A0A096MX51_PAPAN Loading...

F-box only protein 41

Substrate-recognition component of the SCF (SKP1-CUL1-F-box protein)-type E3 ubiquitin ligase complex.

AlphaFold DB (A0A2K6E9M0), UniProt , Accession A0A096MX51, Species PAPAN (Papio anubis, Olive baboon), Gene FBXO41, Length 875 aa.

						>A0A096MX51_PAPAN|A0A096MX51|FBXO41
MASLDLPYRCPRCGEHKRFRSLSSLRAHLEYSHTYETLYILSKTNSICDGAAAAAAAAAAASGFPLAPEPAALLAVPGARREVFESTSFQGKEQAAGPSPAAPHLLHHHHHHAPLAHFPGDLVPASLPCEELAEPGLVPAAAARYALREIEIPLGELFARKSVASSACSTPPPGPGPGPCPGPASASPASPSPADVAYEEGLARLKIRALEKLEVDRRLERLSEEVEQKIAGQVGRLQAELERKAAELETARQESARLGREKEELEERASELSRQVDVSVELLASLKQDLVHKEQELSRKQQEVVQIDQFLKETAAREASAKLRLQQFIEELLERADRAERQLQVISSSCGSTPSASLGRGGGGGGAGPNARGPGRMREHHAGPAVPSTYAVSRHGSSPSTGASSRVPAASQSSGCYDSDSLELPRPEEGAPEDSGPGGLGTRAQATNGGSERSQPPRSSGLRRQAIQNWQRRPRRHSTEGEEGDVSDVGSRTTESEAEGPLDAPRPGPAMAGPLSSCRLSARPEGGSGRGRRAERGSPSRSNEVISPEILKMRAALFCIFTYLDTRTLLHAAEVCRDWRFVARHPAVWTRVLLENARVCSKFLAMLAQWCTQAHSLTLQNLKPRQRGKKESKEEYARSTRGCLEAGLESLLKAAGGNLLILRISHCPNILTDRSLWLASCYCRALQAVTYRSATDPVGHEVIWALGAGCREIVSLQVAPLHPCQQPTRFSNRCLQMIGRCWPHLRALGVGGAGCGVQGLASLARNCMRLQVLELDHVSEITQEVAAEVCREGLKGLEMLVLTATPVTPKALLHFNSICRNLKSIVVQIGIADYFKEPSSPEAQKLFEDMVTKLQALRRRPGFSKILHIKVEGGC
					

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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	36.6	Very low	53.9	Low	248 Å²	248	115.4 Å²	115.4	100%	1.222	64%	0.642	S	S	*	*				0	161.6	0	-75	173.9	168.6	0	0	108.6
2	A	36.3	Very low	54.7	Low	103 Å²	103	114.6 Å²	114.6	85%	0.851	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-65.2	154.3	-167	0	0	0	0	0	114.1
3	S	37.3	Very low	55.6	Low	121 Å²	121	108.5 Å²	108.5	85%	0.846	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-71.1	147.4	-177.9	-168.7	0	0	0	0	112.7
4	L	50.3	Low	56.2	Low	159 Å²	159	103.8 Å²	103.8	83%	0.832	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-74.7	136.2	168	-64.3	162	0	0	0	109.8
5	D	43.7	Very low	56.3	Low	117 Å²	117	103.6 Å²	103.6	63%	0.626	57%	0.574	S	S	*	*			trans	-152.6	100.3	163.8	-144.4	-10.5	0	0	0	109.3
6	L	50.5	Low	56.3	Low	142 Å²	142	108 Å²	108	74%	0.743	59%	0.588	S	S	*	*			trans	-116	107.3	178.5	-84.2	169.3	0	0	0	108.9	Y8	L6-Y8 PolarHBondContact O-N 3.2Å
7	P	64.3	Low	56.5	Low	57 Å²	57	108.4 Å²	108.4	37%	0.37	58%	0.583	S	S	.	*			trans	-74.7	120	-172.5	27.8	-33.5	0	0	0	111.7	R18	P7-R18 HydrophobicContact CB-CB 4.09Å; P7-R18 HydrophobicContact CB-CG 4.47Å
8	Y	64.8	Low	57.3	Low	100 Å²	100	110.9 Å²	110.9	39%	0.392	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.1	143.1	169	-60.4	-79.5	0	0	0	110.1	L6 F19 L22	L6-Y8 PolarHBondContact O-N 3.2Å; Y8-F19 PolarHBondContact N-O 3.46Å; Y8-F19 PolarHBondContact O-N 3.29Å; Y8-L22 HydrophobicContact CD1-CD2 3.97Å; Y8-L22 HydrophobicContact CD1-CG 3.94Å; Y8-L22 HydrophobicContact CE1-CD1 4.01Å; Y8-L22 HydrophobicContact CE1-CD2 3.99Å; Y8-L22 HydrophobicContact CE1-CG 3.59Å; Y8-L22 HydrophobicContact CE2-CG 4.22Å; Y8-L22 HydrophobicContact CG-CG 4.41Å
9	R	72.1	Confident	58.2	Low	97 Å²	97	106.6 Å²	106.6	37%	0.366	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.3	146.3	-173.5	-63.9	175	174.9	-88	21.9	110.7	E15	R9-E15 IonicContact CZ-OE1 2.63Å; R9-E15 IonicContact CZ-OE2 3.81Å; R9-E15 IonicContact NH1-OE1 2.66Å; R9-E15 PolarHBondContact NH1-OE1 3.12Å; R9-E15 VanDerWaalsContact NH1-OE1 3.09Å; R9-E15 IonicContact NH1-OE2 2.73Å; R9-E15 PolarHBondContact NH1-OE2 3.32Å; R9-E15 IonicContact NH2-OE1 3.84Å; R9-E15 PolarHBondContact NH2-OE1 3.15Å; R9-E15 IonicContact NH2-OE2 3.61Å; R9-E15 PolarHBondContact NH2-OE2 3.06Å
10	C	73.8	Confident	58.6	Low	2 Å²	2	112.2 Å²	112.2	1%	0.014	57%	0.572	C	S	.	*			trans	-91	118.8	174.6	-177.4	0	0	0	0	110.3	R12 C13 G14 F19 L25 H28	C10-R12 PolarHBondContact O-N 3.38Å; C10-C13 HydrophobicContact CB-CB 4.22Å; C10-C13 PolarHBondContact O-N 3.26Å; C10-C13 VanDerWaalsContact O-N 3.08Å; C10-G14 PolarHBondContact O-N 2.94Å; C10-F19 HydrophobicContact CB-CE2 4.17Å; C10-L25 HydrophobicContact CB-CD1 3.83Å; C10-H28 WeakPolarHBondContact CB-NE2 3.39Å; C10-H28 PolarHBondContact SG-NE2 3.05Å; C10-H28 VanDerWaalsContact SG-NE2 3.37Å
11	P	63.5	Low	59.1	Low	123 Å²	123	108.6 Å²	108.6	80%	0.799	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-19	-179.3	-25.9	35.2	0	0	0	114.7
12	R	63.2	Low	60.5	Low	106 Å²	106	101 Å²	101	40%	0.4	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-12.3	179.6	-67.7	-176.3	179.2	-174.7	3.6	114.6	C10 H33	C10-R12 PolarHBondContact O-N 3.38Å; R12-H33 WeakPolarHBondContact CB-NE2 3.35Å
13	C	66.7	Low	62.2	Low	36 Å²	36	100.5 Å²	100.5	24%	0.243	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-0.9	-178.5	-61.6	0	0	0	0	114.5	C10 H16 H33	C10-C13 HydrophobicContact CB-CB 4.22Å; C10-C13 PolarHBondContact O-N 3.26Å; C10-C13 VanDerWaalsContact O-N 3.08Å; C13-H16 PolarHBondContact O-CD2 3.24Å; C13-H16 PolarHBondContact O-N 3.03Å; C13-H33 PolarHBondContact SG-NE2 3.09Å
14	G	63.8	Low	63.9	Low	42 Å²	42	97.5 Å²	97.5	43%	0.433	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	62.3	-141.8	175.9	0	0	0	0	0	113.9	C10 H16	C10-G14 PolarHBondContact O-N 2.94Å; G14-H16 VanDerWaalsContact C-N 3.26Å; G14-H16 PolarHBondContact O-N 3.02Å
15	E	57.3	Low	65.1	Low	101 Å²	101	90.9 Å²	90.9	47%	0.472	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-67.4	-21.7	179	-86	-69.2	163.6	0	0	114	R9 K17 R18	R9-E15 IonicContact CZ-OE1 2.63Å; R9-E15 IonicContact CZ-OE2 3.81Å; R9-E15 IonicContact NH1-OE1 2.66Å; R9-E15 PolarHBondContact NH1-OE1 3.12Å; R9-E15 VanDerWaalsContact NH1-OE1 3.09Å; R9-E15 IonicContact NH1-OE2 2.73Å; R9-E15 PolarHBondContact NH1-OE2 3.32Å; R9-E15 IonicContact NH2-OE1 3.84Å; R9-E15 PolarHBondContact NH2-OE1 3.15Å; R9-E15 IonicContact NH2-OE2 3.61Å; R9-E15 PolarHBondContact NH2-OE2 3.06Å; E15-K17 VanDerWaalsContact C-N 3.28Å; E15-K17 PolarHBondContact O-N 3.38Å; E15-K17 VanDerWaalsContact O-N 3.14Å; E15-R18 IonicContact OE1-NH2 2.66Å; E15-R18 IonicContact OE2-CZ 2.77Å; E15-R18 IonicContact OE2-NE 2.7Å; E15-R18 PolarHBondContact OE2-NE 3.12Å; E15-R18 IonicContact OE2-NH2 2.75Å; E15-R18 PolarHBondContact OE2-NH2 3.37Å
16	H	56.8	Low	66.3	Low	174 Å²	174	93 Å²	93	81%	0.806	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-71.3	-12.9	-162	-59.5	-74.8	0	0	0	115.6	C13 G14	C13-H16 PolarHBondContact O-CD2 3.24Å; C13-H16 PolarHBondContact O-N 3.03Å; G14-H16 VanDerWaalsContact C-N 3.26Å; G14-H16 PolarHBondContact O-N 3.02Å
17	K	60.6	Low	67.5	Low	115 Å²	115	88.3 Å²	88.3	50%	0.5	44%	0.437	S	S	.	.			trans	-140.7	126.7	172.6	-64.8	-172.2	-179.6	-179.4	0	111.1	E15 F19	E15-K17 VanDerWaalsContact C-N 3.28Å; E15-K17 PolarHBondContact O-N 3.38Å; E15-K17 VanDerWaalsContact O-N 3.14Å; K17-F19 HydrophobicContact CB-CE2 3.74Å; K17-F19 HydrophobicContact CB-CZ 3.73Å; K17-F19 HydrophobicContact CD-CZ 4.34Å
18	R	70.4	Confident	68.1	Low	153 Å²	153	86.4 Å²	86.4	58%	0.577	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.4	178.5	-63.9	-179	-177.6	-172.1	-0	109.5	P7 E15	P7-R18 HydrophobicContact CB-CB 4.09Å; P7-R18 HydrophobicContact CB-CG 4.47Å; E15-R18 IonicContact OE1-NH2 2.66Å; E15-R18 IonicContact OE2-CZ 2.77Å; E15-R18 IonicContact OE2-NE 2.7Å; E15-R18 PolarHBondContact OE2-NE 3.12Å; E15-R18 IonicContact OE2-NH2 2.75Å; E15-R18 PolarHBondContact OE2-NH2 3.37Å
19	F	74.3	Confident	68.5	Low	30 Å²	30	84.7 Å²	84.7	13%	0.132	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.1	-172.2	-60.4	-86.9	0	0	0	110.9	Y8 C10 K17 S21 L25 H28	Y8-F19 PolarHBondContact N-O 3.46Å; Y8-F19 PolarHBondContact O-N 3.29Å; C10-F19 HydrophobicContact CB-CE2 4.17Å; K17-F19 HydrophobicContact CB-CE2 3.74Å; K17-F19 HydrophobicContact CB-CZ 3.73Å; K17-F19 HydrophobicContact CD-CZ 4.34Å; F19-S21 VanDerWaalsContact C-N 3.27Å; F19-S21 PolarHBondContact O-N 2.89Å; F19-L25 HydrophobicContact CB-CB 4.32Å; F19-L25 HydrophobicContact CD2-CD1 4Å; F19-L25 HydrophobicContact CE2-CD1 4.24Å; F19-L25 HydrophobicContact CG-CB 4.37Å; F19-H28 HydrophobicContact CE1-CB 3.71Å; F19-H28 AromaticContact CE1-CD2 3.91Å; F19-H28 AromaticContact CE1-CG 3.86Å; F19-H28 AromaticContact CE2-CD2 3.47Å; F19-H28 VanDerWaalsContact CE2-CD2 3.47Å; F19-H28 WeakPolarHBondContact CE2-CD2 3.36Å; F19-H28 HydrophobicContact CZ-CB 3.83Å; F19-H28 AromaticContact CZ-CD2 3.09Å; F19-H28 WeakPolarHBondContact CZ-CD2 3.45Å; F19-H28 AromaticContact CZ-CG 3.45Å; F19-H28 VanDerWaalsContact CZ-CG 3.45Å; F19-H28 AromaticContact CZ-NE2 3.73Å
20	R	65.8	Low	68.4	Low	218 Å²	218	86.4 Å²	86.4	82%	0.823	43%	0.432	S	S	*	.	S	Bend	trans	-78.1	-3.5	179.9	-71.7	-178.7	172.1	152.9	-1	114.4
21	S	70.2	Confident	67.9	Low	37 Å²	37	95.9 Å²	95.9	26%	0.259	47%	0.469	S	S	.	.	S	Bend	trans	-151.8	155.4	174.6	80.4	0	0	0	0	112.5	F19 S23 S24 L25	F19-S21 VanDerWaalsContact C-N 3.27Å; F19-S21 PolarHBondContact O-N 2.89Å; S21-S23 VanDerWaalsContact C-N 3.26Å; S21-S23 PolarHBondContact O-N 2.61Å; S21-S23 PolarHBondContact OG-N 3.1Å; S21-S24 PolarHBondContact O-N 3.17Å; S21-S24 PolarHBondContact OG-N 2.99Å; S21-S24 PolarHBondContact OG-OG 3.24Å; S21-L25 PolarHBondContact O-N 3.45Å
22	L	66.1	Low	67.9	Low	89 Å²	89	93.1 Å²	93.1	47%	0.466	45%	0.452	S	S	.	.	H	α-helix	trans	-60.5	-34.9	170.5	-88	164.7	0	0	0	112.4	Y8 L25 R26	Y8-L22 HydrophobicContact CD1-CD2 3.97Å; Y8-L22 HydrophobicContact CD1-CG 3.94Å; Y8-L22 HydrophobicContact CE1-CD1 4.01Å; Y8-L22 HydrophobicContact CE1-CD2 3.99Å; Y8-L22 HydrophobicContact CE1-CG 3.59Å; Y8-L22 HydrophobicContact CE2-CG 4.22Å; Y8-L22 HydrophobicContact CG-CG 4.41Å; L22-L25 PolarHBondContact O-N 3.22Å; L22-R26 WeakPolarHBondContact O-CG 3.41Å; L22-R26 PolarHBondContact O-N 3.38Å
23	S	70.4	Confident	68	Low	92 Å²	92	90.1 Å²	90.1	64%	0.643	44%	0.443	S	S	*	.	H	α-helix	trans	-62.3	-44.4	177.4	-46.6	0	0	0	0	111.3	S21 L25 R26 A27	S21-S23 VanDerWaalsContact C-N 3.26Å; S21-S23 PolarHBondContact O-N 2.61Å; S21-S23 PolarHBondContact OG-N 3.1Å; S23-L25 VanDerWaalsContact C-N 3.34Å; S23-L25 PolarHBondContact O-N 2.89Å; S23-R26 PolarHBondContact O-N 3.04Å; S23-A27 PolarHBondContact O-N 3.14Å
24	S	72.9	Confident	67.1	Low	57 Å²	57	92.4 Å²	92.4	40%	0.399	46%	0.456	S	S	.	.	H	α-helix	trans	-65	-36	175.4	-50.7	0	0	0	0	112.4	S21 H28	S21-S24 PolarHBondContact O-N 3.17Å; S21-S24 PolarHBondContact OG-N 2.99Å; S21-S24 PolarHBondContact OG-OG 3.24Å; S24-H28 WeakPolarHBondContact O-CB 3.41Å; S24-H28 PolarHBondContact O-N 2.9Å; S24-H28 VanDerWaalsContact O-N 3.1Å
25	L	75.8	Confident	66.1	Low	20 Å²	20	100 Å²	100	11%	0.105	47%	0.473	C	S	.	.	H	α-helix	trans	-68.7	-41.9	174.8	177.5	59.6	0	0	0	111.9	C10 F19 S21 L22 S23 H28 L29	C10-L25 HydrophobicContact CB-CD1 3.83Å; F19-L25 HydrophobicContact CB-CB 4.32Å; F19-L25 HydrophobicContact CD2-CD1 4Å; F19-L25 HydrophobicContact CE2-CD1 4.24Å; F19-L25 HydrophobicContact CG-CB 4.37Å; S21-L25 PolarHBondContact O-N 3.45Å; L22-L25 PolarHBondContact O-N 3.22Å; S23-L25 VanDerWaalsContact C-N 3.34Å; S23-L25 PolarHBondContact O-N 2.89Å; L25-H28 PolarHBondContact O-N 3.5Å; L25-L29 HydrophobicContact CD1-CD1 4.31Å; L25-L29 HydrophobicContact CD1-CG 4.26Å; L25-L29 HydrophobicContact CG-CD1 4.14Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3.04Å
26	R	70.2	Confident	65.5	Low	163 Å²	163	101.7 Å²	101.7	62%	0.615	48%	0.481	S	S	*	.	H	α-helix	trans	-61.4	-51	176	-75.3	-178.3	179.8	173.6	-0.3	111.8	L22 S23 H28 L29 E30	L22-R26 WeakPolarHBondContact O-CG 3.41Å; L22-R26 PolarHBondContact O-N 3.38Å; S23-R26 PolarHBondContact O-N 3.04Å; R26-H28 VanDerWaalsContact C-N 3.26Å; R26-H28 PolarHBondContact O-N 3.19Å; R26-L29 WeakPolarHBondContact O-CB 3.47Å; R26-L29 PolarHBondContact O-N 3.36Å; R26-E30 WeakPolarHBondContact O-CG 3.18Å; R26-E30 PolarHBondContact O-N 3.42Å
27	A	74.6	Confident	64.9	Low	43 Å²	43	95.7 Å²	95.7	36%	0.355	46%	0.457	S	S	.	.	H	α-helix	trans	-57.6	-38.6	176.5	0	0	0	0	0	112.3	S23 E30 Y31	S23-A27 PolarHBondContact O-N 3.14Å; A27-E30 PolarHBondContact O-N 3.08Å; A27-Y31 WeakPolarHBondContact O-CB 3.26Å; A27-Y31 WeakPolarHBondContact O-CD2 3.16Å; A27-Y31 PolarHBondContact O-N 3.35Å
28	H	78.1	Confident	64.2	Low	17 Å²	17	94.4 Å²	94.4	8%	0.079	46%	0.455	C	S	.	.	H	α-helix	trans	-65.9	-42.5	173.4	165.9	47	0	0	0	113	C10 F19 S24 L25 R26 E30 S32	C10-H28 WeakPolarHBondContact CB-NE2 3.39Å; C10-H28 PolarHBondContact SG-NE2 3.05Å; C10-H28 VanDerWaalsContact SG-NE2 3.37Å; F19-H28 HydrophobicContact CE1-CB 3.71Å; F19-H28 AromaticContact CE1-CD2 3.91Å; F19-H28 AromaticContact CE1-CG 3.86Å; F19-H28 AromaticContact CE2-CD2 3.47Å; F19-H28 VanDerWaalsContact CE2-CD2 3.47Å; F19-H28 WeakPolarHBondContact CE2-CD2 3.36Å; F19-H28 HydrophobicContact CZ-CB 3.83Å; F19-H28 AromaticContact CZ-CD2 3.09Å; F19-H28 WeakPolarHBondContact CZ-CD2 3.45Å; F19-H28 AromaticContact CZ-CG 3.45Å; F19-H28 VanDerWaalsContact CZ-CG 3.45Å; F19-H28 AromaticContact CZ-NE2 3.73Å; S24-H28 WeakPolarHBondContact O-CB 3.41Å; S24-H28 PolarHBondContact O-N 2.9Å; S24-H28 VanDerWaalsContact O-N 3.1Å; L25-H28 PolarHBondContact O-N 3.5Å; R26-H28 VanDerWaalsContact C-N 3.26Å; R26-H28 PolarHBondContact O-N 3.19Å; H28-E30 VanDerWaalsContact C-N 3.35Å; H28-S32 WeakPolarHBondContact ND1-CB 3.19Å; H28-S32 PolarHBondContact ND1-OG 2.83Å; H28-S32 WeakPolarHBondContact O-CA 3.47Å; H28-S32 WeakPolarHBondContact O-CB 3.45Å; H28-S32 PolarHBondContact O-N 3.03Å; H28-S32 PolarHBondContact O-OG 3.03Å
