 3.5Å; L855-M895 HydrophobicContact CD1-SD 3.82Å; L855-M895 HydrophobicContact CD2-SD 3.97Å; L855-M895 HydrophobicContact CG-SD 4.42Å; F859-M895 HydrophobicContact CD2-CG 3.76Å; F859-M895 HydrophobicContact CE1-CG 4.48Å; F859-M895 HydrophobicContact CE2-CE 3.78Å; F859-M895 HydrophobicContact CE2-CG 3.42Å; F859-M895 VanDerWaalsContact CE2-CG 3.42Å; F859-M895 HydrophobicContact CE2-SD 3.86Å; F859-M895 HydrophobicContact CG-CG 4.46Å; F859-M895 HydrophobicContact CZ-CE 3.82Å; F859-M895 HydrophobicContact CZ-CG 3.83Å; F859-M895 HydrophobicContact CZ-SD 4.41Å; A891-M895 HydrophobicContact CB-CB 4.5Å; P892-M895 HydrophobicContact CB-CB 4.44Å; P892-M895 WeakPolarHBondContact O-CA 3.04Å; P892-M895 WeakPolarHBondContact O-CB 3.48Å; P892-M895 PolarHBondContact O-N 3.1Å; L893-M895 VanDerWaalsContact C-N 3.28Å; L893-M895 PolarHBondContact O-N 3.45Å; M895-V897 VanDerWaalsContact C-N 3.3Å; M895-V897 PolarHBondContact O-N 2.92Å; M895-I898 WeakPolarHBondContact O-CB 3.36Å; M895-I898 PolarHBondContact O-N 3.38Å; M895-I898 VanDerWaalsContact O-N 3.16Å; M895-I898 HydrophobicContact SD-CB 4.5Å; M895-I898 HydrophobicContact SD-CD1 4.25Å; M895-M899 HydrophobicContact CG-CE 3.76Å; M895-M899 WeakPolarHBondContact O-CG 3.29Å; M895-M899 PolarHBondContact O-N 3.03Å; M895-I920 HydrophobicContact CE-CD1 4.21Å; M895-I920 HydrophobicContact CE-CG1 3.95Å; M895-I920 HydrophobicContact CE-CG2 4.25Å; M895-L923 HydrophobicContact CE-CD1 4.33Å
896	Y	90.3	Very high	87.3	Confident	31 Å²	31	46.3 Å²	46.3	12%	0.122	24%	0.244	C	C	.	.	H	α-helix	trans	-65.6	-33	175	-175.3	-124.3	0	0	0	112.6	M885 Q887 P892 L893 M899 K900 W903	M885-Y896 PolarHBondContact O-OH 2.87Å; Q887-Y896 VanDerWaalsContact CA-CE2 3.45Å; Q887-Y896 HydrophobicContact CB-CD1 3.78Å; Q887-Y896 HydrophobicContact CB-CD2 3.85Å; Q887-Y896 HydrophobicContact CB-CE1 3.93Å; Q887-Y896 HydrophobicContact CB-CE2 4Å; Q887-Y896 HydrophobicContact CB-CG 3.74Å; Q887-Y896 HydrophobicContact CG-CD1 4.15Å; Q887-Y896 HydrophobicContact CG-CD2 4.17Å; Q887-Y896 HydrophobicContact CG-CG 3.81Å; P892-Y896 PolarHBondContact O-N 3.49Å; L893-Y896 PolarHBondContact O-N 3.36Å; L893-Y896 VanDerWaalsContact O-N 3.13Å; Y896-M899 HydrophobicContact CD2-CB 4.39Å; Y896-M899 HydrophobicContact CD2-SD 4.12Å; Y896-M899 WeakPolarHBondContact O-CB 3.34Å; Y896-M899 PolarHBondContact O-N 2.9Å; Y896-K900 HydrophobicContact CD1-CD 4.37Å; Y896-K900 HydrophobicContact CE1-CD 3.8Å; Y896-K900 HydrophobicContact CE1-CG 4.25Å; Y896-K900 HydrophobicContact CE2-CG 4.24Å; Y896-K900 PolarHBondContact O-N 2.88Å; Y896-W903 HydrophobicContact CE2-CZ3 4.28Å
897	V	89.3	Confident	87.9	Confident	56 Å²	56	44.5 Å²	44.5	34%	0.339	23%	0.23	S	C	.	.	H	α-helix	trans	-60.8	-44.9	170.7	171.4	0	0	0	0	110.7	L893 D894 M895 M899 K900 M901	L893-V897 WeakPolarHBondContact O-CG2 3.38Å; L893-V897 PolarHBondContact O-N 3.42Å; D894-V897 WeakPolarHBondContact O-CB 3.36Å; D894-V897 PolarHBondContact O-N 3.41Å; M895-V897 VanDerWaalsContact C-N 3.3Å; M895-V897 PolarHBondContact O-N 2.92Å; V897-M899 VanDerWaalsContact C-N 3.34Å; V897-M899 PolarHBondContact O-N 3.28Å; V897-K900 PolarHBondContact O-N 2.87Å; V897-M901 HydrophobicContact CG1-SD 4.16Å; V897-M901 WeakPolarHBondContact O-CG 3.39Å; V897-M901 PolarHBondContact O-N 2.82Å
898	I	94.4	Very high	88.3	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-45.3	174.6	-65.2	166.8	0	0	0	110.9	L855 D894 M895 K900 M901 C902 I916 M919 I920 L923	L855-I898 HydrophobicContact CD1-CG2 3.89Å; D894-I898 WeakPolarHBondContact O-CG1 3.5Å; D894-I898 PolarHBondContact O-N 2.95Å; D894-I898 VanDerWaalsContact O-N 3.13Å; M895-I898 WeakPolarHBondContact O-CB 3.36Å; M895-I898 PolarHBondContact O-N 3.38Å; M895-I898 VanDerWaalsContact O-N 3.16Å; M895-I898 HydrophobicContact SD-CB 4.5Å; M895-I898 HydrophobicContact SD-CD1 4.25Å; I898-K900 PolarHBondContact O-N 3.38Å; I898-M901 WeakPolarHBondContact O-CB 3.13Å; I898-M901 PolarHBondContact O-N 3.09Å; I898-C902 PolarHBondContact O-N 2.91Å; I898-C902 PolarHBondContact O-SG 2.9Å; I898-I916 HydrophobicContact CG2-CG2 3.75Å; I898-M919 HydrophobicContact CD1-CB 3.83Å; I898-M919 HydrophobicContact CD1-CE 4.31Å; I898-M919 HydrophobicContact CG1-CB 4.28Å; I898-M919 HydrophobicContact CG1-CE 3.56Å; I898-M919 HydrophobicContact CG1-SD 4.34Å; I898-I920 HydrophobicContact CD1-CG1 3.8Å; I898-L923 HydrophobicContact CD1-CD1 4.37Å
