A0A087XJX5_POEFO Loading...

Tyrosine-protein kinase receptor Tie-1

Transmembrane tyrosine-protein kinase that may modulate TEK/TIE2 activity and contribute to the regulation of angiogenesis.

AlphaFold DB , UniProt , Accession A0A087XJX5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 937 aa.

						>A0A087XJX5_POEFO|A0A087XJX5
MRLIVRDCPSKKWGHNCDKDCPDCLNGGVCHDLDGDCVCPPGFMGTRCETACRAGMFGRNCQESCRTDHSNNCKEIRFCLPDPYGCSCASGWFGRHCEKACVNDTYGPDCRLSCKCQNEGVCNRFSGCQCPTGWRGQNCEKSERAPQILELDCDLECNLNSSPKVKCSATGNPLPSHNSFELRKLDNTVLKASKTIQESNRSTALFEIPPLSAKQGGLWECRVSTNGGRDSRKFNVTIKVPPVPTTAPKLLEKRSKQLLVMPVESHKGDGPIISTKLLYKPVENRDFWSSIIVYSDKEPITLMNLEPSTRYRVRVQLSRPGEGGEGESGPEAVMETDCPEPTVQPEIENRTVDGHNAKVWWRLPTNSDITPGTATGFLVQLFEPPPSNKKLLEKTTLLNVLSTEFHNLKYHHDYSVVVRLINCGSQGPASKPFLFRVNSQGPSPPRSVQAQALSTSAVQVRWQPPENPNGGIIKYVIEYQPVGQGSPHHWLDINDRNKTTKDVTALNSSTLYQFRVRACSKVPGEWSTFVQEKTQGDDSQILAPTTQGVSGKPTGDGNQLLVAVVGSVTVTCVTILLALLALFYIRKMLLNRRRTFTYQSGSGEETILQFNSGTLTLTRRPKPTPEPLTYPILEWEDIKFEDVIGEGNFGQVIKAMIKKDGNKMSAAIKMLKEFASENDHRDFAGELEVLCKLGQHPNIINLIGACENRGYLYIAIEYAPYGNLLDFLRKSRVLETDPAFAKEHGTASTLTSQQLLQFAVDVATGMHYLSDKQFIHRDLAARNVLVGDSLVAKIADFGLSRGEEVYVKKTMGRLPVRWMAIESLNYSVYTSKSDVWSFGVLLWEIVSLGGTPYCGMTCAELYEKLPQGYRMEKPKNCDDEVYELMRQCWRDRPYERPPFSQISVQLSRMQEARKAYVNMALFENFTYAGIDATAEEA
					

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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	69.1	Low	86.6	Confident	247 Å²	247	116.2 Å²	116.2	100%	1.217	60%	0.596	S	S	*	*				0	126.5	0	-168.4	176	-151.9	0	0	106.5
2	R	85.1	Confident	87	Confident	167 Å²	167	111.6 Å²	111.6	63%	0.63	57%	0.568	S	S	*	*			trans	-104.8	122	175.1	-176.4	177.4	179.8	-140.9	-9.7	107.1	I4 D82	R2-I4 HydrophobicContact CG-CG1 4.49Å; R2-D82 IonicContact CZ-OD1 3.69Å; R2-D82 IonicContact CZ-OD2 2.71Å; R2-D82 IonicContact NH1-OD1 2.69Å; R2-D82 PolarHBondContact NH1-OD1 3.04Å; R2-D82 VanDerWaalsContact NH2-CG 3.33Å; R2-D82 IonicContact NH2-OD1 2.72Å; R2-D82 PolarHBondContact NH2-OD1 2.97Å; R2-D82 VanDerWaalsContact NH2-OD1 3.09Å; R2-D82 IonicContact NH2-OD2 3.41Å; R2-D82 PolarHBondContact NH2-OD2 2.93Å
3	L	88.5	Confident	87.4	Confident	151 Å²	151	106.7 Å²	106.7	79%	0.791	54%	0.538	S	S	*	.			trans	-95.2	127.3	175.2	-177.9	66.9	0	0	0	108.1	V5	L3-V5 HydrophobicContact CD2-CG2 4.13Å; L3-V5 HydrophobicContact CG-CG2 4.06Å
4	I	90.9	Very high	87.4	Confident	52 Å²	52	99.8 Å²	99.8	27%	0.267	51%	0.507	S	S	.	.			trans	-113.9	120.9	174.1	-58.4	171.2	0	0	0	106.2	R2 D82	R2-I4 HydrophobicContact CG-CG1 4.49Å; I4-D82 WeakPolarHBondContact CD1-OD1 3.29Å; I4-D82 HydrophobicContact CG2-CB 4.42Å
5	V	88.2	Confident	87.5	Confident	118 Å²	118	105.3 Å²	105.3	72%	0.715	53%	0.53	S	S	*	.			trans	-111.1	125.2	175.6	-175.9	0	0	0	0	106.6	L3	L3-V5 HydrophobicContact CD2-CG2 4.13Å; L3-V5 HydrophobicContact CG-CG2 4.06Å
6	R	89.5	Confident	87.7	Confident	57 Å²	57	105.8 Å²	105.8	22%	0.215	54%	0.535	C	S	.	.			trans	-80	151.8	178.2	-69.7	171.7	57.6	175	-2.2	110.2	C8 K12 C30 D32 P83	R6-C8 VanDerWaalsContact C-N 3.27Å; R6-C8 PolarHBondContact O-N 3.13Å; R6-K12 PolarHBondContact NH2-O 2.74Å; R6-C30 PolarHBondContact NH1-O 2.94Å; R6-C30 VanDerWaalsContact NH1-O 3.09Å; R6-C30 PolarHBondContact NH2-O 2.92Å; R6-D32 WeakPolarHBondContact CA-OD2 3.25Å; R6-D32 HydrophobicContact CB-CB 4.48Å; R6-D32 WeakPolarHBondContact CB-OD2 3.32Å; R6-P83 HydrophobicContact CG-CB 3.61Å; R6-P83 HydrophobicContact CG-CG 4.43Å
7	D	88.9	Confident	87.8	Confident	136 Å²	136	101.3 Å²	101.3	73%	0.727	52%	0.515	S	S	*	.	S	Bend	trans	-70.2	-29.7	177.9	-70.8	-21.2	0	0	0	111.6	D32	D7-D32 PolarHBondContact N-OD2 3Å
8	C	90.6	Very high	88	Confident	9 Å²	9	102.3 Å²	102.3	6%	0.061	52%	0.522	C	S	.	.	S	Bend	trans	-105.5	149.8	177.8	-70.2	0	0	0	0	113.9	R6 K12 G14 C17 D32	R6-C8 VanDerWaalsContact C-N 3.27Å; R6-C8 PolarHBondContact O-N 3.13Å; C8-K12 HydrophobicContact CB-CB 4.32Å; C8-K12 WeakPolarHBondContact CB-O 3.38Å; C8-G14 PolarHBondContact SG-O 3.07Å; C8-C17 WeakPolarHBondContact CA-SG 3.42Å; C8-C17 HydrophobicContact CB-CB 3.76Å; C8-C17 WeakPolarHBondContact CB-SG 3.21Å; C8-C17 WeakPolarHBondContact SG-CA 2.9Å; C8-C17 WeakPolarHBondContact SG-CB 3.19Å; C8-C17 CovalentContact SG-SG 2.04Å; C8-C17 PolarHBondContact SG-SG 3.49Å; C8-D32 HydrophobicContact CB-CB 4.14Å
9	P	89.7	Confident	87.9	Confident	83 Å²	83	103.1 Å²	103.1	54%	0.539	52%	0.521	S	S	.	.			trans	-62.4	160.7	171.6	26.5	-32.8	0	0	0	111.6	K11 K12	P9-K11 PolarHBondContact O-N 2.88Å; P9-K12 HydrophobicContact CG-CB 4.16Å; P9-K12 HydrophobicContact CG-CG 4.21Å; P9-K12 PolarHBondContact O-N 3.28Å
10	S	84.9	Confident	88.1	Confident	102 Å²	102	103.6 Å²	103.6	71%	0.713	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	137.4	179.5	-173.4	0	0	0	0	111.7	K12	S10-K12 VanDerWaalsContact C-N 3.27Å; S10-K12 PolarHBondContact O-N 2.81Å
11	K	86.9	Confident	88.1	Confident	156 Å²	156	99.7 Å²	99.7	68%	0.678	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	10.3	-176.9	-51.2	-179.3	178.2	-178	0	116.2	P9 C21	P9-K11 PolarHBondContact O-N 2.88Å; K11-C21 WeakPolarHBondContact O-CB 2.98Å; K11-C21 PolarHBondContact O-N 2.95Å
12	K	91.2	Very high	88.9	Confident	61 Å²	61	90.2 Å²	90.2	27%	0.265	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	152.2	174.6	-66.5	-62.5	-160.1	173.6	0	112.4	R6 C8 P9 S10 C17 D18 K19 D20 C21	R6-K12 PolarHBondContact NH2-O 2.74Å; C8-K12 HydrophobicContact CB-CB 4.32Å; C8-K12 WeakPolarHBondContact CB-O 3.38Å; P9-K12 HydrophobicContact CG-CB 4.16Å; P9-K12 HydrophobicContact CG-CG 4.21Å; P9-K12 PolarHBondContact O-N 3.28Å; S10-K12 VanDerWaalsContact C-N 3.27Å; S10-K12 PolarHBondContact O-N 2.81Å; K12-C17 HydrophobicContact CB-CB 4.07Å; K12-C17 WeakPolarHBondContact CB-O 3.09Å; K12-C17 WeakPolarHBondContact CD-O 3.39Å; K12-C17 WeakPolarHBondContact CG-O 3.4Å; K12-D18 PolarHBondContact NZ-O 3.47Å; K12-K19 CarbonylContact C-O 3.44Å; K12-K19 VanDerWaalsContact CA-O 3.31Å; K12-K19 WeakPolarHBondContact CA-O 3.24Å; K12-K19 WeakPolarHBondContact CD-O 3.23Å; K12-D20 WeakPolarHBondContact CD-OD1 3.47Å; K12-D20 VanDerWaalsContact CE-OD1 3.32Å; K12-D20 WeakPolarHBondContact CE-OD1 3.15Å; K12-D20 IonicContact NZ-OD1 3.36Å; K12-D20 PolarHBondContact NZ-OD1 3.45Å; K12-C21 PolarHBondContact O-SG 3.4Å
13	W	92.8	Very high	89.1	Confident	48 Å²	48	87.3 Å²	87.3	18%	0.182	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	171.4	174.9	76.4	-84.5	0	0	0	111.8	C17 K19 D20 H31 D32 L33 D34 G35	W13-C17 WeakPolarHBondContact O-CA 3.39Å; W13-K19 HydrophobicContact CD2-CB 4Å; W13-K19 HydrophobicContact CD2-CD 4.13Å; W13-K19 HydrophobicContact CE3-CD 4.24Å; W13-K19 HydrophobicContact CG-CB 4.15Å; W13-K19 HydrophobicContact CH2-CD 3.56Å; W13-K19 HydrophobicContact CZ2-CB 4.15Å; W13-K19 HydrophobicContact CZ2-CD 3.37Å; W13-K19 HydrophobicContact CZ2-CG 4.41Å; W13-K19 HydrophobicContact CZ3-CD 3.96Å; W13-K19 PolarHBondContact N-O 3.09Å; W13-K19 WeakPolarHBondContact O-CB 3.32Å; W13-K19 PolarHBondContact O-N 3.02Å; W13-D20 VanDerWaalsContact CD1-O 3.31Å; W13-D20 PolarHBondContact NE1-O 3.25Å; W13-D20 VanDerWaalsContact NE1-O 3.07Å; W13-H31 WeakPolarHBondContact CB-O 3.02Å; W13-D32 CarbonylContact C-O 3.55Å; W13-D32 VanDerWaalsContact CA-O 3.29Å; W13-D32 WeakPolarHBondContact CA-O 3.29Å; W13-D32 WeakPolarHBondContact CB-O 3.39Å; W13-L33 VanDerWaalsContact CE3-O 3.23Å; W13-L33 WeakPolarHBondContact CZ3-O 3.46Å; W13-D34 WeakPolarHBondContact CH2-O 3.39Å; W13-D34 VanDerWaalsContact CZ3-CA 3.45Å; W13-D34 WeakPolarHBondContact CZ3-O 3.39Å; W13-G35 VanDerWaalsContact CE3-N 3.25Å; W13-G35 VanDerWaalsContact CG-CA 3.44Å
14	G	88	Confident	89.2	Confident	10 Å²	10	81.1 Å²	81.1	10%	0.103	43%	0.43	C	S	.	.	S	Bend	trans	97.5	163	-176.9	0	0	0	0	0	111.5	C8 N16 C17 D32	C8-G14 PolarHBondContact SG-O 3.07Å; G14-N16 PolarHBondContact O-N 3.13Å; G14-C17 PolarHBondContact O-N 2.81Å; G14-D32 PolarHBondContact N-O 3.1Å
15	H	88.8	Confident	89.2	Confident	183 Å²	183	80.1 Å²	80.1	85%	0.847	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-29.7	-175.8	-171.3	-74	0	0	0	114.3
16	N	89.9	Confident	89.3	Confident	113 Å²	113	75 Å²	75	60%	0.604	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	5.7	179	-63.1	-10.7	0	0	0	113.5	G14 D18	G14-N16 PolarHBondContact O-N 3.13Å; N16-D18 VanDerWaalsContact CB-OD2 3.22Å; N16-D18 WeakPolarHBondContact CB-OD2 3.48Å; N16-D18 PolarHBondContact O-N 2.83Å
17	C	89.9	Confident	89.3	Confident	29 Å²	29	73.8 Å²	73.8	20%	0.196	40%	0.399	C	S	.	.	S	Bend	trans	59.4	25.6	-176.4	-46.7	0	0	0	0	115.3	C8 K12 W13 G14	C8-C17 WeakPolarHBondContact CA-SG 3.42Å; C8-C17 HydrophobicContact CB-CB 3.76Å; C8-C17 WeakPolarHBondContact CB-SG 3.21Å; C8-C17 WeakPolarHBondContact SG-CA 2.9Å; C8-C17 WeakPolarHBondContact SG-CB 3.19Å; C8-C17 CovalentContact SG-SG 2.04Å; C8-C17 PolarHBondContact SG-SG 3.49Å; K12-C17 HydrophobicContact CB-CB 4.07Å; K12-C17 WeakPolarHBondContact CB-O 3.09Å; K12-C17 WeakPolarHBondContact CD-O 3.39Å; K12-C17 WeakPolarHBondContact CG-O 3.4Å; W13-C17 WeakPolarHBondContact O-CA 3.39Å; G14-C17 PolarHBondContact O-N 2.81Å
18	D	90.6	Very high	89.5	Confident	120 Å²	120	68 Å²	68	64%	0.642	37%	0.371	S	S	*	.			trans	-81.2	-24.9	-178.6	-64	-38.3	0	0	0	112.8	K12 N16	K12-D18 PolarHBondContact NZ-O 3.47Å; N16-D18 VanDerWaalsContact CB-OD2 3.22Å; N16-D18 WeakPolarHBondContact CB-OD2 3.48Å; N16-D18 PolarHBondContact O-N 2.83Å
19	K	87.4	Confident	89.6	Confident	116 Å²	116	69.3 Å²	69.3	50%	0.504	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	139.6	-175	-58.6	-179	-177.1	176.6	0	111.1	K12 W13	K12-K19 CarbonylContact C-O 3.44Å; K12-K19 VanDerWaalsContact CA-O 3.31Å; K12-K19 WeakPolarHBondContact CA-O 3.24Å; K12-K19 WeakPolarHBondContact CD-O 3.23Å; W13-K19 HydrophobicContact CD2-CB 4Å; W13-K19 HydrophobicContact CD2-CD 4.13Å; W13-K19 HydrophobicContact CE3-CD 4.24Å; W13-K19 HydrophobicContact CG-CB 4.15Å; W13-K19 HydrophobicContact CH2-CD 3.56Å; W13-K19 HydrophobicContact CZ2-CB 4.15Å; W13-K19 HydrophobicContact CZ2-CD 3.37Å; W13-K19 HydrophobicContact CZ2-CG 4.41Å; W13-K19 HydrophobicContact CZ3-CD 3.96Å; W13-K19 PolarHBondContact N-O 3.09Å; W13-K19 WeakPolarHBondContact O-CB 3.32Å; W13-K19 PolarHBondContact O-N 3.02Å
20	D	90.3	Very high	89.8	Confident	114 Å²	114	65.8 Å²	65.8	61%	0.61	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	134.2	175.2	-65.4	-45.1	0	0	0	110.9	K12 W13	K12-D20 WeakPolarHBondContact CD-OD1 3.47Å; K12-D20 VanDerWaalsContact CE-OD1 3.32Å; K12-D20 WeakPolarHBondContact CE-OD1 3.15Å; K12-D20 IonicContact NZ-OD1 3.36Å; K12-D20 PolarHBondContact NZ-OD1 3.45Å; W13-D20 VanDerWaalsContact CD1-O 3.31Å; W13-D20 PolarHBondContact NE1-O 3.25Å; W13-D20 VanDerWaalsContact NE1-O 3.07Å
21	C	88.6	Confident	90.1	Very high	21 Å²	21	62.8 Å²	62.8	14%	0.142	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-67.3	141.4	172.5	-82.5	0	0	0	0	110.4	K11 K12 C30	K11-C21 WeakPolarHBondContact O-CB 2.98Å; K11-C21 PolarHBondContact O-N 2.95Å; K12-C21 PolarHBondContact O-SG 3.4Å; C21-C30 HydrophobicContact CB-CB 3.55Å; C21-C30 WeakPolarHBondContact CB-SG 3.26Å; C21-C30 WeakPolarHBondContact SG-CB 3.23Å; C21-C30 CovalentContact SG-SG 2.03Å; C21-C30 PolarHBondContact SG-SG 2.77Å
22	P	87.1	Confident	90.2	Very high	49 Å²	49	56.1 Å²	56.1	32%	0.318	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-59.1	146.9	162.7	28.1	-33	0	0	0	109.5	C24 G35 R47	P22-C24 PolarHBondContact O-N 3.44Å; P22-C24 PolarHBondContact O-SG 3.4Å; P22-G35 WeakPolarHBondContact CD-O 3.27Å; P22-G35 WeakPolarHBondContact CG-O 3.18Å; P22-R47 HydrophobicContact CB-CG 4.48Å
23	D	88.8	Confident	90	Very high	106 Å²	106	58.4 Å²	58.4	57%	0.567	32%	0.317	S	S	*	.			trans	-73.7	95.1	177	174.8	46.5	0	0	0	109.3	L25 R47	D23-L25 PolarHBondContact O-N 3.01Å; D23-L25 WeakPolarHBondContact OD2-CD2 3.45Å; D23-R47 VanDerWaalsContact CB-NH2 3.33Å; D23-R47 VanDerWaalsContact O-CZ 3.31Å; D23-R47 PolarHBondContact O-NE 3.44Å; D23-R47 PolarHBondContact O-NH2 3.42Å; D23-R47 IonicContact OD2-NH2 2.63Å; D23-R47 PolarHBondContact OD2-NH2 2.86Å; D23-R47 VanDerWaalsContact OD2-NH2 3.11Å
24	C	90.8	Very high	89.9	Confident	21 Å²	21	59.8 Å²	59.8	14%	0.142	33%	0.328	C	S	.	.			trans	-73.5	112.4	-179.6	-55.7	0	0	0	0	110.1	P22 G28 C30 C37	P22-C24 PolarHBondContact O-N 3.44Å; P22-C24 PolarHBondContact O-SG 3.4Å; C24-G28 WeakPolarHBondContact CB-O 3.47Å; C24-C30 PolarHBondContact SG-N 2.82Å; C24-C37 WeakPolarHBondContact CA-SG 3.39Å; C24-C37 HydrophobicContact CB-CB 3.81Å; C24-C37 WeakPolarHBondContact CB-SG 3.5Å; C24-C37 VanDerWaalsContact SG-CA 3.56Å; C24-C37 WeakPolarHBondContact SG-CB 3.4Å; C24-C37 CovalentContact SG-SG 2.03Å; C24-C37 PolarHBondContact SG-SG 2.88Å
25	L	90.2	Very high	89.9	Confident	30 Å²	30	59.5 Å²	59.5	16%	0.157	33%	0.325	C	S	.	.			trans	-80.5	171.5	-176.1	-55.9	-177.8	0	0	0	111.4	D23 G27 G28 R47 C48 E49	D23-L25 PolarHBondContact O-N 3.01Å; D23-L25 WeakPolarHBondContact OD2-CD2 3.45Å; L25-G27 PolarHBondContact O-N 3.09Å; L25-G28 PolarHBondContact O-N 3.25Å; L25-R47 WeakPolarHBondContact CB-O 3.33Å; L25-R47 PolarHBondContact N-O 2.94Å; L25-C48 WeakPolarHBondContact O-CB 3.38Å; L25-E49 HydrophobicContact CD1-CB 3.88Å
26	N	91.2	Very high	89.9	Confident	12 Å²	12	54.9 Å²	54.9	6%	0.064	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	26.8	171.9	-59.9	-42.5	0	0	0	115.8	P40 F43 C48 Y106 P108 L112	N26-P40 VanDerWaalsContact O-CG 3.3Å; N26-P40 WeakPolarHBondContact O-CG 3.26Å; N26-F43 HydrophobicContact CB-CD1 3.67Å; N26-F43 HydrophobicContact CB-CD2 4.04Å; N26-F43 HydrophobicContact CB-CE1 3.74Å; N26-F43 HydrophobicContact CB-CE2 4.08Å; N26-F43 HydrophobicContact CB-CG 3.83Å; N26-F43 HydrophobicContact CB-CZ 3.95Å; N26-F43 VanDerWaalsContact CG-CE1 3.49Å; N26-F43 WeakPolarHBondContact ND2-CD1 3.06Å; N26-F43 WeakPolarHBondContact ND2-CE1 3.28Å; N26-C48 PolarHBondContact ND2-O 3.32Å; N26-Y106 WeakPolarHBondContact OD1-CE2 3.26Å; N26-Y106 PolarHBondContact OD1-OH 3.23Å; N26-P108 WeakPolarHBondContact O-CD 3.35Å; N26-L112 HydrophobicContact CB-CD1 4.41Å
27	G	89.5	Confident	90.1	Very high	31 Å²	31	50.3 Å²	50.3	32%	0.32	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	18.2	179.3	0	0	0	0	0	114.1	L25	L25-G27 PolarHBondContact O-N 3.09Å
28	G	92.3	Very high	90.2	Very high	13 Å²	13	50.2 Å²	50.2	13%	0.134	28%	0.282	C	S	.	.			trans	-67.3	154.3	168.6	0	0	0	0	0	112.7	C24 L25 V38	C24-G28 WeakPolarHBondContact CB-O 3.47Å; L25-G28 PolarHBondContact O-N 3.25Å; G28-V38 WeakPolarHBondContact CA-O 3.24Å
29	V	93.2	Very high	90.4	Very high	38 Å²	38	45.7 Å²	45.7	23%	0.23	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.9	180	-176.1	0	0	0	0	108.7	H31 V38 P83 Y84	V29-H31 PolarHBondContact O-N 3.04Å; V29-V38 PolarHBondContact N-O 3.33Å; V29-V38 VanDerWaalsContact N-O 3.09Å; V29-V38 PolarHBondContact O-N 3.01Å; V29-P83 HydrophobicContact CG1-CB 4.31Å; V29-P83 HydrophobicContact CG1-CG 3.94Å; V29-Y84 HydrophobicContact CB-CD2 4.27Å; V29-Y84 HydrophobicContact CG2-CD2 3.79Å; V29-Y84 HydrophobicContact CG2-CE2 4.41Å
30	C	92.9	Very high	90.7	Very high	8 Å²	8	40.2 Å²	40.2	5%	0.054	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	130.6	172.9	172.4	0	0	0	0	110.2	R6 C21 C24	R6-C30 PolarHBondContact NH1-O 2.94Å; R6-C30 VanDerWaalsContact NH1-O 3.09Å; R6-C30 PolarHBondContact NH2-O 2.92Å; C21-C30 HydrophobicContact CB-CB 3.55Å; C21-C30 WeakPolarHBondContact CB-SG 3.26Å; C21-C30 WeakPolarHBondContact SG-CB 3.23Å; C21-C30 CovalentContact SG-SG 2.03Å; C21-C30 PolarHBondContact SG-SG 2.77Å; C24-C30 PolarHBondContact SG-N 2.82Å
31	H	92.3	Very high	90.8	Very high	39 Å²	39	35 Å²	35	18%	0.181	21%	0.208	C	C	.	.			trans	-74.1	132.8	175	-164	-57.6	0	0	0	110	W13 V29 L33 D34 G35 D36 V38	W13-H31 WeakPolarHBondContact CB-O 3.02Å; V29-H31 PolarHBondContact O-N 3.04Å; H31-L33 PolarHBondContact ND1-N 2.8Å; H31-L33 VanDerWaalsContact ND1-N 3.15Å; H31-D34 WeakPolarHBondContact CB-OD1 3.45Å; H31-D34 IonicContact CG-OD1 2.68Å; H31-D34 IonicContact ND1-OD1 3.56Å; H31-G35 VanDerWaalsContact O-CA 3.32Å; H31-G35 WeakPolarHBondContact O-CA 3.16Å; H31-G35 PolarHBondContact O-N 2.93Å; H31-G35 VanDerWaalsContact O-N 3.07Å; H31-D36 WeakPolarHBondContact CB-O 3.37Å; H31-D36 PolarHBondContact N-O 2.98Å; H31-V38 HydrophobicContact CB-CG2 4.42Å
32	D	89.4	Confident	90.9	Very high	16 Å²	16	34.6 Å²	34.6	9%	0.086	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-25.4	-175.1	49.9	3.6	0	0	0	113.9	R6 D7 C8 W13 G14	R6-D32 WeakPolarHBondContact CA-OD2 3.25Å; R6-D32 HydrophobicContact CB-CB 4.48Å; R6-D32 WeakPolarHBondContact CB-OD2 3.32Å; D7-D32 PolarHBondContact N-OD2 3Å; C8-D32 HydrophobicContact CB-CB 4.14Å; W13-D32 CarbonylContact C-O 3.55Å; W13-D32 VanDerWaalsContact CA-O 3.29Å; W13-D32 WeakPolarHBondContact CA-O 3.29Å; W13-D32 WeakPolarHBondContact CB-O 3.39Å; G14-D32 PolarHBondContact N-O 3.1Å
33	L	86.8	Confident	91.2	Very high	109 Å²	109	32.3 Å²	32.3	57%	0.571	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-46.9	174.8	-61	179	0	0	0	116	W13 H31	W13-L33 VanDerWaalsContact CE3-O 3.23Å; W13-L33 WeakPolarHBondContact CZ3-O 3.46Å; H31-L33 PolarHBondContact ND1-N 2.8Å; H31-L33 VanDerWaalsContact ND1-N 3.15Å
34	D	89.7	Confident	91.2	Very high	77 Å²	77	30 Å²	30	41%	0.412	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-8	-170.8	61.8	18.3	0	0	0	114.8	W13 H31 D36	W13-D34 WeakPolarHBondContact CH2-O 3.39Å; W13-D34 VanDerWaalsContact CZ3-CA 3.45Å; W13-D34 WeakPolarHBondContact CZ3-O 3.39Å; H31-D34 WeakPolarHBondContact CB-OD1 3.45Å; H31-D34 IonicContact CG-OD1 2.68Å; H31-D34 IonicContact ND1-OD1 3.56Å; D34-D36 PolarHBondContact O-N 2.82Å; D34-D36 WeakPolarHBondContact OD1-CB 3.41Å; D34-D36 PolarHBondContact OD1-N 3.43Å
35	G	88.1	Confident	90.9	Very high	4 Å²	4	30.5 Å²	30.5	4%	0.041	19%	0.188	C	C	.	.			trans	78.1	2.2	178	0	0	0	0	0	114.6	W13 P22 H31	W13-G35 VanDerWaalsContact CE3-N 3.25Å; W13-G35 VanDerWaalsContact CG-CA 3.44Å; P22-G35 WeakPolarHBondContact CD-O 3.27Å; P22-G35 WeakPolarHBondContact CG-O 3.18Å; H31-G35 VanDerWaalsContact O-CA 3.32Å; H31-G35 WeakPolarHBondContact O-CA 3.16Å; H31-G35 PolarHBondContact O-N 2.93Å; H31-G35 VanDerWaalsContact O-N 3.07Å
36	D	90.1	Very high	90.6	Very high	86 Å²	86	34.7 Å²	34.7	46%	0.46	22%	0.215	S	C	.	.			trans	-72.6	145.4	179.1	-82.5	-7.9	0	0	0	111.2	H31 D34 V38	H31-D36 WeakPolarHBondContact CB-O 3.37Å; H31-D36 PolarHBondContact N-O 2.98Å; D34-D36 PolarHBondContact O-N 2.82Å; D34-D36 WeakPolarHBondContact OD1-CB 3.41Å; D34-D36 PolarHBondContact OD1-N 3.43Å; D36-V38 PolarHBondContact O-N 3.31Å
37	C	92.1	Very high	90.5	Very high	18 Å²	18	38.6 Å²	38.6	12%	0.122	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	117.7	173.7	-67.2	0	0	0	0	110.9	C24 C39	C24-C37 WeakPolarHBondContact CA-SG 3.39Å; C24-C37 HydrophobicContact CB-CB 3.81Å; C24-C37 WeakPolarHBondContact CB-SG 3.5Å; C24-C37 VanDerWaalsContact SG-CA 3.56Å; C24-C37 WeakPolarHBondContact SG-CB 3.4Å; C24-C37 CovalentContact SG-SG 2.03Å; C24-C37 PolarHBondContact SG-SG 2.88Å; C37-C39 PolarHBondContact O-N 2.88Å
38	V	93.1	Very high	90.6	Very high	26 Å²	26	37.1 Å²	37.1	16%	0.158	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	108.5	167.8	-174	0	0	0	0	108.4	G28 V29 H31 D36 L80 Y84	G28-V38 WeakPolarHBondContact CA-O 3.24Å; V29-V38 PolarHBondContact N-O 3.33Å; V29-V38 VanDerWaalsContact N-O 3.09Å; V29-V38 PolarHBondContact O-N 3.01Å; H31-V38 HydrophobicContact CB-CG2 4.42Å; D36-V38 PolarHBondContact O-N 3.31Å; V38-L80 HydrophobicContact CG1-CB 4.22Å; V38-L80 HydrophobicContact CG1-CD1 4.29Å; V38-Y84 HydrophobicContact CG1-CD2 4.38Å; V38-Y84 HydrophobicContact CG1-CG 4.19Å
39	C	94.3	Very high	90.3	Very high	26 Å²	26	40.6 Å²	40.6	18%	0.176	23%	0.226	C	C	.	.			trans	-85	139.1	-173.1	-60.7	0	0	0	0	113.7	C37 F43 G45 C48 L80	C37-C39 PolarHBondContact O-N 2.88Å; C39-F43 WeakPolarHBondContact CB-O 3.46Å; C39-G45 PolarHBondContact SG-O 2.81Å; C39-G45 VanDerWaalsContact SG-O 3.41Å; C39-C48 WeakPolarHBondContact CA-SG 3.44Å; C39-C48 HydrophobicContact CB-CB 3.74Å; C39-C48 WeakPolarHBondContact CB-SG 3.33Å; C39-C48 WeakPolarHBondContact SG-CA 3.29Å; C39-C48 WeakPolarHBondContact SG-CB 3.25Å; C39-C48 CovalentContact SG-SG 2.04Å; C39-C48 PolarHBondContact SG-SG 3.24Å; C39-L80 WeakPolarHBondContact O-CD1 3.43Å
40	P	94.5	Very high	90	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.233	C	C	.	.			trans	-66.9	155.4	178.8	26.4	-32.5	0	0	0	112.4	N26 G42 F43 Y84 P108	N26-P40 VanDerWaalsContact O-CG 3.3Å; N26-P40 WeakPolarHBondContact O-CG 3.26Å; P40-G42 PolarHBondContact O-N 2.84Å; P40-G42 VanDerWaalsContact O-N 3.09Å; P40-F43 HydrophobicContact CG-CB 4.2Å; P40-F43 HydrophobicContact CG-CD2 3.89Å; P40-F43 HydrophobicContact CG-CG 4.41Å; P40-F43 PolarHBondContact O-N 2.89Å; P40-Y84 HydrophobicContact CB-CE2 3.87Å; P40-Y84 VanDerWaalsContact CB-OH 3.24Å; P40-Y84 WeakPolarHBondContact CB-OH 3.19Å; P40-P108 HydrophobicContact CB-CB 4Å; P40-P108 HydrophobicContact CB-CG 3.81Å; P40-P108 HydrophobicContact CG-CG 4.22Å
41	P	92.8	Very high	89.8	Confident	4 Å²	4	43 Å²	43	3%	0.026	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	115.3	174.3	25.3	-36.6	0	0	0	111.5	F57 F78 A89 S90	P41-F57 HydrophobicContact CB-CB 4.23Å; P41-F78 HydrophobicContact CB-CB 4.15Å; P41-F78 HydrophobicContact CB-CD1 4.22Å; P41-F78 HydrophobicContact CB-CD2 3.79Å; P41-F78 HydrophobicContact CB-CE2 4.31Å; P41-F78 HydrophobicContact CB-CG 3.76Å; P41-F78 HydrophobicContact CG-CB 3.89Å; P41-F78 HydrophobicContact CG-CD2 3.9Å; P41-F78 HydrophobicContact CG-CG 3.95Å; P41-A89 HydrophobicContact CB-CB 4.41Å; P41-S90 PolarHBondContact O-N 3.38Å; P41-S90 VanDerWaalsContact O-N 3.13Å
42	G	90.7	Very high	89.6	Confident	12 Å²	12	41.8 Å²	41.8	12%	0.124	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.3	1	-176	0	0	0	0	0	114.7	P40 C52	P40-G42 PolarHBondContact O-N 2.84Å; P40-G42 VanDerWaalsContact O-N 3.09Å; G42-C52 WeakPolarHBondContact O-CB 3.48Å; G42-C52 PolarHBondContact O-N 2.87Å
43	F	92.9	Very high	89.3	Confident	2 Å²	2	51 Å²	51	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151.3	173	-66.2	-88.2	0	0	0	112	N26 C39 P40 C48 T50 A51 S90 Y106 F125	N26-F43 HydrophobicContact CB-CD1 3.67Å; N26-F43 HydrophobicContact CB-CD2 4.04Å; N26-F43 HydrophobicContact CB-CE1 3.74Å; N26-F43 HydrophobicContact CB-CE2 4.08Å; N26-F43 HydrophobicContact CB-CG 3.83Å; N26-F43 HydrophobicContact CB-CZ 3.95Å; N26-F43 VanDerWaalsContact CG-CE1 3.49Å; N26-F43 WeakPolarHBondContact ND2-CD1 3.06Å; N26-F43 WeakPolarHBondContact ND2-CE1 3.28Å; C39-F43 WeakPolarHBondContact CB-O 3.46Å; P40-F43 HydrophobicContact CG-CB 4.2Å; P40-F43 HydrophobicContact CG-CD2 3.89Å; P40-F43 HydrophobicContact CG-CG 4.41Å; P40-F43 PolarHBondContact O-N 2.89Å; F43-C48 HydrophobicContact CB-CB 4.47Å; F43-T50 CarbonylContact C-O 3.51Å; F43-T50 VanDerWaalsContact CA-O 3.29Å; F43-T50 WeakPolarHBondContact CA-O 3.47Å; F43-A51 HydrophobicContact CD1-CB 4.01Å; F43-A51 HydrophobicContact CE1-CB 3.71Å; F43-S90 WeakPolarHBondContact CE2-OG 3.24Å; F43-Y106 HydrophobicContact CZ-CD2 4.14Å; F43-Y106 HydrophobicContact CZ-CE2 4.25Å; F43-F125 WeakPolarHBondContact CZ-O 3.43Å
44	M	88.8	Confident	89.1	Confident	56 Å²	56	48.6 Å²	48.6	28%	0.276	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	-179.5	176.7	71	171.7	178.5	0	0	111.3	C48 E49 T50 C61	M44-C48 CarbonylContact O-C 3.54Å; M44-C48 WeakPolarHBondContact O-CA 3.21Å; M44-E49 PolarHBondContact O-N 2.65Å; M44-T50 HydrophobicContact CE-CG2 3.73Å; M44-T50 HydrophobicContact CG-CG2 4.28Å; M44-T50 PolarHBondContact N-O 2.95Å; M44-T50 PolarHBondContact O-N 2.87Å; M44-C61 WeakPolarHBondContact CG-SG 3.5Å; M44-C61 HydrophobicContact SD-CB 3.99Å; M44-C61 PolarHBondContact SD-SG 3.05Å
45	G	84.8	Confident	88.8	Confident	33 Å²	33	45.6 Å²	45.6	34%	0.34	26%	0.257	S	S	.	.	S	Bend	trans	106.4	166.7	-176	0	0	0	0	0	111.1	C39 R47 C48	C39-G45 PolarHBondContact SG-O 2.81Å; C39-G45 VanDerWaalsContact SG-O 3.41Å; G45-R47 PolarHBondContact O-N 2.82Å; G45-C48 PolarHBondContact O-N 3.46Å
46	T	83.5	Confident	88.8	Confident	117 Å²	117	48.2 Å²	48.2	72%	0.718	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-19.1	-177.4	54.1	0	0	0	0	112.3	E49	T46-E49 PolarHBondContact N-OE2 3.38Å
47	R	89.2	Confident	88.8	Confident	95 Å²	95	45.7 Å²	45.7	36%	0.358	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	17.2	175.2	-62.4	-179.4	57	-161.5	-9.1	112.4	P22 D23 L25 G45 E49	P22-R47 HydrophobicContact CB-CG 4.48Å; D23-R47 VanDerWaalsContact CB-NH2 3.33Å; D23-R47 VanDerWaalsContact O-CZ 3.31Å; D23-R47 PolarHBondContact O-NE 3.44Å; D23-R47 PolarHBondContact O-NH2 3.42Å; D23-R47 IonicContact OD2-NH2 2.63Å; D23-R47 PolarHBondContact OD2-NH2 2.86Å; D23-R47 VanDerWaalsContact OD2-NH2 3.11Å; L25-R47 WeakPolarHBondContact CB-O 3.33Å; L25-R47 PolarHBondContact N-O 2.94Å; G45-R47 PolarHBondContact O-N 2.82Å; R47-E49 VanDerWaalsContact CA-OE2 3.27Å; R47-E49 WeakPolarHBondContact CA-OE2 3.49Å; R47-E49 WeakPolarHBondContact CB-OE2 3.35Å; R47-E49 PolarHBondContact N-OE2 2.84Å; R47-E49 PolarHBondContact O-N 2.87Å
48	C	90.9	Very high	88.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	58.9	27.9	-177.1	-43.3	0	0	0	0	114.2	L25 N26 C39 F43 M44 G45	L25-C48 WeakPolarHBondContact O-CB 3.38Å; N26-C48 PolarHBondContact ND2-O 3.32Å; C39-C48 WeakPolarHBondContact CA-SG 3.44Å; C39-C48 HydrophobicContact CB-CB 3.74Å; C39-C48 WeakPolarHBondContact CB-SG 3.33Å; C39-C48 WeakPolarHBondContact SG-CA 3.29Å; C39-C48 WeakPolarHBondContact SG-CB 3.25Å; C39-C48 CovalentContact SG-SG 2.04Å; C39-C48 PolarHBondContact SG-SG 3.24Å; F43-C48 HydrophobicContact CB-CB 4.47Å; M44-C48 CarbonylContact O-C 3.54Å; M44-C48 WeakPolarHBondContact O-CA 3.21Å; G45-C48 PolarHBondContact O-N 3.46Å
49	E	86.9	Confident	87.9	Confident	86 Å²	86	54.2 Å²	54.2	40%	0.402	29%	0.287	S	S	.	.			trans	-77.6	-18.3	-173.5	68.6	-87.1	-153.9	0	0	113.9	L25 M44 T46 R47	L25-E49 HydrophobicContact CD1-CB 3.88Å; M44-E49 PolarHBondContact O-N 2.65Å; T46-E49 PolarHBondContact N-OE2 3.38Å; R47-E49 VanDerWaalsContact CA-OE2 3.27Å; R47-E49 WeakPolarHBondContact CA-OE2 3.49Å; R47-E49 WeakPolarHBondContact CB-OE2 3.35Å; R47-E49 PolarHBondContact N-OE2 2.84Å; R47-E49 PolarHBondContact O-N 2.87Å
50	T	86.8	Confident	87.3	Confident	60 Å²	60	57.9 Å²	57.9	37%	0.368	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122	-173.1	-56.4	0	0	0	0	110.6	F43 M44	F43-T50 CarbonylContact C-O 3.51Å; F43-T50 VanDerWaalsContact CA-O 3.29Å; F43-T50 WeakPolarHBondContact CA-O 3.47Å; M44-T50 HydrophobicContact CE-CG2 3.73Å; M44-T50 HydrophobicContact CG-CG2 4.28Å; M44-T50 PolarHBondContact N-O 2.95Å; M44-T50 PolarHBondContact O-N 2.87Å
51	A	88.4	Confident	87.1	Confident	35 Å²	35	58.5 Å²	58.5	29%	0.289	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	134	172.8	0	0	0	0	0	111.2	F43	F43-A51 HydrophobicContact CD1-CB 4.01Å; F43-A51 HydrophobicContact CE1-CB 3.71Å
52	C	87.3	Confident	86.7	Confident	15 Å²	15	65.7 Å²	65.7	10%	0.101	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-67.2	160.1	168.9	-60.1	0	0	0	0	110.7	G42 M56 C61	G42-C52 WeakPolarHBondContact O-CB 3.48Å; G42-C52 PolarHBondContact O-N 2.87Å; C52-M56 HydrophobicContact CB-CB 4.23Å; C52-M56 WeakPolarHBondContact CB-O 3.31Å; C52-C61 WeakPolarHBondContact CA-SG 3.27Å; C52-C61 HydrophobicContact CB-CB 3.66Å; C52-C61 WeakPolarHBondContact CB-SG 3.14Å; C52-C61 WeakPolarHBondContact SG-CB 3.47Å; C52-C61 CovalentContact SG-SG 2.01Å; C52-C61 PolarHBondContact SG-SG 2.89Å
53	R	84.3	Confident	86.5	Confident	210 Å²	210	70.3 Å²	70.3	79%	0.792	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-61.2	147.8	164.1	-67.7	-176.8	-174.8	176.2	2.3	109.6	G55 M56	R53-G55 PolarHBondContact O-N 2.92Å; R53-M56 HydrophobicContact CB-CG 4.16Å; R53-M56 HydrophobicContact CB-SD 3.99Å; R53-M56 WeakPolarHBondContact O-CB 3.19Å; R53-M56 PolarHBondContact O-N 2.98Å
54	A	81.6	Confident	86.2	Confident	57 Å²	57	72.9 Å²	72.9	47%	0.471	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	131.3	179.6	0	0	0	0	0	111.1	M56	A54-M56 VanDerWaalsContact C-N 3.32Å
55	G	83.3	Confident	85.9	Confident	15 Å²	15	71.7 Å²	71.7	16%	0.155	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	0.4	-177.4	0	0	0	0	0	115.7	R53 S64 C65	R53-G55 PolarHBondContact O-N 2.92Å; G55-S64 WeakPolarHBondContact O-CA 3.44Å; G55-C65 PolarHBondContact O-N 3.01Å
56	M	88.1	Confident	85.1	Confident	58 Å²	58	80.6 Å²	80.6	29%	0.286	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	147.1	175.6	-53.8	-165.2	81.9	0	0	112.4	C52 R53 A54 C61 E63	C52-M56 HydrophobicContact CB-CB 4.23Å; C52-M56 WeakPolarHBondContact CB-O 3.31Å; R53-M56 HydrophobicContact CB-CG 4.16Å; R53-M56 HydrophobicContact CB-SD 3.99Å; R53-M56 WeakPolarHBondContact O-CB 3.19Å; R53-M56 PolarHBondContact O-N 2.98Å; A54-M56 VanDerWaalsContact C-N 3.32Å; M56-C61 HydrophobicContact CB-CB 4.46Å; M56-C61 WeakPolarHBondContact CE-O 3.46Å; M56-E63 CarbonylContact C-O 3.52Å; M56-E63 WeakPolarHBondContact CA-O 3.17Å
57	F	89.6	Confident	83.7	Confident	34 Å²	34	80.4 Å²	80.4	15%	0.149	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	-176	-179	69.5	-84.4	0	0	0	111.7	P41 C61 Q62 E63 C65 F78	P41-F57 HydrophobicContact CB-CB 4.23Å; F57-C61 CarbonylContact O-C 3.56Å; F57-C61 VanDerWaalsContact O-CA 3.29Å; F57-C61 WeakPolarHBondContact O-CA 3.36Å; F57-Q62 PolarHBondContact O-N 3.29Å; F57-E63 HydrophobicContact CD1-CB 4.17Å; F57-E63 HydrophobicContact CD2-CB 4.03Å; F57-E63 HydrophobicContact CE1-CB 3.88Å; F57-E63 HydrophobicContact CE2-CB 3.7Å; F57-E63 HydrophobicContact CE2-CG 4.39Å; F57-E63 WeakPolarHBondContact CE2-OE2 3.31Å; F57-E63 HydrophobicContact CG-CB 4.24Å; F57-E63 HydrophobicContact CZ-CB 3.62Å; F57-E63 PolarHBondContact N-O 2.87Å; F57-E63 WeakPolarHBondContact O-CB 3.15Å; F57-E63 PolarHBondContact O-N 3.04Å; F57-C65 VanDerWaalsContact CD1-SG 3.53Å; F57-C65 VanDerWaalsContact CE1-SG 3.59Å; F57-F78 AromaticContact CD1-CE1 3.91Å; F57-F78 HydrophobicContact CD1-CE1 3.91Å; F57-F78 HydrophobicContact CD1-CZ 4.09Å; F57-F78 HydrophobicContact CD2-CD1 4.03Å; F57-F78 AromaticContact CD2-CE1 3.6Å; F57-F78 HydrophobicContact CD2-CE1 3.6Å; F57-F78 HydrophobicContact CD2-CZ 4.48Å; F57-F78 AromaticContact CE1-CE1 3.87Å; F57-F78 HydrophobicContact CE1-CE1 3.87Å; F57-F78 HydrophobicContact CE1-CZ 4.21Å; F57-F78 HydrophobicContact CE2-CD1 4.12Å; F57-F78 AromaticContact CE2-CE1 3.57Å; F57-F78 HydrophobicContact CE2-CE1 3.57Å; F57-F78 HydrophobicContact CG-CD1 4.5Å; F57-F78 AromaticContact CG-CE1 3.79Å; F57-F78 HydrophobicContact CG-CE1 3.79Å; F57-F78 HydrophobicContact CG-CZ 4.24Å; F57-F78 AromaticContact CZ-CE1 3.71Å; F57-F78 HydrophobicContact CZ-CE1 3.71Å; F57-F78 HydrophobicContact CZ-CZ 4.48Å
58	G	86.9	Confident	82.1	Confident	20 Å²	20	83.6 Å²	83.6	21%	0.206	42%	0.421	C	S	.	.	S	Bend	trans	92.4	172.2	-177.7	0	0	0	0	0	112.9	N60 C61	G58-N60 PolarHBondContact O-N 2.89Å; G58-C61 PolarHBondContact O-N 3.37Å
59	R	79.9	Confident	80.2	Confident	203 Å²	203	90.8 Å²	90.8	77%	0.766	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.5	-170	-165.2	177.3	-169.9	179.5	5.3	114.3
60	N	83.2	Confident	78.7	Confident	103 Å²	103	92.2 Å²	92.2	55%	0.551	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	21.1	179.1	-65.9	-32.6	0	0	0	112.9	G58 Q62	G58-N60 PolarHBondContact O-N 2.89Å; N60-Q62 HydrophobicContact CB-CG 4.07Å; N60-Q62 PolarHBondContact O-N 3.34Å
61	C	88.3	Confident	77.9	Confident	13 Å²	13	93 Å²	93	9%	0.088	48%	0.477	C	S	.	.	S	Bend	trans	53.1	33.8	-174.6	-54.3	0	0	0	0	114.2	M44 C52 M56 F57 G58	M44-C61 WeakPolarHBondContact CG-SG 3.5Å; M44-C61 HydrophobicContact SD-CB 3.99Å; M44-C61 PolarHBondContact SD-SG 3.05Å; C52-C61 WeakPolarHBondContact CA-SG 3.27Å; C52-C61 HydrophobicContact CB-CB 3.66Å; C52-C61 WeakPolarHBondContact CB-SG 3.14Å; C52-C61 WeakPolarHBondContact SG-CB 3.47Å; C52-C61 CovalentContact SG-SG 2.01Å; C52-C61 PolarHBondContact SG-SG 2.89Å; M56-C61 HydrophobicContact CB-CB 4.46Å; M56-C61 WeakPolarHBondContact CE-O 3.46Å; F57-C61 CarbonylContact O-C 3.56Å; F57-C61 VanDerWaalsContact O-CA 3.29Å; F57-C61 WeakPolarHBondContact O-CA 3.36Å; G58-C61 PolarHBondContact O-N 3.37Å
62	Q	86.1	Confident	77.5	Confident	156 Å²	156	94.5 Å²	94.5	73%	0.729	48%	0.479	S	S	*	.			trans	-96	-16.4	-176.8	-71.1	-177.2	-16.9	0	0	113.2	F57 N60	F57-Q62 PolarHBondContact O-N 3.29Å; N60-Q62 HydrophobicContact CB-CG 4.07Å; N60-Q62 PolarHBondContact O-N 3.34Å
63	E	86.9	Confident	77.5	Confident	108 Å²	108	94.1 Å²	94.1	51%	0.505	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	145.5	177.4	-61.8	173.1	-125.8	0	0	109.4	M56 F57	M56-E63 CarbonylContact C-O 3.52Å; M56-E63 WeakPolarHBondContact CA-O 3.17Å; F57-E63 HydrophobicContact CD1-CB 4.17Å; F57-E63 HydrophobicContact CD2-CB 4.03Å; F57-E63 HydrophobicContact CE1-CB 3.88Å; F57-E63 HydrophobicContact CE2-CB 3.7Å; F57-E63 HydrophobicContact CE2-CG 4.39Å; F57-E63 WeakPolarHBondContact CE2-OE2 3.31Å; F57-E63 HydrophobicContact CG-CB 4.24Å; F57-E63 HydrophobicContact CZ-CB 3.62Å; F57-E63 PolarHBondContact N-O 2.87Å; F57-E63 WeakPolarHBondContact O-CB 3.15Å; F57-E63 PolarHBondContact O-N 3.04Å
64	S	86.4	Confident	77.7	Confident	56 Å²	56	87.1 Å²	87.1	39%	0.392	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139	179.8	66.9	0	0	0	0	110.4	G55 R66	G55-S64 WeakPolarHBondContact O-CA 3.44Å; S64-R66 VanDerWaalsContact C-N 3.32Å; S64-R66 PolarHBondContact O-N 2.81Å
65	C	82.3	Confident	78.1	Confident	32 Å²	32	89.9 Å²	89.9	22%	0.216	46%	0.456	C	S	.	.			trans	-69	88.7	171.5	-62.6	0	0	0	0	109.3	G55 F57 C73 I76	G55-C65 PolarHBondContact O-N 3.01Å; F57-C65 VanDerWaalsContact CD1-SG 3.53Å; F57-C65 VanDerWaalsContact CE1-SG 3.59Å; C65-C73 HydrophobicContact CB-CB 3.92Å; C65-C73 WeakPolarHBondContact CB-SG 3.34Å; C65-C73 WeakPolarHBondContact SG-CB 3.47Å; C65-C73 CovalentContact SG-SG 2.02Å; C65-C73 PolarHBondContact SG-SG 3.14Å; C65-I76 HydrophobicContact CB-CD1 4.18Å
66	R	67.1	Low	78.3	Confident	220 Å²	220	91.9 Å²	91.9	83%	0.83	46%	0.462	S	S	*	.			trans	-104.9	110.3	178.7	-100.4	-175.2	172.7	-178.7	-1.4	110.7	S64	S64-R66 VanDerWaalsContact C-N 3.32Å; S64-R66 PolarHBondContact O-N 2.81Å
67	T	55.3	Low	78.4	Confident	113 Å²	113	95 Å²	95	69%	0.693	47%	0.47	S	S	*	.	S	Bend	trans	-163.9	116.9	155.5	23.6	0	0	0	0	107.6	H69	T67-H69 PolarHBondContact O-N 2.91Å
68	D	53.8	Low	78.6	Confident	161 Å²	161	94.5 Å²	94.5	86%	0.861	47%	0.468	S	S	*	.	S	Bend	trans	27.7	-6.4	165.8	-74.8	-25.4	0	0	0	124.7
69	H	51.1	Low	78.8	Confident	152 Å²	152	97.8 Å²	97.8	70%	0.704	49%	0.487	S	S	*	.	S	Bend	trans	-140.2	134.6	168.4	-64.3	-59.9	0	0	0	110.2	T67 N71	T67-H69 PolarHBondContact O-N 2.91Å; H69-N71 PolarHBondContact O-N 3.45Å
70	S	57	Low	79.4	Confident	116 Å²	116	90.2 Å²	90.2	81%	0.811	46%	0.462	S	S	*	.			trans	-63.5	59.1	-179.4	55.2	0	0	0	0	113.9
71	N	69.5	Low	79.7	Confident	77 Å²	77	89.7 Å²	89.7	41%	0.412	46%	0.464	S	S	.	.			trans	-108.2	18.4	-166.9	-79.1	-3.3	0	0	0	114.5	H69 C73 K74 W92	H69-N71 PolarHBondContact O-N 3.45Å; N71-C73 VanDerWaalsContact C-N 3.28Å; N71-C73 PolarHBondContact O-N 3.24Å; N71-C73 VanDerWaalsContact O-N 3.09Å; N71-K74 HydrophobicContact CB-CB 3.96Å; N71-K74 WeakPolarHBondContact O-CB 3.16Å; N71-K74 PolarHBondContact O-N 3.42Å; N71-W92 WeakPolarHBondContact O-CZ2 3.41Å
72	N	80.3	Confident	79.7	Confident	65 Å²	65	92.2 Å²	92.2	35%	0.348	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	45.1	169.9	-67.5	-29.6	0	0	0	114.3	K74 W92 F125	N72-K74 VanDerWaalsContact C-N 3.34Å; N72-K74 PolarHBondContact O-N 2.93Å; N72-W92 PolarHBondContact O-NE1 2.94Å; N72-F125 HydrophobicContact CB-CE1 4.18Å; N72-F125 HydrophobicContact CB-CZ 4.17Å
73	C	87	Confident	79.9	Confident	8 Å²	8	85.4 Å²	85.4	5%	0.054	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	17.6	-177.7	-42.9	0	0	0	0	116.6	C65 N71 I76 F78 A89	C65-C73 HydrophobicContact CB-CB 3.92Å; C65-C73 WeakPolarHBondContact CB-SG 3.34Å; C65-C73 WeakPolarHBondContact SG-CB 3.47Å; C65-C73 CovalentContact SG-SG 2.02Å; C65-C73 PolarHBondContact SG-SG 3.14Å; N71-C73 VanDerWaalsContact C-N 3.28Å; N71-C73 PolarHBondContact O-N 3.24Å; N71-C73 VanDerWaalsContact O-N 3.09Å; C73-I76 PolarHBondContact O-N 3.1Å; C73-F78 HydrophobicContact CB-CE2 4.07Å; C73-F78 HydrophobicContact CB-CZ 4.24Å; C73-A89 HydrophobicContact CB-CB 3.62Å
74	K	88.6	Confident	80.2	Confident	63 Å²	63	81.8 Å²	81.8	27%	0.274	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	146.1	167.9	-168.1	-173.1	178.5	-133.2	0	110.2	N71 N72 I76 W92 E98	N71-K74 HydrophobicContact CB-CB 3.96Å; N71-K74 WeakPolarHBondContact O-CB 3.16Å; N71-K74 PolarHBondContact O-N 3.42Å; N72-K74 VanDerWaalsContact C-N 3.34Å; N72-K74 PolarHBondContact O-N 2.93Å; K74-I76 PolarHBondContact O-N 3.11Å; K74-I76 VanDerWaalsContact O-N 3.16Å; K74-W92 HydrophobicContact CB-CD2 4.03Å; K74-W92 HydrophobicContact CB-CE3 4.17Å; K74-W92 HydrophobicContact CB-CH2 3.81Å; K74-W92 HydrophobicContact CB-CZ2 3.64Å; K74-W92 HydrophobicContact CB-CZ3 4.08Å; K74-W92 HydrophobicContact CD-CE3 4.41Å; K74-W92 HydrophobicContact CD-CH2 3.75Å; K74-W92 HydrophobicContact CD-CZ2 4.44Å; K74-W92 HydrophobicContact CD-CZ3 3.74Å; K74-W92 HydrophobicContact CG-CD2 4.1Å; K74-W92 HydrophobicContact CG-CE3 3.74Å; K74-W92 HydrophobicContact CG-CH2 3.75Å; K74-W92 HydrophobicContact CG-CZ2 4.09Å; K74-W92 HydrophobicContact CG-CZ3 3.57Å; K74-E98 WeakPolarHBondContact CE-O 3.16Å
75	E	88.8	Confident	80.6	Confident	115 Å²	115	79.5 Å²	79.5	54%	0.537	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	7.4	176.9	-74	159.7	-140.9	0	0	115.1	H96 C97 E98	E75-H96 CarbonylContact C-O 3.55Å; E75-H96 VanDerWaalsContact C-O 3.3Å; E75-H96 WeakPolarHBondContact CA-O 3.13Å; E75-C97 PolarHBondContact N-O 3.27Å; E75-E98 HydrophobicContact CG-CB 4.09Å
76	I	88.5	Confident	81.1	Confident	57 Å²	57	80 Å²	80	29%	0.292	42%	0.416	S	S	.	.			trans	-111.7	126	-180	-57.7	176.7	0	0	0	109.8	C65 C73 K74 F78 C97	C65-I76 HydrophobicContact CB-CD1 4.18Å; C73-I76 PolarHBondContact O-N 3.1Å; K74-I76 PolarHBondContact O-N 3.11Å; K74-I76 VanDerWaalsContact O-N 3.16Å; I76-F78 HydrophobicContact CB-CE2 4.06Å; I76-F78 HydrophobicContact CB-CZ 4.3Å; I76-F78 HydrophobicContact CG2-CD2 4.21Å; I76-F78 HydrophobicContact CG2-CE1 4.16Å; I76-F78 HydrophobicContact CG2-CE2 3.59Å; I76-F78 HydrophobicContact CG2-CZ 3.56Å; I76-C97 PolarHBondContact O-SG 2.85Å
77	R	90.9	Very high	82.4	Confident	122 Å²	122	69.7 Å²	69.7	46%	0.46	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.4	173.2	-167.8	176.6	-171.7	105.8	13.8	109.8	C86 R95	R77-C86 PolarHBondContact NH2-O 3.37Å; R77-R95 PolarHBondContact NH1-O 3.18Å
78	F	91.9	Very high	84.2	Confident	24 Å²	24	64.3 Å²	64.3	11%	0.105	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	144.4	178.8	-65.1	-90.6	0	0	0	110.2	P41 F57 C73 I76 C86 S87 A89	P41-F78 HydrophobicContact CB-CB 4.15Å; P41-F78 HydrophobicContact CB-CD1 4.22Å; P41-F78 HydrophobicContact CB-CD2 3.79Å; P41-F78 HydrophobicContact CB-CE2 4.31Å; P41-F78 HydrophobicContact CB-CG 3.76Å; P41-F78 HydrophobicContact CG-CB 3.89Å; P41-F78 HydrophobicContact CG-CD2 3.9Å; P41-F78 HydrophobicContact CG-CG 3.95Å; F57-F78 AromaticContact CD1-CE1 3.91Å; F57-F78 HydrophobicContact CD1-CE1 3.91Å; F57-F78 HydrophobicContact CD1-CZ 4.09Å; F57-F78 HydrophobicContact CD2-CD1 4.03Å; F57-F78 AromaticContact CD2-CE1 3.6Å; F57-F78 HydrophobicContact CD2-CE1 3.6Å; F57-F78 HydrophobicContact CD2-CZ 4.48Å; F57-F78 AromaticContact CE1-CE1 3.87Å; F57-F78 HydrophobicContact CE1-CE1 3.87Å; F57-F78 HydrophobicContact CE1-CZ 4.21Å; F57-F78 HydrophobicContact CE2-CD1 4.12Å; F57-F78 AromaticContact CE2-CE1 3.57Å; F57-F78 HydrophobicContact CE2-CE1 3.57Å; F57-F78 HydrophobicContact CG-CD1 4.5Å; F57-F78 AromaticContact CG-CE1 3.79Å; F57-F78 HydrophobicContact CG-CE1 3.79Å; F57-F78 HydrophobicContact CG-CZ 4.24Å; F57-F78 AromaticContact CZ-CE1 3.71Å; F57-F78 HydrophobicContact CZ-CE1 3.71Å; F57-F78 HydrophobicContact CZ-CZ 4.48Å; C73-F78 HydrophobicContact CB-CE2 4.07Å; C73-F78 HydrophobicContact CB-CZ 4.24Å; I76-F78 HydrophobicContact CB-CE2 4.06Å; I76-F78 HydrophobicContact CB-CZ 4.3Å; I76-F78 HydrophobicContact CG2-CD2 4.21Å; I76-F78 HydrophobicContact CG2-CE1 4.16Å; I76-F78 HydrophobicContact CG2-CE2 3.59Å; I76-F78 HydrophobicContact CG2-CZ 3.56Å; F78-C86 CarbonylContact O-C 3.5Å; F78-C86 WeakPolarHBondContact O-CA 3.39Å; F78-C86 VanDerWaalsContact O-CB 3.24Å; F78-C86 WeakPolarHBondContact O-CB 3.46Å; F78-S87 PolarHBondContact N-O 2.81Å; F78-S87 PolarHBondContact O-N 2.87Å; F78-A89 HydrophobicContact CD2-CB 4.21Å; F78-A89 HydrophobicContact CE2-CB 3.81Å
79	C	92.4	Very high	86	Confident	89 Å²	89	56.9 Å²	56.9	60%	0.601	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.4	168.8	-70.5	0	0	0	0	108.1	G85 C86	C79-G85 WeakPolarHBondContact CA-O 3.21Å; C79-C86 HydrophobicContact CB-CB 4.06Å; C79-C86 WeakPolarHBondContact CB-SG 3.48Å; C79-C86 WeakPolarHBondContact SG-CB 3.39Å; C79-C86 CovalentContact SG-SG 2.04Å; C79-C86 PolarHBondContact SG-SG 3.33Å
80	L	92.3	Very high	88	Confident	45 Å²	45	49.9 Å²	49.9	24%	0.236	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	164	177.9	-61.9	178.6	0	0	0	109.5	V38 C39 Y84 G85	V38-L80 HydrophobicContact CG1-CB 4.22Å; V38-L80 HydrophobicContact CG1-CD1 4.29Å; C39-L80 WeakPolarHBondContact O-CD1 3.43Å; L80-Y84 HydrophobicContact CB-CD1 3.64Å; L80-Y84 HydrophobicContact CB-CE1 4.41Å; L80-Y84 HydrophobicContact CB-CG 4.02Å; L80-Y84 HydrophobicContact CD1-CD1 3.62Å; L80-Y84 HydrophobicContact CD1-CD2 4.23Å; L80-Y84 HydrophobicContact CD1-CE1 3.73Å; L80-Y84 HydrophobicContact CD1-CE2 4.35Å; L80-Y84 HydrophobicContact CD1-CG 3.9Å; L80-Y84 HydrophobicContact CG-CD1 3.92Å; L80-Y84 HydrophobicContact CG-CE1 4.22Å; L80-Y84 HydrophobicContact CG-CG 4.48Å; L80-G85 PolarHBondContact N-O 3.04Å
81	P	89.3	Confident	89.7	Confident	92 Å²	92	44.4 Å²	44.4	60%	0.597	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	146.4	175.5	-27.2	36	0	0	0	112.4	Y84	P81-Y84 WeakPolarHBondContact O-CB 3.4Å; P81-Y84 PolarHBondContact O-N 2.98Å
82	D	88.8	Confident	90.8	Very high	66 Å²	66	41.9 Å²	41.9	35%	0.353	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	138.1	167.5	-66.1	7.8	0	0	0	107.6	R2 I4	R2-D82 IonicContact CZ-OD1 3.69Å; R2-D82 IonicContact CZ-OD2 2.71Å; R2-D82 IonicContact NH1-OD1 2.69Å; R2-D82 PolarHBondContact NH1-OD1 3.04Å; R2-D82 VanDerWaalsContact NH2-CG 3.33Å; R2-D82 IonicContact NH2-OD1 2.72Å; R2-D82 PolarHBondContact NH2-OD1 2.97Å; R2-D82 VanDerWaalsContact NH2-OD1 3.09Å; R2-D82 IonicContact NH2-OD2 3.41Å; R2-D82 PolarHBondContact NH2-OD2 2.93Å; I4-D82 WeakPolarHBondContact CD1-OD1 3.29Å; I4-D82 HydrophobicContact CG2-CB 4.42Å
83	P	90.8	Very high	91.4	Very high	13 Å²	13	42 Å²	42	8%	0.084	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.6	11.4	16.8	35.9	-36.9	0	0	0	116.3	R6 V29	R6-P83 HydrophobicContact CG-CB 3.61Å; R6-P83 HydrophobicContact CG-CG 4.43Å; V29-P83 HydrophobicContact CG1-CB 4.31Å; V29-P83 HydrophobicContact CG1-CG 3.94Å
84	Y	92.8	Very high	91.6	Very high	32 Å²	32	42.8 Å²	42.8	13%	0.125	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-49.3	-174.7	-178.3	-83.7	0	0	0	113.7	V29 V38 P40 L80 P81 S87 P108	V29-Y84 HydrophobicContact CB-CD2 4.27Å; V29-Y84 HydrophobicContact CG2-CD2 3.79Å; V29-Y84 HydrophobicContact CG2-CE2 4.41Å; V38-Y84 HydrophobicContact CG1-CD2 4.38Å; V38-Y84 HydrophobicContact CG1-CG 4.19Å; P40-Y84 HydrophobicContact CB-CE2 3.87Å; P40-Y84 VanDerWaalsContact CB-OH 3.24Å; P40-Y84 WeakPolarHBondContact CB-OH 3.19Å; L80-Y84 HydrophobicContact CB-CD1 3.64Å; L80-Y84 HydrophobicContact CB-CE1 4.41Å; L80-Y84 HydrophobicContact CB-CG 4.02Å; L80-Y84 HydrophobicContact CD1-CD1 3.62Å; L80-Y84 HydrophobicContact CD1-CD2 4.23Å; L80-Y84 HydrophobicContact CD1-CE1 3.73Å; L80-Y84 HydrophobicContact CD1-CE2 4.35Å; L80-Y84 HydrophobicContact CD1-CG 3.9Å; L80-Y84 HydrophobicContact CG-CD1 3.92Å; L80-Y84 HydrophobicContact CG-CE1 4.22Å; L80-Y84 HydrophobicContact CG-CG 4.48Å; P81-Y84 WeakPolarHBondContact O-CB 3.4Å; P81-Y84 PolarHBondContact O-N 2.98Å; Y84-S87 WeakPolarHBondContact CE1-OG 3.28Å; Y84-S87 WeakPolarHBondContact OH-CB 3.38Å; Y84-S87 PolarHBondContact OH-OG 2.74Å; Y84-P108 WeakPolarHBondContact OH-CB 3.4Å
85	G	93.5	Very high	91.6	Very high	7 Å²	7	49.3 Å²	49.3	7%	0.072	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87.4	-138.8	-176	0	0	0	0	0	114.1	C79 L80	C79-G85 WeakPolarHBondContact CA-O 3.21Å; L80-G85 PolarHBondContact N-O 3.04Å
86	C	92.9	Very high	91.6	Very high	43 Å²	43	49.5 Å²	49.5	29%	0.291	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.2	-173.5	-50.1	0	0	0	0	113.5	R77 F78 C79	R77-C86 PolarHBondContact NH2-O 3.37Å; F78-C86 CarbonylContact O-C 3.5Å; F78-C86 WeakPolarHBondContact O-CA 3.39Å; F78-C86 VanDerWaalsContact O-CB 3.24Å; F78-C86 WeakPolarHBondContact O-CB 3.46Å; C79-C86 HydrophobicContact CB-CB 4.06Å; C79-C86 WeakPolarHBondContact CB-SG 3.48Å; C79-C86 WeakPolarHBondContact SG-CB 3.39Å; C79-C86 CovalentContact SG-SG 2.04Å; C79-C86 PolarHBondContact SG-SG 3.33Å
87	S	94.4	Very high	91.7	Very high	4 Å²	4	46.8 Å²	46.8	3%	0.028	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	165.6	-178	63	0	0	0	0	112	F78 Y84	F78-S87 PolarHBondContact N-O 2.81Å; F78-S87 PolarHBondContact O-N 2.87Å; Y84-S87 WeakPolarHBondContact CE1-OG 3.28Å; Y84-S87 WeakPolarHBondContact OH-CB 3.38Å; Y84-S87 PolarHBondContact OH-OG 2.74Å
88	C	93.4	Very high	91.7	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	154.3	163.2	-60.2	0	0	0	0	111.2	W92 C97 D109	C88-W92 HydrophobicContact CB-CB 4.27Å; C88-W92 VanDerWaalsContact CB-O 3.23Å; C88-W92 WeakPolarHBondContact CB-O 3.02Å; C88-C97 WeakPolarHBondContact CA-SG 3.28Å; C88-C97 HydrophobicContact CB-CB 3.64Å; C88-C97 WeakPolarHBondContact CB-SG 3.4Å; C88-C97 WeakPolarHBondContact SG-CA 3.24Å; C88-C97 WeakPolarHBondContact SG-CB 3.48Å; C88-C97 CovalentContact SG-SG 2.02Å; C88-C97 PolarHBondContact SG-SG 2.97Å; C88-D109 VanDerWaalsContact CB-OD1 3.3Å; C88-D109 WeakPolarHBondContact CB-OD1 3.28Å; C88-D109 PolarHBondContact N-OD1 2.85Å; C88-D109 PolarHBondContact SG-OD1 2.83Å; C88-D109 VanDerWaalsContact SG-OD1 3.33Å
89	A	92	Very high	91.8	Very high	5 Å²	5	48.2 Å²	48.2	4%	0.041	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-57.2	151.7	168.2	0	0	0	0	0	111.5	P41 C73 F78 G91 W92	P41-A89 HydrophobicContact CB-CB 4.41Å; C73-A89 HydrophobicContact CB-CB 3.62Å; F78-A89 HydrophobicContact CD2-CB 4.21Å; F78-A89 HydrophobicContact CE2-CB 3.81Å; A89-G91 PolarHBondContact O-N 2.88Å; A89-W92 PolarHBondContact O-N 2.97Å; A89-W92 VanDerWaalsContact O-N 3.12Å
90	S	93	Very high	91.7	Very high	5 Å²	5	46 Å²	46	4%	0.035	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	135	172.9	-169.9	0	0	0	0	110.7	P41 F43 G107 F125	P41-S90 PolarHBondContact O-N 3.38Å; P41-S90 VanDerWaalsContact O-N 3.13Å; F43-S90 WeakPolarHBondContact CE2-OG 3.24Å; S90-G107 WeakPolarHBondContact CA-O 3.12Å; S90-G107 WeakPolarHBondContact OG-CA 3.3Å; S90-G107 PolarHBondContact OG-N 2.8Å; S90-F125 WeakPolarHBondContact CB-O 3.33Å; S90-F125 WeakPolarHBondContact O-CD1 3.04Å; S90-F125 PolarHBondContact OG-O 3.17Å
91	G	91.8	Very high	91.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	-4.6	-177.9	0	0	0	0	0	115.3	A89 C101 R124	A89-G91 PolarHBondContact O-N 2.88Å; G91-C101 WeakPolarHBondContact CA-SG 3.45Å; G91-C101 PolarHBondContact O-N 3.34Å; G91-C101 VanDerWaalsContact O-N 3.15Å; G91-R124 WeakPolarHBondContact CA-O 3.39Å; G91-R124 PolarHBondContact N-O 3.38Å; G91-R124 VanDerWaalsContact O-CZ 3.32Å; G91-R124 PolarHBondContact O-NE 2.98Å; G91-R124 VanDerWaalsContact O-NE 3.09Å; G91-R124 PolarHBondContact O-NH2 3.26Å
92	W	92.9	Very high	91.9	Very high	24 Å²	24	44.4 Å²	44.4	9%	0.091	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.2	179.8	-56.4	102.6	0	0	0	112.8	N71 N72 K74 C88 A89 C97 K99 A100 D109 C110 R124 F125	N71-W92 WeakPolarHBondContact O-CZ2 3.41Å; N72-W92 PolarHBondContact O-NE1 2.94Å; K74-W92 HydrophobicContact CB-CD2 4.03Å; K74-W92 HydrophobicContact CB-CE3 4.17Å; K74-W92 HydrophobicContact CB-CH2 3.81Å; K74-W92 HydrophobicContact CB-CZ2 3.64Å; K74-W92 HydrophobicContact CB-CZ3 4.08Å; K74-W92 HydrophobicContact CD-CE3 4.41Å; K74-W92 HydrophobicContact CD-CH2 3.75Å; K74-W92 HydrophobicContact CD-CZ2 4.44Å; K74-W92 HydrophobicContact CD-CZ3 3.74Å; K74-W92 HydrophobicContact CG-CD2 4.1Å; K74-W92 HydrophobicContact CG-CE3 3.74Å; K74-W92 HydrophobicContact CG-CH2 3.75Å; K74-W92 HydrophobicContact CG-CZ2 4.09Å; K74-W92 HydrophobicContact CG-CZ3 3.57Å; C88-W92 HydrophobicContact CB-CB 4.27Å; C88-W92 VanDerWaalsContact CB-O 3.23Å; C88-W92 WeakPolarHBondContact CB-O 3.02Å; A89-W92 PolarHBondContact O-N 2.97Å; A89-W92 VanDerWaalsContact O-N 3.12Å; W92-C97 HydrophobicContact CB-CB 4.33Å; W92-K99 CarbonylContact C-O 3.53Å; W92-K99 WeakPolarHBondContact CA-O 3.17Å; W92-A100 HydrophobicContact CE3-CB 4.33Å; W92-A100 HydrophobicContact CZ3-CB 3.99Å; W92-D109 WeakPolarHBondContact O-CA 3.42Å; W92-C110 VanDerWaalsContact C-SG 3.53Å; W92-R124 VanDerWaalsContact CD2-NH2 3.35Å; W92-R124 VanDerWaalsContact CE3-NH2 3.33Å; W92-F125 HydrophobicContact CZ2-CZ 4.45Å; W92-F125 AromaticContact NE1-CE1 3.77Å
93	F	93.9	Very high	91.8	Very high	69 Å²	69	48.4 Å²	48.4	30%	0.303	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	173.1	173.2	81.1	-74.7	0	0	0	111	C97 E98 K99 A100 D109 C110	F93-C97 CarbonylContact O-C 3.57Å; F93-E98 PolarHBondContact O-N 2.89Å; F93-K99 HydrophobicContact CD1-CB 3.75Å; F93-K99 WeakPolarHBondContact CD1-O 3.36Å; F93-K99 HydrophobicContact CE1-CB 3.44Å; F93-K99 VanDerWaalsContact CE1-CB 3.44Å; F93-K99 HydrophobicContact CE1-CD 4.42Å; F93-K99 HydrophobicContact CE2-CB 4.36Å; F93-K99 HydrophobicContact CE2-CD 4.08Å; F93-K99 HydrophobicContact CG-CB 4.34Å; F93-K99 HydrophobicContact CZ-CB 3.78Å; F93-K99 HydrophobicContact CZ-CD 3.87Å; F93-K99 HydrophobicContact CZ-CG 4.46Å; F93-K99 PolarHBondContact N-O 3.12Å; F93-K99 WeakPolarHBondContact O-CB 3.25Å; F93-K99 PolarHBondContact O-N 3.48Å; F93-A100 WeakPolarHBondContact CE1-O 3.27Å; F93-D109 WeakPolarHBondContact CB-O 3.27Å; F93-C110 HydrophobicContact CB-CB 4.12Å; F93-C110 HydrophobicContact CD1-CB 4.35Å; F93-C110 HydrophobicContact CG-CB 4.42Å
94	G	91.8	Very high	91.7	Very high	24 Å²	24	52.8 Å²	52.8	25%	0.247	27%	0.27	C	S	.	.	S	Bend	trans	116.6	172.4	-176.2	0	0	0	0	0	111.7	H96 C97	G94-H96 PolarHBondContact O-N 2.99Å; G94-C97 PolarHBondContact O-N 2.71Å
95	R	88	Confident	91.8	Very high	200 Å²	200	52.4 Å²	52.4	76%	0.755	27%	0.271	S	S	*	.	S	Bend	trans	-65.5	-34.6	-178.3	-173.3	178.6	-179	-179.8	-1.2	111.1	R77 E98	R77-R95 PolarHBondContact NH1-O 3.18Å; R95-E98 PolarHBondContact N-OE2 3.27Å
96	H	88.1	Confident	91.8	Very high	119 Å²	119	52.3 Å²	52.3	55%	0.551	27%	0.268	S	S	*	.	S	Bend	trans	-112.7	10.9	-179.9	-59.9	-74	0	0	0	112.1	E75 G94 E98	E75-H96 CarbonylContact C-O 3.55Å; E75-H96 VanDerWaalsContact C-O 3.3Å; E75-H96 WeakPolarHBondContact CA-O 3.13Å; G94-H96 PolarHBondContact O-N 2.99Å; H96-E98 VanDerWaalsContact C-N 3.29Å; H96-E98 VanDerWaalsContact CA-OE2 3.27Å; H96-E98 WeakPolarHBondContact CA-OE2 3.37Å; H96-E98 WeakPolarHBondContact CB-OE2 3.3Å; H96-E98 PolarHBondContact N-OE2 2.8Å; H96-E98 PolarHBondContact O-N 2.91Å
97	C	91.8	Very high	91.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.	S	Bend	trans	63.9	32.2	-177	-46.8	0	0	0	0	113.8	E75 I76 C88 W92 F93 G94	E75-C97 PolarHBondContact N-O 3.27Å; I76-C97 PolarHBondContact O-SG 2.85Å; C88-C97 WeakPolarHBondContact CA-SG 3.28Å; C88-C97 HydrophobicContact CB-CB 3.64Å; C88-C97 WeakPolarHBondContact CB-SG 3.4Å; C88-C97 WeakPolarHBondContact SG-CA 3.24Å; C88-C97 WeakPolarHBondContact SG-CB 3.48Å; C88-C97 CovalentContact SG-SG 2.02Å; C88-C97 PolarHBondContact SG-SG 2.97Å; W92-C97 HydrophobicContact CB-CB 4.33Å; F93-C97 CarbonylContact O-C 3.57Å; G94-C97 PolarHBondContact O-N 2.71Å
98	E	90.4	Very high	91.7	Very high	64 Å²	64	50.5 Å²	50.5	30%	0.299	26%	0.256	S	S	.	.			trans	-87.8	-16.5	-173.4	72.2	-72.2	173.4	0	0	114.1	K74 E75 F93 R95 H96	K74-E98 WeakPolarHBondContact CE-O 3.16Å; E75-E98 HydrophobicContact CG-CB 4.09Å; F93-E98 PolarHBondContact O-N 2.89Å; R95-E98 PolarHBondContact N-OE2 3.27Å; H96-E98 VanDerWaalsContact C-N 3.29Å; H96-E98 VanDerWaalsContact CA-OE2 3.27Å; H96-E98 WeakPolarHBondContact CA-OE2 3.37Å; H96-E98 WeakPolarHBondContact CB-OE2 3.3Å; H96-E98 PolarHBondContact N-OE2 2.8Å; H96-E98 PolarHBondContact O-N 2.91Å
99	K	93.1	Very high	91.7	Very high	112 Å²	112	51.7 Å²	51.7	49%	0.487	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.1	-174.4	-55.4	-175.3	-176.5	179.7	0	111.5	W92 F93	W92-K99 CarbonylContact C-O 3.53Å; W92-K99 WeakPolarHBondContact CA-O 3.17Å; F93-K99 HydrophobicContact CD1-CB 3.75Å; F93-K99 WeakPolarHBondContact CD1-O 3.36Å; F93-K99 HydrophobicContact CE1-CB 3.44Å; F93-K99 VanDerWaalsContact CE1-CB 3.44Å; F93-K99 HydrophobicContact CE1-CD 4.42Å; F93-K99 HydrophobicContact CE2-CB 4.36Å; F93-K99 HydrophobicContact CE2-CD 4.08Å; F93-K99 HydrophobicContact CG-CB 4.34Å; F93-K99 HydrophobicContact CZ-CB 3.78Å; F93-K99 HydrophobicContact CZ-CD 3.87Å; F93-K99 HydrophobicContact CZ-CG 4.46Å; F93-K99 PolarHBondContact N-O 3.12Å; F93-K99 WeakPolarHBondContact O-CB 3.25Å; F93-K99 PolarHBondContact O-N 3.48Å
100	A	91.9	Very high	91.8	Very high	41 Å²	41	52.2 Å²	52.2	34%	0.339	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	144.5	173.5	0	0	0	0	0	111.3	W92 F93 V102	W92-A100 HydrophobicContact CE3-CB 4.33Å; W92-A100 HydrophobicContact CZ3-CB 3.99Å; F93-A100 WeakPolarHBondContact CE1-O 3.27Å; A100-V102 PolarHBondContact O-N 2.83Å
101	C	92.8	Very high	91.8	Very high	12 Å²	12	60.9 Å²	60.9	8%	0.081	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-52.5	141.6	173.5	-59.7	0	0	0	0	112.4	G91 T105 C110 R124	G91-C101 WeakPolarHBondContact CA-SG 3.45Å; G91-C101 PolarHBondContact O-N 3.34Å; G91-C101 VanDerWaalsContact O-N 3.15Å; C101-T105 WeakPolarHBondContact CB-O 3.19Å; C101-C110 WeakPolarHBondContact CA-SG 3.29Å; C101-C110 HydrophobicContact CB-CB 3.72Å; C101-C110 WeakPolarHBondContact CB-SG 3.41Å; C101-C110 WeakPolarHBondContact SG-CB 3.49Å; C101-C110 CovalentContact SG-SG 2.01Å; C101-C110 PolarHBondContact SG-SG 3.03Å; C101-R124 HydrophobicContact CB-CB 3.9Å
102	V	91.7	Very high	91.9	Very high	93 Å²	93	62.8 Å²	62.8	56%	0.564	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-68.6	159.6	171	-65.6	0	0	0	0	110.2	A100 D104 T105	A100-V102 PolarHBondContact O-N 2.83Å; V102-D104 PolarHBondContact O-N 2.76Å; V102-T105 HydrophobicContact CG2-CG2 3.82Å; V102-T105 VanDerWaalsContact CG2-OG1 3.32Å; V102-T105 WeakPolarHBondContact CG2-OG1 3.39Å; V102-T105 PolarHBondContact N-OG1 3.03Å; V102-T105 PolarHBondContact O-N 2.92Å; V102-T105 VanDerWaalsContact O-N 3.15Å; V102-T105 PolarHBondContact O-OG1 3.19Å
103	N	87.5	Confident	91.8	Very high	150 Å²	150	65.4 Å²	65.4	80%	0.802	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	141.5	178.7	-67.1	-4.5	0	0	0	110.9	T105	N103-T105 PolarHBondContact O-N 2.88Å
104	D	88.9	Confident	91.7	Very high	105 Å²	105	63 Å²	63	56%	0.561	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	15.4	-178.7	-53.8	-47.6	0	0	0	116.5	V102 S113 C114 C122	V102-D104 PolarHBondContact O-N 2.76Å; D104-S113 WeakPolarHBondContact O-CA 3.36Å; D104-C114 PolarHBondContact O-N 2.86Å; D104-C122 VanDerWaalsContact CA-SG 3.58Å
105	T	93.6	Very high	91.7	Very high	23 Å²	23	69 Å²	69	14%	0.141	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	148.3	171.9	64.4	0	0	0	0	112.7	C101 V102 N103 L112	C101-T105 WeakPolarHBondContact CB-O 3.19Å; V102-T105 HydrophobicContact CG2-CG2 3.82Å; V102-T105 VanDerWaalsContact CG2-OG1 3.32Å; V102-T105 WeakPolarHBondContact CG2-OG1 3.39Å; V102-T105 PolarHBondContact N-OG1 3.03Å; V102-T105 PolarHBondContact O-N 2.92Å; V102-T105 VanDerWaalsContact O-N 3.15Å; V102-T105 PolarHBondContact O-OG1 3.19Å; N103-T105 PolarHBondContact O-N 2.88Å; T105-L112 CarbonylContact C-O 3.58Å; T105-L112 WeakPolarHBondContact CA-O 3.07Å; T105-L112 WeakPolarHBondContact CB-O 3.19Å
106	Y	93.1	Very high	91.8	Very high	5 Å²	5	61.2 Å²	61.2	2%	0.02	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	-178.6	-178.1	79.3	-75.2	0	0	0	111.3	N26 F43 C110 L112 C114 R124 Q137	N26-Y106 WeakPolarHBondContact OD1-CE2 3.26Å; N26-Y106 PolarHBondContact OD1-OH 3.23Å; F43-Y106 HydrophobicContact CZ-CD2 4.14Å; F43-Y106 HydrophobicContact CZ-CE2 4.25Å; Y106-C110 CarbonylContact O-C 3.52Å; Y106-L112 HydrophobicContact CD1-CB 3.85Å; Y106-L112 HydrophobicContact CD2-CD1 4.38Å; Y106-L112 HydrophobicContact CE1-CB 3.65Å; Y106-L112 HydrophobicContact CE2-CB 4.38Å; Y106-L112 HydrophobicContact CE2-CD1 3.9Å; Y106-L112 HydrophobicContact CG-CB 4.31Å; Y106-L112 PolarHBondContact N-O 2.85Å; Y106-L112 WeakPolarHBondContact O-CA 3.09Å; Y106-L112 VanDerWaalsContact O-CB 3.28Å; Y106-L112 WeakPolarHBondContact O-CB 3.49Å; Y106-L112 PolarHBondContact O-N 2.74Å; Y106-C114 VanDerWaalsContact CD1-SG 3.56Å; Y106-R124 WeakPolarHBondContact CA-O 3.39Å; Y106-R124 WeakPolarHBondContact CB-O 3.41Å; Y106-Q137 PolarHBondContact OH-NE2 3.08Å
107	G	92.6	Very high	91.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	83.8	-178.8	176.1	0	0	0	0	0	113.8	S90 D109 C110	S90-G107 WeakPolarHBondContact CA-O 3.12Å; S90-G107 WeakPolarHBondContact OG-CA 3.3Å; S90-G107 PolarHBondContact OG-N 2.8Å; G107-D109 PolarHBondContact O-N 3.39Å; G107-C110 PolarHBondContact O-N 2.93Å
108	P	93.4	Very high	91.5	Very high	9 Å²	9	63.1 Å²	63.1	6%	0.058	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-62	133.8	-177.2	27.2	-35.2	0	0	0	110.8	N26 P40 Y84 C110 R111	N26-P108 WeakPolarHBondContact O-CD 3.35Å; P40-P108 HydrophobicContact CB-CB 4Å; P40-P108 HydrophobicContact CB-CG 3.81Å; P40-P108 HydrophobicContact CG-CG 4.22Å; Y84-P108 WeakPolarHBondContact OH-CB 3.4Å; P108-C110 PolarHBondContact O-N 2.84Å; P108-R111 PolarHBondContact O-N 2.8Å
109	D	94.3	Very high	91.3	Very high	25 Å²	25	68.6 Å²	68.6	13%	0.134	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	52.9	20.5	-173.2	-61.1	-29	0	0	0	114.3	C88 W92 F93 G107 R111	C88-D109 VanDerWaalsContact CB-OD1 3.3Å; C88-D109 WeakPolarHBondContact CB-OD1 3.28Å; C88-D109 PolarHBondContact N-OD1 2.85Å; C88-D109 PolarHBondContact SG-OD1 2.83Å; C88-D109 VanDerWaalsContact SG-OD1 3.33Å; W92-D109 WeakPolarHBondContact O-CA 3.42Å; F93-D109 WeakPolarHBondContact CB-O 3.27Å; G107-D109 PolarHBondContact O-N 3.39Å; D109-R111 HydrophobicContact CB-CG 3.93Å; D109-R111 PolarHBondContact O-N 2.77Å; D109-R111 IonicContact OD2-CZ 2.67Å; D109-R111 IonicContact OD2-NE 3.11Å; D109-R111 PolarHBondContact OD2-NE 3.48Å; D109-R111 IonicContact OD2-NH2 2.94Å; D109-R111 PolarHBondContact OD2-NH2 3.19Å
110	C	93.3	Very high	90.9	Very high	17 Å²	17	64 Å²	64	12%	0.115	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	56	31.8	-175.6	-50.3	0	0	0	0	114.5	W92 F93 C101 Y106 G107 P108 L112	W92-C110 VanDerWaalsContact C-SG 3.53Å; F93-C110 HydrophobicContact CB-CB 4.12Å; F93-C110 HydrophobicContact CD1-CB 4.35Å; F93-C110 HydrophobicContact CG-CB 4.42Å; C101-C110 WeakPolarHBondContact CA-SG 3.29Å; C101-C110 HydrophobicContact CB-CB 3.72Å; C101-C110 WeakPolarHBondContact CB-SG 3.41Å; C101-C110 WeakPolarHBondContact SG-CB 3.49Å; C101-C110 CovalentContact SG-SG 2.01Å; C101-C110 PolarHBondContact SG-SG 3.03Å; Y106-C110 CarbonylContact O-C 3.52Å; G107-C110 PolarHBondContact O-N 2.93Å; P108-C110 PolarHBondContact O-N 2.84Å; C110-L112 VanDerWaalsContact C-N 3.34Å
111	R	93.4	Very high	90.9	Very high	186 Å²	186	66.5 Å²	66.5	70%	0.702	35%	0.348	S	S	*	.			trans	-83.1	-6.9	-175.4	-64.4	-178.2	-166.5	-176.2	9.3	114.6	P108 D109	P108-R111 PolarHBondContact O-N 2.8Å; D109-R111 HydrophobicContact CB-CG 3.93Å; D109-R111 PolarHBondContact O-N 2.77Å; D109-R111 IonicContact OD2-CZ 2.67Å; D109-R111 IonicContact OD2-NE 3.11Å; D109-R111 PolarHBondContact OD2-NE 3.48Å; D109-R111 IonicContact OD2-NH2 2.94Å; D109-R111 PolarHBondContact OD2-NH2 3.19Å
112	L	92.9	Very high	90.9	Very high	41 Å²	41	67.5 Å²	67.5	22%	0.215	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	143.4	-179.4	-50.1	177.2	0	0	0	110	N26 T105 Y106 C110	N26-L112 HydrophobicContact CB-CD1 4.41Å; T105-L112 CarbonylContact C-O 3.58Å; T105-L112 WeakPolarHBondContact CA-O 3.07Å; T105-L112 WeakPolarHBondContact CB-O 3.19Å; Y106-L112 HydrophobicContact CD1-CB 3.85Å; Y106-L112 HydrophobicContact CD2-CD1 4.38Å; Y106-L112 HydrophobicContact CE1-CB 3.65Å; Y106-L112 HydrophobicContact CE2-CB 4.38Å; Y106-L112 HydrophobicContact CE2-CD1 3.9Å; Y106-L112 HydrophobicContact CG-CB 4.31Å; Y106-L112 PolarHBondContact N-O 2.85Å; Y106-L112 WeakPolarHBondContact O-CA 3.09Å; Y106-L112 VanDerWaalsContact O-CB 3.28Å; Y106-L112 WeakPolarHBondContact O-CB 3.49Å; Y106-L112 PolarHBondContact O-N 2.74Å; C110-L112 VanDerWaalsContact C-N 3.34Å
113	S	92.1	Very high	90.9	Very high	78 Å²	78	65.1 Å²	65.1	55%	0.545	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.9	175.2	-52.7	0	0	0	0	110.2	D104	D104-S113 WeakPolarHBondContact O-CA 3.36Å
114	C	91.2	Very high	91	Very high	18 Å²	18	61.1 Å²	61.1	12%	0.122	31%	0.313	C	S	.	.			trans	-69.1	131.9	172.6	-78.4	0	0	0	0	110.4	D104 Y106 C122	D104-C114 PolarHBondContact O-N 2.86Å; Y106-C114 VanDerWaalsContact CD1-SG 3.56Å; C114-C122 HydrophobicContact CB-CB 3.42Å; C114-C122 VanDerWaalsContact CB-CB 3.42Å; C114-C122 WeakPolarHBondContact CB-SG 3.49Å; C114-C122 WeakPolarHBondContact SG-CB 3.11Å; C114-C122 CovalentContact SG-SG 2.02Å; C114-C122 PolarHBondContact SG-SG 2.97Å
115	K	91.6	Very high	91.1	Very high	150 Å²	150	58.1 Å²	58.1	65%	0.652	30%	0.295	S	S	*	.			trans	-123.9	46.3	174	-65.5	-174.6	178.7	-178.2	0	110.5	Q117 N138	K115-Q117 PolarHBondContact O-N 3.45Å; K115-N138 VanDerWaalsContact O-CB 3.28Å; K115-N138 WeakPolarHBondContact O-CB 3.42Å
116	C	90.1	Very high	90.9	Very high	37 Å²	37	58.7 Å²	58.7	25%	0.25	30%	0.299	C	S	.	.			trans	-66.3	132.5	-171	-45.7	0	0	0	0	111.2	G120 C128	C116-G120 WeakPolarHBondContact CB-O 3.09Å; C116-C128 WeakPolarHBondContact CA-SG 3.47Å; C116-C128 HydrophobicContact CB-CB 3.8Å; C116-C128 WeakPolarHBondContact CB-SG 3.48Å; C116-C128 PolarHBondContact N-SG 2.78Å; C116-C128 WeakPolarHBondContact SG-CA 3.33Å; C116-C128 WeakPolarHBondContact SG-CB 3.41Å; C116-C128 CovalentContact SG-SG 2.03Å; C116-C128 PolarHBondContact SG-SG 2.88Å
117	Q	88.4	Confident	90.8	Very high	96 Å²	96	58.5 Å²	58.5	45%	0.449	30%	0.299	S	S	.	.			trans	-105.8	170.2	175.1	-57.1	-179.1	14.8	0	0	109.4	K115 E119 G120 N138 C139	K115-Q117 PolarHBondContact O-N 3.45Å; Q117-E119 VanDerWaalsContact C-N 3.32Å; Q117-E119 PolarHBondContact O-N 3.48Å; Q117-G120 PolarHBondContact O-N 3.18Å; Q117-N138 WeakPolarHBondContact CB-O 3.48Å; Q117-N138 PolarHBondContact N-O 2.81Å; Q117-C139 WeakPolarHBondContact O-CB 3.28Å
118	N	85.3	Confident	90.7	Very high	63 Å²	63	59.3 Å²	59.3	34%	0.337	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	48.8	171.1	-53.2	-54	0	0	0	113.2	G120 P131 W134 C139	N118-G120 PolarHBondContact O-N 2.73Å; N118-G120 VanDerWaalsContact O-N 3.16Å; N118-P131 WeakPolarHBondContact O-CG 3.22Å; N118-W134 HydrophobicContact CB-CD2 3.82Å; N118-W134 HydrophobicContact CB-CE3 4.18Å; N118-W134 HydrophobicContact CB-CG 4.17Å; N118-W134 HydrophobicContact CB-CH2 4.49Å; N118-W134 HydrophobicContact CB-CZ2 4.16Å; N118-W134 WeakPolarHBondContact ND2-CZ3 3.29Å; N118-C139 PolarHBondContact ND2-O 2.94Å
119	E	85.8	Confident	90.4	Very high	180 Å²	180	63.4 Å²	63.4	84%	0.841	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	17.9	179.4	-55	176.5	-169.5	0	0	115	Q117	Q117-E119 VanDerWaalsContact C-N 3.32Å; Q117-E119 PolarHBondContact O-N 3.48Å
120	G	86.2	Confident	90	Very high	15 Å²	15	64.3 Å²	64.3	16%	0.155	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-61.8	135.6	172.2	0	0	0	0	0	112.2	C116 Q117 N118 Q129	C116-G120 WeakPolarHBondContact CB-O 3.09Å; Q117-G120 PolarHBondContact O-N 3.18Å; N118-G120 PolarHBondContact O-N 2.73Å; N118-G120 VanDerWaalsContact O-N 3.16Å; G120-Q129 VanDerWaalsContact CA-O 3.31Å; G120-Q129 WeakPolarHBondContact CA-O 3.48Å
121	V	91.3	Very high	89.4	Confident	94 Å²	94	65.7 Å²	65.7	57%	0.57	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.6	-178	-179	0	0	0	0	109.9	N123 Q129	V121-N123 PolarHBondContact O-N 3.32Å; V121-Q129 PolarHBondContact N-O 2.78Å; V121-Q129 PolarHBondContact O-N 2.88Å
122	C	91.6	Very high	88.7	Confident	32 Å²	32	64 Å²	64	22%	0.216	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	123.9	176.3	-177.7	0	0	0	0	111.4	D104 C114	D104-C122 VanDerWaalsContact CA-SG 3.58Å; C114-C122 HydrophobicContact CB-CB 3.42Å; C114-C122 VanDerWaalsContact CB-CB 3.42Å; C114-C122 WeakPolarHBondContact CB-SG 3.49Å; C114-C122 WeakPolarHBondContact SG-CB 3.11Å; C114-C122 CovalentContact SG-SG 2.02Å; C114-C122 PolarHBondContact SG-SG 2.97Å
123	N	91.7	Very high	87.7	Confident	43 Å²	43	63.5 Å²	63.5	23%	0.23	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.1	171.5	-174.1	-69.1	0	0	0	110.1	V121 F125 S126 G127 Q129	V121-N123 PolarHBondContact O-N 3.32Å; N123-F125 PolarHBondContact O-N 2.67Å; N123-F125 WeakPolarHBondContact OD1-CB 3.3Å; N123-F125 PolarHBondContact OD1-N 2.84Å; N123-S126 WeakPolarHBondContact CB-OG 3.27Å; N123-S126 PolarHBondContact O-N 2.91Å; N123-S126 PolarHBondContact OD1-N 2.98Å; N123-G127 PolarHBondContact N-O 2.73Å; N123-G127 WeakPolarHBondContact O-CA 3.39Å; N123-G127 PolarHBondContact O-N 3.23Å; N123-Q129 HydrophobicContact CB-CG 3.86Å; N123-Q129 PolarHBondContact ND2-NE2 2.96Å; N123-Q129 VanDerWaalsContact ND2-NE2 3.18Å