29	L	71.6	Confident	62.9	Low	64 Å²	64	94.5 Å²	94.5	34%	0.335	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-43	175.3	-70.5	166.6	0	0	0	111.2	L25 R26 H33	L25-L29 HydrophobicContact CD1-CD1 4.31Å; L25-L29 HydrophobicContact CD1-CG 4.26Å; L25-L29 HydrophobicContact CG-CD1 4.14Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3.04Å; R26-L29 WeakPolarHBondContact O-CB 3.47Å; R26-L29 PolarHBondContact O-N 3.36Å; L29-H33 CarbonylContact O-C 3.55Å; L29-H33 WeakPolarHBondContact O-CA 3.28Å; L29-H33 VanDerWaalsContact O-CB 3.31Å; L29-H33 WeakPolarHBondContact O-CB 3.46Å; L29-H33 PolarHBondContact O-N 3.39Å; L29-H33 VanDerWaalsContact O-N 3.07Å
30	E	71.1	Confident	61.4	Low	133 Å²	133	98.1 Å²	98.1	62%	0.621	48%	0.476	S	S	*	.	H	α-helix	trans	-68.3	-44.8	-179	-71.7	159	179.2	0	0	112.2	R26 A27 H28 T34	R26-E30 WeakPolarHBondContact O-CG 3.18Å; R26-E30 PolarHBondContact O-N 3.42Å; A27-E30 PolarHBondContact O-N 3.08Å; H28-E30 VanDerWaalsContact C-N 3.35Å; E30-T34 WeakPolarHBondContact O-CG2 3.47Å
31	Y	63.8	Low	60.2	Low	201 Å²	201	92 Å²	92	79%	0.788	46%	0.459	S	S	*	.	H	α-helix	trans	-82.1	-33.1	-179.9	-87.7	-93.1	0	0	0	114.9	A27	A27-Y31 WeakPolarHBondContact O-CB 3.26Å; A27-Y31 WeakPolarHBondContact O-CD2 3.16Å; A27-Y31 PolarHBondContact O-N 3.35Å
32	S	62.1	Low	58.7	Low	64 Å²	64	94.3 Å²	94.3	45%	0.448	48%	0.475	S	S	.	.	H	α-helix	trans	-101.4	-11.8	-173.4	-49.6	0	0	0	0	114.2	H28	H28-S32 WeakPolarHBondContact ND1-CB 3.19Å; H28-S32 PolarHBondContact ND1-OG 2.83Å; H28-S32 WeakPolarHBondContact O-CA 3.47Å; H28-S32 WeakPolarHBondContact O-CB 3.45Å; H28-S32 PolarHBondContact O-N 3.03Å; H28-S32 PolarHBondContact O-OG 3.03Å
33	H	65.3	Low	57.4	Low	43 Å²	43	95.6 Å²	95.6	20%	0.199	48%	0.477	C	S	.	.	S	Bend	trans	-137.8	49.7	-173.9	-69.9	-45	0	0	0	112	R12 C13 L29	R12-H33 WeakPolarHBondContact CB-NE2 3.35Å; C13-H33 PolarHBondContact SG-NE2 3.09Å; L29-H33 CarbonylContact O-C 3.55Å; L29-H33 WeakPolarHBondContact O-CA 3.28Å; L29-H33 VanDerWaalsContact O-CB 3.31Å; L29-H33 WeakPolarHBondContact O-CB 3.46Å; L29-H33 PolarHBondContact O-N 3.39Å; L29-H33 VanDerWaalsContact O-N 3.07Å
34	T	48.3	Very low	55.8	Low	84 Å²	84	94.7 Å²	94.7	52%	0.515	47%	0.467	S	S	.	.			trans	-54.9	161.4	176.3	53.1	0	0	0	0	113.3	E30 E36 T37	E30-T34 WeakPolarHBondContact O-CG2 3.47Å; T34-E36 PolarHBondContact O-N 3.42Å; T34-T37 PolarHBondContact O-N 3.4Å; T34-T37 PolarHBondContact O-OG1 3.47Å
35	Y	43.1	Very low	54	Low	201 Å²	201	98.7 Å²	98.7	79%	0.788	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.8	-163.6	-134.8	-107.1	0	0	0	114.8	T37 L38	Y35-T37 PolarHBondContact O-N 2.89Å; Y35-T37 VanDerWaalsContact O-N 3.1Å; Y35-L38 WeakPolarHBondContact O-CB 3.19Å; Y35-L38 PolarHBondContact O-N 3Å
36	E	44.6	Very low	52	Low	137 Å²	137	102.3 Å²	102.3	64%	0.64	51%	0.511	S	S	*	.	H	α-helix	trans	-42.8	-41.7	174.1	-123.3	61.3	-149.5	0	0	114.4	T34 L38 Y39 I40	T34-E36 PolarHBondContact O-N 3.42Å; E36-L38 PolarHBondContact O-N 3.42Å; E36-Y39 PolarHBondContact O-N 3.26Å; E36-I40 PolarHBondContact O-N 3.42Å
37	T	45	Very low	50.3	Low	49 Å²	49	101.2 Å²	101.2	30%	0.301	52%	0.516	S	S	.	.	H	α-helix	trans	-67.2	-25	-175	-21.6	0	0	0	0	112.8	T34 Y35 L41	T34-T37 PolarHBondContact O-N 3.4Å; T34-T37 PolarHBondContact O-OG1 3.47Å; Y35-T37 PolarHBondContact O-N 2.89Å; Y35-T37 VanDerWaalsContact O-N 3.1Å; T37-L41 HydrophobicContact CG2-CD1 4.46Å; T37-L41 PolarHBondContact O-N 2.75Å
38	L	44.7	Very low	48.1	Very low	88 Å²	88	104.6 Å²	104.6	46%	0.461	54%	0.536	S	S	.	.	H	α-helix	trans	-74.5	-34.8	177.6	-67.7	172	0	0	0	111.8	Y35 E36 S42	Y35-L38 WeakPolarHBondContact O-CB 3.19Å; Y35-L38 PolarHBondContact O-N 3Å; E36-L38 PolarHBondContact O-N 3.42Å; L38-S42 WeakPolarHBondContact O-CB 3.32Å; L38-S42 PolarHBondContact O-N 2.91Å; L38-S42 PolarHBondContact O-OG 2.92Å
39	Y	42.7	Very low	45.7	Very low	155 Å²	155	111.8 Å²	111.8	61%	0.608	58%	0.575	S	S	*	*	H	α-helix	trans	-64.4	-43.1	176.7	-176	-102.8	0	0	0	111.2	E36 S42	E36-Y39 PolarHBondContact O-N 3.26Å; Y39-S42 PolarHBondContact O-OG 3.12Å
40	I	42.9	Very low	43.6	Very low	105 Å²	105	111.9 Å²	111.9	54%	0.538	59%	0.591	S	S	.	*	H	α-helix	trans	-64.2	-48.9	177.9	-58.1	176	0	0	0	111.2	E36 S42 K43 T44	E36-I40 PolarHBondContact O-N 3.42Å; I40-S42 VanDerWaalsContact C-N 3.34Å; I40-S42 PolarHBondContact O-N 3.16Å; I40-K43 WeakPolarHBondContact O-CB 3.41Å; I40-K43 PolarHBondContact O-N 3.07Å; I40-T44 PolarHBondContact O-N 3.39Å
41	L	41.2	Very low	41.7	Very low	89 Å²	89	111.1 Å²	111.1	47%	0.466	61%	0.608	S	S	.	*	H	α-helix	trans	-71	-25.4	-177.3	-72.3	169.4	0	0	0	113.9	T37 K43 T44	T37-L41 HydrophobicContact CG2-CD1 4.46Å; T37-L41 PolarHBondContact O-N 2.75Å; L41-K43 PolarHBondContact O-N 3.14Å; L41-T44 PolarHBondContact O-OG1 3.45Å; L41-T44 VanDerWaalsContact O-OG1 3.05Å
42	S	39.4	Very low	40.2	Very low	87 Å²	87	106.1 Å²	106.1	61%	0.608	61%	0.608	S	S	*	*	H	α-helix	trans	-65.9	-18.5	169.7	73.9	0	0	0	0	113.4	L38 Y39 I40	L38-S42 WeakPolarHBondContact O-CB 3.32Å; L38-S42 PolarHBondContact O-N 2.91Å; L38-S42 PolarHBondContact O-OG 2.92Å; Y39-S42 PolarHBondContact O-OG 3.12Å; I40-S42 VanDerWaalsContact C-N 3.34Å; I40-S42 PolarHBondContact O-N 3.16Å
43	K	36.9	Very low	38.7	Very low	116 Å²	116	107.1 Å²	107.1	50%	0.504	62%	0.62	S	S	.	*	H	α-helix	trans	-96.2	-20.5	-178.2	-140	169	-173.6	174.4	0	113.6	I40 L41	I40-K43 WeakPolarHBondContact O-CB 3.41Å; I40-K43 PolarHBondContact O-N 3.07Å; L41-K43 PolarHBondContact O-N 3.14Å
44	T	37.6	Very low	37	Very low	72 Å²	72	109.4 Å²	109.4	44%	0.442	65%	0.647	S	S	.	*	H	α-helix	trans	-79.4	-28.9	177.1	50.8	0	0	0	0	113.3	I40 L41 S46 I47	I40-T44 PolarHBondContact O-N 3.39Å; L41-T44 PolarHBondContact O-OG1 3.45Å; L41-T44 VanDerWaalsContact O-OG1 3.05Å; T44-S46 PolarHBondContact O-N 3.32Å; T44-I47 PolarHBondContact O-N 3.17Å
45	N	35.2	Very low	36.1	Very low	142 Å²	142	110 Å²	110	76%	0.759	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	24.3	179.4	-68	6.3	0	0	0	113.9
46	S	34.1	Very low	35.6	Very low	95 Å²	95	104.9 Å²	104.9	66%	0.664	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	7.6	177.8	-168.4	0	0	0	0	113.1	T44	T44-S46 PolarHBondContact O-N 3.32Å
47	I	33.6	Very low	34.8	Very low	141 Å²	141	102.2 Å²	102.2	72%	0.723	66%	0.661	S	S	*	*			trans	-126.5	73.9	179.3	-49.1	-179.5	0	0	0	109.1	T44	T44-I47 PolarHBondContact O-N 3.17Å
48	C	28.6	Very low	34	Very low	114 Å²	114	104.3 Å²	104.3	77%	0.77	68%	0.683	S	S	*	*			trans	-124.1	61.8	173.3	-65.6	0	0	0	0	110.1
49	D	27.7	Very low	33.4	Very low	167 Å²	167	105 Å²	105	89%	0.893	70%	0.701	S	S	*	*	S	Bend	trans	-167.5	139.8	151.6	-94.3	-33.2	0	0	0	108.4
50	G	28.1	Very low	32.9	Very low	66 Å²	66	102.1 Å²	102.1	68%	0.68	71%	0.71	S	S	*	*			trans	122.2	39.3	-174.4	0	0	0	0	0	116	A52	G50-A52 VanDerWaalsContact C-N 3.27Å; G50-A52 PolarHBondContact O-N 2.92Å
51	A	31.2	Very low	32.1	Very low	118 Å²	118	101.7 Å²	101.7	98%	0.975	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	69.3	-179.4	0	0	0	0	0	113.5
52	A	31.7	Very low	31.5	Very low	95 Å²	95	103.5 Å²	103.5	79%	0.785	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.2	-35	172.8	0	0	0	0	0	113.7	G50 A54	G50-A52 VanDerWaalsContact C-N 3.27Å; G50-A52 PolarHBondContact O-N 2.92Å; A52-A54 VanDerWaalsContact C-N 3.34Å; A52-A54 PolarHBondContact O-N 3.11Å
53	A	31.3	Very low	30.8	Very low	85 Å²	85	102.9 Å²	102.9	70%	0.702	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-82.4	3.2	-168.7	0	0	0	0	0	116.1	A55	A53-A55 VanDerWaalsContact C-N 3.34Å; A53-A55 PolarHBondContact O-N 3.39Å
54	A	29.4	Very low	30.3	Very low	91 Å²	91	107.5 Å²	107.5	75%	0.752	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-71.8	-20.7	-168.7	0	0	0	0	0	115	A52 A56	A52-A54 VanDerWaalsContact C-N 3.34Å; A52-A54 PolarHBondContact O-N 3.11Å; A54-A56 PolarHBondContact O-N 3.21Å
55	A	29.9	Very low	30.2	Very low	98 Å²	98	108.9 Å²	108.9	81%	0.81	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-73	-25.1	-174.4	0	0	0	0	0	114.5	A53	A53-A55 VanDerWaalsContact C-N 3.34Å; A53-A55 PolarHBondContact O-N 3.39Å
56	A	31.2	Very low	29.7	Very low	92 Å²	92	110.1 Å²	110.1	76%	0.76	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-86.5	-14.5	-171.1	0	0	0	0	0	114.8	A54	A54-A56 PolarHBondContact O-N 3.21Å
57	A	28.2	Very low	29.3	Very low	81 Å²	81	110.2 Å²	110.2	67%	0.669	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-85	-14.4	-170	0	0	0	0	0	114.8	A59	A57-A59 VanDerWaalsContact C-N 3.34Å; A57-A59 PolarHBondContact O-N 3.39Å
58	A	29.2	Very low	29.2	Very low	94 Å²	94	109.3 Å²	109.3	78%	0.777	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-76.5	-13.5	-170.4	0	0	0	0	0	115.1
59	A	31.3	Very low	29.2	Very low	101 Å²	101	112.4 Å²	112.4	84%	0.835	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-93.1	-1.4	-167.3	0	0	0	0	0	115.9	A57	A57-A59 VanDerWaalsContact C-N 3.34Å; A57-A59 PolarHBondContact O-N 3.39Å
60	A	31.3	Very low	29.9	Very low	95 Å²	95	109.1 Å²	109.1	79%	0.785	79%	0.787	S	S	*	*	S	Bend	trans	-123.5	21	-164.1	0	0	0	0	0	115.5
61	A	27.3	Very low	29.8	Very low	97 Å²	97	110.5 Å²	110.5	80%	0.802	79%	0.792	S	S	*	*			trans	-132.9	58.2	-171.9	0	0	0	0	0	114.1
62	S	27.3	Very low	29.6	Very low	126 Å²	126	109.3 Å²	109.3	88%	0.881	78%	0.782	S	S	*	*			trans	-137.1	132.1	158.4	67.1	0	0	0	0	109.8
63	G	25	Very low	29.3	Very low	75 Å²	75	112.3 Å²	112.3	77%	0.773	78%	0.784	S	S	*	*			trans	141.3	104.2	-172.1	0	0	0	0	0	112.4
64	F	26.6	Very low	29	Very low	213 Å²	213	115.8 Å²	115.8	93%	0.934	79%	0.79	S	S	*	*			trans	-90.8	172.3	174.4	-106.5	-115.3	0	0	0	111.3
65	P	35	Very low	28.7	Very low	101 Å²	101	116.2 Å²	116.2	66%	0.656	79%	0.793	S	S	*	*			trans	-123	-161.6	-145.2	42.7	-31.5	0	0	0	115.8
66	L	25.5	Very low	28.4	Very low	167 Å²	167	118.1 Å²	118.1	87%	0.874	79%	0.794	S	S	*	*			trans	93	119.9	163.3	-66.4	155.7	0	0	0	119
67	A	25	Very low	28.8	Very low	97 Å²	97	119.7 Å²	119.7	80%	0.802	80%	0.797	S	S	*	*				-170.9	145.5	125.2	0	0	0	0	0	111.1
68	P	33.5	Very low	28.6	Very low	123 Å²	123	119.4 Å²	119.4	80%	0.799	80%	0.802	S	S	*	*			trans	-110.7	167.7	154.4	36.3	-27.8	0	0	0	113
69	E	27.3	Very low	28.5	Very low	178 Å²	178	119.7 Å²	119.7	83%	0.832	80%	0.804	S	S	*	*			trans	-89.7	173.6	-164.3	-91.7	-67.1	111.1	0	0	114.3
70	P	42.6	Very low	28.2	Very low	98 Å²	98	125.2 Å²	125.2	64%	0.636	80%	0.804	S	S	*	*				-130.9	-176.6	-110	47.1	-34.4	0	0	0	117.5
71	A	26.1	Very low	28	Very low	96 Å²	96	131.4 Å²	131.4	79%	0.793	81%	0.807	S	S	*	*			trans	65.3	119	145.7	0	0	0	0	0	122.2
72	A	26	Very low	27.8	Very low	92 Å²	92	133 Å²	133	76%	0.76	80%	0.798	S	S	*	*				-165.2	122.2	128.3	0	0	0	0	0	114.1
73	L	25.7	Very low	27.7	Very low	158 Å²	158	133.1 Å²	133.1	83%	0.827	79%	0.793	S	S	*	*			trans	59.5	119.6	139.5	-62.9	174.2	0	0	0	123.9
74	L	25.5	Very low	27.6	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	79%	0.791	S	S	*	*			trans	90	135.1	130.1	-68.8	168.3	0	0	0	123.7
75	A	23.9	Very low	27.5	Very low	99 Å²	99	134.9 Å²	134.9	82%	0.818	78%	0.781	S	S	*	*			trans	82.6	134.4	148.4	0	0	0	0	0	121.8
76	V	23.3	Very low	27	Very low	138 Å²	138	134.1 Å²	134.1	84%	0.836	78%	0.778	S	S	*	*			trans	-146.9	160.1	-174.6	156.4	0	0	0	0	104.4
77	P	39.6	Very low	27	Very low	125 Å²	125	132.7 Å²	132.7	81%	0.812	78%	0.777	S	S	*	*			cis	-135.6	178.8	14.2	24.6	1	0	0	0	117.7
78	G	23.4	Very low	27	Very low	76 Å²	76	132.5 Å²	132.5	78%	0.784	77%	0.77	S	S	*	*			trans	142	133.6	145.3	0	0	0	0	0	115.9
79	A	26.9	Very low	26.5	Very low	99 Å²	99	134.9 Å²	134.9	82%	0.818	77%	0.768	S	S	*	*			cis	-158.7	149.2	-9.1	0	0	0	0	0	113.7
80	R	25.7	Very low	26.4	Very low	218 Å²	218	134.1 Å²	134.1	82%	0.823	76%	0.764	S	S	*	*			trans	21.5	122.2	156.7	-67.3	-176.3	170.2	-155.3	-1.6	122.6
81	R	25.9	Very low	25.6	Very low	224 Å²	224	132.4 Å²	132.4	85%	0.845	76%	0.764	S	S	*	*				-176.2	115.7	104.3	-99.7	-176.8	153.1	159.4	-6.4	109.2
82	E	25	Very low	25.6	Very low	131 Å²	131	136 Å²	136	61%	0.612	76%	0.762	S	S	*	*				79.5	116.6	76	-76.4	173.4	-172.6	0	0	114.8
83	V	24.9	Very low	25.7	Very low	129 Å²	129	137.7 Å²	137.7	78%	0.782	75%	0.754	S	S	*	*			trans	143.2	115.8	136.6	169.3	0	0	0	0	114
84	F	22.2	Very low	25.7	Very low	169 Å²	169	137.6 Å²	137.6	74%	0.741	75%	0.75	S	S	*	*			trans	53.6	122.8	154.3	-80.1	-116.3	0	0	0	119.8
85	E	23.5	Very low	25.7	Very low	155 Å²	155	134.1 Å²	134.1	72%	0.724	74%	0.744	S	S	*	*				74.5	145.1	67.4	-72.6	-157	162.8	0	0	115
86	S	26.3	Very low	25.7	Very low	85 Å²	85	134.5 Å²	134.5	59%	0.594	75%	0.747	S	S	*	*			cis	-172.4	163.5	-18.9	-98.9	0	0	0	0	110.8
87	T	24.8	Very low	25.7	Very low	138 Å²	138	131.3 Å²	131.3	85%	0.847	74%	0.742	S	S	*	*			trans	68.3	170.1	164.7	73.4	0	0	0	0	120
88	S	24.3	Very low	25.8	Very low	92 Å²	92	131.8 Å²	131.8	64%	0.643	75%	0.745	S	S	*	*				-170.8	171	-54.4	75.5	0	0	0	0	111.5
89	F	23.3	Very low	26	Very low	173 Å²	173	133.4 Å²	133.4	76%	0.759	74%	0.744	S	S	*	*			trans	66.1	166.9	157.9	-89.5	-124.4	0	0	0	119.5
90	Q	26.3	Very low	26.8	Very low	162 Å²	162	134.2 Å²	134.2	76%	0.757	74%	0.741	S	S	*	*			cis	-169.8	166.5	-48.7	-144.3	179	67.9	0	0	110.6
91	G	25.7	Very low	26.8	Very low	62 Å²	62	128.7 Å²	128.7	64%	0.639	74%	0.742	S	S	*	*			trans	124.6	136.6	170.5	0	0	0	0	0	113.2
92	K	25.4	Very low	26.8	Very low	171 Å²	171	122.4 Å²	122.4	74%	0.743	74%	0.738	S	S	*	*			cis	64.7	138	32.3	-67.4	-179.2	147.3	-104	0	113
93	E	28.5	Very low	27.6	Very low	129 Å²	129	121.2 Å²	121.2	60%	0.603	74%	0.742	S	S	*	*			cis	-174.3	171.9	1.4	-114.9	169.3	151.2	0	0	109.8
94	Q	25.7	Very low	27.6	Very low	156 Å²	156	123 Å²	123	73%	0.729	74%	0.741	S	S	*	*			cis	-162.3	154	-9.2	-149.9	-175.5	88.7	0	0	111.1