899	M	95.6	Very high	88.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.7	-47.3	176.9	-63.5	178.8	-161.7	0	0	111.8	L855 W856 F859 P888 A891 M895 Y896 V897 M901 C902 W903	L855-M899 HydrophobicContact CB-CE 3.81Å; L855-M899 HydrophobicContact CB-CG 3.83Å; L855-M899 HydrophobicContact CB-SD 4.32Å; L855-M899 HydrophobicContact CD1-CG 4.05Å; W856-M899 HydrophobicContact CB-SD 4.17Å; F859-M899 HydrophobicContact CB-CE 4.15Å; F859-M899 HydrophobicContact CD2-CE 3.79Å; F859-M899 HydrophobicContact CG-CE 4.24Å; P888-M899 HydrophobicContact CG-CE 3.81Å; P888-M899 HydrophobicContact CG-SD 4.1Å; A891-M899 HydrophobicContact CB-CE 3.98Å; M895-M899 HydrophobicContact CG-CE 3.76Å; M895-M899 WeakPolarHBondContact O-CG 3.29Å; M895-M899 PolarHBondContact O-N 3.03Å; Y896-M899 HydrophobicContact CD2-CB 4.39Å; Y896-M899 HydrophobicContact CD2-SD 4.12Å; Y896-M899 WeakPolarHBondContact O-CB 3.34Å; Y896-M899 PolarHBondContact O-N 2.9Å; V897-M899 VanDerWaalsContact C-N 3.34Å; V897-M899 PolarHBondContact O-N 3.28Å; M899-M901 VanDerWaalsContact C-N 3.32Å; M899-M901 PolarHBondContact O-N 3.23Å; M899-C902 WeakPolarHBondContact O-CB 3.21Å; M899-C902 PolarHBondContact O-N 3.4Å; M899-C902 VanDerWaalsContact O-N 3.11Å; M899-W903 HydrophobicContact CB-CE3 4.47Å; M899-W903 HydrophobicContact CB-CH2 3.99Å; M899-W903 HydrophobicContact CB-CZ2 4.24Å; M899-W903 HydrophobicContact CB-CZ3 4.12Å; M899-W903 PolarHBondContact O-N 2.81Å; M899-W903 HydrophobicContact SD-CH2 4.34Å
900	K	90.6	Very high	89.7	Confident	81 Å²	81	49.1 Å²	49.1	35%	0.352	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-34.7	178.4	-71.2	-169.4	-63.4	-175.3	0	113.2	Q884 Y896 V897 I898 C902 W903	Q884-K900 PolarHBondContact NE2-O 2.66Å; Y896-K900 HydrophobicContact CD1-CD 4.37Å; Y896-K900 HydrophobicContact CE1-CD 3.8Å; Y896-K900 HydrophobicContact CE1-CG 4.25Å; Y896-K900 HydrophobicContact CE2-CG 4.24Å; Y896-K900 PolarHBondContact O-N 2.88Å; V897-K900 PolarHBondContact O-N 2.87Å; I898-K900 PolarHBondContact O-N 3.38Å; K900-C902 VanDerWaalsContact C-N 3.31Å; K900-W903 PolarHBondContact O-N 3.41Å
901	M	94.6	Very high	90.3	Very high	72 Å²	72	48.8 Å²	48.8	36%	0.355	25%	0.254	S	S	.	.	H	α-helix	trans	-64.8	-37.7	173.3	-69.3	175.4	70.4	0	0	111.5	V897 I898 M899 W903 P911 M919	V897-M901 HydrophobicContact CG1-SD 4.16Å; V897-M901 WeakPolarHBondContact O-CG 3.39Å; V897-M901 PolarHBondContact O-N 2.82Å; I898-M901 WeakPolarHBondContact O-CB 3.13Å; I898-M901 PolarHBondContact O-N 3.09Å; M899-M901 VanDerWaalsContact C-N 3.32Å; M899-M901 PolarHBondContact O-N 3.23Å; M901-W903 VanDerWaalsContact C-N 3.34Å; M901-P911 HydrophobicContact CB-CG 4.05Å; M901-P911 HydrophobicContact CE-CB 4.39Å; M901-P911 HydrophobicContact CE-CG 4.33Å; M901-P911 WeakPolarHBondContact O-CD 3.29Å; M901-M919 HydrophobicContact CE-CE 4.45Å; M901-M919 HydrophobicContact CE-SD 4.43Å; M901-M919 HydrophobicContact SD-CE 3.79Å; M901-M919 HydrophobicContact SD-SD 4.44Å
902	C	95.9	Very high	90.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-34.4	174.9	-62.4	0	0	0	0	112.4	V848 I898 M899 K900 N904 R910	V848-C902 HydrophobicContact CG1-CB 4.08Å; V848-C902 WeakPolarHBondContact O-CB 3.35Å; I898-C902 PolarHBondContact O-N 2.91Å; I898-C902 PolarHBondContact O-SG 2.9Å; M899-C902 WeakPolarHBondContact O-CB 3.21Å; M899-C902 PolarHBondContact O-N 3.4Å; M899-C902 VanDerWaalsContact O-N 3.11Å; K900-C902 VanDerWaalsContact C-N 3.31Å; C902-N904 VanDerWaalsContact C-N 3.27Å; C902-N904 PolarHBondContact O-N 3.21Å; C902-R910 VanDerWaalsContact O-CD 3.25Å; C902-R910 WeakPolarHBondContact O-CD 3.38Å; C902-R910 WeakPolarHBondContact O-CG 3.15Å
903	W	95	Very high	91.6	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.015	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	28.9	179	-55.7	-33.5	0	0	0	114.5	W849 G852 I853 W856 Q884 M885 Y896 M899 K900 M901 L905	W849-W903 AromaticContact CD2-CD1 3.97Å; W849-W903 HydrophobicContact CE3-CB 4.28Å; W849-W903 HydrophobicContact CH2-CB 4.18Å; W849-W903 HydrophobicContact CZ3-CB 4.03Å; W849-W903 WeakPolarHBondContact CZ3-O 3.41Å; G852-W903 VanDerWaalsContact O-CZ2 3.27Å; G852-W903 WeakPolarHBondContact O-CZ2 3.35Å; I853-W903 HydrophobicContact CD1-CZ2 3.85Å; I853-W903 VanDerWaalsContact CD1-NE1 3.31Å; W856-W903 HydrophobicContact