124	R	90.4	Very high	87.1	Confident	67 Å²	67	64 Å²	64	25%	0.253	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-24.5	-179.7	59.1	-179	-89.4	-152.4	-5.1	115.2	G91 W92 C101 Y106	G91-R124 WeakPolarHBondContact CA-O 3.39Å; G91-R124 PolarHBondContact N-O 3.38Å; G91-R124 VanDerWaalsContact O-CZ 3.32Å; G91-R124 PolarHBondContact O-NE 2.98Å; G91-R124 VanDerWaalsContact O-NE 3.09Å; G91-R124 PolarHBondContact O-NH2 3.26Å; W92-R124 VanDerWaalsContact CD2-NH2 3.35Å; W92-R124 VanDerWaalsContact CE3-NH2 3.33Å; C101-R124 HydrophobicContact CB-CB 3.9Å; Y106-R124 WeakPolarHBondContact CA-O 3.39Å; Y106-R124 WeakPolarHBondContact CB-O 3.41Å
125	F	91.1	Very high	86.4	Confident	42 Å²	42	67.4 Å²	67.4	18%	0.184	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-41.4	179.2	-61.6	-74.3	0	0	0	112.6	F43 N72 S90 W92 N123	F43-F125 WeakPolarHBondContact CZ-O 3.43Å; N72-F125 HydrophobicContact CB-CE1 4.18Å; N72-F125 HydrophobicContact CB-CZ 4.17Å; S90-F125 WeakPolarHBondContact CB-O 3.33Å; S90-F125 WeakPolarHBondContact O-CD1 3.04Å; S90-F125 PolarHBondContact OG-O 3.17Å; W92-F125 HydrophobicContact CZ2-CZ 4.45Å; W92-F125 AromaticContact NE1-CE1 3.77Å; N123-F125 PolarHBondContact O-N 2.67Å; N123-F125 WeakPolarHBondContact OD1-CB 3.3Å; N123-F125 PolarHBondContact OD1-N 2.84Å
126	S	88.8	Confident	85.7	Confident	34 Å²	34	61.8 Å²	61.8	24%	0.238	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-6.5	-169.2	63.4	0	0	0	0	115.8	N123 Q129	N123-S126 WeakPolarHBondContact CB-OG 3.27Å; N123-S126 PolarHBondContact O-N 2.91Å; N123-S126 PolarHBondContact OD1-N 2.98Å; S126-Q129 PolarHBondContact OG-NE2 2.96Å
127	G	90.9	Very high	85.2	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.2	-141.5	-169.9	0	0	0	0	0	111.7	N123 Q129	N123-G127 PolarHBondContact N-O 2.73Å; N123-G127 WeakPolarHBondContact O-CA 3.39Å; N123-G127 PolarHBondContact O-N 3.23Å; G127-Q129 PolarHBondContact O-N 2.78Å
128	C	90.3	Very high	85.1	Confident	17 Å²	17	61 Å²	61	12%	0.115	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	123	-177.2	-64.1	0	0	0	0	112.6	C116 Q137	C116-C128 WeakPolarHBondContact CA-SG 3.47Å; C116-C128 HydrophobicContact CB-CB 3.8Å; C116-C128 WeakPolarHBondContact CB-SG 3.48Å; C116-C128 PolarHBondContact N-SG 2.78Å; C116-C128 WeakPolarHBondContact SG-CA 3.33Å; C116-C128 WeakPolarHBondContact SG-CB 3.41Å; C116-C128 CovalentContact SG-SG 2.03Å; C116-C128 PolarHBondContact SG-SG 2.88Å; C128-Q137 WeakPolarHBondContact CB-O 3.41Å
129	Q	88.6	Confident	85.1	Confident	95 Å²	95	58 Å²	58	44%	0.444	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	111.2	170.2	-65.5	-175.3	-22.8	0	0	108.8	G120 V121 N123 S126 G127	G120-Q129 VanDerWaalsContact CA-O 3.31Å; G120-Q129 WeakPolarHBondContact CA-O 3.48Å; V121-Q129 PolarHBondContact N-O 2.78Å; V121-Q129 PolarHBondContact O-N 2.88Å; N123-Q129 HydrophobicContact CB-CG 3.86Å; N123-Q129 PolarHBondContact ND2-NE2 2.96Å; N123-Q129 VanDerWaalsContact ND2-NE2 3.18Å; S126-Q129 PolarHBondContact OG-NE2 2.96Å; G127-Q129 PolarHBondContact O-N 2.78Å
130	C	85.1	Confident	84.9	Confident	44 Å²	44	52.6 Å²	52.6	30%	0.297	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-84.9	140	-173.4	-52.7	0	0	0	0	112.3	W134 C139	C130-W134 HydrophobicContact CB-CB 4.17Å; C130-W134 WeakPolarHBondContact CB-O 3.22Å; C130-C139 WeakPolarHBondContact CA-SG 3.22Å; C130-C139 HydrophobicContact CB-CB 3.7Å; C130-C139 WeakPolarHBondContact CB-SG 3.36Å; C130-C139 WeakPolarHBondContact SG-CA 3.31Å; C130-C139 WeakPolarHBondContact SG-CB 3.41Å; C130-C139 CovalentContact SG-SG 2.04Å; C130-C139 PolarHBondContact SG-SG 2.93Å
131	P	81.4	Confident	84.4	Confident	46 Å²	46	56.7 Å²	56.7	30%	0.299	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-68.2	162.2	172.2	26.6	-30.7	0	0	0	111.5	N118 G133 W134	N118-P131 WeakPolarHBondContact O-CG 3.22Å; P131-G133 PolarHBondContact O-N 2.86Å; P131-W134 PolarHBondContact O-N 3.1Å
132	T	77.7	Confident	83.7	Confident	152 Å²	152	54.9 Å²	54.9	93%	0.933	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	126.3	-179.8	-50.1	0	0	0	0	111.3
133	G	71.8	Confident	82.9	Confident	29 Å²	29	56 Å²	56	30%	0.299	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	5	-178.4	0	0	0	0	0	115	P131 S142 E143	P131-G133 PolarHBondContact O-N 2.86Å; G133-S142 CarbonylContact O-C 3.48Å; G133-S142 WeakPolarHBondContact O-CA 3.46Å; G133-E143 PolarHBondContact O-N 2.8Å
134	W	79.9	Confident	82.4	Confident	90 Å²	90	62.7 Å²	62.7	34%	0.341	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	146.2	174.9	-66	92.9	0	0	0	112.3	N118 C130 P131 C139 K141	N118-W134 HydrophobicContact CB-CD2 3.82Å; N118-W134 HydrophobicContact CB-CE3 4.18Å; N118-W134 HydrophobicContact CB-CG 4.17Å; N118-W134 HydrophobicContact CB-CH2 4.49Å; N118-W134 HydrophobicContact CB-CZ2 4.16Å; N118-W134 WeakPolarHBondContact ND2-CZ3 3.29Å; C130-W134 HydrophobicContact CB-CB 4.17Å; C130-W134 WeakPolarHBondContact CB-O 3.22Å; P131-W134 PolarHBondContact O-N 3.1Å; W134-C139 HydrophobicContact CB-CB 4.42Å; W134-K141 CarbonylContact C-O 3.56Å; W134-K141 WeakPolarHBondContact CA-O 3.13Å; W134-K141 VanDerWaalsContact CE3-C 3.47Å
135	R	76.8	Confident	82	Confident	88 Å²	88	61.8 Å²	61.8	33%	0.332	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	171.9	177.9	75.9	-178.2	-175.3	120.2	-6.1	111.5	C139 E140 K141 E143	R135-C139 CarbonylContact O-C 3.3Å; R135-E140 PolarHBondContact O-N 2.8Å; R135-K141 HydrophobicContact CG-CB 3.83Å; R135-K141 PolarHBondContact N-O 3.19Å; R135-K141 WeakPolarHBondContact O-CB 3.4Å; R135-K141 PolarHBondContact O-N 2.7Å; R135-E143 HydrophobicContact CB-CG 4.29Å; R135-E143 WeakPolarHBondContact CD-OE1 3.34Å; R135-E143 HydrophobicContact CG-CG 4.02Å
136	G	75.9	Confident	81.9	Confident	33 Å²	33	60 Å²	60	34%	0.34	32%	0.321	S	S	.	.	S	Bend	trans	113.8	169	179.6	0	0	0	0	0	111.4	N138 C139 E140	G136-N138 PolarHBondContact O-N 2.93Å; G136-C139 PolarHBondContact O-N 2.83Å; G136-E140 WeakPolarHBondContact CA-OE1 3.3Å; G136-E140 WeakPolarHBondContact CA-OE2 3.44Å
137	Q	80.9	Confident	82.1	Confident	78 Å²	78	63.8 Å²	63.8	36%	0.364	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.8	-177.3	-173.3	178.5	13.2	0	0	111.8	Y106 C128 E140	Y106-Q137 PolarHBondContact OH-NE2 3.08Å; C128-Q137 WeakPolarHBondContact CB-O 3.41Å; Q137-E140 PolarHBondContact N-OE2 2.91Å
138	N	85.9	Confident	82.1	Confident	37 Å²	37	63.7 Å²	63.7	20%	0.198	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	16.9	-177.4	-65.2	-33.9	0	0	0	111.7	K115 Q117 G136 E140	K115-N138 VanDerWaalsContact O-CB 3.28Å; K115-N138 WeakPolarHBondContact O-CB 3.42Å; Q117-N138 WeakPolarHBondContact CB-O 3.48Å; Q117-N138 PolarHBondContact N-O 2.81Å; G136-N138 PolarHBondContact O-N 2.93Å; N138-E140 VanDerWaalsContact C-N 3.26Å; N138-E140 VanDerWaalsContact C-OE2 3.3Å; N138-E140 WeakPolarHBondContact CA-OE2 3.31Å; N138-E140 WeakPolarHBondContact CB-OE2 3.42Å; N138-E140 PolarHBondContact N-OE2 2.96Å; N138-E140 PolarHBondContact O-N 3.23Å
139	C	84.7	Confident	82.1	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	60.6	32.1	-175.4	-48.2	0	0	0	0	114.3	Q117 N118 C130 W134 R135 G136	Q117-C139 WeakPolarHBondContact O-CB 3.28Å; N118-C139 PolarHBondContact ND2-O 2.94Å; C130-C139 WeakPolarHBondContact CA-SG 3.22Å; C130-C139 HydrophobicContact CB-CB 3.7Å; C130-C139 WeakPolarHBondContact CB-SG 3.36Å; C130-C139 WeakPolarHBondContact SG-CA 3.31Å; C130-C139 WeakPolarHBondContact SG-CB 3.41Å; C130-C139 CovalentContact SG-SG 2.04Å; C130-C139 PolarHBondContact SG-SG 2.93Å; W134-C139 HydrophobicContact CB-CB 4.42Å; R135-C139 CarbonylContact O-C 3.3Å; G136-C139 PolarHBondContact O-N 2.83Å
140	E	82.8	Confident	82	Confident	67 Å²	67	65.2 Å²	65.2	31%	0.313	34%	0.341	S	S	.	.			trans	-85.9	-8.1	-172	73.3	-70.8	168	0	0	114.8	R135 G136 Q137 N138	R135-E140 PolarHBondContact O-N 2.8Å; G136-E140 WeakPolarHBondContact CA-OE1 3.3Å; G136-E140 WeakPolarHBondContact CA-OE2 3.44Å; Q137-E140 PolarHBondContact N-OE2 2.91Å; N138-E140 VanDerWaalsContact C-N 3.26Å; N138-E140 VanDerWaalsContact C-OE2 3.3Å; N138-E140 WeakPolarHBondContact CA-OE2 3.31Å; N138-E140 WeakPolarHBondContact CB-OE2 3.42Å; N138-E140 PolarHBondContact N-OE2 2.96Å; N138-E140 PolarHBondContact O-N 3.23Å
141	K	76	Confident	82	Confident	102 Å²	102	64.1 Å²	64.1	44%	0.443	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.5	-175.2	-56.7	-179.9	-175.9	174.8	0	111.2	W134 R135	W134-K141 CarbonylContact C-O 3.56Å; W134-K141 WeakPolarHBondContact CA-O 3.13Å; W134-K141 VanDerWaalsContact CE3-C 3.47Å; R135-K141 HydrophobicContact CG-CB 3.83Å; R135-K141 PolarHBondContact N-O 3.19Å; R135-K141 WeakPolarHBondContact O-CB 3.4Å; R135-K141 PolarHBondContact O-N 2.7Å
142	S	75.8	Confident	81.8	Confident	55 Å²	55	64.9 Å²	64.9	39%	0.385	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	145.2	173.9	58.7	0	0	0	0	112	G133 N172	G133-S142 CarbonylContact O-C 3.48Å; G133-S142 WeakPolarHBondContact O-CA 3.46Å; S142-N172 VanDerWaalsContact O-CG 3.31Å; S142-N172 PolarHBondContact O-ND2 2.81Å
143	E	74.2	Confident	81.4	Confident	55 Å²	55	61.8 Å²	61.8	26%	0.257	32%	0.317	S	S	.	.			trans	-108.8	132.4	172.3	-71.3	-167.2	146.2	0	0	110.3	G133 R135 N172	G133-E143 PolarHBondContact O-N 2.8Å; R135-E143 HydrophobicContact CB-CG 4.29Å; R135-E143 WeakPolarHBondContact CD-OE1 3.34Å; R135-E143 HydrophobicContact CG-CG 4.02Å; E143-N172 CarbonylContact C-O 3.56Å; E143-N172 VanDerWaalsContact CA-O 3.28Å; E143-N172 WeakPolarHBondContact CA-O 3.46Å
144	R	81.1	Confident	81.2	Confident	184 Å²	184	66.3 Å²	66.3	69%	0.694	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.1	175.1	-169.2	-174.7	-57.2	-178.3	3	108.8	N172	R144-N172 HydrophobicContact CB-CB 4.01Å; R144-N172 PolarHBondContact N-O 2.83Å; R144-N172 PolarHBondContact O-N 2.91Å; R144-N172 VanDerWaalsContact O-O 3.13Å
145	A	83	Confident	81.3	Confident	48 Å²	48	63.7 Å²	63.7	40%	0.397	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.4	144	173.1	0	0	0	0	0	110.9	G227	A145-G227 VanDerWaalsContact CA-O 3.22Å; A145-G227 WeakPolarHBondContact CA-O 3.02Å; A145-G227 WeakPolarHBondContact CB-O 3.38Å; A145-G227 PolarHBondContact N-O 2.86Å
146	P	89.3	Confident	81.7	Confident	6 Å²	6	64 Å²	64	4%	0.039	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	152.9	176.9	30.3	-32.7	0	0	0	110.2	T170 P175 V223 T225 G228 D230	P146-T170 CarbonylContact C-O 3.55Å; P146-T170 WeakPolarHBondContact CA-O 3.38Å; P146-T170 WeakPolarHBondContact CB-O 3.45Å; P146-P175 HydrophobicContact CB-CG 4.23Å; P146-V223 HydrophobicContact CB-CB 4.39Å; P146-V223 HydrophobicContact CB-CG1 3.84Å; P146-V223 HydrophobicContact CG-CG1 4.25Å; P146-V223 WeakPolarHBondContact CG-O 3.48Å; P146-T225 HydrophobicContact CB-CG2 3.98Å; P146-T225 WeakPolarHBondContact CD-OG1 3.33Å; P146-T225 HydrophobicContact CG-CG2 4.09Å; P146-G228 VanDerWaalsContact CD-O 3.26Å; P146-G228 WeakPolarHBondContact CD-O 3.23Å; P146-G228 WeakPolarHBondContact CG-O 3.34Å; P146-D230 WeakPolarHBondContact O-CB 3.47Å
147	Q	91.4	Very high	82.3	Confident	112 Å²	112	62.8 Å²	62.8	52%	0.523	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	124.7	174.6	-174.8	-179.5	10	0	0	109.2	L149 A169 T170 D230	Q147-L149 PolarHBondContact O-N 3.2Å; Q147-A169 CarbonylContact O-C 3.52Å; Q147-A169 WeakPolarHBondContact O-CA 3.49Å; Q147-A169 WeakPolarHBondContact O-CB 3.29Å; Q147-T170 HydrophobicContact CB-CG2 4.11Å; Q147-T170 PolarHBondContact N-O 3.42Å; Q147-T170 PolarHBondContact O-N 2.82Å; Q147-D230 WeakPolarHBondContact CA-OD2 3.41Å
148	I	91.9	Very high	82.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	122.9	174.6	-61.1	171.9	0	0	0	107.8	L151 A169 C221 V223 D230 R232	I148-L151 HydrophobicContact CG2-CB 4.37Å; I148-A169 HydrophobicContact CG1-CB 4.35Å; I148-C221 WeakPolarHBondContact CD1-O 3.35Å; I148-V223 HydrophobicContact CD1-CG2 4.05Å; I148-V223 HydrophobicContact CG1-CB 4.37Å; I148-V223 HydrophobicContact CG1-CG2 3.75Å; I148-D230 HydrophobicContact CG1-CB 4.4Å; I148-D230 PolarHBondContact N-OD2 3.21Å; I148-R232 HydrophobicContact CB-CG 4.22Å; I148-R232 HydrophobicContact CD1-CB 4.13Å; I148-R232 HydrophobicContact CD1-CG 4.19Å; I148-R232 HydrophobicContact CG2-CG 4.26Å; I148-R232 PolarHBondContact O-NE 2.84Å; I148-R232 PolarHBondContact O-NH1 2.98Å; I148-R232 PolarHBondContact O-NH2 2.83Å
149	L	89.3	Confident	82.9	Confident	64 Å²	64	59.6 Å²	59.6	34%	0.335	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-56	-178.9	-59.7	178	0	0	0	110	Q147 S168 T170 R201 R232	Q147-L149 PolarHBondContact O-N 3.2Å; L149-S168 PolarHBondContact N-O 3.44Å; L149-T170 HydrophobicContact CD1-CG2 4.32Å; L149-T170 HydrophobicContact CD2-CG2 4.07Å; L149-T170 HydrophobicContact CG-CG2 4.31Å; L149-R201 HydrophobicContact CD1-CB 4.26Å; L149-R232 PolarHBondContact O-NH1 3.14Å
150	E	86.4	Confident	83	Confident	80 Å²	80	65.4 Å²	65.4	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.1	-174.9	-65	163.6	-160.6	0	0	109.5	K166 S168 R201	E150-K166 IonicContact OE2-NZ 3.42Å; E150-K166 PolarHBondContact OE2-NZ 3.23Å; E150-S168 PolarHBondContact N-O 3.34Å; E150-S168 PolarHBondContact O-N 2.85Å; E150-S168 PolarHBondContact OE2-OG 3.11Å; E150-R201 IonicContact OE1-CZ 3.09Å; E150-R201 IonicContact OE1-NH1 3.58Å; E150-R201 PolarHBondContact OE1-NH1 2.85Å; E150-R201 IonicContact OE2-NH1 2.68Å
151	L	86.4	Confident	83.2	Confident	20 Å²	20	62.5 Å²	62.5	11%	0.105	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	134.7	172	179.2	62.5	0	0	0	107.4	I148 C153 V165 C167 C221 R232 F234	I148-L151 HydrophobicContact CG2-CB 4.37Å; L151-C153 PolarHBondContact O-N 3.08Å; L151-V165 HydrophobicContact CD1-CG1 4.35Å; L151-C167 HydrophobicContact CD1-CB 4.03Å; L151-C221 HydrophobicContact CD1-CB 3.64Å; L151-C221 HydrophobicContact CD2-CB 4.04Å; L151-R232 HydrophobicContact CD2-CB 3.56Å; L151-F234 HydrophobicContact CD1-CD1 4.28Å; L151-F234 HydrophobicContact CD1-CE1 4.25Å; L151-F234 HydrophobicContact CD2-CD1 3.8Å; L151-F234 HydrophobicContact CD2-CE1 4.46Å; L151-F234 HydrophobicContact CD2-CG 4.49Å; L151-F234 HydrophobicContact CG-CD1 4.19Å
152	D	76	Confident	83.7	Confident	62 Å²	62	59.6 Å²	59.6	33%	0.332	32%	0.315	S	S	.	.			trans	-62.8	119.7	173.7	-59.4	-36.1	0	0	0	109.3	K166	D152-K166 PolarHBondContact OD2-N 2.84Å
153	C	70.5	Confident	84.2	Confident	88 Å²	88	57.6 Å²	57.6	60%	0.595	30%	0.3	S	S	*	.			trans	-104.2	151.4	-179.4	-67.7	0	0	0	0	111.3	L151 L155	L151-C153 PolarHBondContact O-N 3.08Å; C153-L155 PolarHBondContact O-N 2.83Å
154	D	66.2	Low	84.9	Confident	124 Å²	124	60.9 Å²	60.9	66%	0.663	31%	0.314	S	S	*	.	S	Bend	trans	52.4	52.3	173.5	-57.7	-41	0	0	0	114.7	E156	D154-E156 PolarHBondContact O-N 3.16Å
155	L	82.4	Confident	85.3	Confident	35 Å²	35	52.2 Å²	52.2	18%	0.183	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	112.1	-174.1	-167.4	74.4	0	0	0	111	C153 C157 P163 V165 N235 V236 T237	C153-L155 PolarHBondContact O-N 2.83Å; L155-C157 WeakPolarHBondContact CD2-SG 3.18Å; L155-C157 WeakPolarHBondContact CG-SG 3.22Å; L155-P163 HydrophobicContact CD2-CB 4.25Å; L155-P163 HydrophobicContact CD2-CG 4.42Å; L155-V165 HydrophobicContact CD2-CG2 4.01Å; L155-N235 PolarHBondContact N-O 2.84Å; L155-V236 HydrophobicContact CB-CG2 4.39Å; L155-V236 HydrophobicContact CD2-CG2 4.46Å; L155-V236 CarbonylContact O-C 2.94Å; L155-V236 WeakPolarHBondContact O-CA 3.29Å; L155-T237 PolarHBondContact O-N 3.14Å
156	E	86.5	Confident	85.7	Confident	94 Å²	94	53.9 Å²	53.9	44%	0.439	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119	170.6	-167.4	177.4	106.1	0	0	110.1	D154 T237 K239 R319	D154-E156 PolarHBondContact O-N 3.16Å; E156-T237 WeakPolarHBondContact CA-O 3.29Å; E156-K239 HydrophobicContact CG-CD 4.35Å; E156-K239 HydrophobicContact CG-CG 3.5Å; E156-K239 WeakPolarHBondContact OE2-CE 3.42Å; E156-K239 IonicContact OE2-NZ 2.7Å; E156-R319 IonicContact OE1-CZ 3.94Å; E156-R319 IonicContact OE1-NH1 3.75Å; E156-R319 IonicContact OE1-NH2 3.37Å; E156-R319 PolarHBondContact OE1-NH2 3.09Å
157	C	88.3	Confident	85.9	Confident	8 Å²	8	53.6 Å²	53.6	5%	0.054	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	152.9	-175.3	-70.3	0	0	0	0	111.8	L155 P163 L211 T237 I238 K239	L155-C157 WeakPolarHBondContact CD2-SG 3.18Å; L155-C157 WeakPolarHBondContact CG-SG 3.22Å; C157-P163 HydrophobicContact CB-CG 4.45Å; C157-L211 HydrophobicContact CB-CD1 3.41Å; C157-L211 VanDerWaalsContact CB-CD1 3.41Å; C157-T237 PolarHBondContact N-O 3.38Å; C157-I238 CarbonylContact O-C 3.53Å; C157-I238 VanDerWaalsContact O-CA 3.31Å; C157-I238 WeakPolarHBondContact O-CA 3.43Å; C157-K239 PolarHBondContact O-N 3.22Å
158	N	90.4	Very high	86	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.011	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	151.8	174.8	-60.7	-61.4	0	0	0	111.6	S161 K239 P241 R319 P320 G321 E322 G323 G324	N158-S161 WeakPolarHBondContact O-CB 3.48Å; N158-S161 PolarHBondContact O-N 3.02Å; N158-S161 PolarHBondContact O-OG 3.03Å; N158-K239 CarbonylContact C-O 3.55Å; N158-K239 WeakPolarHBondContact CA-O 3.23Å; N158-P241 HydrophobicContact CB-CG 4.32Å; N158-R319 WeakPolarHBondContact OD1-CD 3.16Å; N158-R319 VanDerWaalsContact OD1-CG 3.3Å; N158-R319 WeakPolarHBondContact OD1-CG 3.4Å; N158-R319 PolarHBondContact OD1-NH1 3.5Å; N158-P320 PolarHBondContact ND2-O 3.43Å; N158-G321 VanDerWaalsContact ND2-C 3.35Å; N158-G321 PolarHBondContact ND2-O 2.86Å; N158-E322 WeakPolarHBondContact CB-O 3.38Å; N158-E322 PolarHBondContact ND2-O 2.86Å; N158-G323 WeakPolarHBondContact CB-O 3.3Å; N158-G324 VanDerWaalsContact CG-CA 3.48Å; N158-G324 VanDerWaalsContact ND2-CA 3.3Å; N158-G324 WeakPolarHBondContact ND2-CA 3.11Å; N158-G324 PolarHBondContact ND2-N 3.36Å
159	L	88.5	Confident	86.1	Confident	46 Å²	46	48.3 Å²	48.3	24%	0.241	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	139.4	170.8	-168.9	70.9	0	0	0	110.1	S161 A213 I238 K239	L159-S161 PolarHBondContact O-N 2.7Å; L159-A213 HydrophobicContact CD1-CB 4.21Å; L159-I238 HydrophobicContact CB-CG2 4.33Å; L159-I238 HydrophobicContact CD1-CG2 4.12Å; L159-K239 PolarHBondContact N-O 3.49Å
160	N	86.1	Confident	86.2	Confident	121 Å²	121	47.1 Å²	47.1	65%	0.647	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.4	6.7	-176.3	-54.5	-36	0	0	0	115.9	L211	N160-L211 WeakPolarHBondContact CA-O 3.26Å; N160-L211 PolarHBondContact N-O 2.94Å
161	S	87.5	Confident	86.2	Confident	6 Å²	6	43.7 Å²	43.7	4%	0.042	24%	0.235	C	C	.	.			trans	-79.7	158.2	172.6	80.5	0	0	0	0	112	N158 L159 P163 P210 L211 E322	N158-S161 WeakPolarHBondContact O-CB 3.48Å; N158-S161 PolarHBondContact O-N 3.02Å; N158-S161 PolarHBondContact O-OG 3.03Å; L159-S161 PolarHBondContact O-N 2.7Å; S161-P163 VanDerWaalsContact C-CD 3.47Å; S161-P163 VanDerWaalsContact O-CD 3.32Å; S161-P163 WeakPolarHBondContact O-CD 3.05Å; S161-P210 WeakPolarHBondContact O-CA 3.4Å; S161-L211 PolarHBondContact O-N 2.77Å; S161-E322 WeakPolarHBondContact CB-O 3.49Å
162	S	87	Confident	86.1	Confident	42 Å²	42	45.7 Å²	45.7	29%	0.294	25%	0.246	S	C	.	.			trans	-118.5	70.3	179.8	-57.9	0	0	0	0	111.2	I208	S162-I208 CarbonylContact C-O 3.46Å; S162-I208 VanDerWaalsContact CA-O 3.23Å; S162-I208 WeakPolarHBondContact CA-O 3.34Å; S162-I208 WeakPolarHBondContact CB-O 3.44Å
163	P	86.2	Confident	86.4	Confident	12 Å²	12	44.1 Å²	44.1	8%	0.078	24%	0.238	C	C	.	.			trans	-68.3	152.5	-170.5	29.9	-36.5	0	0	0	112.3	L155 C157 S161 I208 L211	L155-P163 HydrophobicContact CD2-CB 4.25Å; L155-P163 HydrophobicContact CD2-CG 4.42Å; C157-P163 HydrophobicContact CB-CG 4.45Å; S161-P163 VanDerWaalsContact C-CD 3.47Å; S161-P163 VanDerWaalsContact O-CD 3.32Å; S161-P163 WeakPolarHBondContact O-CD 3.05Å; P163-I208 HydrophobicContact CG-CB 4.06Å; P163-I208 HydrophobicContact CG-CD1 4.18Å; P163-I208 WeakPolarHBondContact O-CB 3.47Å; P163-I208 PolarHBondContact O-N 2.83Å; P163-L211 HydrophobicContact CG-CD1 3.73Å; P163-L211 HydrophobicContact CG-CG 4.35Å
164	K	88.3	Confident	87.2	Confident	124 Å²	124	41.9 Å²	41.9	54%	0.539	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.6	175.7	-51	-165.9	-173.7	-155.7	0	110.1	F206 E207	K164-F206 CarbonylContact C-O 3.54Å; K164-F206 VanDerWaalsContact CA-O 3.25Å; K164-F206 WeakPolarHBondContact CA-O 3.25Å; K164-E207 HydrophobicContact CD-CG 4.23Å; K164-E207 WeakPolarHBondContact CE-OE1 3.41Å; K164-E207 HydrophobicContact CG-CG 4.23Å; K164-E207 IonicContact NZ-OE1 2.62Å; K164-E207 PolarHBondContact NZ-OE1 2.79Å
165	V	89.7	Confident	88.4	Confident	2 Å²	2	36 Å²	36	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.5	178.8	176.6	0	0	0	0	109.7	L151 L155 L182 F206 I208 F234	L151-V165 HydrophobicContact CD1-CG1 4.35Å; L155-V165 HydrophobicContact CD2-CG2 4.01Å; V165-L182 HydrophobicContact CB-CD2 4.32Å; V165-L182 HydrophobicContact CG1-CD2 4.5Å; V165-F206 HydrophobicContact CB-CB 4.42Å; V165-F206 PolarHBondContact N-O 3.49Å; V165-F206 PolarHBondContact O-N 3.45Å; V165-I208 HydrophobicContact CG2-CD1 3.6Å; V165-I208 HydrophobicContact CG2-CG1 4.38Å; V165-F234 HydrophobicContact CG1-CZ 4.04Å; V165-F234 HydrophobicContact CG2-CZ 4.41Å
166	K	91.9	Very high	88.7	Confident	84 Å²	84	37 Å²	37	37%	0.365	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.1	177.1	-169.1	-171.3	178.3	-159.1	0	110.3	E150 D152 T203	E150-K166 IonicContact OE2-NZ 3.42Å; E150-K166 PolarHBondContact OE2-NZ 3.23Å; D152-K166 PolarHBondContact OD2-N 2.84Å; K166-T203 HydrophobicContact CD-CG2 3.99Å; K166-T203 HydrophobicContact CG-CG2 3.55Å
167	C	93.4	Very high	88.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	117.1	173.2	-170.3	0	0	0	0	109.9	L151 A204 F206 C221	L151-C167 HydrophobicContact CD1-CB 4.03Å; C167-A204 PolarHBondContact N-O 3.16Å; C167-A204 PolarHBondContact O-N 3.3Å; C167-F206 HydrophobicContact CB-CE2 3.96Å; C167-C221 HydrophobicContact CB-CB 4.06Å; C167-C221 WeakPolarHBondContact CB-SG 3.06Å; C167-C221 WeakPolarHBondContact SG-CB 3.4Å; C167-C221 CovalentContact SG-SG 2.05Å; C167-C221 PolarHBondContact SG-SG 2.75Å
168	S	93.7	Very high	88.7	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.5	-178	-48.6	0	0	0	0	110.3	L149 E150 S202 T203	L149-S168 PolarHBondContact N-O 3.44Å; E150-S168 PolarHBondContact N-O 3.34Å; E150-S168 PolarHBondContact O-N 2.85Å; E150-S168 PolarHBondContact OE2-OG 3.11Å; S168-S202 CarbonylContact C-O 3.47Å; S168-S202 WeakPolarHBondContact CA-O 3.47Å; S168-T203 PolarHBondContact OG-OG1 2.98Å
169	A	93.1	Very high	88.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	150.9	178.8	0	0	0	0	0	113.2	Q147 I148 P175 F180 S202 V223	Q147-A169 CarbonylContact O-C 3.52Å; Q147-A169 WeakPolarHBondContact O-CA 3.49Å; Q147-A169 WeakPolarHBondContact O-CB 3.29Å; I148-A169 HydrophobicContact CG1-CB 4.35Å; A169-P175 HydrophobicContact CB-CG 4.17Å; A169-F180 HydrophobicContact CB-CE1 3.78Å; A169-F180 HydrophobicContact CB-CZ 4.01Å; A169-S202 PolarHBondContact N-O 2.83Å; A169-S202 PolarHBondContact O-N 2.78Å; A169-V223 HydrophobicContact CB-CB 4.26Å; A169-V223 HydrophobicContact CB-CG1 3.97Å; A169-V223 HydrophobicContact CB-CG2 3.83Å
170	T	92.4	Very high	88.8	Confident	39 Å²	39	40.1 Å²	40.1	24%	0.239	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	175.6	170.8	-167.9	0	0	0	0	110.3	P146 Q147 L149 N200	P146-T170 CarbonylContact C-O 3.55Å; P146-T170 WeakPolarHBondContact CA-O 3.38Å; P146-T170 WeakPolarHBondContact CB-O 3.45Å; Q147-T170 HydrophobicContact CB-CG2 4.11Å; Q147-T170 PolarHBondContact N-O 3.42Å; Q147-T170 PolarHBondContact O-N 2.82Å; L149-T170 HydrophobicContact CD1-CG2 4.32Å; L149-T170 HydrophobicContact CD2-CG2 4.07Å; L149-T170 HydrophobicContact CG-CG2 4.31Å; T170-N200 WeakPolarHBondContact CB-O 3.43Å; T170-N200 PolarHBondContact OG1-O 2.8Å
171	G	86.8	Confident	89.1	Confident	9 Å²	9	35.9 Å²	35.9	9%	0.093	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.6	166.9	179.4	0	0	0	0	0	112.3	P173 L174	G171-P173 CarbonylContact C-O 3.33Å; G171-P173 VanDerWaalsContact C-O 3.27Å; G171-P173 CarbonylContact O-C 3.46Å; G171-P173 VanDerWaalsContact O-C 3.31Å; G171-L174 WeakPolarHBondContact O-CA 3.45Å; G171-L174 PolarHBondContact O-N 2.86Å
172	N	82.9	Confident	89.3	Confident	62 Å²	62	35.6 Å²	35.6	33%	0.332	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	108	169.9	-169.3	3.8	0	0	0	109.9	S142 E143 R144	S142-N172 VanDerWaalsContact O-CG 3.31Å; S142-N172 PolarHBondContact O-ND2 2.81Å; E143-N172 CarbonylContact C-O 3.56Å; E143-N172 VanDerWaalsContact CA-O 3.28Å; E143-N172 WeakPolarHBondContact CA-O 3.46Å; R144-N172 HydrophobicContact CB-CB 4.01Å; R144-N172 PolarHBondContact N-O 2.83Å; R144-N172 PolarHBondContact O-N 2.91Å; R144-N172 VanDerWaalsContact O-O 3.13Å
173	P	82.2	Confident	89.4	Confident	28 Å²	28	35.8 Å²	35.8	18%	0.182	19%	0.186	C	C	.	.	S	Bend	cis	-66.9	154	2.6	28.7	-34.8	0	0	0	112.9	G171	G171-P173 CarbonylContact C-O 3.33Å; G171-P173 VanDerWaalsContact C-O 3.27Å; G171-P173 CarbonylContact O-C 3.46Å; G171-P173 VanDerWaalsContact O-C 3.31Å
174	L	87.8	Confident	89.1	Confident	41 Å²	41	36.6 Å²	36.6	22%	0.215	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-57.2	137.8	174.7	-131.4	83.7	0	0	0	109.4	G171 S176 Q197 E198 S202	G171-L174 WeakPolarHBondContact O-CA 3.45Å; G171-L174 PolarHBondContact O-N 2.86Å; L174-S176 PolarHBondContact O-N 3.22Å; L174-Q197 HydrophobicContact CD2-CG 3.71Å; L174-E198 VanDerWaalsContact CD2-O 3.24Å; L174-E198 WeakPolarHBondContact CD2-O 3.38Å; L174-S202 WeakPolarHBondContact CD2-OG 3.43Å
175	P	90.9	Very high	88.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-58.2	128.5	-179	-24.9	34.4	0	0	0	112.1	P146 A169 F180 S202 V223 T225	P146-P175 HydrophobicContact CB-CG 4.23Å; A169-P175 HydrophobicContact CB-CG 4.17Å; P175-F180 HydrophobicContact CB-CD2 4.36Å; P175-F180 HydrophobicContact CB-CE2 3.52Å; P175-F180 HydrophobicContact CB-CZ 3.68Å; P175-F180 HydrophobicContact CG-CZ 4.32Å; P175-S202 WeakPolarHBondContact O-CB 3.39Å; P175-S202 PolarHBondContact O-OG 2.94Å; P175-V223 HydrophobicContact CB-CG1 3.76Å; P175-V223 HydrophobicContact CG-CG1 3.76Å; P175-T225 HydrophobicContact CB-CG2 4.01Å; P175-T225 HydrophobicContact CG-CG2 3.91Å
176	S	89.3	Confident	87.6	Confident	58 Å²	58	41.6 Å²	41.6	41%	0.406	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-87.3	173.5	175.4	68	0	0	0	0	111.3	L174 N178 S179 F180	L174-S176 PolarHBondContact O-N 3.22Å; S176-N178 PolarHBondContact O-N 3Å; S176-N178 VanDerWaalsContact O-N 3.13Å; S176-S179 PolarHBondContact N-OG 2.73Å; S176-S179 WeakPolarHBondContact O-CB 3.27Å; S176-S179 PolarHBondContact O-N 2.85Å; S176-S179 PolarHBondContact O-OG 3.26Å; S176-S179 PolarHBondContact OG-OG 2.74Å; S176-F180 WeakPolarHBondContact O-CD2 3.5Å
177	H	86.9	Confident	86.6	Confident	79 Å²	79	43.7 Å²	43.7	37%	0.366	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-48.5	-42.8	178.6	-175.3	-84.2	0	0	0	113.9	S179 A192 T195	H177-S179 VanDerWaalsContact C-N 3.27Å; H177-S179 PolarHBondContact O-N 3.47Å; H177-A192 PolarHBondContact CE1-O 2.86Å; H177-A192 VanDerWaalsContact CE1-O 3.31Å; H177-A192 PolarHBondContact NE2-O 3.08Å; H177-T195 WeakPolarHBondContact CA-OG1 3.29Å; H177-T195 PolarHBondContact CD2-OG1 2.89Å
178	N	87.4	Confident	86.1	Confident	123 Å²	123	46.7 Å²	46.7	66%	0.658	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-82.6	-4.5	-177.6	-63.2	-18.6	0	0	0	113.6	S176 F180	S176-N178 PolarHBondContact O-N 3Å; S176-N178 VanDerWaalsContact O-N 3.13Å; N178-F180 VanDerWaalsContact C-N 3.3Å
179	S	89.1	Confident	85.8	Confident	13 Å²	13	49.4 Å²	49.4	9%	0.091	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-77.5	-19	179	-56.1	0	0	0	0	112.2	S176 H177 V223 S224	S176-S179 PolarHBondContact N-OG 2.73Å; S176-S179 WeakPolarHBondContact O-CB 3.27Å; S176-S179 PolarHBondContact O-N 2.85Å; S176-S179 PolarHBondContact O-OG 3.26Å; S176-S179 PolarHBondContact OG-OG 2.74Å; H177-S179 VanDerWaalsContact C-N 3.27Å; H177-S179 PolarHBondContact O-N 3.47Å; S179-V223 CarbonylContact O-C 3.31Å; S179-V223 VanDerWaalsContact O-CA 3.3Å; S179-V223 WeakPolarHBondContact O-CA 3.23Å; S179-S224 WeakPolarHBondContact CA-O 3.14Å; S179-S224 WeakPolarHBondContact CB-O 3.14Å; S179-S224 PolarHBondContact O-N 2.82Å; S179-S224 PolarHBondContact OG-O 2.98Å
180	F	92.3	Very high	85.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.5	-176.8	-67.8	-90.6	0	0	0	112.1	A169 P175 S176 N178 T195 S202 A204 F206 V223	A169-F180 HydrophobicContact CB-CE1 3.78Å; A169-F180 HydrophobicContact CB-CZ 4.01Å; P175-F180 HydrophobicContact CB-CD2 4.36Å; P175-F180 HydrophobicContact CB-CE2 3.52Å; P175-F180 HydrophobicContact CB-CZ 3.68Å; P175-F180 HydrophobicContact CG-CZ 4.32Å; S176-F180 WeakPolarHBondContact O-CD2 3.5Å; N178-F180 VanDerWaalsContact C-N 3.3Å; F180-T195 HydrophobicContact CD2-CG2 4.38Å; F180-T195 HydrophobicContact CE2-CG2 4.14Å; F180-S202 VanDerWaalsContact CZ-O 3.31Å; F180-S202 WeakPolarHBondContact CZ-O 3.12Å; F180-A204 HydrophobicContact CB-CB 3.57Å; F180-A204 HydrophobicContact CD1-CB 3.56Å; F180-A204 HydrophobicContact CD2-CB 3.74Å; F180-A204 HydrophobicContact CE1-CB 4.14Å; F180-A204 HydrophobicContact CE2-CB 4.29Å; F180-A204 HydrophobicContact CG-CB 3.35Å; F180-A204 HydrophobicContact CZ-CB 4.48Å; F180-F206 HydrophobicContact CB-CZ 3.88Å; F180-V223 HydrophobicContact CD1-CG1 4.38Å; F180-V223 HydrophobicContact CD1-CG2 3.5Å; F180-V223 HydrophobicContact CE1-CG1 4.19Å; F180-V223 HydrophobicContact CE1-CG2 3.59Å; F180-V223 HydrophobicContact CG-CG2 4.43Å; F180-V223 HydrophobicContact CZ-CG1 4.43Å
181	E	92.4	Very high	85.3	Confident	31 Å²	31	54.7 Å²	54.7	15%	0.145	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	133.4	175.5	-64.4	-172	153.5	0	0	110.3	R183 V189 K191 R222	E181-R183 IonicContact OE2-CZ 2.86Å; E181-R183 IonicContact OE2-NE 3.56Å; E181-R183 PolarHBondContact OE2-NE 2.8Å; E181-R183 IonicContact OE2-NH2 3.84Å; E181-R183 PolarHBondContact OE2-NH2 2.78Å; E181-V189 HydrophobicContact CB-CG1 3.93Å; E181-V189 HydrophobicContact CG-CG1 4Å; E181-K191 IonicContact OE1-NZ 3.54Å; E181-K191 PolarHBondContact OE1-NZ 2.93Å; E181-R222 PolarHBondContact N-O 2.75Å; E181-R222 PolarHBondContact O-N 2.85Å
182	L	90.9	Very high	85.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125	171	-174.7	69	0	0	0	108.7	V165 L190 F206 I208 W219 C221 F234	V165-L182 HydrophobicContact CB-CD2 4.32Å; V165-L182 HydrophobicContact CG1-CD2 4.5Å; L182-L190 HydrophobicContact CB-CB 4.25Å; L182-L190 HydrophobicContact CD2-CD1 4.37Å; L182-L190 PolarHBondContact N-O 3.44Å; L182-L190 PolarHBondContact O-N 3.3Å; L182-F206 HydrophobicContact CB-CD1 3.56Å; L182-F206 HydrophobicContact CB-CD2 4.21Å; L182-F206 HydrophobicContact CB-CE1 3.57Å; L182-F206 HydrophobicContact CB-CE2 4.22Å; L182-F206 HydrophobicContact CB-CG 3.87Å; L182-F206 HydrophobicContact CB-CZ 3.89Å; L182-F206 HydrophobicContact CD2-CB 3.81Å; L182-F206 HydrophobicContact CD2-CD1 4.33Å; L182-F206 HydrophobicContact CD2-CD2 4.38Å; L182-F206 HydrophobicContact CD2-CG 3.94Å; L182-F206 HydrophobicContact CG-CG 4.49Å; L182-I208 HydrophobicContact CD2-CD1 4.35Å; L182-I208 HydrophobicContact CD2-CG1 4.38Å; L182-W219 HydrophobicContact CD1-CE3 4.43Å; L182-W219 HydrophobicContact CD2-CE3 3.95Å; L182-W219 HydrophobicContact CD2-CZ3 3.92Å; L182-W219 HydrophobicContact CG-CE3 3.95Å; L182-W219 HydrophobicContact CG-CZ3 4.27Å; L182-C221 HydrophobicContact CD1-CB 4.32Å; L182-F234 HydrophobicContact CD1-CE1 3.68Å; L182-F234 HydrophobicContact CD1-CZ 3.87Å
183	R	89	Confident	85.7	Confident	47 Å²	47	54.8 Å²	54.8	18%	0.177	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.4	-169.6	-60.1	-178.7	170.1	-148.1	-5.6	111.5	E181 T188 V189 W219 E220 R222	E181-R183 IonicContact OE2-CZ 2.86Å; E181-R183 IonicContact OE2-NE 3.56Å; E181-R183 PolarHBondContact OE2-NE 2.8Å; E181-R183 IonicContact OE2-NH2 3.84Å; E181-R183 PolarHBondContact OE2-NH2 2.78Å; R183-T188 WeakPolarHBondContact CA-O 3.19Å; R183-V189 HydrophobicContact CG-CG2 4.3Å; R183-W219 WeakPolarHBondContact O-CA 3.2Å; R183-E220 HydrophobicContact CB-CB 4.34Å; R183-E220 PolarHBondContact N-O 2.85Å; R183-E220 PolarHBondContact O-N 2.78Å; R183-R222 VanDerWaalsContact CZ-CD 3.41Å; R183-R222 VanDerWaalsContact NH2-NH2 3.12Å
184	K	81.6	Confident	86.1	Confident	28 Å²	28	59.4 Å²	59.4	12%	0.122	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	164.4	170.2	-67.4	-177.9	-176	176.1	0	111	D186 N187 T188 W219	K184-D186 WeakPolarHBondContact CB-OD1 3.34Å; K184-D186 PolarHBondContact O-N 2.98Å; K184-N187 PolarHBondContact O-N 3.18Å; K184-T188 PolarHBondContact N-O 3.41Å; K184-W219 HydrophobicContact CD-CH2 4.04Å; K184-W219 HydrophobicContact CD-CZ2 4.11Å; K184-W219 HydrophobicContact CD-CZ3 4.49Å; K184-W219 HydrophobicContact CG-CD2 4.12Å; K184-W219 HydrophobicContact CG-CE3 3.98Å; K184-W219 HydrophobicContact CG-CH2 3.81Å; K184-W219 HydrophobicContact CG-CZ2 3.89Å; K184-W219 HydrophobicContact CG-CZ3 3.84Å
185	L	71.5	Confident	86.2	Confident	126 Å²	126	59 Å²	59	66%	0.66	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.4	173.4	-85.4	158.4	0	0	0	114	N187 L218	L185-N187 PolarHBondContact O-N 3.19Å; L185-L218 HydrophobicContact CD1-CB 3.88Å; L185-L218 HydrophobicContact CG-CB 4.24Å; L185-L218 VanDerWaalsContact CG-O 3.31Å; L185-L218 WeakPolarHBondContact CG-O 3.42Å
186	D	75.1	Confident	86.2	Confident	106 Å²	106	62.5 Å²	62.5	57%	0.567	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	9.2	175.2	66.5	6.7	0	0	0	113.4	K184 T188	K184-D186 WeakPolarHBondContact CB-OD1 3.34Å; K184-D186 PolarHBondContact O-N 2.98Å; D186-T188 PolarHBondContact O-N 2.97Å; D186-T188 WeakPolarHBondContact OD1-CB 3.37Å; D186-T188 PolarHBondContact OD1-N 2.82Å; D186-T188 PolarHBondContact OD1-OG1 3.32Å; D186-T188 PolarHBondContact OD2-OG1 3.21Å
187	N	71.1	Confident	86.1	Confident	128 Å²	128	65.9 Å²	65.9	68%	0.684	34%	0.339	S	S	*	.			trans	63.5	13.6	-173.7	-65.2	-48.6	0	0	0	115.4	K184 L185 V189	K184-N187 PolarHBondContact O-N 3.18Å; L185-N187 PolarHBondContact O-N 3.19Å; N187-V189 PolarHBondContact O-N 2.6Å
188	T	82.5	Confident	86.1	Confident	62 Å²	62	66.8 Å²	66.8	38%	0.38	34%	0.344	S	S	.	.			trans	-65.2	129	169.5	-54.7	0	0	0	0	109.8	R183 K184 D186	R183-T188 WeakPolarHBondContact CA-O 3.19Å; K184-T188 PolarHBondContact N-O 3.41Å; D186-T188 PolarHBondContact O-N 2.97Å; D186-T188 WeakPolarHBondContact OD1-CB 3.37Å; D186-T188 PolarHBondContact OD1-N 2.82Å; D186-T188 PolarHBondContact OD1-OG1 3.32Å; D186-T188 PolarHBondContact OD2-OG1 3.21Å
189	V	87.1	Confident	85.9	Confident	58 Å²	58	67.2 Å²	67.2	35%	0.352	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.9	-179.9	-175	0	0	0	0	110	E181 R183 N187	E181-V189 HydrophobicContact CB-CG1 3.93Å; E181-V189 HydrophobicContact CG-CG1 4Å; R183-V189 HydrophobicContact CG-CG2 4.3Å; N187-V189 PolarHBondContact O-N 2.6Å
190	L	88.3	Confident	85.8	Confident	31 Å²	31	71.1 Å²	71.1	16%	0.162	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.6	167.9	-62.7	176.8	0	0	0	109.4	L182 F206 I208 W219	L182-L190 HydrophobicContact CB-CB 4.25Å; L182-L190 HydrophobicContact CD2-CD1 4.37Å; L182-L190 PolarHBondContact N-O 3.44Å; L182-L190 PolarHBondContact O-N 3.3Å; L190-F206 WeakPolarHBondContact O-CE1 3.39Å; L190-I208 HydrophobicContact CD1-CG1 4.32Å; L190-W219 HydrophobicContact CD1-CH2 4.24Å; L190-W219 HydrophobicContact CD1-CZ3 3.78Å
191	K	87.4	Confident	85.8	Confident	119 Å²	119	74.1 Å²	74.1	52%	0.517	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	152.3	174.8	-64	-63.2	-174.8	178.8	0	109.9	E181	E181-K191 IonicContact OE1-NZ 3.54Å; E181-K191 PolarHBondContact OE1-NZ 2.93Å
192	A	88.8	Confident	85.8	Confident	9 Å²	9	72.7 Å²	72.7	7%	0.074	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-61.3	137.2	175.8	0	0	0	0	0	110.1	H177 A204 L205 F206	H177-A192 PolarHBondContact CE1-O 2.86Å; H177-A192 VanDerWaalsContact CE1-O 3.31Å; H177-A192 PolarHBondContact NE2-O 3.08Å; A192-A204 HydrophobicContact CB-CB 3.84Å; A192-L205 CarbonylContact C-O 3.49Å; A192-L205 WeakPolarHBondContact CA-O 3.05Å; A192-F206 HydrophobicContact CB-CD1 4.36Å; A192-F206 HydrophobicContact CB-CE1 4.03Å; A192-F206 HydrophobicContact CB-CZ 4.34Å
193	S	89.3	Confident	85.9	Confident	64 Å²	64	73 Å²	73	45%	0.448	38%	0.383	S	S	.	.	S	Bend	trans	-79.2	-34.9	172.8	60.1	0	0	0	0	111.2	L205	S193-L205 PolarHBondContact N-O 2.85Å; S193-L205 PolarHBondContact OG-O 2.92Å; S193-L205 VanDerWaalsContact OG-O 3.09Å
194	K	89.1	Confident	86.1	Confident	125 Å²	125	70.8 Å²	70.8	54%	0.543	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	144	177.5	-174.1	176.2	-179.5	179.6	0	109.9	L205	K194-L205 PolarHBondContact O-N 2.85Å
195	T	90.8	Very high	86.6	Confident	33 Å²	33	72 Å²	72	20%	0.202	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.3	170.5	-58.3	0	0	0	0	109.9	H177 F180 T203	H177-T195 WeakPolarHBondContact CA-OG1 3.29Å; H177-T195 PolarHBondContact CD2-OG1 2.89Å; F180-T195 HydrophobicContact CD2-CG2 4.38Å; F180-T195 HydrophobicContact CE2-CG2 4.14Å; T195-T203 CarbonylContact C-O 3.48Å; T195-T203 VanDerWaalsContact CA-O 3.29Å; T195-T203 WeakPolarHBondContact CA-O 3.3Å
196	I	90.2	Very high	87.6	Confident	73 Å²	73	66 Å²	66	37%	0.374	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123	177.6	-57.6	172.4	0	0	0	107.2	S202 T203 L205	I196-S202 CarbonylContact O-C 3.41Å; I196-S202 WeakPolarHBondContact O-CA 3.42Å; I196-T203 PolarHBondContact N-O 2.97Å; I196-T203 PolarHBondContact O-N 3.38Å; I196-L205 HydrophobicContact CD1-CD1 4.18Å
197	Q	87.4	Confident	88.2	Confident	128 Å²	128	66 Å²	66	60%	0.598	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	122.5	-178.5	-167.6	170.2	-5.6	0	0	109.9	L174	L174-Q197 HydrophobicContact CD2-CG 3.71Å
198	E	87.7	Confident	88.9	Confident	99 Å²	99	60 Å²	60	46%	0.463	32%	0.315	S	S	.	.			trans	-110.8	175.4	176.6	-64.6	173.7	-173.3	0	0	110.1	L174 N200 R201	L174-E198 VanDerWaalsContact CD2-O 3.24Å; L174-E198 WeakPolarHBondContact CD2-O 3.38Å; E198-N200 PolarHBondContact O-N 2.77Å; E198-N200 VanDerWaalsContact O-N 3.11Å; E198-R201 WeakPolarHBondContact CA-O 3.27Å; E198-R201 HydrophobicContact CB-CG 4.03Å; E198-R201 HydrophobicContact CG-CG 4.46Å; E198-R201 PolarHBondContact N-O 2.78Å; E198-R201 VanDerWaalsContact OE2-CD 3.3Å; E198-R201 WeakPolarHBondContact OE2-CD 3.13Å; E198-R201 VanDerWaalsContact OE2-CG 3.24Å; E198-R201 WeakPolarHBondContact OE2-CG 3.41Å; E198-R201 IonicContact OE2-NE 2.74Å
199	S	82.3	Confident	89	Confident	131 Å²	131	60.2 Å²	60.2	92%	0.916	32%	0.317	S	S	*	.	S	Bend	trans	-58.5	-27.2	-175.8	-50.3	0	0	0	0	114.4
200	N	86.9	Confident	88.8	Confident	96 Å²	96	61.3 Å²	61.3	51%	0.513	33%	0.326	S	S	.	.	S	Bend	trans	-132.5	-2.1	-175.7	68.5	-2.7	0	0	0	115.2	T170 E198	T170-N200 WeakPolarHBondContact CB-O 3.43Å; T170-N200 PolarHBondContact OG1-O 2.8Å; E198-N200 PolarHBondContact O-N 2.77Å; E198-N200 VanDerWaalsContact O-N 3.11Å
201	R	92.1	Very high	88.6	Confident	63 Å²	63	59.9 Å²	59.9	24%	0.238	32%	0.318	C	S	.	.			trans	-150.4	155.3	-178.3	67.5	174.2	75.7	-165.3	4.9	111.5	L149 E150 E198	L149-R201 HydrophobicContact CD1-CB 4.26Å; E150-R201 IonicContact OE1-CZ 3.09Å; E150-R201 IonicContact OE1-NH1 3.58Å; E150-R201 PolarHBondContact OE1-NH1 2.85Å; E150-R201 IonicContact OE2-NH1 2.68Å; E198-R201 WeakPolarHBondContact CA-O 3.27Å; E198-R201 HydrophobicContact CB-CG 4.03Å; E198-R201 HydrophobicContact CG-CG 4.46Å; E198-R201 PolarHBondContact N-O 2.78Å; E198-R201 VanDerWaalsContact OE2-CD 3.3Å; E198-R201 WeakPolarHBondContact OE2-CD 3.13Å; E198-R201 VanDerWaalsContact OE2-CG 3.24Å; E198-R201 WeakPolarHBondContact OE2-CG 3.41Å; E198-R201 IonicContact OE2-NE 2.74Å
202	S	93	Very high	88.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.4	167.8	-62.8	0	0	0	0	109.2	S168 A169 L174 P175 F180 I196	S168-S202 CarbonylContact C-O 3.47Å; S168-S202 WeakPolarHBondContact CA-O 3.47Å; A169-S202 PolarHBondContact N-O 2.83Å; A169-S202 PolarHBondContact O-N 2.78Å; L174-S202 WeakPolarHBondContact CD2-OG 3.43Å; P175-S202 WeakPolarHBondContact O-CB 3.39Å; P175-S202 PolarHBondContact O-OG 2.94Å; F180-S202 VanDerWaalsContact CZ-O 3.31Å; F180-S202 WeakPolarHBondContact CZ-O 3.12Å; I196-S202 CarbonylContact O-C 3.41Å; I196-S202 WeakPolarHBondContact O-CA 3.42Å
203	T	93.7	Very high	87.6	Confident	7 Å²	7	60 Å²	60	4%	0.043	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.1	-180	-59.8	0	0	0	0	109.5	K166 S168 T195 I196 L205	K166-T203 HydrophobicContact CD-CG2 3.99Å; K166-T203 HydrophobicContact CG-CG2 3.55Å; S168-T203 PolarHBondContact OG-OG1 2.98Å; T195-T203 CarbonylContact C-O 3.48Å; T195-T203 VanDerWaalsContact CA-O 3.29Å; T195-T203 WeakPolarHBondContact CA-O 3.3Å; I196-T203 PolarHBondContact N-O 2.97Å; I196-T203 PolarHBondContact O-N 3.38Å; T203-L205 HydrophobicContact CG2-CD1 4.32Å
204	A	92.9	Very high	86.8	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.6	171.4	0	0	0	0	0	111.1	C167 F180 A192 F206	C167-A204 PolarHBondContact N-O 3.16Å; C167-A204 PolarHBondContact O-N 3.3Å; F180-A204 HydrophobicContact CB-CB 3.57Å; F180-A204 HydrophobicContact CD1-CB 3.56Å; F180-A204 HydrophobicContact CD2-CB 3.74Å; F180-A204 HydrophobicContact CE1-CB 4.14Å; F180-A204 HydrophobicContact CE2-CB 4.29Å; F180-A204 HydrophobicContact CG-CB 3.35Å; F180-A204 HydrophobicContact CZ-CB 4.48Å; A192-A204 HydrophobicContact CB-CB 3.84Å; A204-F206 HydrophobicContact CB-CE2 3.83Å; A204-F206 HydrophobicContact CB-CZ 4.12Å
205	L	92.6	Very high	86.2	Confident	54 Å²	54	62.9 Å²	62.9	28%	0.283	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	134.6	169.5	-71	84.5	0	0	0	108.7	A192 S193 K194 I196 T203	A192-L205 CarbonylContact C-O 3.49Å; A192-L205 WeakPolarHBondContact CA-O 3.05Å; S193-L205 PolarHBondContact N-O 2.85Å; S193-L205 PolarHBondContact OG-O 2.92Å; S193-L205 VanDerWaalsContact OG-O 3.09Å; K194-L205 PolarHBondContact O-N 2.85Å; I196-L205 HydrophobicContact CD1-CD1 4.18Å; T203-L205 HydrophobicContact CG2-CD1 4.32Å
206	F	91.3	Very high	85.5	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.9	176.5	-60.6	-90	0	0	0	109.2	K164 V165 C167 F180 L182 L190 A192 A204	K164-F206 CarbonylContact C-O 3.54Å; K164-F206 VanDerWaalsContact CA-O 3.25Å; K164-F206 WeakPolarHBondContact CA-O 3.25Å; V165-F206 HydrophobicContact CB-CB 4.42Å; V165-F206 PolarHBondContact N-O 3.49Å; V165-F206 PolarHBondContact O-N 3.45Å; C167-F206 HydrophobicContact CB-CE2 3.96Å; F180-F206 HydrophobicContact CB-CZ 3.88Å; L182-F206 HydrophobicContact CB-CD1 3.56Å; L182-F206 HydrophobicContact CB-CD2 4.21Å; L182-F206 HydrophobicContact CB-CE1 3.57Å; L182-F206 HydrophobicContact CB-CE2 4.22Å; L182-F206 HydrophobicContact CB-CG 3.87Å; L182-F206 HydrophobicContact CB-CZ 3.89Å; L182-F206 HydrophobicContact CD2-CB 3.81Å; L182-F206 HydrophobicContact CD2-CD1 4.33Å; L182-F206 HydrophobicContact CD2-CD2 4.38Å; L182-F206 HydrophobicContact CD2-CG 3.94Å; L182-F206 HydrophobicContact CG-CG 4.49Å; L190-F206 WeakPolarHBondContact O-CE1 3.39Å; A192-F206 HydrophobicContact CB-CD1 4.36Å; A192-F206 HydrophobicContact CB-CE1 4.03Å; A192-F206 HydrophobicContact CB-CZ 4.34Å; A204-F206 HydrophobicContact CB-CE2 3.83Å; A204-F206 HydrophobicContact CB-CZ 4.12Å
207	E	88.4	Confident	85.1	Confident	106 Å²	106	61 Å²	61	50%	0.495	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.1	171.4	-63.7	-170.7	160.8	0	0	108.4	K164	K164-E207 HydrophobicContact CD-CG 4.23Å; K164-E207 WeakPolarHBondContact CE-OE1 3.41Å; K164-E207 HydrophobicContact CG-CG 4.23Å; K164-E207 IonicContact NZ-OE1 2.62Å; K164-E207 PolarHBondContact NZ-OE1 2.79Å
208	I	85.9	Confident	85	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-85.8	127.6	-179.9	-60.8	177.3	0	0	0	108.1	S162 P163 V165 L182 L190 L211 W219	S162-I208 CarbonylContact C-O 3.46Å; S162-I208 VanDerWaalsContact CA-O 3.23Å; S162-I208 WeakPolarHBondContact CA-O 3.34Å; S162-I208 WeakPolarHBondContact CB-O 3.44Å; P163-I208 HydrophobicContact CG-CB 4.06Å; P163-I208 HydrophobicContact CG-CD1 4.18Å; P163-I208 WeakPolarHBondContact O-CB 3.47Å; P163-I208 PolarHBondContact O-N 2.83Å; V165-I208 HydrophobicContact CG2-CD1 3.6Å; V165-I208 HydrophobicContact CG2-CG1 4.38Å; L182-I208 HydrophobicContact CD2-CD1 4.35Å; L182-I208 HydrophobicContact CD2-CG1 4.38Å; L190-I208 HydrophobicContact CD1-CG1 4.32Å; I208-L211 HydrophobicContact CG2-CD2 3.71Å; I208-L211 HydrophobicContact CG2-CG 4.27Å; I208-W219 HydrophobicContact CD1-CE3 4.38Å; I208-W219 HydrophobicContact CD1-CH2 3.79Å; I208-W219 HydrophobicContact CD1-CZ3 3.74Å; I208-W219 HydrophobicContact CG1-CH2 4.17Å; I208-W219 HydrophobicContact CG1-CZ3 4.11Å; I208-W219 HydrophobicContact CG2-CH2 3.74Å; I208-W219 HydrophobicContact CG2-CZ3 4.48Å
209	P	83.1	Confident	85.1	Confident	65 Å²	65	53.1 Å²	53.1	42%	0.422	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-57.5	160.3	173.7	-23.4	32.9	0	0	0	112.2	L211	P209-L211 PolarHBondContact O-N 2.78Å; P209-L211 VanDerWaalsContact O-N 3.12Å
210	P	84.3	Confident	85.5	Confident	82 Å²	82	48.7 Å²	48.7	53%	0.532	28%	0.277	S	S	.	.			trans	-45.9	119.9	-176	-30	34.2	0	0	0	113	S161	S161-P210 WeakPolarHBondContact O-CA 3.4Å
211	L	82.6	Confident	85.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.253	C	S	.	.			trans	-71.1	133.2	-172.8	-74.9	175	0	0	0	112	C157 N160 S161 P163 I208 P209 Q215 I238	C157-L211 HydrophobicContact CB-CD1 3.41Å; C157-L211 VanDerWaalsContact CB-CD1 3.41Å; N160-L211 WeakPolarHBondContact CA-O 3.26Å; N160-L211 PolarHBondContact N-O 2.94Å; S161-L211 PolarHBondContact O-N 2.77Å; P163-L211 HydrophobicContact CG-CD1 3.73Å; P163-L211 HydrophobicContact CG-CG 4.35Å; I208-L211 HydrophobicContact CG2-CD2 3.71Å; I208-L211 HydrophobicContact CG2-CG 4.27Å; P209-L211 PolarHBondContact O-N 2.78Å; P209-L211 VanDerWaalsContact O-N 3.12Å; L211-Q215 HydrophobicContact CD2-CB 4.14Å; L211-I238 HydrophobicContact CB-CD1 4.22Å; L211-I238 HydrophobicContact CD1-CG1 4.48Å; L211-I238 HydrophobicContact CD2-CD1 4.39Å
212	S	81.9	Confident	85.8	Confident	49 Å²	49	43.3 Å²	43.3	34%	0.343	25%	0.25	S	S	.	.			trans	-107.2	156.7	169.6	63.9	0	0	0	0	110.9	K214 Q215 I238	S212-K214 PolarHBondContact O-N 2.89Å; S212-Q215 WeakPolarHBondContact O-CB 3.27Å; S212-Q215 PolarHBondContact O-N 3.43Å; S212-Q215 WeakPolarHBondContact OG-CG 3.41Å; S212-Q215 PolarHBondContact OG-OE1 2.87Å; S212-I238 WeakPolarHBondContact O-CD1 3.38Å
213	A	73.1	Confident	85.8	Confident	81 Å²	81	43.3 Å²	43.3	67%	0.669	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-54.7	-20.3	-178	0	0	0	0	0	114.7	L159	L159-A213 HydrophobicContact CD1-CB 4.21Å
214	K	73.2	Confident	85.6	Confident	201 Å²	201	44.6 Å²	44.6	87%	0.874	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-84	-8.4	178.8	-62.1	-175.7	-179.9	-178.8	0	114.3	S212	S212-K214 PolarHBondContact O-N 2.89Å
215	Q	76	Confident	85.3	Confident	50 Å²	50	45.5 Å²	45.5	23%	0.234	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-98.6	3.3	-173.7	-69.5	171.7	-38.9	0	0	113.8	L211 S212 W219 I238	L211-Q215 HydrophobicContact CD2-CB 4.14Å; S212-Q215 WeakPolarHBondContact O-CB 3.27Å; S212-Q215 PolarHBondContact O-N 3.43Å; S212-Q215 WeakPolarHBondContact OG-CG 3.41Å; S212-Q215 PolarHBondContact OG-OE1 2.87Å; Q215-W219 PolarHBondContact O-NE1 2.8Å; Q215-I238 HydrophobicContact CB-CD1 4.2Å
216	G	77	Confident	84.7	Confident	37 Å²	37	49.2 Å²	49.2	38%	0.381	29%	0.285	S	S	.	.			trans	-71.5	153.3	171.1	0	0	0	0	0	111.5	V236 I238	G216-V236 WeakPolarHBondContact CA-O 3.45Å; G216-I238 VanDerWaalsContact N-CD1 3.27Å
217	G	81.9	Confident	83.9	Confident	28 Å²	28	50.1 Å²	50.1	29%	0.289	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	131.7	-156.3	179.1	0	0	0	0	0	113.4	N235 V236	G217-N235 WeakPolarHBondContact O-CA 3.28Å; G217-V236 PolarHBondContact N-O 2.82Å; G217-V236 PolarHBondContact O-N 3.49Å
218	L	86	Confident	83.6	Confident	57 Å²	57	46.5 Å²	46.5	30%	0.298	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	132	-175.3	-165.2	70.3	0	0	0	111.2	L185 K233 N235	L185-L218 HydrophobicContact CD1-CB 3.88Å; L185-L218 HydrophobicContact CG-CB 4.24Å; L185-L218 VanDerWaalsContact CG-O 3.31Å; L185-L218 WeakPolarHBondContact CG-O 3.42Å; L218-K233 HydrophobicContact CD1-CB 3.97Å; L218-K233 HydrophobicContact CD2-CB 4.34Å; L218-K233 HydrophobicContact CD2-CD 3.72Å; L218-K233 HydrophobicContact CG-CB 4.12Å; L218-K233 HydrophobicContact CG-CD 4.31Å; L218-N235 WeakPolarHBondContact CD1-OD1 3.49Å
219	W	89.3	Confident	83.7	Confident	5 Å²	5	53.3 Å²	53.3	2%	0.019	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	156.3	177.1	-72.2	61.3	0	0	0	109.6	L182 R183 K184 L190 I208 Q215 K233 F234 V236	L182-W219 HydrophobicContact CD1-CE3 4.43Å; L182-W219 HydrophobicContact CD2-CE3 3.95Å; L182-W219 HydrophobicContact CD2-CZ3 3.92Å; L182-W219 HydrophobicContact CG-CE3 3.95Å; L182-W219 HydrophobicContact CG-CZ3 4.27Å; R183-W219 WeakPolarHBondContact O-CA 3.2Å; K184-W219 HydrophobicContact CD-CH2 4.04Å; K184-W219 HydrophobicContact CD-CZ2 4.11Å; K184-W219 HydrophobicContact CD-CZ3 4.49Å; K184-W219 HydrophobicContact CG-CD2 4.12Å; K184-W219 HydrophobicContact CG-CE3 3.98Å; K184-W219 HydrophobicContact CG-CH2 3.81Å; K184-W219 HydrophobicContact CG-CZ2 3.89Å; K184-W219 HydrophobicContact CG-CZ3 3.84Å; L190-W219 HydrophobicContact CD1-CH2 4.24Å; L190-W219 HydrophobicContact CD1-CZ3 3.78Å; I208-W219 HydrophobicContact CD1-CE3 4.38Å; I208-W219 HydrophobicContact CD1-CH2 3.79Å; I208-W219 HydrophobicContact CD1-CZ3 3.74Å; I208-W219 HydrophobicContact CG1-CH2 4.17Å; I208-W219 HydrophobicContact CG1-CZ3 4.11Å; I208-W219 HydrophobicContact CG2-CH2 3.74Å; I208-W219 HydrophobicContact CG2-CZ3 4.48Å; Q215-W219 PolarHBondContact O-NE1 2.8Å; W219-K233 CarbonylContact O-C 3.57Å; W219-K233 WeakPolarHBondContact O-CA 3.11Å; W219-K233 WeakPolarHBondContact O-CB 3.3Å; W219-F234 HydrophobicContact CB-CD1 3.99Å; W219-F234 HydrophobicContact CB-CD2 4.4Å; W219-F234 HydrophobicContact CB-CE1 3.51Å; W219-F234 HydrophobicContact CB-CE2 3.95Å; W219-F234 HydrophobicContact CB-CG 4.43Å; W219-F234 HydrophobicContact CB-CZ 3.49Å; W219-F234 VanDerWaalsContact CB-CZ 3.49Å; W219-F234 HydrophobicContact CG-CE2 4.46Å; W219-F234 HydrophobicContact CG-CZ 4.21Å; W219-F234 PolarHBondContact N-O 3.35Å; W219-F234 PolarHBondContact O-N 2.89Å; W219-V236 HydrophobicContact CB-CG2 4.4Å; W219-V236 HydrophobicContact CD2-CG2 4.14Å; W219-V236 HydrophobicContact CG-CG2 3.77Å
220	E	90.2	Very high	84.2	Confident	38 Å²	38	52.3 Å²	52.3	18%	0.178	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	121.5	-177.9	-179.8	-180	-103.4	0	0	110.7	R183 R232 K233	R183-E220 HydrophobicContact CB-CB 4.34Å; R183-E220 PolarHBondContact N-O 2.85Å; R183-E220 PolarHBondContact O-N 2.78Å; E220-R232 CarbonylContact C-O 3.53Å; E220-R232 WeakPolarHBondContact CA-O 3.38Å; E220-K233 HydrophobicContact CB-CG 4.07Å; E220-K233 HydrophobicContact CG-CG 4.1Å; E220-K233 WeakPolarHBondContact OE1-CE 3.34Å
221	C	92.3	Very high	84.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.1	161.4	-178.8	0	0	0	0	108.8	I148 L151 C167 L182 S231 R232	I148-C221 WeakPolarHBondContact CD1-O 3.35Å; L151-C221 HydrophobicContact CD1-CB 3.64Å; L151-C221 HydrophobicContact CD2-CB 4.04Å; C167-C221 HydrophobicContact CB-CB 4.06Å; C167-C221 WeakPolarHBondContact CB-SG 3.06Å; C167-C221 WeakPolarHBondContact SG-CB 3.4Å; C167-C221 CovalentContact SG-SG 2.05Å; C167-C221 PolarHBondContact SG-SG 2.75Å; L182-C221 HydrophobicContact CD1-CB 4.32Å; C221-S231 CarbonylContact O-C 3.27Å; C221-S231 VanDerWaalsContact O-CA 3.25Å; C221-S231 WeakPolarHBondContact O-CA 3.36Å; C221-R232 PolarHBondContact N-O 2.75Å; C221-R232 PolarHBondContact O-N 2.72Å
222	R	92.1	Very high	85	Confident	47 Å²	47	55.8 Å²	55.8	18%	0.177	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.4	-179.9	-171.7	-168.7	-141.4	-146	-145	110.2	E181 R183 R229	E181-R222 PolarHBondContact N-O 2.75Å; E181-R222 PolarHBondContact O-N 2.85Å; R183-R222 VanDerWaalsContact CZ-CD 3.41Å; R183-R222 VanDerWaalsContact NH2-NH2 3.12Å; R222-R229 HydrophobicContact CG-CG 4.1Å; R222-R229 VanDerWaalsContact CZ-NE 3.28Å; R222-R229 VanDerWaalsContact CZ-NH1 3.28Å; R222-R229 VanDerWaalsContact NE-CD 3.35Å; R222-R229 VanDerWaalsContact NH2-NH2 3.1Å
223	V	93.2	Very high	85.3	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.5	178.2	-173.3	0	0	0	0	109.2	P146 I148 A169 P175 S179 F180 R229 D230	P146-V223 HydrophobicContact CB-CB 4.39Å; P146-V223 HydrophobicContact CB-CG1 3.84Å; P146-V223 HydrophobicContact CG-CG1 4.25Å; P146-V223 WeakPolarHBondContact CG-O 3.48Å; I148-V223 HydrophobicContact CD1-CG2 4.05Å; I148-V223 HydrophobicContact CG1-CB 4.37Å; I148-V223 HydrophobicContact CG1-CG2 3.75Å; A169-V223 HydrophobicContact CB-CB 4.26Å; A169-V223 HydrophobicContact CB-CG1 3.97Å; A169-V223 HydrophobicContact CB-CG2 3.83Å; P175-V223 HydrophobicContact CB-CG1 3.76Å; P175-V223 HydrophobicContact CG-CG1 3.76Å; S179-V223 CarbonylContact O-C 3.31Å; S179-V223 VanDerWaalsContact O-CA 3.3Å; S179-V223 WeakPolarHBondContact O-CA 3.23Å; F180-V223 HydrophobicContact CD1-CG1 4.38Å; F180-V223 HydrophobicContact CD1-CG2 3.5Å; F180-V223 HydrophobicContact CE1-CG1 4.19Å; F180-V223 HydrophobicContact CE1-CG2 3.59Å; F180-V223 HydrophobicContact CG-CG2 4.43Å; F180-V223 HydrophobicContact CZ-CG1 4.43Å; V223-R229 VanDerWaalsContact O-CA 3.27Å; V223-R229 WeakPolarHBondContact O-CA 3.3Å; V223-R229 WeakPolarHBondContact O-CG 3.39Å; V223-D230 PolarHBondContact N-O 2.77Å; V223-D230 PolarHBondContact O-N 3.46Å
224	S	90.1	Very high	86	Confident	33 Å²	33	56.3 Å²	56.3	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.9	-178.8	-57.6	0	0	0	0	110.4	S179 R229	S179-S224 WeakPolarHBondContact CA-O 3.14Å; S179-S224 WeakPolarHBondContact CB-O 3.14Å; S179-S224 PolarHBondContact O-N 2.82Å; S179-S224 PolarHBondContact OG-O 2.98Å; S224-R229 PolarHBondContact OG-NE 3.47Å
225	T	86.7	Confident	86.7	Confident	20 Å²	20	50.3 Å²	50.3	12%	0.123	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	176.5	172.3	73	0	0	0	0	109.6	P146 P175 G227 G228	P146-T225 HydrophobicContact CB-CG2 3.98Å; P146-T225 WeakPolarHBondContact CD-OG1 3.33Å; P146-T225 HydrophobicContact CG-CG2 4.09Å; P175-T225 HydrophobicContact CB-CG2 4.01Å; P175-T225 HydrophobicContact CG-CG2 3.91Å; T225-G227 PolarHBondContact O-N 3.13Å; T225-G227 PolarHBondContact OG1-N 3.14Å; T225-G228 PolarHBondContact N-O 2.78Å; T225-G228 PolarHBondContact O-N 3Å
226	N	79.8	Confident	87.2	Confident	131 Å²	131	48 Å²	48	70%	0.701	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.5	175.5	-64.4	0.8	0	0	0	112.2	G228	N226-G228 VanDerWaalsContact C-N 3.33Å; N226-G228 PolarHBondContact O-N 2.78Å
227	G	73.8	Confident	87.7	Confident	21 Å²	21	49.4 Å²	49.4	22%	0.216	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-6.2	178.4	0	0	0	0	0	114.8	A145 T225	A145-G227 VanDerWaalsContact CA-O 3.22Å; A145-G227 WeakPolarHBondContact CA-O 3.02Å; A145-G227 WeakPolarHBondContact CB-O 3.38Å; A145-G227 PolarHBondContact N-O 2.86Å; T225-G227 PolarHBondContact O-N 3.13Å; T225-G227 PolarHBondContact OG1-N 3.14Å
228	G	82.5	Confident	88	Confident	30 Å²	30	49.6 Å²	49.6	31%	0.309	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	142.9	-159.2	178.3	0	0	0	0	0	114	P146 T225 N226	P146-G228 VanDerWaalsContact CD-O 3.26Å; P146-G228 WeakPolarHBondContact CD-O 3.23Å; P146-G228 WeakPolarHBondContact CG-O 3.34Å; T225-G228 PolarHBondContact N-O 2.78Å; T225-G228 PolarHBondContact O-N 3Å; N226-G228 VanDerWaalsContact C-N 3.33Å; N226-G228 PolarHBondContact O-N 2.78Å
229	R	89.4	Confident	88.2	Confident	145 Å²	145	49.4 Å²	49.4	55%	0.547	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	145.3	-177.6	177.5	-176.1	-67.1	151.6	7.6	111.8	R222 V223 S224	R222-R229 HydrophobicContact CG-CG 4.1Å; R222-R229 VanDerWaalsContact CZ-NE 3.28Å; R222-R229 VanDerWaalsContact CZ-NH1 3.28Å; R222-R229 VanDerWaalsContact NE-CD 3.35Å; R222-R229 VanDerWaalsContact NH2-NH2 3.1Å; V223-R229 VanDerWaalsContact O-CA 3.27Å; V223-R229 WeakPolarHBondContact O-CA 3.3Å; V223-R229 WeakPolarHBondContact O-CG 3.39Å; S224-R229 PolarHBondContact OG-NE 3.47Å
230	D	92.8	Very high	88.3	Confident	43 Å²	43	52.5 Å²	52.5	23%	0.23	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	154.8	167.8	-172.9	24.3	0	0	0	110.6	P146 Q147 I148 V223	P146-D230 WeakPolarHBondContact O-CB 3.47Å; Q147-D230 WeakPolarHBondContact CA-OD2 3.41Å; I148-D230 HydrophobicContact CG1-CB 4.4Å; I148-D230 PolarHBondContact N-OD2 3.21Å; V223-D230 PolarHBondContact N-O 2.77Å; V223-D230 PolarHBondContact O-N 3.46Å
231	S	92.1	Very high	88.3	Confident	53 Å²	53	51.6 Å²	51.6	37%	0.371	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	135	-178.2	56.4	0	0	0	0	112.1	C221	C221-S231 CarbonylContact O-C 3.27Å; C221-S231 VanDerWaalsContact O-CA 3.25Å; C221-S231 WeakPolarHBondContact O-CA 3.36Å
232	R	90.8	Very high	88.3	Confident	103 Å²	103	51.6 Å²	51.6	39%	0.389	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.9	174.7	-76	-170.2	-177.1	175.8	-0.3	110.8	I148 L149 L151 E220 C221	I148-R232 HydrophobicContact CB-CG 4.22Å; I148-R232 HydrophobicContact CD1-CB 4.13Å; I148-R232 HydrophobicContact CD1-CG 4.19Å; I148-R232 HydrophobicContact CG2-CG 4.26Å; I148-R232 PolarHBondContact O-NE 2.84Å; I148-R232 PolarHBondContact O-NH1 2.98Å; I148-R232 PolarHBondContact O-NH2 2.83Å; L149-R232 PolarHBondContact O-NH1 3.14Å; L151-R232 HydrophobicContact CD2-CB 3.56Å; E220-R232 CarbonylContact C-O 3.53Å; E220-R232 WeakPolarHBondContact CA-O 3.38Å; C221-R232 PolarHBondContact N-O 2.75Å; C221-R232 PolarHBondContact O-N 2.72Å
233	K	89.6	Confident	88.4	Confident	134 Å²	134	51.7 Å²	51.7	58%	0.583	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	147.5	-178.1	-56.8	-174.8	-177	177.3	0	111.5	L218 W219 E220	L218-K233 HydrophobicContact CD1-CB 3.97Å; L218-K233 HydrophobicContact CD2-CB 4.34Å; L218-K233 HydrophobicContact CD2-CD 3.72Å; L218-K233 HydrophobicContact CG-CB 4.12Å; L218-K233 HydrophobicContact CG-CD 4.31Å; W219-K233 CarbonylContact O-C 3.57Å; W219-K233 WeakPolarHBondContact O-CA 3.11Å; W219-K233 WeakPolarHBondContact O-CB 3.3Å; E220-K233 HydrophobicContact CB-CG 4.07Å; E220-K233 HydrophobicContact CG-CG 4.1Å; E220-K233 WeakPolarHBondContact OE1-CE 3.34Å
234	F	88.3	Confident	88.3	Confident	6 Å²	6	52 Å²	52	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	154.4	178.7	67.1	-77	0	0	0	110.7	L151 V165 L182 W219 V236	L151-F234 HydrophobicContact CD1-CD1 4.28Å; L151-F234 HydrophobicContact CD1-CE1 4.25Å; L151-F234 HydrophobicContact CD2-CD1 3.8Å; L151-F234 HydrophobicContact CD2-CE1 4.46Å; L151-F234 HydrophobicContact CD2-CG 4.49Å; L151-F234 HydrophobicContact CG-CD1 4.19Å; V165-F234 HydrophobicContact CG1-CZ 4.04Å; V165-F234 HydrophobicContact CG2-CZ 4.41Å; L182-F234 HydrophobicContact CD1-CE1 3.68Å; L182-F234 HydrophobicContact CD1-CZ 3.87Å; W219-F234 HydrophobicContact CB-CD1 3.99Å; W219-F234 HydrophobicContact CB-CD2 4.4Å; W219-F234 HydrophobicContact CB-CE1 3.51Å; W219-F234 HydrophobicContact CB-CE2 3.95Å; W219-F234 HydrophobicContact CB-CG 4.43Å; W219-F234 HydrophobicContact CB-CZ 3.49Å; W219-F234 VanDerWaalsContact CB-CZ 3.49Å; W219-F234 HydrophobicContact CG-CE2 4.46Å; W219-F234 HydrophobicContact CG-CZ 4.21Å; W219-F234 PolarHBondContact N-O 3.35Å; W219-F234 PolarHBondContact O-N 2.89Å; F234-V236 HydrophobicContact CD2-CG2 4.02Å; F234-V236 HydrophobicContact CE2-CG2 3.55Å; F234-V236 HydrophobicContact CZ-CG2 4.43Å
235	N	86.9	Confident	88.4	Confident	76 Å²	76	53.2 Å²	53.2	41%	0.406	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	140.3	178.4	-78.2	-34.6	0	0	0	111.5	L155 G217 L218	L155-N235 PolarHBondContact N-O 2.84Å; G217-N235 WeakPolarHBondContact O-CA 3.28Å; L218-N235 WeakPolarHBondContact CD1-OD1 3.49Å
236	V	87.2	Confident	88.6	Confident	2 Å²	2	54 Å²	54	1%	0.012	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116	170.7	-179.4	0	0	0	0	108.5	L155 G216 G217 W219 F234	L155-V236 HydrophobicContact CB-CG2 4.39Å; L155-V236 HydrophobicContact CD2-CG2 4.46Å; L155-V236 CarbonylContact O-C 2.94Å; L155-V236 WeakPolarHBondContact O-CA 3.29Å; G216-V236 WeakPolarHBondContact CA-O 3.45Å; G217-V236 PolarHBondContact N-O 2.82Å; G217-V236 PolarHBondContact O-N 3.49Å; W219-V236 HydrophobicContact CB-CG2 4.4Å; W219-V236 HydrophobicContact CD2-CG2 4.14Å; W219-V236 HydrophobicContact CG-CG2 3.77Å; F234-V236 HydrophobicContact CD2-CG2 4.02Å; F234-V236 HydrophobicContact CE2-CG2 3.55Å; F234-V236 HydrophobicContact CZ-CG2 4.43Å
237	T	87	Confident	89.2	Confident	66 Å²	66	49.8 Å²	49.8	41%	0.405	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.5	176.6	-57.4	0	0	0	0	109.3	L155 E156 C157 K239	L155-T237 PolarHBondContact O-N 3.14Å; E156-T237 WeakPolarHBondContact CA-O 3.29Å; C157-T237 PolarHBondContact N-O 3.38Å; T237-K239 HydrophobicContact CG2-CD 4.34Å
238	I	88.4	Confident	90.2	Very high	31 Å²	31	49.1 Å²	49.1	16%	0.159	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.8	179.4	-56.1	178.4	0	0	0	109.2	C157 L159 L211 S212 Q215 G216	C157-I238 CarbonylContact O-C 3.53Å; C157-I238 VanDerWaalsContact O-CA 3.31Å; C157-I238 WeakPolarHBondContact O-CA 3.43Å; L159-I238 HydrophobicContact CB-CG2 4.33Å; L159-I238 HydrophobicContact CD1-CG2 4.12Å; L211-I238 HydrophobicContact CB-CD1 4.22Å; L211-I238 HydrophobicContact CD1-CG1 4.48Å; L211-I238 HydrophobicContact CD2-CD1 4.39Å; S212-I238 WeakPolarHBondContact O-CD1 3.38Å; Q215-I238 HydrophobicContact CB-CD1 4.2Å; G216-I238 VanDerWaalsContact N-CD1 3.27Å
239	K	89.5	Confident	90.7	Very high	54 Å²	54	53.4 Å²	53.4	24%	0.235	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146.7	-179.3	-61.4	-65.2	-168.5	178.9	0	110.9	E156 C157 N158 L159 T237 D269 R319	E156-K239 HydrophobicContact CG-CD 4.35Å; E156-K239 HydrophobicContact CG-CG 3.5Å; E156-K239 WeakPolarHBondContact OE2-CE 3.42Å; E156-K239 IonicContact OE2-NZ 2.7Å; C157-K239 PolarHBondContact O-N 3.22Å; N158-K239 CarbonylContact C-O 3.55Å; N158-K239 WeakPolarHBondContact CA-O 3.23Å; L159-K239 PolarHBondContact N-O 3.49Å; T237-K239 HydrophobicContact CG2-CD 4.34Å; K239-D269 WeakPolarHBondContact CA-OD2 3.13Å; K239-D269 HydrophobicContact CB-CB 4.21Å; K239-D269 HydrophobicContact CD-CB 4.07Å; K239-R319 VanDerWaalsContact CB-CZ 3.41Å
240	V	91.4	Very high	90.9	Very high	69 Å²	69	49.4 Å²	49.4	42%	0.418	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-92.3	124.5	178.7	-176.9	0	0	0	0	109.5	D269	V240-D269 PolarHBondContact N-OD2 3.26Å; V240-D269 PolarHBondContact O-N 3.37Å
241	P	91.4	Very high	90.8	Very high	20 Å²	20	51 Å²	51	13%	0.13	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-57.4	145.5	175	-27.7	37	0	0	0	113.4	N158 G323	N158-P241 HydrophobicContact CB-CG 4.32Å; P241-G323 VanDerWaalsContact CG-O 3.23Å; P241-G323 WeakPolarHBondContact CG-O 3.22Å
242	P	91.9	Very high	90.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-76.9	133.5	-175.3	29.6	-34.3	0	0	0	112.8	K267 I272 L317 R319 G326	P242-K267 CarbonylContact C-O 3.46Å; P242-K267 WeakPolarHBondContact CA-O 3.34Å; P242-I272 HydrophobicContact CB-CG1 4.15Å; P242-I272 HydrophobicContact CG-CG1 4.17Å; P242-L317 HydrophobicContact CB-CB 3.99Å; P242-L317 HydrophobicContact CB-CD1 4.35Å; P242-L317 HydrophobicContact CG-CB 3.72Å; P242-R319 HydrophobicContact CG-CB 4.32Å; P242-G326 WeakPolarHBondContact O-CA 3.34Å
243	V	93	Very high	90.3	Very high	49 Å²	49	53.5 Å²	53.5	30%	0.297	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.1	179.1	-176.2	0	0	0	0	110.2	H266 K267 E327	V243-H266 CarbonylContact O-C 3.53Å; V243-H266 VanDerWaalsContact O-CA 3.27Å; V243-H266 WeakPolarHBondContact O-CA 3.28Å; V243-H266 WeakPolarHBondContact O-CB 3.45Å; V243-K267 PolarHBondContact N-O 3.2Å; V243-K267 PolarHBondContact O-N 3.43Å; V243-E327 HydrophobicContact CG1-CB 4.26Å; V243-E327 HydrophobicContact CG2-CB 4.15Å
244	P	92.5	Very high	89.9	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.032	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	137.5	175.7	-20.3	30.3	0	0	0	112.2	V263 V315 L317	P244-V263 HydrophobicContact CB-CB 4.49Å; P244-V263 HydrophobicContact CB-CG2 3.74Å; P244-V315 HydrophobicContact CG-CB 4.22Å; P244-V315 HydrophobicContact CG-CG1 4.29Å; P244-L317 HydrophobicContact CB-CD1 4.45Å; P244-L317 HydrophobicContact CG-CD1 3.78Å; P244-L317 HydrophobicContact CG-CG 3.82Å
245	T	91.6	Very high	89.6	Confident	60 Å²	60	53.7 Å²	53.7	37%	0.368	28%	0.278	S	S	.	.			trans	-101.7	-21.2	177	59.9	0	0	0	0	113.7	S265 K267	T245-S265 PolarHBondContact N-O 3.32Å; T245-S265 PolarHBondContact OG1-O 3.39Å; T245-S265 PolarHBondContact OG1-OG 3.3Å; T245-K267 HydrophobicContact CG2-CB 4.36Å; T245-K267 HydrophobicContact CG2-CD 3.93Å; T245-K267 HydrophobicContact CG2-CG 3.63Å
246	T	91.2	Very high	89.2	Confident	36 Å²	36	55.5 Å²	55.5	22%	0.221	28%	0.283	C	S	.	.	S	Bend	trans	-111.4	150	-179.8	56.8	0	0	0	0	110.9	E264	T246-E264 HydrophobicContact CG2-CB 4.38Å; T246-E264 PolarHBondContact OG1-N 3.4Å; T246-E264 VanDerWaalsContact OG1-N 3.08Å
247	A	92.6	Very high	89.1	Confident	42 Å²	42	58.7 Å²	58.7	35%	0.347	30%	0.297	S	S	.	.			trans	-76.7	153.1	175	0	0	0	0	0	110.5	P330 A332	A247-P330 HydrophobicContact CB-CB 4.23Å; A247-P330 HydrophobicContact CB-CG 4.04Å; A247-A332 HydrophobicContact CB-CB 4.2Å
248	P	93.4	Very high	89.1	Confident	7 Å²	7	55.6 Å²	55.6	5%	0.045	28%	0.278	C	S	.	.			trans	-64.6	143.9	177.7	22.8	-29.3	0	0	0	111.6	V260 M261 P262 V313 V315 P330 A332 M334	P248-V260 HydrophobicContact CB-CG1 3.62Å; P248-M261 CarbonylContact C-O 3.55Å; P248-M261 VanDerWaalsContact CA-O 3.29Å; P248-M261 WeakPolarHBondContact CA-O 3.09Å; P248-P262 WeakPolarHBondContact CA-O 3.47Å; P248-V313 HydrophobicContact CB-CG1 4.44Å; P248-V313 HydrophobicContact CG-CB 4.16Å; P248-V313 HydrophobicContact CG-CG1 3.96Å; P248-V313 WeakPolarHBondContact CG-O 3.4Å; P248-V315 HydrophobicContact CB-CG2 3.9Å; P248-V315 HydrophobicContact CG-CG2 4Å; P248-P330 WeakPolarHBondContact CD-O 3.32Å; P248-A332 HydrophobicContact CG-CB 4.05Å; P248-A332 WeakPolarHBondContact O-CB 3.28Å; P248-M334 HydrophobicContact CB-CE 4.36Å