95	A	25.4	Very low	27.7	Very low	86 Å²	86	122.6 Å²	122.6	71%	0.711	75%	0.746	S	S	*	*			trans	65.3	160.2	145.6	0	0	0	0	0	125.6
96	A	24	Very low	27.9	Very low	106 Å²	106	121.4 Å²	121.4	88%	0.876	74%	0.744	S	S	*	*			trans	78.9	149.3	157.7	0	0	0	0	0	122.2
97	G	22.7	Very low	27.8	Very low	72 Å²	72	124.3 Å²	124.3	74%	0.742	75%	0.748	S	S	*	*			trans	-120.2	-150.4	170.7	0	0	0	0	0	111.2
98	P	42.8	Very low	27.9	Very low	134 Å²	134	124.9 Å²	124.9	87%	0.87	74%	0.74	S	S	*	*			cis	-136.6	-159.9	13.7	43.3	-23.5	0	0	0	115.5
99	S	27.3	Very low	27.9	Very low	110 Å²	110	126.3 Å²	126.3	77%	0.769	74%	0.737	S	S	*	*			trans	-63.2	174.2	174.2	-120.2	0	0	0	0	114.5
100	P	43.3	Very low	27.9	Very low	117 Å²	117	127.3 Å²	127.3	76%	0.76	74%	0.743	S	S	*	*			cis	-148.1	-172.7	29.3	44.3	-23.5	0	0	0	119.4
101	A	25.2	Very low	27.8	Very low	102 Å²	102	125.5 Å²	125.5	84%	0.843	74%	0.735	S	S	*	*			trans	85.1	151.2	151.2	0	0	0	0	0	121.3
102	A	26.3	Very low	27.7	Very low	92 Å²	92	130.7 Å²	130.7	76%	0.76	74%	0.742	S	S	*	*			trans	-127.3	174.9	173.4	0	0	0	0	0	108.9
103	P	40.8	Very low	27.7	Very low	105 Å²	105	127 Å²	127	68%	0.682	74%	0.743	S	S	*	*				-162.5	-178.5	82.5	45.2	-24.7	0	0	0	118.9
104	H	25.8	Very low	28.1	Very low	168 Å²	168	126.5 Å²	126.5	78%	0.778	75%	0.751	S	S	*	*			trans	60.7	121.7	148.8	-64.3	-48.4	0	0	0	124.4
105	L	24.6	Very low	28.1	Very low	160 Å²	160	127.5 Å²	127.5	84%	0.838	76%	0.761	S	S	*	*				152	160.9	119.4	-80.8	174.9	0	0	0	111.7
106	L	26.9	Very low	28.2	Very low	129 Å²	129	127.1 Å²	127.1	68%	0.675	76%	0.757	S	S	*	*				-156.7	175.5	-75.8	-122.6	178.1	0	0	0	110.4
107	H	24.9	Very low	28.3	Very low	146 Å²	146	131.1 Å²	131.1	68%	0.676	76%	0.758	S	S	*	*			trans	74.1	140.8	172.6	-63.1	92.3	0	0	0	118.3
108	H	25.7	Very low	28.6	Very low	150 Å²	150	136.8 Å²	136.8	69%	0.694	76%	0.762	S	S	*	*			cis	-157.6	158.7	-19.5	-132.8	22.5	0	0	0	115.5
109	H	24.7	Very low	28.1	Very low	123 Å²	123	135.7 Å²	135.7	57%	0.569	76%	0.755	S	S	*	*			trans	-38.2	159.2	177.7	-70	-70.7	0	0	0	123.1	H111	H109-H111 AromaticContact CE1-NE2 3.63Å; H109-H111 AromaticContact ND1-CD2 3.62Å; H109-H111 AromaticContact ND1-NE2 3.47Å; H109-H111 PolarHBondContact ND1-NE2 3.02Å
110	H	23.7	Very low	28.1	Very low	193 Å²	193	133.8 Å²	133.8	89%	0.894	75%	0.752	S	S	*	*				-156.8	176.1	105.7	-108	3	0	0	0	114.4
111	H	24.1	Very low	27.5	Very low	124 Å²	124	133.3 Å²	133.3	57%	0.574	74%	0.743	S	S	*	*			trans	-135.6	150.6	-149.8	-98.1	-104.4	0	0	0	116.6	H109	H109-H111 AromaticContact CE1-NE2 3.63Å; H109-H111 AromaticContact ND1-CD2 3.62Å; H109-H111 AromaticContact ND1-NE2 3.47Å; H109-H111 PolarHBondContact ND1-NE2 3.02Å
112	H	23.9	Very low	27.7	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.796	74%	0.741	S	S	*	*			trans	59.6	166.8	157.4	-61.5	-57.6	0	0	0	118.3
113	A	26.2	Very low	28.1	Very low	92 Å²	92	137.3 Å²	137.3	76%	0.76	74%	0.741	S	S	*	*			cis	-148.3	176.3	6.5	0	0	0	0	0	112.1
114	P	37.1	Very low	27.6	Very low	119 Å²	119	138.3 Å²	138.3	77%	0.773	75%	0.748	S	S	*	*			trans	-108.4	161.6	-170.7	40.1	-34	0	0	0	117.4
115	L	25.3	Very low	27.7	Very low	178 Å²	178	135.2 Å²	135.2	93%	0.932	75%	0.751	S	S	*	*			trans	-152.7	158.1	172	-68.1	174.9	0	0	0	109.6
116	A	26.3	Very low	27.8	Very low	78 Å²	78	132.8 Å²	132.8	65%	0.645	75%	0.748	S	S	*	*			cis	-164.7	155.2	-25.6	0	0	0	0	0	109.3	F118	A116-F118 HydrophobicContact CB-CE2 4.42Å
117	H	26.5	Very low	27.8	Very low	190 Å²	190	135 Å²	135	88%	0.88	76%	0.759	S	S	*	*			trans	-93.5	129.1	175.2	-102.2	-50.8	0	0	0	111.6
118	F	28.6	Very low	28.7	Very low	191 Å²	191	133.4 Å²	133.4	84%	0.838	76%	0.762	S	S	*	*			trans	-145.2	154.9	166.6	-82.2	-72.2	0	0	0	113.3	A116	A116-F118 HydrophobicContact CB-CE2 4.42Å
119	P	32.6	Very low	28.6	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	77%	0.766	S	S	*	*			trans	-88.9	154.3	-171.5	35.9	-35.1	0	0	0	113.4
120	G	27.4	Very low	28.7	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	78%	0.776	S	S	*	*			trans	-104.7	110.2	172.4	0	0	0	0	0	112.6
121	D	30	Very low	28.9	Very low	107 Å²	107	132.2 Å²	132.2	57%	0.572	77%	0.769	S	S	*	*			trans	-123.8	130.5	162	-83.2	-45.2	0	0	0	109	R598	D121-R598 IonicContact OD1-CZ 3.6Å; D121-R598 IonicContact OD1-NE 3.72Å; D121-R598 IonicContact OD1-NH2 3.61Å; D121-R598 PolarHBondContact OD1-NH2 3.45Å; D121-R598 IonicContact OD2-CZ 2.8Å; D121-R598 IonicContact OD2-NH2 2.7Å; D121-R598 PolarHBondContact OD2-NH2 2.91Å
122	L	30.7	Very low	28.9	Very low	150 Å²	150	133.6 Å²	133.6	79%	0.785	78%	0.78	S	S	*	*			trans	-108.6	90.7	-174.7	-70.8	174.5	0	0	0	110.9
123	V	33.7	Very low	29	Very low	128 Å²	128	129.7 Å²	129.7	78%	0.776	78%	0.777	S	S	*	*			trans	-141.7	128.9	169	-174.5	0	0	0	0	108.6
124	P	30.4	Very low	28.8	Very low	127 Å²	127	133.6 Å²	133.6	83%	0.825	78%	0.779	S	S	*	*			trans	-77.5	148.2	176.6	31.8	-34.4	0	0	0	111.9
125	A	27.9	Very low	29	Very low	102 Å²	102	133.4 Å²	133.4	84%	0.843	78%	0.779	S	S	*	*			trans	-121.6	160.8	-177.2	0	0	0	0	0	112.5
126	S	26.3	Very low	28.9	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	77%	0.769	S	S	*	*			trans	-153.8	107.8	177.2	59.8	0	0	0	0	114.6
127	L	28.7	Very low	28.9	Very low	174 Å²	174	133 Å²	133	91%	0.911	78%	0.782	S	S	*	*			trans	76.4	153.4	152.3	-56.5	176.7	0	0	0	120.5
128	P	42.4	Very low	28.9	Very low	113 Å²	113	129.7 Å²	129.7	73%	0.734	78%	0.775	S	S	*	*			trans	-138	176	-149.8	43.1	-24.2	0	0	0	117.8
129	C	23.1	Very low	29.2	Very low	115 Å²	115	126.8 Å²	126.8	78%	0.777	78%	0.775	S	S	*	*			trans	176.2	132.4	143.4	-98.4	0	0	0	0	109
130	E	27.8	Very low	28.9	Very low	165 Å²	165	126 Å²	126	77%	0.771	78%	0.778	S	S	*	*				67.1	131.4	85.1	-59.3	-79.1	83.7	0	0	113.2
131	E	27.4	Very low	28.9	Very low	161 Å²	161	127.6 Å²	127.6	75%	0.752	79%	0.785	S	S	*	*			cis	-162.1	-177.5	1.7	-150.3	-160	163.5	0	0	111.5
132	L	25.1	Very low	28.7	Very low	154 Å²	154	127.1 Å²	127.1	81%	0.806	80%	0.796	S	S	*	*			trans	115.7	91	156.3	-61.9	173	0	0	0	121.4
133	A	24.6	Very low	28.4	Very low	89 Å²	89	124.1 Å²	124.1	74%	0.736	79%	0.793	S	S	*	*			trans	44.7	110.1	133.6	0	0	0	0	0	125
134	E	23	Very low	28.2	Very low	174 Å²	174	128.3 Å²	128.3	81%	0.813	80%	0.795	S	S	*	*				41.8	162.1	102.1	-68.1	-56.7	137.9	0	0	123.1
135	P	40.4	Very low	28	Very low	116 Å²	116	132 Å²	132	75%	0.753	79%	0.793	S	S	*	*			cis	-138.5	171.9	-10.5	33.2	-12.2	0	0	0	118.3
136	G	23.4	Very low	28	Very low	71 Å²	71	131.2 Å²	131.2	73%	0.732	79%	0.787	S	S	*	*			trans	97.7	146.3	149.7	0	0	0	0	0	117.9
137	L	26.1	Very low	27.9	Very low	175 Å²	175	133.5 Å²	133.5	92%	0.916	79%	0.79	S	S	*	*			cis	-151.6	162.3	2	-107.3	162.3	0	0	0	110.7
138	V	26.9	Very low	27.8	Very low	122 Å²	122	134.9 Å²	134.9	74%	0.739	78%	0.783	S	S	*	*			trans	-138.5	161	177.7	-144	0	0	0	0	109.6
139	P	36	Very low	26.9	Very low	129 Å²	129	137.9 Å²	137.9	84%	0.838	79%	0.787	S	S	*	*				-145.9	-173.9	95	36	-16.9	0	0	0	114.8
140	A	25.9	Very low	27.1	Very low	95 Å²	95	138.3 Å²	138.3	79%	0.785	78%	0.78	S	S	*	*			trans	-143.5	-164.8	-170.4	0	0	0	0	0	113.2
141	A	26.4	Very low	26.8	Very low	103 Å²	103	139.6 Å²	139.6	85%	0.851	79%	0.786	S	S	*	*			trans	104	150.1	173.5	0	0	0	0	0	116.5
142	A	25.3	Very low	26.8	Very low	97 Å²	97	139.2 Å²	139.2	80%	0.802	79%	0.788	S	S	*	*			cis	-171.2	177.3	-19.7	0	0	0	0	0	112.5
143	A	26.3	Very low	27.3	Very low	87 Å²	87	136.6 Å²	136.6	72%	0.719	78%	0.78	S	S	*	*			trans	72.7	132.5	167.3	0	0	0	0	0	117.8
144	R	28.4	Very low	27.3	Very low	216 Å²	216	140.9 Å²	140.9	82%	0.815	79%	0.79	S	S	*	*			cis	82.5	137.1	45.1	-69.6	174.7	-178	174.9	2.6	112.9
145	Y	26.4	Very low	27.5	Very low	204 Å²	204	136.3 Å²	136.3	80%	0.8	79%	0.789	S	S	*	*			cis	-163.4	162.9	3.2	-111.5	-51.1	0	0	0	111.5
146	A	27.3	Very low	26.9	Very low	85 Å²	85	139.8 Å²	139.8	70%	0.702	80%	0.795	S	S	*	*			trans	63.9	138.5	161.6	0	0	0	0	0	118.9
147	L	25.3	Very low	27	Very low	158 Å²	158	144.5 Å²	144.5	83%	0.827	80%	0.803	S	S	*	*			cis	77.6	132.3	42.5	-68.8	173.6	0	0	0	113.8
148	R	26.8	Very low	27.2	Very low	204 Å²	204	145.5 Å²	145.5	77%	0.77	80%	0.8	S	S	*	*			cis	-160	-164.1	-2	-151.6	-174	-179.9	-177.2	-0.9	110.1
149	E	23.3	Very low	27.1	Very low	176 Å²	176	143.8 Å²	143.8	82%	0.822	80%	0.799	S	S	*	*			trans	88.6	124.1	177.6	-63.3	165	-168.3	0	0	113.8
150	I	26.3	Very low	26.7	Very low	123 Å²	123	149.1 Å²	149.1	63%	0.631	80%	0.802	S	S	*	*			cis	85.8	102.1	30.1	-55.4	165.8	0	0	0	113.5
151	E	22.7	Very low	26.7	Very low	193 Å²	193	154.7 Å²	154.7	90%	0.902	81%	0.809	S	S	*	*				-159.5	170.5	126.4	-115.5	174.5	-165.5	0	0	110.8
152	I	26.3	Very low	26.7	Very low	153 Å²	153	154.8 Å²	154.8	79%	0.785	80%	0.803	S	S	*	*			trans	-128.8	-149.1	-163.7	-29.7	-179.2	0	0	0	111.4
153	P	36	Very low	27	Very low	99 Å²	99	157.2 Å²	157.2	64%	0.643	81%	0.808	S	S	*	*			trans	-126.6	-176.5	-131.9	46.5	-29.2	0	0	0	117
154	L	25.6	Very low	27.1	Very low	179 Å²	179	157.1 Å²	157.1	94%	0.937	81%	0.807	S	S	*	*			trans	66.6	137.4	157.1	-69	166.6	0	0	0	118.9
155	G	27.1	Very low	27.2	Very low	78 Å²	78	152.4 Å²	152.4	80%	0.804	81%	0.807	S	S	*	*			trans	159.2	109.2	168.9	0	0	0	0	0	112.7
156	E	28.2	Very low	27.3	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.883	81%	0.805	S	S	*	*			trans	-83.8	155.6	176.7	-56.5	-179.7	133.9	0	0	112.2
157	L	25.4	Very low	27.4	Very low	169 Å²	169	148.3 Å²	148.3	89%	0.885	81%	0.809	S	S	*	*			trans	-168.8	154.6	133.8	-104.2	165.4	0	0	0	111.6
158	F	29.1	Very low	27.5	Very low	197 Å²	197	146.5 Å²	146.5	86%	0.864	81%	0.808	S	S	*	*			trans	-75.1	139	-168.8	-65.7	-99.7	0	0	0	114.7
159	A	25.1	Very low	27.7	Very low	86 Å²	86	142.1 Å²	142.1	71%	0.711	81%	0.809	S	S	*	*				-175.9	113.4	119.7	0	0	0	0	0	116.1
160	R	27.3	Very low	28.3	Very low	240 Å²	240	140.4 Å²	140.4	91%	0.906	81%	0.81	S	S	*	*			trans	55.7	128.2	136	-63.4	176.2	167.6	-179.9	-4.6	121.9
161	K	25.6	Very low	28.8	Very low	212 Å²	212	140.4 Å²	140.4	92%	0.922	82%	0.818	S	S	*	*			trans	71.1	146.8	160.9	-74.4	-178.2	173.8	-176.3	0	116
162	S	27.1	Very low	29.9	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	81%	0.812	S	S	*	*			cis	-147.1	146.8	-1.5	45.6	0	0	0	0	112.2
163	V	32.5	Very low	30.5	Very low	148 Å²	148	135.5 Å²	135.5	90%	0.897	81%	0.813	S	S	*	*			trans	-70.4	145.6	163.1	177.5	0	0	0	0	109.5
164	A	26.9	Very low	30.5	Very low	86 Å²	86	134.2 Å²	134.2	71%	0.711	82%	0.818	S	S	*	*			trans	-118.7	136.2	171.3	0	0	0	0	0	111.1
165	S	30.2	Very low	31.3	Very low	116 Å²	116	132.2 Å²	132.2	81%	0.811	82%	0.816	S	S	*	*			trans	-165.7	131.2	148.3	-98.2	0	0	0	0	111.4
166	S	30.2	Very low	31.6	Very low	109 Å²	109	131.7 Å²	131.7	76%	0.762	81%	0.81	S	S	*	*			trans	41.1	107.4	152.6	61.4	0	0	0	0	122.1
167	A	28.8	Very low	32.4	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	81%	0.812	S	S	*	*				85.6	144.4	117.8	0	0	0	0	0	123.1
168	C	27.6	Very low	32.9	Very low	119 Å²	119	124.6 Å²	124.6	80%	0.804	80%	0.804	S	S	*	*			trans	69	114.1	158.8	-79	0	0	0	0	122.5
169	S	31.3	Very low	33.5	Very low	113 Å²	113	121.3 Å²	121.3	79%	0.79	80%	0.802	S	S	*	*			trans	82.1	114.5	133	-56.8	0	0	0	0	120.9
170	T	34.9	Very low	33.6	Very low	139 Å²	139	123 Å²	123	85%	0.853	81%	0.807	S	S	*	*			trans	-76.1	151.6	169.7	49.6	0	0	0	0	113.8
171	P	36.7	Very low	34.5	Very low	123 Å²	123	117.6 Å²	117.6	80%	0.799	80%	0.803	S	S	*	*				-132.2	176.1	121.3	34.5	-22.5	0	0	0	113.4
172	P	46.8	Very low	34.7	Very low	118 Å²	118	111.1 Å²	111.1	77%	0.766	80%	0.797	S	S	*	*			trans	-118.7	177.3	-153.7	43.5	-35.6	0	0	0	116.6
173	P	38.6	Very low	35.5	Very low	125 Å²	125	112.2 Å²	112.2	81%	0.812	80%	0.801	S	S	*	*			trans	-97.4	164.6	155.5	37	-30.1	0	0	0	113.3
174	G	35.2	Very low	35.3	Very low	72 Å²	72	110 Å²	110	74%	0.742	80%	0.799	S	S	*	*			trans	-83.5	-160.8	175	0	0	0	0	0	114.6
175	P	42.3	Very low	35.6	Very low	137 Å²	137	111.4 Å²	111.4	89%	0.89	80%	0.803	S	S	*	*			cis	-131.7	-168.3	21.1	41.9	-24	0	0	0	115.8
176	G	34.8	Very low	35.6	Very low	67 Å²	67	110.7 Å²	110.7	69%	0.691	80%	0.804	S	S	*	*			trans	-82.8	-166.6	173	0	0	0	0	0	114.7
177	P	44.8	Very low	36	Very low	140 Å²	140	110.7 Å²	110.7	91%	0.909	80%	0.804	S	S	*	*			cis	-146	-176.9	41.4	43.1	-24	0	0	0	118.3
178	G	34.7	Very low	37	Very low	70 Å²	70	112.3 Å²	112.3	72%	0.722	81%	0.807	S	S	*	*			trans	112	164.3	167.4	0	0	0	0	0	115.1
179	P	41.4	Very low	37.2	Very low	127 Å²	127	111.7 Å²	111.7	83%	0.825	81%	0.81	S	S	*	*			cis	-130.1	-155.6	-3.9	43.9	-26.4	0	0	0	113.5
180	C	28.7	Very low	37.4	Very low	122 Å²	122	111.7 Å²	111.7	82%	0.824	81%	0.81	S	S	*	*			trans	-143.2	178.2	169.5	-52.6	0	0	0	0	109.3
181	P	45.7	Very low	38.1	Very low	126 Å²	126	111.2 Å²	111.2	82%	0.818	81%	0.81	S	S	*	*			cis	-137.3	155.9	-5.8	39.8	-22.1	0	0	0	117.6
182	G	29	Very low	38.3	Very low	76 Å²	76	109.7 Å²	109.7	78%	0.784	80%	0.802	S	S	*	*			trans	64.8	-177.4	147	0	0	0	0	0	120.7
183	P	44.8	Very low	38.5	Very low	128 Å²	128	109.6 Å²	109.6	83%	0.831	80%	0.801	S	S	*	*			cis	-132.4	-173.7	-3.2	43.8	-28.3	0	0	0	115.7
184	A	28.9	Very low	39.1	Very low	102 Å²	102	107.4 Å²	107.4	84%	0.843	79%	0.794	S	S	*	*			trans	77	120.2	153.5	0	0	0	0	0	121
185	S	32.7	Very low	39.8	Very low	116 Å²	116	109.9 Å²	109.9	81%	0.811	79%	0.79	S	S	*	*			trans	-103.2	154.5	165	54.4	0	0	0	0	111.7
186	A	29.6	Very low	40.4	Very low	100 Å²	100	108.6 Å²	108.6	83%	0.826	78%	0.779	S	S	*	*			trans	-116.7	167.3	162.7	0	0	0	0	0	111
187	S	38.1	Very low	41.4	Very low	110 Å²	110	109.3 Å²	109.3	77%	0.769	78%	0.778	S	S	*	*			trans	-158.6	172.8	-178	-57.9	0	0	0	0	109.2
188	P	51.3	Low	41.9	Very low	128 Å²	128	111.8 Å²	111.8	83%	0.831	77%	0.771	S	S	*	*			cis	-127.8	175.9	-12.7	38.4	-23.1	0	0	0	113.7