CB-CH2 4.2Å; W856-W903 HydrophobicContact CB-CZ2 4.13Å; W856-W903 AromaticContact CD1-CH2 3.94Å; W856-W903 HydrophobicContact CG-CH2 4.34Å; Q884-W903 HydrophobicContact CB-CE3 3.98Å; Q884-W903 HydrophobicContact CB-CZ3 4.45Å; Q884-W903 HydrophobicContact CG-CB 4.15Å; Q884-W903 HydrophobicContact CG-CE3 4.15Å; Q884-W903 PolarHBondContact NE2-O 2.67Å; M885-W903 HydrophobicContact CB-CH2 4.13Å; M885-W903 HydrophobicContact CB-CZ3 4.27Å; M885-W903 HydrophobicContact CE-CH2 3.67Å; M885-W903 HydrophobicContact CE-CZ2 3.5Å; M885-W903 VanDerWaalsContact CE-CZ2 3.5Å; Y896-W903 HydrophobicContact CE2-CZ3 4.28Å; M899-W903 HydrophobicContact CB-CE3 4.47Å; M899-W903 HydrophobicContact CB-CH2 3.99Å; M899-W903 HydrophobicContact CB-CZ2 4.24Å; M899-W903 HydrophobicContact CB-CZ3 4.12Å; M899-W903 PolarHBondContact O-N 2.81Å; M899-W903 HydrophobicContact SD-CH2 4.34Å; K900-W903 PolarHBondContact O-N 3.41Å; M901-W903 VanDerWaalsContact C-N 3.34Å; W903-L905 PolarHBondContact O-N 3.22Å
904	N	92.8	Very high	92.5	Very high	55 Å²	55	47.6 Å²	47.6	29%	0.294	25%	0.252	S	S	.	.			trans	-67.8	132.1	171.4	-157.5	-54	0	0	0	109.6	C902 E906 K909 R910	C902-N904 VanDerWaalsContact C-N 3.27Å; C902-N904 PolarHBondContact O-N 3.21Å; N904-E906 PolarHBondContact O-N 2.77Å; N904-E906 PolarHBondContact OD1-N 3.39Å; N904-K909 HydrophobicContact CB-CB 4.32Å; N904-R910 HydrophobicContact CB-CG 3.9Å; N904-R910 PolarHBondContact O-NE 3Å; N904-R910 PolarHBondContact O-NH2 2.76Å; N904-R910 VanDerWaalsContact O-NH2 3.15Å
905	L	89.4	Confident	92.9	Very high	81 Å²	81	47.6 Å²	47.6	42%	0.424	25%	0.248	S	C	.	.	S	Bend	trans	-61.5	-32.9	177.2	-76.5	-179.7	0	0	0	111.8	P834 W903 P907	P834-L905 HydrophobicContact CG-CD2 3.9Å; W903-L905 PolarHBondContact O-N 3.22Å; L905-P907 WeakPolarHBondContact O-CD 3.46Å
906	E	89.8	Confident	93.2	Very high	85 Å²	85	47.6 Å²	47.6	40%	0.397	25%	0.248	S	C	.	.	S	Bend	trans	-87	114.1	177.6	-165.7	175.9	177	0	0	110	N904 T908 K909	N904-E906 PolarHBondContact O-N 2.77Å; N904-E906 PolarHBondContact OD1-N 3.39Å; E906-T908 VanDerWaalsContact C-N 3.25Å; E906-T908 WeakPolarHBondContact CG-OG1 3.43Å; E906-T908 PolarHBondContact O-N 3.23Å; E906-T908 PolarHBondContact OE1-OG1 3.19Å; E906-K909 HydrophobicContact CB-CB 4.34Å; E906-K909 HydrophobicContact CB-CD 4.15Å; E906-K909 HydrophobicContact CB-CG 4.22Å; E906-K909 HydrophobicContact CG-CG 4.36Å; E906-K909 PolarHBondContact O-N 3.07Å; E906-K909 WeakPolarHBondContact OE2-CD 3.31Å; E906-K909 WeakPolarHBondContact OE2-CE 3.41Å; E906-K909 IonicContact OE2-NZ 2.66Å; E906-K909 PolarHBondContact OE2-NZ 3.33Å
907	P	90.5	Very high	93.3	Very high	39 Å²	39	46.4 Å²	46.4	25%	0.253	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-59.8	-34.1	-173.8	-25.3	34.9	0	0	0	113.5	E835 Q845 L905 K909 R910	E835-P907 HydrophobicContact CG-CG 4.28Å; Q845-P907 HydrophobicContact CB-CB 3.88Å; Q845-P907 HydrophobicContact CG-CB 4.41Å; Q845-P907 WeakPolarHBondContact CG-O 3.19Å; Q845-P907 PolarHBondContact NE2-O 2.87Å; L905-P907 WeakPolarHBondContact O-CD 3.46Å; P907-K909 PolarHBondContact O-N 3.02Å; P907-R910 PolarHBondContact O-N 3.39Å
908	T	89	Confident	93.4	Very high	111 Å²	111	46.4 Å²	46.4	68%	0.681	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-68.3	-20.6	179.8	54.1	0	0	0	0	113.4	E906	E906-T908 VanDerWaalsContact C-N 3.25Å; E906-T908 WeakPolarHBondContact CG-OG1 3.43Å; E906-T908 PolarHBondContact O-N 3.23Å; E906-T908 PolarHBondContact OE1-OG1 3.19Å
909	K	92.3	Very high	93.3	Very high	131 Å²	131	48.6 Å²	48.6	57%	0.57	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-88.4	-8.7	177.9	-71.6	-175.4	174	148.4	0	113.7	N904 E906 P907	N904-K909 HydrophobicContact CB-CB 4.32Å; E906-K909 HydrophobicContact CB-CB 4.34Å; E906-K909 HydrophobicContact CB-CD 4.15Å; E906-K909 HydrophobicContact CB-CG 4.22Å; E906-K909 HydrophobicContact CG-CG 4.36Å; E906-K909 PolarHBondContact O-N 3.07Å; E906-K909 WeakPolarHBondContact OE2-CD 3.31Å; E906-K909 WeakPolarHBondContact OE2-CE 3.41Å; E906-K909 IonicContact OE2-NZ 2.66Å; E906-K909 PolarHBondContact OE2-NZ 3.33Å; P907-K909 PolarHBondContact O-N 3.02Å