249	K	93.4	Very high	89.1	Confident	120 Å²	120	55.8 Å²	55.8	52%	0.522	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.4	-174.4	-176.9	-178.9	-178.5	179.6	0	111.5	V260 M261 M334	K249-V260 CarbonylContact O-C 3.51Å; K249-V260 WeakPolarHBondContact O-CA 3.32Å; K249-M261 HydrophobicContact CB-CB 4.22Å; K249-M261 PolarHBondContact N-O 3.08Å; K249-M261 PolarHBondContact O-N 3.31Å; K249-M334 VanDerWaalsContact C-CE 3.43Å
250	L	93	Very high	89.2	Confident	62 Å²	62	53.2 Å²	53.2	33%	0.325	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	127.4	176.9	-175.8	65.6	0	0	0	109.6	E252 K253 L258 M334	L250-E252 VanDerWaalsContact CD1-O 3.29Å; L250-E252 WeakPolarHBondContact CD1-O 3.23Å; L250-K253 HydrophobicContact CD2-CB 4.42Å; L250-L258 HydrophobicContact CD1-CB 3.98Å; L250-L258 HydrophobicContact CD1-CD2 3.8Å; L250-L258 HydrophobicContact CD1-CG 4.39Å; L250-M334 HydrophobicContact CB-CE 3.77Å; L250-M334 HydrophobicContact CB-CG 4.29Å; L250-M334 HydrophobicContact CB-SD 4.2Å; L250-M334 HydrophobicContact CD1-CB 4.49Å; L250-M334 HydrophobicContact CD1-SD 4.02Å; L250-M334 HydrophobicContact CD2-CB 4.48Å
251	L	91.2	Very high	89.2	Confident	75 Å²	75	52.3 Å²	52.3	39%	0.393	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-48.7	176.8	-57.6	-176.6	0	0	0	111.4	L259 M261 P299	L251-L259 HydrophobicContact CB-CB 4.45Å; L251-L259 HydrophobicContact CB-CD2 4.12Å; L251-L259 HydrophobicContact CB-CG 4.2Å; L251-L259 HydrophobicContact CD1-CD2 4.41Å; L251-L259 HydrophobicContact CD1-CG 4.41Å; L251-L259 PolarHBondContact N-O 2.87Å; L251-M261 HydrophobicContact CD1-CB 4.2Å; L251-M261 HydrophobicContact CD1-CE 4.09Å; L251-M261 HydrophobicContact CD2-CB 4.22Å; L251-M261 HydrophobicContact CG-CB 4.21Å; L251-P299 HydrophobicContact CD1-CB 3.7Å; L251-P299 HydrophobicContact CD1-CG 3.58Å
252	E	87.6	Confident	88.8	Confident	113 Å²	113	51.3 Å²	51.3	53%	0.528	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.2	177.9	-62.8	-178.3	-168.4	0	0	110.4	L250 L259	L250-E252 VanDerWaalsContact CD1-O 3.29Å; L250-E252 WeakPolarHBondContact CD1-O 3.23Å; E252-L259 HydrophobicContact CB-CB 3.86Å; E252-L259 HydrophobicContact CB-CD2 4.19Å; E252-L259 HydrophobicContact CG-CD2 4.03Å; E252-L259 PolarHBondContact N-O 3.11Å; E252-L259 PolarHBondContact O-N 3.19Å
253	K	85.9	Confident	88.5	Confident	97 Å²	97	51.9 Å²	51.9	42%	0.422	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.4	174.6	54	167.9	-175.1	152.2	0	110.5	L250 L258 E335 D337	L250-K253 HydrophobicContact CD2-CB 4.42Å; K253-L258 HydrophobicContact CB-CD2 3.65Å; K253-E335 WeakPolarHBondContact CD-O 3.43Å; K253-D337 VanDerWaalsContact CD-OD1 3.27Å; K253-D337 WeakPolarHBondContact CD-OD1 3.45Å; K253-D337 WeakPolarHBondContact CE-OD1 3.37Å; K253-D337 IonicContact NZ-OD1 3.4Å; K253-D337 PolarHBondContact NZ-OD1 3.4Å
254	R	81	Confident	88	Confident	132 Å²	132	56.1 Å²	56.1	50%	0.498	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	177.8	172.9	-60.3	-172.5	179.1	-157.6	0.4	109.3	K256 Q257 T336 D337	R254-K256 VanDerWaalsContact C-N 3.25Å; R254-K256 PolarHBondContact O-N 2.86Å; R254-Q257 HydrophobicContact CB-CB 4.2Å; R254-Q257 PolarHBondContact N-O 2.99Å; R254-T336 WeakPolarHBondContact O-CB 3.33Å; R254-D337 PolarHBondContact O-N 3.41Å
255	S	80.9	Confident	87.7	Confident	12 Å²	12	58.5 Å²	58.5	8%	0.084	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-32.6	-177.5	62.8	0	0	0	0	114.2	P307 D337 C338 E340	S255-P307 WeakPolarHBondContact O-CA 3.39Å; S255-P307 WeakPolarHBondContact O-CB 3.32Å; S255-P307 WeakPolarHBondContact O-CG 3.41Å; S255-D337 WeakPolarHBondContact CA-O 3.41Å; S255-C338 VanDerWaalsContact CB-O 3.22Å; S255-C338 WeakPolarHBondContact CB-O 3.17Å; S255-E340 PolarHBondContact OG-OE1 2.68Å
256	K	79.4	Confident	87.6	Confident	114 Å²	114	58.9 Å²	58.9	50%	0.496	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	14	179.7	-61	-168.6	177.2	-177.4	0	113.7	R254 M303 N304 L305 P307	R254-K256 VanDerWaalsContact C-N 3.25Å; R254-K256 PolarHBondContact O-N 2.86Å; K256-M303 CarbonylContact O-C 3.56Å; K256-N304 PolarHBondContact O-N 3.08Å; K256-N304 VanDerWaalsContact O-N 3.16Å; K256-L305 WeakPolarHBondContact CA-O 3.17Å; K256-L305 VanDerWaalsContact CB-O 3.29Å; K256-L305 WeakPolarHBondContact CB-O 3.33Å; K256-L305 VanDerWaalsContact CG-O 3.3Å; K256-L305 WeakPolarHBondContact CG-O 3.37Å; K256-L305 PolarHBondContact O-N 2.78Å; K256-P307 HydrophobicContact CG-CG 4.03Å
257	Q	85.3	Confident	87.6	Confident	69 Å²	69	64.5 Å²	64.5	32%	0.322	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.1	-171.2	-54	176	-13.1	0	0	111.7	R254 T301 L302 M303	R254-Q257 HydrophobicContact CB-CB 4.2Å; R254-Q257 PolarHBondContact N-O 2.99Å; Q257-T301 HydrophobicContact CB-CG2 4.33Å; Q257-L302 CarbonylContact C-O 3.55Å; Q257-L302 WeakPolarHBondContact CA-O 3.44Å; Q257-L302 WeakPolarHBondContact CB-O 3.26Å; Q257-M303 HydrophobicContact CG-CG 4.3Å
258	L	85.8	Confident	87.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	127.1	171.8	-61.5	171	0	0	0	108.9	L250 K253 V260 T301 L302 L305 Y311 M334 E335 T336	L250-L258 HydrophobicContact CD1-CB 3.98Å; L250-L258 HydrophobicContact CD1-CD2 3.8Å; L250-L258 HydrophobicContact CD1-CG 4.39Å; K253-L258 HydrophobicContact CB-CD2 3.65Å; L258-V260 HydrophobicContact CB-CG2 4.08Å; L258-T301 CarbonylContact O-C 3.56Å; L258-T301 WeakPolarHBondContact O-CA 3.28Å; L258-L302 HydrophobicContact CB-CB 4.27Å; L258-L302 PolarHBondContact N-O 2.96Å; L258-L302 PolarHBondContact O-N 2.91Å; L258-L305 HydrophobicContact CB-CD1 4.11Å; L258-L305 HydrophobicContact CD1-CD1 3.54Å; L258-L305 HydrophobicContact CG-CD1 3.53Å; L258-Y311 HydrophobicContact CD1-CD2 4.37Å; L258-M334 HydrophobicContact CD1-CB 3.75Å; L258-M334 HydrophobicContact CD1-SD 4.47Å; L258-E335 WeakPolarHBondContact CD2-O 3.31Å; L258-T336 HydrophobicContact CD1-CG2 4.26Å; L258-T336 HydrophobicContact CD2-CG2 3.99Å; L258-T336 HydrophobicContact CG-CG2 3.94Å
259	L	89.9	Confident	86.9	Confident	36 Å²	36	67 Å²	67	19%	0.188	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	116.7	171.4	-173.5	66.9	0	0	0	109	L251 E252 P299 T301	L251-L259 HydrophobicContact CB-CB 4.45Å; L251-L259 HydrophobicContact CB-CD2 4.12Å; L251-L259 HydrophobicContact CB-CG 4.2Å; L251-L259 HydrophobicContact CD1-CD2 4.41Å; L251-L259 HydrophobicContact CD1-CG 4.41Å; L251-L259 PolarHBondContact N-O 2.87Å; E252-L259 HydrophobicContact CB-CB 3.86Å; E252-L259 HydrophobicContact CB-CD2 4.19Å; E252-L259 HydrophobicContact CG-CD2 4.03Å; E252-L259 PolarHBondContact N-O 3.11Å; E252-L259 PolarHBondContact O-N 3.19Å; L259-P299 HydrophobicContact CD1-CB 3.68Å; L259-P299 HydrophobicContact CD2-CB 4.36Å; L259-P299 HydrophobicContact CG-CB 3.94Å; L259-T301 WeakPolarHBondContact CD1-OG1 3.39Å
260	V	90.2	Very high	85.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.5	-167.2	178.9	0	0	0	0	110.8	P248 K249 L258 P262 L277 I300 L302 M334	P248-V260 HydrophobicContact CB-CG1 3.62Å; K249-V260 CarbonylContact O-C 3.51Å; K249-V260 WeakPolarHBondContact O-CA 3.32Å; L258-V260 HydrophobicContact CB-CG2 4.08Å; V260-P262 WeakPolarHBondContact O-CD 3.19Å; V260-L277 HydrophobicContact CB-CD2 4.1Å; V260-L277 HydrophobicContact CG1-CD1 4.43Å; V260-L277 HydrophobicContact CG1-CD2 4.04Å; V260-I300 PolarHBondContact N-O 3.38Å; V260-I300 PolarHBondContact O-N 2.8Å; V260-L302 HydrophobicContact CG2-CD1 4.04Å; V260-L302 HydrophobicContact CG2-CG 4.45Å; V260-M334 HydrophobicContact CB-CE 4.29Å; V260-M334 HydrophobicContact CB-SD 4.45Å; V260-M334 HydrophobicContact CG1-CE 3.64Å; V260-M334 HydrophobicContact CG1-SD 4.23Å; V260-M334 HydrophobicContact CG2-CE 3.87Å; V260-M334 HydrophobicContact CG2-SD 3.45Å; V260-M334 WeakPolarHBondContact CG2-SD 3.18Å
261	M	91.1	Very high	85.6	Confident	49 Å²	49	64 Å²	64	24%	0.241	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	118.6	165.1	-171.5	64	79	0	0	109	P248 K249 L251 P299	P248-M261 CarbonylContact C-O 3.55Å; P248-M261 VanDerWaalsContact CA-O 3.29Å; P248-M261 WeakPolarHBondContact CA-O 3.09Å; K249-M261 HydrophobicContact CB-CB 4.22Å; K249-M261 PolarHBondContact N-O 3.08Å; K249-M261 PolarHBondContact O-N 3.31Å; L251-M261 HydrophobicContact CD1-CB 4.2Å; L251-M261 HydrophobicContact CD1-CE 4.09Å; L251-M261 HydrophobicContact CD2-CB 4.22Å; L251-M261 HydrophobicContact CG-CB 4.21Å; M261-P299 HydrophobicContact CE-CG 3.95Å
262	P	84.6	Confident	85.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.317	C	S	.	.			trans	-72.2	-50.3	-167.6	-19.7	33.9	0	0	0	113.3	P248 V260 T275 L277 E298 I300 V315	P248-P262 WeakPolarHBondContact CA-O 3.47Å; V260-P262 WeakPolarHBondContact O-CD 3.19Å; P262-T275 HydrophobicContact CB-CG2 3.68Å; P262-T275 HydrophobicContact CG-CG2 4.26Å; P262-L277 HydrophobicContact CB-CD1 3.88Å; P262-L277 HydrophobicContact CG-CD1 4.39Å; P262-E298 WeakPolarHBondContact CD-O 3.26Å; P262-I300 HydrophobicContact CB-CD1 4.1Å; P262-I300 HydrophobicContact CG-CB 4.32Å; P262-I300 HydrophobicContact CG-CD1 3.28Å; P262-I300 HydrophobicContact CG-CG1 3.53Å; P262-V315 HydrophobicContact CB-CG1 4.21Å; P262-V315 HydrophobicContact CB-CG2 4.16Å; P262-V315 WeakPolarHBondContact O-CG2 3.41Å
263	V	85.2	Confident	85.1	Confident	12 Å²	12	60.1 Å²	60.1	7%	0.073	31%	0.311	C	S	.	.			trans	-155.7	138.5	-175	65	0	0	0	0	109.9	P244 S265 L317	P244-V263 HydrophobicContact CB-CB 4.49Å; P244-V263 HydrophobicContact CB-CG2 3.74Å; V263-S265 WeakPolarHBondContact CG2-O 3.28Å; V263-L317 HydrophobicContact CG1-CD1 4.29Å; V263-L317 HydrophobicContact CG1-CD2 4.14Å
264	E	83.1	Confident	85	Confident	138 Å²	138	56.1 Å²	56.1	65%	0.645	30%	0.295	S	S	*	.	S	Bend	trans	-92.2	-33.6	173.2	-67.5	-178.7	175.7	0	0	111.2	T246	T246-E264 HydrophobicContact CG2-CB 4.38Å; T246-E264 PolarHBondContact OG1-N 3.4Å; T246-E264 VanDerWaalsContact OG1-N 3.08Å
265	S	85.6	Confident	85.2	Confident	54 Å²	54	49.9 Å²	49.9	38%	0.378	27%	0.272	S	S	.	.			trans	-152.6	150.8	178.4	56.4	0	0	0	0	113.8	T245 V263	T245-S265 PolarHBondContact N-O 3.32Å; T245-S265 PolarHBondContact OG1-O 3.39Å; T245-S265 PolarHBondContact OG1-OG 3.3Å; V263-S265 WeakPolarHBondContact CG2-O 3.28Å
266	H	89.9	Confident	85.5	Confident	68 Å²	68	50.5 Å²	50.5	32%	0.315	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	158.3	-179.2	66.1	-78.8	0	0	0	111.4	V243 I272 L317	V243-H266 CarbonylContact O-C 3.53Å; V243-H266 VanDerWaalsContact O-CA 3.27Å; V243-H266 WeakPolarHBondContact O-CA 3.28Å; V243-H266 WeakPolarHBondContact O-CB 3.45Å; H266-I272 WeakPolarHBondContact CE1-CD1 3.35Å; H266-I272 WeakPolarHBondContact NE2-CD1 3.32Å; H266-L317 HydrophobicContact CB-CD1 3.54Å
267	K	90.3	Very high	86	Confident	155 Å²	155	45.1 Å²	45.1	67%	0.674	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	163.7	167.1	-72.9	174.1	-176.3	-177.7	0	109.6	P242 V243 T245	P242-K267 CarbonylContact C-O 3.46Å; P242-K267 WeakPolarHBondContact CA-O 3.34Å; V243-K267 PolarHBondContact N-O 3.2Å; V243-K267 PolarHBondContact O-N 3.43Å; T245-K267 HydrophobicContact CG2-CB 4.36Å; T245-K267 HydrophobicContact CG2-CD 3.93Å; T245-K267 HydrophobicContact CG2-CG 3.63Å
268	G	87.4	Confident	86.3	Confident	38 Å²	38	42.7 Å²	42.7	39%	0.392	24%	0.239	S	C	.	.	S	Bend	trans	102.6	-178.1	180	0	0	0	0	0	112.6
269	D	83.5	Confident	86.6	Confident	62 Å²	62	44.5 Å²	44.5	33%	0.332	25%	0.246	S	C	.	.			trans	-97.6	133.2	-175.4	-63	-51.9	0	0	0	111.4	K239 V240 R319	K239-D269 WeakPolarHBondContact CA-OD2 3.13Å; K239-D269 HydrophobicContact CB-CB 4.21Å; K239-D269 HydrophobicContact CD-CB 4.07Å; V240-D269 PolarHBondContact N-OD2 3.26Å; V240-D269 PolarHBondContact O-N 3.37Å; D269-R319 WeakPolarHBondContact O-CD 3.38Å; D269-R319 PolarHBondContact O-NE 3.32Å; D269-R319 VanDerWaalsContact O-NE 3.14Å
270	G	74.1	Confident	86.6	Confident	39 Å²	39	44.7 Å²	44.7	40%	0.402	25%	0.245	S	C	.	.	S	Bend	trans	-75.7	-177.6	173.9	0	0	0	0	0	114.1	R319	G270-R319 PolarHBondContact O-NH2 2.9Å
271	P	86.4	Confident	86.7	Confident	80 Å²	80	46.2 Å²	46.2	52%	0.519	26%	0.255	S	S	.	.			cis	-80.1	149.1	-6.7	32.8	-33.8	0	0	0	112.3	R319 P320	P271-R319 WeakPolarHBondContact O-CA 3.32Å; P271-R319 WeakPolarHBondContact O-CB 3.39Å; P271-P320 HydrophobicContact CG-CG 4.27Å; P271-P320 VanDerWaalsContact O-CD 3.29Å; P271-P320 WeakPolarHBondContact O-CD 3.28Å
272	I	83.4	Confident	86.6	Confident	30 Å²	30	46 Å²	46	15%	0.154	26%	0.256	C	S	.	.			trans	-75.9	131.5	168.1	-62.6	162.9	0	0	0	108	P242 H266 D296 L317	P242-I272 HydrophobicContact CB-CG1 4.15Å; P242-I272 HydrophobicContact CG-CG1 4.17Å; H266-I272 WeakPolarHBondContact CE1-CD1 3.35Å; H266-I272 WeakPolarHBondContact NE2-CD1 3.32Å; I272-D296 HydrophobicContact CB-CB 4.45Å; I272-D296 HydrophobicContact CD1-CB 4.05Å; I272-D296 WeakPolarHBondContact CD1-OD2 3.27Å; I272-D296 HydrophobicContact CG2-CB 4.08Å; I272-L317 HydrophobicContact CD1-CD1 3.91Å; I272-L317 HydrophobicContact CD1-CD2 4.37Å; I272-L317 HydrophobicContact CG2-CB 4.46Å; I272-L317 HydrophobicContact CG2-CD2 4.2Å
273	I	83.9	Confident	86.5	Confident	78 Å²	78	55 Å²	55	40%	0.4	30%	0.299	S	S	.	.			trans	-109	-23.7	175.5	55.4	165.6	0	0	0	113	Y294 S318 P320	I273-Y294 WeakPolarHBondContact O-CA 3.2Å; I273-Y294 WeakPolarHBondContact O-CD1 3.31Å; I273-S318 VanDerWaalsContact CG1-O 3.29Å; I273-S318 WeakPolarHBondContact CG1-O 3.4Å; I273-S318 PolarHBondContact N-O 3.45Å; I273-P320 HydrophobicContact CD1-CG 4.43Å; I273-P320 HydrophobicContact CG2-CG 3.64Å
274	S	83.4	Confident	85.8	Confident	13 Å²	13	58.7 Å²	58.7	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	150.8	176.7	67.3	0	0	0	0	113	V293 S318	S274-V293 CarbonylContact C-O 3.55Å; S274-V293 WeakPolarHBondContact CA-O 3.34Å; S274-S318 PolarHBondContact N-O 3.3Å; S274-S318 PolarHBondContact O-N 2.82Å; S274-S318 WeakPolarHBondContact OG-CB 3.49Å
275	T	85.4	Confident	84.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	111.9	179	-56.6	0	0	0	0	107.2	P262 V293 S295 D296 I300 V315 L317	P262-T275 HydrophobicContact CB-CG2 3.68Å; P262-T275 HydrophobicContact CG-CG2 4.26Å; T275-V293 PolarHBondContact N-O 3.46Å; T275-V293 PolarHBondContact O-N 3.3Å; T275-S295 WeakPolarHBondContact CB-O 3.41Å; T275-S295 PolarHBondContact OG1-O 2.86Å; T275-D296 WeakPolarHBondContact OG1-CA 3.47Å; T275-I300 HydrophobicContact CG2-CD1 4.16Å; T275-V315 HydrophobicContact CG2-CG1 3.51Å; T275-L317 HydrophobicContact CG2-CD2 3.87Å
276	K	88.1	Confident	83.7	Confident	26 Å²	26	65.8 Å²	65.8	11%	0.113	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	109.7	176.3	-174	-175.6	-56.7	163.3	0	108.6	L278 I291 I292 V315 Q316 E325	K276-L278 HydrophobicContact CG-CD1 4.3Å; K276-L278 HydrophobicContact CG-CG 4.48Å; K276-I291 CarbonylContact C-O 3.56Å; K276-I291 VanDerWaalsContact CA-O 3.23Å; K276-I291 WeakPolarHBondContact CA-O 3.45Å; K276-I292 HydrophobicContact CB-CG1 4.16Å; K276-I292 HydrophobicContact CD-CG1 4.46Å; K276-I292 HydrophobicContact CG-CG1 3.9Å; K276-V315 CarbonylContact O-C 3.44Å; K276-V315 WeakPolarHBondContact O-CA 3Å; K276-Q316 HydrophobicContact CB-CB 4.24Å; K276-Q316 PolarHBondContact N-O 3.43Å; K276-Q316 PolarHBondContact O-N 2.79Å; K276-E325 VanDerWaalsContact NZ-CD 3.26Å; K276-E325 IonicContact NZ-OE1 2.79Å; K276-E325 PolarHBondContact NZ-OE1 2.9Å; K276-E325 IonicContact NZ-OE2 3.73Å; K276-E325 PolarHBondContact NZ-OE2 3.4Å
277	L	89.3	Confident	83	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118.1	174.5	-145.4	80.7	0	0	0	108.3	V260 P262 S290 I291 I300 L302 V313 V315	V260-L277 HydrophobicContact CB-CD2 4.1Å; V260-L277 HydrophobicContact CG1-CD1 4.43Å; V260-L277 HydrophobicContact CG1-CD2 4.04Å; P262-L277 HydrophobicContact CB-CD1 3.88Å; P262-L277 HydrophobicContact CG-CD1 4.39Å; L277-S290 CarbonylContact O-C 3.5Å; L277-S290 VanDerWaalsContact O-CA 3.27Å; L277-S290 WeakPolarHBondContact O-CA 3.14Å; L277-I291 HydrophobicContact CB-CD1 4.09Å; L277-I291 HydrophobicContact CB-CG1 3.62Å; L277-I291 HydrophobicContact CD2-CD1 4.35Å; L277-I291 PolarHBondContact N-O 2.87Å; L277-I291 PolarHBondContact O-N 3.41Å; L277-I300 HydrophobicContact CD1-CD1 4.35Å; L277-I300 HydrophobicContact CD2-CB 4.42Å; L277-I300 HydrophobicContact CD2-CG2 4.17Å; L277-L302 HydrophobicContact CD2-CD1 4.01Å; L277-L302 HydrophobicContact CD2-CD2 3.92Å; L277-L302 HydrophobicContact CD2-CG 3.86Å; L277-V313 HydrophobicContact CD2-CG1 3.97Å; L277-V313 HydrophobicContact CG-CG1 3.93Å; L277-V315 HydrophobicContact CD1-CB 4.39Å; L277-V315 HydrophobicContact CD1-CG1 4.47Å; L277-V315 HydrophobicContact CD1-CG2 3.38Å
278	L	91.3	Very high	82.8	Confident	18 Å²	18	67.1 Å²	67.1	9%	0.094	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.9	177	-60.3	100	0	0	0	109.6	K276 W288 S289 V313 R314 Q316	K276-L278 HydrophobicContact CG-CD1 4.3Å; K276-L278 HydrophobicContact CG-CG 4.48Å; L278-W288 HydrophobicContact CB-CB 4.36Å; L278-W288 HydrophobicContact CB-CD2 4.25Å; L278-W288 HydrophobicContact CB-CE3 3.73Å; L278-W288 HydrophobicContact CB-CZ3 4.35Å; L278-W288 HydrophobicContact CD2-CB 4.02Å; L278-W288 HydrophobicContact CD2-CG 4.37Å; L278-S289 CarbonylContact C-O 3.57Å; L278-S289 VanDerWaalsContact CA-O 3.26Å; L278-S289 WeakPolarHBondContact CA-O 3.3Å; L278-V313 CarbonylContact O-C 3.48Å; L278-V313 VanDerWaalsContact O-CA 3.27Å; L278-V313 WeakPolarHBondContact O-CA 3.48Å; L278-R314 HydrophobicContact CB-CG 3.89Å; L278-R314 HydrophobicContact CD1-CG 4.25Å; L278-R314 PolarHBondContact N-O 3.4Å; L278-R314 PolarHBondContact O-N 2.8Å; L278-Q316 HydrophobicContact CD1-CB 3.86Å
279	Y	91.8	Very high	82.7	Confident	39 Å²	39	68 Å²	68	15%	0.153	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	151.6	178.8	66.1	-78.1	0	0	0	112.6	S289 I291 L302 L305 Y311 R312	Y279-S289 PolarHBondContact N-O 3.01Å; Y279-S289 PolarHBondContact O-N 2.75Å; Y279-I291 HydrophobicContact CE1-CG2 4.34Å; Y279-L302 HydrophobicContact CD1-CD1 4.47Å; Y279-L302 HydrophobicContact CD1-CD2 3.34Å; Y279-L302 HydrophobicContact CD2-CD2 4.48Å; Y279-L302 HydrophobicContact CE1-CD2 3.54Å; Y279-L302 HydrophobicContact CG-CD1 4.21Å; Y279-L302 HydrophobicContact CG-CD2 3.86Å; Y279-L305 HydrophobicContact CD2-CD2 3.75Å; Y279-L305 HydrophobicContact CE2-CD2 3.49Å; Y279-L305 VanDerWaalsContact CE2-CD2 3.49Å; Y279-Y311 HydrophobicContact CD2-CD1 4.1Å; Y279-Y311 HydrophobicContact CD2-CE1 4.35Å; Y279-R312 CarbonylContact C-O 3.48Å; Y279-R312 WeakPolarHBondContact CA-O 3.43Å
280	K	90.9	Very high	82.7	Confident	39 Å²	39	68.1 Å²	68.1	17%	0.17	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	151.9	172.1	64.8	178.2	-174.7	172.8	0	112.1	W288 Y311 R312	K280-W288 HydrophobicContact CB-CE3 4.23Å; K280-W288 HydrophobicContact CD-CD2 3.84Å; K280-W288 HydrophobicContact CD-CE3 4.16Å; K280-W288 HydrophobicContact CD-CG 4.32Å; K280-W288 HydrophobicContact CD-CH2 4.36Å; K280-W288 HydrophobicContact CD-CZ2 4.05Å; K280-W288 HydrophobicContact CD-CZ3 4.42Å; K280-W288 HydrophobicContact CG-CD2 4.06Å; K280-W288 HydrophobicContact CG-CE3 3.84Å; K280-W288 HydrophobicContact CG-CH2 4.16Å; K280-W288 HydrophobicContact CG-CZ2 4.35Å; K280-W288 HydrophobicContact CG-CZ3 3.91Å; K280-Y311 CarbonylContact O-C 3.47Å; K280-Y311 VanDerWaalsContact O-CA 3.28Å; K280-Y311 WeakPolarHBondContact O-CA 3.38Å; K280-R312 HydrophobicContact CG-CB 4.31Å; K280-R312 PolarHBondContact N-O 3.46Å; K280-R312 PolarHBondContact O-N 2.77Å
281	P	91.1	Very high	82.9	Confident	33 Å²	33	68.5 Å²	68.5	21%	0.214	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	144.2	172.3	-21.3	32	0	0	0	111.5	E283 N284 T309 R310 Y311	P281-E283 VanDerWaalsContact C-N 3.34Å; P281-N284 HydrophobicContact CB-CB 4.05Å; P281-N284 HydrophobicContact CG-CB 4.35Å; P281-T309 HydrophobicContact CB-CG2 4.19Å; P281-R310 CarbonylContact C-O 3.48Å; P281-R310 WeakPolarHBondContact CA-O 3.31Å; P281-Y311 HydrophobicContact CB-CE1 4.36Å; P281-Y311 HydrophobicContact CG-CD1 4.32Å; P281-Y311 HydrophobicContact CG-CE1 3.74Å
282	V	89.9	Confident	82.3	Confident	44 Å²	44	67.6 Å²	67.6	27%	0.267	33%	0.33	S	S	.	.	S	Bend	trans	-68.8	-36.3	178.9	172	0	0	0	0	111.3	R310 R312 V333	V282-R310 HydrophobicContact CB-CB 4.14Å; V282-R310 HydrophobicContact CG2-CB 3.79Å; V282-R310 WeakPolarHBondContact CG2-O 2.98Å; V282-R310 PolarHBondContact N-O 3.48Å; V282-R312 HydrophobicContact CG2-CG 3.73Å; V282-V333 HydrophobicContact CG2-CG1 3.97Å
283	E	81.6	Confident	81.6	Confident	190 Å²	190	68 Å²	68	89%	0.888	33%	0.333	S	S	*	.	S	Bend	trans	-80.7	-24.6	-175.4	-59.5	-166.1	168.6	0	0	113	P281	P281-E283 VanDerWaalsContact C-N 3.34Å
284	N	70.3	Confident	80.9	Confident	89 Å²	89	69.6 Å²	69.6	48%	0.476	34%	0.336	S	S	.	.			trans	-95.7	138.7	-178.7	-156.2	-7.3	0	0	0	111.6	P281	P281-N284 HydrophobicContact CB-CB 4.05Å; P281-N284 HydrophobicContact CG-CB 4.35Å
285	R	57.4	Low	79.8	Confident	238 Å²	238	69.8 Å²	69.8	90%	0.898	34%	0.337	S	S	*	.			trans	-92.4	-0.2	-175.6	-73.7	-168.7	-179.5	-167	1.8	114.6
286	D	67.9	Low	78.6	Confident	102 Å²	102	71.6 Å²	71.6	55%	0.545	35%	0.346	S	S	.	.	S	Bend	trans	-75.6	173.6	-175.8	-78.7	-30.7	0	0	0	115.3
287	F	76.3	Confident	77.5	Confident	191 Å²	191	78.2 Å²	78.2	84%	0.838	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-49	146.4	-173.8	-58.6	-87.5	0	0	0	113.8	S289	F287-S289 PolarHBondContact O-N 3.49Å
288	W	85.7	Confident	76.7	Confident	60 Å²	60	80.5 Å²	80.5	23%	0.227	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-65.9	128.5	174.7	-69.7	90.7	0	0	0	110.8	L278 K280 R312 R314 E331	L278-W288 HydrophobicContact CB-CB 4.36Å; L278-W288 HydrophobicContact CB-CD2 4.25Å; L278-W288 HydrophobicContact CB-CE3 3.73Å; L278-W288 HydrophobicContact CB-CZ3 4.35Å; L278-W288 HydrophobicContact CD2-CB 4.02Å; L278-W288 HydrophobicContact CD2-CG 4.37Å; K280-W288 HydrophobicContact CB-CE3 4.23Å; K280-W288 HydrophobicContact CD-CD2 3.84Å; K280-W288 HydrophobicContact CD-CE3 4.16Å; K280-W288 HydrophobicContact CD-CG 4.32Å; K280-W288 HydrophobicContact CD-CH2 4.36Å; K280-W288 HydrophobicContact CD-CZ2 4.05Å; K280-W288 HydrophobicContact CD-CZ3 4.42Å; K280-W288 HydrophobicContact CG-CD2 4.06Å; K280-W288 HydrophobicContact CG-CE3 3.84Å; K280-W288 HydrophobicContact CG-CH2 4.16Å; K280-W288 HydrophobicContact CG-CZ2 4.35Å; K280-W288 HydrophobicContact CG-CZ3 3.91Å; W288-R312 HydrophobicContact CH2-CB 3.87Å; W288-R312 HydrophobicContact CZ3-CB 4.21Å; W288-R312 WeakPolarHBondContact CZ3-O 3.36Å; W288-R314 HydrophobicContact CE3-CG 4.49Å; W288-R314 HydrophobicContact CH2-CG 4Å; W288-R314 HydrophobicContact CZ3-CG 3.98Å; W288-E331 HydrophobicContact CH2-CG 4.07Å; W288-E331 WeakPolarHBondContact CZ2-OE1 3.29Å
289	S	84.8	Confident	76.4	Confident	56 Å²	56	82 Å²	82	39%	0.392	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	150	161.4	-60.9	0	0	0	0	109.3	L278 Y279 F287	L278-S289 CarbonylContact C-O 3.57Å; L278-S289 VanDerWaalsContact CA-O 3.26Å; L278-S289 WeakPolarHBondContact CA-O 3.3Å; Y279-S289 PolarHBondContact N-O 3.01Å; Y279-S289 PolarHBondContact O-N 2.75Å; F287-S289 PolarHBondContact O-N 3.49Å
290	S	84.3	Confident	75.9	Confident	65 Å²	65	80.5 Å²	80.5	46%	0.455	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.5	-179.9	69.1	0	0	0	0	112.6	L277	L277-S290 CarbonylContact O-C 3.5Å; L277-S290 VanDerWaalsContact O-CA 3.27Å; L277-S290 WeakPolarHBondContact O-CA 3.14Å
291	I	77.3	Confident	75.4	Confident	48 Å²	48	81.2 Å²	81.2	25%	0.246	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.6	167.2	55.6	168.7	0	0	0	109.1	K276 L277 Y279 I300 L302	K276-I291 CarbonylContact C-O 3.56Å; K276-I291 VanDerWaalsContact CA-O 3.23Å; K276-I291 WeakPolarHBondContact CA-O 3.45Å; L277-I291 HydrophobicContact CB-CD1 4.09Å; L277-I291 HydrophobicContact CB-CG1 3.62Å; L277-I291 HydrophobicContact CD2-CD1 4.35Å; L277-I291 PolarHBondContact N-O 2.87Å; L277-I291 PolarHBondContact O-N 3.41Å; Y279-I291 HydrophobicContact CE1-CG2 4.34Å; I291-I300 HydrophobicContact CD1-CG2 3.23Å; I291-I300 HydrophobicContact CG1-CG2 4.4Å; I291-L302 HydrophobicContact CD1-CD2 3.62Å; I291-L302 HydrophobicContact CG1-CD2 4.12Å
292	I	74	Confident	74.9	Confident	61 Å²	61	79.7 Å²	79.7	31%	0.313	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.5	178.3	-58.5	172.9	0	0	0	108.1	K276	K276-I292 HydrophobicContact CB-CG1 4.16Å; K276-I292 HydrophobicContact CD-CG1 4.46Å; K276-I292 HydrophobicContact CG-CG1 3.9Å
293	V	67.9	Low	74.4	Confident	37 Å²	37	81.1 Å²	81.1	22%	0.224	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.9	179.6	-176.3	0	0	0	0	108.7	S274 T275 S295 I300	S274-V293 CarbonylContact C-O 3.55Å; S274-V293 WeakPolarHBondContact CA-O 3.34Å; T275-V293 PolarHBondContact N-O 3.46Å; T275-V293 PolarHBondContact O-N 3.3Å; V293-S295 PolarHBondContact O-N 3.33Å; V293-S295 VanDerWaalsContact O-N 3.14Å; V293-I300 HydrophobicContact CB-CD1 3.83Å; V293-I300 HydrophobicContact CB-CG1 4.36Å; V293-I300 HydrophobicContact CG1-CD1 4.33Å; V293-I300 HydrophobicContact CG1-CG1 4.41Å; V293-I300 HydrophobicContact CG2-CD1 3.65Å; V293-I300 HydrophobicContact CG2-CG1 4.02Å; V293-I300 HydrophobicContact CG2-CG2 3.99Å
294	Y	70.7	Confident	74.1	Confident	113 Å²	113	79.3 Å²	79.3	44%	0.443	39%	0.39	S	S	.	.	S	Bend	trans	-89.2	41.6	-178.2	-56.4	-88.6	0	0	0	111.7	I273 Y894	I273-Y294 WeakPolarHBondContact O-CA 3.2Å; I273-Y294 WeakPolarHBondContact O-CD1 3.31Å; Y294-Y894 HydrophobicContact CE2-CE1 4.42Å; Y294-Y894 AromaticContact CZ-CE1 3.95Å; Y294-Y894 VanDerWaalsContact OH-CE1 3.22Å; Y294-Y894 WeakPolarHBondContact OH-CE1 3.4Å; Y294-Y894 PolarHBondContact OH-OH 3.24Å
295	S	59.8	Low	74.8	Confident	16 Å²	16	75.3 Å²	75.3	11%	0.112	37%	0.368	C	S	.	.			trans	-153.2	136.8	-179.6	-175.3	0	0	0	0	109.3	T275 V293	T275-S295 WeakPolarHBondContact CB-O 3.41Å; T275-S295 PolarHBondContact OG1-O 2.86Å; V293-S295 PolarHBondContact O-N 3.33Å; V293-S295 VanDerWaalsContact O-N 3.14Å
296	D	59.7	Low	76	Confident	39 Å²	39	69.6 Å²	69.6	21%	0.209	35%	0.352	C	S	.	.	S	Bend	trans	-104.8	-9.9	179.8	66.6	-33.4	0	0	0	113.4	I272 T275	I272-D296 HydrophobicContact CB-CB 4.45Å; I272-D296 HydrophobicContact CD1-CB 4.05Å; I272-D296 WeakPolarHBondContact CD1-OD2 3.27Å; I272-D296 HydrophobicContact CG2-CB 4.08Å; T275-D296 WeakPolarHBondContact OG1-CA 3.47Å
297	K	65.1	Low	76.7	Confident	164 Å²	164	66.6 Å²	66.6	71%	0.713	34%	0.338	S	S	*	.	S	Bend	trans	-115.3	-5.5	-171.8	-70.1	175.7	-173.6	-179.5	0	114.9
298	E	73.9	Confident	77.1	Confident	49 Å²	49	60.6 Å²	60.6	23%	0.229	32%	0.32	C	S	.	.	S	Bend	trans	-101.2	142.9	-178.6	-70.4	178.9	168.6	0	0	111.4	P262 I300	P262-E298 WeakPolarHBondContact CD-O 3.26Å; E298-I300 PolarHBondContact O-N 3.01Å
299	P	83.5	Confident	77.2	Confident	49 Å²	49	59 Å²	59	32%	0.318	32%	0.317	S	S	.	.			trans	-56.4	136.6	169	-24.7	35	0	0	0	111.8	L251 L259 M261	L251-P299 HydrophobicContact CD1-CB 3.7Å; L251-P299 HydrophobicContact CD1-CG 3.58Å; L259-P299 HydrophobicContact CD1-CB 3.68Å; L259-P299 HydrophobicContact CD2-CB 4.36Å; L259-P299 HydrophobicContact CG-CB 3.94Å; M261-P299 HydrophobicContact CE-CG 3.95Å
300	I	81.6	Confident	77.6	Confident	8 Å²	8	62.8 Å²	62.8	4%	0.041	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.8	-179.7	-62.1	-179.5	0	0	0	109.5	V260 P262 T275 L277 I291 V293 E298	V260-I300 PolarHBondContact N-O 3.38Å; V260-I300 PolarHBondContact O-N 2.8Å; P262-I300 HydrophobicContact CB-CD1 4.1Å; P262-I300 HydrophobicContact CG-CB 4.32Å; P262-I300 HydrophobicContact CG-CD1 3.28Å; P262-I300 HydrophobicContact CG-CG1 3.53Å; T275-I300 HydrophobicContact CG2-CD1 4.16Å; L277-I300 HydrophobicContact CD1-CD1 4.35Å; L277-I300 HydrophobicContact CD2-CB 4.42Å; L277-I300 HydrophobicContact CD2-CG2 4.17Å; I291-I300 HydrophobicContact CD1-CG2 3.23Å; I291-I300 HydrophobicContact CG1-CG2 4.4Å; V293-I300 HydrophobicContact CB-CD1 3.83Å; V293-I300 HydrophobicContact CB-CG1 4.36Å; V293-I300 HydrophobicContact CG1-CD1 4.33Å; V293-I300 HydrophobicContact CG1-CG1 4.41Å; V293-I300 HydrophobicContact CG2-CD1 3.65Å; V293-I300 HydrophobicContact CG2-CG1 4.02Å; V293-I300 HydrophobicContact CG2-CG2 3.99Å; E298-I300 PolarHBondContact O-N 3.01Å
301	T	81.3	Confident	78	Confident	53 Å²	53	60.1 Å²	60.1	33%	0.325	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	112	174.5	-47.5	0	0	0	0	110.7	Q257 L258 L259 M303	Q257-T301 HydrophobicContact CB-CG2 4.33Å; L258-T301 CarbonylContact O-C 3.56Å; L258-T301 WeakPolarHBondContact O-CA 3.28Å; L259-T301 WeakPolarHBondContact CD1-OG1 3.39Å; T301-M303 HydrophobicContact CG2-CG 3.81Å
302	L	80.3	Confident	78.8	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	128	162.5	-70.4	173.5	0	0	0	108.7	Q257 L258 V260 L277 Y279 I291 L305 V313	Q257-L302 CarbonylContact C-O 3.55Å; Q257-L302 WeakPolarHBondContact CA-O 3.44Å; Q257-L302 WeakPolarHBondContact CB-O 3.26Å; L258-L302 HydrophobicContact CB-CB 4.27Å; L258-L302 PolarHBondContact N-O 2.96Å; L258-L302 PolarHBondContact O-N 2.91Å; V260-L302 HydrophobicContact CG2-CD1 4.04Å; V260-L302 HydrophobicContact CG2-CG 4.45Å; L277-L302 HydrophobicContact CD2-CD1 4.01Å; L277-L302 HydrophobicContact CD2-CD2 3.92Å; L277-L302 HydrophobicContact CD2-CG 3.86Å; Y279-L302 HydrophobicContact CD1-CD1 4.47Å; Y279-L302 HydrophobicContact CD1-CD2 3.34Å; Y279-L302 HydrophobicContact CD2-CD2 4.48Å; Y279-L302 HydrophobicContact CE1-CD2 3.54Å; Y279-L302 HydrophobicContact CG-CD1 4.21Å; Y279-L302 HydrophobicContact CG-CD2 3.86Å; I291-L302 HydrophobicContact CD1-CD2 3.62Å; I291-L302 HydrophobicContact CG1-CD2 4.12Å; L302-L305 HydrophobicContact CB-CD1 3.92Å; L302-L305 HydrophobicContact CB-CG 4.45Å; L302-V313 HydrophobicContact CD1-CG1 4.31Å; L302-V313 HydrophobicContact CD1-CG2 4.1Å
303	M	80	Confident	79.7	Confident	74 Å²	74	59.6 Å²	59.6	37%	0.365	29%	0.294	S	S	.	.			trans	-123.6	168.9	-177	-60.7	-173.4	-68.4	0	0	111.2	K256 Q257 T301 L305 Y826	K256-M303 CarbonylContact O-C 3.56Å; Q257-M303 HydrophobicContact CG-CG 4.3Å; T301-M303 HydrophobicContact CG2-CG 3.81Å; M303-L305 PolarHBondContact O-N 3.5Å; M303-Y826 HydrophobicContact CE-CE1 4.22Å
304	N	74.8	Confident	80.9	Confident	152 Å²	152	60.7 Å²	60.7	81%	0.813	29%	0.294	S	S	*	.	S	Bend	trans	58.5	32.4	179.3	-56.6	-30.2	0	0	0	113.5	K256	K256-N304 PolarHBondContact O-N 3.08Å; K256-N304 VanDerWaalsContact O-N 3.16Å
305	L	83.9	Confident	82	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.026	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-81.1	159.8	173.9	-56.1	178.2	0	0	0	110.5	K256 L258 Y279 L302 M303 Y311 T336	K256-L305 WeakPolarHBondContact CA-O 3.17Å; K256-L305 VanDerWaalsContact CB-O 3.29Å; K256-L305 WeakPolarHBondContact CB-O 3.33Å; K256-L305 VanDerWaalsContact CG-O 3.3Å; K256-L305 WeakPolarHBondContact CG-O 3.37Å; K256-L305 PolarHBondContact O-N 2.78Å; L258-L305 HydrophobicContact CB-CD1 4.11Å; L258-L305 HydrophobicContact CD1-CD1 3.54Å; L258-L305 HydrophobicContact CG-CD1 3.53Å; Y279-L305 HydrophobicContact CD2-CD2 3.75Å; Y279-L305 HydrophobicContact CE2-CD2 3.49Å; Y279-L305 VanDerWaalsContact CE2-CD2 3.49Å; L302-L305 HydrophobicContact CB-CD1 3.92Å; L302-L305 HydrophobicContact CB-CG 4.45Å; M303-L305 PolarHBondContact O-N 3.5Å; L305-Y311 HydrophobicContact CB-CE2 3.82Å; L305-Y311 HydrophobicContact CD1-CD2 4.31Å; L305-Y311 HydrophobicContact CD1-CE2 4.23Å; L305-Y311 HydrophobicContact CD2-CD1 4.22Å; L305-Y311 HydrophobicContact CD2-CE1 3.79Å; L305-Y311 HydrophobicContact CD2-CE2 4.16Å; L305-Y311 HydrophobicContact CG-CE2 4.29Å; L305-T336 HydrophobicContact CB-CG2 3.74Å; L305-T336 HydrophobicContact CD1-CG2 3.74Å; L305-T336 HydrophobicContact CG-CG2 4.43Å
306	E	83.4	Confident	83.6	Confident	118 Å²	118	56.1 Å²	56.1	55%	0.551	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-78.3	138.2	173.6	-67.3	178.8	167.4	0	0	109.9	T309 Y311 T336	E306-T309 HydrophobicContact CB-CG2 4.38Å; E306-T309 VanDerWaalsContact CB-OG1 3.25Å; E306-T309 WeakPolarHBondContact CB-OG1 3.39Å; E306-T309 WeakPolarHBondContact O-CB 3.29Å; E306-Y311 PolarHBondContact N-OH 3.43Å; E306-T336 WeakPolarHBondContact O-CB 3.34Å; E306-T336 PolarHBondContact O-OG1 3.02Å
307	P	83.6	Confident	85.1	Confident	40 Å²	40	54.2 Å²	54.2	26%	0.26	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	146.5	174.6	-18.4	30.2	0	0	0	113.3	S255 K256 T309 P339	S255-P307 WeakPolarHBondContact O-CA 3.39Å; S255-P307 WeakPolarHBondContact O-CB 3.32Å; S255-P307 WeakPolarHBondContact O-CG 3.41Å; K256-P307 HydrophobicContact CG-CG 4.03Å; P307-T309 PolarHBondContact O-N 2.74Å; P307-T309 PolarHBondContact O-OG1 2.77Å; P307-P339 HydrophobicContact CB-CB 4.21Å; P307-P339 HydrophobicContact CG-CB 4.34Å
308	S	84.7	Confident	86.3	Confident	64 Å²	64	46.7 Å²	46.7	45%	0.448	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	32.7	-178.9	-45.7	0	0	0	0	113.6	T336 D337 C338	S308-T336 PolarHBondContact N-OG1 2.99Å; S308-D337 PolarHBondContact N-O 3.29Å; S308-C338 WeakPolarHBondContact OG-CA 3.3Å
309	T	87.8	Confident	87	Confident	28 Å²	28	44.6 Å²	44.6	17%	0.172	22%	0.222	C	C	.	.			trans	-115.6	133.8	-176.4	-59.5	0	0	0	0	110.4	P281 E306 P307 Y311 T336	P281-T309 HydrophobicContact CB-CG2 4.19Å; E306-T309 HydrophobicContact CB-CG2 4.38Å; E306-T309 VanDerWaalsContact CB-OG1 3.25Å; E306-T309 WeakPolarHBondContact CB-OG1 3.39Å; E306-T309 WeakPolarHBondContact O-CB 3.29Å; P307-T309 PolarHBondContact O-N 2.74Å; P307-T309 PolarHBondContact O-OG1 2.77Å; T309-Y311 HydrophobicContact CG2-CD2 4.28Å; T309-Y311 HydrophobicContact CG2-CE2 3.65Å; T309-Y311 VanDerWaalsContact O-CD2 3.31Å; T309-Y311 WeakPolarHBondContact O-CD2 3.18Å; T309-T336 PolarHBondContact N-OG1 3.43Å; T309-T336 PolarHBondContact O-N 3.07Å; T309-T336 PolarHBondContact O-OG1 3.21Å
310	R	92.5	Very high	87.2	Confident	134 Å²	134	44.6 Å²	44.6	51%	0.506	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131.5	175	-63.5	177.9	67.3	-168.6	3.6	110.2	P281 V282 V333 M334 E335	P281-R310 CarbonylContact C-O 3.48Å; P281-R310 WeakPolarHBondContact CA-O 3.31Å; V282-R310 HydrophobicContact CB-CB 4.14Å; V282-R310 HydrophobicContact CG2-CB 3.79Å; V282-R310 WeakPolarHBondContact CG2-O 2.98Å; V282-R310 PolarHBondContact N-O 3.48Å; R310-V333 HydrophobicContact CB-CG1 4.38Å; R310-M334 CarbonylContact C-O 3.54Å; R310-M334 VanDerWaalsContact CA-O 3.31Å; R310-M334 WeakPolarHBondContact CA-O 3.45Å; R310-E335 HydrophobicContact CG-CB 4.12Å; R310-E335 HydrophobicContact CG-CG 3.81Å
311	Y	92.4	Very high	87.1	Confident	9 Å²	9	47 Å²	47	4%	0.035	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.1	-179.9	-71.6	-89.5	0	0	0	111.5	L258 Y279 K280 P281 L305 E306 T309 V333 M334 T336	L258-Y311 HydrophobicContact CD1-CD2 4.37Å; Y279-Y311 HydrophobicContact CD2-CD1 4.1Å; Y279-Y311 HydrophobicContact CD2-CE1 4.35Å; K280-Y311 CarbonylContact O-C 3.47Å; K280-Y311 VanDerWaalsContact O-CA 3.28Å; K280-Y311 WeakPolarHBondContact O-CA 3.38Å; P281-Y311 HydrophobicContact CB-CE1 4.36Å; P281-Y311 HydrophobicContact CG-CD1 4.32Å; P281-Y311 HydrophobicContact CG-CE1 3.74Å; L305-Y311 HydrophobicContact CB-CE2 3.82Å; L305-Y311 HydrophobicContact CD1-CD2 4.31Å; L305-Y311 HydrophobicContact CD1-CE2 4.23Å; L305-Y311 HydrophobicContact CD2-CD1 4.22Å; L305-Y311 HydrophobicContact CD2-CE1 3.79Å; L305-Y311 HydrophobicContact CD2-CE2 4.16Å; L305-Y311 HydrophobicContact CG-CE2 4.29Å; E306-Y311 PolarHBondContact N-OH 3.43Å; T309-Y311 HydrophobicContact CG2-CD2 4.28Å; T309-Y311 HydrophobicContact CG2-CE2 3.65Å; T309-Y311 VanDerWaalsContact O-CD2 3.31Å; T309-Y311 WeakPolarHBondContact O-CD2 3.18Å; Y311-V333 CarbonylContact O-C 3.44Å; Y311-V333 VanDerWaalsContact O-CA 3.3Å; Y311-V333 WeakPolarHBondContact O-CA 3.06Å; Y311-M334 PolarHBondContact N-O 3.18Å; Y311-M334 PolarHBondContact O-N 3.22Å; Y311-T336 HydrophobicContact CD2-CG2 4.34Å; Y311-T336 HydrophobicContact CE2-CG2 4.07Å
312	R	93.9	Very high	87.2	Confident	98 Å²	98	50.4 Å²	50.4	37%	0.37	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.4	161.6	-57.1	-169.1	-176.1	-161.7	0.4	108.3	Y279 K280 V282 W288 E331 A332 V333	Y279-R312 CarbonylContact C-O 3.48Å; Y279-R312 WeakPolarHBondContact CA-O 3.43Å; K280-R312 HydrophobicContact CG-CB 4.31Å; K280-R312 PolarHBondContact N-O 3.46Å; K280-R312 PolarHBondContact O-N 2.77Å; V282-R312 HydrophobicContact CG2-CG 3.73Å; W288-R312 HydrophobicContact CH2-CB 3.87Å; W288-R312 HydrophobicContact CZ3-CB 4.21Å; W288-R312 WeakPolarHBondContact CZ3-O 3.36Å; R312-E331 IonicContact NH1-OE2 3.77Å; R312-A332 CarbonylContact C-O 3.5Å; R312-A332 WeakPolarHBondContact CA-O 3.26Å; R312-V333 HydrophobicContact CG-CG2 4.43Å
313	V	93.6	Very high	87.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134	-178	-171.1	0	0	0	0	109.5	P248 L277 L278 L302 E331 A332 M334	P248-V313 HydrophobicContact CB-CG1 4.44Å; P248-V313 HydrophobicContact CG-CB 4.16Å; P248-V313 HydrophobicContact CG-CG1 3.96Å; P248-V313 WeakPolarHBondContact CG-O 3.4Å; L277-V313 HydrophobicContact CD2-CG1 3.97Å; L277-V313 HydrophobicContact CG-CG1 3.93Å; L278-V313 CarbonylContact O-C 3.48Å; L278-V313 VanDerWaalsContact O-CA 3.27Å; L278-V313 WeakPolarHBondContact O-CA 3.48Å; L302-V313 HydrophobicContact CD1-CG1 4.31Å; L302-V313 HydrophobicContact CD1-CG2 4.1Å; V313-E331 CarbonylContact O-C 3.54Å; V313-E331 WeakPolarHBondContact O-CA 3.24Å; V313-A332 PolarHBondContact N-O 3.49Å; V313-A332 PolarHBondContact O-N 3.09Å; V313-M334 HydrophobicContact CB-SD 4.26Å; V313-M334 HydrophobicContact CG2-CG 4.23Å; V313-M334 HydrophobicContact CG2-SD 3.82Å
314	R	93.7	Very high	87.6	Confident	60 Å²	60	48.8 Å²	48.8	23%	0.226	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	165.5	172.9	63.8	-173.2	-170.5	176.8	10.4	111.1	L278 W288 E331	L278-R314 HydrophobicContact CB-CG 3.89Å; L278-R314 HydrophobicContact CD1-CG 4.25Å; L278-R314 PolarHBondContact N-O 3.4Å; L278-R314 PolarHBondContact O-N 2.8Å; W288-R314 HydrophobicContact CE3-CG 4.49Å; W288-R314 HydrophobicContact CH2-CG 4Å; W288-R314 HydrophobicContact CZ3-CG 3.98Å; R314-E331 HydrophobicContact CB-CG 3.8Å; R314-E331 HydrophobicContact CG-CG 4.27Å; R314-E331 IonicContact NH1-OE1 2.64Å; R314-E331 PolarHBondContact NH1-OE1 2.7Å
315	V	92.9	Very high	88.3	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	145	-173.2	-173.5	0	0	0	0	110.2	P244 P248 P262 T275 K276 L277 L317 S328 G329	P244-V315 HydrophobicContact CG-CB 4.22Å; P244-V315 HydrophobicContact CG-CG1 4.29Å; P248-V315 HydrophobicContact CB-CG2 3.9Å; P248-V315 HydrophobicContact CG-CG2 4Å; P262-V315 HydrophobicContact CB-CG1 4.21Å; P262-V315 HydrophobicContact CB-CG2 4.16Å; P262-V315 WeakPolarHBondContact O-CG2 3.41Å; T275-V315 HydrophobicContact CG2-CG1 3.51Å; K276-V315 CarbonylContact O-C 3.44Å; K276-V315 WeakPolarHBondContact O-CA 3Å; L277-V315 HydrophobicContact CD1-CB 4.39Å; L277-V315 HydrophobicContact CD1-CG1 4.47Å; L277-V315 HydrophobicContact CD1-CG2 3.38Å; V315-L317 HydrophobicContact CG1-CD2 4.17Å; V315-S328 CarbonylContact O-C 3.54Å; V315-S328 WeakPolarHBondContact O-CA 3.5Å; V315-G329 PolarHBondContact O-N 3.48Å
316	Q	93	Very high	88.6	Confident	32 Å²	32	46.6 Å²	46.6	15%	0.15	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.4	171.6	-170.7	-177.8	28.4	0	0	108.1	K276 L278 G326	K276-Q316 HydrophobicContact CB-CB 4.24Å; K276-Q316 PolarHBondContact N-O 3.43Å; K276-Q316 PolarHBondContact O-N 2.79Å; L278-Q316 HydrophobicContact CD1-CB 3.86Å; Q316-G326 WeakPolarHBondContact CG-O 3.24Å; Q316-G326 PolarHBondContact NE2-O 3.09Å
317	L	91.6	Very high	89	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.2	-177.3	-60.3	167.8	0	0	0	109.8	P242 P244 V263 H266 I272 T275 V315 G326	P242-L317 HydrophobicContact CB-CB 3.99Å; P242-L317 HydrophobicContact CB-CD1 4.35Å; P242-L317 HydrophobicContact CG-CB 3.72Å; P244-L317 HydrophobicContact CB-CD1 4.45Å; P244-L317 HydrophobicContact CG-CD1 3.78Å; P244-L317 HydrophobicContact CG-CG 3.82Å; V263-L317 HydrophobicContact CG1-CD1 4.29Å; V263-L317 HydrophobicContact CG1-CD2 4.14Å; H266-L317 HydrophobicContact CB-CD1 3.54Å; I272-L317 HydrophobicContact CD1-CD1 3.91Å; I272-L317 HydrophobicContact CD1-CD2 4.37Å; I272-L317 HydrophobicContact CG2-CB 4.46Å; I272-L317 HydrophobicContact CG2-CD2 4.2Å; T275-L317 HydrophobicContact CG2-CD2 3.87Å; V315-L317 HydrophobicContact CG1-CD2 4.17Å; L317-G326 PolarHBondContact O-N 2.82Å
318	S	89.8	Confident	89.4	Confident	5 Å²	5	47.5 Å²	47.5	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141	178.3	-52.5	0	0	0	0	111.6	I273 S274 G324 E325	I273-S318 VanDerWaalsContact CG1-O 3.29Å; I273-S318 WeakPolarHBondContact CG1-O 3.4Å; I273-S318 PolarHBondContact N-O 3.45Å; S274-S318 PolarHBondContact N-O 3.3Å; S274-S318 PolarHBondContact O-N 2.82Å; S274-S318 WeakPolarHBondContact OG-CB 3.49Å; S318-G324 WeakPolarHBondContact CA-O 3.35Å; S318-E325 WeakPolarHBondContact OG-CG 3.44Å
319	R	89.4	Confident	89.7	Confident	5 Å²	5	45 Å²	45	2%	0.019	24%	0.238	C	C	.	.			trans	-108.9	166.3	171	72.9	178.6	-56.8	-69.5	-7.8	111.1	E156 N158 K239 P242 D269 G270 P271 G324	E156-R319 IonicContact OE1-CZ 3.94Å; E156-R319 IonicContact OE1-NH1 3.75Å; E156-R319 IonicContact OE1-NH2 3.37Å; E156-R319 PolarHBondContact OE1-NH2 3.09Å; N158-R319 WeakPolarHBondContact OD1-CD 3.16Å; N158-R319 VanDerWaalsContact OD1-CG 3.3Å; N158-R319 WeakPolarHBondContact OD1-CG 3.4Å; N158-R319 PolarHBondContact OD1-NH1 3.5Å; K239-R319 VanDerWaalsContact CB-CZ 3.41Å; P242-R319 HydrophobicContact CG-CB 4.32Å; D269-R319 WeakPolarHBondContact O-CD 3.38Å; D269-R319 PolarHBondContact O-NE 3.32Å; D269-R319 VanDerWaalsContact O-NE 3.14Å; G270-R319 PolarHBondContact O-NH2 2.9Å; P271-R319 WeakPolarHBondContact O-CA 3.32Å; P271-R319 WeakPolarHBondContact O-CB 3.39Å; R319-G324 PolarHBondContact N-O 2.85Å
320	P	86.6	Confident	90	Very high	49 Å²	49	46.4 Å²	46.4	32%	0.318	25%	0.248	S	C	.	.	S	Bend	trans	-57.7	149.9	179	-22.5	31.9	0	0	0	113.5	N158 P271 I273	N158-P320 PolarHBondContact ND2-O 3.43Å; P271-P320 HydrophobicContact CG-CG 4.27Å; P271-P320 VanDerWaalsContact O-CD 3.29Å; P271-P320 WeakPolarHBondContact O-CD 3.28Å; I273-P320 HydrophobicContact CD1-CG 4.43Å; I273-P320 HydrophobicContact CG2-CG 3.64Å
321	G	80.6	Confident	90.1	Very high	58 Å²	58	44 Å²	44	60%	0.598	24%	0.242	S	C	*	.	S	Bend	trans	90.5	162.9	173.3	0	0	0	0	0	114.7	N158 G324	N158-G321 VanDerWaalsContact ND2-C 3.35Å; N158-G321 PolarHBondContact ND2-O 2.86Å; G321-G324 PolarHBondContact O-N 2.97Å; G321-G324 VanDerWaalsContact O-N 3.13Å
322	E	82.1	Confident	90.2	Very high	126 Å²	126	44.5 Å²	44.5	59%	0.589	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	138.2	177	-171.4	-177.4	168	0	0	110.8	N158 S161 G324	N158-E322 WeakPolarHBondContact CB-O 3.38Å; N158-E322 PolarHBondContact ND2-O 2.86Å; S161-E322 WeakPolarHBondContact CB-O 3.49Å; E322-G324 PolarHBondContact O-N 3.46Å
323	G	82.7	Confident	90.2	Very high	39 Å²	39	43.6 Å²	43.6	40%	0.402	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	11.1	-175.6	0	0	0	0	0	114.5	N158 P241 E325	N158-G323 WeakPolarHBondContact CB-O 3.3Å; P241-G323 VanDerWaalsContact CG-O 3.23Å; P241-G323 WeakPolarHBondContact CG-O 3.22Å; G323-E325 VanDerWaalsContact C-N 3.3Å; G323-E325 PolarHBondContact O-N 2.91Å
324	G	86.3	Confident	90.2	Very high	2 Å²	2	44 Å²	44	2%	0.021	26%	0.255	C	S	.	.			trans	-78.6	-7.7	179.9	0	0	0	0	0	115	N158 S318 R319 G321 E322 G326	N158-G324 VanDerWaalsContact CG-CA 3.48Å; N158-G324 VanDerWaalsContact ND2-CA 3.3Å; N158-G324 WeakPolarHBondContact ND2-CA 3.11Å; N158-G324 PolarHBondContact ND2-N 3.36Å; S318-G324 WeakPolarHBondContact CA-O 3.35Å; R319-G324 PolarHBondContact N-O 2.85Å; G321-G324 PolarHBondContact O-N 2.97Å; G321-G324 VanDerWaalsContact O-N 3.13Å; E322-G324 PolarHBondContact O-N 3.46Å; G324-G326 PolarHBondContact O-N 2.95Å
325	E	90.3	Very high	90.2	Very high	106 Å²	106	45.5 Å²	45.5	50%	0.495	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	118.1	172.3	-56.9	-154.9	145.9	0	0	109.5	K276 S318 G323	K276-E325 VanDerWaalsContact NZ-CD 3.26Å; K276-E325 IonicContact NZ-OE1 2.79Å; K276-E325 PolarHBondContact NZ-OE1 2.9Å; K276-E325 IonicContact NZ-OE2 3.73Å; K276-E325 PolarHBondContact NZ-OE2 3.4Å; S318-E325 WeakPolarHBondContact OG-CG 3.44Å; G323-E325 VanDerWaalsContact C-N 3.3Å; G323-E325 PolarHBondContact O-N 2.91Å
326	G	89.9	Confident	89.9	Confident	4 Å²	4	45.5 Å²	45.5	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	174.7	175.4	0	0	0	0	0	113	P242 Q316 L317 G324	P242-G326 WeakPolarHBondContact O-CA 3.34Å; Q316-G326 WeakPolarHBondContact CG-O 3.24Å; Q316-G326 PolarHBondContact NE2-O 3.09Å; L317-G326 PolarHBondContact O-N 2.82Å; G324-G326 PolarHBondContact O-N 2.95Å
327	E	91.6	Very high	89.6	Confident	144 Å²	144	45.9 Å²	45.9	67%	0.673	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	155.6	175.7	-74.7	-67.1	156	0	0	112.3	V243	V243-E327 HydrophobicContact CG1-CB 4.26Å; V243-E327 HydrophobicContact CG2-CB 4.15Å
328	S	92.4	Very high	89.1	Confident	34 Å²	34	47.6 Å²	47.6	24%	0.238	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	138.2	175.7	-65.2	0	0	0	0	111.3	V315	V315-S328 CarbonylContact O-C 3.54Å; V315-S328 WeakPolarHBondContact O-CA 3.5Å
329	G	91.4	Very high	88.6	Confident	11 Å²	11	50 Å²	50	11%	0.113	30%	0.296	C	S	.	.			trans	-74.5	-179.7	173.4	0	0	0	0	0	114.3	V315	V315-G329 PolarHBondContact O-N 3.48Å
330	P	93.5	Very high	88	Confident	57 Å²	57	54 Å²	54	37%	0.37	32%	0.315	S	S	.	.			trans	-63.6	148.8	177.6	26.5	-33.7	0	0	0	112.8	A247 P248	A247-P330 HydrophobicContact CB-CB 4.23Å; A247-P330 HydrophobicContact CB-CG 4.04Å; P248-P330 WeakPolarHBondContact CD-O 3.32Å
331	E	93.8	Very high	87.7	Confident	84 Å²	84	52 Å²	52	39%	0.393	30%	0.301	S	S	.	.			trans	-85.5	143.3	-178.2	-73.7	173.9	-159.4	0	0	112.2	W288 R312 V313 R314	W288-E331 HydrophobicContact CH2-CG 4.07Å; W288-E331 WeakPolarHBondContact CZ2-OE1 3.29Å; R312-E331 IonicContact NH1-OE2 3.77Å; V313-E331 CarbonylContact O-C 3.54Å; V313-E331 WeakPolarHBondContact O-CA 3.24Å; R314-E331 HydrophobicContact CB-CG 3.8Å; R314-E331 HydrophobicContact CG-CG 4.27Å; R314-E331 IonicContact NH1-OE1 2.64Å; R314-E331 PolarHBondContact NH1-OE1 2.7Å
332	A	94.8	Very high	87.6	Confident	20 Å²	20	54.7 Å²	54.7	17%	0.165	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	152.9	167.7	0	0	0	0	0	110.9	A247 P248 R312 V313	A247-A332 HydrophobicContact CB-CB 4.2Å; P248-A332 HydrophobicContact CG-CB 4.05Å; P248-A332 WeakPolarHBondContact O-CB 3.28Å; R312-A332 CarbonylContact C-O 3.5Å; R312-A332 WeakPolarHBondContact CA-O 3.26Å; V313-A332 PolarHBondContact N-O 3.49Å; V313-A332 PolarHBondContact O-N 3.09Å
333	V	95.1	Very high	87.6	Confident	78 Å²	78	50.1 Å²	50.1	47%	0.473	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.4	173.2	-178.8	0	0	0	0	109.6	V282 R310 Y311 R312	V282-V333 HydrophobicContact CG2-CG1 3.97Å; R310-V333 HydrophobicContact CB-CG1 4.38Å; Y311-V333 CarbonylContact O-C 3.44Å; Y311-V333 VanDerWaalsContact O-CA 3.3Å; Y311-V333 WeakPolarHBondContact O-CA 3.06Å; R312-V333 HydrophobicContact CG-CG2 4.43Å
334	M	93.7	Very high	87.8	Confident	8 Å²	8	51 Å²	51	4%	0.039	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	157.3	-177	-56.5	-177	159	0	0	109.9	P248 K249 L250 L258 V260 R310 Y311 V313	P248-M334 HydrophobicContact CB-CE 4.36Å; K249-M334 VanDerWaalsContact C-CE 3.43Å; L250-M334 HydrophobicContact CB-CE 3.77Å; L250-M334 HydrophobicContact CB-CG 4.29Å; L250-M334 HydrophobicContact CB-SD 4.2Å; L250-M334 HydrophobicContact CD1-CB 4.49Å; L250-M334 HydrophobicContact CD1-SD 4.02Å; L250-M334 HydrophobicContact CD2-CB 4.48Å; L258-M334 HydrophobicContact CD1-CB 3.75Å; L258-M334 HydrophobicContact CD1-SD 4.47Å; V260-M334 HydrophobicContact CB-CE 4.29Å; V260-M334 HydrophobicContact CB-SD 4.45Å; V260-M334 HydrophobicContact CG1-CE 3.64Å; V260-M334 HydrophobicContact CG1-SD 4.23Å; V260-M334 HydrophobicContact CG2-CE 3.87Å; V260-M334 HydrophobicContact CG2-SD 3.45Å; V260-M334 WeakPolarHBondContact CG2-SD 3.18Å; R310-M334 CarbonylContact C-O 3.54Å; R310-M334 VanDerWaalsContact CA-O 3.31Å; R310-M334 WeakPolarHBondContact CA-O 3.45Å; Y311-M334 PolarHBondContact N-O 3.18Å; Y311-M334 PolarHBondContact O-N 3.22Å; V313-M334 HydrophobicContact CB-SD 4.26Å; V313-M334 HydrophobicContact CG2-CG 4.23Å; V313-M334 HydrophobicContact CG2-SD 3.82Å
335	E	92.2	Very high	88	Confident	92 Å²	92	51 Å²	51	43%	0.43	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.1	-174.6	-171.1	174	158.6	0	0	110.8	K253 L258 R310	K253-E335 WeakPolarHBondContact CD-O 3.43Å; L258-E335 WeakPolarHBondContact CD2-O 3.31Å; R310-E335 HydrophobicContact CG-CB 4.12Å; R310-E335 HydrophobicContact CG-CG 3.81Å
336	T	88.4	Confident	87.9	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.012	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-77.7	153.9	174.8	49.6	0	0	0	0	111.2	R254 L258 L305 E306 S308 T309 Y311	R254-T336 WeakPolarHBondContact O-CB 3.33Å; L258-T336 HydrophobicContact CD1-CG2 4.26Å; L258-T336 HydrophobicContact CD2-CG2 3.99Å; L258-T336 HydrophobicContact CG-CG2 3.94Å; L305-T336 HydrophobicContact CB-CG2 3.74Å; L305-T336 HydrophobicContact CD1-CG2 3.74Å; L305-T336 HydrophobicContact CG-CG2 4.43Å; E306-T336 WeakPolarHBondContact O-CB 3.34Å; E306-T336 PolarHBondContact O-OG1 3.02Å; S308-T336 PolarHBondContact N-OG1 2.99Å; T309-T336 PolarHBondContact N-OG1 3.43Å; T309-T336 PolarHBondContact O-N 3.07Å; T309-T336 PolarHBondContact O-OG1 3.21Å; Y311-T336 HydrophobicContact CD2-CG2 4.34Å; Y311-T336 HydrophobicContact CE2-CG2 4.07Å
337	D	84.7	Confident	87.9	Confident	40 Å²	40	51.3 Å²	51.3	21%	0.214	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-75.7	171.9	177.9	-76.8	-35.2	0	0	0	113	K253 R254 S255 S308	K253-D337 VanDerWaalsContact CD-OD1 3.27Å; K253-D337 WeakPolarHBondContact CD-OD1 3.45Å; K253-D337 WeakPolarHBondContact CE-OD1 3.37Å; K253-D337 IonicContact NZ-OD1 3.4Å; K253-D337 PolarHBondContact NZ-OD1 3.4Å; R254-D337 PolarHBondContact O-N 3.41Å; S255-D337 WeakPolarHBondContact CA-O 3.41Å; S308-D337 PolarHBondContact N-O 3.29Å
338	C	81.8	Confident	87.5	Confident	36 Å²	36	49.2 Å²	49.2	24%	0.243	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-62.6	153.2	172.7	-61.6	0	0	0	0	112.2	S255 S308 E340 C423 S425	S255-C338 VanDerWaalsContact CB-O 3.22Å; S255-C338 WeakPolarHBondContact CB-O 3.17Å; S308-C338 WeakPolarHBondContact OG-CA 3.3Å; C338-E340 PolarHBondContact O-N 2.87Å; C338-C423 HydrophobicContact CB-CB 3.69Å; C338-C423 VanDerWaalsContact SG-CB 3.5Å; C338-S425 PolarHBondContact O-OG 3.2Å
339	P	79.1	Confident	86.7	Confident	56 Å²	56	51.4 Å²	51.4	36%	0.364	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-58.8	133.1	-178.1	23.1	-32.9	0	0	0	112.1	P307 N422	P307-P339 HydrophobicContact CB-CB 4.21Å; P307-P339 HydrophobicContact CG-CB 4.34Å; P339-N422 PolarHBondContact O-ND2 2.84Å
340	E	77.2	Confident	86.2	Confident	89 Å²	89	55.6 Å²	55.6	42%	0.416	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-66.8	134.7	176.2	-79.1	160.3	-131.7	0	0	111.5	S255 C338 T342	S255-E340 PolarHBondContact OG-OE1 2.68Å; C338-E340 PolarHBondContact O-N 2.87Å; E340-T342 PolarHBondContact O-N 2.8Å
341	P	80.4	Confident	85.3	Confident	6 Å²	6	56.4 Å²	56.4	4%	0.039	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-64.5	131.1	174.7	-15.8	26.7	0	0	0	111.3	L420 N422 G427 P428	P341-L420 HydrophobicContact CB-CB 3.71Å; P341-L420 HydrophobicContact CG-CB 4.15Å; P341-N422 HydrophobicContact CG-CB 3.77Å; P341-G427 WeakPolarHBondContact O-CA 3.16Å; P341-P428 WeakPolarHBondContact O-CD 3.49Å
342	T	78.3	Confident	84.1	Confident	115 Å²	115	54.1 Å²	54.1	71%	0.706	29%	0.288	S	S	*	.			trans	-97.8	-14	-179.4	52.9	0	0	0	0	113.9	E340 P428	E340-T342 PolarHBondContact O-N 2.8Å; T342-P428 WeakPolarHBondContact O-CG 3.44Å
343	V	82.6	Confident	82.7	Confident	30 Å²	30	57.9 Å²	57.9	18%	0.182	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-80.8	136.3	-175.9	178.4	0	0	0	0	110.4	L363 P364 L420 P428	V343-L363 HydrophobicContact CG1-CD2 3.9Å; V343-P364 HydrophobicContact CG1-CG 4.4Å; V343-L420 HydrophobicContact CB-CD1 3.58Å; V343-L420 HydrophobicContact CG1-CD1 3.87Å; V343-L420 VanDerWaalsContact O-CD1 3.22Å; V343-L420 WeakPolarHBondContact O-CD1 3.43Å; V343-P428 WeakPolarHBondContact O-CG 3.31Å
344	Q	86.9	Confident	81.4	Confident	57 Å²	57	55 Å²	55	27%	0.266	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-98.3	120	176.1	-177.6	175.4	63.9	0	0	110.5	P364 P428 A429	Q344-P364 WeakPolarHBondContact O-CD 3.27Å; Q344-P364 WeakPolarHBondContact O-CG 3.45Å; Q344-P428 HydrophobicContact CB-CB 4.29Å; Q344-P428 HydrophobicContact CB-CG 3.93Å; Q344-A429 PolarHBondContact NE2-O 2.76Å
345	P	89.6	Confident	80.4	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-68	149.9	173.5	-20.4	33.6	0	0	0	113.1	F377 V418 L420 S430	P345-F377 HydrophobicContact CB-CE1 4.47Å; P345-F377 HydrophobicContact CG-CD1 4.16Å; P345-F377 HydrophobicContact CG-CE1 4.14Å; P345-V418 HydrophobicContact CB-CB 4.34Å; P345-V418 HydrophobicContact CB-CG1 4.07Å; P345-V418 HydrophobicContact CG-CG1 4.21Å; P345-L420 HydrophobicContact CG-CD1 4.19Å; P345-L420 HydrophobicContact CG-CG 4.07Å; P345-S430 WeakPolarHBondContact O-CA 3.5Å; P345-S430 WeakPolarHBondContact O-CB 3.29Å
346	E	89.5	Confident	79.8	Confident	90 Å²	90	56.4 Å²	56.4	42%	0.421	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.9	175.1	-65.3	-174	165.3	0	0	111.1	W361 R362	E346-W361 CarbonylContact O-C 3.59Å; E346-W361 WeakPolarHBondContact O-CA 3.43Å; E346-W361 VanDerWaalsContact O-CB 3.26Å; E346-W361 WeakPolarHBondContact O-CB 3.19Å; E346-R362 HydrophobicContact CB-CG 4.14Å; E346-R362 PolarHBondContact N-O 3.22Å; E346-R362 PolarHBondContact O-N 2.91Å; E346-R362 IonicContact OE2-CZ 3.6Å; E346-R362 IonicContact OE2-NE 3.81Å; E346-R362 PolarHBondContact OE2-NE 3.05Å; E346-R362 VanDerWaalsContact OE2-NE 3.11Å; E346-R362 IonicContact OE2-NH2 2.65Å; E346-R362 PolarHBondContact OE2-NH2 2.83Å
347	I	88.4	Confident	79.5	Confident	28 Å²	28	56.3 Å²	56.3	14%	0.144	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	122.8	174.5	-62.4	171.4	0	0	0	108.8	V359 W361 V416 V418 S430 F433	I347-V359 HydrophobicContact CG2-CG1 3.63Å; I347-W361 HydrophobicContact CG1-CB 4.44Å; I347-V416 HydrophobicContact CD1-CG1 4.13Å; I347-V416 WeakPolarHBondContact CD1-O 3.32Å; I347-V418 HydrophobicContact CD1-CG2 4.16Å; I347-V418 HydrophobicContact CG1-CG2 4.09Å; I347-S430 WeakPolarHBondContact CD1-OG 3.48Å; I347-F433 HydrophobicContact CB-CB 4.29Å; I347-F433 HydrophobicContact CD1-CB 3.56Å; I347-F433 HydrophobicContact CG2-CB 4.03Å; I347-F433 HydrophobicContact CG2-CD1 4.24Å; I347-F433 HydrophobicContact CG2-CD2 4.02Å; I347-F433 HydrophobicContact CG2-CG 3.84Å
348	E	82.9	Confident	79.7	Confident	99 Å²	99	57.8 Å²	57.8	46%	0.463	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-54.5	-174	-67.2	-164.9	126.2	0	0	112.9	W360 R362	E348-W360 PolarHBondContact N-O 3.31Å; E348-R362 HydrophobicContact CG-CB 4.07Å; E348-R362 HydrophobicContact CG-CG 3.63Å; E348-R362 WeakPolarHBondContact OE1-CD 3.35Å; E348-R362 IonicContact OE1-CZ 3.21Å; E348-R362 IonicContact OE1-NE 2.73Å; E348-R362 IonicContact OE1-NH1 2.73Å; E348-R362 PolarHBondContact OE1-NH1 2.89Å
349	N	77.6	Confident	80.1	Confident	81 Å²	81	56 Å²	56	43%	0.433	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	170.5	-173.1	62.4	20.4	0	0	0	112.4	W360	N349-W360 PolarHBondContact O-N 3.14Å; N349-W360 WeakPolarHBondContact OD1-CB 3.46Å
350	R	80.1	Confident	80.7	Confident	98 Å²	98	56.7 Å²	56.7	37%	0.37	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.1	173.1	68.7	159.6	-177.6	-97	9	111.9	K358 F433 L434	R350-K358 VanDerWaalsContact CA-O 3.31Å; R350-K358 WeakPolarHBondContact CA-O 3.28Å; R350-F433 HydrophobicContact CB-CE1 3.88Å; R350-F433 HydrophobicContact CB-CZ 4.33Å; R350-F433 HydrophobicContact CG-CE1 3.76Å; R350-F433 HydrophobicContact CG-CZ 3.97Å; R350-L434 PolarHBondContact NH1-O 3.14Å; R350-L434 VanDerWaalsContact NH1-O 3.1Å
351	T	74.7	Confident	81.4	Confident	75 Å²	75	52.5 Å²	52.5	46%	0.46	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	140.2	162.6	57.5	0	0	0	0	108	A357 K358 W360	T351-A357 CarbonylContact O-C 3.55Å; T351-A357 VanDerWaalsContact O-CA 3.29Å; T351-A357 WeakPolarHBondContact O-CA 3.37Å; T351-K358 PolarHBondContact N-O 3.13Å; T351-K358 PolarHBondContact O-N 2.93Å; T351-W360 HydrophobicContact CG2-CH2 3.63Å; T351-W360 HydrophobicContact CG2-CZ3 3.73Å; T351-W360 WeakPolarHBondContact OG1-CH2 3.32Å; T351-W360 WeakPolarHBondContact OG1-CZ3 3.48Å
352	V	68.9	Low	81.8	Confident	35 Å²	35	57.7 Å²	57.7	21%	0.212	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.7	173.8	-176.8	0	0	0	0	106	N356 A357 V437 N469	V352-N356 WeakPolarHBondContact CA-O 3.27Å; V352-A357 HydrophobicContact CG2-CB 4.4Å; V352-V437 HydrophobicContact CG1-CG1 4.21Å; V352-N469 PolarHBondContact O-OD1 3.23Å
353	D	65.6	Low	82	Confident	100 Å²	100	53.9 Å²	53.9	54%	0.535	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	101.4	174.7	-167.9	5.4	0	0	0	108.1	H355 N356 K521	D353-H355 PolarHBondContact O-N 2.7Å; D353-H355 VanDerWaalsContact O-N 3.07Å; D353-N356 PolarHBondContact N-O 3.35Å; D353-N356 PolarHBondContact O-N 2.77Å; D353-K521 IonicContact OD2-NZ 3.81Å
354	G	66.9	Low	81.9	Confident	18 Å²	18	54.5 Å²	54.5	19%	0.186	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	-109.6	-176	0	0	0	0	0	113.2
355	H	73	Confident	80.7	Confident	83 Å²	83	58.8 Å²	58.8	38%	0.384	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-1.1	179.3	-65.9	87.2	0	0	0	113.5	D353 N407 L408 Y410	D353-H355 PolarHBondContact O-N 2.7Å; D353-H355 VanDerWaalsContact O-N 3.07Å; H355-N407 PolarHBondContact O-N 3.36Å; H355-L408 PolarHBondContact CD2-O 2.94Å; H355-L408 VanDerWaalsContact CD2-O 3.28Å; H355-L408 WeakPolarHBondContact O-CB 3.28Å; H355-L408 PolarHBondContact O-N 2.92Å; H355-Y410 AromaticContact CD2-CE2 3.83Å; H355-Y410 AromaticContact CD2-CZ 3.86Å; H355-Y410 AromaticContact CE1-CE2 3.38Å; H355-Y410 WeakPolarHBondContact CE1-CE2 3.4Å; H355-Y410 AromaticContact CE1-CZ 3.35Å; H355-Y410 PolarHBondContact CE1-OH 3.06Å; H355-Y410 AromaticContact ND1-CZ 3.74Å; H355-Y410 PolarHBondContact ND1-OH 3.5Å; H355-Y410 VanDerWaalsContact ND1-OH 3.1Å; H355-Y410 AromaticContact NE2-CD2 3.93Å; H355-Y410 AromaticContact NE2-CE2 3.09Å; H355-Y410 WeakPolarHBondContact NE2-CE2 3.23Å; H355-Y410 AromaticContact NE2-CZ 3.43Å; H355-Y410 PolarHBondContact NE2-OH 2.67Å
356	N	80	Confident	79.2	Confident	45 Å²	45	66.6 Å²	66.6	24%	0.241	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	143.4	-175	-63	-2.8	0	0	0	110.4	V352 D353 E404 F405 H406	V352-N356 WeakPolarHBondContact CA-O 3.27Å; D353-N356 PolarHBondContact N-O 3.35Å; D353-N356 PolarHBondContact O-N 2.77Å; N356-E404 PolarHBondContact ND2-OE1 3.07Å; N356-F405 CarbonylContact C-O 3.59Å; N356-F405 WeakPolarHBondContact CA-O 3.45Å; N356-H406 PolarHBondContact ND2-CD2 3.23Å; N356-H406 WeakPolarHBondContact OD1-CA 3.4Å
357	A	82.5	Confident	77.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.9	172.2	0	0	0	0	0	109.9	T351 V352 E404 F405 L408 F435	T351-A357 CarbonylContact O-C 3.55Å; T351-A357 VanDerWaalsContact O-CA 3.29Å; T351-A357 WeakPolarHBondContact O-CA 3.37Å; V352-A357 HydrophobicContact CG2-CB 4.4Å; A357-E404 WeakPolarHBondContact O-CA 3.42Å; A357-F405 PolarHBondContact N-O 3.32Å; A357-F405 PolarHBondContact O-N 2.7Å; A357-L408 HydrophobicContact CB-CD1 3.57Å; A357-F435 HydrophobicContact CB-CE2 3.71Å; A357-F435 HydrophobicContact CB-CZ 3.97Å
358	K	87.3	Confident	76	Confident	71 Å²	71	70 Å²	70	31%	0.309	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.3	172.1	-169.5	168.8	178.7	172.7	0	109.5	R350 T351 W360 T403 E404	R350-K358 VanDerWaalsContact CA-O 3.31Å; R350-K358 WeakPolarHBondContact CA-O 3.28Å; T351-K358 PolarHBondContact N-O 3.13Å; T351-K358 PolarHBondContact O-N 2.93Å; K358-W360 HydrophobicContact CB-CH2 3.79Å; K358-W360 HydrophobicContact CB-CZ2 4.27Å; K358-W360 HydrophobicContact CB-CZ3 4Å; K358-W360 HydrophobicContact CD-CH2 3.82Å; K358-W360 HydrophobicContact CD-CZ2 3.47Å; K358-W360 VanDerWaalsContact CD-CZ2 3.47Å; K358-W360 HydrophobicContact CG-CD2 4.4Å; K358-W360 HydrophobicContact CG-CE3 4.37Å; K358-W360 HydrophobicContact CG-CH2 3.7Å; K358-W360 HydrophobicContact CG-CZ2 3.67Å; K358-W360 HydrophobicContact CG-CZ3 4.05Å; K358-W360 WeakPolarHBondContact O-CZ3 3.31Å; K358-T403 WeakPolarHBondContact CA-O 3.49Å; K358-E404 HydrophobicContact CB-CG 4.39Å; K358-E404 HydrophobicContact CG-CB 4.46Å
359	V	90.3	Very high	74.9	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.1	-177.1	-179.3	0	0	0	0	109	I347 S402 T403 F405 V416	I347-V359 HydrophobicContact CG2-CG1 3.63Å; V359-S402 WeakPolarHBondContact O-CA 3.44Å; V359-S402 WeakPolarHBondContact O-CB 3.13Å; V359-T403 PolarHBondContact N-O 2.92Å; V359-T403 PolarHBondContact O-N 3.25Å; V359-F405 HydrophobicContact CB-CE2 4.26Å; V359-F405 HydrophobicContact CG2-CD2 4.16Å; V359-F405 HydrophobicContact CG2-CE2 3.79Å; V359-V416 HydrophobicContact CG1-CG1 4.38Å
360	W	91.3	Very high	73.8	Confident	69 Å²	69	68 Å²	68	26%	0.261	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145.4	176.4	-62	-105.4	0	0	0	110.6	E348 N349 T351 K358 L401	E348-W360 PolarHBondContact N-O 3.31Å; N349-W360 PolarHBondContact O-N 3.14Å; N349-W360 WeakPolarHBondContact OD1-CB 3.46Å; T351-W360 HydrophobicContact CG2-CH2 3.63Å; T351-W360 HydrophobicContact CG2-CZ3 3.73Å; T351-W360 WeakPolarHBondContact OG1-CH2 3.32Å; T351-W360 WeakPolarHBondContact OG1-CZ3 3.48Å; K358-W360 HydrophobicContact CB-CH2 3.79Å; K358-W360 HydrophobicContact CB-CZ2 4.27Å; K358-W360 HydrophobicContact CB-CZ3 4Å; K358-W360 HydrophobicContact CD-CH2 3.82Å; K358-W360 HydrophobicContact CD-CZ2 3.47Å; K358-W360 VanDerWaalsContact CD-CZ2 3.47Å; K358-W360 HydrophobicContact CG-CD2 4.4Å; K358-W360 HydrophobicContact CG-CE3 4.37Å; K358-W360 HydrophobicContact CG-CH2 3.7Å; K358-W360 HydrophobicContact CG-CZ2 3.67Å; K358-W360 HydrophobicContact CG-CZ3 4.05Å; K358-W360 WeakPolarHBondContact O-CZ3 3.31Å; W360-L401 WeakPolarHBondContact CA-O 3.35Å
361	W	92.3	Very high	72.3	Confident	2 Å²	2	70 Å²	70	1%	0.008	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	161.2	175.6	58.6	90.3	0	0	0	110.7	E346 I347 F377 V379 T396 V400 L401 S402 T403 V418	E346-W361 CarbonylContact O-C 3.59Å; E346-W361 WeakPolarHBondContact O-CA 3.43Å; E346-W361 VanDerWaalsContact O-CB 3.26Å; E346-W361 WeakPolarHBondContact O-CB 3.19Å; I347-W361 HydrophobicContact CG1-CB 4.44Å; W361-F377 AromaticContact CD1-CE1 3.92Å; W361-F377 HydrophobicContact CZ2-CB 4.29Å; W361-F377 HydrophobicContact CZ2-CD2 4.32Å; W361-F377 HydrophobicContact CZ2-CG 4.37Å; W361-F377 AromaticContact NE1-CD1 3.58Å; W361-F377 AromaticContact NE1-CD2 3.49Å; W361-F377 AromaticContact NE1-CE1 3.69Å; W361-F377 AromaticContact NE1-CE2 3.6Å; W361-F377 AromaticContact NE1-CG 3.47Å; W361-F377 AromaticContact NE1-CZ 3.71Å; W361-V379 HydrophobicContact CH2-CG2 3.48Å; W361-V379 VanDerWaalsContact CH2-CG2 3.48Å; W361-V379 HydrophobicContact CZ2-CG2 3.84Å; W361-V379 HydrophobicContact CZ3-CG2 3.94Å; W361-T396 HydrophobicContact CH2-CG2 4.46Å; W361-V400 VanDerWaalsContact CZ2-O 3.29Å; W361-V400 WeakPolarHBondContact CZ2-O 3.5Å; W361-L401 PolarHBondContact N-O 2.72Å; W361-L401 WeakPolarHBondContact O-CB 3.33Å; W361-S402 VanDerWaalsContact CZ3-C 3.42Å; W361-S402 VanDerWaalsContact CZ3-CA 3.44Å; W361-T403 HydrophobicContact CH2-CG2 4.14Å; W361-T403 HydrophobicContact CZ3-CG2 3.88Å; W361-T403 VanDerWaalsContact CZ3-N 3.3Å; W361-V418 HydrophobicContact CB-CG2 4.47Å; W361-V418 HydrophobicContact CD2-CG1 4.01Å; W361-V418 HydrophobicContact CD2-CG2 4.01Å; W361-V418 HydrophobicContact CE3-CG2 3.91Å; W361-V418 HydrophobicContact CG-CG1 4.02Å; W361-V418 HydrophobicContact CG-CG2 4.27Å; W361-V418 HydrophobicContact CZ3-CG2 4.49Å
362	R	88.8	Confident	71.4	Confident	114 Å²	114	68.8 Å²	68.8	43%	0.43	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	168.5	174.4	65.4	162.4	172.2	-144.6	13.5	110.8	E346 E348	E346-R362 HydrophobicContact CB-CG 4.14Å; E346-R362 PolarHBondContact N-O 3.22Å; E346-R362 PolarHBondContact O-N 2.91Å; E346-R362 IonicContact OE2-CZ 3.6Å; E346-R362 IonicContact OE2-NE 3.81Å; E346-R362 PolarHBondContact OE2-NE 3.05Å; E346-R362 VanDerWaalsContact OE2-NE 3.11Å; E346-R362 IonicContact OE2-NH2 2.65Å; E346-R362 PolarHBondContact OE2-NH2 2.83Å; E348-R362 HydrophobicContact CG-CB 4.07Å; E348-R362 HydrophobicContact CG-CG 3.63Å; E348-R362 WeakPolarHBondContact OE1-CD 3.35Å; E348-R362 IonicContact OE1-CZ 3.21Å; E348-R362 IonicContact OE1-NE 2.73Å; E348-R362 IonicContact OE1-NH1 2.73Å; E348-R362 PolarHBondContact OE1-NH1 2.89Å
363	L	84	Confident	71.3	Confident	36 Å²	36	68.9 Å²	68.9	19%	0.188	39%	0.386	C	S	.	.			trans	-100.3	145.9	169.9	-69	155.5	0	0	0	109.2	V343 I369 F377 L420	V343-L363 HydrophobicContact CG1-CD2 3.9Å; L363-I369 HydrophobicContact CB-CD1 4.29Å; L363-I369 HydrophobicContact CD1-CD1 3.23Å; L363-I369 HydrophobicContact CD2-CD1 4.04Å; L363-I369 HydrophobicContact CG-CD1 4.02Å; L363-F377 HydrophobicContact CD1-CE1 4.33Å; L363-F377 HydrophobicContact CD1-CZ 3.74Å; L363-F377 HydrophobicContact CD2-CE1 3.93Å; L363-F377 HydrophobicContact CD2-CZ 4.2Å; L363-F377 HydrophobicContact CG-CE1 4.21Å; L363-F377 HydrophobicContact CG-CZ 4.03Å; L363-L420 HydrophobicContact CD2-CD1 3.63Å; L363-L420 HydrophobicContact CD2-CD2 4.28Å; L363-L420 HydrophobicContact CD2-CG 4.25Å
364	P	79.8	Confident	71.7	Confident	42 Å²	42	64.8 Å²	64.8	27%	0.273	37%	0.366	S	S	.	.			trans	-58.3	138.1	177.6	-23.2	33.2	0	0	0	112.1	V343 Q344 N366 S367	V343-P364 HydrophobicContact CG1-CG 4.4Å; Q344-P364 WeakPolarHBondContact O-CD 3.27Å; Q344-P364 WeakPolarHBondContact O-CG 3.45Å; P364-N366 PolarHBondContact O-N 3.12Å; P364-S367 PolarHBondContact O-N 2.94Å; P364-S367 PolarHBondContact O-OG 2.93Å
365	T	61.6	Low	72.6	Confident	147 Å²	147	67.2 Å²	67.2	90%	0.902	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-10.6	-172.4	36.1	0	0	0	0	115.8