189	A	30.2	Very low	43	Very low	106 Å²	106	113.1 Å²	113.1	88%	0.876	76%	0.759	S	S	*	*			trans	-157.4	156.5	157.5	0	0	0	0	0	111.4
190	S	35.4	Very low	43.7	Very low	113 Å²	113	112.1 Å²	112.1	79%	0.79	74%	0.743	S	S	*	*			trans	-112.6	155.1	-175	53.8	0	0	0	0	113.7
191	P	50.1	Low	45.1	Very low	130 Å²	130	108.4 Å²	108.4	84%	0.844	73%	0.725	S	S	*	*			trans	-88.3	173.7	-173.2	36.4	-37.7	0	0	0	114.8
192	S	40.5	Very low	45.8	Very low	90 Å²	90	105.8 Å²	105.8	63%	0.629	70%	0.704	S	S	*	*			trans	-133.3	160.8	168.1	87.3	0	0	0	0	111.1	A194	S192-A194 PolarHBondContact O-N 3.43Å
193	P	51.9	Low	47.2	Very low	117 Å²	117	103.9 Å²	103.9	76%	0.76	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	16.4	-157.2	36.9	-37.7	0	0	0	116.7
194	A	51.3	Low	48.1	Very low	79 Å²	79	105.7 Å²	105.7	65%	0.653	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-30.7	-172.2	0	0	0	0	0	114.9	S192 V196	S192-A194 PolarHBondContact O-N 3.43Å; A194-V196 VanDerWaalsContact C-N 3.3Å; A194-V196 PolarHBondContact O-N 2.7Å
195	D	49	Very low	49.8	Very low	124 Å²	124	106.9 Å²	106.9	66%	0.663	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-16.6	-168.1	-56.8	-60	0	0	0	114.6	A197 Y198 E199	D195-A197 VanDerWaalsContact C-N 3.32Å; D195-A197 PolarHBondContact O-N 3.41Å; D195-Y198 PolarHBondContact O-N 3.31Å; D195-E199 PolarHBondContact O-N 3.12Å
196	V	54.9	Low	51.2	Low	109 Å²	109	105.7 Å²	105.7	66%	0.661	64%	0.642	S	S	*	*	H	α-helix	trans	-61.1	-37.4	-170.7	-173.5	0	0	0	0	112.6	A194 E200	A194-V196 VanDerWaalsContact C-N 3.3Å; A194-V196 PolarHBondContact O-N 2.7Å; V196-E200 PolarHBondContact O-N 3.26Å
197	A	56.5	Low	53.1	Low	82 Å²	82	105.4 Å²	105.4	68%	0.678	63%	0.626	S	S	*	*	H	α-helix	trans	-73.1	-27.8	-178.2	0	0	0	0	0	113.3	D195	D195-A197 VanDerWaalsContact C-N 3.32Å; D195-A197 PolarHBondContact O-N 3.41Å
198	Y	56.2	Low	54.5	Low	193 Å²	193	109.3 Å²	109.3	76%	0.757	62%	0.624	S	S	*	*	H	α-helix	trans	-76.9	-38.8	177.7	-159.2	-97	0	0	0	110.9	D195 E200 L202	D195-Y198 PolarHBondContact O-N 3.31Å; Y198-E200 PolarHBondContact O-N 2.91Å; Y198-L202 WeakPolarHBondContact O-CB 3.38Å; Y198-L202 PolarHBondContact O-N 2.66Å; Y198-L202 VanDerWaalsContact O-N 3.11Å
199	E	56.8	Low	55.3	Low	98 Å²	98	105.6 Å²	105.6	46%	0.458	60%	0.604	S	S	.	*	H	α-helix	trans	-64.1	-35.3	173.6	-94.1	-66.6	174.2	0	0	113.2	D195 L202 A203 K206	D195-E199 PolarHBondContact O-N 3.12Å; E199-L202 CarbonylContact O-C 3.58Å; E199-L202 PolarHBondContact O-N 2.75Å; E199-A203 VanDerWaalsContact O-CB 3.25Å; E199-A203 WeakPolarHBondContact O-CB 3.19Å; E199-A203 PolarHBondContact O-N 2.74Å; E199-K206 VanDerWaalsContact CD-NZ 3.33Å; E199-K206 IonicContact OE1-NZ 3.01Å; E199-K206 PolarHBondContact OE1-NZ 2.79Å; E199-K206 VanDerWaalsContact OE1-NZ 3.15Å; E199-K206 IonicContact OE2-NZ 3.8Å; E199-K206 PolarHBondContact OE2-NZ 2.82Å
200	E	56.3	Low	57.1	Low	105 Å²	105	106 Å²	106	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-67.6	-40.8	179.4	-154.6	-154.1	128.6	0	0	112.8	V196 Y198 L202 A203 R204	V196-E200 PolarHBondContact O-N 3.26Å; Y198-E200 PolarHBondContact O-N 2.91Å; E200-L202 VanDerWaalsContact C-N 3.32Å; E200-L202 PolarHBondContact O-N 2.86Å; E200-A203 PolarHBondContact O-N 3.18Å; E200-R204 WeakPolarHBondContact O-CG 3.17Å; E200-R204 PolarHBondContact O-N 3.26Å; E200-R204 IonicContact OE1-CZ 3.86Å; E200-R204 IonicContact OE1-NE 2.67Å; E200-R204 PolarHBondContact OE1-NE 2.84Å; E200-R204 IonicContact OE1-NH2 3.24Å; E200-R204 PolarHBondContact OE1-NH2 2.79Å
201	G	58.9	Low	58.9	Low	44 Å²	44	106.3 Å²	106.3	45%	0.454	58%	0.58	S	S	.	*	H	α-helix	trans	-61.9	-42.5	172.9	0	0	0	0	0	111.6	R204 L205	G201-R204 PolarHBondContact O-N 3.06Å; G201-L205 PolarHBondContact O-N 3.24Å
202	L	59	Low	60.1	Low	72 Å²	72	106.2 Å²	106.2	38%	0.377	57%	0.566	S	S	.	*	H	α-helix	trans	-65.5	-37.1	175.6	-157.3	69.7	0	0	0	111.7	Y198 E199 E200 L205 K206	Y198-L202 WeakPolarHBondContact O-CB 3.38Å; Y198-L202 PolarHBondContact O-N 2.66Å; Y198-L202 VanDerWaalsContact O-N 3.11Å; E199-L202 CarbonylContact O-C 3.58Å; E199-L202 PolarHBondContact O-N 2.75Å; E200-L202 VanDerWaalsContact C-N 3.32Å; E200-L202 PolarHBondContact O-N 2.86Å; L202-L205 PolarHBondContact O-N 3.07Å; L202-K206 HydrophobicContact CG-CD 4.39Å; L202-K206 WeakPolarHBondContact O-CB 3.49Å; L202-K206 WeakPolarHBondContact O-CD 3.11Å; L202-K206 WeakPolarHBondContact O-CG 3.23Å; L202-K206 PolarHBondContact O-N 2.67Å
203	A	59.5	Low	61.7	Low	35 Å²	35	106.7 Å²	106.7	29%	0.289	56%	0.561	S	S	.	*	H	α-helix	trans	-64.4	-43.4	176.9	0	0	0	0	0	112.5	E199 E200 L205 K206 I207	E199-A203 VanDerWaalsContact O-CB 3.25Å; E199-A203 WeakPolarHBondContact O-CB 3.19Å; E199-A203 PolarHBondContact O-N 2.74Å; E200-A203 PolarHBondContact O-N 3.18Å; A203-L205 VanDerWaalsContact C-N 3.27Å; A203-L205 PolarHBondContact O-N 3.23Å; A203-K206 WeakPolarHBondContact O-CB 3.1Å; A203-K206 PolarHBondContact O-N 2.78Å; A203-I207 VanDerWaalsContact O-CG1 3.28Å; A203-I207 WeakPolarHBondContact O-CG1 3.13Å; A203-I207 PolarHBondContact O-N 2.8Å
204	R	63.3	Low	62.8	Low	167 Å²	167	105.7 Å²	105.7	63%	0.63	55%	0.546	S	S	*	.	H	α-helix	trans	-64.8	-33	176.1	-67.7	173.1	-176.8	-101.2	4.5	112.2	E200 G201 R208	E200-R204 WeakPolarHBondContact O-CG 3.17Å; E200-R204 PolarHBondContact O-N 3.26Å; E200-R204 IonicContact OE1-CZ 3.86Å; E200-R204 IonicContact OE1-NE 2.67Å; E200-R204 PolarHBondContact OE1-NE 2.84Å; E200-R204 IonicContact OE1-NH2 3.24Å; E200-R204 PolarHBondContact OE1-NH2 2.79Å; G201-R204 PolarHBondContact O-N 3.06Å; R204-R208 PolarHBondContact O-N 3.5Å
205	L	63.5	Low	64.2	Low	126 Å²	126	106.1 Å²	106.1	66%	0.66	54%	0.541	S	S	*	.	H	α-helix	trans	-73.9	-42.5	173.2	-118.9	157.2	0	0	0	112.1	G201 L202 A203 I207 R208 A209	G201-L205 PolarHBondContact O-N 3.24Å; L202-L205 PolarHBondContact O-N 3.07Å; A203-L205 VanDerWaalsContact C-N 3.27Å; A203-L205 PolarHBondContact O-N 3.23Å; L205-I207 VanDerWaalsContact C-N 3.33Å; L205-I207 PolarHBondContact O-N 3.44Å; L205-R208 PolarHBondContact O-N 2.89Å; L205-A209 WeakPolarHBondContact O-CB 3.32Å; L205-A209 PolarHBondContact O-N 3.45Å
206	K	62.7	Low	65.7	Low	91 Å²	91	102.7 Å²	102.7	40%	0.396	52%	0.522	S	S	.	.	H	α-helix	trans	-55.2	-44.9	170.9	-73.1	160.4	179	169.9	0	110.7	E199 L202 A203 A209 L210	E199-K206 VanDerWaalsContact CD-NZ 3.33Å; E199-K206 IonicContact OE1-NZ 3.01Å; E199-K206 PolarHBondContact OE1-NZ 2.79Å; E199-K206 VanDerWaalsContact OE1-NZ 3.15Å; E199-K206 IonicContact OE2-NZ 3.8Å; E199-K206 PolarHBondContact OE2-NZ 2.82Å; L202-K206 HydrophobicContact CG-CD 4.39Å; L202-K206 WeakPolarHBondContact O-CB 3.49Å; L202-K206 WeakPolarHBondContact O-CD 3.11Å; L202-K206 WeakPolarHBondContact O-CG 3.23Å; L202-K206 PolarHBondContact O-N 2.67Å; A203-K206 WeakPolarHBondContact O-CB 3.1Å; A203-K206 PolarHBondContact O-N 2.78Å; K206-A209 PolarHBondContact O-N 2.96Å; K206-L210 WeakPolarHBondContact O-CB 3.21Å; K206-L210 VanDerWaalsContact O-CG 3.25Å; K206-L210 WeakPolarHBondContact O-CG 3.42Å; K206-L210 PolarHBondContact O-N 2.79Å
207	I	68.9	Low	66.8	Low	94 Å²	94	105.5 Å²	105.5	48%	0.482	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-53	178.9	-70.4	162.3	0	0	0	111.5	A203 L205 A209 L210 E211	A203-I207 VanDerWaalsContact O-CG1 3.28Å; A203-I207 WeakPolarHBondContact O-CG1 3.13Å; A203-I207 PolarHBondContact O-N 2.8Å; L205-I207 VanDerWaalsContact C-N 3.33Å; L205-I207 PolarHBondContact O-N 3.44Å; I207-A209 VanDerWaalsContact C-N 3.26Å; I207-A209 PolarHBondContact O-N 2.8Å; I207-L210 WeakPolarHBondContact O-CB 3.38Å; I207-L210 PolarHBondContact O-N 3.31Å; I207-E211 HydrophobicContact CG2-CG 4.46Å; I207-E211 WeakPolarHBondContact O-CG 3.21Å; I207-E211 PolarHBondContact O-N 3.12Å
208	R	68.8	Low	68.1	Low	193 Å²	193	108.4 Å²	108.4	73%	0.728	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-33.4	177.7	-75.8	-176.6	174	175.9	-1.2	113	R204 L205 K212	R204-R208 PolarHBondContact O-N 3.5Å; L205-R208 PolarHBondContact O-N 2.89Å; R208-K212 WeakPolarHBondContact O-CB 3.32Å; R208-K212 PolarHBondContact O-N 3.45Å
209	A	67.1	Low	69.5	Low	49 Å²	49	104.9 Å²	104.9	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-66.8	-39.6	173	0	0	0	0	0	111.8	L205 K206 I207 K212 L213	L205-A209 WeakPolarHBondContact O-CB 3.32Å; L205-A209 PolarHBondContact O-N 3.45Å; K206-A209 PolarHBondContact O-N 2.96Å; I207-A209 VanDerWaalsContact C-N 3.26Å; I207-A209 PolarHBondContact O-N 2.8Å; A209-K212 PolarHBondContact O-N 3.47Å; A209-L213 VanDerWaalsContact O-CB 3.27Å; A209-L213 WeakPolarHBondContact O-CB 3.4Å; A209-L213 WeakPolarHBondContact O-CD1 3.18Å; A209-L213 WeakPolarHBondContact O-CG 3.14Å; A209-L213 PolarHBondContact O-N 2.97Å
210	L	68.8	Low	70.9	Confident	116 Å²	116	105.2 Å²	105.2	61%	0.607	51%	0.51	S	S	*	.	H	α-helix	trans	-68.3	-42.9	175.8	-72.8	166.2	0	0	0	112.4	K206 I207 K212 L213 E214	K206-L210 WeakPolarHBondContact O-CB 3.21Å; K206-L210 VanDerWaalsContact O-CG 3.25Å; K206-L210 WeakPolarHBondContact O-CG 3.42Å; K206-L210 PolarHBondContact O-N 2.79Å; I207-L210 WeakPolarHBondContact O-CB 3.38Å; I207-L210 PolarHBondContact O-N 3.31Å; L210-K212 VanDerWaalsContact C-N 3.34Å; L210-K212 PolarHBondContact O-N 3.07Å; L210-L213 PolarHBondContact O-N 2.94Å; L210-E214 PolarHBondContact O-N 3.46Å
211	E	72.4	Confident	72.3	Confident	118 Å²	118	106.7 Å²	106.7	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-58.8	-45.9	173.3	-69.9	174.6	143.3	0	0	110.9	I207 E214 V215	I207-E211 HydrophobicContact CG2-CG 4.46Å; I207-E211 WeakPolarHBondContact O-CG 3.21Å; I207-E211 PolarHBondContact O-N 3.12Å; E211-E214 PolarHBondContact O-N 3.09Å; E211-V215 WeakPolarHBondContact O-CG2 3.32Å; E211-V215 PolarHBondContact O-N 2.9Å
212	K	75.3	Confident	73.6	Confident	128 Å²	128	109.7 Å²	109.7	56%	0.557	52%	0.516	S	S	*	.	H	α-helix	trans	-63.8	-46.5	175.6	-162.7	-154.4	171.3	-119.9	0	111.5	R208 A209 L210 E214 V215 D216	R208-K212 WeakPolarHBondContact O-CB 3.32Å; R208-K212 PolarHBondContact O-N 3.45Å; A209-K212 PolarHBondContact O-N 3.47Å; L210-K212 VanDerWaalsContact C-N 3.34Å; L210-K212 PolarHBondContact O-N 3.07Å; K212-E214 PolarHBondContact O-N 3.43Å; K212-V215 PolarHBondContact O-N 3.39Å; K212-V215 VanDerWaalsContact O-N 3.11Å; K212-D216 WeakPolarHBondContact CE-OD2 3.5Å; K212-D216 IonicContact NZ-OD1 3.19Å; K212-D216 IonicContact NZ-OD2 2.64Å; K212-D216 PolarHBondContact NZ-OD2 3Å; K212-D216 WeakPolarHBondContact O-CB 3.39Å; K212-D216 VanDerWaalsContact O-CG 3.23Å; K212-D216 PolarHBondContact O-N 3.46Å
213	L	74.1	Confident	74.9	Confident	100 Å²	100	108.7 Å²	108.7	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-61.3	-28.8	177	-77.9	165.7	0	0	0	112.7	A209 L210 R217	A209-L213 VanDerWaalsContact O-CB 3.27Å; A209-L213 WeakPolarHBondContact O-CB 3.4Å; A209-L213 WeakPolarHBondContact O-CD1 3.18Å; A209-L213 WeakPolarHBondContact O-CG 3.14Å; A209-L213 PolarHBondContact O-N 2.97Å; L210-L213 PolarHBondContact O-N 2.94Å; L213-R217 WeakPolarHBondContact O-CB 3.43Å; L213-R217 WeakPolarHBondContact O-CG 3.42Å; L213-R217 PolarHBondContact O-N 3.07Å
214	E	76.1	Confident	76.4	Confident	97 Å²	97	112 Å²	112	45%	0.453	52%	0.524	S	S	.	.	H	α-helix	trans	-76.3	-38.5	172.8	-165.7	179.8	152.9	0	0	112.3	L210 E211 K212 R217 R218	L210-E214 PolarHBondContact O-N 3.46Å; E211-E214 PolarHBondContact O-N 3.09Å; K212-E214 PolarHBondContact O-N 3.43Å; E214-R217 PolarHBondContact O-N 3.41Å; E214-R218 WeakPolarHBondContact O-CB 3.44Å; E214-R218 VanDerWaalsContact O-CG 3.23Å; E214-R218 WeakPolarHBondContact O-CG 3.47Å; E214-R218 PolarHBondContact O-N 2.83Å; E214-R218 IonicContact OE1-CZ 3.29Å; E214-R218 VanDerWaalsContact OE1-CZ 3.24Å; E214-R218 IonicContact OE1-NE 2.75Å; E214-R218 PolarHBondContact OE1-NE 3.15Å; E214-R218 IonicContact OE1-NH2 3.12Å; E214-R218 PolarHBondContact OE1-NH2 3.37Å
215	V	80.7	Confident	77.6	Confident	88 Å²	88	108.5 Å²	108.5	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-48.1	172.2	173.1	0	0	0	0	110.7	E211 K212 R217 R218 L219	E211-V215 WeakPolarHBondContact O-CG2 3.32Å; E211-V215 PolarHBondContact O-N 2.9Å; K212-V215 PolarHBondContact O-N 3.39Å; K212-V215 VanDerWaalsContact O-N 3.11Å; V215-R217 VanDerWaalsContact C-N 3.34Å; V215-R217 PolarHBondContact O-N 2.89Å; V215-R218 WeakPolarHBondContact O-CB 3.42Å; V215-R218 PolarHBondContact O-N 3.43Å; V215-L219 PolarHBondContact O-N 3.34Å
216	D	79.8	Confident	79.1	Confident	52 Å²	52	106.3 Å²	106.3	28%	0.278	51%	0.506	S	S	.	.	H	α-helix	trans	-55.9	-49	174.9	-66.5	-20.1	0	0	0	109.3	K212 R218 L219 E220	K212-D216 WeakPolarHBondContact CE-OD2 3.5Å; K212-D216 IonicContact NZ-OD1 3.19Å; K212-D216 IonicContact NZ-OD2 2.64Å; K212-D216 PolarHBondContact NZ-OD2 3Å; K212-D216 WeakPolarHBondContact O-CB 3.39Å; K212-D216 VanDerWaalsContact O-CG 3.23Å; K212-D216 PolarHBondContact O-N 3.46Å; D216-R218 VanDerWaalsContact C-N 3.29Å; D216-R218 PolarHBondContact O-N 2.86Å; D216-L219 CarbonylContact O-C 3.58Å; D216-L219 WeakPolarHBondContact O-CB 3.44Å; D216-L219 PolarHBondContact O-N 3.03Å; D216-E220 WeakPolarHBondContact O-CG 3.37Å; D216-E220 PolarHBondContact O-N 3.35Å
217	R	78.6	Confident	80.4	Confident	168 Å²	168	108.3 Å²	108.3	63%	0.634	52%	0.517	S	S	*	.	H	α-helix	trans	-62.8	-23.4	173.5	-87.8	179.1	157.3	170	-3.9	115.9	L213 E214 V215 E220 R221	L213-R217 WeakPolarHBondContact O-CB 3.43Å; L213-R217 WeakPolarHBondContact O-CG 3.42Å; L213-R217 PolarHBondContact O-N 3.07Å; E214-R217 PolarHBondContact O-N 3.41Å; V215-R217 VanDerWaalsContact C-N 3.34Å; V215-R217 PolarHBondContact O-N 2.89Å; R217-E220 WeakPolarHBondContact CA-OE2 3.49Å; R217-E220 WeakPolarHBondContact CG-OE2 3.4Å; R217-R221 PolarHBondContact O-NE 2.79Å; R217-R221 PolarHBondContact O-NH2 3.06Å