910	R	96.2	Very high	93	Very high	7 Å²	7	48.6 Å²	48.6	3%	0.026	25%	0.252	C	S	.	.	S	Bend	trans	-74.2	139.6	176.7	-56.4	174.7	-167.6	151.3	8.9	109.7	E835 Q845 V848 C902 N904 P907	E835-R910 IonicContact OE1-CZ 3.45Å; E835-R910 IonicContact OE1-NH1 3.52Å; E835-R910 PolarHBondContact OE1-NH1 3.25Å; E835-R910 IonicContact OE1-NH2 3.36Å; E835-R910 PolarHBondContact OE1-NH2 2.76Å; E835-R910 IonicContact OE2-CZ 3.68Å; E835-R910 IonicContact OE2-NH1 2.75Å; E835-R910 IonicContact OE2-NH2 2.82Å; E835-R910 PolarHBondContact OE2-NH2 3.5Å; Q845-R910 VanDerWaalsContact C-NH1 3.35Å; Q845-R910 PolarHBondContact NE2-O 2.98Å; Q845-R910 WeakPolarHBondContact O-CD 3.34Å; Q845-R910 PolarHBondContact O-NH1 3.28Å; V848-R910 HydrophobicContact CG1-CB 3.9Å; C902-R910 VanDerWaalsContact O-CD 3.25Å; C902-R910 WeakPolarHBondContact O-CD 3.38Å; C902-R910 WeakPolarHBondContact O-CG 3.15Å; N904-R910 HydrophobicContact CB-CG 3.9Å; N904-R910 PolarHBondContact O-NE 3Å; N904-R910 PolarHBondContact O-NH2 2.76Å; N904-R910 VanDerWaalsContact O-NH2 3.15Å; P907-R910 PolarHBondContact O-N 3.39Å
911	P	96.3	Very high	92.9	Very high	15 Å²	15	47.4 Å²	47.4	10%	0.097	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-68.1	156.8	-179.9	28.4	-33.6	0	0	0	111.7	V848 M901 K915 I916	V848-P911 WeakPolarHBondContact CG1-O 3.39Å; M901-P911 HydrophobicContact CB-CG 4.05Å; M901-P911 HydrophobicContact CE-CB 4.39Å; M901-P911 HydrophobicContact CE-CG 4.33Å; M901-P911 WeakPolarHBondContact O-CD 3.29Å; P911-K915 HydrophobicContact CB-CB 4.38Å; P911-K915 HydrophobicContact CB-CG 4.39Å; P911-I916 HydrophobicContact CB-CG1 3.98Å; P911-I916 HydrophobicContact CG-CD1 3.96Å; P911-I916 HydrophobicContact CG-CG1 3.68Å
912	T	95.5	Very high	92.4	Very high	80 Å²	80	49.1 Å²	49.1	49%	0.491	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-75.5	157.8	171.5	59.6	0	0	0	0	111	S914 K915 I916	T912-S914 VanDerWaalsContact C-N 3.35Å; T912-S914 PolarHBondContact O-N 3.2Å; T912-K915 WeakPolarHBondContact O-CB 3.08Å; T912-K915 PolarHBondContact O-N 2.9Å; T912-K915 WeakPolarHBondContact OG1-CB 3.43Å; T912-K915 PolarHBondContact OG1-N 2.92Å; T912-I916 WeakPolarHBondContact O-CG1 3.46Å; T912-I916 PolarHBondContact O-N 2.94Å
913	F	95.9	Very high	91.7	Very high	5 Å²	5	51.9 Å²	51.9	2%	0.022	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-43	177.5	-71.9	-62.2	0	0	0	112.8	L776 D777 A780 V844 D847 V848 Y851 K915 I916 G917	L776-F913 HydrophobicContact CB-CD1 3.69Å; L776-F913 HydrophobicContact CB-CD2 3.75Å; L776-F913 HydrophobicContact CB-CE1 3.66Å; L776-F913 HydrophobicContact CB-CE2 3.71Å; L776-F913 HydrophobicContact CB-CG 3.74Å; L776-F913 HydrophobicContact CB-CZ 3.66Å; L776-F913 HydrophobicContact CD1-CD1 4.11Å; L776-F913 HydrophobicContact CD1-CE1 3.42Å; L776-F913 VanDerWaalsContact CD1-CE1 3.42Å; L776-F913 HydrophobicContact CD1-CZ 3.68Å; L776-F913 HydrophobicContact CG-CE1 4.14Å; L776-F913 HydrophobicContact CG-CZ 4.15Å; D777-F913 HydrophobicContact CB-CB 3.65Å; A780-F913 HydrophobicContact CB-CD2 4.21Å; V844-F913 HydrophobicContact CG1-CD2 4.17Å; V844-F913 HydrophobicContact CG1-CE2 3.94Å; D847-F913 HydrophobicContact CB-CE2 4.27Å; D847-F913 HydrophobicContact CB-CZ 4Å; V848-F913 HydrophobicContact CB-CZ 4.34Å; V848-F913 HydrophobicContact CG2-CD1 4.42Å; V848-F913 HydrophobicContact CG2-CD2 4.27Å; V848-F913 HydrophobicContact CG2-CE1 3.98Å; V848-F913 HydrophobicContact CG2-CE2 3.82Å; V848-F913 HydrophobicContact CG2-CZ 3.66Å; Y851-F913 HydrophobicContact CD1-CE1 4.3Å; Y851-F913 HydrophobicContact CD2-CE1 4.3Å; Y851-F913 AromaticContact CG-CE1 3.85Å; Y851-F913 HydrophobicContact CG-CE1 3.85Å; F913-K915 VanDerWaalsContact C-N 3.29Å; F913-K915 PolarHBondContact O-N 2.89Å; F913-I916 HydrophobicContact CD1-CD1 4.22Å; F913-I916 PolarHBondContact O-N 3.35Å; F913-I916 VanDerWaalsContact O-N 3.14Å; F913-G917 PolarHBondContact O-N 3.42Å
914	S	93.8	Very high	90.9	Very high	50 Å²	50	54.2 Å²	54.2	35%	0.35	28%	0.28	S	S	.	.	H	α-helix	trans	-52.1	-45.8	170.4	-179.6	0	0	0	0	112.5	D777 T912 I916 G917 Q918	D777-S914 WeakPolarHBondContact OD1-CB 3.43Å; D777-S914 PolarHBondContact OD1-N 3.39Å; D777-S914 WeakPolarHBondContact OD2-CB 3.41Å; T912-S914 VanDerWaalsContact C-N 3.35Å; T912-S914 PolarHBondContact O-N 3.2Å; S914-I916 PolarHBondContact O-N 3.29Å; S914-G917 PolarHBondContact O-N 3.43Å; S914-Q918 WeakPolarHBondContact O-CG 3.46Å; S914-Q918 PolarHBondContact O-N 3.33Å; S914-Q918 VanDerWaalsContact O-N 3.07Å