366	N	57.9	Low	73.3	Confident	165 Å²	165	63.3 Å²	63.3	88%	0.882	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	15.1	175.4	-84.4	1.4	0	0	0	113.5	P364 D368	P364-N366 PolarHBondContact O-N 3.12Å; N366-D368 PolarHBondContact O-N 3.19Å
367	S	56.7	Low	73.8	Confident	31 Å²	31	61.1 Å²	61.1	22%	0.217	35%	0.348	C	S	.	.			trans	-91.4	97.1	176.1	54.9	0	0	0	0	110.3	P364 I369	P364-S367 PolarHBondContact O-N 2.94Å; P364-S367 PolarHBondContact O-OG 2.93Å; S367-I369 PolarHBondContact O-N 3.35Å
368	D	54.2	Low	74.2	Confident	158 Å²	158	61.5 Å²	61.5	85%	0.845	35%	0.35	S	S	*	.			trans	-66.4	87.1	162.8	-78.9	-29.1	0	0	0	108	N366 T370	N366-D368 PolarHBondContact O-N 3.19Å; D368-T370 PolarHBondContact O-N 3.21Å; D368-T370 VanDerWaalsContact O-N 3.09Å
369	I	58.8	Low	74.5	Confident	55 Å²	55	58.1 Å²	58.1	28%	0.282	34%	0.335	S	S	.	.			trans	-75	100.2	173.5	-59.4	174.1	0	0	0	106.8	L363 S367 L398	L363-I369 HydrophobicContact CB-CD1 4.29Å; L363-I369 HydrophobicContact CD1-CD1 3.23Å; L363-I369 HydrophobicContact CD2-CD1 4.04Å; L363-I369 HydrophobicContact CG-CD1 4.02Å; S367-I369 PolarHBondContact O-N 3.35Å; I369-L398 HydrophobicContact CG2-CD2 4.19Å
370	T	55.2	Low	74.7	Confident	83 Å²	83	59 Å²	59	51%	0.509	34%	0.339	S	S	.	.			trans	-74	153.6	174.4	48	0	0	0	0	110.7	D368 G372 T373	D368-T370 PolarHBondContact O-N 3.21Å; D368-T370 VanDerWaalsContact O-N 3.09Å; T370-G372 PolarHBondContact O-N 3.13Å; T370-T373 PolarHBondContact N-OG1 3.23Å; T370-T373 VanDerWaalsContact N-OG1 3.16Å; T370-T373 PolarHBondContact O-N 2.87Å; T370-T373 PolarHBondContact O-OG1 2.88Å; T370-T373 PolarHBondContact OG1-OG1 2.95Å; T370-T373 VanDerWaalsContact OG1-OG1 3.08Å
371	P	48.6	Very low	74.7	Confident	142 Å²	142	55.9 Å²	55.9	92%	0.922	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	111.2	167.3	-19	30.7	0	0	0	109.1
372	G	55.7	Low	74.6	Confident	48 Å²	48	57.7 Å²	57.7	50%	0.495	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.9	-10.1	-177.9	0	0	0	0	0	115.8	T370 N422	T370-G372 PolarHBondContact O-N 3.13Å; G372-N422 PolarHBondContact O-ND2 3.46Å
373	T	66	Low	74.3	Confident	38 Å²	38	54.4 Å²	54.4	23%	0.233	33%	0.325	C	S	.	.	S	Bend	trans	-83.2	-27.6	178.6	-7.1	0	0	0	0	113.7	T370	T370-T373 PolarHBondContact N-OG1 3.23Å; T370-T373 VanDerWaalsContact N-OG1 3.16Å; T370-T373 PolarHBondContact O-N 2.87Å; T370-T373 PolarHBondContact O-OG1 2.88Å; T370-T373 PolarHBondContact OG1-OG1 2.95Å; T370-T373 VanDerWaalsContact OG1-OG1 3.08Å
374	A	75.7	Confident	73.9	Confident	14 Å²	14	54 Å²	54	12%	0.116	32%	0.324	C	S	.	.			trans	-158.4	145.7	179.1	0	0	0	0	0	112.6	L398 L420 I421	A374-L398 HydrophobicContact CB-CD1 3.92Å; A374-L420 HydrophobicContact CB-CB 4.44Å; A374-L420 HydrophobicContact CB-CD2 3.43Å; A374-L420 VanDerWaalsContact CB-CD2 3.43Å; A374-L420 HydrophobicContact CB-CG 4.48Å; A374-I421 CarbonylContact C-O 3.53Å; A374-I421 VanDerWaalsContact CA-O 3.27Å; A374-I421 WeakPolarHBondContact CA-O 3.41Å; A374-I421 WeakPolarHBondContact CB-O 3.43Å
375	T	84.1	Confident	73.2	Confident	68 Å²	68	56.3 Å²	56.3	42%	0.417	34%	0.34	S	S	.	.	S	Bend	trans	-98.8	-21.3	173.1	53.6	0	0	0	0	112.5	I421 C423	T375-I421 PolarHBondContact N-O 3.17Å; T375-I421 PolarHBondContact OG1-O 2.74Å; T375-C423 PolarHBondContact OG1-N 2.91Å
376	G	87.6	Confident	73.1	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.8	-163.6	-176.2	0	0	0	0	0	114.7	T396 I421	G376-T396 CarbonylContact C-O 3.6Å; G376-T396 WeakPolarHBondContact CA-O 3.37Å; G376-I421 VanDerWaalsContact C-CG1 3.48Å; G376-I421 PolarHBondContact N-O 2.91Å; G376-I421 WeakPolarHBondContact O-CG1 3.38Å; G376-I421 PolarHBondContact O-N 2.69Å
377	F	90.8	Very high	73.8	Confident	0 Å²	0	51 Å²	51	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.1	174.7	-56.4	-86.7	0	0	0	112	P345 W361 L363 T395 T396 L398 L401 V418 R419 L420	P345-F377 HydrophobicContact CB-CE1 4.47Å; P345-F377 HydrophobicContact CG-CD1 4.16Å; P345-F377 HydrophobicContact CG-CE1 4.14Å; W361-F377 AromaticContact CD1-CE1 3.92Å; W361-F377 HydrophobicContact CZ2-CB 4.29Å; W361-F377 HydrophobicContact CZ2-CD2 4.32Å; W361-F377 HydrophobicContact CZ2-CG 4.37Å; W361-F377 AromaticContact NE1-CD1 3.58Å; W361-F377 AromaticContact NE1-CD2 3.49Å; W361-F377 AromaticContact NE1-CE1 3.69Å; W361-F377 AromaticContact NE1-CE2 3.6Å; W361-F377 AromaticContact NE1-CG 3.47Å; W361-F377 AromaticContact NE1-CZ 3.71Å; L363-F377 HydrophobicContact CD1-CE1 4.33Å; L363-F377 HydrophobicContact CD1-CZ 3.74Å; L363-F377 HydrophobicContact CD2-CE1 3.93Å; L363-F377 HydrophobicContact CD2-CZ 4.2Å; L363-F377 HydrophobicContact CG-CE1 4.21Å; L363-F377 HydrophobicContact CG-CZ 4.03Å; F377-T395 CarbonylContact O-C 3.51Å; F377-T395 VanDerWaalsContact O-CA 3.27Å; F377-T395 WeakPolarHBondContact O-CA 3.19Å; F377-T396 PolarHBondContact N-O 3.3Å; F377-T396 PolarHBondContact O-N 3.06Å; F377-L398 HydrophobicContact CE2-CD1 4.12Å; F377-L398 WeakPolarHBondContact CE2-O 3.48Å; F377-L398 HydrophobicContact CZ-CD1 4.08Å; F377-L401 HydrophobicContact CE2-CD2 3.69Å; F377-L401 HydrophobicContact CZ-CD2 3.7Å; F377-V418 HydrophobicContact CB-CG1 4.12Å; F377-V418 HydrophobicContact CD1-CG1 3.97Å; F377-V418 HydrophobicContact CG-CG1 4.36Å; F377-R419 CarbonylContact C-O 3.59Å; F377-R419 WeakPolarHBondContact CA-O 3.41Å; F377-L420 HydrophobicContact CD1-CD2 3.98Å; F377-L420 HydrophobicContact CD1-CG 4.03Å; F377-L420 HydrophobicContact CE1-CD2 3.62Å; F377-L420 HydrophobicContact CE1-CG 3.84Å; F377-L420 HydrophobicContact CZ-CD2 4.16Å
378	L	92.3	Very high	74.7	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.042	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119	167.4	179	66.9	0	0	0	108.5	Q380 E393 V418 R419 I421 Q426	L378-Q380 HydrophobicContact CG-CG 4.22Å; L378-E393 HydrophobicContact CD1-CG 3.5Å; L378-E393 VanDerWaalsContact CD1-CG 3.5Å; L378-E393 HydrophobicContact CG-CG 4.47Å; L378-V418 CarbonylContact O-C 3.53Å; L378-V418 WeakPolarHBondContact O-CA 3.16Å; L378-R419 HydrophobicContact CB-CB 4.32Å; L378-R419 PolarHBondContact N-O 3.39Å; L378-R419 PolarHBondContact O-N 3.47Å; L378-I421 HydrophobicContact CB-CG2 3.67Å; L378-Q426 HydrophobicContact CD2-CG 4.26Å
379	V	93.4	Very high	76.2	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.4	-179.4	-170.2	0	0	0	0	109.6	W361 E393 K394 T403 F405 V416 V418	W361-V379 HydrophobicContact CH2-CG2 3.48Å; W361-V379 VanDerWaalsContact CH2-CG2 3.48Å; W361-V379 HydrophobicContact CZ2-CG2 3.84Å; W361-V379 HydrophobicContact CZ3-CG2 3.94Å; V379-E393 WeakPolarHBondContact O-CA 2.81Å; V379-K394 PolarHBondContact N-O 2.85Å; V379-K394 PolarHBondContact O-N 3.13Å; V379-T403 HydrophobicContact CB-CG2 4.25Å; V379-T403 HydrophobicContact CG1-CG2 3.71Å; V379-T403 HydrophobicContact CG2-CG2 4.37Å; V379-F405 HydrophobicContact CG1-CZ 3.8Å; V379-V416 HydrophobicContact CG1-CG1 4.05Å; V379-V418 HydrophobicContact CG1-CG2 4.05Å; V379-V418 HydrophobicContact CG2-CG1 4.24Å; V379-V418 HydrophobicContact CG2-CG2 4.23Å
380	Q	93.4	Very high	77.6	Confident	17 Å²	17	55.4 Å²	55.4	8%	0.079	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.3	-175.6	-65.5	173.8	-49	0	0	110.6	L378 F382 L392 E393 V416 V417	L378-Q380 HydrophobicContact CG-CG 4.22Å; Q380-F382 HydrophobicContact CB-CD2 4.25Å; Q380-F382 HydrophobicContact CB-CE2 3.35Å; Q380-F382 HydrophobicContact CB-CZ 3.66Å; Q380-F382 HydrophobicContact CG-CE2 4.47Å; Q380-F382 HydrophobicContact CG-CZ 4.39Å; Q380-L392 WeakPolarHBondContact CA-O 3.36Å; Q380-E393 HydrophobicContact CG-CB 4.44Å; Q380-E393 HydrophobicContact CG-CG 4.04Å; Q380-E393 PolarHBondContact NE2-OE2 2.61Å; Q380-V416 WeakPolarHBondContact O-CA 3.21Å; Q380-V417 PolarHBondContact N-O 3.4Å; Q380-V417 PolarHBondContact O-N 3.22Å
381	L	91.6	Very high	79.1	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.3	175.5	-179.6	72.1	0	0	0	109	L391 L392 F405 L408 Y414 S415 V416 F435	L381-L391 HydrophobicContact CD2-CB 4.34Å; L381-L391 HydrophobicContact CD2-CD1 4.49Å; L381-L391 HydrophobicContact CG-CB 4.4Å; L381-L391 PolarHBondContact O-N 3.45Å; L381-L392 HydrophobicContact CB-CB 4Å; L381-L392 HydrophobicContact CD2-CB 4.39Å; L381-L392 PolarHBondContact N-O 3Å; L381-L392 PolarHBondContact O-N 2.84Å; L381-F405 HydrophobicContact CB-CD1 4.16Å; L381-F405 HydrophobicContact CB-CE1 3.8Å; L381-F405 HydrophobicContact CB-CZ 4.32Å; L381-F405 HydrophobicContact CD2-CD1 3.93Å; L381-F405 HydrophobicContact CD2-CE1 4.43Å; L381-F405 HydrophobicContact CD2-CG 4.28Å; L381-F405 HydrophobicContact CG-CD1 4.47Å; L381-L408 HydrophobicContact CD2-CD2 3.83Å; L381-Y414 HydrophobicContact CD1-CD1 4.11Å; L381-Y414 HydrophobicContact CD1-CG 4.35Å; L381-Y414 HydrophobicContact CD2-CD1 4.31Å; L381-Y414 HydrophobicContact CG-CD1 4.32Å; L381-S415 CarbonylContact C-O 3.59Å; L381-V416 HydrophobicContact CB-CG2 4.48Å; L381-V416 HydrophobicContact CD1-CG2 3.38Å; L381-F435 HydrophobicContact CD1-CE1 4.2Å; L381-F435 HydrophobicContact CD1-CZ 4.07Å
382	F	89.4	Confident	80.9	Confident	39 Å²	39	51.4 Å²	51.4	17%	0.171	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	155.5	-178.8	-58.7	-91.6	0	0	0	111.5	Q380 N388 K389 K390 S415 V417	Q380-F382 HydrophobicContact CB-CD2 4.25Å; Q380-F382 HydrophobicContact CB-CE2 3.35Å; Q380-F382 HydrophobicContact CB-CZ 3.66Å; Q380-F382 HydrophobicContact CG-CE2 4.47Å; Q380-F382 HydrophobicContact CG-CZ 4.39Å; F382-N388 WeakPolarHBondContact CD1-O 3.46Å; F382-K389 VanDerWaalsContact CA-O 3.29Å; F382-K389 WeakPolarHBondContact CA-O 3.46Å; F382-K390 HydrophobicContact CD1-CB 3.9Å; F382-K390 HydrophobicContact CD1-CG 4.31Å; F382-K390 HydrophobicContact CE1-CB 3.68Å; F382-K390 HydrophobicContact CE1-CD 4.32Å; F382-K390 HydrophobicContact CE1-CG 3.88Å; F382-K390 HydrophobicContact CZ-CG 4.35Å; F382-S415 PolarHBondContact N-O 2.64Å; F382-S415 PolarHBondContact O-N 2.83Å; F382-V417 HydrophobicContact CD2-CG2 4.4Å; F382-V417 HydrophobicContact CE2-CB 4.24Å; F382-V417 HydrophobicContact CE2-CG2 4.2Å
383	E	84.3	Confident	82.6	Confident	46 Å²	46	53.3 Å²	53.3	22%	0.215	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-67.7	147.3	156.5	-67.9	179.5	-177.9	0	0	109.7	S387 K389 L391	E383-S387 WeakPolarHBondContact CB-OG 3.25Å; E383-S387 WeakPolarHBondContact OE2-CB 3.5Å; E383-S387 PolarHBondContact OE2-OG 3.17Å; E383-K389 HydrophobicContact CB-CB 4.43Å; E383-K389 HydrophobicContact CG-CB 4.38Å; E383-K389 PolarHBondContact N-O 2.86Å; E383-L391 HydrophobicContact CG-CD1 3.79Å; E383-L391 HydrophobicContact CG-CD2 3.93Å; E383-L391 HydrophobicContact CG-CG 3.96Å
384	P	75.1	Confident	83.6	Confident	27 Å²	27	55.2 Å²	55.2	18%	0.175	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-64.6	163.6	178.4	32.5	-42.7	0	0	0	111.5	S387 D413 L434	P384-S387 PolarHBondContact O-N 2.76Å; P384-S387 PolarHBondContact O-OG 3.4Å; P384-D413 HydrophobicContact CB-CB 4.23Å; P384-D413 WeakPolarHBondContact CD-O 3.38Å; P384-D413 HydrophobicContact CG-CB 3.67Å; P384-L434 HydrophobicContact CB-CD2 4.33Å
385	P	65.7	Low	84.3	Confident	91 Å²	91	59 Å²	59	59%	0.591	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	139.3	172.2	-21.7	32.3	0	0	0	111
386	P	59.1	Low	84.5	Confident	135 Å²	135	56.8 Å²	56.8	88%	0.877	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95.8	-4.9	15.9	35.6	-34.5	0	0	0	115.9
387	S	71.5	Confident	84.4	Confident	65 Å²	65	62.2 Å²	62.2	46%	0.455	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-32.6	-173.5	70.2	0	0	0	0	113.1	E383 P384 K389	E383-S387 WeakPolarHBondContact CB-OG 3.25Å; E383-S387 WeakPolarHBondContact OE2-CB 3.5Å; E383-S387 PolarHBondContact OE2-OG 3.17Å; P384-S387 PolarHBondContact O-N 2.76Å; P384-S387 PolarHBondContact O-OG 3.4Å; S387-K389 PolarHBondContact O-N 3.36Å
388	N	76.3	Confident	84.2	Confident	102 Å²	102	65 Å²	65	55%	0.545	35%	0.347	S	S	.	.			trans	44.9	26.1	179.9	-77.3	-19.2	0	0	0	114.1	F382 K390	F382-N388 WeakPolarHBondContact CD1-O 3.46Å; N388-K390 PolarHBondContact O-N 2.95Å
389	K	84.9	Confident	83.7	Confident	129 Å²	129	70.9 Å²	70.9	56%	0.561	38%	0.379	S	S	*	.			trans	-74.1	125.3	-172.9	-175.2	-179.9	177.9	-178	0	109.3	F382 E383 S387 L391	F382-K389 VanDerWaalsContact CA-O 3.29Å; F382-K389 WeakPolarHBondContact CA-O 3.46Å; E383-K389 HydrophobicContact CB-CB 4.43Å; E383-K389 HydrophobicContact CG-CB 4.38Å; E383-K389 PolarHBondContact N-O 2.86Å; S387-K389 PolarHBondContact O-N 3.36Å; K389-L391 PolarHBondContact O-N 3.46Å
390	K	88.5	Confident	83.5	Confident	106 Å²	106	73.5 Å²	73.5	46%	0.461	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	116.8	173.8	-168.1	172.8	71.8	176.2	0	109.5	F382 N388 E393	F382-K390 HydrophobicContact CD1-CB 3.9Å; F382-K390 HydrophobicContact CD1-CG 4.31Å; F382-K390 HydrophobicContact CE1-CB 3.68Å; F382-K390 HydrophobicContact CE1-CD 4.32Å; F382-K390 HydrophobicContact CE1-CG 3.88Å; F382-K390 HydrophobicContact CZ-CG 4.35Å; N388-K390 PolarHBondContact O-N 2.95Å; K390-E393 HydrophobicContact CD-CB 4.37Å; K390-E393 IonicContact NZ-OE1 2.89Å; K390-E393 IonicContact NZ-OE2 3.1Å; K390-E393 PolarHBondContact NZ-OE2 3.26Å
391	L	86.9	Confident	83.3	Confident	71 Å²	71	76.1 Å²	76.1	37%	0.372	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-39.2	179.6	-65	179.1	0	0	0	112.1	L381 E383 K389 Y414	L381-L391 HydrophobicContact CD2-CB 4.34Å; L381-L391 HydrophobicContact CD2-CD1 4.49Å; L381-L391 HydrophobicContact CG-CB 4.4Å; L381-L391 PolarHBondContact O-N 3.45Å; E383-L391 HydrophobicContact CG-CD1 3.79Å; E383-L391 HydrophobicContact CG-CD2 3.93Å; E383-L391 HydrophobicContact CG-CG 3.96Å; K389-L391 PolarHBondContact O-N 3.46Å; L391-Y414 HydrophobicContact CD1-CD1 3.81Å; L391-Y414 HydrophobicContact CD1-CE1 3.55Å
392	L	86.6	Confident	83.2	Confident	69 Å²	69	77.4 Å²	77.4	36%	0.361	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	148.8	-178	-158.7	75.7	0	0	0	111.1	Q380 L381 K394 F405	Q380-L392 WeakPolarHBondContact CA-O 3.36Å; L381-L392 HydrophobicContact CB-CB 4Å; L381-L392 HydrophobicContact CD2-CB 4.39Å; L381-L392 PolarHBondContact N-O 3Å; L381-L392 PolarHBondContact O-N 2.84Å; L392-K394 HydrophobicContact CD2-CD 4.24Å; L392-K394 HydrophobicContact CD2-CG 4.34Å; L392-F405 HydrophobicContact CD2-CD1 3.69Å; L392-F405 HydrophobicContact CD2-CE1 4.08Å
393	E	90.9	Very high	83.3	Confident	89 Å²	89	76.2 Å²	76.2	42%	0.416	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	131.7	173	-176.6	169.5	98.3	0	0	109.1	L378 V379 Q380 K390	L378-E393 HydrophobicContact CD1-CG 3.5Å; L378-E393 VanDerWaalsContact CD1-CG 3.5Å; L378-E393 HydrophobicContact CG-CG 4.47Å; V379-E393 WeakPolarHBondContact O-CA 2.81Å; Q380-E393 HydrophobicContact CG-CB 4.44Å; Q380-E393 HydrophobicContact CG-CG 4.04Å; Q380-E393 PolarHBondContact NE2-OE2 2.61Å; K390-E393 HydrophobicContact CD-CB 4.37Å; K390-E393 IonicContact NZ-OE1 2.89Å; K390-E393 IonicContact NZ-OE2 3.1Å; K390-E393 PolarHBondContact NZ-OE2 3.26Å
394	K	87.9	Confident	83.5	Confident	77 Å²	77	77.4 Å²	77.4	34%	0.335	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	140	178	-76.1	-176.3	173.2	178.4	0	110.3	V379 L392 E404	V379-K394 PolarHBondContact N-O 2.85Å; V379-K394 PolarHBondContact O-N 3.13Å; L392-K394 HydrophobicContact CD2-CD 4.24Å; L392-K394 HydrophobicContact CD2-CG 4.34Å; K394-E404 PolarHBondContact NZ-O 3.23Å
395	T	89.2	Confident	84.1	Confident	94 Å²	94	76.2 Å²	76.2	58%	0.577	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.4	172.6	-51.2	0	0	0	0	109.8	F377 I421	F377-T395 CarbonylContact O-C 3.51Å; F377-T395 VanDerWaalsContact O-CA 3.27Å; F377-T395 WeakPolarHBondContact O-CA 3.19Å; T395-I421 HydrophobicContact CG2-CD1 3.34Å; T395-I421 HydrophobicContact CG2-CG1 4.47Å
396	T	88.1	Confident	85	Confident	21 Å²	21	76.3 Å²	76.3	13%	0.129	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	160	176.7	72.1	0	0	0	0	111	W361 G376 F377 V400	W361-T396 HydrophobicContact CH2-CG2 4.46Å; G376-T396 CarbonylContact C-O 3.6Å; G376-T396 WeakPolarHBondContact CA-O 3.37Å; F377-T396 PolarHBondContact N-O 3.3Å; F377-T396 PolarHBondContact O-N 3.06Å; T396-V400 HydrophobicContact CG2-CG1 4.22Å; T396-V400 PolarHBondContact OG1-O 2.76Å
397	L	87.6	Confident	86	Confident	116 Å²	116	76.5 Å²	76.5	61%	0.607	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	159.6	172.1	-62.5	173.9	0	0	0	110.8	N399 V400	L397-N399 WeakPolarHBondContact CB-OD1 3.45Å; L397-N399 PolarHBondContact O-N 3.16Å; L397-V400 HydrophobicContact CB-CG2 4.26Å; L397-V400 PolarHBondContact O-N 3.32Å
398	L	84.5	Confident	86.6	Confident	57 Å²	57	73.8 Å²	73.8	30%	0.298	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.9	-176.9	-167.6	67.6	0	0	0	113.6	I369 A374 F377 V400 L420	I369-L398 HydrophobicContact CG2-CD2 4.19Å; A374-L398 HydrophobicContact CB-CD1 3.92Å; F377-L398 HydrophobicContact CE2-CD1 4.12Å; F377-L398 WeakPolarHBondContact CE2-O 3.48Å; F377-L398 HydrophobicContact CZ-CD1 4.08Å; L398-V400 VanDerWaalsContact C-N 3.34Å; L398-L420 HydrophobicContact CD1-CD2 3.63Å
399	N	82.4	Confident	86.7	Confident	132 Å²	132	76 Å²	76	71%	0.706	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-4.7	175.9	64.9	-26.2	0	0	0	113.9	L397	L397-N399 WeakPolarHBondContact CB-OD1 3.45Å; L397-N399 PolarHBondContact O-N 3.16Å
400	V	88.6	Confident	86.2	Confident	55 Å²	55	73.6 Å²	73.6	33%	0.333	37%	0.371	S	S	.	.			trans	-102.8	106.1	-178.7	178.7	0	0	0	0	109.3	W361 T396 L397 L398 S402	W361-V400 VanDerWaalsContact CZ2-O 3.29Å; W361-V400 WeakPolarHBondContact CZ2-O 3.5Å; T396-V400 HydrophobicContact CG2-CG1 4.22Å; T396-V400 PolarHBondContact OG1-O 2.76Å; L397-V400 HydrophobicContact CB-CG2 4.26Å; L397-V400 PolarHBondContact O-N 3.32Å; L398-V400 VanDerWaalsContact C-N 3.34Å; V400-S402 WeakPolarHBondContact CG1-O 3Å
401	L	89.3	Confident	85.5	Confident	73 Å²	73	73.8 Å²	73.8	38%	0.382	37%	0.374	S	S	.	.			trans	-102.5	15.7	-173.9	-67.9	-178.1	0	0	0	114.3	W360 W361 F377	W360-L401 WeakPolarHBondContact CA-O 3.35Å; W361-L401 PolarHBondContact N-O 2.72Å; W361-L401 WeakPolarHBondContact O-CB 3.33Å; F377-L401 HydrophobicContact CE2-CD2 3.69Å; F377-L401 HydrophobicContact CZ-CD2 3.7Å
402	S	91.2	Very high	85.1	Confident	32 Å²	32	73.4 Å²	73.4	22%	0.224	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	152	177.6	71.9	0	0	0	0	112	V359 W361 V400	V359-S402 WeakPolarHBondContact O-CA 3.44Å; V359-S402 WeakPolarHBondContact O-CB 3.13Å; W361-S402 VanDerWaalsContact CZ3-C 3.42Å; W361-S402 VanDerWaalsContact CZ3-CA 3.44Å; V400-S402 WeakPolarHBondContact CG1-O 3Å
403	T	90.4	Very high	85	Confident	14 Å²	14	73.2 Å²	73.2	9%	0.086	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	153.3	170.4	-166.5	0	0	0	0	110.8	K358 V359 W361 V379 F405	K358-T403 WeakPolarHBondContact CA-O 3.49Å; V359-T403 PolarHBondContact N-O 2.92Å; V359-T403 PolarHBondContact O-N 3.25Å; W361-T403 HydrophobicContact CH2-CG2 4.14Å; W361-T403 HydrophobicContact CZ3-CG2 3.88Å; W361-T403 VanDerWaalsContact CZ3-N 3.3Å; V379-T403 HydrophobicContact CB-CG2 4.25Å; V379-T403 HydrophobicContact CG1-CG2 3.71Å; V379-T403 HydrophobicContact CG2-CG2 4.37Å; T403-F405 HydrophobicContact CG2-CD2 4.49Å; T403-F405 HydrophobicContact CG2-CE1 4.1Å; T403-F405 HydrophobicContact CG2-CE2 3.75Å; T403-F405 HydrophobicContact CG2-CZ 3.54Å
404	E	87.9	Confident	84.9	Confident	70 Å²	70	69.5 Å²	69.5	33%	0.327	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.8	176.1	-168.2	173	-179.1	0	0	111.2	N356 A357 K358 K394 H406	N356-E404 PolarHBondContact ND2-OE1 3.07Å; A357-E404 WeakPolarHBondContact O-CA 3.42Å; K358-E404 HydrophobicContact CB-CG 4.39Å; K358-E404 HydrophobicContact CG-CB 4.46Å; K394-E404 PolarHBondContact NZ-O 3.23Å; E404-H406 PolarHBondContact O-ND1 2.72Å; E404-H406 IonicContact OE1-NE2 2.81Å; E404-H406 IonicContact OE2-NE2 3.67Å
405	F	88.1	Confident	84.9	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.009	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.2	173.2	-55.4	-74.4	0	0	0	108.4	N356 A357 V359 V379 L381 L392 T403 L408 V416	N356-F405 CarbonylContact C-O 3.59Å; N356-F405 WeakPolarHBondContact CA-O 3.45Å; A357-F405 PolarHBondContact N-O 3.32Å; A357-F405 PolarHBondContact O-N 2.7Å; V359-F405 HydrophobicContact CB-CE2 4.26Å; V359-F405 HydrophobicContact CG2-CD2 4.16Å; V359-F405 HydrophobicContact CG2-CE2 3.79Å; V379-F405 HydrophobicContact CG1-CZ 3.8Å; L381-F405 HydrophobicContact CB-CD1 4.16Å; L381-F405 HydrophobicContact CB-CE1 3.8Å; L381-F405 HydrophobicContact CB-CZ 4.32Å; L381-F405 HydrophobicContact CD2-CD1 3.93Å; L381-F405 HydrophobicContact CD2-CE1 4.43Å; L381-F405 HydrophobicContact CD2-CG 4.28Å; L381-F405 HydrophobicContact CG-CD1 4.47Å; L392-F405 HydrophobicContact CD2-CD1 3.69Å; L392-F405 HydrophobicContact CD2-CE1 4.08Å; T403-F405 HydrophobicContact CG2-CD2 4.49Å; T403-F405 HydrophobicContact CG2-CE1 4.1Å; T403-F405 HydrophobicContact CG2-CE2 3.75Å; T403-F405 HydrophobicContact CG2-CZ 3.54Å; F405-L408 HydrophobicContact CB-CD1 4.17Å; F405-L408 HydrophobicContact CB-CD2 4.25Å; F405-L408 HydrophobicContact CB-CG 4.41Å; F405-V416 HydrophobicContact CD2-CG2 4.46Å; F405-V416 HydrophobicContact CE2-CG1 4.27Å; F405-V416 HydrophobicContact CE2-CG2 3.64Å; F405-V416 HydrophobicContact CZ-CG1 4.16Å; F405-V416 HydrophobicContact CZ-CG2 3.8Å
406	H	84.3	Confident	85.1	Confident	93 Å²	93	61.9 Å²	61.9	43%	0.431	31%	0.311	S	S	.	.			trans	-119.9	157.7	-173.7	-56.7	70.4	0	0	0	109.7	N356 E404 L408	N356-H406 PolarHBondContact ND2-CD2 3.23Å; N356-H406 WeakPolarHBondContact OD1-CA 3.4Å; E404-H406 PolarHBondContact O-ND1 2.72Å; E404-H406 IonicContact OE1-NE2 2.81Å; E404-H406 IonicContact OE2-NE2 3.67Å; H406-L408 VanDerWaalsContact C-N 3.35Å; H406-L408 PolarHBondContact O-N 2.81Å
407	N	81.4	Confident	85.3	Confident	140 Å²	140	61.5 Å²	61.5	75%	0.749	31%	0.309	S	S	*	.	S	Bend	trans	59.7	38.3	174.2	-55.4	-33	0	0	0	114.3	H355	H355-N407 PolarHBondContact O-N 3.36Å
408	L	83.1	Confident	85.6	Confident	8 Å²	8	56 Å²	56	4%	0.042	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-75.1	145.2	175.1	-57.7	-179.4	0	0	0	111.1	H355 A357 L381 F405 H406 Y414 F435 V437	H355-L408 PolarHBondContact CD2-O 2.94Å; H355-L408 VanDerWaalsContact CD2-O 3.28Å; H355-L408 WeakPolarHBondContact O-CB 3.28Å; H355-L408 PolarHBondContact O-N 2.92Å; A357-L408 HydrophobicContact CB-CD1 3.57Å; L381-L408 HydrophobicContact CD2-CD2 3.83Å; F405-L408 HydrophobicContact CB-CD1 4.17Å; F405-L408 HydrophobicContact CB-CD2 4.25Å; F405-L408 HydrophobicContact CB-CG 4.41Å; H406-L408 VanDerWaalsContact C-N 3.35Å; H406-L408 PolarHBondContact O-N 2.81Å; L408-Y414 HydrophobicContact CB-CE2 3.87Å; L408-Y414 HydrophobicContact CD1-CD2 4.47Å; L408-Y414 HydrophobicContact CD1-CE2 4.47Å; L408-Y414 HydrophobicContact CD2-CD1 4.38Å; L408-Y414 HydrophobicContact CD2-CE1 3.98Å; L408-Y414 HydrophobicContact CD2-CE2 4.28Å; L408-Y414 HydrophobicContact CG-CE2 4.44Å; L408-F435 HydrophobicContact CD1-CE2 3.72Å; L408-F435 HydrophobicContact CD1-CZ 4.03Å; L408-V437 HydrophobicContact CB-CG2 3.97Å; L408-V437 HydrophobicContact CD1-CG2 4.15Å
409	K	79.6	Confident	85.9	Confident	148 Å²	148	56.1 Å²	56.1	64%	0.643	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-80	140.7	-178.3	-63.1	-177.3	179.5	177.8	0	111.2	H412 Y414	K409-H412 HydrophobicContact CB-CB 4.02Å; K409-H412 WeakPolarHBondContact O-CB 3.19Å; K409-Y414 WeakPolarHBondContact CB-OH 3.47Å; K409-Y414 PolarHBondContact N-OH 2.91Å
410	Y	73.8	Confident	86.3	Confident	78 Å²	78	50 Å²	50	31%	0.306	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	153.7	173.3	-63.3	-61.5	0	0	0	112.9	H355 H412 V437	H355-Y410 AromaticContact CD2-CE2 3.83Å; H355-Y410 AromaticContact CD2-CZ 3.86Å; H355-Y410 AromaticContact CE1-CE2 3.38Å; H355-Y410 WeakPolarHBondContact CE1-CE2 3.4Å; H355-Y410 AromaticContact CE1-CZ 3.35Å; H355-Y410 PolarHBondContact CE1-OH 3.06Å; H355-Y410 AromaticContact ND1-CZ 3.74Å; H355-Y410 PolarHBondContact ND1-OH 3.5Å; H355-Y410 VanDerWaalsContact ND1-OH 3.1Å; H355-Y410 AromaticContact NE2-CD2 3.93Å; H355-Y410 AromaticContact NE2-CE2 3.09Å; H355-Y410 WeakPolarHBondContact NE2-CE2 3.23Å; H355-Y410 AromaticContact NE2-CZ 3.43Å; H355-Y410 PolarHBondContact NE2-OH 2.67Å; Y410-H412 PolarHBondContact O-N 3.33Å; Y410-V437 CarbonylContact C-O 3.56Å; Y410-V437 HydrophobicContact CD1-CG1 3.8Å; Y410-V437 HydrophobicContact CE1-CG1 4.19Å
411	H	72.9	Confident	86.2	Confident	111 Å²	111	48.5 Å²	48.5	51%	0.514	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	18.5	-175.5	-56.2	-76.1	0	0	0	114.2	R436 V437 N438	H411-R436 PolarHBondContact O-NE 2.88Å; H411-R436 VanDerWaalsContact O-NE 3.17Å; H411-R436 PolarHBondContact O-NH2 3.1Å; H411-V437 WeakPolarHBondContact CA-O 3.49Å; H411-V437 PolarHBondContact N-O 2.86Å; H411-N438 PolarHBondContact CE1-O 3.23Å; H411-N438 PolarHBondContact ND1-O 3.21Å
412	H	79.1	Confident	86	Confident	63 Å²	63	45.4 Å²	45.4	29%	0.292	22%	0.218	S	C	.	.			trans	-107	140.8	-178.7	-153.3	72.1	0	0	0	110.6	K409 Y410 Y414 R436 V437	K409-H412 HydrophobicContact CB-CB 4.02Å; K409-H412 WeakPolarHBondContact O-CB 3.19Å; Y410-H412 PolarHBondContact O-N 3.33Å; H412-Y414 HydrophobicContact CB-CE2 3.94Å; H412-Y414 AromaticContact CD2-CE1 3.85Å; H412-Y414 AromaticContact CD2-CZ 3.64Å; H412-R436 WeakPolarHBondContact O-CA 3.34Å; H412-V437 PolarHBondContact O-N 3.07Å; H412-V437 VanDerWaalsContact O-N 3.12Å
413	D	84.3	Confident	85.2	Confident	65 Å²	65	47.9 Å²	47.9	35%	0.348	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	146.5	177.3	-72.5	-37.6	0	0	0	109.2	P384 F435 R436	P384-D413 HydrophobicContact CB-CB 4.23Å; P384-D413 WeakPolarHBondContact CD-O 3.38Å; P384-D413 HydrophobicContact CG-CB 3.67Å; D413-F435 CarbonylContact C-O 3.52Å; D413-R436 WeakPolarHBondContact OD1-CB 3.24Å; D413-R436 WeakPolarHBondContact OD1-CD 3.23Å; D413-R436 WeakPolarHBondContact OD1-CG 3.34Å; D413-R436 IonicContact OD1-NE 2.73Å
414	Y	88.1	Confident	84.2	Confident	10 Å²	10	50.2 Å²	50.2	4%	0.039	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	150.5	-178.1	-68.8	-77.1	0	0	0	110.2	L381 L391 L408 K409 H412 L434 F435 V437	L381-Y414 HydrophobicContact CD1-CD1 4.11Å; L381-Y414 HydrophobicContact CD1-CG 4.35Å; L381-Y414 HydrophobicContact CD2-CD1 4.31Å; L381-Y414 HydrophobicContact CG-CD1 4.32Å; L391-Y414 HydrophobicContact CD1-CD1 3.81Å; L391-Y414 HydrophobicContact CD1-CE1 3.55Å; L408-Y414 HydrophobicContact CB-CE2 3.87Å; L408-Y414 HydrophobicContact CD1-CD2 4.47Å; L408-Y414 HydrophobicContact CD1-CE2 4.47Å; L408-Y414 HydrophobicContact CD2-CD1 4.38Å; L408-Y414 HydrophobicContact CD2-CE1 3.98Å; L408-Y414 HydrophobicContact CD2-CE2 4.28Å; L408-Y414 HydrophobicContact CG-CE2 4.44Å; K409-Y414 WeakPolarHBondContact CB-OH 3.47Å; K409-Y414 PolarHBondContact N-OH 2.91Å; H412-Y414 HydrophobicContact CB-CE2 3.94Å; H412-Y414 AromaticContact CD2-CE1 3.85Å; H412-Y414 AromaticContact CD2-CZ 3.64Å; Y414-L434 CarbonylContact O-C 3.59Å; Y414-L434 WeakPolarHBondContact O-CA 3.43Å; Y414-F435 HydrophobicContact CD2-CD2 4.44Å; Y414-F435 AromaticContact CD2-CE2 3.98Å; Y414-F435 HydrophobicContact CD2-CE2 3.98Å; Y414-F435 HydrophobicContact CD2-CZ 4.45Å; Y414-F435 HydrophobicContact CG-CE2 4.17Å; Y414-F435 HydrophobicContact CG-CZ 4.19Å; Y414-F435 PolarHBondContact N-O 2.88Å; Y414-F435 PolarHBondContact O-N 3.48Å; Y414-V437 HydrophobicContact CD2-CG2 3.99Å; Y414-V437 HydrophobicContact CE2-CG2 3.87Å
415	S	89.8	Confident	83.6	Confident	11 Å²	11	47.6 Å²	47.6	8%	0.077	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.7	176.1	-174.2	0	0	0	0	110.3	L381 F382 F433	L381-S415 CarbonylContact C-O 3.59Å; F382-S415 PolarHBondContact N-O 2.64Å; F382-S415 PolarHBondContact O-N 2.83Å; S415-F433 WeakPolarHBondContact CA-O 3.45Å
416	V	92.1	Very high	83.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.6	176.7	171.1	0	0	0	0	111.3	I347 V359 V379 Q380 L381 F405 V418 F433 F435	I347-V416 HydrophobicContact CD1-CG1 4.13Å; I347-V416 WeakPolarHBondContact CD1-O 3.32Å; V359-V416 HydrophobicContact CG1-CG1 4.38Å; V379-V416 HydrophobicContact CG1-CG1 4.05Å; Q380-V416 WeakPolarHBondContact O-CA 3.21Å; L381-V416 HydrophobicContact CB-CG2 4.48Å; L381-V416 HydrophobicContact CD1-CG2 3.38Å; F405-V416 HydrophobicContact CD2-CG2 4.46Å; F405-V416 HydrophobicContact CE2-CG1 4.27Å; F405-V416 HydrophobicContact CE2-CG2 3.64Å; F405-V416 HydrophobicContact CZ-CG1 4.16Å; F405-V416 HydrophobicContact CZ-CG2 3.8Å; V416-V418 HydrophobicContact CG1-CG2 4.46Å; V416-F433 PolarHBondContact N-O 3.02Å; V416-F433 PolarHBondContact O-N 2.98Å; V416-F435 HydrophobicContact CG2-CE1 3.64Å; V416-F435 HydrophobicContact CG2-CZ 4.41Å
417	V	92.8	Very high	83.3	Confident	13 Å²	13	47.9 Å²	47.9	8%	0.079	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.8	175.7	179.5	0	0	0	0	109.5	Q380 F382 A429 P432	Q380-V417 PolarHBondContact N-O 3.4Å; Q380-V417 PolarHBondContact O-N 3.22Å; F382-V417 HydrophobicContact CD2-CG2 4.4Å; F382-V417 HydrophobicContact CE2-CB 4.24Å; F382-V417 HydrophobicContact CE2-CG2 4.2Å; V417-A429 HydrophobicContact CG1-CB 3.44Å; V417-A429 VanDerWaalsContact CG1-CB 3.44Å; V417-P432 HydrophobicContact CG2-CB 4.22Å; V417-P432 HydrophobicContact CG2-CG 4.29Å
418	V	93.1	Very high	83.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.1	176.5	-175.8	0	0	0	0	109.3	P345 I347 W361 F377 L378 V379 V416 S430	P345-V418 HydrophobicContact CB-CB 4.34Å; P345-V418 HydrophobicContact CB-CG1 4.07Å; P345-V418 HydrophobicContact CG-CG1 4.21Å; I347-V418 HydrophobicContact CD1-CG2 4.16Å; I347-V418 HydrophobicContact CG1-CG2 4.09Å; W361-V418 HydrophobicContact CB-CG2 4.47Å; W361-V418 HydrophobicContact CD2-CG1 4.01Å; W361-V418 HydrophobicContact CD2-CG2 4.01Å; W361-V418 HydrophobicContact CE3-CG2 3.91Å; W361-V418 HydrophobicContact CG-CG1 4.02Å; W361-V418 HydrophobicContact CG-CG2 4.27Å; W361-V418 HydrophobicContact CZ3-CG2 4.49Å; F377-V418 HydrophobicContact CB-CG1 4.12Å; F377-V418 HydrophobicContact CD1-CG1 3.97Å; F377-V418 HydrophobicContact CG-CG1 4.36Å; L378-V418 CarbonylContact O-C 3.53Å; L378-V418 WeakPolarHBondContact O-CA 3.16Å; V379-V418 HydrophobicContact CG1-CG2 4.05Å; V379-V418 HydrophobicContact CG2-CG1 4.24Å; V379-V418 HydrophobicContact CG2-CG2 4.23Å; V416-V418 HydrophobicContact CG1-CG2 4.46Å; V418-S430 PolarHBondContact N-OG 2.87Å; V418-S430 WeakPolarHBondContact O-CB 3.35Å; V418-S430 PolarHBondContact O-N 3.26Å
419	R	92.5	Very high	83.8	Confident	60 Å²	60	44.4 Å²	44.4	23%	0.226	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.1	176.1	-64.9	167.4	-174.5	-96.3	6.5	109.6	F377 L378 A429	F377-R419 CarbonylContact C-O 3.59Å; F377-R419 WeakPolarHBondContact CA-O 3.41Å; L378-R419 HydrophobicContact CB-CB 4.32Å; L378-R419 PolarHBondContact N-O 3.39Å; L378-R419 PolarHBondContact O-N 3.47Å; R419-A429 HydrophobicContact CG-CB 4.16Å
420	L	89.4	Confident	84.4	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	150.2	163.3	-84.2	150.5	0	0	0	109.8	P341 V343 P345 L363 A374 F377 L398 G427	P341-L420 HydrophobicContact CB-CB 3.71Å; P341-L420 HydrophobicContact CG-CB 4.15Å; V343-L420 HydrophobicContact CB-CD1 3.58Å; V343-L420 HydrophobicContact CG1-CD1 3.87Å; V343-L420 VanDerWaalsContact O-CD1 3.22Å; V343-L420 WeakPolarHBondContact O-CD1 3.43Å; P345-L420 HydrophobicContact CG-CD1 4.19Å; P345-L420 HydrophobicContact CG-CG 4.07Å; L363-L420 HydrophobicContact CD2-CD1 3.63Å; L363-L420 HydrophobicContact CD2-CD2 4.28Å; L363-L420 HydrophobicContact CD2-CG 4.25Å; A374-L420 HydrophobicContact CB-CB 4.44Å; A374-L420 HydrophobicContact CB-CD2 3.43Å; A374-L420 VanDerWaalsContact CB-CD2 3.43Å; A374-L420 HydrophobicContact CB-CG 4.48Å; F377-L420 HydrophobicContact CD1-CD2 3.98Å; F377-L420 HydrophobicContact CD1-CG 4.03Å; F377-L420 HydrophobicContact CE1-CD2 3.62Å; F377-L420 HydrophobicContact CE1-CG 3.84Å; F377-L420 HydrophobicContact CZ-CD2 4.16Å; L398-L420 HydrophobicContact CD1-CD2 3.63Å; L420-G427 PolarHBondContact O-N 3.23Å
421	I	87.6	Confident	85.1	Confident	24 Å²	24	41.6 Å²	41.6	12%	0.123	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147.5	172.8	58.2	159	0	0	0	111.1	A374 T375 G376 L378 T395 S425 Q426	A374-I421 CarbonylContact C-O 3.53Å; A374-I421 VanDerWaalsContact CA-O 3.27Å; A374-I421 WeakPolarHBondContact CA-O 3.41Å; A374-I421 WeakPolarHBondContact CB-O 3.43Å; T375-I421 PolarHBondContact N-O 3.17Å; T375-I421 PolarHBondContact OG1-O 2.74Å; G376-I421 VanDerWaalsContact C-CG1 3.48Å; G376-I421 PolarHBondContact N-O 2.91Å; G376-I421 WeakPolarHBondContact O-CG1 3.38Å; G376-I421 PolarHBondContact O-N 2.69Å; L378-I421 HydrophobicContact CB-CG2 3.67Å; T395-I421 HydrophobicContact CG2-CD1 3.34Å; T395-I421 HydrophobicContact CG2-CG1 4.47Å; I421-S425 CarbonylContact C-O 3.59Å; I421-S425 VanDerWaalsContact CA-O 3.22Å; I421-S425 WeakPolarHBondContact CA-O 3.19Å; I421-Q426 HydrophobicContact CG2-CG 4.29Å
422	N	84.1	Confident	85.8	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	110.5	171.4	-172.6	23.7	0	0	0	110	P339 P341 G372 G424 S425	P339-N422 PolarHBondContact O-ND2 2.84Å; P341-N422 HydrophobicContact CG-CB 3.77Å; G372-N422 PolarHBondContact O-ND2 3.46Å; N422-G424 PolarHBondContact O-N 3.48Å; N422-S425 PolarHBondContact N-O 3.47Å; N422-S425 WeakPolarHBondContact O-CB 3.44Å; N422-S425 PolarHBondContact O-N 3.15Å
423	C	74.1	Confident	86.2	Confident	84 Å²	84	40.1 Å²	40.1	57%	0.568	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	32.6	179	-56.5	0	0	0	0	114.4	C338 T375	C338-C423 HydrophobicContact CB-CB 3.69Å; C338-C423 VanDerWaalsContact SG-CB 3.5Å; T375-C423 PolarHBondContact OG1-N 2.91Å
424	G	70	Confident	86.3	Confident	63 Å²	63	42 Å²	42	65%	0.649	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	99.6	-21.3	-178.5	0	0	0	0	0	115.1	N422	N422-G424 PolarHBondContact O-N 3.48Å
425	S	75.6	Confident	86	Confident	15 Å²	15	41.8 Å²	41.8	11%	0.105	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.7	173.1	-63	0	0	0	0	110.9	C338 I421 N422	C338-S425 PolarHBondContact O-OG 3.2Å; I421-S425 CarbonylContact C-O 3.59Å; I421-S425 VanDerWaalsContact CA-O 3.22Å; I421-S425 WeakPolarHBondContact CA-O 3.19Å; N422-S425 PolarHBondContact N-O 3.47Å; N422-S425 WeakPolarHBondContact O-CB 3.44Å; N422-S425 PolarHBondContact O-N 3.15Å
426	Q	84.4	Confident	85.6	Confident	97 Å²	97	46.5 Å²	46.5	45%	0.453	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.6	-177.1	-58.4	-179.3	30.3	0	0	111.3	L378 I421	L378-Q426 HydrophobicContact CD2-CG 4.26Å; I421-Q426 HydrophobicContact CG2-CG 4.29Å
427	G	81.3	Confident	84.8	Confident	5 Å²	5	46.5 Å²	46.5	5%	0.052	26%	0.256	C	S	.	.			trans	-82.5	-176.6	174.8	0	0	0	0	0	114.1	P341 L420 A429	P341-G427 WeakPolarHBondContact O-CA 3.16Å; L420-G427 PolarHBondContact O-N 3.23Å; G427-A429 PolarHBondContact O-N 3.16Å
428	P	86.7	Confident	83.3	Confident	46 Å²	46	49.4 Å²	49.4	30%	0.299	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-61.2	136.8	179.1	24.2	-32.1	0	0	0	111.6	P341 T342 V343 Q344	P341-P428 WeakPolarHBondContact O-CD 3.49Å; T342-P428 WeakPolarHBondContact O-CG 3.44Å; V343-P428 WeakPolarHBondContact O-CG 3.31Å; Q344-P428 HydrophobicContact CB-CB 4.29Å; Q344-P428 HydrophobicContact CB-CG 3.93Å
429	A	88.9	Confident	81.7	Confident	28 Å²	28	50.6 Å²	50.6	23%	0.231	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-64.8	138.5	174.4	0	0	0	0	0	111.5	Q344 V417 R419 G427	Q344-A429 PolarHBondContact NE2-O 2.76Å; V417-A429 HydrophobicContact CG1-CB 3.44Å; V417-A429 VanDerWaalsContact CG1-CB 3.44Å; R419-A429 HydrophobicContact CG-CB 4.16Å; G427-A429 PolarHBondContact O-N 3.16Å
430	S	92.1	Very high	80.3	Confident	3 Å²	3	54 Å²	54	2%	0.021	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-56.6	159.3	164.6	72.2	0	0	0	0	110.9	P345 I347 V418	P345-S430 WeakPolarHBondContact O-CA 3.5Å; P345-S430 WeakPolarHBondContact O-CB 3.29Å; I347-S430 WeakPolarHBondContact CD1-OG 3.48Å; V418-S430 PolarHBondContact N-OG 2.87Å; V418-S430 WeakPolarHBondContact O-CB 3.35Å; V418-S430 PolarHBondContact O-N 3.26Å
431	K	88.4	Confident	79.4	Confident	164 Å²	164	54 Å²	54	71%	0.713	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-55.4	131.2	167.3	-69.3	179.6	-178.4	172	0	109.1	F433	K431-F433 PolarHBondContact O-N 3.16Å
432	P	87.9	Confident	79.1	Confident	90 Å²	90	52.9 Å²	52.9	58%	0.584	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-58.7	126.1	179.1	-23.7	32.8	0	0	0	110.6	V417	V417-P432 HydrophobicContact CG2-CB 4.22Å; V417-P432 HydrophobicContact CG2-CG 4.29Å
433	F	88.1	Confident	78.9	Confident	53 Å²	53	53.8 Å²	53.8	23%	0.232	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.8	179.7	-174.7	-97.3	0	0	0	110.2	I347 R350 S415 V416 K431 F435	I347-F433 HydrophobicContact CB-CB 4.29Å; I347-F433 HydrophobicContact CD1-CB 3.56Å; I347-F433 HydrophobicContact CG2-CB 4.03Å; I347-F433 HydrophobicContact CG2-CD1 4.24Å; I347-F433 HydrophobicContact CG2-CD2 4.02Å; I347-F433 HydrophobicContact CG2-CG 3.84Å; R350-F433 HydrophobicContact CB-CE1 3.88Å; R350-F433 HydrophobicContact CB-CZ 4.33Å; R350-F433 HydrophobicContact CG-CE1 3.76Å; R350-F433 HydrophobicContact CG-CZ 3.97Å; S415-F433 WeakPolarHBondContact CA-O 3.45Å; V416-F433 PolarHBondContact N-O 3.02Å; V416-F433 PolarHBondContact O-N 2.98Å; K431-F433 PolarHBondContact O-N 3.16Å; F433-F435 HydrophobicContact CD1-CD1 4.24Å; F433-F435 HydrophobicContact CE1-CB 4.41Å
434	L	86.2	Confident	79.5	Confident	106 Å²	106	51.7 Å²	51.7	56%	0.555	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	134.5	-177.6	-66.1	164.8	0	0	0	111.5	R350 P384 Y414	R350-L434 PolarHBondContact NH1-O 3.14Å; R350-L434 VanDerWaalsContact NH1-O 3.1Å; P384-L434 HydrophobicContact CB-CD2 4.33Å; Y414-L434 CarbonylContact O-C 3.59Å; Y414-L434 WeakPolarHBondContact O-CA 3.43Å
435	F	81.9	Confident	80.6	Confident	4 Å²	4	49 Å²	49	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	146.6	174.3	68.4	-89.7	0	0	0	113.4	A357 L381 L408 D413 Y414 V416 F433 V437	A357-F435 HydrophobicContact CB-CE2 3.71Å; A357-F435 HydrophobicContact CB-CZ 3.97Å; L381-F435 HydrophobicContact CD1-CE1 4.2Å; L381-F435 HydrophobicContact CD1-CZ 4.07Å; L408-F435 HydrophobicContact CD1-CE2 3.72Å; L408-F435 HydrophobicContact CD1-CZ 4.03Å; D413-F435 CarbonylContact C-O 3.52Å; Y414-F435 HydrophobicContact CD2-CD2 4.44Å; Y414-F435 AromaticContact CD2-CE2 3.98Å; Y414-F435 HydrophobicContact CD2-CE2 3.98Å; Y414-F435 HydrophobicContact CD2-CZ 4.45Å; Y414-F435 HydrophobicContact CG-CE2 4.17Å; Y414-F435 HydrophobicContact CG-CZ 4.19Å; Y414-F435 PolarHBondContact N-O 2.88Å; Y414-F435 PolarHBondContact O-N 3.48Å; V416-F435 HydrophobicContact CG2-CE1 3.64Å; V416-F435 HydrophobicContact CG2-CZ 4.41Å; F433-F435 HydrophobicContact CD1-CD1 4.24Å; F433-F435 HydrophobicContact CE1-CB 4.41Å; F435-V437 HydrophobicContact CD2-CG2 4.47Å; F435-V437 HydrophobicContact CE2-CG2 4.32Å
436	R	79.6	Confident	81.3	Confident	111 Å²	111	53.9 Å²	53.9	42%	0.419	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	139	174.9	-163	167.9	-166.8	159	1.6	111.1	H411 H412 D413 N438	H411-R436 PolarHBondContact O-NE 2.88Å; H411-R436 VanDerWaalsContact O-NE 3.17Å; H411-R436 PolarHBondContact O-NH2 3.1Å; H412-R436 WeakPolarHBondContact O-CA 3.34Å; D413-R436 WeakPolarHBondContact OD1-CB 3.24Å; D413-R436 WeakPolarHBondContact OD1-CD 3.23Å; D413-R436 WeakPolarHBondContact OD1-CG 3.34Å; D413-R436 IonicContact OD1-NE 2.73Å; R436-N438 WeakPolarHBondContact CB-OD1 3.43Å; R436-N438 WeakPolarHBondContact CD-OD1 3.15Å; R436-N438 VanDerWaalsContact CG-OD1 3.3Å; R436-N438 WeakPolarHBondContact CG-OD1 3.12Å; R436-N438 PolarHBondContact O-N 3.01Å
437	V	75.6	Confident	81.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.276	C	S	.	.			trans	-91.3	95.2	169.6	-174.9	0	0	0	0	107.8	V352 L408 Y410 H411 H412 Y414 F435	V352-V437 HydrophobicContact CG1-CG1 4.21Å; L408-V437 HydrophobicContact CB-CG2 3.97Å; L408-V437 HydrophobicContact CD1-CG2 4.15Å; Y410-V437 CarbonylContact C-O 3.56Å; Y410-V437 HydrophobicContact CD1-CG1 3.8Å; Y410-V437 HydrophobicContact CE1-CG1 4.19Å; H411-V437 WeakPolarHBondContact CA-O 3.49Å; H411-V437 PolarHBondContact N-O 2.86Å; H412-V437 PolarHBondContact O-N 3.07Å; H412-V437 VanDerWaalsContact O-N 3.12Å; Y414-V437 HydrophobicContact CD2-CG2 3.99Å; Y414-V437 HydrophobicContact CE2-CG2 3.87Å; F435-V437 HydrophobicContact CD2-CG2 4.47Å; F435-V437 HydrophobicContact CE2-CG2 4.32Å
438	N	62.3	Low	82	Confident	74 Å²	74	53.5 Å²	53.5	40%	0.396	28%	0.279	S	S	.	.			trans	-73.8	-51.4	-163.3	-73	-22.7	0	0	0	115.1	H411 R436	H411-N438 PolarHBondContact CE1-O 3.23Å; H411-N438 PolarHBondContact ND1-O 3.21Å; R436-N438 WeakPolarHBondContact CB-OD1 3.43Å; R436-N438 WeakPolarHBondContact CD-OD1 3.15Å; R436-N438 VanDerWaalsContact CG-OD1 3.3Å; R436-N438 WeakPolarHBondContact CG-OD1 3.12Å; R436-N438 PolarHBondContact O-N 3.01Å
439	S	59.6	Low	82.3	Confident	24 Å²	24	57.3 Å²	57.3	17%	0.168	29%	0.293	C	S	.	.			trans	-169.8	-178.9	179.4	66.8	0	0	0	0	110.9	G441	S439-G441 VanDerWaalsContact C-N 3.34Å; S439-G441 PolarHBondContact O-N 3.18Å; S439-G441 PolarHBondContact OG-O 3.34Å
440	Q	62.3	Low	82.5	Confident	131 Å²	131	56.9 Å²	56.9	61%	0.612	29%	0.29	S	S	*	.	S	Bend	trans	-63.3	-35.6	-179.3	-157.4	174	-0.5	0	0	112.2	N469 V522	Q440-N469 PolarHBondContact O-ND2 3.03Å; Q440-N469 VanDerWaalsContact O-ND2 3.13Å; Q440-V522 VanDerWaalsContact C-CG2 3.46Å; Q440-V522 HydrophobicContact CB-CG2 4.48Å; Q440-V522 HydrophobicContact CG-CB 4.46Å; Q440-V522 HydrophobicContact CG-CG2 4.07Å; Q440-V522 WeakPolarHBondContact O-CG2 3.48Å
441	G	71	Confident	82.5	Confident	6 Å²	6	61.6 Å²	61.6	6%	0.062	31%	0.312	C	S	.	.	S	Bend	trans	-130.2	-171.3	-170.6	0	0	0	0	0	115.7	S439 N469	S439-G441 VanDerWaalsContact C-N 3.34Å; S439-G441 PolarHBondContact O-N 3.18Å; S439-G441 PolarHBondContact OG-O 3.34Å; G441-N469 WeakPolarHBondContact CA-ND2 3.38Å; G441-N469 PolarHBondContact O-ND2 3.1Å
442	P	80.6	Confident	82.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-62.5	154.3	177.2	-22.8	34.5	0	0	0	113.3	N467 N469 A518 G524 E525	P442-N467 WeakPolarHBondContact CA-O 3.26Å; P442-N469 HydrophobicContact CG-CB 4.31Å; P442-A518 HydrophobicContact CB-CB 4.16Å; P442-G524 WeakPolarHBondContact O-CA 3.39Å; P442-E525 PolarHBondContact O-N 3.36Å
443	S	80	Confident	82.4	Confident	26 Å²	26	53.9 Å²	53.9	18%	0.182	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-67	165.1	172.3	68.2	0	0	0	0	112	P465 E466 N467	S443-P465 VanDerWaalsContact O-CB 3.27Å; S443-P465 WeakPolarHBondContact O-CB 3.44Å; S443-P465 VanDerWaalsContact O-CG 3.24Å; S443-P465 WeakPolarHBondContact O-CG 3.37Å; S443-P465 WeakPolarHBondContact OG-CB 3.48Å; S443-E466 PolarHBondContact OG-N 3.25Å; S443-N467 PolarHBondContact N-O 3.29Å; S443-N467 PolarHBondContact OG-N 3.26Å; S443-N467 VanDerWaalsContact OG-N 3.08Å
444	P	87.6	Confident	82.4	Confident	39 Å²	39	53.2 Å²	53.2	25%	0.253	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-58.5	144.9	177	-23.2	32.4	0	0	0	113	E525	P444-E525 HydrophobicContact CG-CB 3.66Å
445	P	91.5	Very high	82.4	Confident	7 Å²	7	50.1 Å²	50.1	5%	0.045	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-57.2	142.1	166.9	-23.5	34.2	0	0	0	111.8	V448 W462 Q463 Y475 V516 A518	P445-V448 HydrophobicContact CB-CG2 4.42Å; P445-W462 HydrophobicContact CB-CB 4.21Å; P445-W462 HydrophobicContact CB-CG 4.24Å; P445-Q463 WeakPolarHBondContact CA-O 3.49Å; P445-Y475 HydrophobicContact CG-CD1 4.15Å; P445-Y475 HydrophobicContact CG-CE1 4.14Å; P445-V516 WeakPolarHBondContact CD-O 3.32Å; P445-V516 HydrophobicContact CG-CB 4.29Å; P445-V516 HydrophobicContact CG-CG1 4.05Å; P445-A518 HydrophobicContact CG-CB 4.28Å
446	R	91.2	Very high	82.6	Confident	118 Å²	118	52.4 Å²	52.4	45%	0.445	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	158.2	-175.9	-64.4	-176	-64.9	146.9	3.1	111.4	V448 Q463 P464	R446-V448 VanDerWaalsContact C-N 3.32Å; R446-V448 PolarHBondContact O-N 2.68Å; R446-Q463 HydrophobicContact CB-CB 4.11Å; R446-Q463 PolarHBondContact N-O 3.4Å; R446-Q463 PolarHBondContact O-N 3.23Å; R446-P464 PolarHBondContact NE-O 2.88Å
447	S	88.8	Confident	83	Confident	73 Å²	73	47.6 Å²	47.6	51%	0.51	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50	46	170.3	-54.8	0	0	0	0	114.4
448	V	92.7	Very high	83.8	Confident	20 Å²	20	47.6 Å²	47.6	12%	0.121	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	132.7	176.6	-174	0	0	0	0	109.5	P445 R446 V460 R461 W462 V516 V530	P445-V448 HydrophobicContact CB-CG2 4.42Å; R446-V448 VanDerWaalsContact C-N 3.32Å; R446-V448 PolarHBondContact O-N 2.68Å; V448-V460 HydrophobicContact CG1-CG1 4.21Å; V448-R461 CarbonylContact C-O 3.52Å; V448-R461 VanDerWaalsContact CA-O 3.28Å; V448-R461 WeakPolarHBondContact CA-O 3.48Å; V448-W462 HydrophobicContact CG2-CB 3.92Å; V448-V516 HydrophobicContact CG1-CG2 3.81Å; V448-V516 HydrophobicContact CG2-CB 4.44Å; V448-V516 HydrophobicContact CG2-CG2 4.42Å; V448-V530 HydrophobicContact CB-CG1 4.36Å; V448-V530 HydrophobicContact CG1-CG1 4.25Å; V448-V530 HydrophobicContact CG1-CG2 3.99Å; V448-V530 WeakPolarHBondContact O-CG1 3.29Å
449	Q	92.3	Very high	85.3	Confident	126 Å²	126	45.3 Å²	45.3	59%	0.589	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.5	-179.6	-64.9	178.7	-0.3	0	0	109.9	V460 R461	Q449-V460 CarbonylContact O-C 3.57Å; Q449-V460 WeakPolarHBondContact O-CA 3.35Å; Q449-R461 PolarHBondContact N-O 2.85Å; Q449-R461 PolarHBondContact O-N 2.88Å
450	A	92.7	Very high	86.9	Confident	20 Å²	20	44.2 Å²	44.2	17%	0.165	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.7	173.9	0	0	0	0	0	109.8	V458 Q459 F514 V530 E532	A450-V458 HydrophobicContact CB-CG1 4.04Å; A450-Q459 CarbonylContact C-O 3.49Å; A450-Q459 VanDerWaalsContact CA-O 3.3Å; A450-Q459 WeakPolarHBondContact CA-O 3.42Å; A450-F514 HydrophobicContact CB-CD2 4Å; A450-F514 HydrophobicContact CB-CE2 4.37Å; A450-V530 HydrophobicContact CB-CG2 3.84Å; A450-E532 HydrophobicContact CB-CB 3.75Å; A450-E532 HydrophobicContact CB-CG 4.44Å
451	Q	92.3	Very high	88.4	Confident	102 Å²	102	43.8 Å²	43.8	48%	0.477	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129	-180	-176.8	179.2	8.8	0	0	110.9	L453 V458 Q459	Q451-L453 PolarHBondContact O-N 3.36Å; Q451-V458 CarbonylContact O-C 3.58Å; Q451-V458 WeakPolarHBondContact O-CA 3.43Å; Q451-Q459 PolarHBondContact N-O 3.41Å; Q451-Q459 PolarHBondContact O-N 3.3Å
452	A	86.8	Confident	89.5	Confident	21 Å²	21	43.9 Å²	43.9	17%	0.174	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	126.8	177.9	0	0	0	0	0	112.1	E532 K533 Q535	A452-E532 HydrophobicContact CB-CG 4.08Å; A452-K533 VanDerWaalsContact CB-O 3.25Å; A452-K533 WeakPolarHBondContact CB-O 3.46Å; A452-Q535 HydrophobicContact CB-CG 4.37Å
453	L	88.5	Confident	90	Very high	71 Å²	71	48.1 Å²	48.1	37%	0.372	25%	0.254	S	S	.	.			trans	-100.9	-39.1	179.2	-70.2	-179.9	0	0	0	112.9	Q451 A457 Q459 D502	Q451-L453 PolarHBondContact O-N 3.36Å; L453-A457 HydrophobicContact CB-CB 4.22Å; L453-A457 PolarHBondContact N-O 3.01Å; L453-Q459 HydrophobicContact CD1-CB 3.79Å; L453-Q459 HydrophobicContact CD2-CB 4.09Å; L453-Q459 HydrophobicContact CG-CB 3.82Å; L453-D502 HydrophobicContact CD1-CB 4.02Å
454	S	86.7	Confident	90.4	Very high	38 Å²	38	49.7 Å²	49.7	27%	0.266	26%	0.264	S	S	.	.	S	Bend	trans	-154.5	-172.7	-177.4	73.9	0	0	0	0	111	S456 A457 Q535	S454-S456 PolarHBondContact O-N 3.36Å; S454-S456 PolarHBondContact OG-N 2.77Å; S454-S456 VanDerWaalsContact OG-N 3.1Å; S454-A457 PolarHBondContact N-O 3.19Å; S454-A457 WeakPolarHBondContact OG-CB 3.42Å; S454-A457 PolarHBondContact OG-N 2.82Å; S454-A457 VanDerWaalsContact OG-N 3.14Å; S454-Q535 PolarHBondContact O-N 3.49Å; S454-Q535 VanDerWaalsContact O-N 3.11Å
455	T	86.2	Confident	90.4	Very high	42 Å²	42	48.3 Å²	48.3	26%	0.258	25%	0.254	S	S	.	.	S	Bend	trans	-67.2	-10.4	171.4	57	0	0	0	0	113.4	S508 Q535	T455-S508 WeakPolarHBondContact O-CA 3.4Å; T455-S508 VanDerWaalsContact O-CB 3.28Å; T455-S508 WeakPolarHBondContact O-CB 3.32Å; T455-S508 PolarHBondContact O-N 2.69Å; T455-Q535 WeakPolarHBondContact CA-O 3.25Å; T455-Q535 HydrophobicContact CG2-CB 4.2Å; T455-Q535 WeakPolarHBondContact CG2-O 3.47Å
456	S	85.9	Confident	89.9	Confident	52 Å²	52	54.8 Å²	54.8	36%	0.364	28%	0.284	S	S	.	.	S	Bend	trans	-138.8	13.3	-179.3	59.9	0	0	0	0	115.3	S454 T504 A505 L506	S454-S456 PolarHBondContact O-N 3.36Å; S454-S456 PolarHBondContact OG-N 2.77Å; S454-S456 VanDerWaalsContact OG-N 3.1Å; S456-T504 CarbonylContact O-C 3.59Å; S456-T504 WeakPolarHBondContact O-CA 3.41Å; S456-A505 PolarHBondContact O-N 3.46Å; S456-L506 VanDerWaalsContact CA-O 3.23Å; S456-L506 WeakPolarHBondContact CA-O 3.41Å; S456-L506 VanDerWaalsContact CB-O 3.32Å; S456-L506 WeakPolarHBondContact CB-O 3.36Å; S456-L506 PolarHBondContact O-N 2.98Å
457	A	89.3	Confident	89	Confident	9 Å²	9	52.8 Å²	52.8	7%	0.074	28%	0.282	C	S	.	.			trans	-145	142.7	-178.3	0	0	0	0	0	114	L453 S454 V503 T504	L453-A457 HydrophobicContact CB-CB 4.22Å; L453-A457 PolarHBondContact N-O 3.01Å; S454-A457 PolarHBondContact N-O 3.19Å; S454-A457 WeakPolarHBondContact OG-CB 3.42Å; S454-A457 PolarHBondContact OG-N 2.82Å; S454-A457 VanDerWaalsContact OG-N 3.14Å; A457-V503 CarbonylContact C-O 3.58Å; A457-V503 VanDerWaalsContact CA-O 3.26Å; A457-V503 WeakPolarHBondContact CA-O 3.48Å; A457-T504 HydrophobicContact CB-CG2 4Å
458	V	91.3	Very high	88.1	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	133.2	174	173.2	0	0	0	0	109.2	A450 Q451 V503 L506 F514 E532 T534	A450-V458 HydrophobicContact CB-CG1 4.04Å; Q451-V458 CarbonylContact O-C 3.58Å; Q451-V458 WeakPolarHBondContact O-CA 3.43Å; V458-V503 PolarHBondContact N-O 3.29Å; V458-V503 PolarHBondContact O-N 3.34Å; V458-L506 HydrophobicContact CB-CD1 3.85Å; V458-L506 HydrophobicContact CG2-CD1 3.66Å; V458-F514 HydrophobicContact CB-CE1 4.44Å; V458-F514 HydrophobicContact CB-CE2 4.37Å; V458-F514 HydrophobicContact CB-CZ 3.78Å; V458-F514 HydrophobicContact CG1-CE1 4.34Å; V458-F514 HydrophobicContact CG1-CE2 3.79Å; V458-F514 HydrophobicContact CG1-CZ 3.65Å; V458-F514 HydrophobicContact CG2-CZ 4.13Å; V458-E532 HydrophobicContact CG1-CB 4.08Å; V458-E532 HydrophobicContact CG1-CG 4.07Å; V458-E532 HydrophobicContact CG2-CG 4.38Å; V458-T534 HydrophobicContact CG2-CG2 4.01Å
459	Q	93.5	Very high	86.8	Confident	27 Å²	27	52.8 Å²	52.8	13%	0.126	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	127.6	173.9	-175.9	165.7	86.4	0	0	110.9	A450 Q451 L453 R461 D502	A450-Q459 CarbonylContact C-O 3.49Å; A450-Q459 VanDerWaalsContact CA-O 3.3Å; A450-Q459 WeakPolarHBondContact CA-O 3.42Å; Q451-Q459 PolarHBondContact N-O 3.41Å; Q451-Q459 PolarHBondContact O-N 3.3Å; L453-Q459 HydrophobicContact CD1-CB 3.79Å; L453-Q459 HydrophobicContact CD2-CB 4.09Å; L453-Q459 HydrophobicContact CG-CB 3.82Å; Q459-R461 HydrophobicContact CG-CG 4.18Å; Q459-D502 WeakPolarHBondContact CB-OD1 3.38Å; Q459-D502 WeakPolarHBondContact CG-OD1 3.16Å; Q459-D502 PolarHBondContact NE2-OD1 2.93Å
460	V	94.1	Very high	85.3	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.2	174.1	-174.2	0	0	0	0	109.1	V448 Q449 W462 I477 T500 K501 V503 F514 V516	V448-V460 HydrophobicContact CG1-CG1 4.21Å; Q449-V460 CarbonylContact O-C 3.57Å; Q449-V460 WeakPolarHBondContact O-CA 3.35Å; V460-W462 HydrophobicContact CB-CZ3 4.5Å; V460-W462 HydrophobicContact CG1-CE3 4.17Å; V460-W462 HydrophobicContact CG1-CZ3 4.36Å; V460-W462 WeakPolarHBondContact O-CZ3 3.41Å; V460-I477 HydrophobicContact CB-CD1 4.13Å; V460-I477 HydrophobicContact CG1-CD1 4.34Å; V460-T500 CarbonylContact O-C 3.53Å; V460-T500 VanDerWaalsContact O-CA 3.31Å; V460-T500 WeakPolarHBondContact O-CA 3.47Å; V460-K501 PolarHBondContact N-O 3.47Å; V460-K501 PolarHBondContact O-N 3.18Å; V460-V503 HydrophobicContact CG2-CG2 4.09Å; V460-F514 HydrophobicContact CG2-CB 4.21Å; V460-F514 HydrophobicContact CG2-CD1 3.58Å; V460-F514 HydrophobicContact CG2-CE1 4.1Å; V460-F514 HydrophobicContact CG2-CG 3.9Å; V460-V516 HydrophobicContact CG1-CG2 3.92Å
461	R	93.6	Very high	84.1	Confident	122 Å²	122	51.7 Å²	51.7	46%	0.46	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	145	179.3	-62.7	-176.6	-179.2	-177.5	2.6	110.6	V448 Q449 Q459 T499	V448-R461 CarbonylContact C-O 3.52Å; V448-R461 VanDerWaalsContact CA-O 3.28Å; V448-R461 WeakPolarHBondContact CA-O 3.48Å; Q449-R461 PolarHBondContact N-O 2.85Å; Q449-R461 PolarHBondContact O-N 2.88Å; Q459-R461 HydrophobicContact CG-CG 4.18Å; R461-T499 CarbonylContact C-O 3.52Å; R461-T499 WeakPolarHBondContact CA-O 3.43Å
462	W	94.3	Very high	83.6	Confident	8 Å²	8	47.9 Å²	47.9	3%	0.03	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	169.1	177.3	62.2	94.1	0	0	0	111.8	P445 V448 V460 Y475 I477 I493 K498 T499 K501 V516	P445-W462 HydrophobicContact CB-CB 4.21Å; P445-W462 HydrophobicContact CB-CG 4.24Å; V448-W462 HydrophobicContact CG2-CB 3.92Å; V460-W462 HydrophobicContact CB-CZ3 4.5Å; V460-W462 HydrophobicContact CG1-CE3 4.17Å; V460-W462 HydrophobicContact CG1-CZ3 4.36Å; V460-W462 WeakPolarHBondContact O-CZ3 3.41Å; W462-Y475 AromaticContact CD1-CE1 3.89Å; W462-Y475 HydrophobicContact CZ2-CD2 4.16Å; W462-Y475 AromaticContact CZ2-CG 3.98Å; W462-Y475 HydrophobicContact CZ2-CG 3.98Å; W462-Y475 AromaticContact NE1-CD1 3.38Å; W462-Y475 AromaticContact NE1-CD2 3.89Å; W462-Y475 AromaticContact NE1-CE1 3.38Å; W462-Y475 AromaticContact NE1-CE2 3.89Å; W462-Y475 AromaticContact NE1-CG 3.64Å; W462-Y475 AromaticContact NE1-CZ 3.65Å; W462-I477 HydrophobicContact CH2-CD1 3.92Å; W462-I477 HydrophobicContact CH2-CG1 4.48Å; W462-I477 HydrophobicContact CZ3-CD1 3.63Å; W462-I477 HydrophobicContact CZ3-CG1 4.35Å; W462-I493 HydrophobicContact CH2-CD1 3.43Å; W462-I493 VanDerWaalsContact CH2-CD1 3.43Å; W462-I493 HydrophobicContact CZ2-CD1 3.96Å; W462-I493 HydrophobicContact CZ3-CD1 4.42Å; W462-K498 WeakPolarHBondContact CZ2-O 3.46Å; W462-K498 PolarHBondContact NE1-O 3.37Å; W462-T499 PolarHBondContact N-O 3.26Å; W462-T499 WeakPolarHBondContact O-CB 3.4Å; W462-K501 HydrophobicContact CH2-CB 3.97Å; W462-K501 HydrophobicContact CZ3-CB 4.14Å; W462-V516 HydrophobicContact CD2-CG1 4.01Å; W462-V516 HydrophobicContact CD2-CG2 4.45Å; W462-V516 HydrophobicContact CE3-CG1 4.33Å; W462-V516 HydrophobicContact CE3-CG2 4.12Å; W462-V516 HydrophobicContact CG-CG1 4.31Å
463	Q	91.5	Very high	83.4	Confident	89 Å²	89	51.7 Å²	51.7	42%	0.416	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	153.7	169.4	-68.2	-176.4	2.1	0	0	110.6	P445 R446	P445-Q463 WeakPolarHBondContact CA-O 3.49Å; R446-Q463 HydrophobicContact CB-CB 4.11Å; R446-Q463 PolarHBondContact N-O 3.4Å; R446-Q463 PolarHBondContact O-N 3.23Å
464	P	88.9	Confident	83.1	Confident	60 Å²	60	50.9 Å²	50.9	39%	0.39	30%	0.296	S	S	.	.			trans	-58	146.8	177.2	-25	34.8	0	0	0	113.2	R446 T499	R446-P464 PolarHBondContact NE-O 2.88Å; P464-T499 HydrophobicContact CG-CG2 4.25Å
465	P	86.3	Confident	83.4	Confident	9 Å²	9	49.2 Å²	49.2	6%	0.058	28%	0.284	C	S	.	.			trans	-45.4	142.9	168.5	-29.6	31.7	0	0	0	113.5	S443 N467 I472 A518	S443-P465 VanDerWaalsContact O-CB 3.27Å; S443-P465 WeakPolarHBondContact O-CB 3.44Å; S443-P465 VanDerWaalsContact O-CG 3.24Å; S443-P465 WeakPolarHBondContact O-CG 3.37Å; S443-P465 WeakPolarHBondContact OG-CB 3.48Å; P465-N467 VanDerWaalsContact C-N 3.28Å; P465-N467 PolarHBondContact O-N 3.03Å; P465-I472 HydrophobicContact CB-CD1 4.48Å; P465-I472 VanDerWaalsContact CD-CD1 3.44Å; P465-I472 HydrophobicContact CG-CD1 3.73Å; P465-A518 HydrophobicContact CG-CB 3.44Å; P465-A518 VanDerWaalsContact CG-CB 3.44Å
466	E	80.3	Confident	83.6	Confident	144 Å²	144	47.3 Å²	47.3	67%	0.673	27%	0.272	S	S	*	.	S	Bend	trans	-62.7	-37.2	171.1	-173.9	173.1	-167.8	0	0	111.7	S443	S443-E466 PolarHBondContact OG-N 3.25Å
467	N	74.1	Confident	83.9	Confident	76 Å²	76	44.8 Å²	44.8	41%	0.406	26%	0.255	S	S	.	.			trans	-121.3	96.6	179.3	-66.2	-66	0	0	0	110.6	P442 S443 P465 N469	P442-N467 WeakPolarHBondContact CA-O 3.26Å; S443-N467 PolarHBondContact N-O 3.29Å; S443-N467 PolarHBondContact OG-N 3.26Å; S443-N467 VanDerWaalsContact OG-N 3.08Å; P465-N467 VanDerWaalsContact C-N 3.28Å; P465-N467 PolarHBondContact O-N 3.03Å; N467-N469 PolarHBondContact O-N 3.37Å
468	P	68.6	Low	84	Confident	57 Å²	57	45.2 Å²	45.2	37%	0.37	26%	0.255	S	S	.	.			trans	-78.4	1.5	-174	30.6	-35.4	0	0	0	114.8	G470 G471 I472	P468-G470 PolarHBondContact O-N 3.06Å; P468-G471 PolarHBondContact O-N 3.38Å; P468-I472 HydrophobicContact CB-CD1 4.2Å; P468-I472 HydrophobicContact CB-CG1 3.91Å
469	N	65.2	Low	83.9	Confident	36 Å²	36	47.2 Å²	47.2	19%	0.193	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	39.9	65.7	175.4	-161.9	28.8	0	0	0	114.8	V352 Q440 G441 P442 N467 S520	V352-N469 PolarHBondContact O-OD1 3.23Å; Q440-N469 PolarHBondContact O-ND2 3.03Å; Q440-N469 VanDerWaalsContact O-ND2 3.13Å; G441-N469 WeakPolarHBondContact CA-ND2 3.38Å; G441-N469 PolarHBondContact O-ND2 3.1Å; P442-N469 HydrophobicContact CG-CB 4.31Å; N467-N469 PolarHBondContact O-N 3.37Å; N469-S520 WeakPolarHBondContact O-CB 3.49Å; N469-S520 PolarHBondContact O-OG 3.04Å
470	G	61	Low	83.6	Confident	89 Å²	89	47 Å²	47	92%	0.918	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	-0.2	179.9	0	0	0	0	0	115.5	P468	P468-G470 PolarHBondContact O-N 3.06Å
471	G	68.2	Low	83.2	Confident	34 Å²	34	48.1 Å²	48.1	35%	0.351	27%	0.269	S	S	.	.			trans	109.1	138.4	174.9	0	0	0	0	0	112.7	P468 S520	P468-G471 PolarHBondContact O-N 3.38Å; G471-S520 WeakPolarHBondContact O-CB 3.33Å
472	I	80.9	Confident	82.7	Confident	21 Å²	21	45.1 Å²	45.1	11%	0.108	26%	0.264	C	S	.	.			trans	-81.5	132.9	-176	-56.4	169.4	0	0	0	108.9	P465 P468 Y475 R496 A518	P465-I472 HydrophobicContact CB-CD1 4.48Å; P465-I472 VanDerWaalsContact CD-CD1 3.44Å; P465-I472 HydrophobicContact CG-CD1 3.73Å; P468-I472 HydrophobicContact CB-CD1 4.2Å; P468-I472 HydrophobicContact CB-CG1 3.91Å; I472-Y475 HydrophobicContact CD1-CE1 4.3Å; I472-Y475 WeakPolarHBondContact CD1-OH 3.37Å; I472-Y475 HydrophobicContact CG2-CD2 4.36Å; I472-Y475 HydrophobicContact CG2-CE1 4.26Å; I472-Y475 HydrophobicContact CG2-CE2 3.89Å; I472-R496 WeakPolarHBondContact O-CB 3.05Å; I472-A518 HydrophobicContact CD1-CB 4.22Å; I472-A518 HydrophobicContact CG1-CB 4.34Å; I472-A518 HydrophobicContact CG2-CB 4.14Å
473	I	82.3	Confident	81.6	Confident	102 Å²	102	48.5 Å²	48.5	52%	0.523	30%	0.302	S	S	.	.			trans	-103.3	-35.2	175.7	62.2	165	0	0	0	112.2	C519 S520	I473-C519 HydrophobicContact CG1-CB 4.41Å; I473-C519 VanDerWaalsContact CG1-O 3.24Å; I473-C519 WeakPolarHBondContact CG1-O 3.41Å; I473-C519 PolarHBondContact N-O 3.4Å; I473-S520 WeakPolarHBondContact CD1-O 3.35Å; I473-S520 VanDerWaalsContact CG1-O 3.26Å; I473-S520 WeakPolarHBondContact CG1-O 3.42Å
474	K	83.9	Confident	80.5	Confident	54 Å²	54	50.7 Å²	50.7	24%	0.235	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	159.1	-179.8	70.6	174	-176.4	173.9	0	112.2	D492 I493 C519	K474-D492 IonicContact NZ-OD1 3.9Å; K474-D492 IonicContact NZ-OD2 2.74Å; K474-D492 PolarHBondContact NZ-OD2 2.99Å; K474-I493 CarbonylContact C-O 3.45Å; K474-I493 VanDerWaalsContact CA-O 3.23Å; K474-I493 WeakPolarHBondContact CA-O 3.38Å; K474-I493 VanDerWaalsContact CB-O 3.24Å; K474-I493 WeakPolarHBondContact CB-O 3.36Å; K474-C519 HydrophobicContact CG-CB 3.67Å; K474-C519 PolarHBondContact N-O 2.9Å; K474-C519 PolarHBondContact O-N 3.09Å
475	Y	91.2	Very high	78.9	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	151.9	166.2	-65.8	-86.4	0	0	0	110.3	P445 W462 I472 I493 R496 K498 V516 R517 A518	P445-Y475 HydrophobicContact CG-CD1 4.15Å; P445-Y475 HydrophobicContact CG-CE1 4.14Å; W462-Y475 AromaticContact CD1-CE1 3.89Å; W462-Y475 HydrophobicContact CZ2-CD2 4.16Å; W462-Y475 AromaticContact CZ2-CG 3.98Å; W462-Y475 HydrophobicContact CZ2-CG 3.98Å; W462-Y475 AromaticContact NE1-CD1 3.38Å; W462-Y475 AromaticContact NE1-CD2 3.89Å; W462-Y475 AromaticContact NE1-CE1 3.38Å; W462-Y475 AromaticContact NE1-CE2 3.89Å; W462-Y475 AromaticContact NE1-CG 3.64Å; W462-Y475 AromaticContact NE1-CZ 3.65Å; I472-Y475 HydrophobicContact CD1-CE1 4.3Å; I472-Y475 WeakPolarHBondContact CD1-OH 3.37Å; I472-Y475 HydrophobicContact CG2-CD2 4.36Å; I472-Y475 HydrophobicContact CG2-CE1 4.26Å; I472-Y475 HydrophobicContact CG2-CE2 3.89Å; Y475-I493 PolarHBondContact N-O 3.33Å; Y475-I493 WeakPolarHBondContact O-CA 3.48Å; Y475-I493 WeakPolarHBondContact O-CB 3.31Å; Y475-I493 PolarHBondContact O-N 2.83Å; Y475-R496 WeakPolarHBondContact CE2-O 3.42Å; Y475-K498 WeakPolarHBondContact CD2-O 3.46Å; Y475-K498 WeakPolarHBondContact CE2-O 3.06Å; Y475-V516 HydrophobicContact CD1-CG1 4.35Å; Y475-R517 CarbonylContact C-O 3.52Å; Y475-R517 WeakPolarHBondContact CA-O 3.47Å; Y475-A518 HydrophobicContact CD1-CB 3.86Å; Y475-A518 HydrophobicContact CE1-CB 3.66Å
476	V	90.8	Very high	77.7	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.8	174.5	-172.4	0	0	0	0	108.4	W490 L491 D492 V516 R517 W526	V476-W490 HydrophobicContact CG1-CB 4.29Å; V476-L491 WeakPolarHBondContact CA-O 3.35Å; V476-D492 WeakPolarHBondContact CG1-OD1 3.4Å; V476-D492 WeakPolarHBondContact CG2-OD1 3.37Å; V476-V516 CarbonylContact O-C 3.58Å; V476-V516 WeakPolarHBondContact O-CA 3.18Å; V476-R517 HydrophobicContact CB-CG 3.88Å; V476-R517 HydrophobicContact CG2-CG 4.32Å; V476-R517 PolarHBondContact N-O 3.39Å; V476-R517 PolarHBondContact O-N 2.76Å; V476-W526 HydrophobicContact CB-CH2 4.21Å; V476-W526 HydrophobicContact CG1-CH2 3.87Å; V476-W526 WeakPolarHBondContact O-CZ3 3.34Å
477	I	92.2	Very high	76.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.2	173	-54.1	-178	0	0	0	108	V460 W462 W490 L491 I493 K501 F514 R515 V516	V460-I477 HydrophobicContact CB-CD1 4.13Å; V460-I477 HydrophobicContact CG1-CD1 4.34Å; W462-I477 HydrophobicContact CH2-CD1 3.92Å; W462-I477 HydrophobicContact CH2-CG1 4.48Å; W462-I477 HydrophobicContact CZ3-CD1 3.63Å; W462-I477 HydrophobicContact CZ3-CG1 4.35Å; I477-W490 CarbonylContact O-C 3.57Å; I477-W490 WeakPolarHBondContact O-CA 3.31Å; I477-L491 PolarHBondContact N-O 2.77Å; I477-L491 PolarHBondContact O-N 3.01Å; I477-I493 HydrophobicContact CD1-CD1 3.68Å; I477-I493 HydrophobicContact CG1-CD1 3.87Å; I477-K501 HydrophobicContact CD1-CB 3.81Å; I477-K501 HydrophobicContact CD1-CG 4.19Å; I477-F514 HydrophobicContact CG2-CD1 4.48Å; I477-R515 WeakPolarHBondContact CA-O 3.29Å; I477-V516 HydrophobicContact CG1-CG1 4.26Å; I477-V516 HydrophobicContact CG1-CG2 4.09Å
478	E	91.1	Very high	76	Confident	17 Å²	17	52 Å²	52	8%	0.079	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.3	168.3	-170.9	-164.3	-99.4	0	0	109.1	H488 H489 F514 R515 W526	E478-H488 HydrophobicContact CG-CB 4.16Å; E478-H488 IonicContact OE2-ND1 3.67Å; E478-H489 CarbonylContact C-O 3.48Å; E478-H489 WeakPolarHBondContact CA-O 3.48Å; E478-F514 CarbonylContact O-C 3.41Å; E478-F514 VanDerWaalsContact O-CA 3.25Å; E478-F514 WeakPolarHBondContact O-CA 3.33Å; E478-R515 HydrophobicContact CB-CG 4.02Å; E478-R515 PolarHBondContact N-O 3.08Å; E478-R515 PolarHBondContact O-N 3.49Å; E478-R515 IonicContact OE1-CZ 3.79Å; E478-R515 IonicContact OE1-NE 2.68Å; E478-R515 IonicContact OE1-NH2 2.65Å; E478-R515 PolarHBondContact OE1-NH2 3.31Å; E478-R515 IonicContact OE2-CZ 3.86Å; E478-R515 IonicContact OE2-NE 3.96Å; E478-R515 PolarHBondContact OE2-NE 2.96Å; E478-R515 IonicContact OE2-NH2 3.82Å; E478-R515 PolarHBondContact OE2-NH2 3.38Å; E478-W526 HydrophobicContact CB-CH2 3.74Å; E478-W526 HydrophobicContact CB-CZ2 4.48Å; E478-W526 HydrophobicContact CB-CZ3 3.82Å
479	Y	90.3	Very high	76.4	Confident	43 Å²	43	53.7 Å²	53.7	17%	0.169	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	150	177.5	69.3	-81.7	0	0	0	113.2	H489 V503 L506 Y512 Q513 F514	Y479-H489 HydrophobicContact CD1-CB 4.1Å; Y479-H489 WeakPolarHBondContact CD1-O 3.47Å; Y479-H489 HydrophobicContact CD2-CB 4.24Å; Y479-H489 HydrophobicContact CE1-CB 3.59Å; Y479-H489 HydrophobicContact CE2-CB 3.74Å; Y479-H489 HydrophobicContact CG-CB 4.4Å; Y479-H489 PolarHBondContact N-O 3.34Å; Y479-H489 PolarHBondContact O-N 2.63Å; Y479-V503 HydrophobicContact CD1-CG1 3.92Å; Y479-V503 HydrophobicContact CD2-CG1 4.06Å; Y479-V503 HydrophobicContact CE1-CG1 3.72Å; Y479-V503 HydrophobicContact CE2-CG1 3.88Å; Y479-V503 HydrophobicContact CG-CG1 4.08Å; Y479-L506 HydrophobicContact CD2-CD2 3.9Å; Y479-L506 HydrophobicContact CE2-CD2 3.6Å; Y479-Y512 HydrophobicContact CD2-CD1 4.21Å; Y479-Q513 WeakPolarHBondContact CA-O 3.23Å; Y479-F514 HydrophobicContact CG-CD1 4.32Å; Y479-F514 HydrophobicContact CG-CE1 4.16Å
480	Q	87.5	Confident	77.3	Confident	23 Å²	23	60.7 Å²	60.7	11%	0.107	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	156.1	175.3	68.5	175.9	19.8	0	0	112.8	H488 Y512 Q513	Q480-H488 PolarHBondContact OE1-CE1 3.32Å; Q480-H488 PolarHBondContact OE1-ND1 3.2Å; Q480-Y512 VanDerWaalsContact C-CD1 3.47Å; Q480-Y512 CarbonylContact O-C 3.59Å; Q480-Y512 VanDerWaalsContact O-CA 3.32Å; Q480-Y512 WeakPolarHBondContact O-CA 3.35Å; Q480-Q513 HydrophobicContact CG-CG 3.61Å; Q480-Q513 PolarHBondContact N-O 3.12Å; Q480-Q513 PolarHBondContact O-N 3.24Å
481	P	86.1	Confident	78.5	Confident	22 Å²	22	59.1 Å²	59.1	14%	0.143	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	138.1	170.5	-10.7	24.3	0	0	0	110.9	G483 T510 L511 Y512	P481-G483 PolarHBondContact O-N 3.05Å; P481-T510 HydrophobicContact CB-CG2 4.22Å; P481-L511 CarbonylContact C-O 3.46Å; P481-L511 WeakPolarHBondContact CA-O 3.43Å; P481-Y512 HydrophobicContact CB-CE1 4.24Å; P481-Y512 HydrophobicContact CG-CD1 4.35Å; P481-Y512 HydrophobicContact CG-CE1 3.78Å
482	V	82.2	Confident	79.3	Confident	59 Å²	59	61 Å²	61	36%	0.358	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	121	176.1	178.6	0	0	0	0	109	L511 Q513 Q531	V482-L511 HydrophobicContact CB-CB 4.32Å; V482-L511 HydrophobicContact CB-CD2 3.85Å; V482-L511 HydrophobicContact CB-CG 4.03Å; V482-L511 HydrophobicContact CG1-CD2 4.01Å; V482-L511 HydrophobicContact CG2-CB 4.41Å; V482-L511 HydrophobicContact CG2-CD2 3.88Å; V482-L511 HydrophobicContact CG2-CG 3.75Å; V482-L511 PolarHBondContact N-O 3.48Å; V482-Q513 HydrophobicContact CG2-CB 4.02Å; V482-Q513 HydrophobicContact CG2-CG 4.37Å; V482-Q531 HydrophobicContact CG2-CG 4.37Å