218	R	83.9	Confident	81.5	Confident	142 Å²	142	110.5 Å²	110.5	54%	0.536	53%	0.525	S	S	.	.	H	α-helix	trans	-81.1	-34.8	173.7	-74.5	166.6	-178.8	-140.8	7.9	109.9	E214 V215 D216 L222	E214-R218 WeakPolarHBondContact O-CB 3.44Å; E214-R218 VanDerWaalsContact O-CG 3.23Å; E214-R218 WeakPolarHBondContact O-CG 3.47Å; E214-R218 PolarHBondContact O-N 2.83Å; E214-R218 IonicContact OE1-CZ 3.29Å; E214-R218 VanDerWaalsContact OE1-CZ 3.24Å; E214-R218 IonicContact OE1-NE 2.75Å; E214-R218 PolarHBondContact OE1-NE 3.15Å; E214-R218 IonicContact OE1-NH2 3.12Å; E214-R218 PolarHBondContact OE1-NH2 3.37Å; V215-R218 WeakPolarHBondContact O-CB 3.42Å; V215-R218 PolarHBondContact O-N 3.43Å; D216-R218 VanDerWaalsContact C-N 3.29Å; D216-R218 PolarHBondContact O-N 2.86Å; R218-L222 WeakPolarHBondContact O-CG 3.39Å; R218-L222 PolarHBondContact O-N 3.35Å; R218-L222 VanDerWaalsContact O-N 3.17Å
219	L	85.6	Confident	82.6	Confident	119 Å²	119	106.6 Å²	106.6	62%	0.623	51%	0.514	S	S	*	.	H	α-helix	trans	-71	-43.2	176.1	-154.7	133.2	0	0	0	111.2	V215 D216 R221 L222 S223	V215-L219 PolarHBondContact O-N 3.34Å; D216-L219 CarbonylContact O-C 3.58Å; D216-L219 WeakPolarHBondContact O-CB 3.44Å; D216-L219 PolarHBondContact O-N 3.03Å; L219-R221 PolarHBondContact O-N 3.44Å; L219-L222 PolarHBondContact O-N 3.16Å; L219-L222 VanDerWaalsContact O-N 3.14Å; L219-S223 PolarHBondContact O-N 3.21Å; L219-S223 PolarHBondContact O-OG 2.76Å; L219-S223 VanDerWaalsContact O-OG 3.07Å
220	E	85.6	Confident	83.9	Confident	106 Å²	106	108.6 Å²	108.6	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-51.8	-53.3	171	-75	170.7	165.5	0	0	111.6	D216 R217 L222 S223 E224	D216-E220 WeakPolarHBondContact O-CG 3.37Å; D216-E220 PolarHBondContact O-N 3.35Å; R217-E220 WeakPolarHBondContact CA-OE2 3.49Å; R217-E220 WeakPolarHBondContact CG-OE2 3.4Å; E220-L222 VanDerWaalsContact C-N 3.3Å; E220-L222 PolarHBondContact O-N 2.89Å; E220-S223 VanDerWaalsContact CA-OG 3.31Å; E220-S223 WeakPolarHBondContact CA-OG 3.34Å; E220-S223 PolarHBondContact O-N 3.48Å; E220-S223 VanDerWaalsContact O-N 3.17Å; E220-S223 PolarHBondContact O-OG 3.33Å; E220-E224 WeakPolarHBondContact O-CG 3.31Å; E220-E224 PolarHBondContact O-N 2.93Å
221	R	85.2	Confident	85	Confident	136 Å²	136	106.1 Å²	106.1	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-33.7	177.7	-81.7	175.5	-74.3	169.4	-3.8	113.6	R217 L219 E225	R217-R221 PolarHBondContact O-NE 2.79Å; R217-R221 PolarHBondContact O-NH2 3.06Å; L219-R221 PolarHBondContact O-N 3.44Å; R221-E225 WeakPolarHBondContact O-CB 3.3Å; R221-E225 PolarHBondContact O-N 3.33Å
222	L	87.1	Confident	85.9	Confident	107 Å²	107	101.8 Å²	101.8	56%	0.56	50%	0.5	S	S	*	.	H	α-helix	trans	-74.2	-36.9	175.3	-73.5	170	0	0	0	111.9	R218 L219 E220 E225 V226	R218-L222 WeakPolarHBondContact O-CG 3.39Å; R218-L222 PolarHBondContact O-N 3.35Å; R218-L222 VanDerWaalsContact O-N 3.17Å; L219-L222 PolarHBondContact O-N 3.16Å; L219-L222 VanDerWaalsContact O-N 3.14Å; E220-L222 VanDerWaalsContact C-N 3.3Å; E220-L222 PolarHBondContact O-N 2.89Å; L222-E225 PolarHBondContact O-N 2.97Å; L222-V226 WeakPolarHBondContact O-CB 3.41Å; L222-V226 VanDerWaalsContact O-CG2 3.26Å; L222-V226 WeakPolarHBondContact O-CG2 3.45Å; L222-V226 PolarHBondContact O-N 3.24Å
223	S	86.2	Confident	86.8	Confident	50 Å²	50	100.9 Å²	100.9	35%	0.35	50%	0.498	S	S	.	.	H	α-helix	trans	-65.3	-43	170.2	41.8	0	0	0	0	111.7	L219 E220 E225 V226 E227	L219-S223 PolarHBondContact O-N 3.21Å; L219-S223 PolarHBondContact O-OG 2.76Å; L219-S223 VanDerWaalsContact O-OG 3.07Å; E220-S223 VanDerWaalsContact CA-OG 3.31Å; E220-S223 WeakPolarHBondContact CA-OG 3.34Å; E220-S223 PolarHBondContact O-N 3.48Å; E220-S223 VanDerWaalsContact O-N 3.17Å; E220-S223 PolarHBondContact O-OG 3.33Å; S223-E225 PolarHBondContact O-N 3.23Å; S223-V226 PolarHBondContact O-N 2.78Å; S223-E227 VanDerWaalsContact O-CB 3.31Å; S223-E227 WeakPolarHBondContact O-CB 3.48Å; S223-E227 WeakPolarHBondContact O-CG 3.45Å; S223-E227 PolarHBondContact O-N 3.01Å
224	E	90.4	Very high	87.8	Confident	104 Å²	104	99.9 Å²	99.9	49%	0.486	50%	0.496	S	S	.	.	H	α-helix	trans	-58.3	-44.5	174.3	-73.1	172.6	167.1	0	0	111.6	E220 Q228	E220-E224 WeakPolarHBondContact O-CG 3.31Å; E220-E224 PolarHBondContact O-N 2.93Å; E224-Q228 VanDerWaalsContact O-CB 3.31Å; E224-Q228 WeakPolarHBondContact O-CB 3.27Å; E224-Q228 WeakPolarHBondContact O-CG 3.4Å; E224-Q228 PolarHBondContact O-N 3.08Å
225	E	89.4	Confident	88.7	Confident	94 Å²	94	97.2 Å²	97.2	44%	0.439	49%	0.494	S	S	.	.	H	α-helix	trans	-68.7	-36.1	178.6	-160.6	-168.5	163.9	0	0	112.2	R221 L222 S223 K229	R221-E225 WeakPolarHBondContact O-CB 3.3Å; R221-E225 PolarHBondContact O-N 3.33Å; L222-E225 PolarHBondContact O-N 2.97Å; S223-E225 PolarHBondContact O-N 3.23Å; E225-K229 VanDerWaalsContact CD-NZ 3.28Å; E225-K229 WeakPolarHBondContact O-CB 3.42Å; E225-K229 WeakPolarHBondContact O-CD 3.45Å; E225-K229 VanDerWaalsContact O-CG 3.24Å; E225-K229 WeakPolarHBondContact O-CG 3.35Å; E225-K229 PolarHBondContact O-N 2.9Å; E225-K229 VanDerWaalsContact OE1-CE 3.24Å; E225-K229 WeakPolarHBondContact OE1-CE 3.32Å; E225-K229 IonicContact OE1-NZ 2.66Å; E225-K229 PolarHBondContact OE1-NZ 3.26Å
226	V	93.9	Very high	89.3	Confident	80 Å²	80	100.8 Å²	100.8	49%	0.485	50%	0.498	S	S	.	.	H	α-helix	trans	-70.4	-44.1	175.1	167.4	0	0	0	0	111.2	L222 S223 K229 I230	L222-V226 WeakPolarHBondContact O-CB 3.41Å; L222-V226 VanDerWaalsContact O-CG2 3.26Å; L222-V226 WeakPolarHBondContact O-CG2 3.45Å; L222-V226 PolarHBondContact O-N 3.24Å; S223-V226 PolarHBondContact O-N 2.78Å; V226-K229 PolarHBondContact O-N 3.43Å; V226-I230 HydrophobicContact CG1-CD1 3.67Å; V226-I230 HydrophobicContact CG1-CG1 4.38Å; V226-I230 WeakPolarHBondContact O-CB 3.4Å; V226-I230 VanDerWaalsContact O-CG1 3.29Å; V226-I230 WeakPolarHBondContact O-CG1 3.4Å; V226-I230 PolarHBondContact O-N 2.89Å
227	E	91.1	Very high	90.1	Very high	133 Å²	133	103.8 Å²	103.8	62%	0.621	51%	0.513	S	S	*	.	H	α-helix	trans	-63.1	-42.1	175.5	-75.9	-179.7	-173.2	0	0	111.4	S223 K229 I230 A231	S223-E227 VanDerWaalsContact O-CB 3.31Å; S223-E227 WeakPolarHBondContact O-CB 3.48Å; S223-E227 WeakPolarHBondContact O-CG 3.45Å; S223-E227 PolarHBondContact O-N 3.01Å; E227-K229 VanDerWaalsContact C-N 3.35Å; E227-K229 PolarHBondContact O-N 2.67Å; E227-I230 PolarHBondContact O-N 2.6Å; E227-A231 WeakPolarHBondContact O-CB 3.36Å; E227-A231 PolarHBondContact O-N 3.38Å
228	Q	90.8	Very high	90.8	Very high	140 Å²	140	100.6 Å²	100.6	65%	0.654	51%	0.506	S	S	*	.	H	α-helix	trans	-63.6	-37.8	173.5	-74.4	175.5	32.1	0	0	112.3	E224 G232	E224-Q228 VanDerWaalsContact O-CB 3.31Å; E224-Q228 WeakPolarHBondContact O-CB 3.27Å; E224-Q228 WeakPolarHBondContact O-CG 3.4Å; E224-Q228 PolarHBondContact O-N 3.08Å; Q228-G232 PolarHBondContact O-N 3.28Å
229	K	92.3	Very high	91.3	Very high	112 Å²	112	96.5 Å²	96.5	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-68.2	-42.5	174.6	-76.5	168	-173	167.3	0	112.2	E225 V226 E227 G232 Q233	E225-K229 VanDerWaalsContact CD-NZ 3.28Å; E225-K229 WeakPolarHBondContact O-CB 3.42Å; E225-K229 WeakPolarHBondContact O-CD 3.45Å; E225-K229 VanDerWaalsContact O-CG 3.24Å; E225-K229 WeakPolarHBondContact O-CG 3.35Å; E225-K229 PolarHBondContact O-N 2.9Å; E225-K229 VanDerWaalsContact OE1-CE 3.24Å; E225-K229 WeakPolarHBondContact OE1-CE 3.32Å; E225-K229 IonicContact OE1-NZ 2.66Å; E225-K229 PolarHBondContact OE1-NZ 3.26Å; V226-K229 PolarHBondContact O-N 3.43Å; E227-K229 VanDerWaalsContact C-N 3.35Å; E227-K229 PolarHBondContact O-N 2.67Å; K229-G232 PolarHBondContact O-N 2.89Å; K229-Q233 WeakPolarHBondContact O-CB 3.44Å; K229-Q233 WeakPolarHBondContact O-CG 3.39Å; K229-Q233 PolarHBondContact O-N 2.79Å
230	I	94.1	Very high	91.7	Very high	91 Å²	91	96.4 Å²	96.4	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-51.3	176.2	-69.9	168.3	0	0	0	110.1	V226 E227 G232 Q233 V234	V226-I230 HydrophobicContact CG1-CD1 3.67Å; V226-I230 HydrophobicContact CG1-CG1 4.38Å; V226-I230 WeakPolarHBondContact O-CB 3.4Å; V226-I230 VanDerWaalsContact O-CG1 3.29Å; V226-I230 WeakPolarHBondContact O-CG1 3.4Å; V226-I230 PolarHBondContact O-N 2.89Å; E227-I230 PolarHBondContact O-N 2.6Å; I230-G232 VanDerWaalsContact C-N 3.27Å; I230-G232 PolarHBondContact O-N 3.13Å; I230-Q233 PolarHBondContact O-N 2.93Å; I230-Q233 VanDerWaalsContact O-N 3.08Å; I230-V234 HydrophobicContact CG2-CG2 4.2Å; I230-V234 WeakPolarHBondContact O-CB 3.44Å; I230-V234 WeakPolarHBondContact O-CG2 3.23Å; I230-V234 PolarHBondContact O-N 3.17Å
231	A	91.4	Very high	92.2	Very high	63 Å²	63	97 Å²	97	52%	0.521	51%	0.505	S	S	.	.	H	α-helix	trans	-58.3	-39.5	175.8	0	0	0	0	0	111.6	E227 G235	E227-A231 WeakPolarHBondContact O-CB 3.36Å; E227-A231 PolarHBondContact O-N 3.38Å; A231-G235 PolarHBondContact O-N 3.42Å
232	G	93.1	Very high	92.7	Very high	28 Å²	28	95.9 Å²	95.9	29%	0.289	51%	0.505	S	S	.	.	H	α-helix	trans	-66.8	-35.6	174	0	0	0	0	0	114	Q228 K229 I230 R236	Q228-G232 PolarHBondContact O-N 3.28Å; K229-G232 PolarHBondContact O-N 2.89Å; I230-G232 VanDerWaalsContact C-N 3.27Å; I230-G232 PolarHBondContact O-N 3.13Å; G232-R236 WeakPolarHBondContact O-CG 3.48Å; G232-R236 PolarHBondContact O-N 2.83Å; G232-R236 PolarHBondContact O-NH1 3.44Å
233	Q	93.4	Very high	93.1	Very high	109 Å²	109	98.8 Å²	98.8	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-72.6	-47.8	173.7	-79.2	179.9	-75.3	0	0	111.6	K229 I230 G235 R236 L237	K229-Q233 WeakPolarHBondContact O-CB 3.44Å; K229-Q233 WeakPolarHBondContact O-CG 3.39Å; K229-Q233 PolarHBondContact O-N 2.79Å; I230-Q233 PolarHBondContact O-N 2.93Å; I230-Q233 VanDerWaalsContact O-N 3.08Å; Q233-G235 PolarHBondContact O-N 2.85Å; Q233-R236 PolarHBondContact O-N 3.35Å; Q233-L237 WeakPolarHBondContact O-CG 3.35Å; Q233-L237 PolarHBondContact O-N 3.29Å
234	V	95.2	Very high	93.6	Very high	79 Å²	79	101.4 Å²	101.4	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-58.3	-47.5	176.3	172.2	0	0	0	0	110.1	I230 R236 L237 Q238	I230-V234 HydrophobicContact CG2-CG2 4.2Å; I230-V234 WeakPolarHBondContact O-CB 3.44Å; I230-V234 WeakPolarHBondContact O-CG2 3.23Å; I230-V234 PolarHBondContact O-N 3.17Å; V234-R236 VanDerWaalsContact C-N 3.3Å; V234-R236 PolarHBondContact O-N 2.99Å; V234-L237 PolarHBondContact O-N 2.99Å; V234-Q238 WeakPolarHBondContact O-CB 3.24Å; V234-Q238 PolarHBondContact O-N 2.86Å
235	G	94.8	Very high	93.7	Very high	41 Å²	41	99 Å²	99	42%	0.423	51%	0.512	S	S	.	.	H	α-helix	trans	-60.9	-33	177.4	0	0	0	0	0	114.2	A231 Q233 A239	A231-G235 PolarHBondContact O-N 3.42Å; Q233-G235 PolarHBondContact O-N 2.85Å; G235-A239 WeakPolarHBondContact O-CB 3.24Å; G235-A239 PolarHBondContact O-N 2.82Å; G235-A239 VanDerWaalsContact O-N 3.15Å
236	R	93.9	Very high	94	Very high	163 Å²	163	97.3 Å²	97.3	62%	0.615	51%	0.514	S	S	*	.	H	α-helix	trans	-71.6	-45.1	172.5	-73.7	-169.6	-55.6	-87.1	11.9	112.2	G232 Q233 V234 Q238 A239 E240	G232-R236 WeakPolarHBondContact O-CG 3.48Å; G232-R236 PolarHBondContact O-N 2.83Å; G232-R236 PolarHBondContact O-NH1 3.44Å; Q233-R236 PolarHBondContact O-N 3.35Å; V234-R236 VanDerWaalsContact C-N 3.3Å; V234-R236 PolarHBondContact O-N 2.99Å; R236-Q238 VanDerWaalsContact C-N 3.32Å; R236-Q238 PolarHBondContact O-N 3.5Å; R236-A239 PolarHBondContact O-N 3.34Å; R236-E240 WeakPolarHBondContact O-CB 3.48Å; R236-E240 PolarHBondContact O-N 3.05Å
237	L	95	Very high	94.1	Very high	114 Å²	114	97.5 Å²	97.5	60%	0.597	51%	0.51	S	S	*	.	H	α-helix	trans	-65.1	-36.8	177.7	-69	170	0	0	0	111.9	Q233 V234 E240 L241	Q233-L237 WeakPolarHBondContact O-CG 3.35Å; Q233-L237 PolarHBondContact O-N 3.29Å; V234-L237 PolarHBondContact O-N 2.99Å; L237-E240 PolarHBondContact O-N 2.85Å; L237-L241 VanDerWaalsContact O-CB 3.24Å; L237-L241 WeakPolarHBondContact O-CB 3.35Å; L237-L241 PolarHBondContact O-N 2.81Å
238	Q	93.9	Very high	94.3	Very high	102 Å²	102	95.2 Å²	95.2	48%	0.477	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-53.5	172.6	-174.7	89	25.8	0	0	110.5	V234 R236 E240 L241 E242	V234-Q238 WeakPolarHBondContact O-CB 3.24Å; V234-Q238 PolarHBondContact O-N 2.86Å; R236-Q238 VanDerWaalsContact C-N 3.32Å; R236-Q238 PolarHBondContact O-N 3.5Å; Q238-E240 VanDerWaalsContact C-N 3.32Å; Q238-E240 PolarHBondContact O-N 2.96Å; Q238-L241 PolarHBondContact O-N 3.44Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.47Å; Q238-E242 PolarHBondContact NE2-OE1 3.25Å; Q238-E242 WeakPolarHBondContact O-CB 3.5Å; Q238-E242 WeakPolarHBondContact O-CG 3.41Å; Q238-E242 PolarHBondContact O-N 2.8Å
239	A	94.6	Very high	94.5	Very high	56 Å²	56	92.5 Å²	92.5	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-32.2	179.1	0	0	0	0	0	113.3	G235 R236 R243	G235-A239 WeakPolarHBondContact O-CB 3.24Å; G235-A239 PolarHBondContact O-N 2.82Å; G235-A239 VanDerWaalsContact O-N 3.15Å; R236-A239 PolarHBondContact O-N 3.34Å; A239-R243 WeakPolarHBondContact O-CB 3.45Å; A239-R243 PolarHBondContact O-N 3.32Å
240	E	94.8	Very high	94.6	Very high	116 Å²	116	90.8 Å²	90.8	54%	0.542	49%	0.488	S	S	.	.	H	α-helix	trans	-73	-39.6	174.6	-174.1	160.8	-151.5	0	0	112	R236 L237 Q238 R243 K244	R236-E240 WeakPolarHBondContact O-CB 3.48Å; R236-E240 PolarHBondContact O-N 3.05Å; L237-E240 PolarHBondContact O-N 2.85Å; Q238-E240 VanDerWaalsContact C-N 3.32Å; Q238-E240 PolarHBondContact O-N 2.96Å; E240-R243 PolarHBondContact O-N 3.3Å; E240-K244 WeakPolarHBondContact O-CB 3.43Å; E240-K244 WeakPolarHBondContact O-CG 3.42Å; E240-K244 PolarHBondContact O-N 2.84Å