915	K	94.1	Very high	89.3	Confident	95 Å²	95	53.3 Å²	53.3	41%	0.413	28%	0.283	S	S	.	.	H	α-helix	trans	-66.1	-40.6	178.9	-173.7	58.6	174.4	-175.1	0	112.1	P911 T912 F913 M919	P911-K915 HydrophobicContact CB-CB 4.38Å; P911-K915 HydrophobicContact CB-CG 4.39Å; T912-K915 WeakPolarHBondContact O-CB 3.08Å; T912-K915 PolarHBondContact O-N 2.9Å; T912-K915 WeakPolarHBondContact OG1-CB 3.43Å; T912-K915 PolarHBondContact OG1-N 2.92Å; F913-K915 VanDerWaalsContact C-N 3.29Å; F913-K915 PolarHBondContact O-N 2.89Å; K915-M919 HydrophobicContact CG-SD 4.47Å; K915-M919 VanDerWaalsContact O-CG 3.3Å; K915-M919 WeakPolarHBondContact O-CG 3.35Å; K915-M919 PolarHBondContact O-N 3.46Å; K915-M919 VanDerWaalsContact O-N 3.13Å
916	I	96	Very high	87	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-45.6	176.4	-63.6	162.9	0	0	0	110.4	V848 Y851 I898 P911 T912 F913 S914 Q918 M919 I920	V848-I916 HydrophobicContact CG1-CD1 4.04Å; Y851-I916 HydrophobicContact CD1-CD1 4.18Å; Y851-I916 HydrophobicContact CD1-CG2 4.48Å; Y851-I916 HydrophobicContact CE1-CD1 4.35Å; Y851-I916 HydrophobicContact CE1-CG2 3.61Å; I898-I916 HydrophobicContact CG2-CG2 3.75Å; P911-I916 HydrophobicContact CB-CG1 3.98Å; P911-I916 HydrophobicContact CG-CD1 3.96Å; P911-I916 HydrophobicContact CG-CG1 3.68Å; T912-I916 WeakPolarHBondContact O-CG1 3.46Å; T912-I916 PolarHBondContact O-N 2.94Å; F913-I916 HydrophobicContact CD1-CD1 4.22Å; F913-I916 PolarHBondContact O-N 3.35Å; F913-I916 VanDerWaalsContact O-N 3.14Å; S914-I916 PolarHBondContact O-N 3.29Å; I916-Q918 PolarHBondContact O-N 3.45Å; I916-M919 WeakPolarHBondContact O-CB 3.49Å; I916-M919 PolarHBondContact O-N 3.36Å; I916-I920 HydrophobicContact CG2-CD1 3.78Å; I916-I920 HydrophobicContact CG2-CG1 4.34Å; I916-I920 WeakPolarHBondContact O-CG1 2.9Å; I916-I920 PolarHBondContact O-N 2.84Å
917	G	92.4	Very high	84.4	Confident	5 Å²	5	55.1 Å²	55.1	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-54.3	-50.3	176.1	0	0	0	0	0	111.9	F913 S914 M919 I920 E921	F913-G917 PolarHBondContact O-N 3.42Å; S914-G917 PolarHBondContact O-N 3.43Å; G917-M919 VanDerWaalsContact C-N 3.27Å; G917-M919 PolarHBondContact O-N 3.4Å; G917-I920 PolarHBondContact O-N 2.91Å; G917-I920 VanDerWaalsContact O-N 3.09Å; G917-E921 WeakPolarHBondContact O-CG 3.45Å; G917-E921 PolarHBondContact O-N 3.26Å
918	Q	91.2	Very high	81.6	Confident	57 Å²	57	57.9 Å²	57.9	27%	0.266	31%	0.312	S	S	.	.	H	α-helix	trans	-59	-35.5	175.7	-68.9	175	5.4	0	0	113.4	S914 I916 K922 L928	S914-Q918 WeakPolarHBondContact O-CG 3.46Å; S914-Q918 PolarHBondContact O-N 3.33Å; S914-Q918 VanDerWaalsContact O-N 3.07Å; I916-Q918 PolarHBondContact O-N 3.45Å; Q918-K922 VanDerWaalsContact O-CG 3.3Å; Q918-K922 WeakPolarHBondContact O-CG 3.46Å; Q918-K922 PolarHBondContact O-N 3.47Å; Q918-L928 HydrophobicContact CG-CD2 3.91Å
919	M	91.6	Very high	78.9	Confident	47 Å²	47	59.5 Å²	59.5	23%	0.232	31%	0.311	C	S	.	.	H	α-helix	trans	-68.7	-40.2	176.8	-69.7	172.8	71.4	0	0	111.2	I898 M901 K915 I916 G917 L923	I898-M919 HydrophobicContact CD1-CB 3.83Å; I898-M919 HydrophobicContact CD1-CE 4.31Å; I898-M919 HydrophobicContact CG1-CB 4.28Å; I898-M919 HydrophobicContact CG1-CE 3.56Å; I898-M919 HydrophobicContact CG1-SD 4.34Å; M901-M919 HydrophobicContact CE-CE 4.45Å; M901-M919 HydrophobicContact CE-SD 4.43Å; M901-M919 HydrophobicContact SD-CE 3.79Å; M901-M919 HydrophobicContact SD-SD 4.44Å; K915-M919 HydrophobicContact CG-SD 4.47Å; K915-M919 VanDerWaalsContact O-CG 3.3Å; K915-M919 WeakPolarHBondContact O-CG 3.35Å; K915-M919 PolarHBondContact O-N 3.46Å; K915-M919 VanDerWaalsContact O-N 3.13Å; I916-M919 WeakPolarHBondContact O-CB 3.49Å; I916-M919 PolarHBondContact O-N 3.36Å; G917-M919 VanDerWaalsContact C-N 3.27Å; G917-M919 PolarHBondContact O-N 3.4Å; M919-L923 PolarHBondContact O-N 3.19Å
920	I	90.8	Very high	76	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-72.7	-38.4	178.3	-59.5	172	0	0	0	111.1	L766 L770 Y851 M895 I898 I916 G917 K922 L923 L924	L766-I920 HydrophobicContact CD2-CG2 4.47Å; L770-I920 HydrophobicContact CB-CG2 3.89Å; L770-I920 HydrophobicContact CD1-CB 4.48Å; Y851-I920 VanDerWaalsContact OH-CD1 3.26Å; Y851-I920 WeakPolarHBondContact OH-CD1 3.44Å; M895-I920 HydrophobicContact CE-CD1 4.21Å; M895-I920 HydrophobicContact CE-CG1 3.95Å; M895-I920 HydrophobicContact CE-CG2 4.25Å; I898-I920 HydrophobicContact CD1-CG1 3.8Å; I916-I920 HydrophobicContact CG2-CD1 3.78Å; I916-I920 HydrophobicContact CG2-CG1 4.34Å; I916-I920 WeakPolarHBondContact O-CG1 2.9Å; I916-I920 PolarHBondContact O-N 2.84Å; G917-I920 PolarHBondContact O-N 2.91Å; G917-I920 VanDerWaalsContact O-N 3.09Å; I920-K922 VanDerWaalsContact C-N 3.28Å; I920-K922 PolarHBondContact O-N 3.31Å; I920-L923 WeakPolarHBondContact O-CA 3.44Å; I920-L923 WeakPolarHBondContact O-CB 3.34Å; I920-L923 PolarHBondContact O-N 3.36Å; I920-L924 HydrophobicContact CG2-CD1 4.28Å; I920-L924 PolarHBondContact O-N 3.41Å