483	G	71.9	Confident	79.5	Confident	80 Å²	80	60.4 Å²	60.4	83%	0.825	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.9	-3.9	178.2	0	0	0	0	0	115.9	P481	P481-G483 PolarHBondContact O-N 3.05Å
484	Q	67.1	Low	79.4	Confident	134 Å²	134	61.9 Å²	61.9	63%	0.626	35%	0.352	S	S	*	.			trans	-110.3	125.7	169.8	-73.5	-178.5	0.4	0	0	110.5	S486	Q484-S486 PolarHBondContact O-N 2.63Å; Q484-S486 VanDerWaalsContact O-N 3.13Å
485	G	55.3	Low	79.2	Confident	79 Å²	79	62.8 Å²	62.8	81%	0.814	36%	0.359	S	S	*	.			trans	-86.3	60	-173.3	0	0	0	0	0	114.9
486	S	61.4	Low	78.5	Confident	79 Å²	79	70.6 Å²	70.6	55%	0.552	39%	0.389	S	S	*	.			trans	100.7	145.2	178.4	-41.8	0	0	0	0	114.3	Q484	Q484-S486 PolarHBondContact O-N 2.63Å; Q484-S486 VanDerWaalsContact O-N 3.13Å
487	P	55.2	Low	78.1	Confident	88 Å²	88	76.4 Å²	76.4	57%	0.571	42%	0.42	S	S	*	.	P	Polyproline II helix	cis	-92.6	138.8	20.3	27.1	-18.5	0	0	0	115.6	H489	P487-H489 PolarHBondContact O-N 3.25Å
488	H	64.2	Low	77.6	Confident	70 Å²	70	80.1 Å²	80.1	32%	0.324	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-69.5	120.5	168.8	-59.8	-87	0	0	0	109.2	E478 Q480 W490	E478-H488 HydrophobicContact CG-CB 4.16Å; E478-H488 IonicContact OE2-ND1 3.67Å; Q480-H488 PolarHBondContact OE1-CE1 3.32Å; Q480-H488 PolarHBondContact OE1-ND1 3.2Å; H488-W490 VanDerWaalsContact O-CE3 3.31Å; H488-W490 WeakPolarHBondContact O-CZ3 3.19Å
489	H	76.9	Confident	77.5	Confident	94 Å²	94	82 Å²	82	44%	0.435	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.4	172.7	-66.2	-77.1	0	0	0	109.5	E478 Y479 P487	E478-H489 CarbonylContact C-O 3.48Å; E478-H489 WeakPolarHBondContact CA-O 3.48Å; Y479-H489 HydrophobicContact CD1-CB 4.1Å; Y479-H489 WeakPolarHBondContact CD1-O 3.47Å; Y479-H489 HydrophobicContact CD2-CB 4.24Å; Y479-H489 HydrophobicContact CE1-CB 3.59Å; Y479-H489 HydrophobicContact CE2-CB 3.74Å; Y479-H489 HydrophobicContact CG-CB 4.4Å; Y479-H489 PolarHBondContact N-O 3.34Å; Y479-H489 PolarHBondContact O-N 2.63Å; P487-H489 PolarHBondContact O-N 3.25Å
490	W	83.9	Confident	77.5	Confident	183 Å²	183	82.3 Å²	82.3	69%	0.693	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	150.8	177.1	62.1	83.1	0	0	0	112.8	V476 I477 H488	V476-W490 HydrophobicContact CG1-CB 4.29Å; I477-W490 CarbonylContact O-C 3.57Å; I477-W490 WeakPolarHBondContact O-CA 3.31Å; H488-W490 VanDerWaalsContact O-CE3 3.31Å; H488-W490 WeakPolarHBondContact O-CZ3 3.19Å
491	L	85.9	Confident	77.7	Confident	56 Å²	56	84.6 Å²	84.6	29%	0.293	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	118.7	-178.1	-172.5	73.9	0	0	0	110.1	V476 I477 K501	V476-L491 WeakPolarHBondContact CA-O 3.35Å; I477-L491 PolarHBondContact N-O 2.77Å; I477-L491 PolarHBondContact O-N 3.01Å; L491-K501 HydrophobicContact CD2-CD 4.26Å; L491-K501 HydrophobicContact CD2-CG 3.66Å
492	D	84.5	Confident	78	Confident	72 Å²	72	86.8 Å²	86.8	39%	0.385	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.9	174.6	-85.8	5.3	0	0	0	110.8	K474 V476	K474-D492 IonicContact NZ-OD1 3.9Å; K474-D492 IonicContact NZ-OD2 2.74Å; K474-D492 PolarHBondContact NZ-OD2 2.99Å; V476-D492 WeakPolarHBondContact CG1-OD1 3.4Å; V476-D492 WeakPolarHBondContact CG2-OD1 3.37Å
493	I	85.9	Confident	78.3	Confident	10 Å²	10	84.1 Å²	84.1	5%	0.051	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	94.6	-179.7	-53.5	175.3	0	0	0	107.7	W462 K474 Y475 I477 D495 K498 K501	W462-I493 HydrophobicContact CH2-CD1 3.43Å; W462-I493 VanDerWaalsContact CH2-CD1 3.43Å; W462-I493 HydrophobicContact CZ2-CD1 3.96Å; W462-I493 HydrophobicContact CZ3-CD1 4.42Å; K474-I493 CarbonylContact C-O 3.45Å; K474-I493 VanDerWaalsContact CA-O 3.23Å; K474-I493 WeakPolarHBondContact CA-O 3.38Å; K474-I493 VanDerWaalsContact CB-O 3.24Å; K474-I493 WeakPolarHBondContact CB-O 3.36Å; Y475-I493 PolarHBondContact N-O 3.33Å; Y475-I493 WeakPolarHBondContact O-CA 3.48Å; Y475-I493 WeakPolarHBondContact O-CB 3.31Å; Y475-I493 PolarHBondContact O-N 2.83Å; I477-I493 HydrophobicContact CD1-CD1 3.68Å; I477-I493 HydrophobicContact CG1-CD1 3.87Å; I493-D495 HydrophobicContact CG2-CB 4.34Å; I493-D495 PolarHBondContact O-N 3Å; I493-K498 HydrophobicContact CG2-CB 3.96Å; I493-K498 HydrophobicContact CG2-CD 3.91Å; I493-K498 HydrophobicContact CG2-CG 4.13Å; I493-K501 HydrophobicContact CD1-CB 3.75Å; I493-K501 HydrophobicContact CD1-CG 3.85Å; I493-K501 HydrophobicContact CG1-CG 4.47Å
494	N	81.1	Confident	79	Confident	133 Å²	133	84.6 Å²	84.6	71%	0.711	45%	0.446	S	S	*	.			trans	-77.3	41.9	-179.3	-63.7	-29.3	0	0	0	112.7
495	D	78.4	Confident	79.7	Confident	72 Å²	72	82.6 Å²	82.6	39%	0.385	45%	0.453	S	S	.	.			trans	-137.5	111.4	177.7	-176.8	-9.5	0	0	0	109.4	I493 N497 K498	I493-D495 HydrophobicContact CG2-CB 4.34Å; I493-D495 PolarHBondContact O-N 3Å; D495-N497 PolarHBondContact O-N 3.5Å; D495-N497 PolarHBondContact OD1-N 3.24Å; D495-K498 HydrophobicContact CB-CB 3.95Å; D495-K498 HydrophobicContact CB-CD 4.41Å; D495-K498 PolarHBondContact O-N 3.46Å
496	R	76.4	Confident	81.2	Confident	166 Å²	166	79.2 Å²	79.2	63%	0.626	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-22	-177.1	64.9	177.2	-175	-169.3	-0.6	114.5	I472 Y475	I472-R496 WeakPolarHBondContact O-CB 3.05Å; Y475-R496 WeakPolarHBondContact CE2-O 3.42Å
497	N	82.3	Confident	82.3	Confident	124 Å²	124	80.5 Å²	80.5	66%	0.663	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-4.5	-176.7	-71.2	-9.7	0	0	0	112.3	D495	D495-N497 PolarHBondContact O-N 3.5Å; D495-N497 PolarHBondContact OD1-N 3.24Å
498	K	82.8	Confident	83.5	Confident	78 Å²	78	79.1 Å²	79.1	34%	0.339	41%	0.409	S	S	.	.			trans	-80.2	125.2	-176	-161	147.9	-172.5	162	0	111	W462 Y475 I493 D495 T500	W462-K498 WeakPolarHBondContact CZ2-O 3.46Å; W462-K498 PolarHBondContact NE1-O 3.37Å; Y475-K498 WeakPolarHBondContact CD2-O 3.46Å; Y475-K498 WeakPolarHBondContact CE2-O 3.06Å; I493-K498 HydrophobicContact CG2-CB 3.96Å; I493-K498 HydrophobicContact CG2-CD 3.91Å; I493-K498 HydrophobicContact CG2-CG 4.13Å; D495-K498 HydrophobicContact CB-CB 3.95Å; D495-K498 HydrophobicContact CB-CD 4.41Å; D495-K498 PolarHBondContact O-N 3.46Å; K498-T500 VanDerWaalsContact CE-O 3.25Å; K498-T500 WeakPolarHBondContact CE-O 3.39Å; K498-T500 VanDerWaalsContact CG-O 3.29Å; K498-T500 WeakPolarHBondContact CG-O 3.4Å
499	T	88.8	Confident	84.4	Confident	56 Å²	56	78.8 Å²	78.8	34%	0.344	42%	0.415	S	S	.	.			trans	-119.4	4.5	-178.6	47.2	0	0	0	0	112.7	R461 W462 P464	R461-T499 CarbonylContact C-O 3.52Å; R461-T499 WeakPolarHBondContact CA-O 3.43Å; W462-T499 PolarHBondContact N-O 3.26Å; W462-T499 WeakPolarHBondContact O-CB 3.4Å; P464-T499 HydrophobicContact CG-CG2 4.25Å
500	T	90.2	Very high	84.8	Confident	50 Å²	50	76.2 Å²	76.2	31%	0.307	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	142.6	179.6	-176.9	0	0	0	0	111.1	V460 K498	V460-T500 CarbonylContact O-C 3.53Å; V460-T500 VanDerWaalsContact O-CA 3.31Å; V460-T500 WeakPolarHBondContact O-CA 3.47Å; K498-T500 VanDerWaalsContact CE-O 3.25Å; K498-T500 WeakPolarHBondContact CE-O 3.39Å; K498-T500 VanDerWaalsContact CG-O 3.29Å; K498-T500 WeakPolarHBondContact CG-O 3.4Å
501	K	91.8	Very high	85.1	Confident	71 Å²	71	70.6 Å²	70.6	31%	0.309	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	134.3	176.2	-176.4	60	177.1	170.7	0	112	V460 W462 I477 L491 I493	V460-K501 PolarHBondContact N-O 3.47Å; V460-K501 PolarHBondContact O-N 3.18Å; W462-K501 HydrophobicContact CH2-CB 3.97Å; W462-K501 HydrophobicContact CZ3-CB 4.14Å; I477-K501 HydrophobicContact CD1-CB 3.81Å; I477-K501 HydrophobicContact CD1-CG 4.19Å; L491-K501 HydrophobicContact CD2-CD 4.26Å; L491-K501 HydrophobicContact CD2-CG 3.66Å; I493-K501 HydrophobicContact CD1-CB 3.75Å; I493-K501 HydrophobicContact CD1-CG 3.85Å; I493-K501 HydrophobicContact CG1-CG 4.47Å
502	D	91	Very high	85.3	Confident	68 Å²	68	68.5 Å²	68.5	36%	0.364	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123	173.1	-52.2	-23.4	0	0	0	109.6	L453 Q459	L453-D502 HydrophobicContact CD1-CB 4.02Å; Q459-D502 WeakPolarHBondContact CB-OD1 3.38Å; Q459-D502 WeakPolarHBondContact CG-OD1 3.16Å; Q459-D502 PolarHBondContact NE2-OD1 2.93Å
503	V	89.1	Confident	85.6	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.024	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	113.7	172.2	-174.7	0	0	0	0	107.1	A457 V458 V460 Y479 L506 F514	A457-V503 CarbonylContact C-O 3.58Å; A457-V503 VanDerWaalsContact CA-O 3.26Å; A457-V503 WeakPolarHBondContact CA-O 3.48Å; V458-V503 PolarHBondContact N-O 3.29Å; V458-V503 PolarHBondContact O-N 3.34Å; V460-V503 HydrophobicContact CG2-CG2 4.09Å; Y479-V503 HydrophobicContact CD1-CG1 3.92Å; Y479-V503 HydrophobicContact CD2-CG1 4.06Å; Y479-V503 HydrophobicContact CE1-CG1 3.72Å; Y479-V503 HydrophobicContact CE2-CG1 3.88Å; Y479-V503 HydrophobicContact CG-CG1 4.08Å; V503-L506 HydrophobicContact CG1-CD1 4.36Å; V503-L506 HydrophobicContact CG1-CD2 4.03Å; V503-L506 HydrophobicContact CG1-CG 4.4Å; V503-F514 HydrophobicContact CB-CE1 4.19Å; V503-F514 HydrophobicContact CG1-CE1 4.33Å; V503-F514 HydrophobicContact CG2-CD1 4.4Å; V503-F514 HydrophobicContact CG2-CE1 4.12Å
504	T	86.3	Confident	86	Confident	89 Å²	89	66 Å²	66	55%	0.546	36%	0.363	S	S	.	.			trans	-109.3	176.4	-174.2	57.7	0	0	0	0	111.4	S456 A457 L506	S456-T504 CarbonylContact O-C 3.59Å; S456-T504 WeakPolarHBondContact O-CA 3.41Å; A457-T504 HydrophobicContact CB-CG2 4Å; T504-L506 VanDerWaalsContact C-N 3.29Å; T504-L506 PolarHBondContact O-N 3.13Å
505	A	82.6	Confident	86.5	Confident	93 Å²	93	62.4 Å²	62.4	77%	0.769	34%	0.339	S	S	*	.	S	Bend	trans	61.6	34.4	-177	0	0	0	0	0	113.6	S456	S456-A505 PolarHBondContact O-N 3.46Å
506	L	86.8	Confident	87.2	Confident	8 Å²	8	59 Å²	59	4%	0.042	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-86.9	149.6	173.4	-57.8	178.1	0	0	0	110.5	S456 V458 Y479 V503 T504 Y512 F514 T534	S456-L506 VanDerWaalsContact CA-O 3.23Å; S456-L506 WeakPolarHBondContact CA-O 3.41Å; S456-L506 VanDerWaalsContact CB-O 3.32Å; S456-L506 WeakPolarHBondContact CB-O 3.36Å; S456-L506 PolarHBondContact O-N 2.98Å; V458-L506 HydrophobicContact CB-CD1 3.85Å; V458-L506 HydrophobicContact CG2-CD1 3.66Å; Y479-L506 HydrophobicContact CD2-CD2 3.9Å; Y479-L506 HydrophobicContact CE2-CD2 3.6Å; V503-L506 HydrophobicContact CG1-CD1 4.36Å; V503-L506 HydrophobicContact CG1-CD2 4.03Å; V503-L506 HydrophobicContact CG1-CG 4.4Å; T504-L506 VanDerWaalsContact C-N 3.29Å; T504-L506 PolarHBondContact O-N 3.13Å; L506-Y512 HydrophobicContact CB-CD2 4.49Å; L506-Y512 HydrophobicContact CB-CE2 3.84Å; L506-Y512 HydrophobicContact CD1-CD2 4.34Å; L506-Y512 HydrophobicContact CD1-CE2 4.48Å; L506-Y512 HydrophobicContact CD2-CD1 4.09Å; L506-Y512 HydrophobicContact CD2-CE1 3.76Å; L506-Y512 HydrophobicContact CD2-CE2 4.19Å; L506-Y512 HydrophobicContact CD2-CG 4.47Å; L506-Y512 HydrophobicContact CG-CE2 4.39Å; L506-F514 HydrophobicContact CD1-CZ 4.29Å; L506-T534 HydrophobicContact CB-CG2 3.85Å; L506-T534 HydrophobicContact CD1-CG2 4.15Å
507	N	85.3	Confident	87.9	Confident	106 Å²	106	54.1 Å²	54.1	57%	0.567	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-68	139.2	173.2	-64.1	-17.1	0	0	0	111.3	T510 Y512 T534	N507-T510 WeakPolarHBondContact CB-OG1 3.12Å; N507-T510 WeakPolarHBondContact O-CB 3.29Å; N507-T510 PolarHBondContact O-OG1 3.38Å; N507-Y512 PolarHBondContact N-OH 3.4Å; N507-Y512 VanDerWaalsContact N-OH 3.09Å; N507-T534 PolarHBondContact O-OG1 2.94Å
508	S	80.5	Confident	88.2	Confident	59 Å²	59	48.2 Å²	48.2	41%	0.413	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	154.6	177	62.3	0	0	0	0	112.5	T455 T510	T455-S508 WeakPolarHBondContact O-CA 3.4Å; T455-S508 VanDerWaalsContact O-CB 3.28Å; T455-S508 WeakPolarHBondContact O-CB 3.32Å; T455-S508 PolarHBondContact O-N 2.69Å; S508-T510 PolarHBondContact O-N 2.88Å; S508-T510 PolarHBondContact O-OG1 2.93Å
509	S	82.1	Confident	88.3	Confident	63 Å²	63	44.8 Å²	44.8	44%	0.441	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	21	-177.8	-63.8	0	0	0	0	116	K533 T534 Q535 G536	S509-K533 WeakPolarHBondContact O-CE 3.23Å; S509-T534 PolarHBondContact N-OG1 2.85Å; S509-Q535 PolarHBondContact N-O 3.04Å; S509-G536 VanDerWaalsContact OG-CA 3.3Å; S509-G536 WeakPolarHBondContact OG-CA 3.45Å
510	T	85.6	Confident	87.8	Confident	39 Å²	39	42.6 Å²	42.6	24%	0.239	24%	0.243	C	C	.	.			trans	-106.3	137	-174.7	-57	0	0	0	0	110.9	P481 N507 S508 Y512 T534	P481-T510 HydrophobicContact CB-CG2 4.22Å; N507-T510 WeakPolarHBondContact CB-OG1 3.12Å; N507-T510 WeakPolarHBondContact O-CB 3.29Å; N507-T510 PolarHBondContact O-OG1 3.38Å; S508-T510 PolarHBondContact O-N 2.88Å; S508-T510 PolarHBondContact O-OG1 2.93Å; T510-Y512 HydrophobicContact CG2-CD2 4.19Å; T510-Y512 HydrophobicContact CG2-CE2 3.61Å; T510-Y512 WeakPolarHBondContact O-CD2 3.37Å; T510-T534 PolarHBondContact N-OG1 2.84Å; T510-T534 PolarHBondContact O-N 3.31Å; T510-T534 PolarHBondContact O-OG1 3.39Å
511	L	89.5	Confident	86.8	Confident	66 Å²	66	48.7 Å²	48.7	35%	0.346	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.8	177.1	-175.3	70	0	0	0	109.8	P481 V482 Q531 K533	P481-L511 CarbonylContact C-O 3.46Å; P481-L511 WeakPolarHBondContact CA-O 3.43Å; V482-L511 HydrophobicContact CB-CB 4.32Å; V482-L511 HydrophobicContact CB-CD2 3.85Å; V482-L511 HydrophobicContact CB-CG 4.03Å; V482-L511 HydrophobicContact CG1-CD2 4.01Å; V482-L511 HydrophobicContact CG2-CB 4.41Å; V482-L511 HydrophobicContact CG2-CD2 3.88Å; V482-L511 HydrophobicContact CG2-CG 3.75Å; V482-L511 PolarHBondContact N-O 3.48Å; L511-Q531 HydrophobicContact CD1-CB 4.4Å; L511-K533 HydrophobicContact CD1-CB 3.99Å
512	Y	90.4	Very high	85.8	Confident	12 Å²	12	47.3 Å²	47.3	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.6	177	-73.3	-94.5	0	0	0	111.1	Y479 Q480 P481 L506 N507 T510 F514 Q531 E532 T534	Y479-Y512 HydrophobicContact CD2-CD1 4.21Å; Q480-Y512 VanDerWaalsContact C-CD1 3.47Å; Q480-Y512 CarbonylContact O-C 3.59Å; Q480-Y512 VanDerWaalsContact O-CA 3.32Å; Q480-Y512 WeakPolarHBondContact O-CA 3.35Å; P481-Y512 HydrophobicContact CB-CE1 4.24Å; P481-Y512 HydrophobicContact CG-CD1 4.35Å; P481-Y512 HydrophobicContact CG-CE1 3.78Å; L506-Y512 HydrophobicContact CB-CD2 4.49Å; L506-Y512 HydrophobicContact CB-CE2 3.84Å; L506-Y512 HydrophobicContact CD1-CD2 4.34Å; L506-Y512 HydrophobicContact CD1-CE2 4.48Å; L506-Y512 HydrophobicContact CD2-CD1 4.09Å; L506-Y512 HydrophobicContact CD2-CE1 3.76Å; L506-Y512 HydrophobicContact CD2-CE2 4.19Å; L506-Y512 HydrophobicContact CD2-CG 4.47Å; L506-Y512 HydrophobicContact CG-CE2 4.39Å; N507-Y512 PolarHBondContact N-OH 3.4Å; N507-Y512 VanDerWaalsContact N-OH 3.09Å; T510-Y512 HydrophobicContact CG2-CD2 4.19Å; T510-Y512 HydrophobicContact CG2-CE2 3.61Å; T510-Y512 WeakPolarHBondContact O-CD2 3.37Å; Y512-F514 VanDerWaalsContact CB-CE2 3.49Å; Y512-F514 HydrophobicContact CG-CZ 4.31Å; Y512-Q531 CarbonylContact O-C 3.54Å; Y512-Q531 VanDerWaalsContact O-CA 3.24Å; Y512-Q531 WeakPolarHBondContact O-CA 3.39Å; Y512-E532 PolarHBondContact N-O 3.2Å; Y512-E532 PolarHBondContact O-N 3.13Å; Y512-T534 HydrophobicContact CD2-CG2 4.4Å; Y512-T534 HydrophobicContact CE2-CG2 4.34Å
513	Q	91.9	Very high	85.2	Confident	30 Å²	30	47.8 Å²	47.8	14%	0.14	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.6	167.2	68.1	179.9	16.9	0	0	111.1	Y479 Q480 V482 F529 V530 Q531	Y479-Q513 WeakPolarHBondContact CA-O 3.23Å; Q480-Q513 HydrophobicContact CG-CG 3.61Å; Q480-Q513 PolarHBondContact N-O 3.12Å; Q480-Q513 PolarHBondContact O-N 3.24Å; V482-Q513 HydrophobicContact CG2-CB 4.02Å; V482-Q513 HydrophobicContact CG2-CG 4.37Å; Q513-F529 HydrophobicContact CB-CD1 3.98Å; Q513-F529 HydrophobicContact CG-CD1 3.79Å; Q513-F529 HydrophobicContact CG-CE1 3.98Å; Q513-V530 CarbonylContact C-O 3.6Å; Q513-V530 VanDerWaalsContact CA-O 3.28Å; Q513-V530 WeakPolarHBondContact CA-O 3.17Å; Q513-Q531 HydrophobicContact CB-CG 3.85Å
514	F	93.1	Very high	84.8	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.9	-174	-53.6	-97.2	0	0	0	110.9	A450 V458 V460 I477 E478 Y479 V503 L506 Y512 F529 V530 E532	A450-F514 HydrophobicContact CB-CD2 4Å; A450-F514 HydrophobicContact CB-CE2 4.37Å; V458-F514 HydrophobicContact CB-CE1 4.44Å; V458-F514 HydrophobicContact CB-CE2 4.37Å; V458-F514 HydrophobicContact CB-CZ 3.78Å; V458-F514 HydrophobicContact CG1-CE1 4.34Å; V458-F514 HydrophobicContact CG1-CE2 3.79Å; V458-F514 HydrophobicContact CG1-CZ 3.65Å; V458-F514 HydrophobicContact CG2-CZ 4.13Å; V460-F514 HydrophobicContact CG2-CB 4.21Å; V460-F514 HydrophobicContact CG2-CD1 3.58Å; V460-F514 HydrophobicContact CG2-CE1 4.1Å; V460-F514 HydrophobicContact CG2-CG 3.9Å; I477-F514 HydrophobicContact CG2-CD1 4.48Å; E478-F514 CarbonylContact O-C 3.41Å; E478-F514 VanDerWaalsContact O-CA 3.25Å; E478-F514 WeakPolarHBondContact O-CA 3.33Å; Y479-F514 HydrophobicContact CG-CD1 4.32Å; Y479-F514 HydrophobicContact CG-CE1 4.16Å; V503-F514 HydrophobicContact CB-CE1 4.19Å; V503-F514 HydrophobicContact CG1-CE1 4.33Å; V503-F514 HydrophobicContact CG2-CD1 4.4Å; V503-F514 HydrophobicContact CG2-CE1 4.12Å; L506-F514 HydrophobicContact CD1-CZ 4.29Å; Y512-F514 VanDerWaalsContact CB-CE2 3.49Å; Y512-F514 HydrophobicContact CG-CZ 4.31Å; F514-F529 CarbonylContact O-C 3.58Å; F514-F529 VanDerWaalsContact O-CA 3.28Å; F514-F529 WeakPolarHBondContact O-CA 3.47Å; F514-V530 HydrophobicContact CB-CG2 3.94Å; F514-V530 PolarHBondContact N-O 2.93Å; F514-V530 PolarHBondContact O-N 3.19Å; F514-E532 HydrophobicContact CE2-CB 4.3Å
515	R	92.9	Very high	84.7	Confident	56 Å²	56	48.5 Å²	48.5	21%	0.211	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	153.1	166.3	61.3	176.8	179.5	-179	-2.2	111.1	I477 E478 W526 F529	I477-R515 WeakPolarHBondContact CA-O 3.29Å; E478-R515 HydrophobicContact CB-CG 4.02Å; E478-R515 PolarHBondContact N-O 3.08Å; E478-R515 PolarHBondContact O-N 3.49Å; E478-R515 IonicContact OE1-CZ 3.79Å; E478-R515 IonicContact OE1-NE 2.68Å; E478-R515 IonicContact OE1-NH2 2.65Å; E478-R515 PolarHBondContact OE1-NH2 3.31Å; E478-R515 IonicContact OE2-CZ 3.86Å; E478-R515 IonicContact OE2-NE 3.96Å; E478-R515 PolarHBondContact OE2-NE 2.96Å; E478-R515 IonicContact OE2-NH2 3.82Å; E478-R515 PolarHBondContact OE2-NH2 3.38Å; R515-W526 HydrophobicContact CB-CE3 4.41Å; R515-W526 HydrophobicContact CG-CD2 4.28Å; R515-W526 HydrophobicContact CG-CE3 3.73Å; R515-W526 HydrophobicContact CG-CZ3 4.19Å; R515-F529 HydrophobicContact CB-CD1 3.93Å; R515-F529 HydrophobicContact CB-CE1 4.09Å; R515-F529 HydrophobicContact CB-CG 4.4Å; R515-F529 VanDerWaalsContact CD-CZ 3.4Å; R515-F529 HydrophobicContact CG-CD1 3.98Å; R515-F529 HydrophobicContact CG-CE1 3.59Å; R515-F529 HydrophobicContact CG-CZ 3.99Å
516	V	93.3	Very high	85	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.6	-174.3	-167.6	0	0	0	0	110.2	P445 V448 V460 W462 Y475 V476 I477 S527	P445-V516 WeakPolarHBondContact CD-O 3.32Å; P445-V516 HydrophobicContact CG-CB 4.29Å; P445-V516 HydrophobicContact CG-CG1 4.05Å; V448-V516 HydrophobicContact CG1-CG2 3.81Å; V448-V516 HydrophobicContact CG2-CB 4.44Å; V448-V516 HydrophobicContact CG2-CG2 4.42Å; V460-V516 HydrophobicContact CG1-CG2 3.92Å; W462-V516 HydrophobicContact CD2-CG1 4.01Å; W462-V516 HydrophobicContact CD2-CG2 4.45Å; W462-V516 HydrophobicContact CE3-CG1 4.33Å; W462-V516 HydrophobicContact CE3-CG2 4.12Å; W462-V516 HydrophobicContact CG-CG1 4.31Å; Y475-V516 HydrophobicContact CD1-CG1 4.35Å; V476-V516 CarbonylContact O-C 3.58Å; V476-V516 WeakPolarHBondContact O-CA 3.18Å; I477-V516 HydrophobicContact CG1-CG1 4.26Å; I477-V516 HydrophobicContact CG1-CG2 4.09Å; V516-S527 PolarHBondContact N-OG 2.67Å; V516-S527 WeakPolarHBondContact O-CB 3.39Å; V516-S527 PolarHBondContact O-N 2.97Å; V516-S527 PolarHBondContact O-OG 2.75Å
517	R	90.6	Very high	85.3	Confident	65 Å²	65	47.5 Å²	47.5	25%	0.245	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	152	167	66.2	175.5	176.7	-173.7	-1.9	111.6	Y475 V476 E525 W526	Y475-R517 CarbonylContact C-O 3.52Å; Y475-R517 WeakPolarHBondContact CA-O 3.47Å; V476-R517 HydrophobicContact CB-CG 3.88Å; V476-R517 HydrophobicContact CG2-CG 4.32Å; V476-R517 PolarHBondContact N-O 3.39Å; V476-R517 PolarHBondContact O-N 2.76Å; R517-E525 VanDerWaalsContact CB-O 3.27Å; R517-E525 WeakPolarHBondContact CB-O 3.49Å; R517-W526 HydrophobicContact CB-CD2 3.92Å; R517-W526 HydrophobicContact CB-CE3 3.67Å; R517-W526 HydrophobicContact CB-CG 4.4Å; R517-W526 HydrophobicContact CB-CZ3 4.1Å; R517-W526 HydrophobicContact CG-CD2 3.99Å; R517-W526 HydrophobicContact CG-CE3 3.72Å; R517-W526 HydrophobicContact CG-CH2 3.85Å; R517-W526 HydrophobicContact CG-CZ2 4.1Å; R517-W526 HydrophobicContact CG-CZ3 3.65Å
518	A	88.9	Confident	85.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	147.6	169	0	0	0	0	0	110.3	P442 P445 P465 I472 Y475 G524	P442-A518 HydrophobicContact CB-CB 4.16Å; P445-A518 HydrophobicContact CG-CB 4.28Å; P465-A518 HydrophobicContact CG-CB 3.44Å; P465-A518 VanDerWaalsContact CG-CB 3.44Å; I472-A518 HydrophobicContact CD1-CB 4.22Å; I472-A518 HydrophobicContact CG1-CB 4.34Å; I472-A518 HydrophobicContact CG2-CB 4.14Å; Y475-A518 HydrophobicContact CD1-CB 3.86Å; Y475-A518 HydrophobicContact CE1-CB 3.66Å; A518-G524 WeakPolarHBondContact O-CA 3.41Å; A518-G524 PolarHBondContact O-N 3.36Å
519	C	83.1	Confident	85.9	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.034	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.5	175.3	-57.8	0	0	0	0	109.9	I473 K474	I473-C519 HydrophobicContact CG1-CB 4.41Å; I473-C519 VanDerWaalsContact CG1-O 3.24Å; I473-C519 WeakPolarHBondContact CG1-O 3.41Å; I473-C519 PolarHBondContact N-O 3.4Å; K474-C519 HydrophobicContact CG-CB 3.67Å; K474-C519 PolarHBondContact N-O 2.9Å; K474-C519 PolarHBondContact O-N 3.09Å
520	S	79.9	Confident	86.4	Confident	10 Å²	10	47.5 Å²	47.5	7%	0.07	24%	0.239	C	C	.	.	S	Bend	trans	-106.4	-136.9	162.7	69.7	0	0	0	0	108.3	N469 G471 I473 V522	N469-S520 WeakPolarHBondContact O-CB 3.49Å; N469-S520 PolarHBondContact O-OG 3.04Å; G471-S520 WeakPolarHBondContact O-CB 3.33Å; I473-S520 WeakPolarHBondContact CD1-O 3.35Å; I473-S520 VanDerWaalsContact CG1-O 3.26Å; I473-S520 WeakPolarHBondContact CG1-O 3.42Å; S520-V522 PolarHBondContact N-O 3.24Å; S520-V522 PolarHBondContact O-N 3.4Å; S520-V522 VanDerWaalsContact O-N 3.09Å
521	K	68.8	Low	86.7	Confident	178 Å²	178	50.7 Å²	50.7	77%	0.774	25%	0.252	S	S	*	.	S	Bend	trans	-57.5	-20.2	169.3	-70.4	-179.3	-176.4	168.4	0	112.9	D353	D353-K521 IonicContact OD2-NZ 3.81Å
522	V	70.3	Confident	86.8	Confident	43 Å²	43	50.3 Å²	50.3	26%	0.261	25%	0.248	S	C	.	.	S	Bend	trans	-136.3	157.8	176.1	-63.8	0	0	0	0	110.7	Q440 S520	Q440-V522 VanDerWaalsContact C-CG2 3.46Å; Q440-V522 HydrophobicContact CB-CG2 4.48Å; Q440-V522 HydrophobicContact CG-CB 4.46Å; Q440-V522 HydrophobicContact CG-CG2 4.07Å; Q440-V522 WeakPolarHBondContact O-CG2 3.48Å; S520-V522 PolarHBondContact N-O 3.24Å; S520-V522 PolarHBondContact O-N 3.4Å; S520-V522 VanDerWaalsContact O-N 3.09Å
523	P	78.6	Confident	86.7	Confident	77 Å²	77	55.2 Å²	55.2	50%	0.5	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	135.6	-179.9	-17	30.7	0	0	0	111.9
524	G	80.6	Confident	86.4	Confident	10 Å²	10	54 Å²	54	10%	0.103	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-179.5	171.3	0	0	0	0	0	113.1	P442 A518	P442-G524 WeakPolarHBondContact O-CA 3.39Å; A518-G524 WeakPolarHBondContact O-CA 3.41Å; A518-G524 PolarHBondContact O-N 3.36Å
525	E	83.9	Confident	86	Confident	98 Å²	98	58.7 Å²	58.7	46%	0.458	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	151.9	-179.9	-68.6	-179.5	171.9	0	0	112.6	P442 P444 R517	P442-E525 PolarHBondContact O-N 3.36Å; P444-E525 HydrophobicContact CG-CB 3.66Å; R517-E525 VanDerWaalsContact CB-O 3.27Å; R517-E525 WeakPolarHBondContact CB-O 3.49Å
526	W	89.4	Confident	84.7	Confident	69 Å²	69	58.1 Å²	58.1	26%	0.261	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	143.3	176.4	-70.7	107.3	0	0	0	111.9	V476 E478 R515 R517	V476-W526 HydrophobicContact CB-CH2 4.21Å; V476-W526 HydrophobicContact CG1-CH2 3.87Å; V476-W526 WeakPolarHBondContact O-CZ3 3.34Å; E478-W526 HydrophobicContact CB-CH2 3.74Å; E478-W526 HydrophobicContact CB-CZ2 4.48Å; E478-W526 HydrophobicContact CB-CZ3 3.82Å; R515-W526 HydrophobicContact CB-CE3 4.41Å; R515-W526 HydrophobicContact CG-CD2 4.28Å; R515-W526 HydrophobicContact CG-CE3 3.73Å; R515-W526 HydrophobicContact CG-CZ3 4.19Å; R517-W526 HydrophobicContact CB-CD2 3.92Å; R517-W526 HydrophobicContact CB-CE3 3.67Å; R517-W526 HydrophobicContact CB-CG 4.4Å; R517-W526 HydrophobicContact CB-CZ3 4.1Å; R517-W526 HydrophobicContact CG-CD2 3.99Å; R517-W526 HydrophobicContact CG-CE3 3.72Å; R517-W526 HydrophobicContact CG-CH2 3.85Å; R517-W526 HydrophobicContact CG-CZ2 4.1Å; R517-W526 HydrophobicContact CG-CZ3 3.65Å
527	S	91.9	Very high	83	Confident	12 Å²	12	64 Å²	64	8%	0.084	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-65.3	164.4	164.6	76.2	0	0	0	0	111.3	V516	V516-S527 PolarHBondContact N-OG 2.67Å; V516-S527 WeakPolarHBondContact O-CB 3.39Å; V516-S527 PolarHBondContact O-N 2.97Å; V516-S527 PolarHBondContact O-OG 2.75Å
528	T	88.5	Confident	81.1	Confident	120 Å²	120	69.2 Å²	69.2	74%	0.736	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-60	155.5	163.2	52.9	0	0	0	0	110.7
529	F	90.8	Very high	78.7	Confident	79 Å²	79	74.9 Å²	74.9	35%	0.346	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-70.9	142.8	176	-77.8	-77.5	0	0	0	111.7	Q513 F514 R515	Q513-F529 HydrophobicContact CB-CD1 3.98Å; Q513-F529 HydrophobicContact CG-CD1 3.79Å; Q513-F529 HydrophobicContact CG-CE1 3.98Å; F514-F529 CarbonylContact O-C 3.58Å; F514-F529 VanDerWaalsContact O-CA 3.28Å; F514-F529 WeakPolarHBondContact O-CA 3.47Å; R515-F529 HydrophobicContact CB-CD1 3.93Å; R515-F529 HydrophobicContact CB-CE1 4.09Å; R515-F529 HydrophobicContact CB-CG 4.4Å; R515-F529 VanDerWaalsContact CD-CZ 3.4Å; R515-F529 HydrophobicContact CG-CD1 3.98Å; R515-F529 HydrophobicContact CG-CE1 3.59Å; R515-F529 HydrophobicContact CG-CZ 3.99Å
530	V	92.3	Very high	77.1	Confident	28 Å²	28	83.5 Å²	83.5	17%	0.17	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.1	166.5	-61.8	0	0	0	0	109.3	V448 A450 Q513 F514	V448-V530 HydrophobicContact CB-CG1 4.36Å; V448-V530 HydrophobicContact CG1-CG1 4.25Å; V448-V530 HydrophobicContact CG1-CG2 3.99Å; V448-V530 WeakPolarHBondContact O-CG1 3.29Å; A450-V530 HydrophobicContact CB-CG2 3.84Å; Q513-V530 CarbonylContact C-O 3.6Å; Q513-V530 VanDerWaalsContact CA-O 3.28Å; Q513-V530 WeakPolarHBondContact CA-O 3.17Å; F514-V530 HydrophobicContact CB-CG2 3.94Å; F514-V530 PolarHBondContact N-O 2.93Å; F514-V530 PolarHBondContact O-N 3.19Å
531	Q	92.4	Very high	74.9	Confident	107 Å²	107	90.6 Å²	90.6	50%	0.5	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144.4	-175.4	-66.5	-176.4	-7.7	0	0	111.4	V482 L511 Y512 Q513	V482-Q531 HydrophobicContact CG2-CG 4.37Å; L511-Q531 HydrophobicContact CD1-CB 4.4Å; Y512-Q531 CarbonylContact O-C 3.54Å; Y512-Q531 VanDerWaalsContact O-CA 3.24Å; Y512-Q531 WeakPolarHBondContact O-CA 3.39Å; Q513-Q531 HydrophobicContact CB-CG 3.85Å
532	E	92.3	Very high	73	Confident	57 Å²	57	90 Å²	90	27%	0.266	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	146	176.1	-170.9	56.7	-81.7	0	0	112.1	A450 A452 V458 Y512 F514	A450-E532 HydrophobicContact CB-CB 3.75Å; A450-E532 HydrophobicContact CB-CG 4.44Å; A452-E532 HydrophobicContact CB-CG 4.08Å; V458-E532 HydrophobicContact CG1-CB 4.08Å; V458-E532 HydrophobicContact CG1-CG 4.07Å; V458-E532 HydrophobicContact CG2-CG 4.38Å; Y512-E532 PolarHBondContact N-O 3.2Å; Y512-E532 PolarHBondContact O-N 3.13Å; F514-E532 HydrophobicContact CE2-CB 4.3Å
533	K	88.1	Confident	71.4	Confident	115 Å²	115	92.2 Å²	92.2	50%	0.5	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	126.9	-178.8	-168.3	179.6	-179.4	-178.2	0	111	A452 S509 L511	A452-K533 VanDerWaalsContact CB-O 3.25Å; A452-K533 WeakPolarHBondContact CB-O 3.46Å; S509-K533 WeakPolarHBondContact O-CE 3.23Å; L511-K533 HydrophobicContact CD1-CB 3.99Å
534	T	86	Confident	69.5	Low	4 Å²	4	94.4 Å²	94.4	3%	0.025	52%	0.518	C	S	.	.			trans	-62.4	150.8	174.3	53.5	0	0	0	0	111.5	V458 L506 N507 S509 T510 Y512	V458-T534 HydrophobicContact CG2-CG2 4.01Å; L506-T534 HydrophobicContact CB-CG2 3.85Å; L506-T534 HydrophobicContact CD1-CG2 4.15Å; N507-T534 PolarHBondContact O-OG1 2.94Å; S509-T534 PolarHBondContact N-OG1 2.85Å; T510-T534 PolarHBondContact N-OG1 2.84Å; T510-T534 PolarHBondContact O-N 3.31Å; T510-T534 PolarHBondContact O-OG1 3.39Å; Y512-T534 HydrophobicContact CD2-CG2 4.4Å; Y512-T534 HydrophobicContact CE2-CG2 4.34Å
535	Q	83.5	Confident	67.2	Low	100 Å²	100	100 Å²	100	47%	0.467	55%	0.55	S	S	.	*			trans	-64.1	157.4	178.9	-61.6	174.6	1.9	0	0	111.5	A452 S454 T455 S509	A452-Q535 HydrophobicContact CB-CG 4.37Å; S454-Q535 PolarHBondContact O-N 3.49Å; S454-Q535 VanDerWaalsContact O-N 3.11Å; T455-Q535 WeakPolarHBondContact CA-O 3.25Å; T455-Q535 HydrophobicContact CG2-CB 4.2Å; T455-Q535 WeakPolarHBondContact CG2-O 3.47Å; S509-Q535 PolarHBondContact N-O 3.04Å
536	G	66.2	Low	64.7	Low	44 Å²	44	101.3 Å²	101.3	45%	0.454	57%	0.566	S	S	.	*			trans	-106.9	157	178.2	0	0	0	0	0	112.5	S509	S509-G536 VanDerWaalsContact OG-CA 3.3Å; S509-G536 WeakPolarHBondContact OG-CA 3.45Å
537	D	56.8	Low	61.8	Low	124 Å²	124	107.4 Å²	107.4	66%	0.663	60%	0.597	S	S	*	*			trans	-88.8	114.7	170.8	-72.3	-36.4	0	0	0	108.9
538	D	50.8	Low	58.7	Low	174 Å²	174	110.6 Å²	110.6	93%	0.93	63%	0.632	S	S	*	*			trans	-145.8	134.9	160.8	-96.3	-34.1	0	0	0	112.5
539	S	39.3	Very low	55.9	Low	119 Å²	119	111.9 Å²	111.9	83%	0.832	64%	0.639	S	S	*	*			trans	-89	151.6	-177.5	-59.5	0	0	0	0	111.7
540	Q	48.4	Very low	52.9	Low	186 Å²	186	113.8 Å²	113.8	87%	0.869	66%	0.662	S	S	*	*			trans	-58.7	146.5	176.9	-64.8	179.1	-14.6	0	0	113.8
541	I	33.7	Very low	49.8	Very low	158 Å²	158	116 Å²	116	81%	0.81	69%	0.691	S	S	*	*			trans	-163.6	126.6	142.9	-93.3	146.6	0	0	0	112.4
542	L	30.2	Very low	46.9	Very low	166 Å²	166	120.3 Å²	120.3	87%	0.869	71%	0.708	S	S	*	*			trans	33.8	142.5	150.9	-70.1	104.8	0	0	0	126.7
543	A	36.7	Very low	44.5	Very low	89 Å²	89	122.6 Å²	122.6	74%	0.736	73%	0.728	S	S	*	*			trans	-72.8	176.9	177.8	0	0	0	0	0	116
544	P	37.4	Very low	42.1	Very low	124 Å²	124	123.4 Å²	123.4	81%	0.805	74%	0.743	S	S	*	*				-145.3	164.3	90.2	35.2	-16.1	0	0	0	117.3
545	T	32.9	Very low	39.5	Very low	126 Å²	126	127 Å²	127	77%	0.773	78%	0.78	S	S	*	*			trans	-59.2	147.4	173.6	32.3	0	0	0	0	116.9
546	T	31.3	Very low	37.7	Very low	127 Å²	127	130.4 Å²	130.4	78%	0.779	80%	0.802	S	S	*	*				178.8	130.5	108	36	0	0	0	0	114.7
547	Q	28.6	Very low	36.7	Very low	196 Å²	196	131.2 Å²	131.2	92%	0.916	81%	0.81	S	S	*	*			trans	58.9	128.7	142.2	-65	-169.9	-10	0	0	124.7
548	G	26.9	Very low	36.4	Very low	80 Å²	80	131.2 Å²	131.2	83%	0.825	81%	0.81	S	S	*	*			trans	172.4	93.6	159.5	0	0	0	0	0	112.8
549	V	29.5	Very low	36.4	Very low	147 Å²	147	131.5 Å²	131.5	89%	0.891	81%	0.806	S	S	*	*			trans	-71.9	141.3	-172.2	170.6	0	0	0	0	113.6
550	S	26.6	Very low	36.9	Very low	119 Å²	119	132.9 Å²	132.9	83%	0.832	80%	0.803	S	S	*	*				163.6	131.4	120.9	-172.3	0	0	0	0	113.7
551	G	28.9	Very low	37	Very low	75 Å²	75	130 Å²	130	77%	0.773	79%	0.793	S	S	*	*			trans	106.4	90	142.6	0	0	0	0	0	119.7
552	K	31.5	Very low	38.1	Very low	196 Å²	196	127.9 Å²	127.9	85%	0.852	79%	0.787	S	S	*	*			trans	-87.7	167.9	145.2	-118	-173.8	177.7	177.9	0	107.7
553	P	41.3	Very low	39.2	Very low	105 Å²	105	123.2 Å²	123.2	68%	0.682	77%	0.773	S	S	*	*			cis	-143.5	171.5	17.4	40	-18.1	0	0	0	118.1
554	T	36.6	Very low	40.1	Very low	133 Å²	133	123.3 Å²	123.3	82%	0.816	76%	0.764	S	S	*	*			trans	6.4	139.4	149.3	58.5	0	0	0	0	121.4
555	G	32	Very low	41.1	Very low	78 Å²	78	121.7 Å²	121.7	80%	0.804	75%	0.751	S	S	*	*			trans	170.4	98.6	156	0	0	0	0	0	113.6
556	D	46.7	Very low	42.3	Very low	172 Å²	172	117.2 Å²	117.2	92%	0.92	73%	0.73	S	S	*	*			trans	-53.6	140.2	171.1	-139.5	-13.9	0	0	0	112
557	G	45.2	Very low	43.7	Very low	62 Å²	62	114.3 Å²	114.3	64%	0.639	72%	0.715	S	S	*	*			trans	157.4	58.3	176.9	0	0	0	0	0	115
558	N	49.1	Very low	45.5	Very low	123 Å²	123	108.8 Å²	108.8	66%	0.658	70%	0.695	S	S	*	*			trans	-148.8	29.5	163.5	-104.3	-10.5	0	0	0	114.2
559	Q	51.2	Low	47.3	Very low	180 Å²	180	108.5 Å²	108.5	84%	0.841	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	3.7	173.1	-86.4	-164.8	-10.1	0	0	115.1
560	L	50.7	Low	49.4	Very low	149 Å²	149	105.8 Å²	105.8	78%	0.78	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-25.9	174.5	-124	90.4	0	0	0	114.3
561	L	50.7	Low	51.7	Low	124 Å²	124	103.5 Å²	103.5	65%	0.649	64%	0.642	S	S	*	*	H	α-helix	trans	-78.1	-31.5	-175.6	-137	100.6	0	0	0	112.8	V565	L561-V565 WeakPolarHBondContact O-CG2 3.49Å
562	V	55.6	Low	53.8	Low	114 Å²	114	103.1 Å²	103.1	69%	0.691	63%	0.627	S	S	*	*	H	α-helix	trans	-75	-28.2	-179.3	-177.6	0	0	0	0	111.8	G566	V562-G566 PolarHBondContact O-N 3.14Å
563	A	53.1	Low	56	Low	68 Å²	68	97.7 Å²	97.7	56%	0.562	61%	0.61	S	S	*	*	H	α-helix	trans	-74.5	-33.1	-179.6	0	0	0	0	0	113.3	S567	A563-S567 PolarHBondContact O-N 2.81Å
564	V	56.2	Low	57.7	Low	91 Å²	91	96.2 Å²	96.2	55%	0.552	60%	0.599	S	S	*	*	H	α-helix	trans	-78.6	-37.8	-180	-179.1	0	0	0	0	111.6	G566 S567 V568	V564-G566 VanDerWaalsContact C-N 3.32Å; V564-G566 PolarHBondContact O-N 3.43Å; V564-S567 PolarHBondContact O-N 3.23Å; V564-S567 PolarHBondContact O-OG 3.15Å; V564-V568 WeakPolarHBondContact O-CG2 3.42Å; V564-V568 PolarHBondContact O-N 3.29Å
565	V	58.4	Low	59.8	Low	90 Å²	90	94.6 Å²	94.6	55%	0.545	58%	0.584	S	S	.	*	H	α-helix	trans	-69.5	-32.9	176.1	179.7	0	0	0	0	111.1	L561 T569	L561-V565 WeakPolarHBondContact O-CG2 3.49Å; V565-T569 HydrophobicContact CG1-CG2 4.46Å; V565-T569 WeakPolarHBondContact O-CB 3.46Å; V565-T569 VanDerWaalsContact O-CG2 3.27Å; V565-T569 WeakPolarHBondContact O-CG2 3.45Å; V565-T569 PolarHBondContact O-N 3.43Å; V565-T569 PolarHBondContact O-OG1 2.79Å
566	G	58.2	Low	62	Low	32 Å²	32	95.9 Å²	95.9	33%	0.33	57%	0.572	S	S	.	*	H	α-helix	trans	-67.2	-38.7	174.3	0	0	0	0	0	113.9	V562 V564 T569 V570	V562-G566 PolarHBondContact O-N 3.14Å; V564-G566 VanDerWaalsContact C-N 3.32Å; V564-G566 PolarHBondContact O-N 3.43Å; G566-T569 WeakPolarHBondContact CA-OG1 3.33Å; G566-T569 PolarHBondContact O-OG1 3.11Å; G566-T569 VanDerWaalsContact O-OG1 3.09Å; G566-V570 WeakPolarHBondContact O-CB 3.35Å; G566-V570 WeakPolarHBondContact O-CG2 3.33Å; G566-V570 PolarHBondContact O-N 2.65Å; G566-V570 VanDerWaalsContact O-N 3.09Å
567	S	60.3	Low	63.7	Low	66 Å²	66	92.8 Å²	92.8	46%	0.462	56%	0.555	S	S	.	*	H	α-helix	trans	-74.9	-37.3	-177.7	72.4	0	0	0	0	112.6	A563 V564 T571	A563-S567 PolarHBondContact O-N 2.81Å; V564-S567 PolarHBondContact O-N 3.23Å; V564-S567 PolarHBondContact O-OG 3.15Å; S567-T571 WeakPolarHBondContact O-CB 3.47Å; S567-T571 WeakPolarHBondContact O-CG2 3.36Å; S567-T571 PolarHBondContact O-N 3.34Å; S567-T571 PolarHBondContact O-OG1 2.91Å
568	V	66.3	Low	65.3	Low	80 Å²	80	92.2 Å²	92.2	49%	0.485	54%	0.544	S	S	.	.	H	α-helix	trans	-71.1	-38.2	177.3	180	0	0	0	0	111.4	V564 T571 C572	V564-V568 WeakPolarHBondContact O-CG2 3.42Å; V564-V568 PolarHBondContact O-N 3.29Å; V568-T571 VanDerWaalsContact CA-OG1 3.31Å; V568-T571 WeakPolarHBondContact CA-OG1 3.32Å; V568-T571 PolarHBondContact O-OG1 2.69Å; V568-T571 VanDerWaalsContact O-OG1 3.07Å; V568-C572 VanDerWaalsContact O-CB 3.28Å; V568-C572 WeakPolarHBondContact O-CB 3.48Å; V568-C572 PolarHBondContact O-N 2.85Å; V568-C572 PolarHBondContact O-SG 2.68Å
569	T	66.1	Low	66.8	Low	75 Å²	75	91.5 Å²	91.5	46%	0.46	54%	0.54	S	S	.	.	H	α-helix	trans	-68.9	-41.4	176.4	48.6	0	0	0	0	112.1	V565 G566 C572 V573	V565-T569 HydrophobicContact CG1-CG2 4.46Å; V565-T569 WeakPolarHBondContact O-CB 3.46Å; V565-T569 VanDerWaalsContact O-CG2 3.27Å; V565-T569 WeakPolarHBondContact O-CG2 3.45Å; V565-T569 PolarHBondContact O-N 3.43Å; V565-T569 PolarHBondContact O-OG1 2.79Å; G566-T569 WeakPolarHBondContact CA-OG1 3.33Å; G566-T569 PolarHBondContact O-OG1 3.11Å; G566-T569 VanDerWaalsContact O-OG1 3.09Å; T569-C572 PolarHBondContact O-N 3Å; T569-V573 WeakPolarHBondContact O-CB 3.43Å; T569-V573 WeakPolarHBondContact O-CG2 3.18Å; T569-V573 PolarHBondContact O-N 2.73Å
570	V	73.8	Confident	68.1	Low	90 Å²	90	87 Å²	87	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-67	-40	176.8	172.5	0	0	0	0	111.3	G566 V573 T574	G566-V570 WeakPolarHBondContact O-CB 3.35Å; G566-V570 WeakPolarHBondContact O-CG2 3.33Å; G566-V570 PolarHBondContact O-N 2.65Å; G566-V570 VanDerWaalsContact O-N 3.09Å; V570-V573 PolarHBondContact O-N 3.42Å; V570-T574 HydrophobicContact CG1-CG2 4.41Å; V570-T574 VanDerWaalsContact O-CG2 3.29Å; V570-T574 WeakPolarHBondContact O-CG2 3.25Å; V570-T574 PolarHBondContact O-N 3.05Å; V570-T574 PolarHBondContact O-OG1 3.08Å; V570-T574 VanDerWaalsContact O-OG1 3.07Å
571	T	74.5	Confident	69.5	Low	70 Å²	70	82.2 Å²	82.2	43%	0.429	50%	0.503	S	S	.	.	H	α-helix	trans	-69.1	-38.8	176.4	46.4	0	0	0	0	112.9	S567 V568 T574 I575	S567-T571 WeakPolarHBondContact O-CB 3.47Å; S567-T571 WeakPolarHBondContact O-CG2 3.36Å; S567-T571 PolarHBondContact O-N 3.34Å; S567-T571 PolarHBondContact O-OG1 2.91Å; V568-T571 VanDerWaalsContact CA-OG1 3.31Å; V568-T571 WeakPolarHBondContact CA-OG1 3.32Å; V568-T571 PolarHBondContact O-OG1 2.69Å; V568-T571 VanDerWaalsContact O-OG1 3.07Å; T571-T574 WeakPolarHBondContact CA-OG1 3.06Å; T571-T574 PolarHBondContact O-N 3.21Å; T571-T574 PolarHBondContact O-OG1 3.15Å; T571-I575 WeakPolarHBondContact O-CB 3.43Å; T571-I575 WeakPolarHBondContact O-CD1 3.25Å; T571-I575 WeakPolarHBondContact O-CG1 3.04Å; T571-I575 PolarHBondContact O-N 3.16Å
572	C	73.3	Confident	70.7	Confident	68 Å²	68	81.4 Å²	81.4	46%	0.459	50%	0.499	S	S	.	.	H	α-helix	trans	-64	-40.8	172.6	-74.9	0	0	0	0	111.9	V568 T569 L576	V568-C572 VanDerWaalsContact O-CB 3.28Å; V568-C572 WeakPolarHBondContact O-CB 3.48Å; V568-C572 PolarHBondContact O-N 2.85Å; V568-C572 PolarHBondContact O-SG 2.68Å; T569-C572 PolarHBondContact O-N 3Å; C572-L576 WeakPolarHBondContact O-CB 3.36Å; C572-L576 PolarHBondContact O-N 3.39Å
573	V	77.5	Confident	71.8	Confident	81 Å²	81	82.2 Å²	82.2	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-69.1	-38.7	178	171.1	0	0	0	0	111.6	T569 V570 L576 L577	T569-V573 WeakPolarHBondContact O-CB 3.43Å; T569-V573 WeakPolarHBondContact O-CG2 3.18Å; T569-V573 PolarHBondContact O-N 2.73Å; V570-V573 PolarHBondContact O-N 3.42Å; V573-L576 PolarHBondContact O-N 3.19Å; V573-L577 HydrophobicContact CG1-CD1 3.95Å; V573-L577 HydrophobicContact CG1-CG 4.41Å; V573-L577 WeakPolarHBondContact O-CB 3.32Å; V573-L577 VanDerWaalsContact O-CG 3.3Å; V573-L577 WeakPolarHBondContact O-CG 3.42Å; V573-L577 PolarHBondContact O-N 3.36Å
574	T	75.5	Confident	72.7	Confident	74 Å²	74	86 Å²	86	45%	0.454	49%	0.494	S	S	.	.	H	α-helix	trans	-69.8	-36.6	176.4	54.1	0	0	0	0	112.2	V570 T571 L577 A578	V570-T574 HydrophobicContact CG1-CG2 4.41Å; V570-T574 VanDerWaalsContact O-CG2 3.29Å; V570-T574 WeakPolarHBondContact O-CG2 3.25Å; V570-T574 PolarHBondContact O-N 3.05Å; V570-T574 PolarHBondContact O-OG1 3.08Å; V570-T574 VanDerWaalsContact O-OG1 3.07Å; T571-T574 WeakPolarHBondContact CA-OG1 3.06Å; T571-T574 PolarHBondContact O-N 3.21Å; T571-T574 PolarHBondContact O-OG1 3.15Å; T574-L577 PolarHBondContact O-N 3.37Å; T574-A578 VanDerWaalsContact O-CB 3.28Å; T574-A578 WeakPolarHBondContact O-CB 3.48Å; T574-A578 PolarHBondContact O-N 3.37Å
575	I	80.7	Confident	73.6	Confident	99 Å²	99	86.1 Å²	86.1	51%	0.508	49%	0.49	S	S	.	.	H	α-helix	trans	-65.4	-42.1	171.8	-67.7	166.1	0	0	0	110.5	T571 L577 A578 L579	T571-I575 WeakPolarHBondContact O-CB 3.43Å; T571-I575 WeakPolarHBondContact O-CD1 3.25Å; T571-I575 WeakPolarHBondContact O-CG1 3.04Å; T571-I575 PolarHBondContact O-N 3.16Å; I575-L577 PolarHBondContact O-N 3.02Å; I575-A578 PolarHBondContact O-N 3.04Å; I575-L579 HydrophobicContact CG2-CD1 3.9Å; I575-L579 HydrophobicContact CG2-CG 4.33Å; I575-L579 WeakPolarHBondContact O-CB 3.37Å; I575-L579 VanDerWaalsContact O-CG 3.27Å; I575-L579 WeakPolarHBondContact O-CG 3.04Å; I575-L579 PolarHBondContact O-N 2.9Å
576	L	78.9	Confident	73.9	Confident	106 Å²	106	90.5 Å²	90.5	56%	0.555	50%	0.497	S	S	*	.	H	α-helix	trans	-63	-41.8	175.6	-116.4	143.2	0	0	0	112.1	C572 V573 L579 L580	C572-L576 WeakPolarHBondContact O-CB 3.36Å; C572-L576 PolarHBondContact O-N 3.39Å; V573-L576 PolarHBondContact O-N 3.19Å; L576-L579 PolarHBondContact O-N 3.49Å; L576-L580 HydrophobicContact CD2-CD1 4.33Å; L576-L580 VanDerWaalsContact O-CB 3.28Å; L576-L580 WeakPolarHBondContact O-CB 3.16Å; L576-L580 VanDerWaalsContact O-CG 3.26Å; L576-L580 WeakPolarHBondContact O-CG 3.46Å; L576-L580 PolarHBondContact O-N 2.76Å
577	L	81.8	Confident	74.1	Confident	107 Å²	107	93.6 Å²	93.6	56%	0.56	50%	0.501	S	S	*	.	H	α-helix	trans	-68.3	-37.4	175.6	-74.3	170.4	0	0	0	112	V573 T574 I575 L580 A581	V573-L577 HydrophobicContact CG1-CD1 3.95Å; V573-L577 HydrophobicContact CG1-CG 4.41Å; V573-L577 WeakPolarHBondContact O-CB 3.32Å; V573-L577 VanDerWaalsContact O-CG 3.3Å; V573-L577 WeakPolarHBondContact O-CG 3.42Å; V573-L577 PolarHBondContact O-N 3.36Å; T574-L577 PolarHBondContact O-N 3.37Å; I575-L577 PolarHBondContact O-N 3.02Å; L577-L580 PolarHBondContact O-N 2.9Å; L577-A581 VanDerWaalsContact O-CB 3.23Å; L577-A581 WeakPolarHBondContact O-CB 3.48Å; L577-A581 PolarHBondContact O-N 3.46Å
578	A	80.1	Confident	74.2	Confident	50 Å²	50	96.8 Å²	96.8	41%	0.413	51%	0.51	S	S	.	.	H	α-helix	trans	-67.9	-39.4	174.6	0	0	0	0	0	111.8	T574 I575 A581 L582	T574-A578 VanDerWaalsContact O-CB 3.28Å; T574-A578 WeakPolarHBondContact O-CB 3.48Å; T574-A578 PolarHBondContact O-N 3.37Å; I575-A578 PolarHBondContact O-N 3.04Å; A578-A581 PolarHBondContact O-N 2.93Å; A578-L582 WeakPolarHBondContact O-CB 3.44Å; A578-L582 VanDerWaalsContact O-CG 3.3Å; A578-L582 WeakPolarHBondContact O-CG 3.46Å; A578-L582 PolarHBondContact O-N 3.24Å
579	L	79.2	Confident	73.6	Confident	108 Å²	108	97.9 Å²	97.9	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-68.6	-37.6	173.5	-72.3	172.1	0	0	0	111.8	I575 L576 L582 F583	I575-L579 HydrophobicContact CG2-CD1 3.9Å; I575-L579 HydrophobicContact CG2-CG 4.33Å; I575-L579 WeakPolarHBondContact O-CB 3.37Å; I575-L579 VanDerWaalsContact O-CG 3.27Å; I575-L579 WeakPolarHBondContact O-CG 3.04Å; I575-L579 PolarHBondContact O-N 2.9Å; L576-L579 PolarHBondContact O-N 3.49Å; L579-L582 PolarHBondContact O-N 2.65Å; L579-F583 WeakPolarHBondContact O-CB 3.34Å; L579-F583 PolarHBondContact O-N 3.15Å
580	L	79.9	Confident	72.9	Confident	86 Å²	86	99.1 Å²	99.1	45%	0.45	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-37.5	172.7	-79.9	167.3	0	0	0	111.8	L576 L577 F583 Y584	L576-L580 HydrophobicContact CD2-CD1 4.33Å; L576-L580 VanDerWaalsContact O-CB 3.28Å; L576-L580 WeakPolarHBondContact O-CB 3.16Å; L576-L580 VanDerWaalsContact O-CG 3.26Å; L576-L580 WeakPolarHBondContact O-CG 3.46Å; L576-L580 PolarHBondContact O-N 2.76Å; L577-L580 PolarHBondContact O-N 2.9Å; L580-F583 PolarHBondContact O-N 2.89Å; L580-Y584 WeakPolarHBondContact O-CB 3.32Å; L580-Y584 PolarHBondContact O-N 3.21Å
581	A	79.9	Confident	71.5	Confident	47 Å²	47	98.6 Å²	98.6	39%	0.388	51%	0.51	S	S	.	.	H	α-helix	trans	-68.3	-43	173.8	0	0	0	0	0	111	L577 A578 F583 Y584 I585	L577-A581 VanDerWaalsContact O-CB 3.23Å; L577-A581 WeakPolarHBondContact O-CB 3.48Å; L577-A581 PolarHBondContact O-N 3.46Å; A578-A581 PolarHBondContact O-N 2.93Å; A581-F583 VanDerWaalsContact C-N 3.32Å; A581-F583 PolarHBondContact O-N 2.67Å; A581-Y584 CarbonylContact O-C 3.47Å; A581-Y584 PolarHBondContact O-N 2.73Å; A581-I585 VanDerWaalsContact O-CB 3.31Å; A581-I585 WeakPolarHBondContact O-CB 3.49Å; A581-I585 WeakPolarHBondContact O-CD1 3.35Å; A581-I585 WeakPolarHBondContact O-CG1 3.33Å; A581-I585 PolarHBondContact O-N 2.64Å
582	L	75.4	Confident	70	Confident	108 Å²	108	104.4 Å²	104.4	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-63.9	-37.8	172.6	-77.3	168.7	0	0	0	111.5	A578 L579 I585 R586	A578-L582 WeakPolarHBondContact O-CB 3.44Å; A578-L582 VanDerWaalsContact O-CG 3.3Å; A578-L582 WeakPolarHBondContact O-CG 3.46Å; A578-L582 PolarHBondContact O-N 3.24Å; L579-L582 PolarHBondContact O-N 2.65Å; L582-I585 PolarHBondContact O-N 3.33Å; L582-R586 WeakPolarHBondContact O-CB 3.46Å; L582-R586 PolarHBondContact O-N 3.06Å
583	F	78	Confident	68.4	Low	130 Å²	130	111.3 Å²	111.3	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-66	-41.3	172.5	-178.3	-98	0	0	0	111.2	L579 L580 A581 R586 K587	L579-F583 WeakPolarHBondContact O-CB 3.34Å; L579-F583 PolarHBondContact O-N 3.15Å; L580-F583 PolarHBondContact O-N 2.89Å; A581-F583 VanDerWaalsContact C-N 3.32Å; A581-F583 PolarHBondContact O-N 2.67Å; F583-R586 PolarHBondContact O-N 2.96Å; F583-K587 HydrophobicContact CE1-CD 4.3Å; F583-K587 WeakPolarHBondContact O-CB 3.37Å; F583-K587 PolarHBondContact O-N 3.11Å
584	Y	73.8	Confident	66.5	Low	148 Å²	148	116.3 Å²	116.3	58%	0.58	55%	0.551	S	S	*	*	H	α-helix	trans	-68.3	-39.2	175.7	-113.1	-86.5	0	0	0	112.3	L580 A581 K587 M588	L580-Y584 WeakPolarHBondContact O-CB 3.32Å; L580-Y584 PolarHBondContact O-N 3.21Å; A581-Y584 CarbonylContact O-C 3.47Å; A581-Y584 PolarHBondContact O-N 2.73Å; Y584-K587 CarbonylContact O-C 3.57Å; Y584-K587 PolarHBondContact O-N 2.87Å; Y584-M588 WeakPolarHBondContact O-CB 3.44Å; Y584-M588 PolarHBondContact O-N 3.25Å
585	I	74.1	Confident	64.4	Low	93 Å²	93	118 Å²	118	48%	0.477	56%	0.562	S	S	.	*	H	α-helix	trans	-68.2	-43.4	175.6	-69.4	163.7	0	0	0	109.6	A581 L582 M588 L589	A581-I585 VanDerWaalsContact O-CB 3.31Å; A581-I585 WeakPolarHBondContact O-CB 3.49Å; A581-I585 WeakPolarHBondContact O-CD1 3.35Å; A581-I585 WeakPolarHBondContact O-CG1 3.33Å; A581-I585 PolarHBondContact O-N 2.64Å; L582-I585 PolarHBondContact O-N 3.33Å; I585-M588 CarbonylContact O-C 3.58Å; I585-M588 PolarHBondContact O-N 3.22Å; I585-L589 HydrophobicContact CG2-CD1 3.87Å; I585-L589 HydrophobicContact CG2-CG 4.4Å; I585-L589 WeakPolarHBondContact O-CB 3.47Å; I585-L589 VanDerWaalsContact O-CG 3.28Å; I585-L589 WeakPolarHBondContact O-CG 3.37Å; I585-L589 PolarHBondContact O-N 3.06Å
586	R	65.6	Low	62	Low	183 Å²	183	122.8 Å²	122.8	69%	0.691	58%	0.579	S	S	*	*	H	α-helix	trans	-65.7	-37.7	174.4	-162.9	175	177.4	149	-0.2	111.1	L582 F583 L589 L590	L582-R586 WeakPolarHBondContact O-CB 3.46Å; L582-R586 PolarHBondContact O-N 3.06Å; F583-R586 PolarHBondContact O-N 2.96Å; R586-L589 PolarHBondContact O-N 3.25Å; R586-L590 HydrophobicContact CG-CD1 4.13Å; R586-L590 WeakPolarHBondContact O-CB 3.29Å; R586-L590 WeakPolarHBondContact O-CD1 3.47Å; R586-L590 VanDerWaalsContact O-CG 3.26Å; R586-L590 WeakPolarHBondContact O-CG 3.37Å; R586-L590 PolarHBondContact O-N 3.43Å
587	K	62.2	Low	59.7	Low	97 Å²	97	123 Å²	123	42%	0.422	59%	0.585	S	S	.	*	H	α-helix	trans	-67.9	-34.7	171.8	-172.5	177.1	-179.1	178.7	0	111.9	F583 Y584 N591	F583-K587 HydrophobicContact CE1-CD 4.3Å; F583-K587 WeakPolarHBondContact O-CB 3.37Å; F583-K587 PolarHBondContact O-N 3.11Å; Y584-K587 CarbonylContact O-C 3.57Å; Y584-K587 PolarHBondContact O-N 2.87Å; K587-N591 WeakPolarHBondContact O-CB 3.27Å; K587-N591 PolarHBondContact O-N 2.89Å
588	M	60.9	Low	57.1	Low	132 Å²	132	127.7 Å²	127.7	65%	0.65	60%	0.596	S	S	*	*	H	α-helix	trans	-72.1	-40	173.3	-114.3	-174.6	78.4	0	0	111.6	Y584 I585 N591 R592	Y584-M588 WeakPolarHBondContact O-CB 3.44Å; Y584-M588 PolarHBondContact O-N 3.25Å; I585-M588 CarbonylContact O-C 3.58Å; I585-M588 PolarHBondContact O-N 3.22Å; M588-N591 PolarHBondContact O-N 3.28Å; M588-R592 WeakPolarHBondContact O-CB 3.28Å; M588-R592 PolarHBondContact O-N 3.12Å
589	L	54.9	Low	54.5	Low	103 Å²	103	132.4 Å²	132.4	54%	0.539	61%	0.61	S	S	.	*	H	α-helix	trans	-70.6	-37.4	175.5	-70.7	168.1	0	0	0	111.5	I585 R586 R592 R593	I585-L589 HydrophobicContact CG2-CD1 3.87Å; I585-L589 HydrophobicContact CG2-CG 4.4Å; I585-L589 WeakPolarHBondContact O-CB 3.47Å; I585-L589 VanDerWaalsContact O-CG 3.28Å; I585-L589 WeakPolarHBondContact O-CG 3.37Å; I585-L589 PolarHBondContact O-N 3.06Å; R586-L589 PolarHBondContact O-N 3.25Å; L589-R592 PolarHBondContact O-N 3.1Å; L589-R593 PolarHBondContact O-N 3Å
590	L	50.6	Low	52	Low	102 Å²	102	131.6 Å²	131.6	53%	0.534	61%	0.613	S	S	.	*	H	α-helix	trans	-68.1	-40.6	170.2	-80.3	160.9	0	0	0	112	R586 R592 R593 R594	R586-L590 HydrophobicContact CG-CD1 4.13Å; R586-L590 WeakPolarHBondContact O-CB 3.29Å; R586-L590 WeakPolarHBondContact O-CD1 3.47Å; R586-L590 VanDerWaalsContact O-CG 3.26Å; R586-L590 WeakPolarHBondContact O-CG 3.37Å; R586-L590 PolarHBondContact O-N 3.43Å; L590-R592 VanDerWaalsContact C-N 3.35Å; L590-R593 CarbonylContact O-C 3.53Å; L590-R593 PolarHBondContact O-N 3.06Å; L590-R594 PolarHBondContact O-N 3.42Å
591	N	45.6	Very low	49.2	Very low	78 Å²	78	130.8 Å²	130.8	42%	0.417	63%	0.626	S	S	.	*	H	α-helix	trans	-70.1	-31.8	174.4	-86.1	-3.1	0	0	0	112.1	K587 M588 R593 R594 T595	K587-N591 WeakPolarHBondContact O-CB 3.27Å; K587-N591 PolarHBondContact O-N 2.89Å; M588-N591 PolarHBondContact O-N 3.28Å; N591-R593 VanDerWaalsContact C-N 3.32Å; N591-R594 CarbonylContact O-C 3.57Å; N591-R594 PolarHBondContact O-N 2.94Å; N591-R594 VanDerWaalsContact O-N 3.14Å; N591-T595 WeakPolarHBondContact O-CG2 3.48Å; N591-T595 PolarHBondContact O-N 3.33Å; N591-T595 PolarHBondContact O-OG1 3.37Å; N591-T595 VanDerWaalsContact O-OG1 3.13Å
592	R	41.9	Very low	46.6	Very low	193 Å²	193	133.7 Å²	133.7	73%	0.728	64%	0.643	S	S	*	*	H	α-helix	trans	-72.3	-24.9	173.7	-159.3	174.8	-176.1	-172.7	0.6	112.2	M588 L589 L590	M588-R592 WeakPolarHBondContact O-CB 3.28Å; M588-R592 PolarHBondContact O-N 3.12Å; L589-R592 PolarHBondContact O-N 3.1Å; L590-R592 VanDerWaalsContact C-N 3.35Å
593	R	40.2	Very low	44.5	Very low	213 Å²	213	132.2 Å²	132.2	80%	0.804	66%	0.655	S	S	*	*	H	α-helix	trans	-79.7	-24.8	164.9	-78.3	-172.4	177	-174.5	-0.9	113.4	L589 L590 N591	L589-R593 PolarHBondContact O-N 3Å; L590-R593 CarbonylContact O-C 3.53Å; L590-R593 PolarHBondContact O-N 3.06Å; N591-R593 VanDerWaalsContact C-N 3.32Å
594	R	36.8	Very low	41.9	Very low	185 Å²	185	135.2 Å²	135.2	70%	0.698	67%	0.67	S	S	*	*	H	α-helix	trans	-83.7	-12.8	174.9	-85.8	-179.4	160.7	173.9	-4.9	114.8	L590 N591 T597	L590-R594 PolarHBondContact O-N 3.42Å; N591-R594 CarbonylContact O-C 3.57Å; N591-R594 PolarHBondContact O-N 2.94Å; N591-R594 VanDerWaalsContact O-N 3.14Å; R594-T597 PolarHBondContact O-OG1 3.44Å
595	T	31.8	Very low	39.8	Very low	111 Å²	111	136.8 Å²	136.8	68%	0.681	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	9.9	177.7	50.8	0	0	0	0	114.3	N591	N591-T595 WeakPolarHBondContact O-CG2 3.48Å; N591-T595 PolarHBondContact O-N 3.33Å; N591-T595 PolarHBondContact O-OG1 3.37Å; N591-T595 VanDerWaalsContact O-OG1 3.13Å
596	F	30.1	Very low	37.4	Very low	199 Å²	199	138.3 Å²	138.3	87%	0.873	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	8.1	164.3	-128.2	-89.8	0	0	0	113.2
597	T	30.4	Very low	35.6	Very low	109 Å²	109	136.6 Å²	136.6	67%	0.669	70%	0.7	S	S	*	*	S	Bend	trans	-104.3	102.4	168.1	40.1	0	0	0	0	109.7	R594	R594-T597 PolarHBondContact O-OG1 3.44Å
598	Y	28.8	Very low	33.9	Very low	206 Å²	206	136.8 Å²	136.8	81%	0.808	71%	0.705	S	S	*	*			trans	6	121.7	160.2	-144.7	-102.5	0	0	0	118.4	S600	Y598-S600 WeakPolarHBondContact CE1-OG 3.42Å
599	Q	23.6	Very low	32.1	Very low	149 Å²	149	137 Å²	137	70%	0.696	70%	0.704	S	S	*	*			trans	-80.6	121.1	159.1	-77.5	176.4	-40.5	0	0	109.4
600	S	26.7	Very low	30.5	Very low	91 Å²	91	139 Å²	139	64%	0.636	71%	0.709	S	S	*	*			trans	-111.4	121	156.6	-81.4	0	0	0	0	109.3	Y598	Y598-S600 WeakPolarHBondContact CE1-OG 3.42Å
601	G	22.9	Very low	29.3	Very low	70 Å²	70	138.7 Å²	138.7	72%	0.722	71%	0.708	S	S	*	*			trans	-85.4	144.2	172	0	0	0	0	0	112.3
602	S	24.9	Very low	28.4	Very low	107 Å²	107	140 Å²	140	75%	0.748	72%	0.723	S	S	*	*			trans	40.6	115.9	156.5	66	0	0	0	0	119.2
603	G	30.8	Very low	27.6	Very low	78 Å²	78	134.6 Å²	134.6	80%	0.804	73%	0.727	S	S	*	*			trans	-65.8	146.8	171.8	0	0	0	0	0	114.3
604	E	23.1	Very low	26.9	Very low	193 Å²	193	130.2 Å²	130.2	90%	0.902	73%	0.725	S	S	*	*			trans	-140.4	135.2	133.3	-104.4	176.2	178.8	0	0	106.6
605	E	30.3	Very low	26.3	Very low	181 Å²	181	127 Å²	127	85%	0.846	72%	0.72	S	S	*	*			trans	-69.4	125.8	-168.3	-62.4	177.5	133.2	0	0	111.9
606	T	22.9	Very low	25.9	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	72%	0.72	S	S	*	*			trans	-109.9	105.6	160	44	0	0	0	0	109.5	L608	T606-L608 PolarHBondContact O-N 2.98Å
607	I	29.1	Very low	25.7	Very low	147 Å²	147	124.7 Å²	124.7	75%	0.754	72%	0.716	S	S	*	*			trans	-75.2	113	163.3	-63.8	167.6	0	0	0	106.4
608	L	24.8	Very low	25.3	Very low	102 Å²	102	124.4 Å²	124.4	53%	0.534	72%	0.715	S	S	.	*			trans	-128.8	107.2	171.1	-99.5	153	0	0	0	108.9	T606	T606-L608 PolarHBondContact O-N 2.98Å
609	Q	23.6	Very low	25.2	Very low	135 Å²	135	125.8 Å²	125.8	63%	0.631	72%	0.719	S	S	*	*			trans	-70	137.1	171.7	-79	172.6	-59.6	0	0	109.4
610	F	22.5	Very low	25.4	Very low	146 Å²	146	129 Å²	129	64%	0.64	72%	0.724	S	S	*	*			trans	-104.1	117.3	162.3	-88.4	-87.2	0	0	0	108.5	S612	F610-S612 PolarHBondContact O-N 3.43Å
611	N	24.2	Very low	25.3	Very low	95 Å²	95	130.1 Å²	130.1	51%	0.508	73%	0.73	S	S	.	*			trans	-81.3	109.6	169.8	-76.5	-33.4	0	0	0	110
612	S	27.4	Very low	25.4	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	74%	0.737	S	S	*	*			trans	-85.8	136.7	146	-68.3	0	0	0	0	107.1	F610 T614	F610-S612 PolarHBondContact O-N 3.43Å; S612-T614 PolarHBondContact O-N 2.96Å
613	G	24.7	Very low	25.6	Very low	80 Å²	80	136.9 Å²	136.9	83%	0.825	74%	0.737	S	S	*	*	S	Bend	trans	-47.2	121.2	-171.9	0	0	0	0	0	114.8
614	T	25.5	Very low	25.6	Very low	122 Å²	122	138.8 Å²	138.8	75%	0.748	73%	0.734	S	S	*	*			trans	39.6	80.6	164.8	-34	0	0	0	0	117.1	S612 T616	S612-T614 PolarHBondContact O-N 2.96Å; T614-T616 HydrophobicContact CG2-CG2 3.99Å
615	L	24.3	Very low	26.2	Very low	116 Å²	116	135.7 Å²	135.7	61%	0.607	73%	0.73	S	S	*	*			trans	-91.4	110	133.6	-76.9	165.6	0	0	0	107.5	L617 E804	L615-L617 PolarHBondContact O-N 2.84Å; L615-E804 WeakPolarHBondContact CD1-OE1 3.34Å; L615-E804 WeakPolarHBondContact CD1-OE2 3.05Å
616	T	23.1	Very low	26.7	Very low	109 Å²	109	135.4 Å²	135.4	67%	0.669	73%	0.729	S	S	*	*			trans	-56.5	95.3	160.8	45.3	0	0	0	0	107.9	T614 T618	T614-T616 HydrophobicContact CG2-CG2 3.99Å; T616-T618 PolarHBondContact O-N 2.96Å
617	L	25.8	Very low	28.1	Very low	153 Å²	153	135 Å²	135	80%	0.801	73%	0.728	S	S	*	*			trans	-69.6	79.3	158.6	-117.3	149.9	0	0	0	105.9	L615 R619	L615-L617 PolarHBondContact O-N 2.84Å; L617-R619 PolarHBondContact O-N 2.78Å
618	T	23.3	Very low	29.7	Very low	104 Å²	104	131.5 Å²	131.5	64%	0.638	71%	0.711	S	S	*	*			trans	-56.6	102.3	150.1	50.3	0	0	0	0	104.5	T616 R620	T616-T618 PolarHBondContact O-N 2.96Å; T618-R620 PolarHBondContact O-N 2.8Å
619	R	26.9	Very low	32	Very low	235 Å²	235	132.8 Å²	132.8	89%	0.887	72%	0.723	S	S	*	*			trans	-63.4	84.2	175.7	-151.4	-176	-162.7	-172.5	5.8	106.6	L617	L617-R619 PolarHBondContact O-N 2.78Å
620	R	26.1	Very low	34.7	Very low	215 Å²	215	129.4 Å²	129.4	81%	0.811	71%	0.705	S	S	*	*			trans	-63.1	137.4	163.4	-74.7	-173.1	179.6	-178.1	0.8	106.1	T618 K622	T618-R620 PolarHBondContact O-N 2.8Å; R620-K622 PolarHBondContact O-N 3.49Å
621	P	26	Very low	37.7	Very low	116 Å²	116	125.2 Å²	125.2	75%	0.753	69%	0.692	S	S	*	*			trans	-50.5	138.5	174.8	-20.5	29.9	0	0	0	109.2	P623	P621-P623 VanDerWaalsContact O-CD 3.25Å; P621-P623 WeakPolarHBondContact O-CD 3.46Å
622	K	24.8	Very low	40.7	Very low	203 Å²	203	126.5 Å²	126.5	88%	0.883	70%	0.698	S	S	*	*			trans	-44.8	116.7	170.1	-107.4	-179.1	174	-178.2	0	107.9	R620 T624	R620-K622 PolarHBondContact O-N 3.49Å; K622-T624 PolarHBondContact O-N 3.34Å
623	P	29.3	Very low	43.6	Very low	115 Å²	115	122 Å²	122	75%	0.747	67%	0.666	S	S	*	*			trans	-58.4	133.8	164.9	-15.4	28.7	0	0	0	106.9	P621	P621-P623 VanDerWaalsContact O-CD 3.25Å; P621-P623 WeakPolarHBondContact O-CD 3.46Å
624	T	29.8	Very low	46.6	Very low	119 Å²	119	123.5 Å²	123.5	73%	0.73	65%	0.651	S	S	*	*			trans	-49.3	137.6	164.3	37.4	0	0	0	0	109	K622 E626	K622-T624 PolarHBondContact O-N 3.34Å; T624-E626 PolarHBondContact O-N 2.92Å
625	P	35.6	Very low	49.6	Very low	127 Å²	127	121.8 Å²	121.8	83%	0.825	63%	0.631	S	S	*	*			trans	-60.1	108.6	-178.1	24.3	-32.3	0	0	0	109.2
626	E	41.1	Very low	52.7	Low	176 Å²	176	123.5 Å²	123.5	82%	0.822	64%	0.636	S	S	*	*			trans	-67.6	136	165.1	-74.6	-178.9	168.2	0	0	107.9	T624 L628	T624-E626 PolarHBondContact O-N 2.92Å; E626-L628 PolarHBondContact O-N 3.47Å
627	P	53.1	Low	56	Low	115 Å²	115	121 Å²	121	75%	0.747	62%	0.618	S	S	*	*			trans	-59.9	130	178.1	22.3	-30.1	0	0	0	110.2	T629	P627-T629 PolarHBondContact O-N 3.3Å; P627-T629 PolarHBondContact O-OG1 2.92Å
628	L	62.4	Low	59.1	Low	73 Å²	73	114.3 Å²	114.3	38%	0.382	58%	0.583	S	S	.	*			trans	-59.1	112.2	179.7	-155.1	97.3	0	0	0	109.1	E626 Y630 L687 E688	E626-L628 PolarHBondContact O-N 3.47Å; L628-Y630 HydrophobicContact CD2-CD1 4.18Å; L628-L687 HydrophobicContact CD2-CG 4.49Å; L628-E688 HydrophobicContact CD1-CB 3.82Å; L628-E688 HydrophobicContact CD1-CG 3.64Å; L628-E688 HydrophobicContact CD2-CB 4.03Å
629	T	72.1	Confident	62.4	Low	130 Å²	130	116.7 Å²	116.7	80%	0.798	59%	0.585	S	S	*	*			trans	-94.9	114.1	179.8	-54.1	0	0	0	0	109.1	P627	P627-T629 PolarHBondContact O-N 3.3Å; P627-T629 PolarHBondContact O-OG1 2.92Å
630	Y	80.6	Confident	65.5	Low	64 Å²	64	108.7 Å²	108.7	25%	0.251	56%	0.557	S	S	.	*			trans	-124	156.9	176.4	53.7	-94.3	0	0	0	111	L628 I632 L687 C691 A705	L628-Y630 HydrophobicContact CD2-CD1 4.18Å; Y630-I632 HydrophobicContact CD2-CG1 4.33Å; Y630-I632 HydrophobicContact CE2-CG1 4.15Å; Y630-I632 PolarHBondContact O-N 3.49Å; Y630-I632 VanDerWaalsContact O-N 3.09Å; Y630-L687 HydrophobicContact CD1-CD2 3.99Å; Y630-L687 HydrophobicContact CE1-CD2 4.12Å; Y630-L687 HydrophobicContact CG-CD2 4.18Å; Y630-C691 VanDerWaalsContact CB-SG 3.54Å; Y630-A705 HydrophobicContact CD2-CB 3.8Å; Y630-A705 HydrophobicContact CE2-CB 3.89Å
631	P	85.1	Confident	68.7	Low	57 Å²	57	101.8 Å²	101.8	37%	0.37	53%	0.534	S	S	.	.			trans	-64.1	112.9	175.4	-15.3	28.9	0	0	0	109.7	G704 A705	P631-G704 CarbonylContact O-C 3.54Å; P631-G704 WeakPolarHBondContact O-CA 3.46Å; P631-A705 PolarHBondContact O-N 3.49Å
632	I	86.9	Confident	71.6	Confident	123 Å²	123	102 Å²	102	63%	0.631	53%	0.528	S	S	*	.	B	Isolated β-bridge	trans	-77.7	133.8	178.9	-58.3	174.6	0	0	0	108.7	Y630 A705	Y630-I632 HydrophobicContact CD2-CG1 4.33Å; Y630-I632 HydrophobicContact CE2-CG1 4.15Å; Y630-I632 PolarHBondContact O-N 3.49Å; Y630-I632 VanDerWaalsContact O-N 3.09Å; I632-A705 WeakPolarHBondContact CA-O 3.47Å
633	L	89.2	Confident	74.6	Confident	10 Å²	10	96.2 Å²	96.2	5%	0.052	51%	0.51	C	S	.	.			trans	-104.5	134.8	170.2	-69.1	170.7	0	0	0	109.5	I638 I657 K659 A705 C706 A715	L633-I638 HydrophobicContact CB-CD1 4.24Å; L633-I638 HydrophobicContact CD1-CD1 4.45Å; L633-I657 HydrophobicContact CD1-CD1 3.91Å; L633-I657 HydrophobicContact CD1-CG2 4.49Å; L633-I657 HydrophobicContact CD2-CG2 3.83Å; L633-K659 HydrophobicContact CD2-CD 4.36Å; L633-A705 PolarHBondContact N-O 2.86Å; L633-C706 HydrophobicContact CB-CB 4.16Å; L633-C706 WeakPolarHBondContact O-CB 3.49Å; L633-A715 HydrophobicContact CD1-CB 3.4Å
634	E	88.3	Confident	77.2	Confident	111 Å²	111	94.3 Å²	94.3	52%	0.519	49%	0.493	S	S	.	.			trans	-73.9	139.3	171.3	-61.5	-57.8	150.6	0	0	109.7	E636 D637	E634-E636 PolarHBondContact O-N 2.95Å; E634-D637 HydrophobicContact CB-CB 4.44Å; E634-D637 PolarHBondContact O-N 2.98Å; E634-D637 VanDerWaalsContact O-N 3.12Å
635	W	88.8	Confident	79.3	Confident	87 Å²	87	90 Å²	90	33%	0.33	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-61.9	-34.7	-176.8	177.7	-97.6	0	0	0	111.8	D637 I638 F640 N708 Y713	W635-D637 PolarHBondContact O-N 3.01Å; W635-I638 PolarHBondContact O-N 2.89Å; W635-F640 AromaticContact CH2-CE2 3.66Å; W635-F640 HydrophobicContact CH2-CE2 3.66Å; W635-F640 AromaticContact CH2-CZ 3.78Å; W635-F640 HydrophobicContact CH2-CZ 3.78Å; W635-F640 AromaticContact CZ2-CE2 3.94Å; W635-F640 HydrophobicContact CZ2-CE2 3.94Å; W635-F640 HydrophobicContact CZ3-CE2 4.12Å; W635-F640 AromaticContact CZ3-CZ 3.93Å; W635-F640 HydrophobicContact CZ3-CZ 3.93Å; W635-N708 HydrophobicContact CD2-CB 3.84Å; W635-N708 HydrophobicContact CE3-CB 3.32Å; W635-N708 VanDerWaalsContact CE3-ND2 3.34Å; W635-N708 HydrophobicContact CG-CB 4.46Å; W635-N708 HydrophobicContact CH2-CB 4.39Å; W635-N708 VanDerWaalsContact CH2-ND2 3.32Å; W635-N708 WeakPolarHBondContact CH2-ND2 3.35Å; W635-N708 WeakPolarHBondContact CZ2-ND2 3.37Å; W635-N708 HydrophobicContact CZ3-CB 3.65Å; W635-N708 WeakPolarHBondContact CZ3-ND2 3.49Å; W635-Y713 HydrophobicContact CE3-CE2 4.48Å; W635-Y713 HydrophobicContact CH2-CE1 4.17Å; W635-Y713 HydrophobicContact CH2-CE2 4.16Å; W635-Y713 AromaticContact CH2-CZ 3.79Å; W635-Y713 HydrophobicContact CZ3-CD1 4.32Å; W635-Y713 AromaticContact CZ3-CD2 3.87Å; W635-Y713 HydrophobicContact CZ3-CD2 3.87Å; W635-Y713 AromaticContact CZ3-CE1 4Å; W635-Y713 HydrophobicContact CZ3-CE1 4Å; W635-Y713 AromaticContact CZ3-CE2 3.53Å; W635-Y713 HydrophobicContact CZ3-CE2 3.53Å; W635-Y713 HydrophobicContact CZ3-CG 4.27Å; W635-Y713 AromaticContact CZ3-CZ 3.6Å
636	E	88.9	Confident	80.9	Confident	151 Å²	151	90.7 Å²	90.7	71%	0.706	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-68.2	-21.5	179.5	-62.3	72.1	-155.3	0	0	113.1	E634 I638	E634-E636 PolarHBondContact O-N 2.95Å; E636-I638 VanDerWaalsContact C-N 3.31Å
637	D	91	Very high	81.9	Confident	56 Å²	56	84.2 Å²	84.2	30%	0.299	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-86.8	-2.1	-179.1	-78.6	-32.3	0	0	0	113.1	E634 W635 I657 K658	E634-D637 HydrophobicContact CB-CB 4.44Å; E634-D637 PolarHBondContact O-N 2.98Å; E634-D637 VanDerWaalsContact O-N 3.12Å; W635-D637 PolarHBondContact O-N 3.01Å; D637-I657 WeakPolarHBondContact O-CA 3.42Å; D637-K658 HydrophobicContact CB-CB 4.19Å; D637-K658 WeakPolarHBondContact CB-O 3.26Å; D637-K658 PolarHBondContact O-N 2.77Å
638	I	92.3	Very high	82	Confident	14 Å²	14	84.3 Å²	84.3	7%	0.072	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.1	179.4	-54	174.7	0	0	0	109.9	L633 W635 E636 F640 A655 I657 I668 C706	L633-I638 HydrophobicContact CB-CD1 4.24Å; L633-I638 HydrophobicContact CD1-CD1 4.45Å; W635-I638 PolarHBondContact O-N 2.89Å; E636-I638 VanDerWaalsContact C-N 3.31Å; I638-F640 HydrophobicContact CG2-CD1 4.42Å; I638-F640 HydrophobicContact CG2-CD2 4.29Å; I638-F640 HydrophobicContact CG2-CE1 4.05Å; I638-F640 HydrophobicContact CG2-CE2 3.89Å; I638-F640 HydrophobicContact CG2-CZ 3.76Å; I638-A655 HydrophobicContact CG2-CB 3.98Å; I638-I657 HydrophobicContact CG1-CG1 4.5Å; I638-I668 HydrophobicContact CG2-CD1 4.24Å; I638-I668 HydrophobicContact CG2-CG1 4.28Å; I638-C706 HydrophobicContact CD1-CB 4.39Å; I638-C706 VanDerWaalsContact CD1-SG 3.51Å
639	K	92.5	Very high	81.8	Confident	153 Å²	153	85.4 Å²	85.4	67%	0.665	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	105.2	171.2	-173	-177.7	178.3	-173.4	0	110.3	A655 M656	K639-A655 CarbonylContact O-C 3.56Å; K639-A655 VanDerWaalsContact O-CA 3.23Å; K639-A655 WeakPolarHBondContact O-CA 3.42Å; K639-A655 WeakPolarHBondContact O-CB 3.42Å; K639-M656 HydrophobicContact CB-CB 4.36Å; K639-M656 PolarHBondContact N-O 2.85Å; K639-M656 PolarHBondContact O-N 3.49Å
640	F	91.2	Very high	81.8	Confident	68 Å²	68	80 Å²	80	30%	0.298	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	140.6	176.8	-61	-84.3	0	0	0	112.1	W635 I638 I653 I668 Y713	W635-F640 AromaticContact CH2-CE2 3.66Å; W635-F640 HydrophobicContact CH2-CE2 3.66Å; W635-F640 AromaticContact CH2-CZ 3.78Å; W635-F640 HydrophobicContact CH2-CZ 3.78Å; W635-F640 AromaticContact CZ2-CE2 3.94Å; W635-F640 HydrophobicContact CZ2-CE2 3.94Å; W635-F640 HydrophobicContact CZ3-CE2 4.12Å; W635-F640 AromaticContact CZ3-CZ 3.93Å; W635-F640 HydrophobicContact CZ3-CZ 3.93Å; I638-F640 HydrophobicContact CG2-CD1 4.42Å; I638-F640 HydrophobicContact CG2-CD2 4.29Å; I638-F640 HydrophobicContact CG2-CE1 4.05Å; I638-F640 HydrophobicContact CG2-CE2 3.89Å; I638-F640 HydrophobicContact CG2-CZ 3.76Å; F640-I653 HydrophobicContact CB-CG2 4.31Å; F640-I653 HydrophobicContact CD1-CB 4.24Å; F640-I653 HydrophobicContact CD1-CD1 4.04Å; F640-I653 HydrophobicContact CD1-CG2 4.06Å; F640-I653 HydrophobicContact CE1-CD1 4.4Å; F640-I668 HydrophobicContact CD1-CG1 4.49Å; F640-I668 HydrophobicContact CE1-CB 4.2Å; F640-I668 HydrophobicContact CE1-CG1 4.09Å; F640-I668 HydrophobicContact CE1-CG2 3.99Å; F640-Y713 HydrophobicContact CE1-CD1 4.43Å; F640-Y713 HydrophobicContact CZ-CD1 4.27Å; F640-Y713 HydrophobicContact CZ-CE1 4.26Å
641	E	93	Very high	81.8	Confident	70 Å²	70	79.3 Å²	79.3	33%	0.327	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-134.5	173.5	-57.4	-175.6	175.2	0	0	108.8	K654	E641-K654 WeakPolarHBondContact CA-O 3.27Å; E641-K654 HydrophobicContact CB-CB 4.31Å; E641-K654 WeakPolarHBondContact CB-O 3.43Å; E641-K654 PolarHBondContact N-O 3.12Å; E641-K654 VanDerWaalsContact OE2-CD 3.27Å; E641-K654 WeakPolarHBondContact OE2-CD 3.18Å; E641-K654 WeakPolarHBondContact OE2-CE 3.35Å; E641-K654 IonicContact OE2-NZ 3.55Å; E641-K654 PolarHBondContact OE2-NZ 3.3Å
642	D	88.1	Confident	81.9	Confident	120 Å²	120	78.5 Å²	78.5	64%	0.642	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	150.7	-176.5	-56	-51.8	0	0	0	112.8	I644 I653 K654	D642-I644 PolarHBondContact O-N 3.21Å; D642-I653 WeakPolarHBondContact O-CG2 3.45Å; D642-K654 PolarHBondContact O-N 3.31Å
643	V	87.3	Confident	82.1	Confident	81 Å²	81	73.4 Å²	73.4	49%	0.491	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	120.7	166.8	-178	0	0	0	0	108.2	I653	V643-I653 HydrophobicContact CG2-CG1 4.42Å