241	L	96.1	Very high	94.7	Very high	120 Å²	120	89 Å²	89	63%	0.628	49%	0.487	S	S	*	.	H	α-helix	trans	-63.7	-43.6	172.5	-179	64.3	0	0	0	111.5	L237 Q238 K244 A245	L237-L241 VanDerWaalsContact O-CB 3.24Å; L237-L241 WeakPolarHBondContact O-CB 3.35Å; L237-L241 PolarHBondContact O-N 2.81Å; Q238-L241 PolarHBondContact O-N 3.44Å; L241-K244 PolarHBondContact O-N 3.21Å; L241-A245 WeakPolarHBondContact O-CB 3.48Å; L241-A245 PolarHBondContact O-N 3.1Å
242	E	94.1	Very high	94.9	Very high	112 Å²	112	92.9 Å²	92.9	52%	0.523	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-42.4	176.2	-74.7	168.9	-167.7	0	0	111.6	Q238 A245 A246	Q238-E242 WeakPolarHBondContact CG-OE1 3.47Å; Q238-E242 PolarHBondContact NE2-OE1 3.25Å; Q238-E242 WeakPolarHBondContact O-CB 3.5Å; Q238-E242 WeakPolarHBondContact O-CG 3.41Å; Q238-E242 PolarHBondContact O-N 2.8Å; E242-A245 PolarHBondContact O-N 2.94Å; E242-A246 WeakPolarHBondContact O-CB 3.41Å; E242-A246 PolarHBondContact O-N 3.09Å
243	R	96.8	Very high	95.1	Very high	167 Å²	167	97.7 Å²	97.7	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-59.2	-48.3	170.6	171.7	179.2	-76.4	152.9	-4.9	111.5	A239 E240 A245 A246 E247	A239-R243 WeakPolarHBondContact O-CB 3.45Å; A239-R243 PolarHBondContact O-N 3.32Å; E240-R243 PolarHBondContact O-N 3.3Å; R243-A245 VanDerWaalsContact C-N 3.33Å; R243-A245 PolarHBondContact O-N 3.49Å; R243-A246 PolarHBondContact O-N 3.12Å; R243-E247 WeakPolarHBondContact CD-OE1 3.49Å; R243-E247 HydrophobicContact CG-CG 4.39Å; R243-E247 VanDerWaalsContact CG-OE1 3.24Å; R243-E247 WeakPolarHBondContact CG-OE1 3.38Å; R243-E247 WeakPolarHBondContact O-CG 3.44Å; R243-E247 PolarHBondContact O-N 2.86Å
244	K	95.6	Very high	95.2	Very high	105 Å²	105	98.6 Å²	98.6	46%	0.457	51%	0.507	S	S	.	.	H	α-helix	trans	-67.8	-32.7	-178.1	-71.8	-70.9	162.2	-154.2	0	112.6	E240 L241 E247 L248	E240-K244 WeakPolarHBondContact O-CB 3.43Å; E240-K244 WeakPolarHBondContact O-CG 3.42Å; E240-K244 PolarHBondContact O-N 2.84Å; L241-K244 PolarHBondContact O-N 3.21Å; K244-E247 WeakPolarHBondContact CD-OE2 3.49Å; K244-E247 IonicContact NZ-OE1 3.88Å; K244-E247 PolarHBondContact NZ-OE1 3.27Å; K244-E247 IonicContact NZ-OE2 3.09Å; K244-E247 PolarHBondContact NZ-OE2 2.73Å; K244-L248 WeakPolarHBondContact O-CB 3.44Å; K244-L248 PolarHBondContact O-N 3.49Å
245	A	94.1	Very high	95	Very high	54 Å²	54	98.7 Å²	98.7	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-45.4	170.2	0	0	0	0	0	111.4	L241 E242 R243 L248 E249	L241-A245 WeakPolarHBondContact O-CB 3.48Å; L241-A245 PolarHBondContact O-N 3.1Å; E242-A245 PolarHBondContact O-N 2.94Å; R243-A245 VanDerWaalsContact C-N 3.33Å; R243-A245 PolarHBondContact O-N 3.49Å; A245-L248 PolarHBondContact O-N 3.27Å; A245-E249 PolarHBondContact O-N 3.29Å
246	A	95.3	Very high	95.1	Very high	59 Å²	59	99.3 Å²	99.3	49%	0.488	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-46.1	177.6	0	0	0	0	0	112.8	E242 R243 L248 E249 T250	E242-A246 WeakPolarHBondContact O-CB 3.41Å; E242-A246 PolarHBondContact O-N 3.09Å; R243-A246 PolarHBondContact O-N 3.12Å; A246-L248 VanDerWaalsContact C-N 3.31Å; A246-L248 PolarHBondContact O-N 3.21Å; A246-E249 PolarHBondContact O-N 2.8Å; A246-T250 PolarHBondContact O-N 3.39Å; A246-T250 PolarHBondContact O-OG1 3.28Å
247	E	95.9	Very high	95.2	Very high	83 Å²	83	99.1 Å²	99.1	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-56.2	-45.1	173.7	-72.3	173.2	-157.1	0	0	111.3	R243 K244 T250 A251	R243-E247 WeakPolarHBondContact CD-OE1 3.49Å; R243-E247 HydrophobicContact CG-CG 4.39Å; R243-E247 VanDerWaalsContact CG-OE1 3.24Å; R243-E247 WeakPolarHBondContact CG-OE1 3.38Å; R243-E247 WeakPolarHBondContact O-CG 3.44Å; R243-E247 PolarHBondContact O-N 2.86Å; K244-E247 WeakPolarHBondContact CD-OE2 3.49Å; K244-E247 IonicContact NZ-OE1 3.88Å; K244-E247 PolarHBondContact NZ-OE1 3.27Å; K244-E247 IonicContact NZ-OE2 3.09Å; K244-E247 PolarHBondContact NZ-OE2 2.73Å; E247-T250 WeakPolarHBondContact CA-OG1 3.49Å; E247-T250 PolarHBondContact O-N 3.05Å; E247-T250 PolarHBondContact O-OG1 2.86Å; E247-A251 PolarHBondContact O-N 2.88Å
248	L	95.9	Very high	95.2	Very high	86 Å²	86	98.8 Å²	98.8	45%	0.45	51%	0.51	S	S	.	.	H	α-helix	trans	-70.9	-34.5	-177.9	-163.7	152.4	0	0	0	112.3	K244 A245 A246 A251 R252	K244-L248 WeakPolarHBondContact O-CB 3.44Å; K244-L248 PolarHBondContact O-N 3.49Å; A245-L248 PolarHBondContact O-N 3.27Å; A246-L248 VanDerWaalsContact C-N 3.31Å; A246-L248 PolarHBondContact O-N 3.21Å; L248-A251 PolarHBondContact O-N 3.02Å; L248-R252 HydrophobicContact CD2-CG 4.18Å; L248-R252 VanDerWaalsContact CD2-NE 3.34Å; L248-R252 WeakPolarHBondContact O-CG 3.21Å; L248-R252 PolarHBondContact O-N 2.74Å
249	E	93.8	Very high	95.3	Very high	82 Å²	82	95.3 Å²	95.3	38%	0.383	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-38.6	170.1	-75.9	-53.6	132.2	0	0	112.6	A245 A246 R252 Q253	A245-E249 PolarHBondContact O-N 3.29Å; A246-E249 PolarHBondContact O-N 2.8Å; E249-R252 WeakPolarHBondContact O-CB 3.45Å; E249-R252 PolarHBondContact O-N 3.17Å; E249-R252 WeakPolarHBondContact OE1-CD 3.46Å; E249-R252 IonicContact OE1-CZ 3.73Å; E249-R252 IonicContact OE1-NE 2.73Å; E249-R252 IonicContact OE1-NH1 3.97Å; E249-R252 PolarHBondContact OE1-NH1 3.49Å; E249-Q253 VanDerWaalsContact O-CG 3.31Å; E249-Q253 WeakPolarHBondContact O-CG 3.42Å; E249-Q253 PolarHBondContact O-N 3.24Å
250	T	95.6	Very high	95.4	Very high	77 Å²	77	100.8 Å²	100.8	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-43.3	172.6	49.7	0	0	0	0	111.9	A246 E247 R252 Q253 E254	A246-T250 PolarHBondContact O-N 3.39Å; A246-T250 PolarHBondContact O-OG1 3.28Å; E247-T250 WeakPolarHBondContact CA-OG1 3.49Å; E247-T250 PolarHBondContact O-N 3.05Å; E247-T250 PolarHBondContact O-OG1 2.86Å; T250-R252 VanDerWaalsContact C-N 3.33Å; T250-R252 PolarHBondContact O-N 3.3Å; T250-Q253 PolarHBondContact O-N 3.43Å; T250-Q253 VanDerWaalsContact O-N 3.16Å; T250-E254 WeakPolarHBondContact O-CG 3.42Å; T250-E254 PolarHBondContact O-N 3.38Å
251	A	95.5	Very high	95.4	Very high	53 Å²	53	98.7 Å²	98.7	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-34.1	175.4	0	0	0	0	0	113.1	E247 L248 S255	E247-A251 PolarHBondContact O-N 2.88Å; L248-A251 PolarHBondContact O-N 3.02Å; A251-S255 VanDerWaalsContact O-CB 3.25Å; A251-S255 WeakPolarHBondContact O-CB 3.31Å; A251-S255 PolarHBondContact O-N 3.47Å
252	R	95.8	Very high	95.4	Very high	145 Å²	145	98.4 Å²	98.4	55%	0.547	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-43.4	171.6	-79.9	172.8	170.5	156.3	3.5	111.8	L248 E249 T250 S255 A256	L248-R252 HydrophobicContact CD2-CG 4.18Å; L248-R252 VanDerWaalsContact CD2-NE 3.34Å; L248-R252 WeakPolarHBondContact O-CG 3.21Å; L248-R252 PolarHBondContact O-N 2.74Å; E249-R252 WeakPolarHBondContact O-CB 3.45Å; E249-R252 PolarHBondContact O-N 3.17Å; E249-R252 WeakPolarHBondContact OE1-CD 3.46Å; E249-R252 IonicContact OE1-CZ 3.73Å; E249-R252 IonicContact OE1-NE 2.73Å; E249-R252 IonicContact OE1-NH1 3.97Å; E249-R252 PolarHBondContact OE1-NH1 3.49Å; T250-R252 VanDerWaalsContact C-N 3.33Å; T250-R252 PolarHBondContact O-N 3.3Å; R252-S255 PolarHBondContact O-N 3.33Å; R252-A256 VanDerWaalsContact O-CB 3.29Å; R252-A256 WeakPolarHBondContact O-CB 3.5Å; R252-A256 PolarHBondContact O-N 2.82Å
253	Q	96.1	Very high	95.5	Very high	128 Å²	128	99.3 Å²	99.3	60%	0.598	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-41.5	178.9	-69.3	169	32.5	0	0	112	E249 T250 A256 R257	E249-Q253 VanDerWaalsContact O-CG 3.31Å; E249-Q253 WeakPolarHBondContact O-CG 3.42Å; E249-Q253 PolarHBondContact O-N 3.24Å; T250-Q253 PolarHBondContact O-N 3.43Å; T250-Q253 VanDerWaalsContact O-N 3.16Å; Q253-A256 PolarHBondContact O-N 3.02Å; Q253-R257 WeakPolarHBondContact O-CB 3.45Å; Q253-R257 PolarHBondContact O-N 2.97Å
254	E	95.5	Very high	95.5	Very high	128 Å²	128	95.6 Å²	95.6	60%	0.598	49%	0.488	S	S	*	.	H	α-helix	trans	-64.7	-44.7	174.4	-70.8	-177.6	160.9	0	0	112.1	T250 A256 R257 L258	T250-E254 WeakPolarHBondContact O-CG 3.42Å; T250-E254 PolarHBondContact O-N 3.38Å; E254-A256 PolarHBondContact O-N 3.44Å; E254-R257 WeakPolarHBondContact O-CB 3.1Å; E254-R257 PolarHBondContact O-N 3.28Å; E254-L258 WeakPolarHBondContact O-CG 3.35Å; E254-L258 PolarHBondContact O-N 3.04Å
255	S	92.8	Very high	95.5	Very high	81 Å²	81	95.8 Å²	95.8	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-60.5	-44.6	174.8	-176.2	0	0	0	0	112.1	A251 R252 R257 L258 G259	A251-S255 VanDerWaalsContact O-CB 3.25Å; A251-S255 WeakPolarHBondContact O-CB 3.31Å; A251-S255 PolarHBondContact O-N 3.47Å; R252-S255 PolarHBondContact O-N 3.33Å; S255-R257 VanDerWaalsContact C-N 3.28Å; S255-R257 PolarHBondContact O-N 3.31Å; S255-L258 PolarHBondContact O-N 2.9Å; S255-G259 PolarHBondContact O-N 3.5Å
256	A	95.7	Very high	95.6	Very high	54 Å²	54	98 Å²	98	45%	0.446	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-27.1	176.4	0	0	0	0	0	113.4	R252 Q253 E254	R252-A256 VanDerWaalsContact O-CB 3.29Å; R252-A256 WeakPolarHBondContact O-CB 3.5Å; R252-A256 PolarHBondContact O-N 2.82Å; Q253-A256 PolarHBondContact O-N 3.02Å; E254-A256 PolarHBondContact O-N 3.44Å
257	R	96.9	Very high	95.6	Very high	159 Å²	159	102.1 Å²	102.1	60%	0.6	50%	0.504	S	S	*	.	H	α-helix	trans	-72.6	-50.5	171	176.3	-176.8	164.5	-154.4	-16.1	111.1	Q253 E254 S255 G259 R260 E261	Q253-R257 WeakPolarHBondContact O-CB 3.45Å; Q253-R257 PolarHBondContact O-N 2.97Å; E254-R257 WeakPolarHBondContact O-CB 3.1Å; E254-R257 PolarHBondContact O-N 3.28Å; S255-R257 VanDerWaalsContact C-N 3.28Å; S255-R257 PolarHBondContact O-N 3.31Å; R257-G259 PolarHBondContact O-N 2.87Å; R257-R260 PolarHBondContact O-N 3.3Å; R257-R260 VanDerWaalsContact O-N 3.08Å; R257-E261 IonicContact CZ-OE1 3.15Å; R257-E261 IonicContact NE-OE1 2.79Å; R257-E261 PolarHBondContact NE-OE1 2.88Å; R257-E261 IonicContact NH2-OE1 2.67Å; R257-E261 PolarHBondContact NH2-OE1 3.48Å; R257-E261 IonicContact NH2-OE2 2.6Å; R257-E261 PolarHBondContact O-N 2.84Å
258	L	94.7	Very high	95.7	Very high	107 Å²	107	104.6 Å²	104.6	56%	0.56	51%	0.51	S	S	*	.	H	α-helix	trans	-61.2	-32	179.1	-70.8	171	0	0	0	112.3	E254 S255 E261 K262	E254-L258 WeakPolarHBondContact O-CG 3.35Å; E254-L258 PolarHBondContact O-N 3.04Å; S255-L258 PolarHBondContact O-N 2.9Å; L258-E261 PolarHBondContact O-N 3.36Å; L258-K262 WeakPolarHBondContact O-CB 3.5Å; L258-K262 PolarHBondContact O-N 2.96Å
259	G	95.9	Very high	95.6	Very high	30 Å²	30	103.2 Å²	103.2	31%	0.309	51%	0.511	S	S	.	.	H	α-helix	trans	-57.8	-47.4	170.8	0	0	0	0	0	113	S255 R257 K262 E263	S255-G259 PolarHBondContact O-N 3.5Å; R257-G259 PolarHBondContact O-N 2.87Å; G259-K262 WeakPolarHBondContact O-CB 3.25Å; G259-K262 PolarHBondContact O-N 3.43Å; G259-E263 WeakPolarHBondContact O-CG 3.32Å; G259-E263 PolarHBondContact O-N 3.3Å
260	R	96.5	Very high	95.7	Very high	171 Å²	171	103.1 Å²	103.1	65%	0.645	52%	0.519	S	S	*	.	H	α-helix	trans	-67.9	-42.1	177.4	-60.9	176.3	-161.9	-170.6	3.2	112.2	R257 K262 E263 E264	R257-R260 PolarHBondContact O-N 3.3Å; R257-R260 VanDerWaalsContact O-N 3.08Å; R260-K262 PolarHBondContact O-N 3.29Å; R260-E263 PolarHBondContact O-N 3.07Å; R260-E264 PolarHBondContact O-N 3.32Å
261	E	95.7	Very high	95.7	Very high	71 Å²	71	102.9 Å²	102.9	33%	0.332	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-33.9	176.2	-69.3	179.8	179.9	0	0	111.3	R257 L258 L265	R257-E261 IonicContact CZ-OE1 3.15Å; R257-E261 IonicContact NE-OE1 2.79Å; R257-E261 PolarHBondContact NE-OE1 2.88Å; R257-E261 IonicContact NH2-OE1 2.67Å; R257-E261 PolarHBondContact NH2-OE1 3.48Å; R257-E261 IonicContact NH2-OE2 2.6Å; R257-E261 PolarHBondContact O-N 2.84Å; L258-E261 PolarHBondContact O-N 3.36Å; E261-L265 WeakPolarHBondContact O-CD1 3.47Å; E261-L265 WeakPolarHBondContact O-CG 3.48Å; E261-L265 PolarHBondContact O-N 3.47Å
262	K	96.1	Very high	95.7	Very high	115 Å²	115	105.5 Å²	105.5	50%	0.5	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-48.8	170.4	-179.6	-177.5	178.8	-82.2	0	112.2	L258 G259 R260 E264 L265 E266	L258-K262 WeakPolarHBondContact O-CB 3.5Å; L258-K262 PolarHBondContact O-N 2.96Å; G259-K262 WeakPolarHBondContact O-CB 3.25Å; G259-K262 PolarHBondContact O-N 3.43Å; R260-K262 PolarHBondContact O-N 3.29Å; K262-E264 VanDerWaalsContact C-N 3.35Å; K262-E264 PolarHBondContact O-N 3.43Å; K262-L265 PolarHBondContact O-N 3.33Å; K262-L265 VanDerWaalsContact O-N 3.07Å; K262-E266 VanDerWaalsContact CE-OE1 3.27Å; K262-E266 WeakPolarHBondContact CE-OE1 3.39Å; K262-E266 HydrophobicContact CG-CG 4.47Å; K262-E266 IonicContact NZ-OE1 3.25Å; K262-E266 PolarHBondContact NZ-OE1 2.99Å; K262-E266 IonicContact NZ-OE2 3.85Å; K262-E266 PolarHBondContact NZ-OE2 3.48Å; K262-E266 PolarHBondContact O-N 3.29Å
263	E	96.4	Very high	95.6	Very high	131 Å²	131	101.8 Å²	101.8	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-58.5	-44.5	179.2	-73.8	168.3	177.4	0	0	111.6	G259 R260 L265 E266 E267	G259-E263 WeakPolarHBondContact O-CG 3.32Å; G259-E263 PolarHBondContact O-N 3.3Å; R260-E263 PolarHBondContact O-N 3.07Å; E263-L265 VanDerWaalsContact C-N 3.29Å; E263-L265 PolarHBondContact O-N 3.47Å; E263-E266 PolarHBondContact O-N 2.79Å; E263-E267 PolarHBondContact O-N 3.2Å