921	E	87.3	Confident	72.9	Confident	57 Å²	57	67.9 Å²	67.9	27%	0.266	36%	0.358	S	S	.	.	H	α-helix	trans	-58.6	-38.7	174.7	-79	169.7	-178.6	0	0	112.4	L770 Q774 G917 L923 L924 G925 G926	L770-E921 HydrophobicContact CD1-CG 3.63Å; L770-E921 HydrophobicContact CD2-CG 3.57Å; L770-E921 HydrophobicContact CG-CG 4.26Å; Q774-E921 PolarHBondContact NE2-OE1 2.91Å; G917-E921 WeakPolarHBondContact O-CG 3.45Å; G917-E921 PolarHBondContact O-N 3.26Å; E921-L923 VanDerWaalsContact C-N 3.28Å; E921-L923 PolarHBondContact O-N 3.02Å; E921-L924 CarbonylContact O-C 3.6Å; E921-L924 WeakPolarHBondContact O-CA 3.49Å; E921-L924 PolarHBondContact O-N 3.47Å; E921-L924 VanDerWaalsContact O-N 3.12Å; E921-G925 PolarHBondContact O-N 3.1Å; E921-G926 PolarHBondContact O-N 3.24Å
922	K	84.1	Confident	69.7	Low	108 Å²	108	75.8 Å²	75.8	47%	0.47	39%	0.394	S	S	.	.	H	α-helix	trans	-61.7	-37	173.5	-73.7	173.4	-176.2	-171.6	0	112.3	Q918 I920 L924 G925	Q918-K922 VanDerWaalsContact O-CG 3.3Å; Q918-K922 WeakPolarHBondContact O-CG 3.46Å; Q918-K922 PolarHBondContact O-N 3.47Å; I920-K922 VanDerWaalsContact C-N 3.28Å; I920-K922 PolarHBondContact O-N 3.31Å; K922-L924 VanDerWaalsContact C-N 3.31Å; K922-G925 PolarHBondContact O-N 3.39Å
923	L	80.6	Confident	66.6	Low	58 Å²	58	77.4 Å²	77.4	30%	0.304	40%	0.404	S	S	.	.	H	α-helix	trans	-69.4	-31.7	175.3	-59.8	175.2	0	0	0	111.9	L766 D894 M895 I898 M919 I920 E921 G925	L766-L923 HydrophobicContact CD2-CB 4.45Å; L766-L923 HydrophobicContact CD2-CD1 4.44Å; D894-L923 HydrophobicContact CB-CD1 3.91Å; D894-L923 HydrophobicContact CB-CD2 3.53Å; D894-L923 HydrophobicContact CB-CG 4.33Å; M895-L923 HydrophobicContact CE-CD1 4.33Å; I898-L923 HydrophobicContact CD1-CD1 4.37Å; M919-L923 PolarHBondContact O-N 3.19Å; I920-L923 WeakPolarHBondContact O-CA 3.44Å; I920-L923 WeakPolarHBondContact O-CB 3.34Å; I920-L923 PolarHBondContact O-N 3.36Å; E921-L923 VanDerWaalsContact C-N 3.28Å; E921-L923 PolarHBondContact O-N 3.02Å; L923-G925 VanDerWaalsContact C-N 3.26Å; L923-G925 PolarHBondContact O-N 3.07Å
924	L	78.6	Confident	63.3	Low	53 Å²	53	83.4 Å²	83.4	28%	0.277	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-1.8	173	-73.9	165.5	0	0	0	113.6	L766 R767 L770 I920 E921 K922	L766-L924 HydrophobicContact CB-CD1 4.28Å; L766-L924 HydrophobicContact CB-CD2 3.62Å; L766-L924 HydrophobicContact CB-CG 3.97Å; L766-L924 HydrophobicContact CD1-CD2 4.11Å; R767-L924 HydrophobicContact CG-CD2 4.35Å; L770-L924 HydrophobicContact CB-CD1 4.17Å; L770-L924 HydrophobicContact CD2-CD1 3.67Å; I920-L924 HydrophobicContact CG2-CD1 4.28Å; I920-L924 PolarHBondContact O-N 3.41Å; E921-L924 CarbonylContact O-C 3.6Å; E921-L924 WeakPolarHBondContact O-CA 3.49Å; E921-L924 PolarHBondContact O-N 3.47Å; E921-L924 VanDerWaalsContact O-N 3.12Å; K922-L924 VanDerWaalsContact C-N 3.31Å
925	G	60	Low	60.1	Low	35 Å²	35	91 Å²	91	36%	0.361	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	14.4	176.2	0	0	0	0	0	116.1	E921 K922 L923	E921-G925 PolarHBondContact O-N 3.1Å; K922-G925 PolarHBondContact O-N 3.39Å; L923-G925 VanDerWaalsContact C-N 3.26Å; L923-G925 PolarHBondContact O-N 3.07Å
926	G	41	Very low	56.9	Low	37 Å²	37	95.4 Å²	95.4	38%	0.381	48%	0.479	S	S	.	.			trans	-90.7	134	175.2	0	0	0	0	0	113.1	E921	E921-G926 PolarHBondContact O-N 3.24Å
927	H	35.5	Very low	53.7	Low	168 Å²	168	102.3 Å²	102.3	78%	0.778	52%	0.516	S	S	*	.			trans	-105.5	114.4	164.4	-98.1	-57.5	0	0	0	110.3
928	L	30.8	Very low	50.5	Low	97 Å²	97	111.2 Å²	111.2	51%	0.508	56%	0.559	S	S	.	*			trans	10.3	105	154.4	-63	160.1	0	0	0	117.3	Q918	Q918-L928 HydrophobicContact CG-CD2 3.91Å
929	E	32.6	Very low	47.4	Very low	145 Å²	145	117.6 Å²	117.6	68%	0.678	59%	0.588	S	S	*	*			trans	-93.7	111.7	151.2	-72.8	-179	167.4	0	0	108.4	E931	E929-E931 PolarHBondContact O-N 3.3Å; E929-E931 VanDerWaalsContact O-N 3.12Å