644	I	84.1	Confident	82.3	Confident	76 Å²	76	75.2 Å²	75.2	39%	0.39	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-12.4	-174.9	56.7	172.5	0	0	0	113.4	D642 V652 K654 A667 Y718	D642-I644 PolarHBondContact O-N 3.21Å; I644-V652 HydrophobicContact CD1-CG1 3.91Å; I644-V652 HydrophobicContact CG1-CB 4.19Å; I644-V652 HydrophobicContact CG1-CG1 3.86Å; I644-V652 WeakPolarHBondContact CG1-O 3.4Å; I644-V652 PolarHBondContact N-O 3.09Å; I644-K654 HydrophobicContact CD1-CB 4.16Å; I644-K654 HydrophobicContact CG1-CB 4.5Å; I644-K654 HydrophobicContact CG2-CB 3.73Å; I644-A667 HydrophobicContact CD1-CB 4.05Å; I644-Y718 HydrophobicContact CD1-CD2 3.98Å; I644-Y718 HydrophobicContact CD1-CE2 3.68Å
645	G	73.6	Confident	82.6	Confident	29 Å²	29	69.9 Å²	69.9	30%	0.299	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	138.3	174.4	0	0	0	0	0	110.8	Q651 V652	G645-Q651 WeakPolarHBondContact O-CA 3.37Å; G645-V652 PolarHBondContact N-O 3.37Å; G645-V652 PolarHBondContact O-N 2.83Å
646	E	69.6	Low	82.8	Confident	140 Å²	140	68.3 Å²	68.3	65%	0.654	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	120.5	178.1	-161.6	-174.8	160.9	0	0	109.2	Q651 K672	E646-Q651 HydrophobicContact CG-CB 4.41Å; E646-K672 VanDerWaalsContact OE1-CE 3.23Å; E646-K672 WeakPolarHBondContact OE1-CE 3.2Å; E646-K672 IonicContact OE1-NZ 3.38Å; E646-K672 PolarHBondContact OE1-NZ 3.24Å
647	G	61.9	Low	83	Confident	40 Å²	40	61.2 Å²	61.2	41%	0.412	32%	0.324	S	S	.	.			trans	-111.3	-175.9	179	0	0	0	0	0	112.4	F649 G650 K672	G647-F649 VanDerWaalsContact C-N 3.27Å; G647-F649 PolarHBondContact O-N 2.79Å; G647-G650 PolarHBondContact N-O 3.29Å; G647-K672 WeakPolarHBondContact O-CE 3.25Å; G647-K672 PolarHBondContact O-NZ 2.87Å
648	N	55.3	Low	83	Confident	118 Å²	118	63.6 Å²	63.6	63%	0.631	33%	0.332	S	S	*	.	S	Bend	trans	-66.3	-28.1	175.7	-86.8	-45.5	0	0	0	113.3	R813	N648-R813 PolarHBondContact ND2-NH1 3.17Å
649	F	57.3	Low	82.4	Confident	96 Å²	96	66 Å²	66	42%	0.421	34%	0.341	S	S	.	.	S	Bend	trans	-115.3	-21.7	-168.3	-51	-69.2	0	0	0	113.6	G647 L671 K672 D679	G647-F649 VanDerWaalsContact C-N 3.27Å; G647-F649 PolarHBondContact O-N 2.79Å; F649-L671 VanDerWaalsContact O-CD2 3.24Å; F649-L671 WeakPolarHBondContact O-CD2 3.34Å; F649-K672 PolarHBondContact O-N 2.98Å; F649-K672 VanDerWaalsContact O-N 3.1Å; F649-D679 HydrophobicContact CB-CB 4.37Å; F649-D679 HydrophobicContact CD1-CB 4.41Å; F649-D679 WeakPolarHBondContact CD1-OD1 3.45Å; F649-D679 VanDerWaalsContact CD1-OD2 3.28Å; F649-D679 WeakPolarHBondContact CD1-OD2 3.24Å; F649-D679 WeakPolarHBondContact CE1-OD1 3.21Å
650	G	71.8	Confident	81.8	Confident	16 Å²	16	65.8 Å²	65.8	17%	0.165	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	175.1	-175.2	0	0	0	0	0	112.3	G647 M670	G647-G650 PolarHBondContact N-O 3.29Å; G650-M670 CarbonylContact C-O 3.56Å; G650-M670 WeakPolarHBondContact CA-O 2.85Å
651	Q	82.1	Confident	81.1	Confident	50 Å²	50	65.4 Å²	65.4	23%	0.234	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	150.4	173.3	65.6	-174.4	24.2	0	0	109.4	G645 E646 I653 M670	G645-Q651 WeakPolarHBondContact O-CA 3.37Å; E646-Q651 HydrophobicContact CG-CB 4.41Å; Q651-I653 HydrophobicContact CG-CG1 4.32Å; Q651-M670 HydrophobicContact CG-CG 3.53Å; Q651-M670 HydrophobicContact CG-SD 3.96Å; Q651-M670 PolarHBondContact N-O 3.45Å; Q651-M670 PolarHBondContact NE2-SD 3.09Å; Q651-M670 PolarHBondContact O-N 3.27Å
652	V	87.8	Confident	80.7	Confident	39 Å²	39	67.9 Å²	67.9	24%	0.236	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.6	176	-171.4	0	0	0	0	107.5	I644 G645 A667 I668 K669	I644-V652 HydrophobicContact CD1-CG1 3.91Å; I644-V652 HydrophobicContact CG1-CB 4.19Å; I644-V652 HydrophobicContact CG1-CG1 3.86Å; I644-V652 WeakPolarHBondContact CG1-O 3.4Å; I644-V652 PolarHBondContact N-O 3.09Å; G645-V652 PolarHBondContact N-O 3.37Å; G645-V652 PolarHBondContact O-N 2.83Å; V652-A667 HydrophobicContact CG1-CB 3.8Å; V652-I668 CarbonylContact C-O 3.44Å; V652-I668 VanDerWaalsContact CA-O 3.29Å; V652-I668 WeakPolarHBondContact CA-O 3.16Å; V652-K669 HydrophobicContact CG2-CG 4.17Å
653	I	90.3	Very high	80.8	Confident	17 Å²	17	70.2 Å²	70.2	9%	0.087	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.1	-178.6	-45.1	179.4	0	0	0	107.9	F640 D642 V643 Q651 I668 M670	F640-I653 HydrophobicContact CB-CG2 4.31Å; F640-I653 HydrophobicContact CD1-CB 4.24Å; F640-I653 HydrophobicContact CD1-CD1 4.04Å; F640-I653 HydrophobicContact CD1-CG2 4.06Å; F640-I653 HydrophobicContact CE1-CD1 4.4Å; D642-I653 WeakPolarHBondContact O-CG2 3.45Å; V643-I653 HydrophobicContact CG2-CG1 4.42Å; Q651-I653 HydrophobicContact CG-CG1 4.32Å; I653-I668 PolarHBondContact N-O 3.16Å; I653-I668 PolarHBondContact O-N 2.93Å; I653-M670 HydrophobicContact CD1-SD 3.82Å
654	K	93.2	Very high	81	Confident	47 Å²	47	70.4 Å²	70.4	20%	0.204	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	138.7	168.7	-173	179.2	173.2	-140.1	0	109	E641 D642 I644 Y718	E641-K654 WeakPolarHBondContact CA-O 3.27Å; E641-K654 HydrophobicContact CB-CB 4.31Å; E641-K654 WeakPolarHBondContact CB-O 3.43Å; E641-K654 PolarHBondContact N-O 3.12Å; E641-K654 VanDerWaalsContact OE2-CD 3.27Å; E641-K654 WeakPolarHBondContact OE2-CD 3.18Å; E641-K654 WeakPolarHBondContact OE2-CE 3.35Å; E641-K654 IonicContact OE2-NZ 3.55Å; E641-K654 PolarHBondContact OE2-NZ 3.3Å; D642-K654 PolarHBondContact O-N 3.31Å; I644-K654 HydrophobicContact CD1-CB 4.16Å; I644-K654 HydrophobicContact CG1-CB 4.5Å; I644-K654 HydrophobicContact CG2-CB 3.73Å; K654-Y718 HydrophobicContact CB-CE2 4.48Å; K654-Y718 HydrophobicContact CD-CE2 3.93Å; K654-Y718 HydrophobicContact CG-CD2 4.2Å; K654-Y718 HydrophobicContact CG-CE2 3.99Å
655	A	94	Very high	81.4	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156.3	176.4	0	0	0	0	0	111.4	I638 K639 A666 I668	I638-A655 HydrophobicContact CG2-CB 3.98Å; K639-A655 CarbonylContact O-C 3.56Å; K639-A655 VanDerWaalsContact O-CA 3.23Å; K639-A655 WeakPolarHBondContact O-CA 3.42Å; K639-A655 WeakPolarHBondContact O-CB 3.42Å; A655-A666 PolarHBondContact N-O 3.35Å; A655-A666 PolarHBondContact O-N 3.22Å; A655-I668 HydrophobicContact CB-CD1 4.19Å; A655-I668 HydrophobicContact CB-CG1 3.52Å
656	M	94	Very high	82.4	Confident	54 Å²	54	67.8 Å²	67.8	27%	0.266	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	119.4	165.5	-163.6	66.7	55.4	0	0	108.3	K639 K663	K639-M656 HydrophobicContact CB-CB 4.36Å; K639-M656 PolarHBondContact N-O 2.85Å; K639-M656 PolarHBondContact O-N 3.49Å; M656-K663 HydrophobicContact CG-CB 4.43Å; M656-K663 HydrophobicContact SD-CB 4.33Å
657	I	93.3	Very high	83.6	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.6	179.6	-60.4	179.9	0	0	0	109.2	L633 D637 I638 K659 K663 M664 A666 I668 I703 A715	L633-I657 HydrophobicContact CD1-CD1 3.91Å; L633-I657 HydrophobicContact CD1-CG2 4.49Å; L633-I657 HydrophobicContact CD2-CG2 3.83Å; D637-I657 WeakPolarHBondContact O-CA 3.42Å; I638-I657 HydrophobicContact CG1-CG1 4.5Å; I657-K659 HydrophobicContact CG2-CB 4.3Å; I657-K663 WeakPolarHBondContact O-CA 3.3Å; I657-M664 PolarHBondContact N-O 3.44Å; I657-M664 PolarHBondContact O-N 3.45Å; I657-A666 HydrophobicContact CD1-CB 3.25Å; I657-A666 HydrophobicContact CG1-CB 3.75Å; I657-I668 HydrophobicContact CD1-CD1 3.86Å; I657-I703 HydrophobicContact CD1-CG2 4.27Å; I657-A715 HydrophobicContact CD1-CB 3.45Å; I657-A715 VanDerWaalsContact CD1-CB 3.45Å
658	K	89.7	Confident	85	Confident	107 Å²	107	59.6 Å²	59.6	47%	0.465	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	109.5	168.5	-172.9	-176.3	174.1	-161.2	0	108.9	D637 N662	D637-K658 HydrophobicContact CB-CB 4.19Å; D637-K658 WeakPolarHBondContact CB-O 3.26Å; D637-K658 PolarHBondContact O-N 2.77Å; K658-N662 WeakPolarHBondContact CA-O 3.44Å
659	K	81.1	Confident	86.7	Confident	63 Å²	63	56 Å²	56	27%	0.274	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.2	179.2	-171.2	179.4	178.3	-178.2	0	109.3	L633 I657 G661 N662 I703	L633-K659 HydrophobicContact CD2-CD 4.36Å; I657-K659 HydrophobicContact CG2-CB 4.3Å; K659-G661 PolarHBondContact O-N 2.79Å; K659-G661 VanDerWaalsContact O-N 3.09Å; K659-N662 PolarHBondContact N-O 2.76Å; K659-N662 PolarHBondContact O-N 3.34Å; K659-I703 HydrophobicContact CD-CG2 4.11Å; K659-I703 PolarHBondContact NZ-O 3.41Å
660	D	79	Confident	88.1	Confident	149 Å²	149	52.6 Å²	52.6	80%	0.797	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	33.2	179.9	-53.5	-43	0	0	0	113.7	N662	D660-N662 VanDerWaalsContact C-N 3.28Å; D660-N662 PolarHBondContact O-N 3.29Å
661	G	77.6	Confident	88.5	Confident	61 Å²	61	52.5 Å²	52.5	63%	0.629	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	-10.3	-178	0	0	0	0	0	115.6	K659	K659-G661 PolarHBondContact O-N 2.79Å; K659-G661 VanDerWaalsContact O-N 3.09Å
662	N	84.8	Confident	88.4	Confident	121 Å²	121	52.7 Å²	52.7	65%	0.647	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	141.9	177.5	-68.9	-36.1	0	0	0	111.4	K658 K659 D660	K658-N662 WeakPolarHBondContact CA-O 3.44Å; K659-N662 PolarHBondContact N-O 2.76Å; K659-N662 PolarHBondContact O-N 3.34Å; D660-N662 VanDerWaalsContact C-N 3.28Å; D660-N662 PolarHBondContact O-N 3.29Å
663	K	89.4	Confident	87.7	Confident	170 Å²	170	57.9 Å²	57.9	74%	0.739	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	130.5	171.7	-68.9	-177.7	179.9	177.9	0	109.4	M656 I657	M656-K663 HydrophobicContact CG-CB 4.43Å; M656-K663 HydrophobicContact SD-CB 4.33Å; I657-K663 WeakPolarHBondContact O-CA 3.3Å
664	M	92	Very high	86.8	Confident	84 Å²	84	66 Å²	66	41%	0.414	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	149.1	177.5	70.5	-164.4	-37.8	0	0	111.6	I657 I703	I657-M664 PolarHBondContact N-O 3.44Å; I657-M664 PolarHBondContact O-N 3.45Å; M664-I703 HydrophobicContact SD-CD1 4.31Å; M664-I703 HydrophobicContact SD-CG2 4.16Å
665	S	92.8	Very high	85.7	Confident	50 Å²	50	64.7 Å²	64.7	35%	0.35	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.6	172.6	-63.1	0	0	0	0	110.5
666	A	94.4	Very high	84.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.2	179.4	0	0	0	0	0	110.6	A655 I657 I703 I716	A655-A666 PolarHBondContact N-O 3.35Å; A655-A666 PolarHBondContact O-N 3.22Å; I657-A666 HydrophobicContact CD1-CB 3.25Å; I657-A666 HydrophobicContact CG1-CB 3.75Å; A666-I703 HydrophobicContact CB-CD1 3.62Å; A666-I716 WeakPolarHBondContact CA-O 3.41Å
667	A	93.6	Very high	83.5	Confident	8 Å²	8	72.5 Å²	72.5	7%	0.066	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.2	164.8	0	0	0	0	0	108.4	I644 V652 I716 Y718	I644-A667 HydrophobicContact CD1-CB 4.05Å; V652-A667 HydrophobicContact CG1-CB 3.8Å; A667-I716 HydrophobicContact CB-CG1 3.96Å; A667-I716 PolarHBondContact N-O 3.32Å; A667-I716 WeakPolarHBondContact O-CG1 3.08Å; A667-I716 PolarHBondContact O-N 2.93Å; A667-Y718 HydrophobicContact CB-CD2 4.4Å
668	I	92.1	Very high	82.3	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.2	175.8	-53.7	-61	0	0	0	108.5	I638 F640 V652 I653 A655 I657 Y713 I714 A715	I638-I668 HydrophobicContact CG2-CD1 4.24Å; I638-I668 HydrophobicContact CG2-CG1 4.28Å; F640-I668 HydrophobicContact CD1-CG1 4.49Å; F640-I668 HydrophobicContact CE1-CB 4.2Å; F640-I668 HydrophobicContact CE1-CG1 4.09Å; F640-I668 HydrophobicContact CE1-CG2 3.99Å; V652-I668 CarbonylContact C-O 3.44Å; V652-I668 VanDerWaalsContact CA-O 3.29Å; V652-I668 WeakPolarHBondContact CA-O 3.16Å; I653-I668 PolarHBondContact N-O 3.16Å; I653-I668 PolarHBondContact O-N 2.93Å; A655-I668 HydrophobicContact CB-CD1 4.19Å; A655-I668 HydrophobicContact CB-CG1 3.52Å; I657-I668 HydrophobicContact CD1-CD1 3.86Å; I668-Y713 HydrophobicContact CG2-CD1 3.8Å; I668-Y713 HydrophobicContact CG2-CG 4.35Å; I668-I714 WeakPolarHBondContact CA-O 3.34Å; I668-A715 HydrophobicContact CD1-CB 3.48Å; I668-A715 VanDerWaalsContact CD1-CB 3.48Å
669	K	89.9	Confident	81.4	Confident	41 Å²	41	72.4 Å²	72.4	18%	0.178	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	134.8	170.6	-158.3	174.7	-172.2	-173.6	0	108.3	V652 F683 E686 I714 D796	V652-K669 HydrophobicContact CG2-CG 4.17Å; K669-F683 HydrophobicContact CB-CE2 3.93Å; K669-F683 HydrophobicContact CB-CZ 4.34Å; K669-F683 HydrophobicContact CD-CD2 4.42Å; K669-F683 HydrophobicContact CD-CE2 3.87Å; K669-F683 HydrophobicContact CG-CE2 3.64Å; K669-F683 HydrophobicContact CG-CZ 4.44Å; K669-F683 WeakPolarHBondContact O-CZ 3.2Å; K669-E686 WeakPolarHBondContact CE-OE2 3.23Å; K669-E686 IonicContact NZ-OE1 3.47Å; K669-E686 PolarHBondContact NZ-OE1 3.36Å; K669-E686 IonicContact NZ-OE2 3.43Å; K669-E686 PolarHBondContact NZ-OE2 2.82Å; K669-I714 PolarHBondContact N-O 3.27Å; K669-I714 PolarHBondContact O-N 2.97Å; K669-D796 IonicContact NZ-OD1 3.96Å; K669-D796 PolarHBondContact NZ-OD1 2.76Å
670	M	86.8	Confident	81	Confident	25 Å²	25	73.8 Å²	73.8	12%	0.123	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	154.5	174.7	64.2	177.2	-65.5	0	0	110.8	G650 Q651 I653 Y713	G650-M670 CarbonylContact C-O 3.56Å; G650-M670 WeakPolarHBondContact CA-O 2.85Å; Q651-M670 HydrophobicContact CG-CG 3.53Å; Q651-M670 HydrophobicContact CG-SD 3.96Å; Q651-M670 PolarHBondContact N-O 3.45Å; Q651-M670 PolarHBondContact NE2-SD 3.09Å; Q651-M670 PolarHBondContact O-N 3.27Å; I653-M670 HydrophobicContact CD1-SD 3.82Å; M670-Y713 HydrophobicContact CB-CD1 3.88Å; M670-Y713 HydrophobicContact CB-CE1 4.08Å; M670-Y713 HydrophobicContact CE-CE1 3.65Å; M670-Y713 HydrophobicContact CG-CE1 4.44Å; M670-Y713 HydrophobicContact SD-CD1 4.12Å; M670-Y713 HydrophobicContact SD-CE1 3.57Å; M670-Y713 VanDerWaalsContact SD-CE1 3.57Å
671	L	81.2	Confident	80.8	Confident	15 Å²	15	74.6 Å²	74.6	8%	0.079	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	153.4	175.6	-68.5	175.4	0	0	0	111.8	F649 A675 D679 H680 F683	F649-L671 VanDerWaalsContact O-CD2 3.24Å; F649-L671 WeakPolarHBondContact O-CD2 3.34Å; L671-A675 HydrophobicContact CB-CB 3.97Å; L671-A675 HydrophobicContact CD1-CB 4.22Å; L671-A675 HydrophobicContact CD2-CB 4.28Å; L671-A675 HydrophobicContact CG-CB 4.39Å; L671-D679 HydrophobicContact CD2-CB 4.37Å; L671-H680 HydrophobicContact CD1-CB 4.31Å; L671-H680 WeakPolarHBondContact CD1-ND1 3.38Å; L671-F683 HydrophobicContact CD1-CB 3.87Å; L671-F683 HydrophobicContact CD1-CD1 3.73Å; L671-F683 HydrophobicContact CD1-CG 3.99Å; L671-F683 HydrophobicContact CD2-CB 4.1Å; L671-F683 HydrophobicContact CD2-CD1 4.43Å; L671-F683 HydrophobicContact CD2-CD2 4.44Å; L671-F683 HydrophobicContact CD2-CG 4.08Å; L671-F683 HydrophobicContact CG-CB 4.12Å; L671-F683 HydrophobicContact CG-CD1 3.68Å; L671-F683 HydrophobicContact CG-CD2 4.47Å; L671-F683 HydrophobicContact CG-CE1 4.2Å; L671-F683 HydrophobicContact CG-CG 3.84Å
672	K	78.6	Confident	80.6	Confident	54 Å²	54	73.8 Å²	73.8	24%	0.235	36%	0.357	C	S	.	.			trans	-78.2	157.9	171.2	-68.7	178.5	172.3	178.6	0	110.5	E646 G647 F649 F674 A675	E646-K672 VanDerWaalsContact OE1-CE 3.23Å; E646-K672 WeakPolarHBondContact OE1-CE 3.2Å; E646-K672 IonicContact OE1-NZ 3.38Å; E646-K672 PolarHBondContact OE1-NZ 3.24Å; G647-K672 WeakPolarHBondContact O-CE 3.25Å; G647-K672 PolarHBondContact O-NZ 2.87Å; F649-K672 PolarHBondContact O-N 2.98Å; F649-K672 VanDerWaalsContact O-N 3.1Å; K672-F674 PolarHBondContact O-N 3.32Å; K672-A675 WeakPolarHBondContact O-CB 3.2Å; K672-A675 PolarHBondContact O-N 3.45Å; K672-A675 VanDerWaalsContact O-N 3.07Å
673	E	73.7	Confident	80.4	Confident	147 Å²	147	68.6 Å²	68.6	69%	0.687	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.8	-178.4	-65.7	-173.5	162	0	0	114.4
674	F	72.5	Confident	80	Confident	188 Å²	188	62.7 Å²	62.7	83%	0.825	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	17.8	-177.7	-41.4	-73.5	0	0	0	113.7	K672	K672-F674 PolarHBondContact O-N 3.32Å
675	A	69.6	Low	79.3	Confident	19 Å²	19	59.2 Å²	59.2	16%	0.157	30%	0.298	C	S	.	.			trans	-63.2	142.8	178.6	0	0	0	0	0	111.5	L671 K672 D679	L671-A675 HydrophobicContact CB-CB 3.97Å; L671-A675 HydrophobicContact CD1-CB 4.22Å; L671-A675 HydrophobicContact CD2-CB 4.28Å; L671-A675 HydrophobicContact CG-CB 4.39Å; K672-A675 WeakPolarHBondContact O-CB 3.2Å; K672-A675 PolarHBondContact O-N 3.45Å; K672-A675 VanDerWaalsContact O-N 3.07Å; A675-D679 HydrophobicContact CB-CB 4.17Å
676	S	70.5	Confident	78.9	Confident	52 Å²	52	57.1 Å²	57.1	36%	0.364	28%	0.282	S	S	.	.			trans	-78.8	161	178.8	73.8	0	0	0	0	111.7	N678 D679 H680	S676-N678 PolarHBondContact O-N 3.12Å; S676-N678 VanDerWaalsContact O-N 3.13Å; S676-D679 VanDerWaalsContact CB-OD2 3.29Å; S676-D679 WeakPolarHBondContact CB-OD2 3.46Å; S676-D679 PolarHBondContact N-OD2 3.11Å; S676-D679 WeakPolarHBondContact O-CA 3.38Å; S676-D679 WeakPolarHBondContact O-CB 3.46Å; S676-D679 PolarHBondContact O-N 3.39Å; S676-D679 PolarHBondContact OG-N 3.1Å; S676-D679 PolarHBondContact OG-OD2 2.93Å; S676-H680 PolarHBondContact O-CD2 3.13Å; S676-H680 VanDerWaalsContact O-CD2 3.31Å; S676-H680 PolarHBondContact O-N 2.85Å
677	E	70.8	Confident	78.5	Confident	167 Å²	167	57.4 Å²	57.4	78%	0.78	28%	0.284	S	S	*	.	H	α-helix	trans	-57.5	-28.6	174.4	-69.5	-167.4	157.4	0	0	113.2	R681	E677-R681 WeakPolarHBondContact O-CG 3.45Å; E677-R681 PolarHBondContact O-N 3.14Å; E677-R681 VanDerWaalsContact O-N 3.14Å
678	N	67.8	Low	78.1	Confident	78 Å²	78	60.6 Å²	60.6	42%	0.417	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-41.8	173.1	-73.8	-15.7	0	0	0	111.5	S676 H680 R681 D682	S676-N678 PolarHBondContact O-N 3.12Å; S676-N678 VanDerWaalsContact O-N 3.13Å; N678-H680 VanDerWaalsContact C-N 3.32Å; N678-H680 PolarHBondContact O-N 2.91Å; N678-R681 PolarHBondContact O-N 3.19Å; N678-R681 VanDerWaalsContact O-N 3.15Å; N678-R681 PolarHBondContact OD1-NH2 3.48Å; N678-D682 PolarHBondContact O-N 3.5Å
679	D	70.8	Confident	77.8	Confident	27 Å²	27	60.9 Å²	60.9	14%	0.144	30%	0.299	C	S	.	.	H	α-helix	trans	-65.4	-38.7	179	-53.9	-42.4	0	0	0	110.7	F649 L671 A675 S676 R681 D682 F683	F649-D679 HydrophobicContact CB-CB 4.37Å; F649-D679 HydrophobicContact CD1-CB 4.41Å; F649-D679 WeakPolarHBondContact CD1-OD1 3.45Å; F649-D679 VanDerWaalsContact CD1-OD2 3.28Å; F649-D679 WeakPolarHBondContact CD1-OD2 3.24Å; F649-D679 WeakPolarHBondContact CE1-OD1 3.21Å; L671-D679 HydrophobicContact CD2-CB 4.37Å; A675-D679 HydrophobicContact CB-CB 4.17Å; S676-D679 VanDerWaalsContact CB-OD2 3.29Å; S676-D679 WeakPolarHBondContact CB-OD2 3.46Å; S676-D679 PolarHBondContact N-OD2 3.11Å; S676-D679 WeakPolarHBondContact O-CA 3.38Å; S676-D679 WeakPolarHBondContact O-CB 3.46Å; S676-D679 PolarHBondContact O-N 3.39Å; S676-D679 PolarHBondContact OG-N 3.1Å; S676-D679 PolarHBondContact OG-OD2 2.93Å; D679-R681 VanDerWaalsContact C-N 3.35Å; D679-R681 PolarHBondContact O-N 2.91Å; D679-D682 PolarHBondContact O-N 3.21Å; D679-F683 WeakPolarHBondContact O-CB 3.27Å; D679-F683 PolarHBondContact O-N 3.14Å
680	H	72.9	Confident	77.7	Confident	92 Å²	92	59.2 Å²	59.2	43%	0.426	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-41.5	171.8	-79.9	-85.2	0	0	0	112.7	L671 S676 N678 A684	L671-H680 HydrophobicContact CD1-CB 4.31Å; L671-H680 WeakPolarHBondContact CD1-ND1 3.38Å; S676-H680 PolarHBondContact O-CD2 3.13Å; S676-H680 VanDerWaalsContact O-CD2 3.31Å; S676-H680 PolarHBondContact O-N 2.85Å; N678-H680 VanDerWaalsContact C-N 3.32Å; N678-H680 PolarHBondContact O-N 2.91Å; H680-A684 WeakPolarHBondContact O-CB 3.39Å; H680-A684 PolarHBondContact O-N 2.74Å
681	R	74.9	Confident	77.8	Confident	167 Å²	167	59.8 Å²	59.8	63%	0.63	30%	0.298	S	S	*	.	H	α-helix	trans	-68.7	-43.8	177.3	-74.2	-169.5	-65.5	-177.4	-2.5	112.8	E677 N678 D679 F683 A684 G685	E677-R681 WeakPolarHBondContact O-CG 3.45Å; E677-R681 PolarHBondContact O-N 3.14Å; E677-R681 VanDerWaalsContact O-N 3.14Å; N678-R681 PolarHBondContact O-N 3.19Å; N678-R681 VanDerWaalsContact O-N 3.15Å; N678-R681 PolarHBondContact OD1-NH2 3.48Å; D679-R681 VanDerWaalsContact C-N 3.35Å; D679-R681 PolarHBondContact O-N 2.91Å; R681-F683 VanDerWaalsContact C-N 3.33Å; R681-A684 PolarHBondContact O-N 3.04Å; R681-G685 PolarHBondContact O-N 2.95Å
682	D	74.1	Confident	78	Confident	44 Å²	44	64.8 Å²	64.8	24%	0.235	32%	0.319	C	S	.	.	H	α-helix	trans	-66.5	-38	178.7	-74.5	-19.5	0	0	0	111	N678 D679 G685 E686 G798 R801	N678-D682 PolarHBondContact O-N 3.5Å; D679-D682 PolarHBondContact O-N 3.21Å; D682-G685 PolarHBondContact O-N 2.99Å; D682-E686 PolarHBondContact O-N 2.92Å; D682-G798 WeakPolarHBondContact CB-O 3.27Å; D682-R801 IonicContact OD1-CZ 3.53Å; D682-R801 IonicContact OD1-NH2 3.11Å; D682-R801 PolarHBondContact OD1-NH2 2.98Å
683	F	80.5	Confident	78.4	Confident	11 Å²	11	62.3 Å²	62.3	5%	0.048	31%	0.309	C	S	.	.	H	α-helix	trans	-68.2	-41.2	175.9	-172.1	-119	0	0	0	113.2	K669 L671 D679 R681 G685 E686 L687 L712 I714	K669-F683 HydrophobicContact CB-CE2 3.93Å; K669-F683 HydrophobicContact CB-CZ 4.34Å; K669-F683 HydrophobicContact CD-CD2 4.42Å; K669-F683 HydrophobicContact CD-CE2 3.87Å; K669-F683 HydrophobicContact CG-CE2 3.64Å; K669-F683 HydrophobicContact CG-CZ 4.44Å; K669-F683 WeakPolarHBondContact O-CZ 3.2Å; L671-F683 HydrophobicContact CD1-CB 3.87Å; L671-F683 HydrophobicContact CD1-CD1 3.73Å; L671-F683 HydrophobicContact CD1-CG 3.99Å; L671-F683 HydrophobicContact CD2-CB 4.1Å; L671-F683 HydrophobicContact CD2-CD1 4.43Å; L671-F683 HydrophobicContact CD2-CD2 4.44Å; L671-F683 HydrophobicContact CD2-CG 4.08Å; L671-F683 HydrophobicContact CG-CB 4.12Å; L671-F683 HydrophobicContact CG-CD1 3.68Å; L671-F683 HydrophobicContact CG-CD2 4.47Å; L671-F683 HydrophobicContact CG-CE1 4.2Å; L671-F683 HydrophobicContact CG-CG 3.84Å; D679-F683 WeakPolarHBondContact O-CB 3.27Å; D679-F683 PolarHBondContact O-N 3.14Å; R681-F683 VanDerWaalsContact C-N 3.33Å; F683-G685 VanDerWaalsContact C-N 3.34Å; F683-E686 WeakPolarHBondContact O-CB 3.43Å; F683-E686 PolarHBondContact O-N 2.61Å; F683-L687 PolarHBondContact O-N 3.25Å; F683-L712 HydrophobicContact CD1-CD2 4.06Å; F683-L712 HydrophobicContact CE1-CB 4.06Å; F683-L712 HydrophobicContact CE1-CD2 3.98Å; F683-L712 HydrophobicContact CE1-CG 3.97Å; F683-L712 WeakPolarHBondContact CE1-O 3.41Å; F683-I714 HydrophobicContact CD1-CD1 4.4Å; F683-I714 HydrophobicContact CD2-CD1 4Å; F683-I714 HydrophobicContact CE1-CD1 4.01Å; F683-I714 HydrophobicContact CE1-CG1 4.12Å; F683-I714 HydrophobicContact CE2-CB 4.48Å; F683-I714 HydrophobicContact CE2-CD1 3.54Å; F683-I714 HydrophobicContact CE2-CG1 4.08Å; F683-I714 HydrophobicContact CG-CD1 4.39Å; F683-I714 HydrophobicContact CZ-CB 4.19Å; F683-I714 HydrophobicContact CZ-CD1 3.55Å; F683-I714 HydrophobicContact CZ-CG1 3.63Å; F683-I714 WeakPolarHBondContact O-CD1 3.3Å
684	A	79.8	Confident	79	Confident	47 Å²	47	57.1 Å²	57.1	39%	0.388	30%	0.295	S	S	.	.	H	α-helix	trans	-66.4	-37.1	171.9	0	0	0	0	0	112	H680 R681 E686 L687 E688	H680-A684 WeakPolarHBondContact O-CB 3.39Å; H680-A684 PolarHBondContact O-N 2.74Å; R681-A684 PolarHBondContact O-N 3.04Å; A684-E686 VanDerWaalsContact C-N 3.32Å; A684-E686 PolarHBondContact O-N 3.09Å; A684-L687 WeakPolarHBondContact O-CB 3.41Å; A684-L687 PolarHBondContact O-N 2.88Å; A684-E688 PolarHBondContact O-N 2.69Å
685	G	78.4	Confident	79.8	Confident	11 Å²	11	56.2 Å²	56.2	11%	0.113	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-36.9	174.5	0	0	0	0	0	112.9	R681 D682 F683 E688 V689	R681-G685 PolarHBondContact O-N 2.95Å; D682-G685 PolarHBondContact O-N 2.99Å; F683-G685 VanDerWaalsContact C-N 3.34Å; G685-E688 PolarHBondContact O-N 3.21Å; G685-V689 VanDerWaalsContact O-CG2 3.29Å; G685-V689 WeakPolarHBondContact O-CG2 3.44Å; G685-V689 PolarHBondContact O-N 2.85Å
686	E	84.1	Confident	81.1	Confident	6 Å²	6	56.7 Å²	56.7	3%	0.028	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-43.6	174.4	-179.6	173.4	-165.8	0	0	112	K669 D682 F683 A684 E688 V689 L690 F797	K669-E686 WeakPolarHBondContact CE-OE2 3.23Å; K669-E686 IonicContact NZ-OE1 3.47Å; K669-E686 PolarHBondContact NZ-OE1 3.36Å; K669-E686 IonicContact NZ-OE2 3.43Å; K669-E686 PolarHBondContact NZ-OE2 2.82Å; D682-E686 PolarHBondContact O-N 2.92Å; F683-E686 WeakPolarHBondContact O-CB 3.43Å; F683-E686 PolarHBondContact O-N 2.61Å; A684-E686 VanDerWaalsContact C-N 3.32Å; A684-E686 PolarHBondContact O-N 3.09Å; E686-E688 VanDerWaalsContact C-N 3.35Å; E686-E688 PolarHBondContact O-N 2.89Å; E686-V689 PolarHBondContact O-N 2.05Å; E686-L690 HydrophobicContact CG-CD1 4.15Å; E686-L690 WeakPolarHBondContact O-CG 3.39Å; E686-L690 PolarHBondContact O-N 3.11Å; E686-F797 HydrophobicContact CG-CB 4.22Å
687	L	85.5	Confident	82.2	Confident	6 Å²	6	58.1 Å²	58.1	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-45.8	174.2	179.9	59.2	0	0	0	111.5	L628 Y630 F683 A684 L690 C691 L702 A705 L712 I714	L628-L687 HydrophobicContact CD2-CG 4.49Å; Y630-L687 HydrophobicContact CD1-CD2 3.99Å; Y630-L687 HydrophobicContact CE1-CD2 4.12Å; Y630-L687 HydrophobicContact CG-CD2 4.18Å; F683-L687 PolarHBondContact O-N 3.25Å; A684-L687 WeakPolarHBondContact O-CB 3.41Å; A684-L687 PolarHBondContact O-N 2.88Å; L687-L690 PolarHBondContact O-N 3.29Å; L687-C691 PolarHBondContact O-N 2.9Å; L687-C691 PolarHBondContact O-SG 2.85Å; L687-L702 HydrophobicContact CD1-CD1 3.79Å; L687-L702 HydrophobicContact CD1-CD2 3.73Å; L687-L702 HydrophobicContact CD1-CG 4.44Å; L687-A705 HydrophobicContact CD1-CB 3.87Å; L687-A705 HydrophobicContact CD2-CB 3.94Å; L687-L712 HydrophobicContact CD2-CD1 4.31Å; L687-L712 HydrophobicContact CD2-CD2 4.32Å; L687-I714 HydrophobicContact CB-CD1 3.78Å; L687-I714 HydrophobicContact CB-CG1 4.38Å; L687-I714 HydrophobicContact CD1-CG1 4.49Å; L687-I714 HydrophobicContact CD1-CG2 4.38Å
688	E	85.5	Confident	83.5	Confident	75 Å²	75	50.7 Å²	50.7	35%	0.35	27%	0.266	S	S	.	.	H	α-helix	trans	-61.2	-44.2	178.4	167.6	169.7	-160.2	0	0	112.5	L628 A684 G685 E686 C691 K692	L628-E688 HydrophobicContact CD1-CB 3.82Å; L628-E688 HydrophobicContact CD1-CG 3.64Å; L628-E688 HydrophobicContact CD2-CB 4.03Å; A684-E688 PolarHBondContact O-N 2.69Å; G685-E688 PolarHBondContact O-N 3.21Å; E686-E688 VanDerWaalsContact C-N 3.35Å; E686-E688 PolarHBondContact O-N 2.89Å; E688-C691 PolarHBondContact O-N 2.81Å; E688-K692 HydrophobicContact CG-CD 4.12Å; E688-K692 WeakPolarHBondContact O-CG 3.31Å; E688-K692 PolarHBondContact O-N 2.75Å; E688-K692 VanDerWaalsContact O-N 3.1Å; E688-K692 WeakPolarHBondContact OE1-CE 3.41Å; E688-K692 IonicContact OE1-NZ 3.65Å; E688-K692 PolarHBondContact OE1-NZ 2.85Å
689	V	86.4	Confident	84.8	Confident	6 Å²	6	47 Å²	47	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-50.9	177.4	172.1	0	0	0	0	110.1	G685 E686 C691 K692 L693 F774 F797	G685-V689 VanDerWaalsContact O-CG2 3.29Å; G685-V689 WeakPolarHBondContact O-CG2 3.44Å; G685-V689 PolarHBondContact O-N 2.85Å; E686-V689 PolarHBondContact O-N 2.05Å; V689-C691 VanDerWaalsContact C-N 3.29Å; V689-C691 PolarHBondContact O-N 2.89Å; V689-K692 PolarHBondContact O-N 2.93Å; V689-K692 VanDerWaalsContact O-N 3.12Å; V689-L693 HydrophobicContact CG1-CD1 3.56Å; V689-L693 HydrophobicContact CG1-CG 4.11Å; V689-L693 VanDerWaalsContact O-CG 3.29Å; V689-L693 WeakPolarHBondContact O-CG 3.16Å; V689-L693 PolarHBondContact O-N 2.96Å; V689-F774 HydrophobicContact CB-CE1 4.32Å; V689-F774 HydrophobicContact CG1-CD1 4.02Å; V689-F774 HydrophobicContact CG1-CE1 4.01Å; V689-F774 HydrophobicContact CG2-CD1 4.31Å; V689-F774 HydrophobicContact CG2-CE1 3.96Å; V689-F797 HydrophobicContact CB-CB 4.18Å; V689-F797 HydrophobicContact CG1-CB 3.86Å; V689-F797 HydrophobicContact CG1-CD1 3.81Å; V689-F797 HydrophobicContact CG1-CG 3.86Å
690	L	88.3	Confident	86	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-36.1	-179.1	-70.7	172.9	0	0	0	112.7	E686 L687 G694 I700 L702 I716 F797	E686-L690 HydrophobicContact CG-CD1 4.15Å; E686-L690 WeakPolarHBondContact O-CG 3.39Å; E686-L690 PolarHBondContact O-N 3.11Å; L687-L690 PolarHBondContact O-N 3.29Å; L690-G694 PolarHBondContact O-N 3.43Å; L690-I700 HydrophobicContact CD2-CG2 4.28Å; L690-I700 WeakPolarHBondContact CD2-O 3.02Å; L690-L702 HydrophobicContact CB-CB 4.05Å; L690-I716 HydrophobicContact CD1-CG2 3.92Å; L690-F797 HydrophobicContact CD2-CD2 3.6Å; L690-F797 HydrophobicContact CD2-CE2 3.65Å; L690-F797 HydrophobicContact CG-CD2 4.16Å
691	C	87	Confident	86.9	Confident	38 Å²	38	42.6 Å²	42.6	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-63.4	-44.7	173.7	-68.5	0	0	0	0	112.2	Y630 L687 E688 V689 L702	Y630-C691 VanDerWaalsContact CB-SG 3.54Å; L687-C691 PolarHBondContact O-N 2.9Å; L687-C691 PolarHBondContact O-SG 2.85Å; E688-C691 PolarHBondContact O-N 2.81Å; V689-C691 VanDerWaalsContact C-N 3.29Å; V689-C691 PolarHBondContact O-N 2.89Å; C691-L702 WeakPolarHBondContact SG-CD2 3.15Å
692	K	87	Confident	87.7	Confident	120 Å²	120	35.9 Å²	35.9	52%	0.522	20%	0.202	S	C	.	.	H	α-helix	trans	-71.7	-32.9	-177.5	-74.9	175.2	173.4	173.1	0	113.2	E688 V689 G694 F774	E688-K692 HydrophobicContact CG-CD 4.12Å; E688-K692 WeakPolarHBondContact O-CG 3.31Å; E688-K692 PolarHBondContact O-N 2.75Å; E688-K692 VanDerWaalsContact O-N 3.1Å; E688-K692 WeakPolarHBondContact OE1-CE 3.41Å; E688-K692 IonicContact OE1-NZ 3.65Å; E688-K692 PolarHBondContact OE1-NZ 2.85Å; V689-K692 PolarHBondContact O-N 2.93Å; V689-K692 VanDerWaalsContact O-N 3.12Å; K692-G694 VanDerWaalsContact C-N 3.34Å; K692-F774 HydrophobicContact CB-CE2 4.32Å; K692-F774 HydrophobicContact CB-CZ 3.76Å; K692-F774 HydrophobicContact CD-CZ 4.03Å
693	L	87.5	Confident	88.6	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-71.3	-30.3	178.5	-69.4	174.2	0	0	0	112.4	V689 I699 Y768 L769 K772 F774 F797	V689-L693 HydrophobicContact CG1-CD1 3.56Å; V689-L693 HydrophobicContact CG1-CG 4.11Å; V689-L693 VanDerWaalsContact O-CG 3.29Å; V689-L693 WeakPolarHBondContact O-CG 3.16Å; V689-L693 PolarHBondContact O-N 2.96Å; L693-I699 HydrophobicContact CD1-CG2 4.48Å; L693-Y768 HydrophobicContact CD2-CE1 4.42Å; L693-Y768 WeakPolarHBondContact O-CE1 3.13Å; L693-Y768 PolarHBondContact O-OH 3.29Å; L693-L769 HydrophobicContact CD1-CD2 3.48Å; L693-L769 VanDerWaalsContact CD1-CD2 3.48Å; L693-L769 HydrophobicContact CD2-CD2 3.63Å; L693-L769 HydrophobicContact CG-CD2 4.21Å; L693-K772 HydrophobicContact CD2-CB 4.2Å; L693-K772 HydrophobicContact CD2-CG 4.49Å; L693-F774 HydrophobicContact CD2-CD2 3.5Å; L693-F774 VanDerWaalsContact CD2-CD2 3.5Å; L693-F774 HydrophobicContact CD2-CE2 3.79Å; L693-F774 HydrophobicContact CD2-CG 4.01Å; L693-F774 HydrophobicContact CG-CD2 4.43Å; L693-F774 HydrophobicContact CG-CE2 4.41Å; L693-F797 HydrophobicContact CD1-CD1 4.4Å; L693-F797 HydrophobicContact CD1-CE1 4.02Å; L693-F797 HydrophobicContact CD1-CZ 4.15Å
694	G	85.9	Confident	89.1	Confident	38 Å²	38	34 Å²	34	39%	0.392	19%	0.192	S	C	.	.			trans	65.9	-157.1	-174.6	0	0	0	0	0	112	L690 K692	L690-G694 PolarHBondContact O-N 3.43Å; K692-G694 VanDerWaalsContact C-N 3.34Å
695	Q	89.6	Confident	89.7	Confident	169 Å²	169	31.7 Å²	31.7	79%	0.79	17%	0.173	S	C	*	.			trans	-88.1	132.4	-176.5	-68.3	-178.8	2	0	0	112.4	N701	Q695-N701 VanDerWaalsContact CA-OD1 3.24Å; Q695-N701 WeakPolarHBondContact CA-OD1 3.42Å
696	H	95	Very high	90.2	Very high	29 Å²	29	31.4 Å²	31.4	13%	0.134	17%	0.169	C	C	.	.			trans	-146.3	140.9	172.1	-174.6	-86.3	0	0	0	110.2	N698 I699 N701 Y768	H696-N698 VanDerWaalsContact C-N 3.31Å; H696-N698 PolarHBondContact ND1-N 2.87Å; H696-N698 VanDerWaalsContact ND1-N 3.14Å; H696-N698 PolarHBondContact O-N 3.33Å; H696-I699 HydrophobicContact CB-CB 4.14Å; H696-I699 HydrophobicContact CB-CD1 4.13Å; H696-I699 HydrophobicContact CB-CG1 4.26Å; H696-I699 PolarHBondContact O-N 3.15Å; H696-N701 PolarHBondContact N-OD1 3.28Å; H696-N701 PolarHBondContact O-ND2 2.94Å; H696-N701 PolarHBondContact O-OD1 2.9Å; H696-Y768 HydrophobicContact CB-CD1 4.12Å; H696-Y768 HydrophobicContact CB-CE1 4.08Å; H696-Y768 AromaticContact CD2-CD1 3.9Å; H696-Y768 AromaticContact CD2-CD2 3.64Å; H696-Y768 AromaticContact CD2-CG 3.48Å; H696-Y768 VanDerWaalsContact CD2-CG 3.48Å; H696-Y768 AromaticContact CG-CD1 3.99Å; H696-Y768 AromaticContact NE2-CG 3.96Å
697	P	95.2	Very high	90.3	Very high	81 Å²	81	37.6 Å²	37.6	53%	0.526	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-36.2	-175.3	21.5	-33.8	0	0	0	113.8	K793	P697-K793 WeakPolarHBondContact O-CG 3.41Å; P697-K793 PolarHBondContact O-NZ 3.05Å
698	N	97.5	Very high	90.2	Very high	12 Å²	12	39 Å²	39	6%	0.064	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	17.5	-178.5	-50.7	106.6	0	0	0	114.6	H696 D761 A792 K793 I794	H696-N698 VanDerWaalsContact C-N 3.31Å; H696-N698 PolarHBondContact ND1-N 2.87Å; H696-N698 VanDerWaalsContact ND1-N 3.14Å; H696-N698 PolarHBondContact O-N 3.33Å; N698-D761 WeakPolarHBondContact CB-O 3.2Å; N698-D761 WeakPolarHBondContact ND2-CA 3.19Å; N698-D761 WeakPolarHBondContact ND2-CB 3.44Å; N698-D761 PolarHBondContact ND2-OD1 3.36Å; N698-A792 WeakPolarHBondContact CA-O 3.33Å; N698-A792 PolarHBondContact ND2-O 2.9Å; N698-K793 WeakPolarHBondContact O-CA 3.45Å; N698-I794 PolarHBondContact O-N 3.3Å
699	I	96	Very high	90	Very high	1 Å²	1	46 Å²	46	1%	0.005	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-124.4	142.2	170.6	-64.5	174.6	0	0	0	107.2	L693 H696 N701 Y768 L769 F797	L693-I699 HydrophobicContact CD1-CG2 4.48Å; H696-I699 HydrophobicContact CB-CB 4.14Å; H696-I699 HydrophobicContact CB-CD1 4.13Å; H696-I699 HydrophobicContact CB-CG1 4.26Å; H696-I699 PolarHBondContact O-N 3.15Å; I699-N701 PolarHBondContact O-N 2.9Å; I699-N701 PolarHBondContact O-ND2 2.88Å; I699-Y768 HydrophobicContact CD1-CD1 3.51Å; I699-Y768 HydrophobicContact CD1-CE1 4.13Å; I699-Y768 HydrophobicContact CD1-CG 4.5Å; I699-L769 HydrophobicContact CD1-CD1 4.17Å; I699-L769 HydrophobicContact CD1-CD2 4.19Å; I699-L769 HydrophobicContact CD1-CG 3.76Å; I699-F797 HydrophobicContact CG2-CE2 3.86Å; I699-F797 HydrophobicContact CG2-CZ 3.64Å
700	I	94.2	Very high	89.4	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-66.2	125.4	176.8	-157.7	66.3	0	0	0	109.7	L690 I716 E717 L785 K793 I794 A795 F797	L690-I700 HydrophobicContact CD2-CG2 4.28Å; L690-I700 WeakPolarHBondContact CD2-O 3.02Å; I700-I716 HydrophobicContact CG1-CB 4.3Å; I700-I716 HydrophobicContact CG1-CD1 4.17Å; I700-E717 HydrophobicContact CD1-CB 3.94Å; I700-E717 HydrophobicContact CD1-CG 4.44Å; I700-E717 WeakPolarHBondContact CD1-O 3.39Å; I700-E717 HydrophobicContact CG1-CB 4.4Å; I700-L785 HydrophobicContact CD1-CD1 3.89Å; I700-L785 HydrophobicContact CG1-CD1 4.09Å; I700-K793 HydrophobicContact CD1-CB 4.35Å; I700-K793 HydrophobicContact CD1-CD 4.01Å; I700-I794 PolarHBondContact N-O 3.09Å; I700-A795 HydrophobicContact CB-CB 4.18Å; I700-A795 HydrophobicContact CG2-CB 3.86Å; I700-F797 HydrophobicContact CG2-CE2 4.25Å
701	N	92.3	Very high	89.1	Confident	24 Å²	24	52.3 Å²	52.3	13%	0.128	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-89.7	141.9	-171.4	-64.7	-63	0	0	0	111.9	Q695 H696 I699 I716 E717	Q695-N701 VanDerWaalsContact CA-OD1 3.24Å; Q695-N701 WeakPolarHBondContact CA-OD1 3.42Å; H696-N701 PolarHBondContact N-OD1 3.28Å; H696-N701 PolarHBondContact O-ND2 2.94Å; H696-N701 PolarHBondContact O-OD1 2.9Å; I699-N701 PolarHBondContact O-N 2.9Å; I699-N701 PolarHBondContact O-ND2 2.88Å; N701-I716 WeakPolarHBondContact O-CA 3.22Å; N701-E717 HydrophobicContact CB-CB 4.44Å; N701-E717 PolarHBondContact ND2-OE2 3.37Å; N701-E717 PolarHBondContact O-N 3.36Å
702	L	92.9	Very high	89	Confident	26 Å²	26	52.6 Å²	52.6	14%	0.136	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	125.4	169.9	-179.2	70.6	0	0	0	110.3	L687 L690 C691 G704 I714	L687-L702 HydrophobicContact CD1-CD1 3.79Å; L687-L702 HydrophobicContact CD1-CD2 3.73Å; L687-L702 HydrophobicContact CD1-CG 4.44Å; L690-L702 HydrophobicContact CB-CB 4.05Å; C691-L702 WeakPolarHBondContact SG-CD2 3.15Å; L702-G704 WeakPolarHBondContact CD1-O 3.39Å; L702-I714 HydrophobicContact CD1-CG2 3.63Å
703	I	92.1	Very high	89.2	Confident	15 Å²	15	48 Å²	48	8%	0.077	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-43.2	170.4	-62.9	174.4	0	0	0	109.5	I657 K659 M664 A666 A715	I657-I703 HydrophobicContact CD1-CG2 4.27Å; K659-I703 HydrophobicContact CD-CG2 4.11Å; K659-I703 PolarHBondContact NZ-O 3.41Å; M664-I703 HydrophobicContact SD-CD1 4.31Å; M664-I703 HydrophobicContact SD-CG2 4.16Å; A666-I703 HydrophobicContact CB-CD1 3.62Å; I703-A715 HydrophobicContact CB-CB 4.19Å; I703-A715 WeakPolarHBondContact CB-O 3.45Å; I703-A715 PolarHBondContact N-O 2.9Å
704	G	90.8	Very high	89.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.5	-175.5	176.1	0	0	0	0	0	112	P631 L702 A715	P631-G704 CarbonylContact O-C 3.54Å; P631-G704 WeakPolarHBondContact O-CA 3.46Å; L702-G704 WeakPolarHBondContact CD1-O 3.39Å; G704-A715 PolarHBondContact N-O 2.87Å; G704-A715 WeakPolarHBondContact O-CA 3.42Å; G704-A715 WeakPolarHBondContact O-CB 3.49Å; G704-A715 PolarHBondContact O-N 2.76Å
705	A	91.8	Very high	89.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.4	174	0	0	0	0	0	110.8	Y630 P631 I632 L633 L687 L712 Y713	Y630-A705 HydrophobicContact CD2-CB 3.8Å; Y630-A705 HydrophobicContact CE2-CB 3.89Å; P631-A705 PolarHBondContact O-N 3.49Å; I632-A705 WeakPolarHBondContact CA-O 3.47Å; L633-A705 PolarHBondContact N-O 2.86Å; L687-A705 HydrophobicContact CD1-CB 3.87Å; L687-A705 HydrophobicContact CD2-CB 3.94Å; A705-L712 HydrophobicContact CB-CD1 4.29Å; A705-Y713 CarbonylContact C-O 3.56Å; A705-Y713 WeakPolarHBondContact CA-O 3.29Å; A705-Y713 WeakPolarHBondContact CB-O 3.38Å
706	C	88.7	Confident	89.8	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.034	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.6	172.2	75.7	0	0	0	0	110.6	L633 I638 Y713	L633-C706 HydrophobicContact CB-CB 4.16Å; L633-C706 WeakPolarHBondContact O-CB 3.49Å; I638-C706 HydrophobicContact CD1-CB 4.39Å; I638-C706 VanDerWaalsContact CD1-SG 3.51Å; C706-Y713 PolarHBondContact N-O 3.49Å; C706-Y713 PolarHBondContact O-N 3.47Å
707	E	86.4	Confident	89.7	Confident	135 Å²	135	39.6 Å²	39.6	63%	0.631	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.6	171.6	-168.1	177.3	174.7	0	0	108.1	Y711	E707-Y711 WeakPolarHBondContact CA-O 3.27Å
708	N	84.3	Confident	89.6	Confident	36 Å²	36	38.5 Å²	38.5	19%	0.193	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	129.9	179.7	-179.7	43.9	0	0	0	110.2	W635 G710 Y711 Y713	W635-N708 HydrophobicContact CD2-CB 3.84Å; W635-N708 HydrophobicContact CE3-CB 3.32Å; W635-N708 VanDerWaalsContact CE3-ND2 3.34Å; W635-N708 HydrophobicContact CG-CB 4.46Å; W635-N708 HydrophobicContact CH2-CB 4.39Å; W635-N708 VanDerWaalsContact CH2-ND2 3.32Å; W635-N708 WeakPolarHBondContact CH2-ND2 3.35Å; W635-N708 WeakPolarHBondContact CZ2-ND2 3.37Å; W635-N708 HydrophobicContact CZ3-CB 3.65Å; W635-N708 WeakPolarHBondContact CZ3-ND2 3.49Å; N708-G710 PolarHBondContact O-N 3.15Å; N708-G710 VanDerWaalsContact O-N 3.13Å; N708-Y711 PolarHBondContact N-O 3.03Å; N708-Y711 PolarHBondContact O-N 2.84Å; N708-Y713 HydrophobicContact CB-CE2 4.1Å
709	R	81.2	Confident	89.5	Confident	222 Å²	222	38.5 Å²	38.5	84%	0.838	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	33.2	-178.5	-58.7	179.8	179.7	-174.6	-0.4	114	Y711	R709-Y711 VanDerWaalsContact C-N 3.35Å; R709-Y711 WeakPolarHBondContact O-CD2 3.34Å
710	G	73.8	Confident	89.3	Confident	61 Å²	61	40.6 Å²	40.6	63%	0.629	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	8.9	-179.5	0	0	0	0	0	115.1	N708	N708-G710 PolarHBondContact O-N 3.15Å; N708-G710 VanDerWaalsContact O-N 3.13Å
711	Y	81.2	Confident	89.3	Confident	84 Å²	84	45.6 Å²	45.6	33%	0.329	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.8	173.9	-64.7	-84.2	0	0	0	110.8	E707 N708 R709 Y713	E707-Y711 WeakPolarHBondContact CA-O 3.27Å; N708-Y711 PolarHBondContact N-O 3.03Å; N708-Y711 PolarHBondContact O-N 2.84Å; R709-Y711 VanDerWaalsContact C-N 3.35Å; R709-Y711 WeakPolarHBondContact O-CD2 3.34Å; Y711-Y713 VanDerWaalsContact O-CD2 3.29Å; Y711-Y713 WeakPolarHBondContact O-CD2 3.5Å; Y711-Y713 WeakPolarHBondContact O-CE2 3.25Å
712	L	85.9	Confident	89.3	Confident	43 Å²	43	46 Å²	46	23%	0.225	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.4	173.2	179.9	65.3	0	0	0	110.2	F683 L687 A705 I714	F683-L712 HydrophobicContact CD1-CD2 4.06Å; F683-L712 HydrophobicContact CE1-CB 4.06Å; F683-L712 HydrophobicContact CE1-CD2 3.98Å; F683-L712 HydrophobicContact CE1-CG 3.97Å; F683-L712 WeakPolarHBondContact CE1-O 3.41Å; L687-L712 HydrophobicContact CD2-CD1 4.31Å; L687-L712 HydrophobicContact CD2-CD2 4.32Å; A705-L712 HydrophobicContact CB-CD1 4.29Å; L712-I714 HydrophobicContact CD2-CD1 4.45Å; L712-I714 HydrophobicContact CD2-CG1 4.36Å; L712-I714 HydrophobicContact CG-CG1 4.29Å
713	Y	90.1	Very high	89.3	Confident	23 Å²	23	46.4 Å²	46.4	9%	0.09	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.6	175.5	-60.8	-98.5	0	0	0	108.7	W635 F640 I668 M670 A705 C706 N708 Y711	W635-Y713 HydrophobicContact CE3-CE2 4.48Å; W635-Y713 HydrophobicContact CH2-CE1 4.17Å; W635-Y713 HydrophobicContact CH2-CE2 4.16Å; W635-Y713 AromaticContact CH2-CZ 3.79Å; W635-Y713 HydrophobicContact CZ3-CD1 4.32Å; W635-Y713 AromaticContact CZ3-CD2 3.87Å; W635-Y713 HydrophobicContact CZ3-CD2 3.87Å; W635-Y713 AromaticContact CZ3-CE1 4Å; W635-Y713 HydrophobicContact CZ3-CE1 4Å; W635-Y713 AromaticContact CZ3-CE2 3.53Å; W635-Y713 HydrophobicContact CZ3-CE2 3.53Å; W635-Y713 HydrophobicContact CZ3-CG 4.27Å; W635-Y713 AromaticContact CZ3-CZ 3.6Å; F640-Y713 HydrophobicContact CE1-CD1 4.43Å; F640-Y713 HydrophobicContact CZ-CD1 4.27Å; F640-Y713 HydrophobicContact CZ-CE1 4.26Å; I668-Y713 HydrophobicContact CG2-CD1 3.8Å; I668-Y713 HydrophobicContact CG2-CG 4.35Å; M670-Y713 HydrophobicContact CB-CD1 3.88Å; M670-Y713 HydrophobicContact CB-CE1 4.08Å; M670-Y713 HydrophobicContact CE-CE1 3.65Å; M670-Y713 HydrophobicContact CG-CE1 4.44Å; M670-Y713 HydrophobicContact SD-CD1 4.12Å; M670-Y713 HydrophobicContact SD-CE1 3.57Å; M670-Y713 VanDerWaalsContact SD-CE1 3.57Å; A705-Y713 CarbonylContact C-O 3.56Å; A705-Y713 WeakPolarHBondContact CA-O 3.29Å; A705-Y713 WeakPolarHBondContact CB-O 3.38Å; C706-Y713 PolarHBondContact N-O 3.49Å; C706-Y713 PolarHBondContact O-N 3.47Å; N708-Y713 HydrophobicContact CB-CE2 4.1Å; Y711-Y713 VanDerWaalsContact O-CD2 3.29Å; Y711-Y713 WeakPolarHBondContact O-CD2 3.5Å; Y711-Y713 WeakPolarHBondContact O-CE2 3.25Å
714	I	91.4	Very high	89.5	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116.3	178.5	-57.6	176.3	0	0	0	107.9	I668 K669 F683 L687 L702 L712 I716	I668-I714 WeakPolarHBondContact CA-O 3.34Å; K669-I714 PolarHBondContact N-O 3.27Å; K669-I714 PolarHBondContact O-N 2.97Å; F683-I714 HydrophobicContact CD1-CD1 4.4Å; F683-I714 HydrophobicContact CD2-CD1 4Å; F683-I714 HydrophobicContact CE1-CD1 4.01Å; F683-I714 HydrophobicContact CE1-CG1 4.12Å; F683-I714 HydrophobicContact CE2-CB 4.48Å; F683-I714 HydrophobicContact CE2-CD1 3.54Å; F683-I714 HydrophobicContact CE2-CG1 4.08Å; F683-I714 HydrophobicContact CG-CD1 4.39Å; F683-I714 HydrophobicContact CZ-CB 4.19Å; F683-I714 HydrophobicContact CZ-CD1 3.55Å; F683-I714 HydrophobicContact CZ-CG1 3.63Å; F683-I714 WeakPolarHBondContact O-CD1 3.3Å; L687-I714 HydrophobicContact CB-CD1 3.78Å; L687-I714 HydrophobicContact CB-CG1 4.38Å; L687-I714 HydrophobicContact CD1-CG1 4.49Å; L687-I714 HydrophobicContact CD1-CG2 4.38Å; L702-I714 HydrophobicContact CD1-CG2 3.63Å; L712-I714 HydrophobicContact CD2-CD1 4.45Å; L712-I714 HydrophobicContact CD2-CG1 4.36Å; L712-I714 HydrophobicContact CG-CG1 4.29Å; I714-I716 HydrophobicContact CG2-CG2 4Å
715	A	92.7	Very high	89.7	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.008	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	116	174.9	0	0	0	0	0	110.5	L633 I657 I668 I703 G704	L633-A715 HydrophobicContact CD1-CB 3.4Å; I657-A715 HydrophobicContact CD1-CB 3.45Å; I657-A715 VanDerWaalsContact CD1-CB 3.45Å; I668-A715 HydrophobicContact CD1-CB 3.48Å; I668-A715 VanDerWaalsContact CD1-CB 3.48Å; I703-A715 HydrophobicContact CB-CB 4.19Å; I703-A715 WeakPolarHBondContact CB-O 3.45Å; I703-A715 PolarHBondContact N-O 2.9Å; G704-A715 PolarHBondContact N-O 2.87Å; G704-A715 WeakPolarHBondContact O-CA 3.42Å; G704-A715 WeakPolarHBondContact O-CB 3.49Å; G704-A715 PolarHBondContact O-N 2.76Å
716	I	92.5	Very high	89.8	Confident	14 Å²	14	50 Å²	50	7%	0.072	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	161.7	175.2	59.9	178.1	0	0	0	110.7	A666 A667 L690 I700 N701 I714 Y718	A666-I716 WeakPolarHBondContact CA-O 3.41Å; A667-I716 HydrophobicContact CB-CG1 3.96Å; A667-I716 PolarHBondContact N-O 3.32Å; A667-I716 WeakPolarHBondContact O-CG1 3.08Å; A667-I716 PolarHBondContact O-N 2.93Å; L690-I716 HydrophobicContact CD1-CG2 3.92Å; I700-I716 HydrophobicContact CG1-CB 4.3Å; I700-I716 HydrophobicContact CG1-CD1 4.17Å; N701-I716 WeakPolarHBondContact O-CA 3.22Å; I714-I716 HydrophobicContact CG2-CG2 4Å; I716-Y718 PolarHBondContact O-N 3.05Å
717	E	92.7	Very high	90.2	Very high	47 Å²	47	51.4 Å²	51.4	22%	0.22	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	134.9	171.7	-175.7	-176.7	168	0	0	111.1	I700 N701 K793	I700-E717 HydrophobicContact CD1-CB 3.94Å; I700-E717 HydrophobicContact CD1-CG 4.44Å; I700-E717 WeakPolarHBondContact CD1-O 3.39Å; I700-E717 HydrophobicContact CG1-CB 4.4Å; N701-E717 HydrophobicContact CB-CB 4.44Å; N701-E717 PolarHBondContact ND2-OE2 3.37Å; N701-E717 PolarHBondContact O-N 3.36Å; E717-K793 VanDerWaalsContact CD-NZ 3.26Å; E717-K793 WeakPolarHBondContact OE1-CE 3.4Å; E717-K793 IonicContact OE1-NZ 3.53Å; E717-K793 PolarHBondContact OE1-NZ 3.33Å; E717-K793 IonicContact OE2-NZ 2.76Å; E717-K793 PolarHBondContact OE2-NZ 3.41Å
718	Y	93.6	Very high	90.7	Very high	57 Å²	57	45 Å²	45	22%	0.224	23%	0.228	C	C	.	.			trans	-82.6	126.8	177.8	178.1	-107.2	0	0	0	110.7	I644 K654 A667 I716 P720	I644-Y718 HydrophobicContact CD1-CD2 3.98Å; I644-Y718 HydrophobicContact CD1-CE2 3.68Å; K654-Y718 HydrophobicContact CB-CE2 4.48Å; K654-Y718 HydrophobicContact CD-CE2 3.93Å; K654-Y718 HydrophobicContact CG-CD2 4.2Å; K654-Y718 HydrophobicContact CG-CE2 3.99Å; A667-Y718 HydrophobicContact CB-CD2 4.4Å; I716-Y718 PolarHBondContact O-N 3.05Å; Y718-P720 HydrophobicContact CD1-CB 4.43Å; Y718-P720 HydrophobicContact CE1-CB 3.84Å
719	A	94.1	Very high	91.2	Very high	12 Å²	12	45.4 Å²	45.4	10%	0.099	23%	0.227	C	C	.	.			trans	-104.3	107.1	175.5	0	0	0	0	0	110.2	Y721 G722 L785	A719-Y721 VanDerWaalsContact C-N 3.28Å; A719-Y721 PolarHBondContact O-N 2.79Å; A719-G722 PolarHBondContact O-N 3.19Å; A719-L785 HydrophobicContact CB-CB 3.66Å; A719-L785 HydrophobicContact CB-CD1 4.12Å; A719-L785 HydrophobicContact CB-CG 4.34Å
720	P	92.3	Very high	91.9	Very high	45 Å²	45	41.8 Å²	41.8	29%	0.292	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.7	-167	26.1	-34.8	0	0	0	114.6	Y718 D788	Y718-P720 HydrophobicContact CD1-CB 4.43Å; Y718-P720 HydrophobicContact CE1-CB 3.84Å; P720-D788 WeakPolarHBondContact CG-OD1 3.4Å
721	Y	94.3	Very high	92.9	Very high	106 Å²	106	39 Å²	39	42%	0.416	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	1.4	-177	-57.3	-73.8	0	0	0	113.5	A719 F727 V786 G787 L790	A719-Y721 VanDerWaalsContact C-N 3.28Å; A719-Y721 PolarHBondContact O-N 2.79Å; Y721-F727 AromaticContact CD1-CE2 3.94Å; Y721-F727 HydrophobicContact CD1-CE2 3.94Å; Y721-F727 HydrophobicContact CG-CE2 4.05Å; Y721-V786 HydrophobicContact CD2-CG1 3.95Å; Y721-V786 HydrophobicContact CG-CG1 4.22Å; Y721-V786 PolarHBondContact N-O 3.14Å; Y721-G787 VanDerWaalsContact CD2-O 3.27Å; Y721-G787 WeakPolarHBondContact CD2-O 3.39Å; Y721-G787 WeakPolarHBondContact CE2-O 3.17Å; Y721-L790 HydrophobicContact CD2-CD2 4.23Å; Y721-L790 HydrophobicContact CE2-CD2 4.08Å
722	G	92.1	Very high	93.5	Very high	32 Å²	32	35 Å²	35	33%	0.33	17%	0.173	S	C	.	.			trans	74.8	-154.5	179	0	0	0	0	0	113.3	A719 L785 V786	A719-G722 PolarHBondContact O-N 3.19Å; G722-L785 WeakPolarHBondContact O-CA 3.39Å; G722-V786 PolarHBondContact O-N 3.19Å
723	N	93.1	Very high	93.8	Very high	36 Å²	36	33.2 Å²	33.2	19%	0.193	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-79	151.6	179.4	73.2	78.6	0	0	0	112.2	L725 D726 F727 R782 V784 L785	N723-L725 VanDerWaalsContact C-N 3.34Å; N723-L725 PolarHBondContact O-N 2.88Å; N723-L725 WeakPolarHBondContact OD1-CB 3.42Å; N723-L725 PolarHBondContact OD1-N 3.21Å; N723-D726 PolarHBondContact ND2-OD2 2.91Å; N723-D726 PolarHBondContact O-N 3.39Å; N723-D726 PolarHBondContact OD1-N 2.77Å; N723-F727 WeakPolarHBondContact O-CB 3.27Å; N723-F727 PolarHBondContact O-N 2.75Å; N723-F727 VanDerWaalsContact O-N 3.09Å; N723-R782 WeakPolarHBondContact CB-O 3.34Å; N723-V784 CarbonylContact C-O 3.56Å; N723-V784 VanDerWaalsContact CA-O 3.26Å; N723-V784 WeakPolarHBondContact CA-O 3.47Å; N723-L785 HydrophobicContact CB-CD2 4.25Å
724	L	97.3	Very high	93.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-35	-174.7	178.8	62.8	0	0	0	111.9	F727 L728 F758 A781 V784 V786 I845	L724-F727 PolarHBondContact O-N 3.09Å; L724-L728 HydrophobicContact CD1-CD1 4.24Å; L724-L728 HydrophobicContact CD1-CD2 4.43Å; L724-L728 HydrophobicContact CD1-CG 4.01Å; L724-L728 HydrophobicContact CG-CD1 3.92Å; L724-L728 HydrophobicContact CG-CG 4.2Å; L724-L728 WeakPolarHBondContact O-CB 3.3Å; L724-L728 WeakPolarHBondContact O-CG 3.24Å; L724-L728 PolarHBondContact O-N 3.15Å; L724-F758 HydrophobicContact CD1-CB 4.4Å; L724-F758 HydrophobicContact CD1-CD1 4.2Å; L724-F758 HydrophobicContact CD1-CD2 3.77Å; L724-F758 HydrophobicContact CD1-CE1 4.4Å; L724-F758 HydrophobicContact CD1-CE2 4.01Å; L724-F758 HydrophobicContact CD1-CG 3.88Å; L724-F758 HydrophobicContact CD1-CZ 4.32Å; L724-F758 HydrophobicContact CD2-CB 4.32Å; L724-A781 WeakPolarHBondContact CB-O 3.09Å; L724-A781 PolarHBondContact N-O 3.32Å; L724-V784 HydrophobicContact CB-CB 3.98Å; L724-V784 HydrophobicContact CB-CG1 4.1Å; L724-V784 WeakPolarHBondContact CB-O 3.19Å; L724-V784 HydrophobicContact CD2-CB 4.13Å; L724-V784 HydrophobicContact CD2-CG1 3.91Å; L724-V784 PolarHBondContact N-O 2.86Å; L724-V786 HydrophobicContact CB-CG2 4.07Å; L724-V786 HydrophobicContact CD1-CG2 3.8Å; L724-I845 HydrophobicContact CD2-CD1 4.15Å; L724-I845 HydrophobicContact CD2-CG1 4.08Å
725	L	95.4	Very high	93.6	Very high	17 Å²	17	39.9 Å²	39.9	9%	0.089	20%	0.197	C	C	.	.	H	α-helix	trans	-60	-51.5	178.4	178.6	62.7	0	0	0	111.7	N723 F727 L728 R729 A781 R782	N723-L725 VanDerWaalsContact C-N 3.34Å; N723-L725 PolarHBondContact O-N 2.88Å; N723-L725 WeakPolarHBondContact OD1-CB 3.42Å; N723-L725 PolarHBondContact OD1-N 3.21Å; L725-F727 VanDerWaalsContact C-N 3.31Å; L725-F727 PolarHBondContact O-N 3.05Å; L725-L728 PolarHBondContact O-N 3.42Å; L725-R729 WeakPolarHBondContact O-CG 3.44Å; L725-R729 PolarHBondContact O-N 3.48Å; L725-A781 HydrophobicContact CB-CB 3.96Å; L725-A781 HydrophobicContact CD1-CB 4.48Å; L725-A781 PolarHBondContact N-O 3.24Å; L725-R782 HydrophobicContact CB-CB 4.41Å; L725-R782 HydrophobicContact CD2-CB 4.13Å
726	D	93.7	Very high	93.5	Very high	72 Å²	72	44 Å²	44	39%	0.385	22%	0.222	S	C	.	.	H	α-helix	trans	-65.7	-37.3	177.8	-71.4	-24.4	0	0	0	111.6	N723 R729 K730	N723-D726 PolarHBondContact ND2-OD2 2.91Å; N723-D726 PolarHBondContact O-N 3.39Å; N723-D726 PolarHBondContact OD1-N 2.77Å; D726-R729 PolarHBondContact O-N 3.42Å; D726-K730 WeakPolarHBondContact O-CB 3.28Å; D726-K730 VanDerWaalsContact O-CG 3.27Å; D726-K730 WeakPolarHBondContact O-CG 3.32Å; D726-K730 PolarHBondContact O-N 3.36Å
727	F	96.4	Very high	93.4	Very high	36 Å²	36	46.9 Å²	46.9	16%	0.158	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-44.1	176.6	-169.5	-99.3	0	0	0	112	Y721 N723 L724 L725 K730 S731 L750 F758 V786 L790	Y721-F727 AromaticContact CD1-CE2 3.94Å; Y721-F727 HydrophobicContact CD1-CE2 3.94Å; Y721-F727 HydrophobicContact CG-CE2 4.05Å; N723-F727 WeakPolarHBondContact O-CB 3.27Å; N723-F727 PolarHBondContact O-N 2.75Å; N723-F727 VanDerWaalsContact O-N 3.09Å; L724-F727 PolarHBondContact O-N 3.09Å; L725-F727 VanDerWaalsContact C-N 3.31Å; L725-F727 PolarHBondContact O-N 3.05Å; F727-K730 PolarHBondContact O-N 3.4Å; F727-S731 PolarHBondContact O-N 3.45Å; F727-L750 HydrophobicContact CD1-CD1 4.32Å; F727-L750 HydrophobicContact CE1-CD1 4.16Å; F727-L750 HydrophobicContact CE1-CD2 3.82Å; F727-L750 HydrophobicContact CZ-CD2 4.43Å; F727-F758 HydrophobicContact CD1-CE2 4.41Å; F727-F758 HydrophobicContact CD1-CZ 4.18Å; F727-F758 HydrophobicContact CE1-CE2 4.26Å; F727-F758 AromaticContact CE1-CZ 3.82Å; F727-F758 HydrophobicContact CE1-CZ 3.82Å; F727-V786 HydrophobicContact CB-CG2 4.37Å; F727-V786 HydrophobicContact CD1-CG2 4.37Å; F727-V786 HydrophobicContact CG-CG2 4.33Å; F727-L790 HydrophobicContact CE1-CD2 4.36Å; F727-L790 HydrophobicContact CZ-CD2 3.75Å
728	L	96.8	Very high	93.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-43.3	174.8	-71.5	166.4	0	0	0	111.5	L724 L725 S731 L750 L755 I845 L848	L724-L728 HydrophobicContact CD1-CD1 4.24Å; L724-L728 HydrophobicContact CD1-CD2 4.43Å; L724-L728 HydrophobicContact CD1-CG 4.01Å; L724-L728 HydrophobicContact CG-CD1 3.92Å; L724-L728 HydrophobicContact CG-CG 4.2Å; L724-L728 WeakPolarHBondContact O-CB 3.3Å; L724-L728 WeakPolarHBondContact O-CG 3.24Å; L724-L728 PolarHBondContact O-N 3.15Å; L725-L728 PolarHBondContact O-N 3.42Å; L728-S731 WeakPolarHBondContact O-CB 3.47Å; L728-S731 PolarHBondContact O-N 3.16Å; L728-S731 PolarHBondContact O-OG 2.79Å; L728-L750 HydrophobicContact CD2-CD1 4.05Å; L728-L755 HydrophobicContact CD2-CD2 3.5Å; L728-L755 VanDerWaalsContact CD2-CD2 3.5Å; L728-I845 HydrophobicContact CD1-CG1 4.27Å; L728-L848 HydrophobicContact CD2-CD2 4.44Å
729	R	95.2	Very high	93	Very high	44 Å²	44	48.3 Å²	48.3	17%	0.166	26%	0.263	C	S	.	.	H	α-helix	trans	-65.6	-42.9	178.5	-73	176.3	175.1	-178.3	-2.6	112.6	L725 D726 S731 R732 G849 I930 E935	L725-R729 WeakPolarHBondContact O-CG 3.44Å; L725-R729 PolarHBondContact O-N 3.48Å; D726-R729 PolarHBondContact O-N 3.42Å; R729-S731 PolarHBondContact O-N 2.86Å; R729-R732 VanDerWaalsContact O-CB 3.3Å; R729-R732 WeakPolarHBondContact O-CB 3.18Å; R729-R732 WeakPolarHBondContact O-CG 3.43Å; R729-R732 PolarHBondContact O-N 3.37Å; R729-G849 PolarHBondContact NE-O 2.84Å; R729-G849 PolarHBondContact NH2-O 3Å; R729-I930 HydrophobicContact CG-CD1 4.16Å; R729-E935 IonicContact CZ-OE1 3.82Å; R729-E935 IonicContact CZ-OE2 3.33Å; R729-E935 IonicContact NH1-OE1 3.79Å; R729-E935 IonicContact NH1-OE2 2.84Å; R729-E935 PolarHBondContact NH1-OE2 2.71Å; R729-E935 VanDerWaalsContact NH2-CD 3.3Å; R729-E935 IonicContact NH2-OE1 2.77Å; R729-E935 PolarHBondContact NH2-OE1 3.33Å; R729-E935 IonicContact NH2-OE2 2.76Å; R729-E935 PolarHBondContact NH2-OE2 3.41Å
730	K	94.6	Very high	92.8	Very high	146 Å²	146	51.3 Å²	51.3	64%	0.635	28%	0.275	S	S	*	.	H	α-helix	trans	-60.2	-25.7	174.4	-73.5	170.4	-175.5	173	0	112.5	D726 F727 R732	D726-K730 WeakPolarHBondContact O-CB 3.28Å; D726-K730 VanDerWaalsContact O-CG 3.27Å; D726-K730 WeakPolarHBondContact O-CG 3.32Å; D726-K730 PolarHBondContact O-N 3.36Å; F727-K730 PolarHBondContact O-N 3.4Å; K730-R732 VanDerWaalsContact C-N 3.29Å; K730-R732 PolarHBondContact O-N 3.33Å
731	S	94.8	Very high	92.6	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.014	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-12.7	176.5	85.8	0	0	0	0	114.5	F727 L728 R729 V733 S748 T749	F727-S731 PolarHBondContact O-N 3.45Å; L728-S731 WeakPolarHBondContact O-CB 3.47Å; L728-S731 PolarHBondContact O-N 3.16Å; L728-S731 PolarHBondContact O-OG 2.79Å; R729-S731 PolarHBondContact O-N 2.86Å; S731-V733 PolarHBondContact O-N 3.34Å; S731-S748 WeakPolarHBondContact CB-OG 3.5Å; S731-S748 WeakPolarHBondContact O-CA 3.36Å; S731-S748 PolarHBondContact O-OG 2.76Å; S731-S748 PolarHBondContact OG-OG 2.86Å; S731-T749 PolarHBondContact O-N 2.78Å
732	R	94.5	Very high	92.3	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.008	27%	0.273	C	S	.	.			trans	-69.6	75.7	179.9	-66	-178.6	177	-153	-4.9	111.2	R729 K730 L734 E735 T736 S847 L848 G850 Y927 A928	R729-R732 VanDerWaalsContact O-CB 3.3Å; R729-R732 WeakPolarHBondContact O-CB 3.18Å; R729-R732 WeakPolarHBondContact O-CG 3.43Å; R729-R732 PolarHBondContact O-N 3.37Å; K730-R732 VanDerWaalsContact C-N 3.29Å; K730-R732 PolarHBondContact O-N 3.33Å; R732-L734 VanDerWaalsContact C-N 3.25Å; R732-L734 PolarHBondContact O-N 3.47Å; R732-E735 HydrophobicContact CB-CB 4.46Å; R732-E735 IonicContact NH1-OE1 2.99Å; R732-E735 PolarHBondContact O-N 2.92Å; R732-T736 PolarHBondContact O-N 3.01Å; R732-T736 VanDerWaalsContact O-N 3.13Å; R732-T736 PolarHBondContact O-OG1 3.38Å; R732-S847 PolarHBondContact NH2-O 2.8Å; R732-L848 HydrophobicContact CG-CB 4.07Å; R732-L848 HydrophobicContact CG-CD1 4.26Å; R732-L848 PolarHBondContact NE-O 2.01Å; R732-L848 PolarHBondContact NH2-O 3Å; R732-G850 VanDerWaalsContact NH2-N 3.18Å; R732-Y927 WeakPolarHBondContact CA-OH 3.49Å; R732-Y927 HydrophobicContact CB-CE1 4.01Å; R732-Y927 HydrophobicContact CB-CE2 4.01Å; R732-Y927 HydrophobicContact CG-CD1 4.06Å; R732-Y927 HydrophobicContact CG-CE1 3.83Å; R732-Y927 HydrophobicContact CG-CE2 4.42Å; R732-Y927 HydrophobicContact CG-CG 4.46Å; R732-A928 PolarHBondContact NH1-O 2.87Å; R732-A928 VanDerWaalsContact NH1-O 3.14Å; R732-A928 PolarHBondContact NH2-O 3.47Å
733	V	92.2	Very high	92.1	Very high	5 Å²	5	57.5 Å²	57.5	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-26	-167.8	72.2	0	0	0	0	113.3	S731 E735 T736 D737 F740 A741 T746 A747 T749	S731-V733 PolarHBondContact O-N 3.34Å; V733-E735 PolarHBondContact O-N 3.06Å; V733-T736 WeakPolarHBondContact CA-OG1 3.48Å; V733-T736 PolarHBondContact O-N 3.27Å; V733-D737 HydrophobicContact CG2-CB 3.98Å; V733-D737 CarbonylContact O-C 3.5Å; V733-D737 WeakPolarHBondContact O-CA 3.43Å; V733-D737 PolarHBondContact O-N 3.18Å; V733-F740 HydrophobicContact CG2-CB 4.38Å; V733-F740 HydrophobicContact CG2-CD1 3.63Å; V733-F740 HydrophobicContact CG2-CE1 4.41Å; V733-F740 HydrophobicContact CG2-CG 4.38Å; V733-A741 HydrophobicContact CG1-CB 3.82Å; V733-T746 HydrophobicContact CG1-CG2 4.16Å; V733-T746 WeakPolarHBondContact CG1-O 3.35Å; V733-A747 PolarHBondContact N-O 3.03Å; V733-T749 HydrophobicContact CB-CG2 4.19Å; V733-T749 HydrophobicContact CG2-CG2 4.24Å
734	L	88.3	Confident	91.8	Very high	50 Å²	50	60.8 Å²	60.8	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-24.9	171.5	-170.9	67.9	0	0	0	113.5	R732 P738 A741 L921 F925 Y927	R732-L734 VanDerWaalsContact C-N 3.25Å; R732-L734 PolarHBondContact O-N 3.47Å; L734-P738 WeakPolarHBondContact O-CG 3.41Å; L734-A741 HydrophobicContact CB-CB 4.19Å; L734-A741 HydrophobicContact CD1-CB 3.98Å; L734-L921 HydrophobicContact CD1-CD1 4.43Å; L734-L921 HydrophobicContact CD1-CD2 4.37Å; L734-L921 HydrophobicContact CD2-CD2 3.96Å; L734-F925 HydrophobicContact CD2-CD1 4.02Å; L734-Y927 HydrophobicContact CB-CE2 3.9Å; L734-Y927 VanDerWaalsContact CB-OH 3.24Å; L734-Y927 WeakPolarHBondContact CB-OH 3.43Å; L734-Y927 HydrophobicContact CD2-CE2 4.45Å; L734-Y927 PolarHBondContact N-OH 2.85Å
735	E	89.5	Confident	91.4	Very high	114 Å²	114	62.5 Å²	62.5	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-90.9	-39.5	174.5	-74.3	172.5	-168.6	0	0	111.8	R732 V733 Y927	R732-E735 HydrophobicContact CB-CB 4.46Å; R732-E735 IonicContact NH1-OE1 2.99Å; R732-E735 PolarHBondContact O-N 2.92Å; V733-E735 PolarHBondContact O-N 3.06Å; E735-Y927 HydrophobicContact CG-CD2 4.12Å; E735-Y927 HydrophobicContact CG-CE2 3.88Å; E735-Y927 WeakPolarHBondContact OE1-CD2 3.28Å
736	T	89.4	Confident	91.3	Very high	88 Å²	88	63 Å²	63	54%	0.54	33%	0.327	S	S	.	.	H	α-helix	trans	-87.9	-35.2	-173.9	57.6	0	0	0	0	114.1	R732 V733	R732-T736 PolarHBondContact O-N 3.01Å; R732-T736 VanDerWaalsContact O-N 3.13Å; R732-T736 PolarHBondContact O-OG1 3.38Å; V733-T736 WeakPolarHBondContact CA-OG1 3.48Å; V733-T736 PolarHBondContact O-N 3.27Å
737	D	90.4	Very high	91.1	Very high	74 Å²	74	59.6 Å²	59.6	40%	0.396	31%	0.309	S	S	.	.			trans	-145.9	80.8	175.5	-171.1	-16	0	0	0	111.4	V733 A739 F740 A741	V733-D737 HydrophobicContact CG2-CB 3.98Å; V733-D737 CarbonylContact O-C 3.5Å; V733-D737 WeakPolarHBondContact O-CA 3.43Å; V733-D737 PolarHBondContact O-N 3.18Å; D737-A739 PolarHBondContact O-N 2.92Å; D737-A739 VanDerWaalsContact O-N 3.15Å; D737-A739 PolarHBondContact OD1-N 3.42Å; D737-F740 HydrophobicContact CB-CB 4.17Å; D737-F740 PolarHBondContact O-N 3.17Å; D737-F740 PolarHBondContact OD1-N 3.49Å; D737-F740 VanDerWaalsContact OD1-N 3.14Å; D737-A741 PolarHBondContact O-N 2.81Å; D737-A741 VanDerWaalsContact O-N 3.09Å
738	P	90.1	Very high	90.9	Very high	63 Å²	63	58 Å²	58	41%	0.409	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-23	-176.7	-19.5	28.4	0	0	0	114.4	L734 K742	L734-P738 WeakPolarHBondContact O-CG 3.41Å; P738-K742 WeakPolarHBondContact O-CG 3.48Å; P738-K742 PolarHBondContact O-N 2.6Å
739	A	88.3	Confident	90.7	Very high	70 Å²	70	62 Å²	62	58%	0.579	33%	0.328	S	S	*	.	H	α-helix	trans	-72.8	-51.1	179.9	0	0	0	0	0	110	D737 A741 K742 E743	D737-A739 PolarHBondContact O-N 2.92Å; D737-A739 VanDerWaalsContact O-N 3.15Å; D737-A739 PolarHBondContact OD1-N 3.42Å; A739-A741 VanDerWaalsContact C-N 3.31Å; A739-A741 PolarHBondContact O-N 2.79Å; A739-K742 PolarHBondContact O-N 3.17Å; A739-E743 WeakPolarHBondContact O-CB 3.26Å; A739-E743 PolarHBondContact O-N 3.2Å
740	F	89.7	Confident	90.7	Very high	76 Å²	76	60.4 Å²	60.4	33%	0.333	32%	0.322	S	S	.	.	H	α-helix	trans	-58.3	-43.9	174.6	-178.5	-87.3	0	0	0	111.8	V733 D737 K742 E743 H744 T746	V733-F740 HydrophobicContact CG2-CB 4.38Å; V733-F740 HydrophobicContact CG2-CD1 3.63Å; V733-F740 HydrophobicContact CG2-CE1 4.41Å; V733-F740 HydrophobicContact CG2-CG 4.38Å; D737-F740 HydrophobicContact CB-CB 4.17Å; D737-F740 PolarHBondContact O-N 3.17Å; D737-F740 PolarHBondContact OD1-N 3.49Å; D737-F740 VanDerWaalsContact OD1-N 3.14Å; F740-K742 PolarHBondContact O-N 3.18Å; F740-E743 PolarHBondContact O-N 3.43Å; F740-H744 AromaticContact CD2-CE1 3.55Å; F740-H744 AromaticContact CD2-ND1 3.54Å; F740-H744 HydrophobicContact CE1-CB 4.37Å; F740-H744 AromaticContact CE2-CE1 3.34Å; F740-H744 WeakPolarHBondContact CE2-CE1 3.48Å; F740-H744 AromaticContact CE2-ND1 3.5Å; F740-H744 AromaticContact CE2-NE2 3.77Å; F740-H744 AromaticContact CG-ND1 3.85Å; F740-H744 AromaticContact CZ-CE1 3.96Å; F740-H744 AromaticContact CZ-CG 3.9Å; F740-H744 AromaticContact CZ-ND1 3.8Å; F740-H744 WeakPolarHBondContact O-CB 3.4Å; F740-H744 PolarHBondContact O-N 3.04Å; F740-H744 PolarHBondContact O-ND1 2.65Å; F740-T746 HydrophobicContact CE1-CG2 4.36Å
741	A	88.7	Confident	90.7	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-56.5	-47.7	180	0	0	0	0	0	112.4	V733 L734 D737 A739 G745 T746 L921	V733-A741 HydrophobicContact CG1-CB 3.82Å; L734-A741 HydrophobicContact CB-CB 4.19Å; L734-A741 HydrophobicContact CD1-CB 3.98Å; D737-A741 PolarHBondContact O-N 2.81Å; D737-A741 VanDerWaalsContact O-N 3.09Å; A739-A741 VanDerWaalsContact C-N 3.31Å; A739-A741 PolarHBondContact O-N 2.79Å; A741-G745 CarbonylContact O-C 3.54Å; A741-G745 WeakPolarHBondContact O-CA 3.06Å; A741-G745 PolarHBondContact O-N 3.05Å; A741-T746 WeakPolarHBondContact CA-O 3.36Å; A741-T746 WeakPolarHBondContact CB-O 3.39Å; A741-T746 PolarHBondContact O-N 2.96Å; A741-L921 HydrophobicContact CB-CD1 4.33Å; A741-L921 WeakPolarHBondContact O-CD1 3.39Å
742	K	87.2	Confident	90.6	Very high	156 Å²	156	57.3 Å²	57.3	68%	0.678	32%	0.316	S	S	*	.	H	α-helix	trans	-72	-38.8	-179.4	-71.9	176.6	-176.1	179.7	0	112.4	P738 A739 F740	P738-K742 WeakPolarHBondContact O-CG 3.48Å; P738-K742 PolarHBondContact O-N 2.6Å; A739-K742 PolarHBondContact O-N 3.17Å; F740-K742 PolarHBondContact O-N 3.18Å
743	E	88.9	Confident	90.5	Very high	156 Å²	156	62.7 Å²	62.7	73%	0.729	34%	0.341	S	S	*	.	H	α-helix	trans	-62.7	-44.4	177.5	-177.2	-178.4	-175.6	0	0	111.7	A739 F740	A739-E743 WeakPolarHBondContact O-CB 3.26Å; A739-E743 PolarHBondContact O-N 3.2Å; F740-E743 PolarHBondContact O-N 3.43Å
744	H	87	Confident	90.7	Very high	106 Å²	106	65.4 Å²	65.4	49%	0.491	35%	0.353	S	S	.	.	H	α-helix	trans	-93	-1.5	-177	-64	77.6	0	0	0	113.3	F740 T746	F740-H744 AromaticContact CD2-CE1 3.55Å; F740-H744 AromaticContact CD2-ND1 3.54Å; F740-H744 HydrophobicContact CE1-CB 4.37Å; F740-H744 AromaticContact CE2-CE1 3.34Å; F740-H744 WeakPolarHBondContact CE2-CE1 3.48Å; F740-H744 AromaticContact CE2-ND1 3.5Å; F740-H744 AromaticContact CE2-NE2 3.77Å; F740-H744 AromaticContact CG-ND1 3.85Å; F740-H744 AromaticContact CZ-CE1 3.96Å; F740-H744 AromaticContact CZ-CG 3.9Å; F740-H744 AromaticContact CZ-ND1 3.8Å; F740-H744 WeakPolarHBondContact O-CB 3.4Å; F740-H744 PolarHBondContact O-N 3.04Å; F740-H744 PolarHBondContact O-ND1 2.65Å; H744-T746 VanDerWaalsContact C-N 3.26Å; H744-T746 HydrophobicContact CB-CG2 4.04Å; H744-T746 PolarHBondContact O-N 2.92Å
745	G	89.4	Confident	91.1	Very high	35 Å²	35	63 Å²	63	36%	0.361	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	27.9	179.4	0	0	0	0	0	114.4	A741 A920 L921	A741-G745 CarbonylContact O-C 3.54Å; A741-G745 WeakPolarHBondContact O-CA 3.06Å; A741-G745 PolarHBondContact O-N 3.05Å; G745-A920 WeakPolarHBondContact O-CA 3.35Å; G745-L921 PolarHBondContact O-N 2.84Å
746	T	91.6	Very high	91.3	Very high	28 Å²	28	57.8 Å²	57.8	17%	0.172	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-122	141.1	-173.5	-174	0	0	0	0	113	V733 F740 A741 H744 S748 M919	V733-T746 HydrophobicContact CG1-CG2 4.16Å; V733-T746 WeakPolarHBondContact CG1-O 3.35Å; F740-T746 HydrophobicContact CE1-CG2 4.36Å; A741-T746 WeakPolarHBondContact CA-O 3.36Å; A741-T746 WeakPolarHBondContact CB-O 3.39Å; A741-T746 PolarHBondContact O-N 2.96Å; H744-T746 VanDerWaalsContact C-N 3.26Å; H744-T746 HydrophobicContact CB-CG2 4.04Å; H744-T746 PolarHBondContact O-N 2.92Å; T746-S748 PolarHBondContact OG1-N 3.24Å; T746-S748 PolarHBondContact OG1-O 3.14Å; T746-M919 CarbonylContact C-O 3.55Å; T746-M919 WeakPolarHBondContact CA-O 3.42Å; T746-M919 PolarHBondContact OG1-O 3.5Å
747	A	89.6	Confident	91.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.304	C	S	.	.	S	Bend	trans	-87.5	-8.5	172.4	0	0	0	0	0	112.7	V733 M919 L921 F925 Y927	V733-A747 PolarHBondContact N-O 3.03Å; A747-M919 PolarHBondContact N-O 3.45Å; A747-L921 HydrophobicContact CB-CD2 3.89Å; A747-F925 HydrophobicContact CB-CD1 4.37Å; A747-F925 HydrophobicContact CB-CE1 3.64Å; A747-F925 HydrophobicContact CB-CE2 3.83Å; A747-F925 HydrophobicContact CB-CZ 3.34Å; A747-Y927 HydrophobicContact CB-CE1 4.2Å; A747-Y927 PolarHBondContact O-OH 3.46Å