264	E	96.5	Very high	95.6	Very high	89 Å²	89	101.7 Å²	101.7	42%	0.416	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-35.6	173.6	-76.3	-173.7	-156.7	0	0	113.1	R260 K262 R268	R260-E264 PolarHBondContact O-N 3.32Å; K262-E264 VanDerWaalsContact C-N 3.35Å; K262-E264 PolarHBondContact O-N 3.43Å; E264-R268 WeakPolarHBondContact O-CB 3.49Å; E264-R268 VanDerWaalsContact O-CD 3.3Å; E264-R268 WeakPolarHBondContact O-CD 3.43Å; E264-R268 WeakPolarHBondContact O-CG 3.25Å; E264-R268 PolarHBondContact O-N 3Å; E264-R268 VanDerWaalsContact O-N 3.09Å; E264-R268 IonicContact OE2-CZ 2.65Å; E264-R268 VanDerWaalsContact OE2-CZ 3.3Å; E264-R268 IonicContact OE2-NH1 3.15Å; E264-R268 PolarHBondContact OE2-NH1 3.45Å; E264-R268 VanDerWaalsContact OE2-NH1 3.16Å; E264-R268 IonicContact OE2-NH2 2.89Å; E264-R268 PolarHBondContact OE2-NH2 2.98Å
265	L	94.8	Very high	95.6	Very high	109 Å²	109	100 Å²	100	57%	0.571	50%	0.501	S	S	*	.	H	α-helix	trans	-75.9	-35.6	178.2	-72.8	170.4	0	0	0	112.2	E261 K262 E263 R268 A269	E261-L265 WeakPolarHBondContact O-CD1 3.47Å; E261-L265 WeakPolarHBondContact O-CG 3.48Å; E261-L265 PolarHBondContact O-N 3.47Å; K262-L265 PolarHBondContact O-N 3.33Å; K262-L265 VanDerWaalsContact O-N 3.07Å; E263-L265 VanDerWaalsContact C-N 3.29Å; E263-L265 PolarHBondContact O-N 3.47Å; L265-R268 PolarHBondContact O-N 2.94Å; L265-A269 WeakPolarHBondContact O-CB 3.35Å; L265-A269 PolarHBondContact O-N 3.36Å
266	E	95.6	Very high	95.8	Very high	99 Å²	99	100.4 Å²	100.4	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-69.7	-36.8	174.2	-72.8	179	150.5	0	0	111.9	K262 E263 S270	K262-E266 VanDerWaalsContact CE-OE1 3.27Å; K262-E266 WeakPolarHBondContact CE-OE1 3.39Å; K262-E266 HydrophobicContact CG-CG 4.47Å; K262-E266 IonicContact NZ-OE1 3.25Å; K262-E266 PolarHBondContact NZ-OE1 2.99Å; K262-E266 IonicContact NZ-OE2 3.85Å; K262-E266 PolarHBondContact NZ-OE2 3.48Å; K262-E266 PolarHBondContact O-N 3.29Å; E263-E266 PolarHBondContact O-N 2.79Å; E266-S270 WeakPolarHBondContact O-CB 3.21Å; E266-S270 PolarHBondContact O-N 3.3Å; E266-S270 PolarHBondContact O-OG 3.08Å
267	E	96.6	Very high	95.7	Very high	146 Å²	146	102.1 Å²	102.1	68%	0.682	50%	0.502	S	S	*	.	H	α-helix	trans	-63.4	-47.7	170.4	-173.2	-179	-159.4	0	0	111.4	E263 A269 S270 E271	E263-E267 PolarHBondContact O-N 3.2Å; E267-A269 VanDerWaalsContact C-N 3.34Å; E267-A269 PolarHBondContact O-N 3.49Å; E267-S270 WeakPolarHBondContact O-CB 3.31Å; E267-S270 PolarHBondContact O-N 3.19Å; E267-S270 VanDerWaalsContact O-N 3.14Å; E267-E271 PolarHBondContact O-N 2.86Å
268	R	96.5	Very high	95.7	Very high	135 Å²	135	98 Å²	98	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-61.2	-40	177.4	-73.8	166.1	-171.7	144.7	12.6	112.4	E264 L265 S270 L272	E264-R268 WeakPolarHBondContact O-CB 3.49Å; E264-R268 VanDerWaalsContact O-CD 3.3Å; E264-R268 WeakPolarHBondContact O-CD 3.43Å; E264-R268 WeakPolarHBondContact O-CG 3.25Å; E264-R268 PolarHBondContact O-N 3Å; E264-R268 VanDerWaalsContact O-N 3.09Å; E264-R268 IonicContact OE2-CZ 2.65Å; E264-R268 VanDerWaalsContact OE2-CZ 3.3Å; E264-R268 IonicContact OE2-NH1 3.15Å; E264-R268 PolarHBondContact OE2-NH1 3.45Å; E264-R268 VanDerWaalsContact OE2-NH1 3.16Å; E264-R268 IonicContact OE2-NH2 2.89Å; E264-R268 PolarHBondContact OE2-NH2 2.98Å; L265-R268 PolarHBondContact O-N 2.94Å; R268-S270 VanDerWaalsContact C-N 3.35Å; R268-L272 WeakPolarHBondContact O-CB 3.28Å; R268-L272 VanDerWaalsContact O-CG 3.29Å; R268-L272 WeakPolarHBondContact O-CG 3.36Å; R268-L272 PolarHBondContact O-N 3.38Å
269	A	95.1	Very high	95.3	Very high	58 Å²	58	96.4 Å²	96.4	48%	0.479	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-39.9	174.6	0	0	0	0	0	111.9	L265 E267 L272 S273	L265-A269 WeakPolarHBondContact O-CB 3.35Å; L265-A269 PolarHBondContact O-N 3.36Å; E267-A269 VanDerWaalsContact C-N 3.34Å; E267-A269 PolarHBondContact O-N 3.49Å; A269-L272 PolarHBondContact O-N 3.15Å; A269-S273 PolarHBondContact O-N 3.33Å
270	S	95.3	Very high	95.3	Very high	80 Å²	80	99.2 Å²	99.2	56%	0.559	50%	0.503	S	S	*	.	H	α-helix	trans	-65.8	-44.7	178.4	-58.3	0	0	0	0	112.3	E266 E267 R268 S273 R274	E266-S270 WeakPolarHBondContact O-CB 3.21Å; E266-S270 PolarHBondContact O-N 3.3Å; E266-S270 PolarHBondContact O-OG 3.08Å; E267-S270 WeakPolarHBondContact O-CB 3.31Å; E267-S270 PolarHBondContact O-N 3.19Å; E267-S270 VanDerWaalsContact O-N 3.14Å; R268-S270 VanDerWaalsContact C-N 3.35Å; S270-S273 PolarHBondContact O-N 2.83Å; S270-R274 PolarHBondContact O-N 2.78Å
271	E	96.3	Very high	95.3	Very high	71 Å²	71	97.8 Å²	97.8	33%	0.332	50%	0.503	S	S	.	.	H	α-helix	trans	-66.1	-37.4	175.1	171.8	56.1	-163.5	0	0	112	E267 R274 Q275	E267-E271 PolarHBondContact O-N 2.86Å; E271-R274 PolarHBondContact O-N 2.79Å; E271-R274 IonicContact OE1-CZ 3.68Å; E271-R274 IonicContact OE1-NE 3.49Å; E271-R274 IonicContact OE1-NH2 3.59Å; E271-R274 PolarHBondContact OE1-NH2 3.32Å; E271-R274 IonicContact OE2-CZ 2.65Å; E271-R274 VanDerWaalsContact OE2-CZ 3.25Å; E271-R274 IonicContact OE2-NE 3.65Å; E271-R274 PolarHBondContact OE2-NE 3.41Å; E271-R274 IonicContact OE2-NH2 3.29Å; E271-R274 PolarHBondContact OE2-NH2 2.87Å; E271-Q275 WeakPolarHBondContact O-CG 3.31Å; E271-Q275 PolarHBondContact O-N 2.83Å; E271-Q275 PolarHBondContact OE1-NE2 3.04Å
272	L	94.8	Very high	95.2	Very high	109 Å²	109	99.4 Å²	99.4	57%	0.571	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-41.1	173.3	-76	170.6	0	0	0	112.3	R268 A269 Q275 V276	R268-L272 WeakPolarHBondContact O-CB 3.28Å; R268-L272 VanDerWaalsContact O-CG 3.29Å; R268-L272 WeakPolarHBondContact O-CG 3.36Å; R268-L272 PolarHBondContact O-N 3.38Å; A269-L272 PolarHBondContact O-N 3.15Å; L272-Q275 PolarHBondContact O-N 3.46Å; L272-V276 WeakPolarHBondContact O-CG2 3.2Å; L272-V276 PolarHBondContact O-N 2.76Å
273	S	93.8	Very high	95	Very high	66 Å²	66	99.6 Å²	99.6	46%	0.462	52%	0.52	S	S	.	.	H	α-helix	trans	-58	-50.2	172.8	-167.6	0	0	0	0	110.7	A269 S270 Q275 V276 D277	A269-S273 PolarHBondContact O-N 3.33Å; S270-S273 PolarHBondContact O-N 2.83Å; S273-Q275 PolarHBondContact O-N 3.22Å; S273-V276 WeakPolarHBondContact O-CA 3.43Å; S273-V276 WeakPolarHBondContact O-CB 3.35Å; S273-V276 PolarHBondContact O-N 3.24Å; S273-D277 PolarHBondContact O-N 2.98Å; S273-D277 VanDerWaalsContact O-OD2 3.09Å
274	R	97.1	Very high	94.9	Very high	126 Å²	126	95.7 Å²	95.7	48%	0.475	51%	0.51	S	S	.	.	H	α-helix	trans	-59.5	-32.9	179	-163	-165.8	64.6	68.3	5.5	112.9	S270 E271 V278	S270-R274 PolarHBondContact O-N 2.78Å; E271-R274 PolarHBondContact O-N 2.79Å; E271-R274 IonicContact OE1-CZ 3.68Å; E271-R274 IonicContact OE1-NE 3.49Å; E271-R274 IonicContact OE1-NH2 3.59Å; E271-R274 PolarHBondContact OE1-NH2 3.32Å; E271-R274 IonicContact OE2-CZ 2.65Å; E271-R274 VanDerWaalsContact OE2-CZ 3.25Å; E271-R274 IonicContact OE2-NE 3.65Å; E271-R274 PolarHBondContact OE2-NE 3.41Å; E271-R274 IonicContact OE2-NH2 3.29Å; E271-R274 PolarHBondContact OE2-NH2 2.87Å; R274-V278 WeakPolarHBondContact O-CG2 3.45Å; R274-V278 PolarHBondContact O-N 3.35Å
275	Q	94.8	Very high	94.8	Very high	94 Å²	94	94.6 Å²	94.6	44%	0.439	51%	0.512	S	S	.	.	H	α-helix	trans	-71.9	-34.6	173.2	-72.8	178.9	23.3	0	0	112.9	E271 L272 S273 S279	E271-Q275 WeakPolarHBondContact O-CG 3.31Å; E271-Q275 PolarHBondContact O-N 2.83Å; E271-Q275 PolarHBondContact OE1-NE2 3.04Å; L272-Q275 PolarHBondContact O-N 3.46Å; S273-Q275 PolarHBondContact O-N 3.22Å; Q275-S279 WeakPolarHBondContact O-CB 3.27Å; Q275-S279 PolarHBondContact O-N 2.84Å; Q275-S279 VanDerWaalsContact O-N 3.12Å; Q275-S279 PolarHBondContact O-OG 3.07Å
276	V	96.3	Very high	94.6	Very high	88 Å²	88	94.1 Å²	94.1	53%	0.533	51%	0.509	S	S	.	.	H	α-helix	trans	-65.5	-46.4	171.5	172.5	0	0	0	0	110.4	L272 S273 V278 S279 V280	L272-V276 WeakPolarHBondContact O-CG2 3.2Å; L272-V276 PolarHBondContact O-N 2.76Å; S273-V276 WeakPolarHBondContact O-CA 3.43Å; S273-V276 WeakPolarHBondContact O-CB 3.35Å; S273-V276 PolarHBondContact O-N 3.24Å; V276-V278 PolarHBondContact O-N 3.42Å; V276-S279 CarbonylContact O-C 3.56Å; V276-S279 WeakPolarHBondContact O-CA 3.39Å; V276-S279 WeakPolarHBondContact O-CB 3.18Å; V276-S279 PolarHBondContact O-N 3.14Å; V276-V280 HydrophobicContact CG1-CG2 4.35Å; V276-V280 WeakPolarHBondContact O-CG2 3.49Å; V276-V280 PolarHBondContact O-N 3.07Å
277	D	94.5	Very high	94.5	Very high	91 Å²	91	96.7 Å²	96.7	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-57.6	-50.7	-179.9	-61.7	-42.7	0	0	0	111.7	S273 S279 V280 E281	S273-D277 PolarHBondContact O-N 2.98Å; S273-D277 VanDerWaalsContact O-OD2 3.09Å; D277-S279 PolarHBondContact O-N 2.81Å; D277-V280 PolarHBondContact O-N 2.9Å; D277-V280 VanDerWaalsContact O-N 3.09Å; D277-E281 PolarHBondContact O-N 3.11Å
278	V	95.9	Very high	94.5	Very high	72 Å²	72	96.7 Å²	96.7	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-61.2	-32.7	175.3	172	0	0	0	0	112.1	R274 V276 L282	R274-V278 WeakPolarHBondContact O-CG2 3.45Å; R274-V278 PolarHBondContact O-N 3.35Å; V276-V278 PolarHBondContact O-N 3.42Å; V278-L282 WeakPolarHBondContact O-CB 3.29Å; V278-L282 PolarHBondContact O-N 3.49Å
279	S	87.3	Confident	94.5	Very high	74 Å²	74	93.8 Å²	93.8	52%	0.517	51%	0.514	S	S	.	.	H	α-helix	trans	-71.3	-34.7	175.7	-60.3	0	0	0	0	112.3	Q275 V276 D277 L283	Q275-S279 WeakPolarHBondContact O-CB 3.27Å; Q275-S279 PolarHBondContact O-N 2.84Å; Q275-S279 VanDerWaalsContact O-N 3.12Å; Q275-S279 PolarHBondContact O-OG 3.07Å; V276-S279 CarbonylContact O-C 3.56Å; V276-S279 WeakPolarHBondContact O-CA 3.39Å; V276-S279 WeakPolarHBondContact O-CB 3.18Å; V276-S279 PolarHBondContact O-N 3.14Å; D277-S279 PolarHBondContact O-N 2.81Å; S279-L283 WeakPolarHBondContact O-CB 3.27Å; S279-L283 PolarHBondContact O-N 2.63Å
280	V	96.3	Very high	94.4	Very high	88 Å²	88	96.5 Å²	96.5	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-69.8	-43.1	174.8	171.4	0	0	0	0	111	V276 D277 L282 L283 A284	V276-V280 HydrophobicContact CG1-CG2 4.35Å; V276-V280 WeakPolarHBondContact O-CG2 3.49Å; V276-V280 PolarHBondContact O-N 3.07Å; D277-V280 PolarHBondContact O-N 2.9Å; D277-V280 VanDerWaalsContact O-N 3.09Å; V280-L282 PolarHBondContact O-N 2.78Å; V280-L283 PolarHBondContact O-N 3.28Å; V280-A284 WeakPolarHBondContact O-CB 3.5Å; V280-A284 PolarHBondContact O-N 2.98Å
281	E	94.9	Very high	94.5	Very high	141 Å²	141	95.9 Å²	95.9	66%	0.659	51%	0.512	S	S	*	.	H	α-helix	trans	-59.8	-45.4	173.4	-70.6	-171.5	157.1	0	0	111.9	D277 L283 A284 S285	D277-E281 PolarHBondContact O-N 3.11Å; E281-L283 VanDerWaalsContact C-N 3.34Å; E281-L283 PolarHBondContact O-N 2.9Å; E281-A284 PolarHBondContact O-N 3.48Å; E281-S285 PolarHBondContact O-N 3.05Å
282	L	94.1	Very high	94.4	Very high	105 Å²	105	96.8 Å²	96.8	55%	0.55	52%	0.516	S	S	.	.	H	α-helix	trans	-62.6	-40.6	176.5	-178.9	60.2	0	0	0	111.7	V278 V280 S285 L286	V278-L282 WeakPolarHBondContact O-CB 3.29Å; V278-L282 PolarHBondContact O-N 3.49Å; V280-L282 PolarHBondContact O-N 2.78Å; L282-S285 PolarHBondContact O-N 3.03Å; L282-L286 HydrophobicContact CD1-CD1 4.32Å; L282-L286 HydrophobicContact CD1-CG 4.34Å; L282-L286 HydrophobicContact CG-CD1 4.08Å; L282-L286 WeakPolarHBondContact O-CB 3.46Å; L282-L286 VanDerWaalsContact O-CG 3.27Å; L282-L286 WeakPolarHBondContact O-CG 3.24Å; L282-L286 PolarHBondContact O-N 3.23Å
283	L	93.1	Very high	94.5	Very high	120 Å²	120	94.4 Å²	94.4	63%	0.628	50%	0.501	S	S	*	.	H	α-helix	trans	-65	-39.9	175.9	-177.6	62.4	0	0	0	112.1	S279 V280 E281 L286 K287	S279-L283 WeakPolarHBondContact O-CB 3.27Å; S279-L283 PolarHBondContact O-N 2.63Å; V280-L283 PolarHBondContact O-N 3.28Å; E281-L283 VanDerWaalsContact C-N 3.34Å; E281-L283 PolarHBondContact O-N 2.9Å; L283-L286 PolarHBondContact O-N 3.2Å; L283-K287 WeakPolarHBondContact O-CB 3.36Å; L283-K287 PolarHBondContact O-N 3.4Å
284	A	93.2	Very high	94.6	Very high	49 Å²	49	96.9 Å²	96.9	41%	0.405	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-43.9	175.2	0	0	0	0	0	111.7	V280 E281 K287 Q288	V280-A284 WeakPolarHBondContact O-CB 3.5Å; V280-A284 PolarHBondContact O-N 2.98Å; E281-A284 PolarHBondContact O-N 3.48Å; A284-K287 PolarHBondContact O-N 2.99Å; A284-Q288 WeakPolarHBondContact O-CG 3.27Å; A284-Q288 PolarHBondContact O-N 2.82Å; A284-Q288 VanDerWaalsContact O-N 3.09Å
285	S	94.1	Very high	94.5	Very high	65 Å²	65	96.9 Å²	96.9	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-59.9	-50.3	174.1	-178.8	0	0	0	0	111.9	E281 L282 K287 Q288 D289	E281-S285 PolarHBondContact O-N 3.05Å; L282-S285 PolarHBondContact O-N 3.03Å; S285-K287 VanDerWaalsContact C-N 3.28Å; S285-K287 PolarHBondContact O-N 3.15Å; S285-Q288 PolarHBondContact O-N 3.1Å; S285-Q288 VanDerWaalsContact O-N 3.13Å; S285-D289 PolarHBondContact O-N 3.18Å
286	L	91.9	Very high	94.6	Very high	99 Å²	99	95.5 Å²	95.5	52%	0.518	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-34.6	177.2	-72.1	170.1	0	0	0	112.8	L282 L283 L290	L282-L286 HydrophobicContact CD1-CD1 4.32Å; L282-L286 HydrophobicContact CD1-CG 4.34Å; L282-L286 HydrophobicContact CG-CD1 4.08Å; L282-L286 WeakPolarHBondContact O-CB 3.46Å; L282-L286 VanDerWaalsContact O-CG 3.27Å; L282-L286 WeakPolarHBondContact O-CG 3.24Å; L282-L286 PolarHBondContact O-N 3.23Å; L283-L286 PolarHBondContact O-N 3.2Å; L286-L290 WeakPolarHBondContact O-CB 3.41Å; L286-L290 PolarHBondContact O-N 3.12Å