930	D	32	Very low	44.3	Very low	170 Å²	170	124.5 Å²	124.5	91%	0.909	62%	0.62	S	S	*	*			trans	-72.1	85.5	154.4	-93.7	-32.3	0	0	0	107
931	E	29.9	Very low	41.2	Very low	144 Å²	144	133.7 Å²	133.7	67%	0.673	66%	0.663	S	S	*	*			trans	-101.4	99.5	160.3	-83	-162.2	158.5	0	0	109.6	E929 V933	E929-E931 PolarHBondContact O-N 3.3Å; E929-E931 VanDerWaalsContact O-N 3.12Å; E931-V933 VanDerWaalsContact C-N 3.26Å; E931-V933 HydrophobicContact CB-CG2 4.38Å; E931-V933 PolarHBondContact O-N 3.43Å
932	Q	29.7	Very low	38.3	Very low	181 Å²	181	137.8 Å²	137.8	85%	0.846	69%	0.692	S	S	*	*			trans	-56.7	92.7	151.9	-79.8	179.8	-27.9	0	0	108.7	I934	Q932-I934 PolarHBondContact O-N 3.42Å
933	V	29.6	Very low	35.4	Very low	114 Å²	114	139 Å²	139	69%	0.691	71%	0.708	S	S	*	*			trans	-77	95.7	166.8	-177.9	0	0	0	0	108.4	E931 Y935	E931-V933 VanDerWaalsContact C-N 3.26Å; E931-V933 HydrophobicContact CB-CG2 4.38Å; E931-V933 PolarHBondContact O-N 3.43Å; V933-Y935 PolarHBondContact O-N 2.99Å
934	I	28.1	Very low	32.7	Very low	131 Å²	131	145.5 Å²	145.5	67%	0.672	74%	0.737	S	S	*	*			trans	-57	119.2	162.1	-66.1	167.5	0	0	0	107.9	Q932 Q936	Q932-I934 PolarHBondContact O-N 3.42Å; I934-Q936 PolarHBondContact O-N 2.97Å
935	Y	26.8	Very low	30.1	Very low	208 Å²	208	147 Å²	147	82%	0.816	76%	0.758	S	S	*	*			trans	-63	102.8	165.8	-73.8	-91.2	0	0	0	109	V933 N937	V933-Y935 PolarHBondContact O-N 2.99Å; Y935-N937 PolarHBondContact O-N 3.07Å
936	Q	25.9	Very low	28.5	Very low	188 Å²	188	152.7 Å²	152.7	88%	0.879	78%	0.78	S	S	*	*			trans	-82.3	103.6	160.7	-89.1	-178	-21.1	0	0	108.8	I934 M938	I934-Q936 PolarHBondContact O-N 2.97Å; Q936-M938 PolarHBondContact O-N 3.4Å
937	N	28.5	Very low	27.7	Very low	145 Å²	145	154.8 Å²	154.8	78%	0.775	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.5	120.9	168.5	-71	-34.7	0	0	0	109.9	Y935 Q939	Y935-N937 PolarHBondContact O-N 3.07Å; N937-Q939 PolarHBondContact O-N 3.35Å
938	M	26.5	Very low	27.2	Very low	193 Å²	193	157 Å²	157	95%	0.951	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-70.9	118.4	155.4	-100.8	-167.6	-69.7	0	0	108	Q936	Q936-M938 PolarHBondContact O-N 3.4Å
939	Q	25.6	Very low	27	Very low	191 Å²	191	159 Å²	159	89%	0.893	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60.3	132.5	177.6	-68.8	165	-41.1	0	0	110.9	N937	N937-Q939 PolarHBondContact O-N 3.35Å
940	Q	26.6	Very low	26.7	Very low	192 Å²	192	161.2 Å²	161.2	90%	0.897	82%	0.815	S	S	*	*			trans	-126.8	119	152.4	-138.7	170.7	0.8	0	0	107
941	E	25.5	Very low	26.5	Very low	193 Å²	193	159 Å²	159	90%	0.902	81%	0.81	S	S	*	*			trans	-59.2	124.9	-175	-64.2	170	143.7	0	0	111.7
942	V	25.5	Very low	26.3	Very low	143 Å²	143	161.6 Å²	161.6	87%	0.867	82%	0.819	S	S	*	*			trans	-141.1	137.5	150.7	-174.5	0	0	0	0	108.6
943	T	24.9	Very low	26	Very low	133 Å²	133	159 Å²	159	82%	0.816	82%	0.819	S	S	*	*			trans	-61.9	155.1	-163.6	42.8	0	0	0	0	117.9
944	E	23	Very low	25.9	Very low	194 Å²	194	163 Å²	163	91%	0.907	83%	0.83	S	S	*	*			trans	-43.1	138.7	170.8	-61.1	170.1	146.2	0	0	115.5
945	A	24	Very low	25.8	Very low	86 Å²	86	164.9 Å²	164.9	71%	0.711	84%	0.841	S	S	*	*				-177.8	137	126.7	0	0	0	0	0	112
946	D	25.8	Very low	25.8	Very low	154 Å²	154	158.4 Å²	158.4	82%	0.824	84%	0.838	S	S	*	*			trans	84	86.1	151.1	-55.1	-20	0	0	0	122
947	A	25.1	Very low	26.2	Very low	81 Å²	81	155.7 Å²	155.7	67%	0.669	84%	0.836	S	S	*	*				58.1	119.6	106.5	0	0	0	0	0	122.5
948	Y	25.5	Very low	26.2	Very low	215 Å²	215	154 Å²	154	84%	0.843	84%	0.835	S	S	*	*			trans	71.7	141.2	144.5	-81.5	-101.1	0	0	0	118.3
949	D	26.4	Very low	26.2	Very low	139 Å²	139	152 Å²	152	74%	0.743	83%	0.828	S	S	*	*			cis	-163.9	155.1	0.5	-149.1	-11.4	0	0	0	108.1
950	K	24.6	Very low	26.3	Very low	191 Å²	191	152.1 Å²	152.1	83%	0.83	83%	0.829	S	S	*	*			trans	-104.8	151	172.7	-101.4	-175.2	-179.2	178.2	0	110.2
951	P	28.2	Very low	26.2	Very low	123 Å²	123	147.6 Å²	147.6	80%	0.799	82%	0.818	S	S	*	*				-137.6	124.6	127	28.8	-11.9	0	0	0	111.6
952	K	26.1	Very low	26.3	Very low	199 Å²	199	143.4 Å²	143.4	87%	0.865	81%	0.809	S	S	*	*				65	119.1	84.5	-91.5	-171.1	179.5	179.9	0	115.6
953	C	24.4	Very low	26.3	Very low	126 Å²	126	143.5 Å²	143.5	85%	0.851	81%	0.805	S	S	*	*			trans	-66.9	157.3	178.2	-55.9	0	0	0	0	114
954	H	25.7	Very low	26.6	Very low	198 Å²	198	145.8 Å²	145.8	92%	0.917	81%	0.805	S	S	*	*			trans	-129.2	138.4	160.2	-94	-65.9	0	0	0	110.7