748	S	93.3	Very high	92	Very high	4 Å²	4	53 Å²	53	3%	0.028	29%	0.286	C	S	.	.			trans	-149.1	154.5	176.6	-174.3	0	0	0	0	113.5	S731 T746 L750	S731-S748 WeakPolarHBondContact CB-OG 3.5Å; S731-S748 WeakPolarHBondContact O-CA 3.36Å; S731-S748 PolarHBondContact O-OG 2.76Å; S731-S748 PolarHBondContact OG-OG 2.86Å; T746-S748 PolarHBondContact OG1-N 3.24Å; T746-S748 PolarHBondContact OG1-O 3.14Å; S748-L750 PolarHBondContact OG-N 2.97Å
749	T	93.2	Very high	92.4	Very high	84 Å²	84	50 Å²	50	52%	0.515	27%	0.266	S	S	.	.	S	Bend	trans	-75.9	-13.2	165.3	55	0	0	0	0	112.8	S731 V733	S731-T749 PolarHBondContact O-N 2.78Å; V733-T749 HydrophobicContact CB-CG2 4.19Å; V733-T749 HydrophobicContact CG2-CG2 4.24Å
750	L	94.4	Very high	92.9	Very high	9 Å²	9	47.1 Å²	47.1	5%	0.047	24%	0.242	C	C	.	.	S	Bend	trans	-93.8	140.4	177	-63.4	173.2	0	0	0	111.6	F727 L728 S748 L755 F758	F727-L750 HydrophobicContact CD1-CD1 4.32Å; F727-L750 HydrophobicContact CE1-CD1 4.16Å; F727-L750 HydrophobicContact CE1-CD2 3.82Å; F727-L750 HydrophobicContact CZ-CD2 4.43Å; L728-L750 HydrophobicContact CD2-CD1 4.05Å; S748-L750 PolarHBondContact OG-N 2.97Å; L750-L755 HydrophobicContact CB-CD2 4.23Å; L750-L755 HydrophobicContact CB-CG 4.37Å; L750-L755 HydrophobicContact CD1-CD2 3.9Å; L750-F758 HydrophobicContact CD1-CE2 4.24Å
751	T	93.5	Very high	93.3	Very high	69 Å²	69	44.1 Å²	44.1	42%	0.423	23%	0.229	S	C	.	.			trans	-87.4	159.6	175.7	63.9	0	0	0	0	111.9	Q753 Q754 L755	T751-Q753 PolarHBondContact O-N 2.86Å; T751-Q754 PolarHBondContact O-N 3.46Å; T751-Q754 VanDerWaalsContact O-N 3.16Å; T751-Q754 WeakPolarHBondContact OG1-CG 3.5Å; T751-Q754 PolarHBondContact OG1-N 3.01Å; T751-Q754 PolarHBondContact OG1-OE1 3.49Å; T751-L755 PolarHBondContact O-N 2.83Å; T751-L755 VanDerWaalsContact O-N 3.09Å
752	S	93.4	Very high	93.8	Very high	14 Å²	14	44.1 Å²	44.1	10%	0.098	23%	0.229	C	C	.	.	H	α-helix	trans	-54.5	-36.2	172.6	-178.3	0	0	0	0	112.7	L756 Y916 V917	S752-L756 WeakPolarHBondContact O-CG 3.24Å; S752-L756 PolarHBondContact O-N 3.32Å; S752-L756 VanDerWaalsContact O-N 3.09Å; S752-Y916 PolarHBondContact OG-N 3.46Å; S752-Y916 VanDerWaalsContact OG-N 3.07Å; S752-V917 WeakPolarHBondContact CB-O 3.2Å; S752-V917 PolarHBondContact OG-N 3.15Å
753	Q	92.8	Very high	94.3	Very high	116 Å²	116	36.7 Å²	36.7	54%	0.542	20%	0.197	S	C	.	.	H	α-helix	trans	-69.2	-41.2	179.6	-79.5	176.4	-25	0	0	111.8	T751 L756 Q757	T751-Q753 PolarHBondContact O-N 2.86Å; Q753-L756 PolarHBondContact O-N 2.94Å; Q753-Q757 WeakPolarHBondContact O-CB 3.3Å; Q753-Q757 PolarHBondContact O-N 3.12Å
754	Q	95.4	Very high	94.7	Very high	61 Å²	61	31.1 Å²	31.1	29%	0.285	17%	0.174	S	C	.	.	H	α-helix	trans	-65.2	-41.2	176.5	-73.3	164.7	-49.6	0	0	111.9	T751 Q757 F758	T751-Q754 PolarHBondContact O-N 3.46Å; T751-Q754 VanDerWaalsContact O-N 3.16Å; T751-Q754 WeakPolarHBondContact OG1-CG 3.5Å; T751-Q754 PolarHBondContact OG1-N 3.01Å; T751-Q754 PolarHBondContact OG1-OE1 3.49Å; Q754-Q757 WeakPolarHBondContact O-CB 3.24Å; Q754-Q757 PolarHBondContact O-N 3.29Å; Q754-F758 VanDerWaalsContact O-CD2 3.29Å; Q754-F758 WeakPolarHBondContact O-CD2 3.41Å; Q754-F758 WeakPolarHBondContact O-CG 3.5Å; Q754-F758 PolarHBondContact O-N 2.86Å
755	L	96.6	Very high	95.2	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-44.8	175.8	-66.3	176.3	0	0	0	111.8	L728 L750 T751 Q757 F758 A759 I845 L848 V917 M919	L728-L755 HydrophobicContact CD2-CD2 3.5Å; L728-L755 VanDerWaalsContact CD2-CD2 3.5Å; L750-L755 HydrophobicContact CB-CD2 4.23Å; L750-L755 HydrophobicContact CB-CG 4.37Å; L750-L755 HydrophobicContact CD1-CD2 3.9Å; T751-L755 PolarHBondContact O-N 2.83Å; T751-L755 VanDerWaalsContact O-N 3.09Å; L755-Q757 VanDerWaalsContact C-N 3.32Å; L755-Q757 PolarHBondContact O-N 2.95Å; L755-F758 HydrophobicContact CD2-CD2 4.48Å; L755-F758 PolarHBondContact O-N 2.83Å; L755-A759 PolarHBondContact O-N 2.79Å; L755-I845 HydrophobicContact CB-CG2 3.88Å; L755-I845 HydrophobicContact CD2-CG2 4Å; L755-I845 WeakPolarHBondContact O-CG2 3.5Å; L755-L848 HydrophobicContact CD1-CD2 3.98Å; L755-L848 HydrophobicContact CD2-CD2 4.03Å; L755-V917 HydrophobicContact CD1-CB 4.14Å; L755-V917 HydrophobicContact CD1-CG1 3.89Å; L755-V917 HydrophobicContact CD1-CG2 4.3Å; L755-M919 HydrophobicContact CD1-SD 4.11Å
756	L	95.5	Very high	95.6	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-65.3	-35.4	174.1	-72.2	179.7	0	0	0	112.1	S752 Q753 F758 A759 V760 V881 L906 M909 Q910 Y916	S752-L756 WeakPolarHBondContact O-CG 3.24Å; S752-L756 PolarHBondContact O-N 3.32Å; S752-L756 VanDerWaalsContact O-N 3.09Å; Q753-L756 PolarHBondContact O-N 2.94Å; L756-F758 PolarHBondContact O-N 3.33Å; L756-A759 WeakPolarHBondContact O-CB 3.14Å; L756-A759 PolarHBondContact O-N 3.36Å; L756-A759 VanDerWaalsContact O-N 3.14Å; L756-V760 WeakPolarHBondContact O-CG2 3.49Å; L756-V760 PolarHBondContact O-N 2.79Å; L756-V881 HydrophobicContact CD2-CG2 4.26Å; L756-L906 HydrophobicContact CD2-CD2 4.23Å; L756-M909 HydrophobicContact CD1-CB 4.04Å; L756-Q910 HydrophobicContact CB-CB 4.2Å; L756-Q910 HydrophobicContact CB-CG 4.44Å; L756-Y916 HydrophobicContact CD1-CD2 3.69Å; L756-Y916 HydrophobicContact CD1-CG 4.1Å
757	Q	96.4	Very high	95.8	Very high	58 Å²	58	26.8 Å²	26.8	27%	0.271	14%	0.142	S	C	.	.	H	α-helix	trans	-60.2	-44.5	175.7	-172.9	62.1	51	0	0	111.4	Q753 Q754 L755 A759 V760 D761	Q753-Q757 WeakPolarHBondContact O-CB 3.3Å; Q753-Q757 PolarHBondContact O-N 3.12Å; Q754-Q757 WeakPolarHBondContact O-CB 3.24Å; Q754-Q757 PolarHBondContact O-N 3.29Å; L755-Q757 VanDerWaalsContact C-N 3.32Å; L755-Q757 PolarHBondContact O-N 2.95Å; Q757-A759 VanDerWaalsContact C-N 3.27Å; Q757-A759 PolarHBondContact O-N 3.44Å; Q757-V760 PolarHBondContact O-N 3.38Å; Q757-D761 PolarHBondContact NE2-OD1 3.4Å; Q757-D761 WeakPolarHBondContact O-CB 3.38Å; Q757-D761 VanDerWaalsContact O-CG 3.29Å; Q757-D761 PolarHBondContact O-N 3.43Å
758	F	98.3	Very high	96.1	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.009	15%	0.151	C	C	.	.	H	α-helix	trans	-58.3	-41.1	174.4	-62.9	-45.7	0	0	0	112	L724 F727 L750 Q754 L755 L756 D761 V762 V786 L790 A792 I845	L724-F758 HydrophobicContact CD1-CB 4.4Å; L724-F758 HydrophobicContact CD1-CD1 4.2Å; L724-F758 HydrophobicContact CD1-CD2 3.77Å; L724-F758 HydrophobicContact CD1-CE1 4.4Å; L724-F758 HydrophobicContact CD1-CE2 4.01Å; L724-F758 HydrophobicContact CD1-CG 3.88Å; L724-F758 HydrophobicContact CD1-CZ 4.32Å; L724-F758 HydrophobicContact CD2-CB 4.32Å; F727-F758 HydrophobicContact CD1-CE2 4.41Å; F727-F758 HydrophobicContact CD1-CZ 4.18Å; F727-F758 HydrophobicContact CE1-CE2 4.26Å; F727-F758 AromaticContact CE1-CZ 3.82Å; F727-F758 HydrophobicContact CE1-CZ 3.82Å; L750-F758 HydrophobicContact CD1-CE2 4.24Å; Q754-F758 VanDerWaalsContact O-CD2 3.29Å; Q754-F758 WeakPolarHBondContact O-CD2 3.41Å; Q754-F758 WeakPolarHBondContact O-CG 3.5Å; Q754-F758 PolarHBondContact O-N 2.86Å; L755-F758 HydrophobicContact CD2-CD2 4.48Å; L755-F758 PolarHBondContact O-N 2.83Å; L756-F758 PolarHBondContact O-N 3.33Å; F758-D761 PolarHBondContact O-N 3.14Å; F758-V762 VanDerWaalsContact O-CG2 3.28Å; F758-V762 WeakPolarHBondContact O-CG2 3.41Å; F758-V762 PolarHBondContact O-N 3.34Å; F758-V786 HydrophobicContact CE1-CG1 4.13Å; F758-V786 HydrophobicContact CE1-CG2 4.35Å; F758-V786 HydrophobicContact CZ-CG1 4.49Å; F758-L790 HydrophobicContact CE1-CB 4.26Å; F758-L790 VanDerWaalsContact CE1-O 3.25Å; F758-L790 WeakPolarHBondContact CE1-O 3.27Å; F758-L790 HydrophobicContact CZ-CB 4.49Å; F758-A792 HydrophobicContact CB-CB 4.38Å; F758-A792 HydrophobicContact CD1-CB 3.83Å; F758-I845 HydrophobicContact CB-CD1 4.09Å
759	A	98.3	Very high	96	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.6	-40.4	177	0	0	0	0	0	112.6	L755 L756 Q757 A763 L842 I845 L906	L755-A759 PolarHBondContact O-N 2.79Å; L756-A759 WeakPolarHBondContact O-CB 3.14Å; L756-A759 PolarHBondContact O-N 3.36Å; L756-A759 VanDerWaalsContact O-N 3.14Å; Q757-A759 VanDerWaalsContact C-N 3.27Å; Q757-A759 PolarHBondContact O-N 3.44Å; A759-A763 VanDerWaalsContact O-CB 3.27Å; A759-A763 WeakPolarHBondContact O-CB 3.4Å; A759-A763 PolarHBondContact O-N 3.41Å; A759-L842 HydrophobicContact CB-CD1 3.68Å; A759-I845 HydrophobicContact CB-CD1 4.09Å; A759-L906 HydrophobicContact CB-CD1 3.93Å; A759-L906 HydrophobicContact CB-CD2 4.23Å
760	V	98	Very high	95.8	Very high	11 Å²	11	26.6 Å²	26.6	7%	0.067	14%	0.136	C	C	.	.	H	α-helix	trans	-61.9	-47.6	175	170.2	0	0	0	0	110.7	L756 Q757 A763 T764 L906 Q910	L756-V760 WeakPolarHBondContact O-CG2 3.49Å; L756-V760 PolarHBondContact O-N 2.79Å; Q757-V760 PolarHBondContact O-N 3.38Å; V760-A763 PolarHBondContact O-N 2.92Å; V760-T764 WeakPolarHBondContact O-CB 3.07Å; V760-T764 PolarHBondContact O-N 3.3Å; V760-T764 PolarHBondContact O-OG1 3.32Å; V760-L906 HydrophobicContact CG2-CB 3.59Å; V760-Q910 HydrophobicContact CG2-CB 4.21Å
761	D	98.3	Very high	95.6	Very high	13 Å²	13	31.5 Å²	31.5	7%	0.07	16%	0.162	C	C	.	.	H	α-helix	trans	-58.5	-50.2	179.5	-78.4	-3	0	0	0	111.1	N698 Q757 F758 T764 G765 A792	N698-D761 WeakPolarHBondContact CB-O 3.2Å; N698-D761 WeakPolarHBondContact ND2-CA 3.19Å; N698-D761 WeakPolarHBondContact ND2-CB 3.44Å; N698-D761 PolarHBondContact ND2-OD1 3.36Å; Q757-D761 PolarHBondContact NE2-OD1 3.4Å; Q757-D761 WeakPolarHBondContact O-CB 3.38Å; Q757-D761 VanDerWaalsContact O-CG 3.29Å; Q757-D761 PolarHBondContact O-N 3.43Å; F758-D761 PolarHBondContact O-N 3.14Å; D761-T764 PolarHBondContact O-N 3.3Å; D761-G765 PolarHBondContact O-N 3.45Å; D761-A792 HydrophobicContact CB-CB 3.71Å; D761-A792 PolarHBondContact OD2-N 3.06Å
762	V	98.5	Very high	95.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-43.2	177.9	176.1	0	0	0	0	111.2	F758 T764 G765 M766 L779 V784 A792 I794 F838 L841	F758-V762 VanDerWaalsContact O-CG2 3.28Å; F758-V762 WeakPolarHBondContact O-CG2 3.41Å; F758-V762 PolarHBondContact O-N 3.34Å; V762-T764 VanDerWaalsContact C-N 3.27Å; V762-T764 PolarHBondContact O-N 2.9Å; V762-G765 PolarHBondContact O-N 2.9Å; V762-M766 HydrophobicContact CG1-CG 4.35Å; V762-M766 WeakPolarHBondContact O-CB 3.47Å; V762-M766 WeakPolarHBondContact O-CG 3.36Å; V762-M766 PolarHBondContact O-N 2.84Å; V762-L779 HydrophobicContact CG1-CD1 4.13Å; V762-V784 HydrophobicContact CG2-CB 4.49Å; V762-V784 HydrophobicContact CG2-CG1 3.8Å; V762-V784 HydrophobicContact CG2-CG2 3.87Å; V762-A792 HydrophobicContact CG2-CB 4.23Å; V762-I794 HydrophobicContact CG1-CD1 4.42Å; V762-I794 HydrophobicContact CG1-CG1 4.3Å; V762-F838 HydrophobicContact CB-CE2 4.18Å; V762-F838 HydrophobicContact CG1-CD2 3.92Å; V762-F838 HydrophobicContact CG1-CE2 3.93Å; V762-L841 HydrophobicContact CG1-CD1 4Å; V762-L841 HydrophobicContact CG1-CD2 4.21Å; V762-L841 HydrophobicContact CG2-CD2 4.49Å
763	A	98.3	Very high	94.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-37.2	177.5	0	0	0	0	0	112	A759 V760 H767 F838 I902 L906	A759-A763 VanDerWaalsContact O-CB 3.27Å; A759-A763 WeakPolarHBondContact O-CB 3.4Å; A759-A763 PolarHBondContact O-N 3.41Å; V760-A763 PolarHBondContact O-N 2.92Å; A763-H767 WeakPolarHBondContact O-CB 3.38Å; A763-H767 PolarHBondContact O-N 2.9Å; A763-F838 HydrophobicContact CB-CE2 3.88Å; A763-F838 HydrophobicContact CB-CZ 3.89Å; A763-I902 HydrophobicContact CB-CG2 4.01Å; A763-L906 HydrophobicContact CB-CD1 4.11Å
764	T	97.8	Very high	94.4	Very high	39 Å²	39	32 Å²	32	24%	0.239	16%	0.157	C	C	.	.	H	α-helix	trans	-69.4	-44.1	178.2	-56.4	0	0	0	0	111.3	V760 D761 V762 H767 Y768 S903	V760-T764 WeakPolarHBondContact O-CB 3.07Å; V760-T764 PolarHBondContact O-N 3.3Å; V760-T764 PolarHBondContact O-OG1 3.32Å; D761-T764 PolarHBondContact O-N 3.3Å; V762-T764 VanDerWaalsContact C-N 3.27Å; V762-T764 PolarHBondContact O-N 2.9Å; T764-H767 WeakPolarHBondContact O-CB 3.38Å; T764-H767 PolarHBondContact O-N 3.37Å; T764-Y768 PolarHBondContact O-N 3.01Å; T764-Y768 VanDerWaalsContact O-N 3.11Å; T764-S903 PolarHBondContact OG1-OG 3.34Å
765	G	96.9	Very high	94	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-41.2	173.3	0	0	0	0	0	113	D761 V762 Y768 L769 I794	D761-G765 PolarHBondContact O-N 3.45Å; V762-G765 PolarHBondContact O-N 2.9Å; G765-Y768 WeakPolarHBondContact O-CB 3.48Å; G765-Y768 PolarHBondContact O-N 2.95Å; G765-L769 PolarHBondContact O-N 3.4Å; G765-I794 VanDerWaalsContact C-CD1 3.49Å
766	M	97.6	Very high	93.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-70.5	-31.7	177.1	-74.5	-56.5	-55	0	0	113.2	V762 L769 S770 H776 L779 I794 D834 F899	V762-M766 HydrophobicContact CG1-CG 4.35Å; V762-M766 WeakPolarHBondContact O-CB 3.47Å; V762-M766 WeakPolarHBondContact O-CG 3.36Å; V762-M766 PolarHBondContact O-N 2.84Å; M766-L769 HydrophobicContact CE-CD1 4.45Å; M766-L769 PolarHBondContact O-N 2.89Å; M766-L769 HydrophobicContact SD-CD1 3.58Å; M766-L769 VanDerWaalsContact SD-CD1 3.58Å; M766-S770 WeakPolarHBondContact O-CB 3.38Å; M766-S770 PolarHBondContact O-N 3.31Å; M766-H776 HydrophobicContact CE-CB 3.91Å; M766-H776 HydrophobicContact SD-CB 4.1Å; M766-L779 HydrophobicContact CE-CD2 4.26Å; M766-L779 HydrophobicContact CG-CD1 4.27Å; M766-L779 HydrophobicContact CG-CD2 3.72Å; M766-L779 HydrophobicContact SD-CD1 3.95Å; M766-L779 HydrophobicContact SD-CD2 3.88Å; M766-L779 HydrophobicContact SD-CG 4.43Å; M766-I794 HydrophobicContact CB-CD1 4.42Å; M766-I794 HydrophobicContact CG-CD1 3.66Å; M766-I794 HydrophobicContact SD-CD1 3.81Å; M766-D834 HydrophobicContact CE-CB 3.67Å; M766-F899 HydrophobicContact CB-CD1 3.49Å; M766-F899 VanDerWaalsContact CB-CD1 3.49Å; M766-F899 HydrophobicContact CB-CD2 3.82Å; M766-F899 HydrophobicContact CB-CE1 3.41Å; M766-F899 VanDerWaalsContact CB-CE1 3.41Å; M766-F899 HydrophobicContact CB-CE2 3.76Å; M766-F899 HydrophobicContact CB-CG 3.69Å; M766-F899 HydrophobicContact CB-CZ 3.56Å; M766-F899 HydrophobicContact CE-CE2 3.68Å; M766-F899 HydrophobicContact CE-CZ 3.79Å; M766-F899 HydrophobicContact CG-CD1 4.39Å; M766-F899 HydrophobicContact CG-CE1 3.85Å; M766-F899 HydrophobicContact CG-CE2 4.36Å; M766-F899 HydrophobicContact CG-CZ 3.83Å
767	H	96	Very high	93.4	Very high	77 Å²	77	29.7 Å²	29.7	36%	0.356	15%	0.145	S	C	.	.	H	α-helix	trans	-60.6	-48.2	169.5	174.9	-151.7	0	0	0	110.6	A763 T764 L769 S770 D771 F899	A763-H767 WeakPolarHBondContact O-CB 3.38Å; A763-H767 PolarHBondContact O-N 2.9Å; T764-H767 WeakPolarHBondContact O-CB 3.38Å; T764-H767 PolarHBondContact O-N 3.37Å; H767-L769 PolarHBondContact O-N 2.81Å; H767-S770 PolarHBondContact O-N 3.3Å; H767-D771 WeakPolarHBondContact O-CB 3.47Å; H767-D771 PolarHBondContact O-N 3.25Å; H767-F899 HydrophobicContact CB-CB 3.86Å
768	Y	95.3	Very high	93.1	Very high	52 Å²	52	27.8 Å²	27.8	20%	0.204	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-45.8	176.3	-179.4	-98.9	0	0	0	112.5	L693 H696 I699 T764 G765 S770 D771 K772	L693-Y768 HydrophobicContact CD2-CE1 4.42Å; L693-Y768 WeakPolarHBondContact O-CE1 3.13Å; L693-Y768 PolarHBondContact O-OH 3.29Å; H696-Y768 HydrophobicContact CB-CD1 4.12Å; H696-Y768 HydrophobicContact CB-CE1 4.08Å; H696-Y768 AromaticContact CD2-CD1 3.9Å; H696-Y768 AromaticContact CD2-CD2 3.64Å; H696-Y768 AromaticContact CD2-CG 3.48Å; H696-Y768 VanDerWaalsContact CD2-CG 3.48Å; H696-Y768 AromaticContact CG-CD1 3.99Å; H696-Y768 AromaticContact NE2-CG 3.96Å; I699-Y768 HydrophobicContact CD1-CD1 3.51Å; I699-Y768 HydrophobicContact CD1-CE1 4.13Å; I699-Y768 HydrophobicContact CD1-CG 4.5Å; T764-Y768 PolarHBondContact O-N 3.01Å; T764-Y768 VanDerWaalsContact O-N 3.11Å; G765-Y768 WeakPolarHBondContact O-CB 3.48Å; G765-Y768 PolarHBondContact O-N 2.95Å; Y768-S770 PolarHBondContact O-N 2.73Å; Y768-D771 PolarHBondContact O-N 3.33Å; Y768-K772 HydrophobicContact CD1-CG 4.44Å; Y768-K772 HydrophobicContact CE1-CG 4.12Å; Y768-K772 HydrophobicContact CE2-CG 4.33Å; Y768-K772 VanDerWaalsContact O-CG 3.32Å; Y768-K772 WeakPolarHBondContact O-CG 3.33Å; Y768-K772 PolarHBondContact O-N 2.84Å; Y768-K772 VanDerWaalsContact OH-CE 3.32Å; Y768-K772 WeakPolarHBondContact OH-CE 3.45Å
769	L	92.3	Very high	93	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-57	-48.4	175.2	-79.9	159.9	0	0	0	112	L693 I699 G765 M766 H767 D771 K772 Q773 F774 I794 F797	L693-L769 HydrophobicContact CD1-CD2 3.48Å; L693-L769 VanDerWaalsContact CD1-CD2 3.48Å; L693-L769 HydrophobicContact CD2-CD2 3.63Å; L693-L769 HydrophobicContact CG-CD2 4.21Å; I699-L769 HydrophobicContact CD1-CD1 4.17Å; I699-L769 HydrophobicContact CD1-CD2 4.19Å; I699-L769 HydrophobicContact CD1-CG 3.76Å; G765-L769 PolarHBondContact O-N 3.4Å; M766-L769 HydrophobicContact CE-CD1 4.45Å; M766-L769 PolarHBondContact O-N 2.89Å; M766-L769 HydrophobicContact SD-CD1 3.58Å; M766-L769 VanDerWaalsContact SD-CD1 3.58Å; H767-L769 PolarHBondContact O-N 2.81Å; L769-D771 PolarHBondContact O-N 3.03Å; L769-K772 CarbonylContact O-C 3.6Å; L769-K772 PolarHBondContact O-N 2.91Å; L769-Q773 PolarHBondContact O-N 2.84Å; L769-F774 HydrophobicContact CD2-CB 3.98Å; L769-F774 PolarHBondContact O-N 3.11Å; L769-I794 HydrophobicContact CD1-CD1 3.96Å; L769-I794 HydrophobicContact CD1-CG2 4.26Å; L769-F797 HydrophobicContact CD1-CE1 3.95Å; L769-F797 HydrophobicContact CD1-CZ 4.41Å; L769-F797 HydrophobicContact CD2-CD1 4.47Å; L769-F797 HydrophobicContact CD2-CE1 3.65Å; L769-F797 HydrophobicContact CD2-CZ 4.37Å; L769-F797 HydrophobicContact CG-CE1 4.45Å
770	S	89.4	Confident	92.8	Very high	31 Å²	31	27.7 Å²	27.7	22%	0.217	14%	0.137	C	C	.	.	H	α-helix	trans	-65.3	-38.2	-179.7	-176.9	0	0	0	0	112.3	M766 H767 Y768 K772 Q773 S831	M766-S770 WeakPolarHBondContact O-CB 3.38Å; M766-S770 PolarHBondContact O-N 3.31Å; H767-S770 PolarHBondContact O-N 3.3Å; Y768-S770 PolarHBondContact O-N 2.73Å; S770-K772 VanDerWaalsContact C-N 3.29Å; S770-Q773 PolarHBondContact O-N 2.77Å; S770-Q773 PolarHBondContact O-NE2 2.82Å; S770-S831 WeakPolarHBondContact OG-CB 3.19Å
771	D	88.3	Confident	92.7	Very high	112 Å²	112	27.2 Å²	27.2	60%	0.599	13%	0.134	S	C	*	.	H	α-helix	trans	-65.1	-37.4	177.3	-168.3	52.6	0	0	0	111	H767 Y768 L769 Q773	H767-D771 WeakPolarHBondContact O-CB 3.47Å; H767-D771 PolarHBondContact O-N 3.25Å; Y768-D771 PolarHBondContact O-N 3.33Å; L769-D771 PolarHBondContact O-N 3.03Å; D771-Q773 PolarHBondContact O-N 3.13Å; D771-Q773 PolarHBondContact O-NE2 3.38Å
772	K	86.1	Confident	92.5	Very high	99 Å²	99	30.2 Å²	30.2	43%	0.43	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	5.3	171.7	-64.5	-68.7	-177	175	0	114.3	L693 Y768 L769 S770 F774	L693-K772 HydrophobicContact CD2-CB 4.2Å; L693-K772 HydrophobicContact CD2-CG 4.49Å; Y768-K772 HydrophobicContact CD1-CG 4.44Å; Y768-K772 HydrophobicContact CE1-CG 4.12Å; Y768-K772 HydrophobicContact CE2-CG 4.33Å; Y768-K772 VanDerWaalsContact O-CG 3.32Å; Y768-K772 WeakPolarHBondContact O-CG 3.33Å; Y768-K772 PolarHBondContact O-N 2.84Å; Y768-K772 VanDerWaalsContact OH-CE 3.32Å; Y768-K772 WeakPolarHBondContact OH-CE 3.45Å; L769-K772 CarbonylContact O-C 3.6Å; L769-K772 PolarHBondContact O-N 2.91Å; S770-K772 VanDerWaalsContact C-N 3.29Å; K772-F774 VanDerWaalsContact C-N 3.31Å; K772-F774 HydrophobicContact CB-CD2 3.78Å; K772-F774 HydrophobicContact CB-CE2 4.21Å; K772-F774 VanDerWaalsContact O-CD2 3.23Å; K772-F774 WeakPolarHBondContact O-CD2 3.49Å; K772-F774 PolarHBondContact O-N 2.84Å
773	Q	83.4	Confident	92.2	Very high	91 Å²	91	30.9 Å²	30.9	43%	0.425	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	32.9	179.7	-50.3	-57.7	-46.4	0	0	114	L769 S770 D771 G802 E803 E804	L769-Q773 PolarHBondContact O-N 2.84Å; S770-Q773 PolarHBondContact O-N 2.77Å; S770-Q773 PolarHBondContact O-NE2 2.82Å; D771-Q773 PolarHBondContact O-N 3.13Å; D771-Q773 PolarHBondContact O-NE2 3.38Å; Q773-G802 CarbonylContact O-C 3.59Å; Q773-G802 WeakPolarHBondContact O-CA 3.22Å; Q773-E803 PolarHBondContact O-N 3.14Å; Q773-E804 PolarHBondContact OE1-OE1 2.98Å
774	F	85.5	Confident	92.1	Very high	19 Å²	19	30.9 Å²	30.9	8%	0.083	15%	0.147	C	C	.	.			trans	-101.1	140.2	171.4	-74.9	-91.4	0	0	0	111.3	V689 K692 L693 L769 K772	V689-F774 HydrophobicContact CB-CE1 4.32Å; V689-F774 HydrophobicContact CG1-CD1 4.02Å; V689-F774 HydrophobicContact CG1-CE1 4.01Å; V689-F774 HydrophobicContact CG2-CD1 4.31Å; V689-F774 HydrophobicContact CG2-CE1 3.96Å; K692-F774 HydrophobicContact CB-CE2 4.32Å; K692-F774 HydrophobicContact CB-CZ 3.76Å; K692-F774 HydrophobicContact CD-CZ 4.03Å; L693-F774 HydrophobicContact CD2-CD2 3.5Å; L693-F774 VanDerWaalsContact CD2-CD2 3.5Å; L693-F774 HydrophobicContact CD2-CE2 3.79Å; L693-F774 HydrophobicContact CD2-CG 4.01Å; L693-F774 HydrophobicContact CG-CD2 4.43Å; L693-F774 HydrophobicContact CG-CE2 4.41Å; L769-F774 HydrophobicContact CD2-CB 3.98Å; L769-F774 PolarHBondContact O-N 3.11Å; K772-F774 VanDerWaalsContact C-N 3.31Å; K772-F774 HydrophobicContact CB-CD2 3.78Å; K772-F774 HydrophobicContact CB-CE2 4.21Å; K772-F774 VanDerWaalsContact O-CD2 3.23Å; K772-F774 WeakPolarHBondContact O-CD2 3.49Å; K772-F774 PolarHBondContact O-N 2.84Å
775	I	87.4	Confident	92.1	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.015	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-109.4	126.8	170.7	-52.6	166.3	0	0	0	108	R777 S800 R801 E803 Y829 D834	I775-R777 HydrophobicContact CB-CG 4.22Å; I775-R777 HydrophobicContact CG2-CG 3.57Å; I775-S800 VanDerWaalsContact O-CA 3.26Å; I775-S800 WeakPolarHBondContact O-CA 3.14Å; I775-S800 WeakPolarHBondContact O-CB 3.05Å; I775-R801 PolarHBondContact N-O 2.98Å; I775-R801 PolarHBondContact O-N 3.1Å; I775-E803 WeakPolarHBondContact CD1-O 3.2Å; I775-E803 WeakPolarHBondContact CG1-O 3.01Å; I775-Y829 WeakPolarHBondContact CD1-O 3.29Å; I775-D834 WeakPolarHBondContact CA-OD2 3.28Å; I775-D834 VanDerWaalsContact CG2-OD2 3.28Å; I775-D834 WeakPolarHBondContact CG2-OD2 3.47Å
776	H	91.1	Very high	92.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.146	C	C	.	.			trans	-72.6	-49.5	-177.6	-167.7	-78.3	0	0	0	112	M766 D778 L779 I794 A795 F797 S800 D834	M766-H776 HydrophobicContact CE-CB 3.91Å; M766-H776 HydrophobicContact SD-CB 4.1Å; H776-D778 PolarHBondContact CE1-O 2.89Å; H776-D778 VanDerWaalsContact CE1-O 3.24Å; H776-D778 PolarHBondContact ND1-N 3.26Å; H776-D778 PolarHBondContact ND1-O 3.5Å; H776-D778 PolarHBondContact O-N 2.88Å; H776-D778 VanDerWaalsContact O-N 3.13Å; H776-L779 PolarHBondContact ND1-N 2.86Å; H776-L779 VanDerWaalsContact ND1-N 3.19Å; H776-I794 VanDerWaalsContact CD2-CG2 3.47Å; H776-I794 WeakPolarHBondContact CD2-CG2 3.08Å; H776-I794 VanDerWaalsContact NE2-CG2 3.34Å; H776-I794 WeakPolarHBondContact NE2-CG2 3.29Å; H776-A795 PolarHBondContact NE2-O 3.2Å; H776-F797 AromaticContact CD2-CE1 3.77Å; H776-S800 PolarHBondContact O-OG 3.39Å; H776-D834 PolarHBondContact N-OD2 2.79Å
777	R	88.8	Confident	91.9	Very high	14 Å²	14	30.9 Å²	30.9	5%	0.053	15%	0.146	C	C	.	.	S	Bend	trans	70.7	-17.1	178.1	-50.6	-172	-169.9	153.4	-1.1	117.9	I775 L799 R801 Y806 Y829 D834	I775-R777 HydrophobicContact CB-CG 4.22Å; I775-R777 HydrophobicContact CG2-CG 3.57Å; R777-L799 WeakPolarHBondContact CD-O 3.05Å; R777-L799 PolarHBondContact NH1-O 2.81Å; R777-R801 VanDerWaalsContact NH2-CB 3.26Å; R777-R801 VanDerWaalsContact NH2-CG 3.31Å; R777-Y806 VanDerWaalsContact CZ-CB 3.45Å; R777-Y829 HydrophobicContact CB-CD1 3.87Å; R777-Y829 HydrophobicContact CB-CE1 4.23Å; R777-Y829 HydrophobicContact CG-CD1 3.81Å; R777-Y829 HydrophobicContact CG-CG 4Å; R777-D834 PolarHBondContact N-OD1 3.41Å
778	D	89.6	Confident	91.6	Very high	19 Å²	19	32.3 Å²	32.3	10%	0.102	16%	0.156	C	C	.	.			trans	-133	49.2	172.7	-165.8	19.8	0	0	0	112.5	H776 A780 R782 N783 L799 P815	H776-D778 PolarHBondContact CE1-O 2.89Å; H776-D778 VanDerWaalsContact CE1-O 3.24Å; H776-D778 PolarHBondContact ND1-N 3.26Å; H776-D778 PolarHBondContact ND1-O 3.5Å; H776-D778 PolarHBondContact O-N 2.88Å; H776-D778 VanDerWaalsContact O-N 3.13Å; D778-A780 PolarHBondContact O-N 2.82Å; D778-R782 VanDerWaalsContact CG-NH2 3.27Å; D778-R782 IonicContact OD1-CZ 2.91Å; D778-R782 IonicContact OD1-NH2 3.41Å; D778-R782 PolarHBondContact OD1-NH2 2.85Å; D778-R782 IonicContact OD2-NH2 2.84Å; D778-R782 PolarHBondContact OD2-NH2 3.28Å; D778-R782 VanDerWaalsContact OD2-NH2 3.11Å; D778-N783 VanDerWaalsContact CG-ND2 3.27Å; D778-N783 PolarHBondContact O-ND2 2.62Å; D778-N783 PolarHBondContact OD2-ND2 3.45Å; D778-L799 HydrophobicContact CB-CD1 4.11Å; D778-P815 HydrophobicContact CB-CG 4.33Å; D778-P815 WeakPolarHBondContact OD1-CB 3.36Å; D778-P815 WeakPolarHBondContact OD1-CG 3.16Å
779	L	95.7	Very high	91.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.			trans	-76.4	115.8	178.9	-176.4	67.4	0	0	0	110	V762 M766 H776 I794 S837 F838 L841 F899	V762-L779 HydrophobicContact CG1-CD1 4.13Å; M766-L779 HydrophobicContact CE-CD2 4.26Å; M766-L779 HydrophobicContact CG-CD1 4.27Å; M766-L779 HydrophobicContact CG-CD2 3.72Å; M766-L779 HydrophobicContact SD-CD1 3.95Å; M766-L779 HydrophobicContact SD-CD2 3.88Å; M766-L779 HydrophobicContact SD-CG 4.43Å; H776-L779 PolarHBondContact ND1-N 2.86Å; H776-L779 VanDerWaalsContact ND1-N 3.19Å; L779-I794 HydrophobicContact CD1-CG2 4.35Å; L779-S837 WeakPolarHBondContact O-CB 3.5Å; L779-F838 HydrophobicContact CD2-CB 3.86Å; L779-F838 HydrophobicContact CD2-CD2 4.32Å; L779-L841 HydrophobicContact CD1-CD1 3.97Å; L779-L841 HydrophobicContact CG-CD1 3.9Å; L779-F899 HydrophobicContact CD2-CZ 4.41Å
780	A	95.1	Very high	91.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-156.3	160.3	-179.7	0	0	0	0	0	110.3	D778 R782 N783 V784 W818	D778-A780 PolarHBondContact O-N 2.82Å; A780-R782 HydrophobicContact CB-CG 4.05Å; A780-R782 VanDerWaalsContact CB-NH1 3.3Å; A780-R782 PolarHBondContact O-N 3.14Å; A780-R782 VanDerWaalsContact O-N 3.16Å; A780-N783 PolarHBondContact O-N 3.36Å; A780-V784 PolarHBondContact O-N 2.83Å; A780-W818 HydrophobicContact CB-CD2 4.03Å; A780-W818 HydrophobicContact CB-CG 4.01Å; A780-W818 HydrophobicContact CB-CZ2 4.31Å
781	A	96.3	Very high	91.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-59.9	-28.6	-179.2	0	0	0	0	0	113.6	L724 L725 N783 V784 E844	L724-A781 WeakPolarHBondContact CB-O 3.09Å; L724-A781 PolarHBondContact N-O 3.32Å; L725-A781 HydrophobicContact CB-CB 3.96Å; L725-A781 HydrophobicContact CD1-CB 4.48Å; L725-A781 PolarHBondContact N-O 3.24Å; A781-N783 PolarHBondContact O-N 3.12Å; A781-V784 PolarHBondContact O-N 3.44Å; A781-E844 HydrophobicContact CB-CB 4.1Å; A781-E844 PolarHBondContact N-OE2 2.87Å; A781-E844 VanDerWaalsContact N-OE2 3.09Å
782	R	92.3	Very high	92.3	Very high	76 Å²	76	32.7 Å²	32.7	29%	0.287	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-66.3	-22.5	173.9	66.4	177	-174.7	-76.7	-9	114.1	N723 L725 D778 A780 W818	N723-R782 WeakPolarHBondContact CB-O 3.34Å; L725-R782 HydrophobicContact CB-CB 4.41Å; L725-R782 HydrophobicContact CD2-CB 4.13Å; D778-R782 VanDerWaalsContact CG-NH2 3.27Å; D778-R782 IonicContact OD1-CZ 2.91Å; D778-R782 IonicContact OD1-NH2 3.41Å; D778-R782 PolarHBondContact OD1-NH2 2.85Å; D778-R782 IonicContact OD2-NH2 2.84Å; D778-R782 PolarHBondContact OD2-NH2 3.28Å; D778-R782 VanDerWaalsContact OD2-NH2 3.11Å; A780-R782 HydrophobicContact CB-CG 4.05Å; A780-R782 VanDerWaalsContact CB-NH1 3.3Å; A780-R782 PolarHBondContact O-N 3.14Å; A780-R782 VanDerWaalsContact O-N 3.16Å; R782-W818 VanDerWaalsContact NH1-CZ3 3.29Å
783	N	93.2	Very high	92.9	Very high	14 Å²	14	28.8 Å²	28.8	8%	0.075	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-103.4	14.5	-180	-66.2	-12.6	0	0	0	111.9	D778 A780 A781 A795 D796	D778-N783 VanDerWaalsContact CG-ND2 3.27Å; D778-N783 PolarHBondContact O-ND2 2.62Å; D778-N783 PolarHBondContact OD2-ND2 3.45Å; A780-N783 PolarHBondContact O-N 3.36Å; A781-N783 PolarHBondContact O-N 3.12Å; N783-A795 CarbonylContact O-C 3.52Å; N783-A795 WeakPolarHBondContact O-CA 3.34Å; N783-A795 PolarHBondContact O-N 3.09Å; N783-A795 VanDerWaalsContact O-O 3.07Å; N783-D796 HydrophobicContact CB-CB 4.28Å
784	V	97.1	Very high	93.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.2	169.6	178.2	0	0	0	0	107.8	N723 L724 V762 A780 A781 A792 K793 L841	N723-V784 CarbonylContact C-O 3.56Å; N723-V784 VanDerWaalsContact CA-O 3.26Å; N723-V784 WeakPolarHBondContact CA-O 3.47Å; L724-V784 HydrophobicContact CB-CB 3.98Å; L724-V784 HydrophobicContact CB-CG1 4.1Å; L724-V784 WeakPolarHBondContact CB-O 3.19Å; L724-V784 HydrophobicContact CD2-CB 4.13Å; L724-V784 HydrophobicContact CD2-CG1 3.91Å; L724-V784 PolarHBondContact N-O 2.86Å; V762-V784 HydrophobicContact CG2-CB 4.49Å; V762-V784 HydrophobicContact CG2-CG1 3.8Å; V762-V784 HydrophobicContact CG2-CG2 3.87Å; A780-V784 PolarHBondContact O-N 2.83Å; A781-V784 PolarHBondContact O-N 3.44Å; V784-A792 HydrophobicContact CG1-CB 3.83Å; V784-K793 CarbonylContact C-O 3.54Å; V784-K793 WeakPolarHBondContact CA-O 3.03Å; V784-L841 HydrophobicContact CG2-CD1 3.88Å
785	L	95.9	Very high	93.8	Very high	39 Å²	39	23.9 Å²	23.9	20%	0.204	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	148.3	177.3	-65.5	176.3	0	0	0	110.7	I700 A719 G722 N723 A792 K793 A795	I700-L785 HydrophobicContact CD1-CD1 3.89Å; I700-L785 HydrophobicContact CG1-CD1 4.09Å; A719-L785 HydrophobicContact CB-CB 3.66Å; A719-L785 HydrophobicContact CB-CD1 4.12Å; A719-L785 HydrophobicContact CB-CG 4.34Å; G722-L785 WeakPolarHBondContact O-CA 3.39Å; N723-L785 HydrophobicContact CB-CD2 4.25Å; L785-A792 WeakPolarHBondContact O-CA 3.37Å; L785-K793 PolarHBondContact N-O 3.38Å; L785-K793 PolarHBondContact O-N 3.47Å; L785-A795 HydrophobicContact CD1-CB 3.75Å; L785-A795 HydrophobicContact CG-CB 3.84Å
786	V	97.1	Very high	93.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	107.3	177.7	-177.3	0	0	0	0	108.8	Y721 G722 L724 F727 F758 L790	Y721-V786 HydrophobicContact CD2-CG1 3.95Å; Y721-V786 HydrophobicContact CG-CG1 4.22Å; Y721-V786 PolarHBondContact N-O 3.14Å; G722-V786 PolarHBondContact O-N 3.19Å; L724-V786 HydrophobicContact CB-CG2 4.07Å; L724-V786 HydrophobicContact CD1-CG2 3.8Å; F727-V786 HydrophobicContact CB-CG2 4.37Å; F727-V786 HydrophobicContact CD1-CG2 4.37Å; F727-V786 HydrophobicContact CG-CG2 4.33Å; F758-V786 HydrophobicContact CE1-CG1 4.13Å; F758-V786 HydrophobicContact CE1-CG2 4.35Å; F758-V786 HydrophobicContact CZ-CG1 4.49Å; V786-L790 HydrophobicContact CG1-CD2 4.11Å
787	G	93.5	Very high	92.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.145	C	C	.	.			trans	-83	-172.3	-177.6	0	0	0	0	0	113.7	Y721 L790 V791	Y721-G787 VanDerWaalsContact CD2-O 3.27Å; Y721-G787 WeakPolarHBondContact CD2-O 3.39Å; Y721-G787 WeakPolarHBondContact CE2-O 3.17Å; G787-L790 PolarHBondContact O-N 3.29Å; G787-V791 PolarHBondContact N-O 3.2Å
788	D	90.1	Very high	91.7	Very high	107 Å²	107	26.3 Å²	26.3	57%	0.572	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-54.6	148.6	171	-70.4	-48.5	0	0	0	111.5	P720 L790 V791	P720-D788 WeakPolarHBondContact CG-OD1 3.4Å; D788-L790 PolarHBondContact O-N 3.34Å; D788-L790 VanDerWaalsContact O-N 3.1Å; D788-V791 PolarHBondContact O-N 2.83Å
789	S	92.3	Very high	90.2	Very high	114 Å²	114	27.6 Å²	27.6	80%	0.797	15%	0.154	S	C	*	.	G	3₁₀ helix	trans	56.8	22.9	-176.8	-56.8	0	0	0	0	114.7	V791	S789-V791 VanDerWaalsContact C-N 3.28Å; S789-V791 PolarHBondContact O-N 3.49Å
790	L	94.1	Very high	88.9	Confident	44 Å²	44	27.7 Å²	27.7	23%	0.23	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	62.4	29	-179.2	-53	176	0	0	0	114	Y721 F727 F758 V786 G787 D788	Y721-L790 HydrophobicContact CD2-CD2 4.23Å; Y721-L790 HydrophobicContact CE2-CD2 4.08Å; F727-L790 HydrophobicContact CE1-CD2 4.36Å; F727-L790 HydrophobicContact CZ-CD2 3.75Å; F758-L790 HydrophobicContact CE1-CB 4.26Å; F758-L790 VanDerWaalsContact CE1-O 3.25Å; F758-L790 WeakPolarHBondContact CE1-O 3.27Å; F758-L790 HydrophobicContact CZ-CB 4.49Å; V786-L790 HydrophobicContact CG1-CD2 4.11Å; G787-L790 PolarHBondContact O-N 3.29Å; D788-L790 PolarHBondContact O-N 3.34Å; D788-L790 VanDerWaalsContact O-N 3.1Å
791	V	97	Very high	87.3	Confident	46 Å²	46	30.8 Å²	30.8	28%	0.279	17%	0.167	S	C	.	.			trans	-76.1	125	174.3	178.8	0	0	0	0	109.9	G787 D788 S789 K793	G787-V791 PolarHBondContact N-O 3.2Å; D788-V791 PolarHBondContact O-N 2.83Å; S789-V791 VanDerWaalsContact C-N 3.28Å; S789-V791 PolarHBondContact O-N 3.49Å; V791-K793 HydrophobicContact CG1-CG 4.47Å
792	A	97.8	Very high	84.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	132.9	173.9	0	0	0	0	0	111.3	N698 F758 D761 V762 V784 L785	N698-A792 WeakPolarHBondContact CA-O 3.33Å; N698-A792 PolarHBondContact ND2-O 2.9Å; F758-A792 HydrophobicContact CB-CB 4.38Å; F758-A792 HydrophobicContact CD1-CB 3.83Å; D761-A792 HydrophobicContact CB-CB 3.71Å; D761-A792 PolarHBondContact OD2-N 3.06Å; V762-A792 HydrophobicContact CG2-CB 4.23Å; V784-A792 HydrophobicContact CG1-CB 3.83Å; L785-A792 WeakPolarHBondContact O-CA 3.37Å
793	K	97.4	Very high	82.4	Confident	17 Å²	17	34.4 Å²	34.4	7%	0.074	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.8	-176.4	-69.8	171.2	-179.3	-88	0	110.4	P697 N698 I700 E717 V784 L785 V791	P697-K793 WeakPolarHBondContact O-CG 3.41Å; P697-K793 PolarHBondContact O-NZ 3.05Å; N698-K793 WeakPolarHBondContact O-CA 3.45Å; I700-K793 HydrophobicContact CD1-CB 4.35Å; I700-K793 HydrophobicContact CD1-CD 4.01Å; E717-K793 VanDerWaalsContact CD-NZ 3.26Å; E717-K793 WeakPolarHBondContact OE1-CE 3.4Å; E717-K793 IonicContact OE1-NZ 3.53Å; E717-K793 PolarHBondContact OE1-NZ 3.33Å; E717-K793 IonicContact OE2-NZ 2.76Å; E717-K793 PolarHBondContact OE2-NZ 3.41Å; V784-K793 CarbonylContact C-O 3.54Å; V784-K793 WeakPolarHBondContact CA-O 3.03Å; L785-K793 PolarHBondContact N-O 3.38Å; L785-K793 PolarHBondContact O-N 3.47Å; V791-K793 HydrophobicContact CG1-CG 4.47Å
794	I	96.7	Very high	79.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	133.9	176	-57.4	163	0	0	0	109	N698 I700 V762 G765 M766 L769 H776 L779 F797	N698-I794 PolarHBondContact O-N 3.3Å; I700-I794 PolarHBondContact N-O 3.09Å; V762-I794 HydrophobicContact CG1-CD1 4.42Å; V762-I794 HydrophobicContact CG1-CG1 4.3Å; G765-I794 VanDerWaalsContact C-CD1 3.49Å; M766-I794 HydrophobicContact CB-CD1 4.42Å; M766-I794 HydrophobicContact CG-CD1 3.66Å; M766-I794 HydrophobicContact SD-CD1 3.81Å; L769-I794 HydrophobicContact CD1-CD1 3.96Å; L769-I794 HydrophobicContact CD1-CG2 4.26Å; H776-I794 VanDerWaalsContact CD2-CG2 3.47Å; H776-I794 WeakPolarHBondContact CD2-CG2 3.08Å; H776-I794 VanDerWaalsContact NE2-CG2 3.34Å; H776-I794 WeakPolarHBondContact NE2-CG2 3.29Å; L779-I794 HydrophobicContact CD1-CG2 4.35Å; I794-F797 HydrophobicContact CG2-CE1 4.39Å; I794-F797 HydrophobicContact CG2-CZ 4.09Å
795	A	90.4	Very high	76.2	Confident	8 Å²	8	41.6 Å²	41.6	7%	0.066	24%	0.238	C	C	.	.			trans	-137.6	176.1	-177.1	0	0	0	0	0	111.4	I700 H776 N783 L785	I700-A795 HydrophobicContact CB-CB 4.18Å; I700-A795 HydrophobicContact CG2-CB 3.86Å; H776-A795 PolarHBondContact NE2-O 3.2Å; N783-A795 CarbonylContact O-C 3.52Å; N783-A795 WeakPolarHBondContact O-CA 3.34Å; N783-A795 PolarHBondContact O-N 3.09Å; N783-A795 VanDerWaalsContact O-O 3.07Å; L785-A795 HydrophobicContact CD1-CB 3.75Å; L785-A795 HydrophobicContact CG-CB 3.84Å
796	D	81.1	Confident	73.5	Confident	59 Å²	59	42.1 Å²	42.1	32%	0.316	24%	0.238	S	C	.	.			trans	63.8	72.7	177.3	-155	20	0	0	0	115	K669 N783 G798	K669-D796 IonicContact NZ-OD1 3.96Å; K669-D796 PolarHBondContact NZ-OD1 2.76Å; N783-D796 HydrophobicContact CB-CB 4.28Å; D796-G798 VanDerWaalsContact C-N 3.3Å; D796-G798 PolarHBondContact O-N 3.46Å
797	F	77.1	Confident	70.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.257	C	S	.	.			trans	-87.7	13.8	-178.9	-62.9	-82.8	0	0	0	114.1	E686 V689 L690 L693 I699 I700 L769 H776 I794 L799 S800	E686-F797 HydrophobicContact CG-CB 4.22Å; V689-F797 HydrophobicContact CB-CB 4.18Å; V689-F797 HydrophobicContact CG1-CB 3.86Å; V689-F797 HydrophobicContact CG1-CD1 3.81Å; V689-F797 HydrophobicContact CG1-CG 3.86Å; L690-F797 HydrophobicContact CD2-CD2 3.6Å; L690-F797 HydrophobicContact CD2-CE2 3.65Å; L690-F797 HydrophobicContact CG-CD2 4.16Å; L693-F797 HydrophobicContact CD1-CD1 4.4Å; L693-F797 HydrophobicContact CD1-CE1 4.02Å; L693-F797 HydrophobicContact CD1-CZ 4.15Å; I699-F797 HydrophobicContact CG2-CE2 3.86Å; I699-F797 HydrophobicContact CG2-CZ 3.64Å; I700-F797 HydrophobicContact CG2-CE2 4.25Å; L769-F797 HydrophobicContact CD1-CE1 3.95Å; L769-F797 HydrophobicContact CD1-CZ 4.41Å; L769-F797 HydrophobicContact CD2-CD1 4.47Å; L769-F797 HydrophobicContact CD2-CE1 3.65Å; L769-F797 HydrophobicContact CD2-CZ 4.37Å; L769-F797 HydrophobicContact CG-CE1 4.45Å; H776-F797 AromaticContact CD2-CE1 3.77Å; I794-F797 HydrophobicContact CG2-CE1 4.39Å; I794-F797 HydrophobicContact CG2-CZ 4.09Å; F797-L799 PolarHBondContact O-N 2.84Å; F797-L799 VanDerWaalsContact O-N 3.08Å; F797-S800 WeakPolarHBondContact CA-OG 3.32Å; F797-S800 WeakPolarHBondContact CD1-OG 3.41Å; F797-S800 WeakPolarHBondContact O-CB 3.45Å; F797-S800 PolarHBondContact O-N 3.07Å; F797-S800 PolarHBondContact O-OG 3.49Å
798	G	65.2	Low	68.1	Low	10 Å²	10	47.2 Å²	47.2	10%	0.103	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.2	-174.7	0	0	0	0	0	114	D682 D796 R801	D682-G798 WeakPolarHBondContact CB-O 3.27Å; D796-G798 VanDerWaalsContact C-N 3.3Å; D796-G798 PolarHBondContact O-N 3.46Å; G798-R801 PolarHBondContact O-NH1 2.95Å; G798-R801 VanDerWaalsContact O-NH1 3.17Å
799	L	59.8	Low	65.2	Low	46 Å²	46	50.8 Å²	50.8	24%	0.241	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-4.6	177.2	-63.2	178.4	0	0	0	114.1	R777 D778 F797	R777-L799 WeakPolarHBondContact CD-O 3.05Å; R777-L799 PolarHBondContact NH1-O 2.81Å; D778-L799 HydrophobicContact CB-CD1 4.11Å; F797-L799 PolarHBondContact O-N 2.84Å; F797-L799 VanDerWaalsContact O-N 3.08Å
800	S	67.6	Low	62.3	Low	1 Å²	1	50 Å²	50	1%	0.007	27%	0.266	C	S	.	.			trans	-76.6	150	-176	-52.3	0	0	0	0	112	I775 H776 F797	I775-S800 VanDerWaalsContact O-CA 3.26Å; I775-S800 WeakPolarHBondContact O-CA 3.14Å; I775-S800 WeakPolarHBondContact O-CB 3.05Å; H776-S800 PolarHBondContact O-OG 3.39Å; F797-S800 WeakPolarHBondContact CA-OG 3.32Å; F797-S800 WeakPolarHBondContact CD1-OG 3.41Å; F797-S800 WeakPolarHBondContact O-CB 3.45Å; F797-S800 PolarHBondContact O-N 3.07Å; F797-S800 PolarHBondContact O-OG 3.49Å
801	R	62	Low	59.5	Low	66 Å²	66	56 Å²	56	25%	0.249	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-146.5	152.7	174.8	-48.8	-76.6	178	-109.7	8.4	110.8	D682 I775 R777 G798 E803 Y806	D682-R801 IonicContact OD1-CZ 3.53Å; D682-R801 IonicContact OD1-NH2 3.11Å; D682-R801 PolarHBondContact OD1-NH2 2.98Å; I775-R801 PolarHBondContact N-O 2.98Å; I775-R801 PolarHBondContact O-N 3.1Å; R777-R801 VanDerWaalsContact NH2-CB 3.26Å; R777-R801 VanDerWaalsContact NH2-CG 3.31Å; G798-R801 PolarHBondContact O-NH1 2.95Å; G798-R801 VanDerWaalsContact O-NH1 3.17Å; R801-E803 PolarHBondContact O-N 3.45Å; R801-Y806 HydrophobicContact CG-CE2 4.48Å
802	G	45.4	Very low	57	Low	51 Å²	51	55.9 Å²	55.9	53%	0.526	30%	0.303	S	S	.	.	S	Bend	trans	-87.2	68.5	175.7	0	0	0	0	0	112.3	Q773	Q773-G802 CarbonylContact O-C 3.59Å; Q773-G802 WeakPolarHBondContact O-CA 3.22Å
803	E	40.3	Very low	54.8	Low	101 Å²	101	63.3 Å²	63.3	47%	0.472	33%	0.331	S	S	.	.			trans	-143.7	143.1	177.9	-65.8	180	169.9	0	0	109	Q773 I775 R801 V805 Y806	Q773-E803 PolarHBondContact O-N 3.14Å; I775-E803 WeakPolarHBondContact CD1-O 3.2Å; I775-E803 WeakPolarHBondContact CG1-O 3.01Å; R801-E803 PolarHBondContact O-N 3.45Å; E803-V805 VanDerWaalsContact C-N 3.34Å; E803-V805 PolarHBondContact O-N 2.79Å; E803-Y806 WeakPolarHBondContact OE2-CD2 3.02Å
804	E	31.2	Very low	53.3	Low	99 Å²	99	64.8 Å²	64.8	46%	0.463	34%	0.339	S	S	.	.	S	Bend	trans	-68.9	-29	179.6	-79.3	-172.7	-165.1	0	0	114.4	L615 Q773	L615-E804 WeakPolarHBondContact CD1-OE1 3.34Å; L615-E804 WeakPolarHBondContact CD1-OE2 3.05Å; Q773-E804 PolarHBondContact OE1-OE1 2.98Å
805	V	29.2	Very low	52.6	Low	65 Å²	65	65.5 Å²	65.5	39%	0.394	34%	0.344	S	S	.	.	S	Bend	trans	-144	133.2	177.3	-176.4	0	0	0	0	108.2	E803 V828 Y829 T830	E803-V805 VanDerWaalsContact C-N 3.34Å; E803-V805 PolarHBondContact O-N 2.79Å; V805-V828 HydrophobicContact CG1-CG1 4.33Å; V805-Y829 WeakPolarHBondContact CA-O 3.34Å; V805-T830 HydrophobicContact CG1-CG2 4.28Å; V805-T830 HydrophobicContact CG2-CG2 4.12Å
806	Y	37.9	Very low	52.4	Low	51 Å²	51	66.2 Å²	66.2	20%	0.2	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.3	175.8	174	-95.3	0	0	0	112.6	R777 R801 E803 K808 Y829	R777-Y806 VanDerWaalsContact CZ-CB 3.45Å; R801-Y806 HydrophobicContact CG-CE2 4.48Å; E803-Y806 WeakPolarHBondContact OE2-CD2 3.02Å; Y806-K808 HydrophobicContact CD1-CB 4.38Å; Y806-K808 VanDerWaalsContact CE1-CA 3.45Å; Y806-K808 HydrophobicContact CE1-CB 3.64Å; Y806-K808 HydrophobicContact CE1-CG 4.06Å; Y806-Y829 AromaticContact CD1-CD2 3.98Å; Y806-Y829 HydrophobicContact CD1-CD2 3.98Å; Y806-Y829 PolarHBondContact N-O 2.8Å; Y806-Y829 PolarHBondContact O-N 2.83Å
807	V	41.9	Very low	52.9	Low	68 Å²	68	64.2 Å²	64.2	41%	0.412	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114.6	174.5	-176.4	0	0	0	0	108.7	K809 S827 V828	V807-K809 PolarHBondContact O-N 2.67Å; V807-S827 WeakPolarHBondContact CA-O 3.48Å; V807-V828 HydrophobicContact CG2-CG2 4.49Å
808	K	35.4	Very low	53.8	Low	39 Å²	39	65.4 Å²	65.4	17%	0.17	34%	0.34	C	S	.	.			trans	-72.5	120.3	-178.8	-165.5	176	179.9	174	0	110.2	Y806 T810 L814 S827 Y829	Y806-K808 HydrophobicContact CD1-CB 4.38Å; Y806-K808 VanDerWaalsContact CE1-CA 3.45Å; Y806-K808 HydrophobicContact CE1-CB 3.64Å; Y806-K808 HydrophobicContact CE1-CG 4.06Å; K808-T810 WeakPolarHBondContact CE-O 3.12Å; K808-L814 HydrophobicContact CD-CD2 4.07Å; K808-S827 PolarHBondContact N-O 3.3Å; K808-Y829 HydrophobicContact CB-CE2 4.01Å
809	K	30.1	Very low	55	Low	181 Å²	181	65.1 Å²	65.1	79%	0.787	34%	0.336	S	S	*	.			trans	-89	-9.6	-176.4	-64.5	-173.7	177	-173.6	0	115.2	V807	V807-K809 PolarHBondContact O-N 2.67Å
810	T	31	Very low	56.6	Low	98 Å²	98	62.9 Å²	62.9	60%	0.601	32%	0.324	S	S	*	.	S	Bend	trans	-129.2	139.5	-173.7	35	0	0	0	0	112.7	K808 G812	K808-T810 WeakPolarHBondContact CE-O 3.12Å; T810-G812 PolarHBondContact O-N 3.17Å
811	M	34.7	Very low	57.6	Low	171 Å²	171	63.7 Å²	63.7	84%	0.842	33%	0.328	S	S	*	.			trans	-72.2	101.9	176.6	-67	-101.4	100.5	0	0	110
812	G	43.8	Very low	58.8	Low	42 Å²	42	61.5 Å²	61.5	43%	0.433	32%	0.321	S	S	.	.			trans	-119.2	176.8	169	0	0	0	0	0	110.6	T810 L814	T810-G812 PolarHBondContact O-N 3.17Å; G812-L814 PolarHBondContact O-N 3.45Å
813	R	51.7	Low	60.7	Low	156 Å²	156	59.1 Å²	59.1	59%	0.589	30%	0.296	S	S	*	.			trans	-58.4	136.8	169.3	-77.7	176	161.8	162.5	-10.7	109.5	N648	N648-R813 PolarHBondContact ND2-NH1 3.17Å
814	L	66.8	Low	62.7	Low	49 Å²	49	54.9 Å²	54.9	26%	0.257	28%	0.277	S	S	.	.			trans	-127.5	135.2	-174.5	-74.4	177.6	0	0	0	109.2	K808 G812 V816 M819 Y829	K808-L814 HydrophobicContact CD-CD2 4.07Å; G812-L814 PolarHBondContact O-N 3.45Å; L814-V816 HydrophobicContact CB-CG2 4.35Å; L814-V816 PolarHBondContact O-N 2.79Å; L814-M819 HydrophobicContact CB-SD 3.75Å; L814-M819 HydrophobicContact CD1-CE 4.28Å; L814-M819 HydrophobicContact CD1-SD 4.38Å; L814-M819 HydrophobicContact CD2-CE 4.47Å; L814-M819 HydrophobicContact CD2-SD 4.26Å; L814-M819 HydrophobicContact CG-SD 4.34Å; L814-Y829 VanDerWaalsContact CD2-OH 3.3Å; L814-Y829 WeakPolarHBondContact CD2-OH 3.45Å
815	P	83.1	Confident	64.8	Low	15 Å²	15	53.2 Å²	53.2	10%	0.097	27%	0.271	C	S	.	.			trans	-78.6	63.7	-180	35.4	-38.7	0	0	0	110.8	D778 R817 W818 M819	D778-P815 HydrophobicContact CB-CG 4.33Å; D778-P815 WeakPolarHBondContact OD1-CB 3.36Å; D778-P815 WeakPolarHBondContact OD1-CG 3.16Å; P815-R817 PolarHBondContact O-N 3.38Å; P815-W818 HydrophobicContact CB-CE3 4.34Å; P815-W818 PolarHBondContact O-N 3.13Å; P815-M819 HydrophobicContact CG-CG 4.15Å; P815-M819 HydrophobicContact CG-SD 4.48Å; P815-M819 WeakPolarHBondContact O-CG 3.17Å; P815-M819 PolarHBondContact O-N 3.19Å
816	V	86.1	Confident	66.8	Low	23 Å²	23	56 Å²	56	14%	0.139	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-47.9	-43.2	-166.8	175.8	0	0	0	0	113.2	L814 W818 M819 L824 C858 Y862	L814-V816 HydrophobicContact CB-CG2 4.35Å; L814-V816 PolarHBondContact O-N 2.79Å; V816-W818 PolarHBondContact O-N 3.4Å; V816-M819 PolarHBondContact O-N 2.79Å; V816-L824 HydrophobicContact CB-CD2 4.37Å; V816-L824 HydrophobicContact CG1-CD2 3.7Å; V816-C858 HydrophobicContact CB-CB 4.37Å; V816-C858 HydrophobicContact CG1-CB 3.87Å; V816-Y862 HydrophobicContact CG1-CE2 4.15Å
817	R	91.2	Very high	68.7	Low	16 Å²	16	55.1 Å²	55.1	6%	0.06	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-67.2	-18.7	-177.4	-62.1	175	179.4	-77	-7.3	114.1	P815 P852 Y853 M856 L861	P815-R817 PolarHBondContact O-N 3.38Å; R817-P852 HydrophobicContact CB-CB 4.34Å; R817-P852 WeakPolarHBondContact CD-O 3.32Å; R817-P852 PolarHBondContact NH1-O 3.25Å; R817-Y853 HydrophobicContact CB-CD2 4.35Å; R817-Y853 PolarHBondContact NH1-O 3.41Å; R817-Y853 WeakPolarHBondContact O-CE2 3.44Å; R817-M856 PolarHBondContact NH1-O 3.45Å; R817-M856 PolarHBondContact NH2-O 2.03Å; R817-L861 HydrophobicContact CG-CD1 3.93Å
818	W	94.8	Very high	70.3	Confident	25 Å²	25	52.8 Å²	52.8	10%	0.095	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-103.2	-7.5	177.3	-69.4	-99.7	0	0	0	113	A780 R782 P815 V816 S837 V840 E844 P852	A780-W818 HydrophobicContact CB-CD2 4.03Å; A780-W818 HydrophobicContact CB-CG 4.01Å; A780-W818 HydrophobicContact CB-CZ2 4.31Å; R782-W818 VanDerWaalsContact NH1-CZ3 3.29Å; P815-W818 HydrophobicContact CB-CE3 4.34Å; P815-W818 PolarHBondContact O-N 3.13Å; V816-W818 PolarHBondContact O-N 3.4Å; W818-S837 WeakPolarHBondContact O-CA 3.22Å; W818-S837 WeakPolarHBondContact O-CB 3.24Å; W818-S837 PolarHBondContact O-OG 3.34Å; W818-V840 VanDerWaalsContact CD1-CG1 3.45Å; W818-V840 HydrophobicContact CD2-CG1 4.39Å; W818-V840 HydrophobicContact CG-CB 4.42Å; W818-V840 HydrophobicContact CG-CG1 3.98Å; W818-E844 WeakPolarHBondContact CZ2-OE1 3.17Å; W818-E844 PolarHBondContact NE1-OE2 2.91Å; W818-P852 HydrophobicContact CH2-CG 4.26Å; W818-P852 HydrophobicContact CZ2-CG 3.69Å
819	M	91.3	Very high	72.5	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.02	26%	0.256	C	S	.	.			trans	-78.6	140.9	-175.5	-73.5	175	63.5	0	0	111.9	L814 P815 V816 S823 L824 Y829 W836	L814-M819 HydrophobicContact CB-SD 3.75Å; L814-M819 HydrophobicContact CD1-CE 4.28Å; L814-M819 HydrophobicContact CD1-SD 4.38Å; L814-M819 HydrophobicContact CD2-CE 4.47Å; L814-M819 HydrophobicContact CD2-SD 4.26Å; L814-M819 HydrophobicContact CG-SD 4.34Å; P815-M819 HydrophobicContact CG-CG 4.15Å; P815-M819 HydrophobicContact CG-SD 4.48Å; P815-M819 WeakPolarHBondContact O-CG 3.17Å; P815-M819 PolarHBondContact O-N 3.19Å; V816-M819 PolarHBondContact O-N 2.79Å; M819-S823 WeakPolarHBondContact CE-O 3.31Å; M819-L824 HydrophobicContact CB-CD2 3.72Å; M819-L824 HydrophobicContact CB-CG 3.78Å; M819-L824 HydrophobicContact CE-CD2 4.12Å; M819-L824 HydrophobicContact SD-CD2 4.16Å; M819-Y829 HydrophobicContact CE-CE1 4.35Å; M819-Y829 WeakPolarHBondContact CE-OH 3.42Å; M819-W836 PolarHBondContact O-NE1 2.94Å
820	A	93.9	Very high	75.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.			trans	-69.6	158.9	171.7	0	0	0	0	0	111.5	E822 S823 L824 W836	A820-E822 VanDerWaalsContact C-N 3.26Å; A820-E822 VanDerWaalsContact CB-CD 3.42Å; A820-E822 HydrophobicContact CB-CG 4.47Å; A820-E822 VanDerWaalsContact CB-OE1 3.32Å; A820-E822 WeakPolarHBondContact CB-OE1 3.45Å; A820-E822 VanDerWaalsContact CB-OE2 3.31Å; A820-E822 WeakPolarHBondContact CB-OE2 3.38Å; A820-E822 PolarHBondContact O-N 3.25Å; A820-S823 CarbonylContact O-C 3.49Å; A820-S823 WeakPolarHBondContact O-CA 3.13Å; A820-S823 WeakPolarHBondContact O-CB 3.2Å; A820-S823 PolarHBondContact O-N 3.26Å; A820-L824 WeakPolarHBondContact O-CG 3.42Å; A820-L824 PolarHBondContact O-N 2.9Å; A820-W836 HydrophobicContact CB-CB 3.66Å; A820-W836 HydrophobicContact CB-CD2 3.98Å; A820-W836 HydrophobicContact CB-CE3 4.36Å; A820-W836 HydrophobicContact CB-CG 3.67Å
821	I	88.8	Confident	78	Confident	18 Å²	18	41 Å²	41	9%	0.092	21%	0.21	C	C	.	.	H	α-helix	trans	-55.4	-42.7	-179.6	-64.8	168.3	0	0	0	111.3	S823 L824 N825 W836 L865 P866	I821-S823 VanDerWaalsContact C-N 3.31Å; I821-S823 PolarHBondContact O-N 3.18Å; I821-L824 PolarHBondContact O-N 3.48Å; I821-N825 WeakPolarHBondContact O-CB 3.34Å; I821-N825 PolarHBondContact O-N 2.92Å; I821-W836 HydrophobicContact CD1-CH2 3.65Å; I821-W836 HydrophobicContact CD1-CZ3 3.88Å; I821-W836 HydrophobicContact CG1-CH2 3.61Å; I821-W836 HydrophobicContact CG1-CZ2 4.23Å; I821-W836 HydrophobicContact CG1-CZ3 3.99Å; I821-L865 HydrophobicContact CD1-CB 4.34Å; I821-L865 HydrophobicContact CG1-CB 4.02Å; I821-P866 HydrophobicContact CG2-CG 4.23Å
822	E	85.4	Confident	80.9	Confident	19 Å²	19	35.1 Å²	35.1	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-67.8	-31	177.3	69.8	-79.9	-168.2	0	0	113.1	A820 Y826 S827 V828 P893 R896	A820-E822 VanDerWaalsContact C-N 3.26Å; A820-E822 VanDerWaalsContact CB-CD 3.42Å; A820-E822 HydrophobicContact CB-CG 4.47Å; A820-E822 VanDerWaalsContact CB-OE1 3.32Å; A820-E822 WeakPolarHBondContact CB-OE1 3.45Å; A820-E822 VanDerWaalsContact CB-OE2 3.31Å; A820-E822 WeakPolarHBondContact CB-OE2 3.38Å; A820-E822 PolarHBondContact O-N 3.25Å; E822-Y826 HydrophobicContact CB-CD2 4.3Å; E822-Y826 CarbonylContact O-C 3.57Å; E822-Y826 WeakPolarHBondContact O-CA 2.99Å; E822-Y826 WeakPolarHBondContact O-CB 3.12Å; E822-Y826 PolarHBondContact O-N 2.73Å; E822-S827 PolarHBondContact O-N 2.88Å; E822-V828 HydrophobicContact CG-CB 4.41Å; E822-V828 HydrophobicContact CG-CG1 4.43Å; E822-V828 PolarHBondContact O-N 2.62Å; E822-P893 HydrophobicContact CG-CG 4.17Å; E822-R896 IonicContact OE1-CZ 3.5Å; E822-R896 IonicContact OE1-NH1 3.84Å; E822-R896 PolarHBondContact OE1-NH1 3.16Å; E822-R896 IonicContact OE1-NH2 2.84Å; E822-R896 IonicContact OE2-CZ 2.69Å; E822-R896 IonicContact OE2-NH1 2.75Å; E822-R896 PolarHBondContact OE2-NH1 2.93Å; E822-R896 IonicContact OE2-NH2 3.21Å; E822-R896 PolarHBondContact OE2-NH2 2.93Å
823	S	85.8	Confident	83.3	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-73.9	-38.3	175.6	-50.7	0	0	0	0	111	M819 A820 I821 S827 V828 S833	M819-S823 WeakPolarHBondContact CE-O 3.31Å; A820-S823 CarbonylContact O-C 3.49Å; A820-S823 WeakPolarHBondContact O-CA 3.13Å; A820-S823 WeakPolarHBondContact O-CB 3.2Å; A820-S823 PolarHBondContact O-N 3.26Å; I821-S823 VanDerWaalsContact C-N 3.31Å; I821-S823 PolarHBondContact O-N 3.18Å; S823-S827 VanDerWaalsContact O-CA 3.23Å; S823-S827 WeakPolarHBondContact O-CA 3.42Å; S823-S827 PolarHBondContact O-N 2.95Å; S823-S827 VanDerWaalsContact O-N 3.08Å; S823-V828 VanDerWaalsContact CA-O 3.24Å; S823-V828 WeakPolarHBondContact CA-O 3.48Å; S823-V828 WeakPolarHBondContact CB-O 3.46Å; S823-V828 PolarHBondContact OG-O 2.83Å; S823-S833 WeakPolarHBondContact OG-CB 3.42Å
824	L	81.7	Confident	85.5	Confident	11 Å²	11	25.9 Å²	25.9	6%	0.058	13%	0.132	C	C	.	.	H	α-helix	trans	-65	-54.3	175	-71	171.8	0	0	0	110.8	V816 M819 A820 I821 Y862 L865	V816-L824 HydrophobicContact CB-CD2 4.37Å; V816-L824 HydrophobicContact CG1-CD2 3.7Å; M819-L824 HydrophobicContact CB-CD2 3.72Å; M819-L824 HydrophobicContact CB-CG 3.78Å; M819-L824 HydrophobicContact CE-CD2 4.12Å; M819-L824 HydrophobicContact SD-CD2 4.16Å; A820-L824 WeakPolarHBondContact O-CG 3.42Å; A820-L824 PolarHBondContact O-N 2.9Å; I821-L824 PolarHBondContact O-N 3.48Å; L824-Y862 HydrophobicContact CB-CD1 4.18Å; L824-Y862 HydrophobicContact CB-CE1 3.65Å; L824-Y862 HydrophobicContact CD2-CE1 4.23Å; L824-Y862 HydrophobicContact CD2-CE2 3.87Å; L824-Y862 HydrophobicContact CG-CE1 4.5Å; L824-Y862 VanDerWaalsContact O-CE1 3.32Å; L824-Y862 WeakPolarHBondContact O-CE1 2.99Å; L824-Y862 PolarHBondContact O-OH 3.3Å; L824-L865 HydrophobicContact CD1-CD1 3.72Å
825	N	76.7	Confident	87	Confident	65 Å²	65	23.6 Å²	23.6	35%	0.348	12%	0.12	S	C	.	.	H	α-helix	trans	-79.3	-32.6	-171.2	-69.1	-11.4	0	0	0	113.5	I821	I821-N825 WeakPolarHBondContact O-CB 3.34Å; I821-N825 PolarHBondContact O-N 2.92Å
826	Y	71.1	Confident	87.7	Confident	122 Å²	122	22.9 Å²	22.9	48%	0.478	12%	0.116	S	C	.	.	H	α-helix	trans	-127.2	2.7	-168.3	-48	-62.7	0	0	0	113.6	M303 E822 V828	M303-Y826 HydrophobicContact CE-CE1 4.22Å; E822-Y826 HydrophobicContact CB-CD2 4.3Å; E822-Y826 CarbonylContact O-C 3.57Å; E822-Y826 WeakPolarHBondContact O-CA 2.99Å; E822-Y826 WeakPolarHBondContact O-CB 3.12Å; E822-Y826 PolarHBondContact O-N 2.73Å; Y826-V828 PolarHBondContact O-N 2.91Å; Y826-V828 VanDerWaalsContact O-N 3.11Å
827	S	76.6	Confident	88.3	Confident	34 Å²	34	22 Å²	22	24%	0.238	11%	0.111	C	C	.	.			trans	54.2	27.9	-174.8	-60.2	0	0	0	0	113.4	V807 K808 E822 S823 Y829	V807-S827 WeakPolarHBondContact CA-O 3.48Å; K808-S827 PolarHBondContact N-O 3.3Å; E822-S827 PolarHBondContact O-N 2.88Å; S823-S827 VanDerWaalsContact O-CA 3.23Å; S823-S827 WeakPolarHBondContact O-CA 3.42Å; S823-S827 PolarHBondContact O-N 2.95Å; S823-S827 VanDerWaalsContact O-N 3.08Å; S827-Y829 VanDerWaalsContact O-CD2 3.24Å; S827-Y829 WeakPolarHBondContact O-CD2 3.33Å; S827-Y829 VanDerWaalsContact O-CE2 3.32Å; S827-Y829 WeakPolarHBondContact O-CE2 3.29Å
828	V	76.3	Confident	88.7	Confident	19 Å²	19	21.3 Å²	21.3	12%	0.115	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.5	178.5	173.4	0	0	0	0	109.4	V805 V807 E822 S823 Y826 T830	V805-V828 HydrophobicContact CG1-CG1 4.33Å; V807-V828 HydrophobicContact CG2-CG2 4.49Å; E822-V828 HydrophobicContact CG-CB 4.41Å; E822-V828 HydrophobicContact CG-CG1 4.43Å; E822-V828 PolarHBondContact O-N 2.62Å; S823-V828 VanDerWaalsContact CA-O 3.24Å; S823-V828 WeakPolarHBondContact CA-O 3.48Å; S823-V828 WeakPolarHBondContact CB-O 3.46Å; S823-V828 PolarHBondContact OG-O 2.83Å; Y826-V828 PolarHBondContact O-N 2.91Å; Y826-V828 VanDerWaalsContact O-N 3.11Å; V828-T830 HydrophobicContact CG1-CG2 4.06Å
829	Y	82.4	Confident	88.8	Confident	7 Å²	7	20.1 Å²	20.1	3%	0.027	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.6	175.6	-58.8	-92.8	0	0	0	109.8	I775 R777 V805 Y806 K808 L814 M819 S827 S833	I775-Y829 WeakPolarHBondContact CD1-O 3.29Å; R777-Y829 HydrophobicContact CB-CD1 3.87Å; R777-Y829 HydrophobicContact CB-CE1 4.23Å; R777-Y829 HydrophobicContact CG-CD1 3.81Å; R777-Y829 HydrophobicContact CG-CG 4Å; V805-Y829 WeakPolarHBondContact CA-O 3.34Å; Y806-Y829 AromaticContact CD1-CD2 3.98Å; Y806-Y829 HydrophobicContact CD1-CD2 3.98Å; Y806-Y829 PolarHBondContact N-O 2.8Å; Y806-Y829 PolarHBondContact O-N 2.83Å; K808-Y829 HydrophobicContact CB-CE2 4.01Å; L814-Y829 VanDerWaalsContact CD2-OH 3.3Å; L814-Y829 WeakPolarHBondContact CD2-OH 3.45Å; M819-Y829 HydrophobicContact CE-CE1 4.35Å; M819-Y829 WeakPolarHBondContact CE-OH 3.42Å; S827-Y829 VanDerWaalsContact O-CD2 3.24Å; S827-Y829 WeakPolarHBondContact O-CD2 3.33Å; S827-Y829 VanDerWaalsContact O-CE2 3.32Å; S827-Y829 WeakPolarHBondContact O-CE2 3.29Å; Y829-S833 WeakPolarHBondContact CA-OG 3.45Å
830	T	86.6	Confident	89.2	Confident	24 Å²	24	19.9 Å²	19.9	15%	0.147	10%	0.103	C	C	.	.			trans	-147.3	171	-179.3	64.5	0	0	0	0	110	V805 V828 K832 S833 D834	V805-T830 HydrophobicContact CG1-CG2 4.28Å; V805-T830 HydrophobicContact CG2-CG2 4.12Å; V828-T830 HydrophobicContact CG1-CG2 4.06Å; T830-K832 PolarHBondContact O-N 3.42Å; T830-K832 VanDerWaalsContact O-N 3.14Å; T830-K832 PolarHBondContact OG1-N 3.26Å; T830-S833 PolarHBondContact N-OG 2.9Å; T830-S833 PolarHBondContact O-N 3.26Å; T830-S833 PolarHBondContact O-OG 3.27Å; T830-S833 PolarHBondContact OG1-N 2.77Å; T830-S833 VanDerWaalsContact OG1-N 3.16Å; T830-D834 PolarHBondContact O-N 3.1Å; T830-D834 VanDerWaalsContact O-N 3.16Å
831	S	89.9	Confident	89.4	Confident	40 Å²	40	19.9 Å²	19.9	28%	0.28	10%	0.103	S	C	.	.	H	α-helix	trans	-55.9	-29.4	168.7	60.7	0	0	0	0	112.6	S770 D834 V835	S770-S831 WeakPolarHBondContact OG-CB 3.19Å; S831-D834 PolarHBondContact O-N 3.26Å; S831-V835 WeakPolarHBondContact O-CG2 3.45Å; S831-V835 PolarHBondContact O-N 2.92Å; S831-V835 VanDerWaalsContact O-N 3.09Å
832	K	95.1	Very high	89.8	Confident	47 Å²	47	19.1 Å²	19.1	20%	0.204	10%	0.099	C	C	.	.	H	α-helix	trans	-76.5	-25.8	176.4	-61.5	-60.7	-173.3	174.3	0	113.7	T830 W836 P893 R896	T830-K832 PolarHBondContact O-N 3.42Å; T830-K832 VanDerWaalsContact O-N 3.14Å; T830-K832 PolarHBondContact OG1-N 3.26Å; K832-W836 PolarHBondContact O-N 3.15Å; K832-P893 HydrophobicContact CB-CB 3.86Å; K832-P893 WeakPolarHBondContact CD-O 3.14Å; K832-P893 HydrophobicContact CG-CB 4.48Å; K832-P893 WeakPolarHBondContact CG-O 3.21Å; K832-R896 HydrophobicContact CD-CB 4.44Å; K832-R896 PolarHBondContact NZ-O 3.01Å; K832-R896 WeakPolarHBondContact O-CD 3.3Å; K832-R896 PolarHBondContact O-NH1 2.97Å
833	S	94.5	Very high	90.5	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.014	10%	0.099	C	C	.	.	H	α-helix	trans	-73	-35.5	169.4	64.8	0	0	0	0	110.8	S823 Y829 T830 V835 W836 S837	S823-S833 WeakPolarHBondContact OG-CB 3.42Å; Y829-S833 WeakPolarHBondContact CA-OG 3.45Å; T830-S833 PolarHBondContact N-OG 2.9Å; T830-S833 PolarHBondContact O-N 3.26Å; T830-S833 PolarHBondContact O-OG 3.27Å; T830-S833 PolarHBondContact OG1-N 2.77Å; T830-S833 VanDerWaalsContact OG1-N 3.16Å; S833-V835 VanDerWaalsContact C-N 3.29Å; S833-V835 PolarHBondContact O-N 2.95Å; S833-W836 VanDerWaalsContact O-CB 3.31Å; S833-W836 WeakPolarHBondContact O-CB 3.48Å; S833-W836 PolarHBondContact O-N 3.04Å; S833-W836 VanDerWaalsContact O-N 3.14Å; S833-S837 PolarHBondContact O-N 3.31Å; S833-S837 VanDerWaalsContact O-N 3.15Å; S833-S837 PolarHBondContact O-OG 3.21Å
834	D	96.9	Very high	91	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-65.5	-33	172.7	-73.8	-19.3	0	0	0	112.1	M766 I775 H776 R777 T830 S831 W836 S837 F838 F899	M766-D834 HydrophobicContact CE-CB 3.67Å; I775-D834 WeakPolarHBondContact CA-OD2 3.28Å; I775-D834 VanDerWaalsContact CG2-OD2 3.28Å; I775-D834 WeakPolarHBondContact CG2-OD2 3.47Å; H776-D834 PolarHBondContact N-OD2 2.79Å; R777-D834 PolarHBondContact N-OD1 3.41Å; T830-D834 PolarHBondContact O-N 3.1Å; T830-D834 VanDerWaalsContact O-N 3.16Å; S831-D834 PolarHBondContact O-N 3.26Å; D834-W836 VanDerWaalsContact C-N 3.29Å; D834-W836 PolarHBondContact O-N 3.42Å; D834-S837 PolarHBondContact O-N 3.16Å; D834-F838 WeakPolarHBondContact O-CB 3.47Å; D834-F838 PolarHBondContact O-N 3.18Å; D834-F899 HydrophobicContact CB-CE2 3.96Å; D834-F899 HydrophobicContact CB-CZ 4.13Å
835	V	98.4	Very high	91.8	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-60.3	-38.8	171.6	167.7	0	0	0	0	111.5	S831 S833 F838 G839 C888 R896 P897 F899 I902	S831-V835 WeakPolarHBondContact O-CG2 3.45Å; S831-V835 PolarHBondContact O-N 2.92Å; S831-V835 VanDerWaalsContact O-N 3.09Å; S833-V835 VanDerWaalsContact C-N 3.29Å; S833-V835 PolarHBondContact O-N 2.95Å; V835-F838 WeakPolarHBondContact O-CB 3.4Å; V835-F838 PolarHBondContact O-N 3.14Å; V835-G839 PolarHBondContact O-N 3.29Å; V835-C888 HydrophobicContact CG1-CB 4.04Å; V835-C888 WeakPolarHBondContact O-CB 3.38Å; V835-R896 HydrophobicContact CG1-CB 3.9Å; V835-P897 WeakPolarHBondContact CG1-O 3.04Å; V835-P897 WeakPolarHBondContact CG2-O 3.39Å; V835-F899 HydrophobicContact CG2-CD2 3.93Å; V835-F899 HydrophobicContact CG2-CE1 4.43Å; V835-F899 HydrophobicContact CG2-CE2 3.68Å; V835-F899 HydrophobicContact CG2-CG 4.4Å; V835-F899 HydrophobicContact CG2-CZ 3.95Å; V835-I902 HydrophobicContact CG1-CD1 3.86Å; V835-I902 HydrophobicContact CG2-CD1 4.17Å
836	W	98.4	Very high	92.8	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.8	-48.2	174	176.8	-72.9	0	0	0	111.1	M819 A820 I821 K832 S833 D834 F838 G839 V840 L865 W889	M819-W836 PolarHBondContact O-NE1 2.94Å; A820-W836 HydrophobicContact CB-CB 3.66Å; A820-W836 HydrophobicContact CB-CD2 3.98Å; A820-W836 HydrophobicContact CB-CE3 4.36Å; A820-W836 HydrophobicContact CB-CG 3.67Å; I821-W836 HydrophobicContact CD1-CH2 3.65Å; I821-W836 HydrophobicContact CD1-CZ3 3.88Å; I821-W836 HydrophobicContact CG1-CH2 3.61Å; I821-W836 HydrophobicContact CG1-CZ2 4.23Å; I821-W836 HydrophobicContact CG1-CZ3 3.99Å; K832-W836 PolarHBondContact O-N 3.15Å; S833-W836 VanDerWaalsContact O-CB 3.31Å; S833-W836 WeakPolarHBondContact O-CB 3.48Å; S833-W836 PolarHBondContact O-N 3.04Å; S833-W836 VanDerWaalsContact O-N 3.14Å; D834-W836 VanDerWaalsContact C-N 3.29Å; D834-W836 PolarHBondContact O-N 3.42Å; W836-F838 VanDerWaalsContact C-N 3.26Å; W836-F838 PolarHBondContact O-N 3.15Å; W836-G839 WeakPolarHBondContact O-CA 3.38Å; W836-G839 PolarHBondContact O-N 3.35Å; W836-V840 PolarHBondContact O-N 3.04Å; W836-V840 VanDerWaalsContact O-N 3.16Å; W836-L865 HydrophobicContact CH2-CD2 4.47Å; W836-L865 HydrophobicContact CZ2-CD1 4.18Å; W836-L865 HydrophobicContact CZ2-CD2 4.11Å; W836-W889 AromaticContact CD2-CD1 3.77Å; W836-W889 AromaticContact CE2-CD1 3.91Å; W836-W889 HydrophobicContact CE3-CB 4.11Å; W836-W889 HydrophobicContact CH2-CB 4.2Å; W836-W889 HydrophobicContact CZ3-CB 3.96Å; W836-W889 WeakPolarHBondContact CZ3-O 3.1Å; W836-W889 PolarHBondContact O-NE1 3.25Å
837	S	98.3	Very high	94	Very high	6 Å²	6	10.2 Å²	10.2	4%	0.042	6%	0.058	C	C	.	.	H	α-helix	trans	-59.6	-37.5	177.1	-53.6	0	0	0	0	111.7	L779 W818 S833 D834 G839 V840 L841	L779-S837 WeakPolarHBondContact O-CB 3.5Å; W818-S837 WeakPolarHBondContact O-CA 3.22Å; W818-S837 WeakPolarHBondContact O-CB 3.24Å; W818-S837 PolarHBondContact O-OG 3.34Å; S833-S837 PolarHBondContact O-N 3.31Å; S833-S837 VanDerWaalsContact O-N 3.15Å; S833-S837 PolarHBondContact O-OG 3.21Å; D834-S837 PolarHBondContact O-N 3.16Å; S837-G839 PolarHBondContact O-N 3.09Å; S837-V840 WeakPolarHBondContact O-CB 3.04Å; S837-V840 PolarHBondContact O-N 3.09Å; S837-L841 PolarHBondContact O-N 3.4Å
838	F	98.7	Very high	94.9	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-61.5	-40.9	171.9	178.6	-90.9	0	0	0	112.4	V762 A763 L779 D834 V835 W836 V840 L841 L842 F899 I902 L906	V762-F838 HydrophobicContact CB-CE2 4.18Å; V762-F838 HydrophobicContact CG1-CD2 3.92Å; V762-F838 HydrophobicContact CG1-CE2 3.93Å; A763-F838 HydrophobicContact CB-CE2 3.88Å; A763-F838 HydrophobicContact CB-CZ 3.89Å; L779-F838 HydrophobicContact CD2-CB 3.86Å; L779-F838 HydrophobicContact CD2-CD2 4.32Å; D834-F838 WeakPolarHBondContact O-CB 3.47Å; D834-F838 PolarHBondContact O-N 3.18Å; V835-F838 WeakPolarHBondContact O-CB 3.4Å; V835-F838 PolarHBondContact O-N 3.14Å; W836-F838 VanDerWaalsContact C-N 3.26Å; W836-F838 PolarHBondContact O-N 3.15Å; F838-V840 VanDerWaalsContact C-N 3.27Å; F838-V840 PolarHBondContact O-N 3.38Å; F838-L841 PolarHBondContact O-N 3.3Å; F838-L842 HydrophobicContact CE1-CB 4.36Å; F838-L842 HydrophobicContact CE1-CD2 4.3Å; F838-L842 WeakPolarHBondContact O-CB 3.37Å; F838-L842 PolarHBondContact O-N 2.82Å; F838-F899 HydrophobicContact CB-CE1 3.63Å; F838-F899 HydrophobicContact CB-CZ 3.94Å; F838-F899 HydrophobicContact CD1-CE1 4.44Å; F838-F899 AromaticContact CD2-CE1 3.85Å; F838-F899 HydrophobicContact CD2-CE1 3.85Å; F838-F899 AromaticContact CG-CE1 3.7Å; F838-F899 HydrophobicContact CG-CE1 3.7Å; F838-F899 HydrophobicContact CG-CZ 4.5Å; F838-I902 HydrophobicContact CD1-CD1 4.27Å; F838-I902 HydrophobicContact CD1-CG2 3.98Å; F838-I902 HydrophobicContact CE1-CG2 3.34Å; F838-I902 HydrophobicContact CZ-CG2 3.79Å; F838-L906 HydrophobicContact CE1-CD1 4.09Å; F838-L906 HydrophobicContact CZ-CD1 3.62Å
839	G	98.4	Very high	95.8	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-58.6	-40.9	174	0	0	0	0	0	112.1	V835 W836 S837 L842 W843 W889	V835-G839 PolarHBondContact O-N 3.29Å; W836-G839 WeakPolarHBondContact O-CA 3.38Å; W836-G839 PolarHBondContact O-N 3.35Å; S837-G839 PolarHBondContact O-N 3.09Å; G839-L842 PolarHBondContact O-N 3.04Å; G839-W843 PolarHBondContact O-N 3.07Å; G839-W843 VanDerWaalsContact O-N 3.12Å; G839-W889 VanDerWaalsContact C-CZ2 3.44Å; G839-W889 WeakPolarHBondContact O-CZ2 2.97Å
840	V	98.4	Very high	96.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-65.5	-45	174.7	-177.8	0	0	0	0	111	W818 W836 S837 F838 L842 W843 E844 P852 M871 W889	W818-V840 VanDerWaalsContact CD1-CG1 3.45Å; W818-V840 HydrophobicContact CD2-CG1 4.39Å; W818-V840 HydrophobicContact CG-CB 4.42Å; W818-V840 HydrophobicContact CG-CG1 3.98Å; W836-V840 PolarHBondContact O-N 3.04Å; W836-V840 VanDerWaalsContact O-N 3.16Å; S837-V840 WeakPolarHBondContact O-CB 3.04Å; S837-V840 PolarHBondContact O-N 3.09Å; F838-V840 VanDerWaalsContact C-N 3.27Å; F838-V840 PolarHBondContact O-N 3.38Å; V840-L842 VanDerWaalsContact C-N 3.34Å; V840-L842 PolarHBondContact O-N 3.21Å; V840-W843 WeakPolarHBondContact O-CA 3.04Å; V840-W843 WeakPolarHBondContact O-CB 3.43Å; V840-W843 PolarHBondContact O-N 3.31Å; V840-W843 VanDerWaalsContact O-N 3.1Å; V840-E844 PolarHBondContact O-N 3.38Å; V840-P852 HydrophobicContact CG1-CB 3.7Å; V840-P852 HydrophobicContact CG1-CG 3.6Å; V840-M871 HydrophobicContact CB-CE 4.37Å; V840-M871 HydrophobicContact CG1-CE 4.11Å; V840-M871 HydrophobicContact CG2-CE 4.15Å; V840-W889 HydrophobicContact CG2-CZ2 4.47Å
841	L	98.4	Very high	96.7	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-60.1	-41.5	175.4	180	158	0	0	0	112.3	V762 L779 V784 S837 F838 W843 E844 I845	V762-L841 HydrophobicContact CG1-CD1 4Å; V762-L841 HydrophobicContact CG1-CD2 4.21Å; V762-L841 HydrophobicContact CG2-CD2 4.49Å; L779-L841 HydrophobicContact CD1-CD1 3.97Å; L779-L841 HydrophobicContact CG-CD1 3.9Å; V784-L841 HydrophobicContact CG2-CD1 3.88Å; S837-L841 PolarHBondContact O-N 3.4Å; F838-L841 PolarHBondContact O-N 3.3Å; L841-W843 VanDerWaalsContact C-N 3.26Å; L841-W843 PolarHBondContact O-N 3.19Å; L841-E844 WeakPolarHBondContact O-CB 3Å; L841-E844 PolarHBondContact O-N 3.04Å; L841-E844 VanDerWaalsContact O-N 3.11Å; L841-I845 HydrophobicContact CD2-CD1 3.47Å; L841-I845 VanDerWaalsContact CD2-CD1 3.47Å; L841-I845 HydrophobicContact CD2-CG1 4.1Å; L841-I845 WeakPolarHBondContact O-CG1 3.47Å; L841-I845 PolarHBondContact O-N 3.3Å