955	D	27.6	Very low	26.7	Very low	170 Å²	170	144.2 Å²	144.2	91%	0.909	80%	0.803	S	S	*	*			trans	-88.4	146.6	-179.4	-82.2	-48.2	0	0	0	114
956	G	25.5	Very low	27	Very low	72 Å²	72	149.4 Å²	149.4	74%	0.742	81%	0.813	S	S	*	*			trans	94.9	166.8	142.5	0	0	0	0	0	118.8
957	P	34.8	Very low	27.1	Very low	131 Å²	131	151.1 Å²	151.1	85%	0.851	82%	0.816	S	S	*	*			cis	-135.3	-174.1	-29.6	37.4	-17.7	0	0	0	113.9
958	C	28.5	Very low	27.2	Very low	111 Å²	111	156.1 Å²	156.1	75%	0.75	83%	0.826	S	S	*	*			trans	-53.4	154.6	-172.6	-52.8	0	0	0	0	119.1
959	D	25.8	Very low	27.4	Very low	150 Å²	150	155 Å²	155	80%	0.802	83%	0.828	S	S	*	*				142.7	124.4	125.2	-80.4	-17.1	0	0	0	112.5
960	Q	28.3	Very low	27.4	Very low	194 Å²	194	154 Å²	154	91%	0.907	83%	0.829	S	S	*	*				165.6	149.3	117.3	-89.6	-178.2	-3.4	0	0	113.2
961	S	25.4	Very low	27.6	Very low	96 Å²	96	152.9 Å²	152.9	67%	0.671	83%	0.831	S	S	*	*			trans	-88.1	177.1	-165.8	55.1	0	0	0	0	115
962	C	25.9	Very low	27.5	Very low	105 Å²	105	156.4 Å²	156.4	71%	0.709	84%	0.839	S	S	*	*			trans	77	146.2	155.9	-59	0	0	0	0	115.2
963	D	27.4	Very low	27.4	Very low	146 Å²	146	156 Å²	156	78%	0.781	84%	0.838	S	S	*	*			cis	-162.8	167.4	-11.5	-110.2	-43.6	0	0	0	105.4
964	H	29.4	Very low	27.8	Very low	180 Å²	180	156.5 Å²	156.5	83%	0.833	84%	0.837	S	S	*	*			trans	-57.5	133.3	173.3	-82.2	-23.9	0	0	0	113.2
965	D	25.4	Very low	27.8	Very low	161 Å²	161	153.6 Å²	153.6	86%	0.861	83%	0.828	S	S	*	*			trans	-132.2	118	147.3	-83.9	-42.4	0	0	0	108.8
966	E	31.4	Very low	27.9	Very low	195 Å²	195	153 Å²	153	91%	0.911	83%	0.825	S	S	*	*			trans	-73.5	117.2	164.8	-69.8	-175.9	150.6	0	0	108.1
967	E	26.6	Very low	28	Very low	190 Å²	190	159 Å²	159	89%	0.888	83%	0.827	S	S	*	*			trans	-126.5	141.7	163.1	-92.5	-169.7	164	0	0	111.5
968	E	27.5	Very low	27.7	Very low	187 Å²	187	161.7 Å²	161.7	87%	0.874	83%	0.828	S	S	*	*			trans	-60.3	149.5	-160.9	-63.6	173.3	135.2	0	0	115.4
969	Q	31.3	Very low	27.8	Very low	192 Å²	192	163.9 Å²	163.9	90%	0.897	83%	0.825	S	S	*	*			trans	-50.9	145.1	164.8	-67.3	178.1	-13.3	0	0	112.3
970	P	26.2	Very low	28.1	Very low	118 Å²	118	161.6 Å²	161.6	77%	0.766	82%	0.819	S	S	*	*			trans	-118.8	114	140.2	26.5	-11.2	0	0	0	110.4	M972	P970-M972 PolarHBondContact O-N 3.46Å
971	L	27.2	Very low	28.1	Very low	166 Å²	166	160 Å²	160	87%	0.869	82%	0.815	S	S	*	*			trans	27	96	140.4	-74.5	147.9	0	0	0	116.1	K973	L971-K973 PolarHBondContact O-N 3.42Å
972	M	27	Very low	28.2	Very low	197 Å²	197	163.3 Å²	163.3	97%	0.97	82%	0.823	S	S	*	*			trans	-60.1	107.5	162.4	-86.5	-166.2	170.7	0	0	110.1	P970	P970-M972 PolarHBondContact O-N 3.46Å
973	K	25.1	Very low	28.4	Very low	191 Å²	191	166.6 Å²	166.6	83%	0.83	83%	0.829	S	S	*	*			trans	-64.6	129.7	159	-79.6	-179.8	176.2	175.4	0	109.1	L971 N975	L971-K973 PolarHBondContact O-N 3.42Å; K973-N975 PolarHBondContact O-N 3.32Å
974	T	30.9	Very low	28.4	Very low	137 Å²	137	167.8 Å²	167.8	84%	0.84	83%	0.832	S	S	*	*			trans	-60.5	112	167	33.7	0	0	0	0	110.3
975	N	25.9	Very low	28.4	Very low	137 Å²	137	167 Å²	167	73%	0.733	83%	0.832	S	S	*	*			trans	-117.2	117.3	162.8	-90.4	-15.5	0	0	0	109.9	K973 Y977	K973-N975 PolarHBondContact O-N 3.32Å; N975-Y977 PolarHBondContact O-N 3.49Å
976	N	30.6	Very low	28.6	Very low	157 Å²	157	167.4 Å²	167.4	84%	0.84	83%	0.83	S	S	*	*			trans	-57.1	113.5	172	-77.7	-31.8	0	0	0	110.8
977	Y	26.9	Very low	28.4	Very low	199 Å²	199	165.4 Å²	165.4	78%	0.78	82%	0.824	S	S	*	*			trans	-106.3	98	155.9	-78.3	-78.3	0	0	0	108.8	N975 F979 C980	N975-Y977 PolarHBondContact O-N 3.49Å; Y977-F979 PolarHBondContact O-N 3.44Å; Y977-C980 PolarHBondContact O-N 3.45Å
978	Q	29.3	Very low	28.5	Very low	187 Å²	187	163.5 Å²	163.5	87%	0.874	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	56	179.9	-160.6	172	3	0	0	110.9
979	F	30.9	Very low	28.6	Very low	156 Å²	156	161.6 Å²	161.6	68%	0.684	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.5	-3.2	160.1	-97	-82.6	0	0	0	112.3	Y977	Y977-F979 PolarHBondContact O-N 3.44Å
980	C	32	Very low	28.3	Very low	102 Å²	102	158.8 Å²	158.8	69%	0.689	81%	0.807	S	S	*	*			trans	-108.3	0	172.4	-74.2	0	0	0	0	112.3	K822 C840 Y977	K822-C980 WeakPolarHBondContact CE-OXT 3.46Å; C840-C980 PolarHBondContact SG-SG 2.93Å; Y977-C980 PolarHBondContact O-N 3.45Å

Retrieved 980 of 980 residues in 515.2 ms (Link to these results)

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