842	L	98.5	Very high	97	Very high	1 Å²	1	4.4 Å²	4.4	1%	0.005	2%	0.021	C	C	.	.	H	α-helix	trans	-61.6	-38.4	175.6	-177.8	58	0	0	0	110.7	A759 F838 G839 V840 I845 V846 V881 L884 M885	A759-L842 HydrophobicContact CB-CD1 3.68Å; F838-L842 HydrophobicContact CE1-CB 4.36Å; F838-L842 HydrophobicContact CE1-CD2 4.3Å; F838-L842 WeakPolarHBondContact O-CB 3.37Å; F838-L842 PolarHBondContact O-N 2.82Å; G839-L842 PolarHBondContact O-N 3.04Å; V840-L842 VanDerWaalsContact C-N 3.34Å; V840-L842 PolarHBondContact O-N 3.21Å; L842-I845 PolarHBondContact O-N 3.11Å; L842-V846 HydrophobicContact CD1-CG2 4.44Å; L842-V846 WeakPolarHBondContact O-CG2 2.97Å; L842-V846 PolarHBondContact O-N 2.83Å; L842-V881 HydrophobicContact CD1-CG1 4.45Å; L842-V881 HydrophobicContact CD2-CG1 4.36Å; L842-V881 HydrophobicContact CG-CG1 4.44Å; L842-L884 HydrophobicContact CD2-CD2 4.05Å; L842-L884 HydrophobicContact CD2-CG 4.18Å; L842-M885 HydrophobicContact CB-CE 4.44Å; L842-M885 HydrophobicContact CB-CG 4.35Å; L842-M885 HydrophobicContact CD2-CE 4.43Å; L842-M885 HydrophobicContact CD2-CG 3.82Å; L842-M885 HydrophobicContact CG-CE 3.82Å; L842-M885 HydrophobicContact CG-CG 4.03Å
843	W	98.4	Very high	96.9	Very high	23 Å²	23	2.4 Å²	2.4	9%	0.087	1%	0.012	C	C	.	.	H	α-helix	trans	-65.4	-40.1	172.9	-172.8	99.3	0	0	0	112	G839 V840 L841 V846 S847 G850 M871 E872 M885 W889 A928	G839-W843 PolarHBondContact O-N 3.07Å; G839-W843 VanDerWaalsContact O-N 3.12Å; V840-W843 WeakPolarHBondContact O-CA 3.04Å; V840-W843 WeakPolarHBondContact O-CB 3.43Å; V840-W843 PolarHBondContact O-N 3.31Å; V840-W843 VanDerWaalsContact O-N 3.1Å; L841-W843 VanDerWaalsContact C-N 3.26Å; L841-W843 PolarHBondContact O-N 3.19Å; W843-V846 PolarHBondContact O-N 3.06Å; W843-S847 WeakPolarHBondContact CZ3-OG 3.47Å; W843-S847 WeakPolarHBondContact O-CB 3.46Å; W843-S847 PolarHBondContact O-N 3.04Å; W843-S847 PolarHBondContact O-OG 2.92Å; W843-G850 WeakPolarHBondContact CZ3-O 3.04Å; W843-M871 HydrophobicContact CB-CE 3.89Å; W843-M871 HydrophobicContact CD2-CE 4.06Å; W843-M871 HydrophobicContact CD2-SD 3.82Å; W843-M871 HydrophobicContact CE3-CE 4.45Å; W843-M871 HydrophobicContact CE3-SD 4.06Å; W843-M871 HydrophobicContact CG-CE 3.79Å; W843-M871 HydrophobicContact CG-SD 4.15Å; W843-M871 HydrophobicContact CZ2-SD 4.47Å; W843-M871 HydrophobicContact CZ3-SD 4.48Å; W843-E872 PolarHBondContact NE1-O 3.09Å; W843-E872 VanDerWaalsContact NE1-O 3.15Å; W843-M885 HydrophobicContact CB-CE 4.18Å; W843-M885 HydrophobicContact CB-SD 3.94Å; W843-M885 HydrophobicContact CG-SD 4.35Å; W843-W889 HydrophobicContact CB-CH2 4.12Å; W843-W889 HydrophobicContact CB-CZ2 4.16Å; W843-W889 HydrophobicContact CG-CH2 4.35Å; W843-A928 HydrophobicContact CH2-CB 3.98Å; W843-A928 HydrophobicContact CZ2-CB 4.43Å
844	E	98.1	Very high	96.6	Very high	2 Å²	2	5 Å²	5	1%	0.009	3%	0.03	C	C	.	.	H	α-helix	trans	-59.4	-46.1	172.4	-66	179.8	95.1	0	0	111.6	A781 W818 V840 L841 S847 L848 G849 P852	A781-E844 HydrophobicContact CB-CB 4.1Å; A781-E844 PolarHBondContact N-OE2 2.87Å; A781-E844 VanDerWaalsContact N-OE2 3.09Å; W818-E844 WeakPolarHBondContact CZ2-OE1 3.17Å; W818-E844 PolarHBondContact NE1-OE2 2.91Å; V840-E844 PolarHBondContact O-N 3.38Å; L841-E844 WeakPolarHBondContact O-CB 3Å; L841-E844 PolarHBondContact O-N 3.04Å; L841-E844 VanDerWaalsContact O-N 3.11Å; E844-S847 WeakPolarHBondContact CA-OG 3.43Å; E844-S847 PolarHBondContact O-N 3.07Å; E844-S847 PolarHBondContact O-OG 2.98Å; E844-L848 PolarHBondContact O-N 3.36Å; E844-L848 VanDerWaalsContact O-N 3.15Å; E844-G849 PolarHBondContact O-N 3.26Å; E844-P852 HydrophobicContact CG-CG 3.85Å
845	I	97.9	Very high	96.1	Very high	1 Å²	1	8 Å²	8	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-58	-52.4	177.8	-69.6	174.5	0	0	0	110.8	L724 L728 L755 F758 A759 L841 L842 S847 L848	L724-I845 HydrophobicContact CD2-CD1 4.15Å; L724-I845 HydrophobicContact CD2-CG1 4.08Å; L728-I845 HydrophobicContact CD1-CG1 4.27Å; L755-I845 HydrophobicContact CB-CG2 3.88Å; L755-I845 HydrophobicContact CD2-CG2 4Å; L755-I845 WeakPolarHBondContact O-CG2 3.5Å; F758-I845 HydrophobicContact CB-CD1 4.09Å; A759-I845 HydrophobicContact CB-CD1 4.09Å; L841-I845 HydrophobicContact CD2-CD1 3.47Å; L841-I845 VanDerWaalsContact CD2-CD1 3.47Å; L841-I845 HydrophobicContact CD2-CG1 4.1Å; L841-I845 WeakPolarHBondContact O-CG1 3.47Å; L841-I845 PolarHBondContact O-N 3.3Å; L842-I845 PolarHBondContact O-N 3.11Å; I845-S847 VanDerWaalsContact C-N 3.32Å; I845-S847 PolarHBondContact O-N 2.93Å; I845-L848 PolarHBondContact O-N 2.79Å
846	V	96.7	Very high	95.5	Very high	1 Å²	1	9 Å²	9	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-68.3	-33.3	-175.9	173.6	0	0	0	0	111.9	L842 W843 L848 P874 N876 C877 V881 M885 V917	L842-V846 HydrophobicContact CD1-CG2 4.44Å; L842-V846 WeakPolarHBondContact O-CG2 2.97Å; L842-V846 PolarHBondContact O-N 2.83Å; W843-V846 PolarHBondContact O-N 3.06Å; V846-L848 PolarHBondContact O-N 2.87Å; V846-P874 HydrophobicContact CG1-CB 4.17Å; V846-P874 HydrophobicContact CG1-CG 4.12Å; V846-N876 PolarHBondContact O-ND2 2.77Å; V846-C877 HydrophobicContact CG1-CB 3.63Å; V846-V881 HydrophobicContact CG2-CG1 3.93Å; V846-M885 HydrophobicContact CB-CE 3.96Å; V846-M885 HydrophobicContact CG1-CE 4.46Å; V846-M885 HydrophobicContact CG2-CE 3.71Å; V846-V917 HydrophobicContact CG1-CG1 4.21Å; V846-V917 HydrophobicContact CG1-CG2 4.39Å; V846-V917 HydrophobicContact CG2-CG2 4.16Å
847	S	95.9	Very high	94.8	Very high	5 Å²	5	12.6 Å²	12.6	4%	0.035	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	4.3	177.6	68.1	0	0	0	0	114.1	R732 W843 E844 I845 G849 G850	R732-S847 PolarHBondContact NH2-O 2.8Å; W843-S847 WeakPolarHBondContact CZ3-OG 3.47Å; W843-S847 WeakPolarHBondContact O-CB 3.46Å; W843-S847 PolarHBondContact O-N 3.04Å; W843-S847 PolarHBondContact O-OG 2.92Å; E844-S847 WeakPolarHBondContact CA-OG 3.43Å; E844-S847 PolarHBondContact O-N 3.07Å; E844-S847 PolarHBondContact O-OG 2.98Å; I845-S847 VanDerWaalsContact C-N 3.32Å; I845-S847 PolarHBondContact O-N 2.93Å; S847-G849 PolarHBondContact O-N 2.98Å; S847-G850 PolarHBondContact OG-N 3.32Å
848	L	96.3	Very high	93.9	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	46.5	-175.1	-54.7	174.6	0	0	0	112.7	L728 R732 L755 E844 I845 V846 M919 Y927	L728-L848 HydrophobicContact CD2-CD2 4.44Å; R732-L848 HydrophobicContact CG-CB 4.07Å; R732-L848 HydrophobicContact CG-CD1 4.26Å; R732-L848 PolarHBondContact NE-O 2.01Å; R732-L848 PolarHBondContact NH2-O 3Å; L755-L848 HydrophobicContact CD1-CD2 3.98Å; L755-L848 HydrophobicContact CD2-CD2 4.03Å; E844-L848 PolarHBondContact O-N 3.36Å; E844-L848 VanDerWaalsContact O-N 3.15Å; I845-L848 PolarHBondContact O-N 2.79Å; V846-L848 PolarHBondContact O-N 2.87Å; L848-M919 HydrophobicContact CD1-CE 3.65Å; L848-M919 HydrophobicContact CD2-CE 4.03Å; L848-M919 HydrophobicContact CG-CE 4.18Å; L848-Y927 HydrophobicContact CD1-CD1 4.07Å; L848-Y927 HydrophobicContact CD1-CE1 3.69Å
849	G	95.3	Very high	92.8	Very high	0 Å²	0	18 Å²	18	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	79.3	32.3	176	0	0	0	0	0	114.5	R729 E844 S847	R729-G849 PolarHBondContact NE-O 2.84Å; R729-G849 PolarHBondContact NH2-O 3Å; E844-G849 PolarHBondContact O-N 3.26Å; S847-G849 PolarHBondContact O-N 2.98Å
850	G	94.6	Very high	92.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-64.9	152.8	169.5	0	0	0	0	0	111.3	R732 W843 S847 P852	R732-G850 VanDerWaalsContact NH2-N 3.18Å; W843-G850 WeakPolarHBondContact CZ3-O 3.04Å; S847-G850 PolarHBondContact OG-N 3.32Å; G850-P852 WeakPolarHBondContact O-CD 3.31Å
851	T	93.6	Very high	91.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-74.5	121.9	177.1	-53.1	0	0	0	0	109.4	Y853 C854 G929 I930 D931 A934 E935	T851-Y853 PolarHBondContact O-N 2.04Å; T851-C854 WeakPolarHBondContact O-CB 3.37Å; T851-C854 PolarHBondContact O-N 3.26Å; T851-C854 VanDerWaalsContact O-N 3.1Å; T851-G929 PolarHBondContact N-O 3.32Å; T851-I930 WeakPolarHBondContact OG1-CA 3.37Å; T851-D931 HydrophobicContact CG2-CB 4.25Å; T851-D931 PolarHBondContact OG1-N 2.85Å; T851-A934 HydrophobicContact CG2-CB 4.41Å; T851-E935 HydrophobicContact CG2-CG 4.49Å; T851-E935 PolarHBondContact OG1-OE1 3.47Å
852	P	95.2	Very high	90.2	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	132.2	178	-26.9	36.4	0	0	0	111.5	R817 W818 V840 E844 G850 C854 M871	R817-P852 HydrophobicContact CB-CB 4.34Å; R817-P852 WeakPolarHBondContact CD-O 3.32Å; R817-P852 PolarHBondContact NH1-O 3.25Å; W818-P852 HydrophobicContact CH2-CG 4.26Å; W818-P852 HydrophobicContact CZ2-CG 3.69Å; V840-P852 HydrophobicContact CG1-CB 3.7Å; V840-P852 HydrophobicContact CG1-CG 3.6Å; E844-P852 HydrophobicContact CG-CG 3.85Å; G850-P852 WeakPolarHBondContact O-CD 3.31Å; P852-C854 VanDerWaalsContact C-N 3.27Å; P852-C854 PolarHBondContact O-N 2.89Å; P852-M871 HydrophobicContact CB-CE 4.46Å; P852-M871 HydrophobicContact CB-SD 3.85Å
853	Y	93.3	Very high	89.4	Confident	6 Å²	6	31.7 Å²	31.7	2%	0.024	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	40.9	-176.2	-47.4	-83	0	0	0	113.2	R817 T851 G855 M856 L861 L865 Y869 M871	R817-Y853 HydrophobicContact CB-CD2 4.35Å; R817-Y853 PolarHBondContact NH1-O 3.41Å; R817-Y853 WeakPolarHBondContact O-CE2 3.44Å; T851-Y853 PolarHBondContact O-N 2.04Å; Y853-G855 PolarHBondContact O-N 3.32Å; Y853-M856 HydrophobicContact CD1-CE 4.06Å; Y853-M856 HydrophobicContact CG-CE 4.45Å; Y853-M856 PolarHBondContact O-N 3.3Å; Y853-L861 HydrophobicContact CD1-CD2 3.51Å; Y853-L861 HydrophobicContact CD2-CD1 3.95Å; Y853-L861 HydrophobicContact CD2-CD2 3.91Å; Y853-L861 HydrophobicContact CE1-CD2 4.03Å; Y853-L861 HydrophobicContact CE2-CD2 4.42Å; Y853-L861 HydrophobicContact CG-CD1 4.16Å; Y853-L861 HydrophobicContact CG-CD2 3.44Å; Y853-L861 VanDerWaalsContact CG-CD2 3.44Å; Y853-L861 HydrophobicContact CG-CG 4.44Å; Y853-L865 HydrophobicContact CE1-CD2 3.92Å; Y853-Y869 AromaticContact CD1-CE1 3.94Å; Y853-Y869 HydrophobicContact CD1-CE1 3.94Å; Y853-Y869 HydrophobicContact CE1-CD1 4.49Å; Y853-Y869 HydrophobicContact CE1-CE1 4.13Å; Y853-M871 HydrophobicContact CD1-CG 3.4Å; Y853-M871 HydrophobicContact CD1-SD 4.16Å; Y853-M871 HydrophobicContact CD2-CG 4.31Å; Y853-M871 HydrophobicContact CD2-SD 4.04Å; Y853-M871 HydrophobicContact CE1-CB 4.39Å; Y853-M871 HydrophobicContact CE1-CG 3.2Å; Y853-M871 HydrophobicContact CE1-SD 4.13Å; Y853-M871 HydrophobicContact CE2-CE 4.21Å; Y853-M871 HydrophobicContact CE2-CG 4.12Å; Y853-M871 HydrophobicContact CE2-SD 3.95Å; Y853-M871 HydrophobicContact CG-CG 3.97Å; Y853-M871 HydrophobicContact CG-SD 4.13Å
854	C	89.5	Confident	88.8	Confident	57 Å²	57	34.1 Å²	34.1	39%	0.385	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	132.1	179.3	-173	0	0	0	0	111.6	T851 P852 M856	T851-C854 WeakPolarHBondContact O-CB 3.37Å; T851-C854 PolarHBondContact O-N 3.26Å; T851-C854 VanDerWaalsContact O-N 3.1Å; P852-C854 VanDerWaalsContact C-N 3.27Å; P852-C854 PolarHBondContact O-N 2.89Å; C854-M856 VanDerWaalsContact C-N 3.32Å; C854-M856 PolarHBondContact O-N 2.85Å
855	G	85.8	Confident	88.3	Confident	64 Å²	64	34.1 Å²	34.1	66%	0.66	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.3	-3.7	-179	0	0	0	0	0	115.8	Y853	Y853-G855 PolarHBondContact O-N 3.32Å
856	M	86	Confident	87.7	Confident	22 Å²	22	37 Å²	37	11%	0.108	22%	0.22	C	C	.	.			trans	-102.6	142.9	170.8	-76	175	-86.3	0	0	111.7	R817 Y853 C854 L861 K864 Y869	R817-M856 PolarHBondContact NH1-O 3.45Å; R817-M856 PolarHBondContact NH2-O 2.03Å; Y853-M856 HydrophobicContact CD1-CE 4.06Å; Y853-M856 HydrophobicContact CG-CE 4.45Å; Y853-M856 PolarHBondContact O-N 3.3Å; C854-M856 VanDerWaalsContact C-N 3.32Å; C854-M856 PolarHBondContact O-N 2.85Å; M856-L861 HydrophobicContact SD-CD2 4.39Å; M856-K864 HydrophobicContact SD-CD 4.18Å; M856-Y869 HydrophobicContact CE-CE1 3.65Å; M856-Y869 WeakPolarHBondContact CE-OH 3.32Å; M856-Y869 HydrophobicContact SD-CE1 3.92Å
857	T	83.4	Confident	87.2	Confident	75 Å²	75	44.2 Å²	44.2	46%	0.46	25%	0.253	S	S	.	.			trans	-77.2	158.1	171.7	65.6	0	0	0	0	111.6	A859 E860 L861	T857-A859 PolarHBondContact O-N 3.4Å; T857-E860 PolarHBondContact N-OE2 2.81Å; T857-E860 PolarHBondContact O-N 3.07Å; T857-E860 WeakPolarHBondContact OG1-CG 3.42Å; T857-E860 PolarHBondContact OG1-N 2.74Å; T857-E860 PolarHBondContact OG1-OE2 3.15Å; T857-L861 PolarHBondContact O-N 3.39Å
858	C	78.9	Confident	86.8	Confident	54 Å²	54	46 Å²	46	37%	0.365	27%	0.272	S	S	.	.	H	α-helix	trans	-57	-35.2	174	-70.6	0	0	0	0	112.8	V816 L861 Y862	V816-C858 HydrophobicContact CB-CB 4.37Å; V816-C858 HydrophobicContact CG1-CB 3.87Å; C858-L861 WeakPolarHBondContact O-CB 3.4Å; C858-L861 PolarHBondContact O-N 3Å; C858-Y862 WeakPolarHBondContact O-CD2 3.06Å; C858-Y862 PolarHBondContact O-N 3.18Å
859	A	75.9	Confident	86.8	Confident	66 Å²	66	49.4 Å²	49.4	55%	0.545	29%	0.285	S	S	.	.	H	α-helix	trans	-66.4	-41.6	179.1	0	0	0	0	0	112.2	T857 L861 Y862 E863	T857-A859 PolarHBondContact O-N 3.4Å; A859-L861 PolarHBondContact O-N 3.07Å; A859-Y862 WeakPolarHBondContact O-CB 3.29Å; A859-Y862 PolarHBondContact O-N 3.02Å; A859-E863 PolarHBondContact O-N 2.8Å
860	E	83.1	Confident	86.8	Confident	67 Å²	67	51 Å²	51	31%	0.313	29%	0.291	S	S	.	.	H	α-helix	trans	-63.4	-31.1	175.8	-71	167.7	115.4	0	0	112.2	T857 E863 K864	T857-E860 PolarHBondContact N-OE2 2.81Å; T857-E860 PolarHBondContact O-N 3.07Å; T857-E860 WeakPolarHBondContact OG1-CG 3.42Å; T857-E860 PolarHBondContact OG1-N 2.74Å; T857-E860 PolarHBondContact OG1-OE2 3.15Å; E860-E863 PolarHBondContact O-N 2.73Å; E860-K864 VanDerWaalsContact O-CB 3.32Å; E860-K864 WeakPolarHBondContact O-CB 3.45Å; E860-K864 WeakPolarHBondContact O-CG 3.35Å; E860-K864 PolarHBondContact O-N 2.83Å
861	L	81	Confident	86.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-38.8	175.6	-66.4	177.1	0	0	0	112.5	R817 Y853 M856 T857 C858 A859 E863 L865	R817-L861 HydrophobicContact CG-CD1 3.93Å; Y853-L861 HydrophobicContact CD1-CD2 3.51Å; Y853-L861 HydrophobicContact CD2-CD1 3.95Å; Y853-L861 HydrophobicContact CD2-CD2 3.91Å; Y853-L861 HydrophobicContact CE1-CD2 4.03Å; Y853-L861 HydrophobicContact CE2-CD2 4.42Å; Y853-L861 HydrophobicContact CG-CD1 4.16Å; Y853-L861 HydrophobicContact CG-CD2 3.44Å; Y853-L861 VanDerWaalsContact CG-CD2 3.44Å; Y853-L861 HydrophobicContact CG-CG 4.44Å; M856-L861 HydrophobicContact SD-CD2 4.39Å; T857-L861 PolarHBondContact O-N 3.39Å; C858-L861 WeakPolarHBondContact O-CB 3.4Å; C858-L861 PolarHBondContact O-N 3Å; A859-L861 PolarHBondContact O-N 3.07Å; L861-E863 PolarHBondContact O-N 3.41Å; L861-L865 HydrophobicContact CB-CD1 4.2Å; L861-L865 HydrophobicContact CB-CG 4.49Å; L861-L865 WeakPolarHBondContact O-CB 3.48Å; L861-L865 VanDerWaalsContact O-CG 3.27Å; L861-L865 WeakPolarHBondContact O-CG 3.45Å; L861-L865 PolarHBondContact O-N 3.31Å
862	Y	77.3	Confident	86.7	Confident	88 Å²	88	58.3 Å²	58.3	35%	0.345	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-34.9	174.6	-90.1	-87.4	0	0	0	112.2	V816 L824 C858 A859 P866	V816-Y862 HydrophobicContact CG1-CE2 4.15Å; L824-Y862 HydrophobicContact CB-CD1 4.18Å; L824-Y862 HydrophobicContact CB-CE1 3.65Å; L824-Y862 HydrophobicContact CD2-CE1 4.23Å; L824-Y862 HydrophobicContact CD2-CE2 3.87Å; L824-Y862 HydrophobicContact CG-CE1 4.5Å; L824-Y862 VanDerWaalsContact O-CE1 3.32Å; L824-Y862 WeakPolarHBondContact O-CE1 2.99Å; L824-Y862 PolarHBondContact O-OH 3.3Å; C858-Y862 WeakPolarHBondContact O-CD2 3.06Å; C858-Y862 PolarHBondContact O-N 3.18Å; A859-Y862 WeakPolarHBondContact O-CB 3.29Å; A859-Y862 PolarHBondContact O-N 3.02Å; Y862-P866 WeakPolarHBondContact O-CD 3.48Å; Y862-P866 WeakPolarHBondContact O-CG 3Å
863	E	81.2	Confident	86.7	Confident	133 Å²	133	61.8 Å²	61.8	62%	0.621	34%	0.341	S	S	*	.	H	α-helix	trans	-83.7	-45.1	179.8	-65.1	-173.7	169.7	0	0	112.5	A859 E860 L861 Q867	A859-E863 PolarHBondContact O-N 2.8Å; E860-E863 PolarHBondContact O-N 2.73Å; L861-E863 PolarHBondContact O-N 3.41Å; E863-Q867 VanDerWaalsContact O-CD 3.31Å; E863-Q867 VanDerWaalsContact O-CG 3.28Å; E863-Q867 WeakPolarHBondContact O-CG 3.15Å; E863-Q867 PolarHBondContact O-NE2 3.29Å
864	K	86.7	Confident	86.7	Confident	74 Å²	74	62.2 Å²	62.2	32%	0.322	34%	0.344	S	S	.	.	H	α-helix	trans	-79.8	-36.6	-170.8	-69.7	-173.7	179.2	-179.7	0	113.6	M856 E860 Q867 Y869	M856-K864 HydrophobicContact SD-CD 4.18Å; E860-K864 VanDerWaalsContact O-CB 3.32Å; E860-K864 WeakPolarHBondContact O-CB 3.45Å; E860-K864 WeakPolarHBondContact O-CG 3.35Å; E860-K864 PolarHBondContact O-N 2.83Å; K864-Q867 WeakPolarHBondContact O-CB 3.22Å; K864-Q867 PolarHBondContact O-N 3.2Å; K864-Q867 VanDerWaalsContact O-N 3.08Å; K864-Y869 HydrophobicContact CB-CD1 4.25Å; K864-Y869 HydrophobicContact CB-CG 4.15Å; K864-Y869 VanDerWaalsContact O-CB 3.23Å; K864-Y869 WeakPolarHBondContact O-CB 3.39Å; K864-Y869 PolarHBondContact O-N 2.67Å; K864-Y869 VanDerWaalsContact O-N 3.16Å
865	L	87.6	Confident	86.6	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-61.5	-44.8	-177.4	-67.8	174.1	0	0	0	112.6	I821 L824 W836 Y853 L861 Q867 G868 Y869 R870	I821-L865 HydrophobicContact CD1-CB 4.34Å; I821-L865 HydrophobicContact CG1-CB 4.02Å; L824-L865 HydrophobicContact CD1-CD1 3.72Å; W836-L865 HydrophobicContact CH2-CD2 4.47Å; W836-L865 HydrophobicContact CZ2-CD1 4.18Å; W836-L865 HydrophobicContact CZ2-CD2 4.11Å; Y853-L865 HydrophobicContact CE1-CD2 3.92Å; L861-L865 HydrophobicContact CB-CD1 4.2Å; L861-L865 HydrophobicContact CB-CG 4.49Å; L861-L865 WeakPolarHBondContact O-CB 3.48Å; L861-L865 VanDerWaalsContact O-CG 3.27Å; L861-L865 WeakPolarHBondContact O-CG 3.45Å; L861-L865 PolarHBondContact O-N 3.31Å; L865-Q867 PolarHBondContact O-N 2.92Å; L865-G868 PolarHBondContact O-N 3.38Å; L865-G868 VanDerWaalsContact O-N 3.13Å; L865-Y869 WeakPolarHBondContact CD2-O 3.45Å; L865-R870 PolarHBondContact O-NH1 2.04Å
866	P	84.1	Confident	86.8	Confident	62 Å²	62	64.5 Å²	64.5	40%	0.403	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-66.2	-20	173.8	-22	35.2	0	0	0	114.6	I821 Y862 G868	I821-P866 HydrophobicContact CG2-CG 4.23Å; Y862-P866 WeakPolarHBondContact O-CD 3.48Å; Y862-P866 WeakPolarHBondContact O-CG 3Å; P866-G868 PolarHBondContact O-N 3.31Å
867	Q	86.4	Confident	87.2	Confident	151 Å²	151	63.9 Å²	63.9	71%	0.706	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-81.8	5	174.5	-63.6	171.6	28.3	0	0	112.7	E863 K864 L865	E863-Q867 VanDerWaalsContact O-CD 3.31Å; E863-Q867 VanDerWaalsContact O-CG 3.28Å; E863-Q867 WeakPolarHBondContact O-CG 3.15Å; E863-Q867 PolarHBondContact O-NE2 3.29Å; K864-Q867 WeakPolarHBondContact O-CB 3.22Å; K864-Q867 PolarHBondContact O-N 3.2Å; K864-Q867 VanDerWaalsContact O-N 3.08Å; L865-Q867 PolarHBondContact O-N 2.92Å
868	G	88.7	Confident	87.7	Confident	42 Å²	42	62.1 Å²	62.1	43%	0.433	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	4	178.9	0	0	0	0	0	114.6	L865 P866	L865-G868 PolarHBondContact O-N 3.38Å; L865-G868 VanDerWaalsContact O-N 3.13Å; P866-G868 PolarHBondContact O-N 3.31Å
869	Y	94.6	Very high	88.4	Confident	73 Å²	73	64.8 Å²	64.8	29%	0.286	33%	0.327	S	S	.	.			trans	-64.2	137.5	175	179.3	-95.4	0	0	0	111	Y853 M856 K864 L865	Y853-Y869 AromaticContact CD1-CE1 3.94Å; Y853-Y869 HydrophobicContact CD1-CE1 3.94Å; Y853-Y869 HydrophobicContact CE1-CD1 4.49Å; Y853-Y869 HydrophobicContact CE1-CE1 4.13Å; M856-Y869 HydrophobicContact CE-CE1 3.65Å; M856-Y869 WeakPolarHBondContact CE-OH 3.32Å; M856-Y869 HydrophobicContact SD-CE1 3.92Å; K864-Y869 HydrophobicContact CB-CD1 4.25Å; K864-Y869 HydrophobicContact CB-CG 4.15Å; K864-Y869 VanDerWaalsContact O-CB 3.23Å; K864-Y869 WeakPolarHBondContact O-CB 3.39Å; K864-Y869 PolarHBondContact O-N 2.67Å; K864-Y869 VanDerWaalsContact O-N 3.16Å; L865-Y869 WeakPolarHBondContact CD2-O 3.45Å
870	R	95.6	Very high	89.3	Confident	34 Å²	34	64.8 Å²	64.8	13%	0.128	32%	0.315	C	S	.	.			trans	-138.4	158.5	174.9	-64	-61.2	-179.1	-86.7	0.5	110	L865 W889 D891	L865-R870 PolarHBondContact O-NH1 2.04Å; R870-W889 HydrophobicContact CB-CE3 4.28Å; R870-W889 VanDerWaalsContact CZ-O 3.26Å; R870-W889 PolarHBondContact NE-O 2.69Å; R870-W889 PolarHBondContact NH2-O 2.89Å; R870-D891 IonicContact CZ-OD1 2.65Å; R870-D891 IonicContact NH1-OD1 2.79Å; R870-D891 IonicContact NH2-OD1 3.92Å; R870-D891 PolarHBondContact NH2-OD1 2.91Å
871	M	94.8	Very high	89.8	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.02	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-58.5	140.3	176.8	-67.6	-173.1	-72.8	0	0	111.1	V840 W843 P852 Y853 Y882 W889	V840-M871 HydrophobicContact CB-CE 4.37Å; V840-M871 HydrophobicContact CG1-CE 4.11Å; V840-M871 HydrophobicContact CG2-CE 4.15Å; W843-M871 HydrophobicContact CB-CE 3.89Å; W843-M871 HydrophobicContact CD2-CE 4.06Å; W843-M871 HydrophobicContact CD2-SD 3.82Å; W843-M871 HydrophobicContact CE3-CE 4.45Å; W843-M871 HydrophobicContact CE3-SD 4.06Å; W843-M871 HydrophobicContact CG-CE 3.79Å; W843-M871 HydrophobicContact CG-SD 4.15Å; W843-M871 HydrophobicContact CZ2-SD 4.47Å; W843-M871 HydrophobicContact CZ3-SD 4.48Å; P852-M871 HydrophobicContact CB-CE 4.46Å; P852-M871 HydrophobicContact CB-SD 3.85Å; Y853-M871 HydrophobicContact CD1-CG 3.4Å; Y853-M871 HydrophobicContact CD1-SD 4.16Å; Y853-M871 HydrophobicContact CD2-CG 4.31Å; Y853-M871 HydrophobicContact CD2-SD 4.04Å; Y853-M871 HydrophobicContact CE1-CB 4.39Å; Y853-M871 HydrophobicContact CE1-CG 3.2Å; Y853-M871 HydrophobicContact CE1-SD 4.13Å; Y853-M871 HydrophobicContact CE2-CE 4.21Å; Y853-M871 HydrophobicContact CE2-CG 4.12Å; Y853-M871 HydrophobicContact CE2-SD 3.95Å; Y853-M871 HydrophobicContact CG-CG 3.97Å; Y853-M871 HydrophobicContact CG-SD 4.13Å; M871-Y882 WeakPolarHBondContact O-CE2 3.47Å; M871-Y882 PolarHBondContact O-OH 2.98Å; M871-W889 HydrophobicContact CB-CH2 4.18Å; M871-W889 HydrophobicContact CB-CZ3 4.39Å; M871-W889 HydrophobicContact CE-CH2 3.57Å; M871-W889 HydrophobicContact CE-CZ2 3.3Å
872	E	92.4	Very high	90.6	Very high	150 Å²	150	63.1 Å²	63.1	70%	0.701	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-65.3	151.8	176.6	-63.4	-178.8	-178.4	0	0	111.4	W843 P874	W843-E872 PolarHBondContact NE1-O 3.09Å; W843-E872 VanDerWaalsContact NE1-O 3.15Å; E872-P874 WeakPolarHBondContact O-CD 3.03Å
873	K	95	Very high	91.5	Very high	74 Å²	74	62.8 Å²	62.8	32%	0.322	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-63.9	122.8	175.5	-177.4	179	176.6	-154.1	0	109.8	K875 C877 D879 Y882	K873-K875 PolarHBondContact O-N 2.87Å; K873-C877 WeakPolarHBondContact CE-O 3.4Å; K873-C877 HydrophobicContact CG-CB 4.22Å; K873-C877 PolarHBondContact NZ-O 2.72Å; K873-D879 WeakPolarHBondContact CE-OD1 3.35Å; K873-D879 IonicContact NZ-OD1 3.06Å; K873-D879 PolarHBondContact NZ-OD1 3.13Å; K873-Y882 VanDerWaalsContact CA-CE2 3.4Å; K873-Y882 HydrophobicContact CB-CD1 3.77Å; K873-Y882 HydrophobicContact CB-CD2 3.74Å; K873-Y882 HydrophobicContact CB-CE1 3.82Å; K873-Y882 HydrophobicContact CB-CE2 3.79Å; K873-Y882 HydrophobicContact CB-CG 3.73Å; K873-Y882 HydrophobicContact CD-CD1 4Å; K873-Y882 HydrophobicContact CD-CG 3.99Å; K873-Y882 HydrophobicContact CG-CD1 3.93Å; K873-Y882 HydrophobicContact CG-CD2 3.88Å; K873-Y882 HydrophobicContact CG-CE1 4.48Å; K873-Y882 HydrophobicContact CG-CE2 4.44Å; K873-Y882 HydrophobicContact CG-CG 3.59Å
874	P	92.8	Very high	92.3	Very high	15 Å²	15	56.5 Å²	56.5	10%	0.097	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-58.2	139.3	173.2	-22.5	32.8	0	0	0	111.1	V846 E872 N876 C877	V846-P874 HydrophobicContact CG1-CB 4.17Å; V846-P874 HydrophobicContact CG1-CG 4.12Å; E872-P874 WeakPolarHBondContact O-CD 3.03Å; P874-N876 VanDerWaalsContact CB-OD1 3.25Å; P874-N876 WeakPolarHBondContact CB-OD1 3.24Å; P874-N876 PolarHBondContact O-N 2.78Å; P874-N876 VanDerWaalsContact O-N 3.14Å; P874-C877 HydrophobicContact CB-CB 3.99Å; P874-C877 HydrophobicContact CG-CB 4.26Å; P874-C877 WeakPolarHBondContact O-CB 3.41Å; P874-C877 PolarHBondContact O-N 3.45Å
875	K	88.3	Confident	92.8	Very high	151 Å²	151	53 Å²	53	66%	0.657	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.6	-176.8	-66.9	-177.1	-179.2	174.2	0	113.3	K873 C877 F922	K873-K875 PolarHBondContact O-N 2.87Å; K875-C877 VanDerWaalsContact C-N 3.33Å; K875-F922 HydrophobicContact CB-CZ 4.37Å
876	N	89.1	Confident	93.3	Very high	17 Å²	17	58.8 Å²	58.8	9%	0.091	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	4.7	177.1	63.7	-34.1	0	0	0	113.8	V846 P874 V917 N918	V846-N876 PolarHBondContact O-ND2 2.77Å; P874-N876 VanDerWaalsContact CB-OD1 3.25Å; P874-N876 WeakPolarHBondContact CB-OD1 3.24Å; P874-N876 PolarHBondContact O-N 2.78Å; P874-N876 VanDerWaalsContact O-N 3.14Å; N876-V917 HydrophobicContact CB-CG1 4.45Å; N876-V917 WeakPolarHBondContact ND2-CG1 3.42Å; N876-V917 CarbonylContact O-C 3.52Å; N876-V917 VanDerWaalsContact O-CA 3.28Å; N876-V917 WeakPolarHBondContact O-CA 3.45Å; N876-N918 WeakPolarHBondContact CB-O 2.99Å; N876-N918 PolarHBondContact O-N 2.02Å
877	C	93.9	Very high	93.9	Very high	9 Å²	9	57.5 Å²	57.5	6%	0.061	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-97.4	140.9	-175	-170.6	0	0	0	0	112.1	V846 K873 P874 K875	V846-C877 HydrophobicContact CG1-CB 3.63Å; K873-C877 WeakPolarHBondContact CE-O 3.4Å; K873-C877 HydrophobicContact CG-CB 4.22Å; K873-C877 PolarHBondContact NZ-O 2.72Å; P874-C877 HydrophobicContact CB-CB 3.99Å; P874-C877 HydrophobicContact CG-CB 4.26Å; P874-C877 WeakPolarHBondContact O-CB 3.41Å; P874-C877 PolarHBondContact O-N 3.45Å; K875-C877 VanDerWaalsContact C-N 3.33Å
878	D	94.9	Very high	94.5	Very high	38 Å²	38	50.3 Å²	50.3	20%	0.203	24%	0.24	C	C	.	.			trans	-75.2	151.9	167.4	-171.8	-98.5	0	0	0	112	E880 V881 Y882 K914 Y916	D878-E880 PolarHBondContact O-N 2.79Å; D878-E880 VanDerWaalsContact OD1-CB 3.25Å; D878-E880 WeakPolarHBondContact OD1-CB 3.28Å; D878-E880 PolarHBondContact OD1-N 2.88Å; D878-V881 PolarHBondContact O-N 2.97Å; D878-Y882 PolarHBondContact O-N 2.79Å; D878-K914 IonicContact OD1-NZ 3.83Å; D878-K914 PolarHBondContact OD1-NZ 3.06Å; D878-K914 WeakPolarHBondContact OD2-CE 3.32Å; D878-K914 IonicContact OD2-NZ 3.83Å; D878-K914 PolarHBondContact OD2-NZ 3.4Å; D878-Y916 HydrophobicContact CB-CD1 4.04Å; D878-Y916 VanDerWaalsContact CB-O 3.27Å; D878-Y916 WeakPolarHBondContact CB-O 2.99Å; D878-Y916 PolarHBondContact N-O 2.02Å
879	D	93.2	Very high	94.9	Very high	111 Å²	111	48.4 Å²	48.4	59%	0.594	22%	0.22	S	C	*	.	H	α-helix	trans	-59.1	-34.2	-180	-71.6	-39.6	0	0	0	112.6	K873 Y882 E883	K873-D879 WeakPolarHBondContact CE-OD1 3.35Å; K873-D879 IonicContact NZ-OD1 3.06Å; K873-D879 PolarHBondContact NZ-OD1 3.13Å; D879-Y882 PolarHBondContact O-N 3.09Å; D879-E883 WeakPolarHBondContact O-CB 3.17Å; D879-E883 PolarHBondContact O-N 3.38Å
880	E	93.8	Very high	94.9	Very high	66 Å²	66	49.9 Å²	49.9	31%	0.308	23%	0.225	S	C	.	.	H	α-helix	trans	-69.7	-37	-175.6	-159.5	169.6	-176.6	0	0	112.3	D878 L884 R908 M909 Y916	D878-E880 PolarHBondContact O-N 2.79Å; D878-E880 VanDerWaalsContact OD1-CB 3.25Å; D878-E880 WeakPolarHBondContact OD1-CB 3.28Å; D878-E880 PolarHBondContact OD1-N 2.88Å; E880-L884 PolarHBondContact O-N 3.11Å; E880-R908 IonicContact OE1-CZ 3.4Å; E880-R908 IonicContact OE1-NH1 2.61Å; E880-R908 PolarHBondContact OE1-NH1 3.44Å; E880-R908 IonicContact OE1-NH2 3.61Å; E880-R908 PolarHBondContact OE1-NH2 3.26Å; E880-M909 HydrophobicContact CG-CE 3.77Å; E880-Y916 HydrophobicContact CB-CE1 4.25Å; E880-Y916 WeakPolarHBondContact OE2-CE1 3.32Å
881	V	94.6	Very high	94.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72.4	-40.2	175.3	175.4	0	0	0	0	110.8	L756 L842 V846 D878 L884 M885 M909 Y916	L756-V881 HydrophobicContact CD2-CG2 4.26Å; L842-V881 HydrophobicContact CD1-CG1 4.45Å; L842-V881 HydrophobicContact CD2-CG1 4.36Å; L842-V881 HydrophobicContact CG-CG1 4.44Å; V846-V881 HydrophobicContact CG2-CG1 3.93Å; D878-V881 PolarHBondContact O-N 2.97Å; V881-L884 WeakPolarHBondContact O-CB 3.43Å; V881-L884 PolarHBondContact O-N 2.86Å; V881-M885 HydrophobicContact CG1-CE 3.99Å; V881-M885 PolarHBondContact O-N 3.47Å; V881-M885 VanDerWaalsContact O-N 3.14Å; V881-M909 HydrophobicContact CG2-SD 3.82Å; V881-Y916 HydrophobicContact CG2-CD1 3.91Å; V881-Y916 HydrophobicContact CG2-CG 4.15Å
882	Y	97.8	Very high	93.9	Very high	32 Å²	32	57.6 Å²	57.6	13%	0.125	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-36.2	177.2	-175.6	-112.3	0	0	0	112.6	M871 K873 D878 D879 L884 M885 R886 W889	M871-Y882 WeakPolarHBondContact O-CE2 3.47Å; M871-Y882 PolarHBondContact O-OH 2.98Å; K873-Y882 VanDerWaalsContact CA-CE2 3.4Å; K873-Y882 HydrophobicContact CB-CD1 3.77Å; K873-Y882 HydrophobicContact CB-CD2 3.74Å; K873-Y882 HydrophobicContact CB-CE1 3.82Å; K873-Y882 HydrophobicContact CB-CE2 3.79Å; K873-Y882 HydrophobicContact CB-CG 3.73Å; K873-Y882 HydrophobicContact CD-CD1 4Å; K873-Y882 HydrophobicContact CD-CG 3.99Å; K873-Y882 HydrophobicContact CG-CD1 3.93Å; K873-Y882 HydrophobicContact CG-CD2 3.88Å; K873-Y882 HydrophobicContact CG-CE1 4.48Å; K873-Y882 HydrophobicContact CG-CE2 4.44Å; K873-Y882 HydrophobicContact CG-CG 3.59Å; D878-Y882 PolarHBondContact O-N 2.79Å; D879-Y882 PolarHBondContact O-N 3.09Å; Y882-L884 VanDerWaalsContact C-N 3.29Å; Y882-L884 PolarHBondContact O-N 2.96Å; Y882-M885 HydrophobicContact CD2-SD 3.87Å; Y882-M885 WeakPolarHBondContact O-CB 3.45Å; Y882-M885 PolarHBondContact O-N 3.46Å; Y882-M885 VanDerWaalsContact O-N 3.13Å; Y882-R886 HydrophobicContact CD1-CG 4.12Å; Y882-R886 HydrophobicContact CE1-CG 3.79Å; Y882-R886 HydrophobicContact CE2-CG 4.5Å; Y882-R886 VanDerWaalsContact O-CG 3.31Å; Y882-R886 WeakPolarHBondContact O-CG 3.33Å; Y882-R886 PolarHBondContact O-N 3.48Å; Y882-W889 HydrophobicContact CE2-CZ3 4.25Å
883	E	96.6	Very high	93.7	Very high	80 Å²	80	52.2 Å²	52.2	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-64.7	-35.7	174.6	-176	53.4	-151.1	0	0	111.5	D879 R886 Q887	D879-E883 WeakPolarHBondContact O-CB 3.17Å; D879-E883 PolarHBondContact O-N 3.38Å; E883-R886 PolarHBondContact O-N 2.98Å; E883-R886 IonicContact OE2-NE 3.11Å; E883-Q887 VanDerWaalsContact O-CG 3.32Å; E883-Q887 WeakPolarHBondContact O-CG 3.35Å; E883-Q887 PolarHBondContact O-N 3.06Å
884	L	96.9	Very high	93	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-43	170	178.3	58.2	0	0	0	111.8	L842 E880 V881 Y882 R886 Q887 C888 I902 L906	L842-L884 HydrophobicContact CD2-CD2 4.05Å; L842-L884 HydrophobicContact CD2-CG 4.18Å; E880-L884 PolarHBondContact O-N 3.11Å; V881-L884 WeakPolarHBondContact O-CB 3.43Å; V881-L884 PolarHBondContact O-N 2.86Å; Y882-L884 VanDerWaalsContact C-N 3.29Å; Y882-L884 PolarHBondContact O-N 2.96Å; L884-R886 VanDerWaalsContact C-N 3.31Å; L884-R886 PolarHBondContact O-N 2.86Å; L884-Q887 PolarHBondContact O-N 3.09Å; L884-C888 PolarHBondContact O-N 3.06Å; L884-C888 VanDerWaalsContact O-N 3.08Å; L884-C888 PolarHBondContact O-SG 3.21Å; L884-C888 VanDerWaalsContact O-SG 3.34Å; L884-I902 HydrophobicContact CD1-CG1 4.34Å; L884-I902 HydrophobicContact CD2-CG2 4.46Å; L884-L906 HydrophobicContact CD2-CD1 4.26Å; L884-L906 HydrophobicContact CD2-CD2 3.66Å; L884-L906 HydrophobicContact CD2-CG 3.71Å
885	M	98.3	Very high	92.6	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.5	-43.9	173.3	-61	172.5	-173.2	0	0	111.4	L842 W843 V846 V881 Y882 Q887 C888 W889	L842-M885 HydrophobicContact CB-CE 4.44Å; L842-M885 HydrophobicContact CB-CG 4.35Å; L842-M885 HydrophobicContact CD2-CE 4.43Å; L842-M885 HydrophobicContact CD2-CG 3.82Å; L842-M885 HydrophobicContact CG-CE 3.82Å; L842-M885 HydrophobicContact CG-CG 4.03Å; W843-M885 HydrophobicContact CB-CE 4.18Å; W843-M885 HydrophobicContact CB-SD 3.94Å; W843-M885 HydrophobicContact CG-SD 4.35Å; V846-M885 HydrophobicContact CB-CE 3.96Å; V846-M885 HydrophobicContact CG1-CE 4.46Å; V846-M885 HydrophobicContact CG2-CE 3.71Å; V881-M885 HydrophobicContact CG1-CE 3.99Å; V881-M885 PolarHBondContact O-N 3.47Å; V881-M885 VanDerWaalsContact O-N 3.14Å; Y882-M885 HydrophobicContact CD2-SD 3.87Å; Y882-M885 WeakPolarHBondContact O-CB 3.45Å; Y882-M885 PolarHBondContact O-N 3.46Å; Y882-M885 VanDerWaalsContact O-N 3.13Å; M885-Q887 PolarHBondContact O-N 3.09Å; M885-C888 WeakPolarHBondContact O-CB 3.44Å; M885-C888 PolarHBondContact O-N 3.09Å; M885-C888 VanDerWaalsContact O-N 3.15Å; M885-W889 HydrophobicContact CB-CE3 4.13Å; M885-W889 HydrophobicContact CB-CH2 3.61Å; M885-W889 HydrophobicContact CB-CZ2 4.03Å; M885-W889 HydrophobicContact CB-CZ3 3.67Å; M885-W889 HydrophobicContact CG-CH2 4.2Å; M885-W889 VanDerWaalsContact O-CD2 3.22Å; M885-W889 PolarHBondContact O-N 3.47Å; M885-W889 HydrophobicContact SD-CH2 4.01Å
886	R	97.9	Very high	93	Very high	124 Å²	124	50 Å²	50	47%	0.468	23%	0.226	S	C	.	.	H	α-helix	trans	-64.9	-36.8	178.7	-66	-119.5	-62.8	-158	0.6	112.9	Y882 E883 L884 C888 W889 R890	Y882-R886 HydrophobicContact CD1-CG 4.12Å; Y882-R886 HydrophobicContact CE1-CG 3.79Å; Y882-R886 HydrophobicContact CE2-CG 4.5Å; Y882-R886 VanDerWaalsContact O-CG 3.31Å; Y882-R886 WeakPolarHBondContact O-CG 3.33Å; Y882-R886 PolarHBondContact O-N 3.48Å; E883-R886 PolarHBondContact O-N 2.98Å; E883-R886 IonicContact OE2-NE 3.11Å; L884-R886 VanDerWaalsContact C-N 3.31Å; L884-R886 PolarHBondContact O-N 2.86Å; R886-C888 VanDerWaalsContact C-N 3.33Å; R886-W889 CarbonylContact O-C 3.47Å; R886-W889 PolarHBondContact O-N 2.83Å; R886-R890 PolarHBondContact O-N 3.44Å
887	Q	96.4	Very high	93.1	Very high	35 Å²	35	49.4 Å²	49.4	16%	0.164	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-40.6	172.1	-71.8	172.4	40	0	0	111.6	E883 L884 M885 W889 R890 P897	E883-Q887 VanDerWaalsContact O-CG 3.32Å; E883-Q887 WeakPolarHBondContact O-CG 3.35Å; E883-Q887 PolarHBondContact O-N 3.06Å; L884-Q887 PolarHBondContact O-N 3.09Å; M885-Q887 PolarHBondContact O-N 3.09Å; Q887-W889 VanDerWaalsContact C-N 3.27Å; Q887-W889 PolarHBondContact O-N 2.03Å; Q887-R890 PolarHBondContact O-N 2.72Å; Q887-P897 HydrophobicContact CB-CG 4.13Å; Q887-P897 WeakPolarHBondContact O-CD 3.43Å
888	C	98.1	Very high	93	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-30.9	174.4	-66.6	0	0	0	0	112.7	V835 L884 M885 R886 R896	V835-C888 HydrophobicContact CG1-CB 4.04Å; V835-C888 WeakPolarHBondContact O-CB 3.38Å; L884-C888 PolarHBondContact O-N 3.06Å; L884-C888 VanDerWaalsContact O-N 3.08Å; L884-C888 PolarHBondContact O-SG 3.21Å; L884-C888 VanDerWaalsContact O-SG 3.34Å; M885-C888 WeakPolarHBondContact O-CB 3.44Å; M885-C888 PolarHBondContact O-N 3.09Å; M885-C888 VanDerWaalsContact O-N 3.15Å; R886-C888 VanDerWaalsContact C-N 3.33Å; C888-R896 WeakPolarHBondContact O-CD 3.37Å
889	W	98.2	Very high	93	Very high	2 Å²	2	50 Å²	50	1%	0.008	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	23.7	-179.5	-51.9	-42.8	0	0	0	115	W836 G839 V840 W843 R870 M871 Y882 M885 R886 Q887	W836-W889 AromaticContact CD2-CD1 3.77Å; W836-W889 AromaticContact CE2-CD1 3.91Å; W836-W889 HydrophobicContact CE3-CB 4.11Å; W836-W889 HydrophobicContact CH2-CB 4.2Å; W836-W889 HydrophobicContact CZ3-CB 3.96Å; W836-W889 WeakPolarHBondContact CZ3-O 3.1Å; W836-W889 PolarHBondContact O-NE1 3.25Å; G839-W889 VanDerWaalsContact C-CZ2 3.44Å; G839-W889 WeakPolarHBondContact O-CZ2 2.97Å; V840-W889 HydrophobicContact CG2-CZ2 4.47Å; W843-W889 HydrophobicContact CB-CH2 4.12Å; W843-W889 HydrophobicContact CB-CZ2 4.16Å; W843-W889 HydrophobicContact CG-CH2 4.35Å; R870-W889 HydrophobicContact CB-CE3 4.28Å; R870-W889 VanDerWaalsContact CZ-O 3.26Å; R870-W889 PolarHBondContact NE-O 2.69Å; R870-W889 PolarHBondContact NH2-O 2.89Å; M871-W889 HydrophobicContact CB-CH2 4.18Å; M871-W889 HydrophobicContact CB-CZ3 4.39Å; M871-W889 HydrophobicContact CE-CH2 3.57Å; M871-W889 HydrophobicContact CE-CZ2 3.3Å; Y882-W889 HydrophobicContact CE2-CZ3 4.25Å; M885-W889 HydrophobicContact CB-CE3 4.13Å; M885-W889 HydrophobicContact CB-CH2 3.61Å; M885-W889 HydrophobicContact CB-CZ2 4.03Å; M885-W889 HydrophobicContact CB-CZ3 3.67Å; M885-W889 HydrophobicContact CG-CH2 4.2Å; M885-W889 VanDerWaalsContact O-CD2 3.22Å; M885-W889 PolarHBondContact O-N 3.47Å; M885-W889 HydrophobicContact SD-CH2 4.01Å; R886-W889 CarbonylContact O-C 3.47Å; R886-W889 PolarHBondContact O-N 2.83Å; Q887-W889 VanDerWaalsContact C-N 3.27Å; Q887-W889 PolarHBondContact O-N 2.03Å
890	R	94.7	Very high	92.9	Very high	105 Å²	105	47.1 Å²	47.1	40%	0.396	22%	0.217	S	C	.	.			trans	-61.6	141.2	172.1	-72.4	-178.5	179.6	171	-5.9	111.1	R886 Q887 R892 E895 R896	R886-R890 PolarHBondContact O-N 3.44Å; Q887-R890 PolarHBondContact O-N 2.72Å; R890-R892 VanDerWaalsContact C-N 3.29Å; R890-R892 PolarHBondContact O-N 3.32Å; R890-E895 HydrophobicContact CB-CB 4.22Å; R890-E895 WeakPolarHBondContact CD-O 3.43Å; R890-E895 PolarHBondContact NH1-O 3.42Å; R890-R896 HydrophobicContact CB-CG 4.11Å; R890-R896 PolarHBondContact O-NE 2.84Å; R890-R896 PolarHBondContact O-NH2 3.24Å
891	D	87	Confident	92.7	Very high	85 Å²	85	48.3 Å²	48.3	46%	0.455	22%	0.222	S	C	.	.	S	Bend	trans	-55.7	-47	-178.1	-70.2	-30.8	0	0	0	111.3	R870 P893 R896	R870-D891 IonicContact CZ-OD1 2.65Å; R870-D891 IonicContact NH1-OD1 2.79Å; R870-D891 IonicContact NH2-OD1 3.92Å; R870-D891 PolarHBondContact NH2-OD1 2.91Å; D891-P893 WeakPolarHBondContact O-CD 2.99Å; D891-R896 PolarHBondContact O-NH2 3.09Å
892	R	82.1	Confident	92.8	Very high	114 Å²	114	48.3 Å²	48.3	43%	0.43	22%	0.222	S	C	.	.	S	Bend	trans	-84	118.8	-178.4	-71.3	162.6	171	-157.9	5.2	110.3	R890 Y894 E895	R890-R892 VanDerWaalsContact C-N 3.29Å; R890-R892 PolarHBondContact O-N 3.32Å; R892-Y894 VanDerWaalsContact C-N 3.27Å; R892-Y894 HydrophobicContact CB-CD1 4.29Å; R892-Y894 HydrophobicContact CB-CE1 3.85Å; R892-Y894 HydrophobicContact CB-CE2 4.09Å; R892-Y894 VanDerWaalsContact CD-OH 3.26Å; R892-Y894 WeakPolarHBondContact CD-OH 3.48Å; R892-Y894 HydrophobicContact CG-CE1 4.14Å; R892-Y894 PolarHBondContact NH1-OH 3.19Å; R892-Y894 VanDerWaalsContact NH1-OH 3.17Å; R892-Y894 PolarHBondContact O-N 2.97Å; R892-E895 HydrophobicContact CB-CB 4.4Å; R892-E895 HydrophobicContact CB-CG 3.83Å; R892-E895 WeakPolarHBondContact CD-OE1 3.23Å; R892-E895 IonicContact NH1-OE1 3.23Å; R892-E895 PolarHBondContact O-N 2.04Å
893	P	87.9	Confident	92.6	Very high	38 Å²	38	47.5 Å²	47.5	25%	0.247	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-57.3	-35.7	-175.6	-27.4	35.1	0	0	0	114.5	E822 K832 D891 E895 R896	E822-P893 HydrophobicContact CG-CG 4.17Å; K832-P893 HydrophobicContact CB-CB 3.86Å; K832-P893 WeakPolarHBondContact CD-O 3.14Å; K832-P893 HydrophobicContact CG-CB 4.48Å; K832-P893 WeakPolarHBondContact CG-O 3.21Å; D891-P893 WeakPolarHBondContact O-CD 2.99Å; P893-E895 VanDerWaalsContact C-N 3.25Å; P893-E895 PolarHBondContact O-N 3.24Å; P893-R896 WeakPolarHBondContact O-CB 3.3Å; P893-R896 PolarHBondContact O-N 2.91Å
894	Y	80.1	Confident	92.2	Very high	116 Å²	116	48.5 Å²	48.5	46%	0.455	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-70.8	-17.6	-179.7	56.5	-99.2	0	0	0	113.9	Y294 R892 R896	Y294-Y894 HydrophobicContact CE2-CE1 4.42Å; Y294-Y894 AromaticContact CZ-CE1 3.95Å; Y294-Y894 VanDerWaalsContact OH-CE1 3.22Å; Y294-Y894 WeakPolarHBondContact OH-CE1 3.4Å; Y294-Y894 PolarHBondContact OH-OH 3.24Å; R892-Y894 VanDerWaalsContact C-N 3.27Å; R892-Y894 HydrophobicContact CB-CD1 4.29Å; R892-Y894 HydrophobicContact CB-CE1 3.85Å; R892-Y894 HydrophobicContact CB-CE2 4.09Å; R892-Y894 VanDerWaalsContact CD-OH 3.26Å; R892-Y894 WeakPolarHBondContact CD-OH 3.48Å; R892-Y894 HydrophobicContact CG-CE1 4.14Å; R892-Y894 PolarHBondContact NH1-OH 3.19Å; R892-Y894 VanDerWaalsContact NH1-OH 3.17Å; R892-Y894 PolarHBondContact O-N 2.97Å; Y894-R896 VanDerWaalsContact C-N 3.34Å
895	E	85.3	Confident	91.9	Very high	73 Å²	73	50.4 Å²	50.4	34%	0.341	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-84.5	-11.7	176.5	-60.4	179.9	175.5	0	0	112.5	R890 R892 P893	R890-E895 HydrophobicContact CB-CB 4.22Å; R890-E895 WeakPolarHBondContact CD-O 3.43Å; R890-E895 PolarHBondContact NH1-O 3.42Å; R892-E895 HydrophobicContact CB-CB 4.4Å; R892-E895 HydrophobicContact CB-CG 3.83Å; R892-E895 WeakPolarHBondContact CD-OE1 3.23Å; R892-E895 IonicContact NH1-OE1 3.23Å; R892-E895 PolarHBondContact O-N 2.04Å; P893-E895 VanDerWaalsContact C-N 3.25Å; P893-E895 PolarHBondContact O-N 3.24Å
896	R	95.8	Very high	91.7	Very high	3 Å²	3	50.4 Å²	50.4	1%	0.011	24%	0.241	C	C	.	.	S	Bend	trans	-75.6	141.5	179	-57	173	-168.2	153.3	9.4	110.2	E822 K832 V835 C888 R890 D891 P893 Y894	E822-R896 IonicContact OE1-CZ 3.5Å; E822-R896 IonicContact OE1-NH1 3.84Å; E822-R896 PolarHBondContact OE1-NH1 3.16Å; E822-R896 IonicContact OE1-NH2 2.84Å; E822-R896 IonicContact OE2-CZ 2.69Å; E822-R896 IonicContact OE2-NH1 2.75Å; E822-R896 PolarHBondContact OE2-NH1 2.93Å; E822-R896 IonicContact OE2-NH2 3.21Å; E822-R896 PolarHBondContact OE2-NH2 2.93Å; K832-R896 HydrophobicContact CD-CB 4.44Å; K832-R896 PolarHBondContact NZ-O 3.01Å; K832-R896 WeakPolarHBondContact O-CD 3.3Å; K832-R896 PolarHBondContact O-NH1 2.97Å; V835-R896 HydrophobicContact CG1-CB 3.9Å; C888-R896 WeakPolarHBondContact O-CD 3.37Å; R890-R896 HydrophobicContact CB-CG 4.11Å; R890-R896 PolarHBondContact O-NE 2.84Å; R890-R896 PolarHBondContact O-NH2 3.24Å; D891-R896 PolarHBondContact O-NH2 3.09Å; P893-R896 WeakPolarHBondContact O-CB 3.3Å; P893-R896 PolarHBondContact O-N 2.91Å; Y894-R896 VanDerWaalsContact C-N 3.34Å
897	P	91.2	Very high	91.5	Very high	6 Å²	6	46 Å²	46	4%	0.039	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-65.9	144.5	-179.6	27.2	-33.4	0	0	0	111.1	V835 Q887 Q901 I902	V835-P897 WeakPolarHBondContact CG1-O 3.04Å; V835-P897 WeakPolarHBondContact CG2-O 3.39Å; Q887-P897 HydrophobicContact CB-CG 4.13Å; Q887-P897 WeakPolarHBondContact O-CD 3.43Å; P897-Q901 HydrophobicContact CB-CB 4.37Å; P897-Q901 HydrophobicContact CB-CG 4.46Å; P897-I902 HydrophobicContact CB-CG1 4.01Å; P897-I902 HydrophobicContact CG-CD1 4.06Å; P897-I902 HydrophobicContact CG-CG1 3.8Å
898	P	91.3	Very high	91.3	Very high	53 Å²	53	50.1 Å²	50.1	34%	0.344	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-70.4	156.6	168.8	30.9	-33.7	0	0	0	111.2	S900 Q901 I902	P898-S900 PolarHBondContact O-N 2.83Å; P898-S900 VanDerWaalsContact O-N 3.15Å; P898-Q901 HydrophobicContact CG-CB 4.03Å; P898-Q901 WeakPolarHBondContact O-CB 3.37Å; P898-Q901 PolarHBondContact O-N 3.24Å; P898-I902 PolarHBondContact O-N 2.87Å; P898-I902 VanDerWaalsContact O-N 3.12Å
899	F	96.4	Very high	91.1	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-30.5	179.6	-79.3	-69.4	0	0	0	114.1	M766 H767 L779 D834 V835 F838 Q901 I902 S903	M766-F899 HydrophobicContact CB-CD1 3.49Å; M766-F899 VanDerWaalsContact CB-CD1 3.49Å; M766-F899 HydrophobicContact CB-CD2 3.82Å; M766-F899 HydrophobicContact CB-CE1 3.41Å; M766-F899 VanDerWaalsContact CB-CE1 3.41Å; M766-F899 HydrophobicContact CB-CE2 3.76Å; M766-F899 HydrophobicContact CB-CG 3.69Å; M766-F899 HydrophobicContact CB-CZ 3.56Å; M766-F899 HydrophobicContact CE-CE2 3.68Å; M766-F899 HydrophobicContact CE-CZ 3.79Å; M766-F899 HydrophobicContact CG-CD1 4.39Å; M766-F899 HydrophobicContact CG-CE1 3.85Å; M766-F899 HydrophobicContact CG-CE2 4.36Å; M766-F899 HydrophobicContact CG-CZ 3.83Å; H767-F899 HydrophobicContact CB-CB 3.86Å; L779-F899 HydrophobicContact CD2-CZ 4.41Å; D834-F899 HydrophobicContact CB-CE2 3.96Å; D834-F899 HydrophobicContact CB-CZ 4.13Å; V835-F899 HydrophobicContact CG2-CD2 3.93Å; V835-F899 HydrophobicContact CG2-CE1 4.43Å; V835-F899 HydrophobicContact CG2-CE2 3.68Å; V835-F899 HydrophobicContact CG2-CG 4.4Å; V835-F899 HydrophobicContact CG2-CZ 3.95Å; F838-F899 HydrophobicContact CB-CE1 3.63Å; F838-F899 HydrophobicContact CB-CZ 3.94Å; F838-F899 HydrophobicContact CD1-CE1 4.44Å; F838-F899 AromaticContact CD2-CE1 3.85Å; F838-F899 HydrophobicContact CD2-CE1 3.85Å; F838-F899 AromaticContact CG-CE1 3.7Å; F838-F899 HydrophobicContact CG-CE1 3.7Å; F838-F899 HydrophobicContact CG-CZ 4.5Å; F899-Q901 VanDerWaalsContact C-N 3.32Å; F899-Q901 PolarHBondContact O-N 2.03Å; F899-I902 HydrophobicContact CD1-CD1 4.12Å; F899-I902 HydrophobicContact CE1-CD1 4.43Å; F899-I902 PolarHBondContact O-N 3.03Å; F899-S903 WeakPolarHBondContact O-CB 3.46Å; F899-S903 PolarHBondContact O-N 3.33Å
900	S	90.2	Very high	90.7	Very high	51 Å²	51	52.5 Å²	52.5	36%	0.357	26%	0.255	S	S	.	.	H	α-helix	trans	-59.4	-41.5	173.2	55.5	0	0	0	0	112.4	P898 V904	P898-S900 PolarHBondContact O-N 2.83Å; P898-S900 VanDerWaalsContact O-N 3.15Å; S900-V904 WeakPolarHBondContact O-CG2 3.06Å; S900-V904 PolarHBondContact O-N 2.85Å
901	Q	90.8	Very high	90.4	Very high	90 Å²	90	54.7 Å²	54.7	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-73.3	-39.8	176.8	-173.4	-179.7	5.7	0	0	111.6	P897 P898 F899 V904 Q905	P897-Q901 HydrophobicContact CB-CB 4.37Å; P897-Q901 HydrophobicContact CB-CG 4.46Å; P898-Q901 HydrophobicContact CG-CB 4.03Å; P898-Q901 WeakPolarHBondContact O-CB 3.37Å; P898-Q901 PolarHBondContact O-N 3.24Å; F899-Q901 VanDerWaalsContact C-N 3.32Å; F899-Q901 PolarHBondContact O-N 2.03Å; Q901-V904 PolarHBondContact O-N 3.35Å; Q901-Q905 WeakPolarHBondContact O-CG 3.24Å; Q901-Q905 PolarHBondContact O-N 2.77Å
902	I	96.4	Very high	90.3	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-48	178.1	-63.7	172.8	0	0	0	110.5	A763 V835 F838 L884 P897 P898 F899 V904 Q905 L906	A763-I902 HydrophobicContact CB-CG2 4.01Å; V835-I902 HydrophobicContact CG1-CD1 3.86Å; V835-I902 HydrophobicContact CG2-CD1 4.17Å; F838-I902 HydrophobicContact CD1-CD1 4.27Å; F838-I902 HydrophobicContact CD1-CG2 3.98Å; F838-I902 HydrophobicContact CE1-CG2 3.34Å; F838-I902 HydrophobicContact CZ-CG2 3.79Å; L884-I902 HydrophobicContact CD1-CG1 4.34Å; L884-I902 HydrophobicContact CD2-CG2 4.46Å; P897-I902 HydrophobicContact CB-CG1 4.01Å; P897-I902 HydrophobicContact CG-CD1 4.06Å; P897-I902 HydrophobicContact CG-CG1 3.8Å; P898-I902 PolarHBondContact O-N 2.87Å; P898-I902 VanDerWaalsContact O-N 3.12Å; F899-I902 HydrophobicContact CD1-CD1 4.12Å; F899-I902 HydrophobicContact CE1-CD1 4.43Å; F899-I902 PolarHBondContact O-N 3.03Å; I902-V904 PolarHBondContact O-N 3.47Å; I902-Q905 PolarHBondContact O-N 2.79Å; I902-L906 HydrophobicContact CG2-CD1 3.78Å; I902-L906 WeakPolarHBondContact O-CG 3.09Å; I902-L906 PolarHBondContact O-N 3.12Å
903	S	92.8	Very high	90	Very high	15 Å²	15	59 Å²	59	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-56.8	-50.3	178	173.5	0	0	0	0	111.2	T764 F899 Q905 L906 S907	T764-S903 PolarHBondContact OG1-OG 3.34Å; F899-S903 WeakPolarHBondContact O-CB 3.46Å; F899-S903 PolarHBondContact O-N 3.33Å; S903-Q905 PolarHBondContact O-N 3.41Å; S903-L906 PolarHBondContact O-N 3.15Å; S903-S907 WeakPolarHBondContact O-CB 3.3Å; S903-S907 PolarHBondContact O-N 3.19Å; S903-S907 PolarHBondContact O-OG 2.94Å; S903-S907 VanDerWaalsContact O-OG 3.1Å
904	V	87.6	Confident	89.9	Confident	102 Å²	102	61.6 Å²	61.6	62%	0.618	29%	0.293	S	S	*	.	H	α-helix	trans	-60.3	-42.4	177.8	171.6	0	0	0	0	112.4	S900 Q901 I902 R908	S900-V904 WeakPolarHBondContact O-CG2 3.06Å; S900-V904 PolarHBondContact O-N 2.85Å; Q901-V904 PolarHBondContact O-N 3.35Å; I902-V904 PolarHBondContact O-N 3.47Å; V904-R908 PolarHBondContact O-N 3.22Å; V904-R908 VanDerWaalsContact O-N 3.11Å
905	Q	92.6	Very high	90.2	Very high	40 Å²	40	59.6 Å²	59.6	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-44.6	178.3	-74.8	-173.9	28.1	0	0	111.8	Q901 I902 S903 R908 M909	Q901-Q905 WeakPolarHBondContact O-CG 3.24Å; Q901-Q905 PolarHBondContact O-N 2.77Å; I902-Q905 PolarHBondContact O-N 2.79Å; S903-Q905 PolarHBondContact O-N 3.41Å; Q905-R908 PolarHBondContact O-N 3.35Å; Q905-M909 HydrophobicContact CB-CE 4.42Å; Q905-M909 WeakPolarHBondContact O-CG 2.95Å; Q905-M909 PolarHBondContact O-N 2.02Å; Q905-M909 VanDerWaalsContact O-N 3.14Å
906	L	93.8	Very high	90.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-40	179.2	-73	168.1	0	0	0	112.3	L756 A759 V760 A763 F838 L884 I902 S903 R908 M909 Q910	L756-L906 HydrophobicContact CD2-CD2 4.23Å; A759-L906 HydrophobicContact CB-CD1 3.93Å; A759-L906 HydrophobicContact CB-CD2 4.23Å; V760-L906 HydrophobicContact CG2-CB 3.59Å; A763-L906 HydrophobicContact CB-CD1 4.11Å; F838-L906 HydrophobicContact CE1-CD1 4.09Å; F838-L906 HydrophobicContact CZ-CD1 3.62Å; L884-L906 HydrophobicContact CD2-CD1 4.26Å; L884-L906 HydrophobicContact CD2-CD2 3.66Å; L884-L906 HydrophobicContact CD2-CG 3.71Å; I902-L906 HydrophobicContact CG2-CD1 3.78Å; I902-L906 WeakPolarHBondContact O-CG 3.09Å; I902-L906 PolarHBondContact O-N 3.12Å; S903-L906 PolarHBondContact O-N 3.15Å; L906-R908 VanDerWaalsContact C-N 3.32Å; L906-R908 PolarHBondContact O-N 3.16Å; L906-M909 HydrophobicContact CD2-SD 4.46Å; L906-M909 WeakPolarHBondContact O-CB 3.05Å; L906-M909 PolarHBondContact O-N 2.83Å; L906-M909 VanDerWaalsContact O-N 3.12Å; L906-Q910 WeakPolarHBondContact O-CB 3.06Å; L906-Q910 PolarHBondContact O-N 3.45Å
907	S	92.6	Very high	90.2	Very high	31 Å²	31	56.5 Å²	56.5	22%	0.217	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-44.1	174.8	-64.7	0	0	0	0	111.2	S903 M909 Q910 E911	S903-S907 WeakPolarHBondContact O-CB 3.3Å; S903-S907 PolarHBondContact O-N 3.19Å; S903-S907 PolarHBondContact O-OG 2.94Å; S903-S907 VanDerWaalsContact O-OG 3.1Å; S907-M909 VanDerWaalsContact C-N 3.3Å; S907-M909 PolarHBondContact O-N 2.72Å; S907-Q910 PolarHBondContact O-N 2.93Å; S907-Q910 VanDerWaalsContact O-N 3.15Å; S907-E911 WeakPolarHBondContact O-CG 3.41Å; S907-E911 PolarHBondContact O-N 2.04Å
908	R	93.7	Very high	90.1	Very high	122 Å²	122	59.9 Å²	59.9	46%	0.46	30%	0.304	S	S	.	.	H	α-helix	trans	-61	-39	174.7	-174.2	-169.9	59.6	86.1	7.7	112.3	E880 V904 Q905 L906 A912	E880-R908 IonicContact OE1-CZ 3.4Å; E880-R908 IonicContact OE1-NH1 2.61Å; E880-R908 PolarHBondContact OE1-NH1 3.44Å; E880-R908 IonicContact OE1-NH2 3.61Å; E880-R908 PolarHBondContact OE1-NH2 3.26Å; V904-R908 PolarHBondContact O-N 3.22Å; V904-R908 VanDerWaalsContact O-N 3.11Å; Q905-R908 PolarHBondContact O-N 3.35Å; L906-R908 VanDerWaalsContact C-N 3.32Å; L906-R908 PolarHBondContact O-N 3.16Å; R908-A912 WeakPolarHBondContact O-CB 3.19Å; R908-A912 PolarHBondContact O-N 3.03Å
909	M	92.1	Very high	90	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-40.2	175.7	-66	177.3	-157.7	0	0	111.3	L756 E880 V881 Q905 L906 S907 A912 Y916	L756-M909 HydrophobicContact CD1-CB 4.04Å; E880-M909 HydrophobicContact CG-CE 3.77Å; V881-M909 HydrophobicContact CG2-SD 3.82Å; Q905-M909 HydrophobicContact CB-CE 4.42Å; Q905-M909 WeakPolarHBondContact O-CG 2.95Å; Q905-M909 PolarHBondContact O-N 2.02Å; Q905-M909 VanDerWaalsContact O-N 3.14Å; L906-M909 HydrophobicContact CD2-SD 4.46Å; L906-M909 WeakPolarHBondContact O-CB 3.05Å; L906-M909 PolarHBondContact O-N 2.83Å; L906-M909 VanDerWaalsContact O-N 3.12Å; S907-M909 VanDerWaalsContact C-N 3.3Å; S907-M909 PolarHBondContact O-N 2.72Å; M909-A912 PolarHBondContact O-N 3.34Å; M909-Y916 HydrophobicContact CB-CD2 4.17Å; M909-Y916 HydrophobicContact CB-CE1 4.17Å; M909-Y916 HydrophobicContact CB-CE2 3.81Å; M909-Y916 HydrophobicContact CG-CD1 4.41Å; M909-Y916 HydrophobicContact CG-CE1 3.86Å; M909-Y916 HydrophobicContact CG-CE2 4.37Å; M909-Y916 WeakPolarHBondContact O-CE2 3.47Å; M909-Y916 HydrophobicContact SD-CD1 4.4Å; M909-Y916 HydrophobicContact SD-CE1 4.3Å
910	Q	90.1	Very high	89.5	Confident	50 Å²	50	60.4 Å²	60.4	23%	0.234	31%	0.31	C	S	.	.	H	α-helix	trans	-67	-37	179.9	-176.8	-90.8	1.1	0	0	112.3	L756 V760 L906 S907 A912	L756-Q910 HydrophobicContact CB-CB 4.2Å; L756-Q910 HydrophobicContact CB-CG 4.44Å; V760-Q910 HydrophobicContact CG2-CB 4.21Å; L906-Q910 WeakPolarHBondContact O-CB 3.06Å; L906-Q910 PolarHBondContact O-N 3.45Å; S907-Q910 PolarHBondContact O-N 2.93Å; S907-Q910 VanDerWaalsContact O-N 3.15Å; Q910-A912 VanDerWaalsContact C-N 3.33Å
911	E	88.5	Confident	89.2	Confident	151 Å²	151	60.4 Å²	60.4	71%	0.706	31%	0.306	S	S	*	.	H	α-helix	trans	-75.7	-19.4	176.2	-70.2	174.3	-175.9	0	0	113.6	S907	S907-E911 WeakPolarHBondContact O-CG 3.41Å; S907-E911 PolarHBondContact O-N 2.04Å
912	A	84.9	Confident	88.6	Confident	29 Å²	29	60.1 Å²	60.1	24%	0.24	30%	0.304	C	S	.	.	S	Bend	trans	-73.5	143.4	-179.8	0	0	0	0	0	111.6	R908 M909 Q910 K914 Y916	R908-A912 WeakPolarHBondContact O-CB 3.19Å; R908-A912 PolarHBondContact O-N 3.03Å; M909-A912 PolarHBondContact O-N 3.34Å; Q910-A912 VanDerWaalsContact C-N 3.33Å; A912-K914 PolarHBondContact O-N 3.4Å; A912-Y916 HydrophobicContact CB-CE2 4.04Å
913	R	76.4	Confident	87.5	Confident	260 Å²	260	68.6 Å²	68.6	98%	0.981	34%	0.343	S	S	*	.	S	Bend	trans	-75.3	17.6	175.9	-64.4	-175.9	178.1	179.2	-0.7	114
914	K	86.5	Confident	86.6	Confident	93 Å²	93	74.7 Å²	74.7	40%	0.404	38%	0.375	S	S	.	.	S	Bend	trans	-98.5	137.4	-179.5	179.4	-176.6	172.6	-164.9	0	109	D878 A912 Y916	D878-K914 IonicContact OD1-NZ 3.83Å; D878-K914 PolarHBondContact OD1-NZ 3.06Å; D878-K914 WeakPolarHBondContact OD2-CE 3.32Å; D878-K914 IonicContact OD2-NZ 3.83Å; D878-K914 PolarHBondContact OD2-NZ 3.4Å; A912-K914 PolarHBondContact O-N 3.4Å; K914-Y916 HydrophobicContact CB-CD2 4.42Å; K914-Y916 HydrophobicContact CB-CE2 3.87Å; K914-Y916 HydrophobicContact CD-CD1 4.41Å; K914-Y916 HydrophobicContact CD-CE1 3.93Å; K914-Y916 HydrophobicContact CD-CE2 4.32Å; K914-Y916 HydrophobicContact CG-CE2 4.25Å; K914-Y916 VanDerWaalsContact O-CD2 3.22Å; K914-Y916 WeakPolarHBondContact O-CD2 3.19Å; K914-Y916 WeakPolarHBondContact O-CE2 3.02Å; K914-Y916 PolarHBondContact O-N 2.72Å
915	A	85.3	Confident	86.3	Confident	74 Å²	74	71.2 Å²	71.2	61%	0.612	35%	0.351	S	S	*	.			trans	-80.8	115.4	169.2	0	0	0	0	0	109.4
916	Y	91.1	Very high	85.9	Confident	8 Å²	8	73.6 Å²	73.6	3%	0.031	37%	0.369	C	S	.	.	S	Bend	trans	-94.8	-17.4	179.9	-69.6	-91.2	0	0	0	113.3	S752 L756 D878 E880 V881 M909 A912 K914	S752-Y916 PolarHBondContact OG-N 3.46Å; S752-Y916 VanDerWaalsContact OG-N 3.07Å; L756-Y916 HydrophobicContact CD1-CD2 3.69Å; L756-Y916 HydrophobicContact CD1-CG 4.1Å; D878-Y916 HydrophobicContact CB-CD1 4.04Å; D878-Y916 VanDerWaalsContact CB-O 3.27Å; D878-Y916 WeakPolarHBondContact CB-O 2.99Å; D878-Y916 PolarHBondContact N-O 2.02Å; E880-Y916 HydrophobicContact CB-CE1 4.25Å; E880-Y916 WeakPolarHBondContact OE2-CE1 3.32Å; V881-Y916 HydrophobicContact CG2-CD1 3.91Å; V881-Y916 HydrophobicContact CG2-CG 4.15Å; M909-Y916 HydrophobicContact CB-CD2 4.17Å; M909-Y916 HydrophobicContact CB-CE1 4.17Å; M909-Y916 HydrophobicContact CB-CE2 3.81Å; M909-Y916 HydrophobicContact CG-CD1 4.41Å; M909-Y916 HydrophobicContact CG-CE1 3.86Å; M909-Y916 HydrophobicContact CG-CE2 4.37Å; M909-Y916 WeakPolarHBondContact O-CE2 3.47Å; M909-Y916 HydrophobicContact SD-CD1 4.4Å; M909-Y916 HydrophobicContact SD-CE1 4.3Å; A912-Y916 HydrophobicContact CB-CE2 4.04Å; K914-Y916 HydrophobicContact CB-CD2 4.42Å; K914-Y916 HydrophobicContact CB-CE2 3.87Å; K914-Y916 HydrophobicContact CD-CD1 4.41Å; K914-Y916 HydrophobicContact CD-CE1 3.93Å; K914-Y916 HydrophobicContact CD-CE2 4.32Å; K914-Y916 HydrophobicContact CG-CE2 4.25Å; K914-Y916 VanDerWaalsContact O-CD2 3.22Å; K914-Y916 WeakPolarHBondContact O-CD2 3.19Å; K914-Y916 WeakPolarHBondContact O-CE2 3.02Å; K914-Y916 PolarHBondContact O-N 2.72Å
917	V	90.8	Very high	85.7	Confident	3 Å²	3	75.2 Å²	75.2	2%	0.018	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-122.8	115.2	171.5	-166.7	0	0	0	0	108.3	S752 L755 V846 N876 M919	S752-V917 WeakPolarHBondContact CB-O 3.2Å; S752-V917 PolarHBondContact OG-N 3.15Å; L755-V917 HydrophobicContact CD1-CB 4.14Å; L755-V917 HydrophobicContact CD1-CG1 3.89Å; L755-V917 HydrophobicContact CD1-CG2 4.3Å; V846-V917 HydrophobicContact CG1-CG1 4.21Å; V846-V917 HydrophobicContact CG1-CG2 4.39Å; V846-V917 HydrophobicContact CG2-CG2 4.16Å; N876-V917 HydrophobicContact CB-CG1 4.45Å; N876-V917 WeakPolarHBondContact ND2-CG1 3.42Å; N876-V917 CarbonylContact O-C 3.52Å; N876-V917 VanDerWaalsContact O-CA 3.28Å; N876-V917 WeakPolarHBondContact O-CA 3.45Å; V917-M919 HydrophobicContact CB-SD 4.21Å; V917-M919 HydrophobicContact CG1-SD 3.54Å; V917-M919 VanDerWaalsContact CG1-SD 3.54Å; V917-M919 PolarHBondContact O-N 3.46Å
918	N	89.1	Confident	85.5	Confident	78 Å²	78	75.1 Å²	75.1	42%	0.417	38%	0.376	S	S	.	.			trans	-81.3	110.6	-178.6	-175.4	6.7	0	0	0	110.8	N876 A920	N876-N918 WeakPolarHBondContact CB-O 2.99Å; N876-N918 PolarHBondContact O-N 2.02Å; N918-A920 VanDerWaalsContact OD1-CB 3.3Å; N918-A920 WeakPolarHBondContact OD1-CB 3.27Å; N918-A920 PolarHBondContact OD1-N 2.99Å
919	M	88.2	Confident	85.2	Confident	21 Å²	21	71.1 Å²	71.1	10%	0.103	37%	0.373	C	S	.	.			trans	-96	0.4	179.2	-52.6	-41.7	-61.2	0	0	113.3	T746 A747 L755 L848 V917	T746-M919 CarbonylContact C-O 3.55Å; T746-M919 WeakPolarHBondContact CA-O 3.42Å; T746-M919 PolarHBondContact OG1-O 3.5Å; A747-M919 PolarHBondContact N-O 3.45Å; L755-M919 HydrophobicContact CD1-SD 4.11Å; L848-M919 HydrophobicContact CD1-CE 3.65Å; L848-M919 HydrophobicContact CD2-CE 4.03Å; L848-M919 HydrophobicContact CG-CE 4.18Å; V917-M919 HydrophobicContact CB-SD 4.21Å; V917-M919 HydrophobicContact CG1-SD 3.54Å; V917-M919 VanDerWaalsContact CG1-SD 3.54Å; V917-M919 PolarHBondContact O-N 3.46Å
920	A	86.3	Confident	85.1	Confident	48 Å²	48	74.2 Å²	74.2	40%	0.397	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-70.9	138.9	179.5	0	0	0	0	0	111.2	G745 N918	G745-A920 WeakPolarHBondContact O-CA 3.35Å; N918-A920 VanDerWaalsContact OD1-CB 3.3Å; N918-A920 WeakPolarHBondContact OD1-CB 3.27Å; N918-A920 PolarHBondContact OD1-N 2.99Å
921	L	83.5	Confident	84.8	Confident	51 Å²	51	73.6 Å²	73.6	27%	0.267	39%	0.387	S	S	.	.			trans	-71	135.8	169.3	-69.2	171.5	0	0	0	110	L734 A741 G745 A747 F925	L734-L921 HydrophobicContact CD1-CD1 4.43Å; L734-L921 HydrophobicContact CD1-CD2 4.37Å; L734-L921 HydrophobicContact CD2-CD2 3.96Å; A741-L921 HydrophobicContact CB-CD1 4.33Å; A741-L921 WeakPolarHBondContact O-CD1 3.39Å; G745-L921 PolarHBondContact O-N 2.84Å; A747-L921 HydrophobicContact CB-CD2 3.89Å; L921-F925 HydrophobicContact CD2-CB 4.44Å; L921-F925 HydrophobicContact CD2-CD1 4.07Å; L921-F925 HydrophobicContact CD2-CG 4.17Å
922	F	78.9	Confident	84.1	Confident	84 Å²	84	69.2 Å²	69.2	37%	0.368	38%	0.377	S	S	.	.			trans	-134.9	164.7	173.7	55.9	-96.2	0	0	0	110.5	K875 N924 F925	K875-F922 HydrophobicContact CB-CZ 4.37Å; F922-N924 PolarHBondContact O-N 2.01Å; F922-F925 HydrophobicContact CD1-CD2 4.03Å; F922-F925 HydrophobicContact CD2-CB 4.42Å; F922-F925 AromaticContact CE1-CD2 3.53Å; F922-F925 HydrophobicContact CE1-CD2 3.53Å; F922-F925 HydrophobicContact CE1-CE2 4.23Å; F922-F925 HydrophobicContact CE2-CB 4.35Å; F922-F925 HydrophobicContact CZ-CB 4.44Å; F922-F925 AromaticContact CZ-CD2 3.79Å; F922-F925 HydrophobicContact CZ-CD2 3.79Å; F922-F925 WeakPolarHBondContact O-CB 3.33Å; F922-F925 PolarHBondContact O-N 3.37Å
923	E	72.2	Confident	83.2	Confident	179 Å²	179	73 Å²	73	84%	0.836	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	124.9	179.3	-72.2	-175.2	165.5	0	0	110.8
924	N	74.5	Confident	82.5	Confident	142 Å²	142	61.4 Å²	61.4	76%	0.759	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	29.8	-174.1	-48.7	-44.3	0	0	0	115.6	F922 T926	F922-N924 PolarHBondContact O-N 2.01Å; N924-T926 PolarHBondContact O-N 2.83Å
925	F	80.6	Confident	81.3	Confident	29 Å²	29	60.5 Å²	60.5	13%	0.127	35%	0.354	C	S	.	.			trans	-59.1	132.3	167.8	-178.5	-85.7	0	0	0	111.4	L734 A747 L921 F922 Y927	L734-F925 HydrophobicContact CD2-CD1 4.02Å; A747-F925 HydrophobicContact CB-CD1 4.37Å; A747-F925 HydrophobicContact CB-CE1 3.64Å; A747-F925 HydrophobicContact CB-CE2 3.83Å; A747-F925 HydrophobicContact CB-CZ 3.34Å; L921-F925 HydrophobicContact CD2-CB 4.44Å; L921-F925 HydrophobicContact CD2-CD1 4.07Å; L921-F925 HydrophobicContact CD2-CG 4.17Å; F922-F925 HydrophobicContact CD1-CD2 4.03Å; F922-F925 HydrophobicContact CD2-CB 4.42Å; F922-F925 AromaticContact CE1-CD2 3.53Å; F922-F925 HydrophobicContact CE1-CD2 3.53Å; F922-F925 HydrophobicContact CE1-CE2 4.23Å; F922-F925 HydrophobicContact CE2-CB 4.35Å; F922-F925 HydrophobicContact CZ-CB 4.44Å; F922-F925 AromaticContact CZ-CD2 3.79Å; F922-F925 HydrophobicContact CZ-CD2 3.79Å; F922-F925 WeakPolarHBondContact O-CB 3.33Å; F922-F925 PolarHBondContact O-N 3.37Å; F925-Y927 AromaticContact CE1-CD1 3.73Å; F925-Y927 HydrophobicContact CE1-CD1 3.73Å; F925-Y927 HydrophobicContact CE1-CD2 4.26Å; F925-Y927 AromaticContact CE1-CE1 3.61Å; F925-Y927 HydrophobicContact CE1-CE1 3.61Å; F925-Y927 HydrophobicContact CE1-CE2 4.16Å; F925-Y927 HydrophobicContact CE1-CG 4.06Å; F925-Y927 AromaticContact CE1-CZ 3.84Å; F925-Y927 AromaticContact CZ-CD1 3.89Å; F925-Y927 HydrophobicContact CZ-CD1 3.89Å; F925-Y927 AromaticContact CZ-CE1 3.82Å; F925-Y927 HydrophobicContact CZ-CE1 3.82Å
926	T	85.2	Confident	79.4	Confident	91 Å²	91	64.8 Å²	64.8	56%	0.558	36%	0.362	S	S	*	.			trans	-141.6	133.2	175.4	56.5	0	0	0	0	109.3	N924	N924-T926 PolarHBondContact O-N 2.83Å
927	Y	89.5	Confident	76.7	Confident	33 Å²	33	70 Å²	70	13%	0.129	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-66.3	160.1	170.8	-62.6	-72.1	0	0	0	111.6	R732 L734 E735 A747 L848 F925 G929	R732-Y927 WeakPolarHBondContact CA-OH 3.49Å; R732-Y927 HydrophobicContact CB-CE1 4.01Å; R732-Y927 HydrophobicContact CB-CE2 4.01Å; R732-Y927 HydrophobicContact CG-CD1 4.06Å; R732-Y927 HydrophobicContact CG-CE1 3.83Å; R732-Y927 HydrophobicContact CG-CE2 4.42Å; R732-Y927 HydrophobicContact CG-CG 4.46Å; L734-Y927 HydrophobicContact CB-CE2 3.9Å; L734-Y927 VanDerWaalsContact CB-OH 3.24Å; L734-Y927 WeakPolarHBondContact CB-OH 3.43Å; L734-Y927 HydrophobicContact CD2-CE2 4.45Å; L734-Y927 PolarHBondContact N-OH 2.85Å; E735-Y927 HydrophobicContact CG-CD2 4.12Å; E735-Y927 HydrophobicContact CG-CE2 3.88Å; E735-Y927 WeakPolarHBondContact OE1-CD2 3.28Å; A747-Y927 HydrophobicContact CB-CE1 4.2Å; A747-Y927 PolarHBondContact O-OH 3.46Å; L848-Y927 HydrophobicContact CD1-CD1 4.07Å; L848-Y927 HydrophobicContact CD1-CE1 3.69Å; F925-Y927 AromaticContact CE1-CD1 3.73Å; F925-Y927 HydrophobicContact CE1-CD1 3.73Å; F925-Y927 HydrophobicContact CE1-CD2 4.26Å; F925-Y927 AromaticContact CE1-CE1 3.61Å; F925-Y927 HydrophobicContact CE1-CE1 3.61Å; F925-Y927 HydrophobicContact CE1-CE2 4.16Å; F925-Y927 HydrophobicContact CE1-CG 4.06Å; F925-Y927 AromaticContact CE1-CZ 3.84Å; F925-Y927 AromaticContact CZ-CD1 3.89Å; F925-Y927 HydrophobicContact CZ-CD1 3.89Å; F925-Y927 AromaticContact CZ-CE1 3.82Å; F925-Y927 HydrophobicContact CZ-CE1 3.82Å; Y927-G929 PolarHBondContact O-N 3.41Å
928	A	88.9	Confident	76	Confident	29 Å²	29	73.4 Å²	73.4	24%	0.24	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-60.9	136.7	163.9	0	0	0	0	0	109.9	R732 W843	R732-A928 PolarHBondContact NH1-O 2.87Å; R732-A928 VanDerWaalsContact NH1-O 3.14Å; R732-A928 PolarHBondContact NH2-O 3.47Å; W843-A928 HydrophobicContact CH2-CB 3.98Å; W843-A928 HydrophobicContact CZ2-CB 4.43Å
929	G	87.6	Confident	75.3	Confident	38 Å²	38	73.1 Å²	73.1	39%	0.392	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-59.1	148.5	-177.3	0	0	0	0	0	113	T851 Y927	T851-G929 PolarHBondContact N-O 3.32Å; Y927-G929 PolarHBondContact O-N 3.41Å
930	I	89.6	Confident	74.6	Confident	68 Å²	68	76 Å²	76	35%	0.349	44%	0.444	S	S	.	.			trans	-112.4	120	171	-64	172	0	0	0	107.4	R729 T851	R729-I930 HydrophobicContact CG-CD1 4.16Å; T851-I930 WeakPolarHBondContact OG1-CA 3.37Å
931	D	84.3	Confident	73.9	Confident	36 Å²	36	77.6 Å²	77.6	19%	0.193	45%	0.447	C	S	.	.			trans	-106.8	90.7	174.9	-177.3	-5.5	0	0	0	109.5	T851 T933 A934 E935	T851-D931 HydrophobicContact CG2-CB 4.25Å; T851-D931 PolarHBondContact OG1-N 2.85Å; D931-T933 PolarHBondContact O-N 3.44Å; D931-T933 PolarHBondContact OD1-N 3.27Å; D931-T933 PolarHBondContact OD1-OG1 3.23Å; D931-A934 HydrophobicContact CB-CB 4.04Å; D931-A934 PolarHBondContact O-N 3.05Å; D931-A934 VanDerWaalsContact O-N 3.12Å; D931-A934 PolarHBondContact OD1-N 3.02Å; D931-E935 PolarHBondContact O-N 3.37Å
932	A	72.2	Confident	73.3	Confident	60 Å²	60	79.3 Å²	79.3	50%	0.496	46%	0.458	S	S	.	.	H	α-helix	trans	-60.1	-27.6	179.6	0	0	0	0	0	112.8	A934 E935 E936	A932-A934 VanDerWaalsContact C-N 3.32Å; A932-E935 PolarHBondContact O-N 3.28Å; A932-E936 PolarHBondContact O-N 3.26Å
933	T	65.7	Low	72.9	Confident	108 Å²	108	79 Å²	79	66%	0.663	46%	0.464	S	S	*	.	H	α-helix	trans	-73.5	-27.8	179.4	68.3	0	0	0	0	112.6	D931	D931-T933 PolarHBondContact O-N 3.44Å; D931-T933 PolarHBondContact OD1-N 3.27Å; D931-T933 PolarHBondContact OD1-OG1 3.23Å
934	A	63	Low	72.9	Confident	17 Å²	17	71.9 Å²	71.9	14%	0.14	44%	0.437	C	S	.	.	H	α-helix	trans	-80.2	-15.7	174.1	0	0	0	0	0	113.6	T851 D931 A932	T851-A934 HydrophobicContact CG2-CB 4.41Å; D931-A934 HydrophobicContact CB-CB 4.04Å; D931-A934 PolarHBondContact O-N 3.05Å; D931-A934 VanDerWaalsContact O-N 3.12Å; D931-A934 PolarHBondContact OD1-N 3.02Å; A932-A934 VanDerWaalsContact C-N 3.32Å
935	E	61.1	Low	72.8	Confident	73 Å²	73	66.5 Å²	66.5	34%	0.341	41%	0.413	S	S	.	.	H	α-helix	trans	-93.6	-23.7	-179.7	-72	172	-167.6	0	0	112.9	R729 T851 D931 A932	R729-E935 IonicContact CZ-OE1 3.82Å; R729-E935 IonicContact CZ-OE2 3.33Å; R729-E935 IonicContact NH1-OE1 3.79Å; R729-E935 IonicContact NH1-OE2 2.84Å; R729-E935 PolarHBondContact NH1-OE2 2.71Å; R729-E935 VanDerWaalsContact NH2-CD 3.3Å; R729-E935 IonicContact NH2-OE1 2.77Å; R729-E935 PolarHBondContact NH2-OE1 3.33Å; R729-E935 IonicContact NH2-OE2 2.76Å; R729-E935 PolarHBondContact NH2-OE2 3.41Å; T851-E935 HydrophobicContact CG2-CG 4.49Å; T851-E935 PolarHBondContact OG1-OE1 3.47Å; D931-E935 PolarHBondContact O-N 3.37Å; A932-E935 PolarHBondContact O-N 3.28Å
936	E	46.1	Very low	72.2	Confident	165 Å²	165	69.6 Å²	69.6	77%	0.771	44%	0.437	S	S	*	.			trans	-81.9	-14.8	171.5	-70.8	-174.9	167.4	0	0	114	A932	A932-E936 PolarHBondContact O-N 3.26Å
937	A	32.9	Very low	71	Confident	117 Å²	117	67.6 Å²	67.6	97%	0.967	43%	0.425	S	S	*	.			trans	-89.9	0	-175.5	0	0	0	0	0	112.4

Retrieved 937 of 937 residues in 1558.1 ms (Link to these results)

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