287	K	93.8	Very high	94.5	Very high	153 Å²	153	96.9 Å²	96.9	67%	0.665	51%	0.508	S	S	*	.	H	α-helix	trans	-66.4	-42	174.8	-175.1	179	179	-179	0	112	L283 A284 S285 L290 V291	L283-K287 WeakPolarHBondContact O-CB 3.36Å; L283-K287 PolarHBondContact O-N 3.4Å; A284-K287 PolarHBondContact O-N 2.99Å; S285-K287 VanDerWaalsContact C-N 3.28Å; S285-K287 PolarHBondContact O-N 3.15Å; K287-L290 PolarHBondContact O-N 3.41Å; K287-V291 WeakPolarHBondContact O-CG2 3.42Å; K287-V291 PolarHBondContact O-N 3.11Å
288	Q	96.4	Very high	94.5	Very high	147 Å²	147	96 Å²	96	69%	0.687	51%	0.509	S	S	*	.	H	α-helix	trans	-64.6	-43.9	175	-68.6	176.5	7.8	0	0	111.5	A284 S285 L290 V291 H292	A284-Q288 WeakPolarHBondContact O-CG 3.27Å; A284-Q288 PolarHBondContact O-N 2.82Å; A284-Q288 VanDerWaalsContact O-N 3.09Å; S285-Q288 PolarHBondContact O-N 3.1Å; S285-Q288 VanDerWaalsContact O-N 3.13Å; Q288-L290 VanDerWaalsContact C-N 3.31Å; Q288-L290 PolarHBondContact O-N 2.86Å; Q288-V291 PolarHBondContact O-N 3.04Å; Q288-H292 WeakPolarHBondContact O-CB 3.38Å; Q288-H292 PolarHBondContact O-N 3.41Å
289	D	95.4	Very high	94.5	Very high	74 Å²	74	98.8 Å²	98.8	40%	0.396	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-37.6	179	-129.3	13.6	0	0	0	111.6	S285 H292 K293	S285-D289 PolarHBondContact O-N 3.18Å; D289-H292 PolarHBondContact O-N 2.86Å; D289-K293 WeakPolarHBondContact O-CB 3.33Å; D289-K293 WeakPolarHBondContact O-CG 3.44Å; D289-K293 PolarHBondContact O-N 2.73Å
290	L	94.3	Very high	94.9	Very high	114 Å²	114	99.2 Å²	99.2	60%	0.597	50%	0.504	S	S	*	.	H	α-helix	trans	-62	-52.6	174.5	-166.1	163.7	0	0	0	111.4	L286 K287 Q288 H292 K293 E294	L286-L290 WeakPolarHBondContact O-CB 3.41Å; L286-L290 PolarHBondContact O-N 3.12Å; K287-L290 PolarHBondContact O-N 3.41Å; Q288-L290 VanDerWaalsContact C-N 3.31Å; Q288-L290 PolarHBondContact O-N 2.86Å; L290-H292 VanDerWaalsContact C-N 3.29Å; L290-H292 PolarHBondContact O-N 3.17Å; L290-K293 PolarHBondContact O-N 2.98Å; L290-K293 VanDerWaalsContact O-N 3.08Å; L290-E294 PolarHBondContact O-N 2.75Å
291	V	96.8	Very high	94.8	Very high	67 Å²	67	100.5 Å²	100.5	41%	0.406	50%	0.504	S	S	.	.	H	α-helix	trans	-58.3	-42.4	178.1	172.4	0	0	0	0	111.1	K287 Q288 K293 E294 Q295	K287-V291 WeakPolarHBondContact O-CG2 3.42Å; K287-V291 PolarHBondContact O-N 3.11Å; Q288-V291 PolarHBondContact O-N 3.04Å; V291-K293 PolarHBondContact O-N 2.86Å; V291-E294 PolarHBondContact O-N 3.02Å; V291-Q295 WeakPolarHBondContact O-CG 3.45Å; V291-Q295 PolarHBondContact O-N 2.85Å
292	H	94.9	Very high	94.9	Very high	90 Å²	90	99.8 Å²	99.8	42%	0.417	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-38.2	176.6	176.6	49.7	0	0	0	112.5	Q288 D289 L290 Q295 E296	Q288-H292 WeakPolarHBondContact O-CB 3.38Å; Q288-H292 PolarHBondContact O-N 3.41Å; D289-H292 PolarHBondContact O-N 2.86Å; L290-H292 VanDerWaalsContact C-N 3.29Å; L290-H292 PolarHBondContact O-N 3.17Å; H292-Q295 PolarHBondContact O-N 3.36Å; H292-E296 PolarHBondContact O-N 3.13Å
293	K	95.5	Very high	94.9	Very high	59 Å²	59	97.9 Å²	97.9	26%	0.257	49%	0.489	S	S	.	.	H	α-helix	trans	-71.3	-30.9	176.3	-69.1	-76.4	149.3	-80.1	0	112.8	D289 L290 V291 E296 L297	D289-K293 WeakPolarHBondContact O-CB 3.33Å; D289-K293 WeakPolarHBondContact O-CG 3.44Å; D289-K293 PolarHBondContact O-N 2.73Å; L290-K293 PolarHBondContact O-N 2.98Å; L290-K293 VanDerWaalsContact O-N 3.08Å; V291-K293 PolarHBondContact O-N 2.86Å; K293-E296 WeakPolarHBondContact CE-OE2 3.44Å; K293-E296 IonicContact NZ-OE2 2.76Å; K293-E296 PolarHBondContact NZ-OE2 3.3Å; K293-E296 PolarHBondContact O-N 3.45Å; K293-L297 WeakPolarHBondContact O-CB 3.49Å; K293-L297 PolarHBondContact O-N 3.27Å
294	E	95.5	Very high	95	Very high	119 Å²	119	96.1 Å²	96.1	56%	0.556	48%	0.484	S	S	*	.	H	α-helix	trans	-67.2	-43.9	172.8	-174.6	162.4	-132.8	0	0	111.6	L290 V291 E296 L297 S298	L290-E294 PolarHBondContact O-N 2.75Å; V291-E294 PolarHBondContact O-N 3.02Å; E294-E296 PolarHBondContact O-N 2.9Å; E294-L297 PolarHBondContact O-N 3.17Å; E294-S298 PolarHBondContact O-N 2.65Å; E294-S298 PolarHBondContact O-OG 2.84Å
295	Q	96.3	Very high	95.1	Very high	125 Å²	125	98 Å²	98	58%	0.584	49%	0.489	S	S	*	.	H	α-helix	trans	-60	-43.4	171.5	-68.6	171.9	-0.6	0	0	112.4	V291 H292 L297 S298 R299	V291-Q295 WeakPolarHBondContact O-CG 3.45Å; V291-Q295 PolarHBondContact O-N 2.85Å; H292-Q295 PolarHBondContact O-N 3.36Å; Q295-L297 VanDerWaalsContact C-N 3.33Å; Q295-L297 PolarHBondContact O-N 3.35Å; Q295-S298 PolarHBondContact O-N 3.15Å; Q295-R299 PolarHBondContact O-N 3.19Å; Q295-R299 VanDerWaalsContact O-N 3.11Å
296	E	96.1	Very high	95.2	Very high	65 Å²	65	100.7 Å²	100.7	30%	0.304	50%	0.495	S	S	.	.	H	α-helix	trans	-60.9	-40.8	173.8	-77.8	-157.5	112.5	0	0	112.6	H292 K293 E294 R299 K300	H292-E296 PolarHBondContact O-N 3.13Å; K293-E296 WeakPolarHBondContact CE-OE2 3.44Å; K293-E296 IonicContact NZ-OE2 2.76Å; K293-E296 PolarHBondContact NZ-OE2 3.3Å; K293-E296 PolarHBondContact O-N 3.45Å; E294-E296 PolarHBondContact O-N 2.9Å; E296-R299 PolarHBondContact O-N 3.27Å; E296-R299 IonicContact OE1-NH2 3.17Å; E296-K300 WeakPolarHBondContact O-CG 3.2Å; E296-K300 PolarHBondContact O-N 3.31Å
297	L	93.9	Very high	95.3	Very high	118 Å²	118	100.7 Å²	100.7	62%	0.618	49%	0.494	S	S	*	.	H	α-helix	trans	-66.9	-44.7	179.9	-171.5	149.7	0	0	0	111.1	K293 E294 Q295 R299 K300 Q301	K293-L297 WeakPolarHBondContact O-CB 3.49Å; K293-L297 PolarHBondContact O-N 3.27Å; E294-L297 PolarHBondContact O-N 3.17Å; Q295-L297 VanDerWaalsContact C-N 3.33Å; Q295-L297 PolarHBondContact O-N 3.35Å; L297-R299 PolarHBondContact O-N 3.14Å; L297-K300 CarbonylContact O-C 3.59Å; L297-K300 PolarHBondContact O-N 3.09Å; L297-K300 VanDerWaalsContact O-N 3.11Å; L297-Q301 PolarHBondContact O-N 3.21Å
298	S	94.5	Very high	95.2	Very high	72 Å²	72	96.9 Å²	96.9	50%	0.503	48%	0.481	S	S	.	.	H	α-helix	trans	-57.7	-45.2	174.9	-66.9	0	0	0	0	112.2	E294 Q295 K300 Q301 Q302	E294-S298 PolarHBondContact O-N 2.65Å; E294-S298 PolarHBondContact O-OG 2.84Å; Q295-S298 PolarHBondContact O-N 3.15Å; S298-K300 PolarHBondContact O-N 3.29Å; S298-Q301 WeakPolarHBondContact O-CB 3.31Å; S298-Q301 PolarHBondContact O-N 2.88Å; S298-Q302 PolarHBondContact O-N 3.38Å; S298-Q302 VanDerWaalsContact O-N 3.08Å
299	R	97.2	Very high	95.2	Very high	131 Å²	131	94.4 Å²	94.4	49%	0.494	47%	0.47	S	S	.	.	H	α-helix	trans	-60.6	-43.8	172.9	-180	178.6	58.9	160.7	-5.2	112.1	Q295 E296 L297 Q301 Q302 E303	Q295-R299 PolarHBondContact O-N 3.19Å; Q295-R299 VanDerWaalsContact O-N 3.11Å; E296-R299 PolarHBondContact O-N 3.27Å; E296-R299 IonicContact OE1-NH2 3.17Å; L297-R299 PolarHBondContact O-N 3.14Å; R299-Q301 VanDerWaalsContact C-N 3.31Å; R299-Q301 PolarHBondContact O-N 3.3Å; R299-Q302 PolarHBondContact O-N 2.84Å; R299-E303 PolarHBondContact O-N 3.28Å
300	K	95.6	Very high	95.2	Very high	82 Å²	82	97.3 Å²	97.3	36%	0.357	48%	0.479	S	S	.	.	H	α-helix	trans	-68.3	-28.4	177.8	-69.3	-43.5	-172.3	-172.4	0	113.1	E296 L297 S298 E303 V304	E296-K300 WeakPolarHBondContact O-CG 3.2Å; E296-K300 PolarHBondContact O-N 3.31Å; L297-K300 CarbonylContact O-C 3.59Å; L297-K300 PolarHBondContact O-N 3.09Å; L297-K300 VanDerWaalsContact O-N 3.11Å; S298-K300 PolarHBondContact O-N 3.29Å; K300-E303 VanDerWaalsContact CD-CD 3.44Å; K300-E303 WeakPolarHBondContact CD-OE1 3.29Å; K300-E303 WeakPolarHBondContact CD-OE2 3.47Å; K300-E303 WeakPolarHBondContact CE-OE2 3.33Å; K300-E303 IonicContact NZ-OE1 3.83Å; K300-E303 PolarHBondContact NZ-OE1 3.31Å; K300-E303 IonicContact NZ-OE2 2.79Å; K300-E303 PolarHBondContact NZ-OE2 3.33Å; K300-V304 VanDerWaalsContact O-CG2 3.31Å; K300-V304 WeakPolarHBondContact O-CG2 3.26Å; K300-V304 PolarHBondContact O-N 2.79Å; K300-V304 VanDerWaalsContact O-N 3.12Å
301	Q	93.5	Very high	95.3	Very high	115 Å²	115	96.6 Å²	96.6	54%	0.537	48%	0.476	S	S	.	.	H	α-helix	trans	-66.7	-41.7	171.3	-171.8	59.8	31.8	0	0	111	L297 S298 R299 V304 V305	L297-Q301 PolarHBondContact O-N 3.21Å; S298-Q301 WeakPolarHBondContact O-CB 3.31Å; S298-Q301 PolarHBondContact O-N 2.88Å; R299-Q301 VanDerWaalsContact C-N 3.31Å; R299-Q301 PolarHBondContact O-N 3.3Å; Q301-V304 PolarHBondContact O-N 3.04Å; Q301-V305 WeakPolarHBondContact O-CG2 3.38Å; Q301-V305 PolarHBondContact O-N 3.05Å; Q301-V305 VanDerWaalsContact O-N 3.1Å
302	Q	96.1	Very high	95.1	Very high	127 Å²	127	98.8 Å²	98.8	59%	0.593	48%	0.48	S	S	*	.	H	α-helix	trans	-65.1	-42.2	176.2	-164.4	176.3	20.3	0	0	112.5	S298 R299 V304 V305 Q306	S298-Q302 PolarHBondContact O-N 3.38Å; S298-Q302 VanDerWaalsContact O-N 3.08Å; R299-Q302 PolarHBondContact O-N 2.84Å; Q302-V304 VanDerWaalsContact C-N 3.31Å; Q302-V304 PolarHBondContact O-N 3.11Å; Q302-V305 PolarHBondContact O-N 3.38Å; Q302-Q306 WeakPolarHBondContact O-CG 3.47Å; Q302-Q306 PolarHBondContact O-N 3.22Å; Q302-Q306 VanDerWaalsContact O-N 3.1Å
303	E	95.8	Very high	95.2	Very high	64 Å²	64	98.1 Å²	98.1	30%	0.299	48%	0.477	S	S	.	.	H	α-helix	trans	-58.6	-40.6	172.6	-72.7	174.2	-148	0	0	112.1	R299 K300 Q306 I307	R299-E303 PolarHBondContact O-N 3.28Å; K300-E303 VanDerWaalsContact CD-CD 3.44Å; K300-E303 WeakPolarHBondContact CD-OE1 3.29Å; K300-E303 WeakPolarHBondContact CD-OE2 3.47Å; K300-E303 WeakPolarHBondContact CE-OE2 3.33Å; K300-E303 IonicContact NZ-OE1 3.83Å; K300-E303 PolarHBondContact NZ-OE1 3.31Å; K300-E303 IonicContact NZ-OE2 2.79Å; K300-E303 PolarHBondContact NZ-OE2 3.33Å; E303-Q306 PolarHBondContact O-N 2.9Å; E303-I307 WeakPolarHBondContact O-CG1 3.4Å; E303-I307 PolarHBondContact O-N 3.3Å
304	V	94.2	Very high	95.2	Very high	84 Å²	84	98.1 Å²	98.1	51%	0.509	48%	0.481	S	S	.	.	H	α-helix	trans	-65.6	-39.9	177.9	166.9	0	0	0	0	111.8	K300 Q301 Q302 I307 D308	K300-V304 VanDerWaalsContact O-CG2 3.31Å; K300-V304 WeakPolarHBondContact O-CG2 3.26Å; K300-V304 PolarHBondContact O-N 2.79Å; K300-V304 VanDerWaalsContact O-N 3.12Å; Q301-V304 PolarHBondContact O-N 3.04Å; Q302-V304 VanDerWaalsContact C-N 3.31Å; Q302-V304 PolarHBondContact O-N 3.11Å; V304-I307 PolarHBondContact O-N 3.5Å; V304-D308 WeakPolarHBondContact O-CB 3.4Å; V304-D308 PolarHBondContact O-N 2.94Å
305	V	95.2	Very high	95.1	Very high	87 Å²	87	95 Å²	95	53%	0.527	48%	0.476	S	S	.	.	H	α-helix	trans	-63.9	-39.9	175.8	172.4	0	0	0	0	111.5	Q301 Q302 D308 Q309	Q301-V305 WeakPolarHBondContact O-CG2 3.38Å; Q301-V305 PolarHBondContact O-N 3.05Å; Q301-V305 VanDerWaalsContact O-N 3.1Å; Q302-V305 PolarHBondContact O-N 3.38Å; V305-D308 PolarHBondContact O-N 3.48Å; V305-Q309 PolarHBondContact O-N 3.33Å
306	Q	96.4	Very high	95.1	Very high	123 Å²	123	92 Å²	92	58%	0.575	47%	0.473	S	S	*	.	H	α-helix	trans	-63.7	-40.9	175.2	-69.8	172	-7.1	0	0	112.3	Q302 E303 F310	Q302-Q306 WeakPolarHBondContact O-CG 3.47Å; Q302-Q306 PolarHBondContact O-N 3.22Å; Q302-Q306 VanDerWaalsContact O-N 3.1Å; E303-Q306 PolarHBondContact O-N 2.9Å; Q306-F310 PolarHBondContact O-N 3.06Å
307	I	94.9	Very high	95	Very high	98 Å²	98	96.8 Å²	96.8	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-67.9	-41.6	177.5	-67.5	164.5	0	0	0	111.3	E303 V304 F310 L311	E303-I307 WeakPolarHBondContact O-CG1 3.4Å; E303-I307 PolarHBondContact O-N 3.3Å; V304-I307 PolarHBondContact O-N 3.5Å; I307-F310 PolarHBondContact O-N 3.22Å; I307-L311 HydrophobicContact CG2-CD1 3.99Å; I307-L311 HydrophobicContact CG2-CG 4.39Å; I307-L311 WeakPolarHBondContact O-CB 3.48Å; I307-L311 VanDerWaalsContact O-CG 3.3Å; I307-L311 WeakPolarHBondContact O-CG 3.42Å; I307-L311 PolarHBondContact O-N 2.78Å
308	D	90.4	Very high	95.1	Very high	73 Å²	73	96.2 Å²	96.2	39%	0.39	48%	0.483	S	S	.	.	H	α-helix	trans	-61.5	-42.8	176.1	176	62.9	0	0	0	111.9	V304 V305 L311 K312	V304-D308 WeakPolarHBondContact O-CB 3.4Å; V304-D308 PolarHBondContact O-N 2.94Å; V305-D308 PolarHBondContact O-N 3.48Å; D308-L311 PolarHBondContact O-N 3Å; D308-K312 WeakPolarHBondContact O-CG 3.32Å; D308-K312 PolarHBondContact O-N 3.05Å; D308-K312 WeakPolarHBondContact OD1-CE 3.45Å; D308-K312 IonicContact OD1-NZ 3.58Å; D308-K312 VanDerWaalsContact OD2-CE 3.23Å; D308-K312 WeakPolarHBondContact OD2-CE 3.42Å; D308-K312 IonicContact OD2-NZ 2.72Å; D308-K312 PolarHBondContact OD2-NZ 2.73Å
309	Q	96.5	Very high	95.1	Very high	96 Å²	96	95.2 Å²	95.2	45%	0.449	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-47.5	173.2	179.4	58.5	26.1	0	0	112.1	V305 L311 K312 E313	V305-Q309 PolarHBondContact O-N 3.33Å; Q309-L311 VanDerWaalsContact C-N 3.32Å; Q309-L311 PolarHBondContact O-N 2.95Å; Q309-K312 PolarHBondContact O-N 3.43Å; Q309-E313 PolarHBondContact NE2-OE1 3.17Å; Q309-E313 PolarHBondContact O-N 3.34Å
310	F	96.5	Very high	94.9	Very high	135 Å²	135	91.2 Å²	91.2	59%	0.592	47%	0.47	S	S	*	.	H	α-helix	trans	-60.7	-39	177.2	176.9	-95.6	0	0	0	112.7	Q306 I307 T314	Q306-F310 PolarHBondContact O-N 3.06Å; I307-F310 PolarHBondContact O-N 3.22Å; F310-T314 WeakPolarHBondContact O-CB 3.44Å; F310-T314 PolarHBondContact O-N 3.33Å; F310-T314 PolarHBondContact O-OG1 3Å
311	L	94.8	Very high	94.9	Very high	99 Å²	99	90 Å²	90	52%	0.518	48%	0.476	S	S	.	.	H	α-helix	trans	-67.3	-39.7	176.4	-72.2	172.1	0	0	0	112	I307 D308 Q309 T314 A315	I307-L311 HydrophobicContact CG2-CD1 3.99Å; I307-L311 HydrophobicContact CG2-CG 4.39Å; I307-L311 WeakPolarHBondContact O-CB 3.48Å; I307-L311 VanDerWaalsContact O-CG 3.3Å; I307-L311 WeakPolarHBondContact O-CG 3.42Å; I307-L311 PolarHBondContact O-N 2.78Å; D308-L311 PolarHBondContact O-N 3Å; Q309-L311 VanDerWaalsContact C-N 3.32Å; Q309-L311 PolarHBondContact O-N 2.95Å; L311-T314 PolarHBondContact O-N 3.38Å; L311-A315 WeakPolarHBondContact O-CB 3.26Å; L311-A315 PolarHBondContact O-N 3.4Å
312	K	94.3	Very high	94.8	Very high	113 Å²	113	90.4 Å²	90.4	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-61.8	-46.6	174.2	-74.7	163.9	175.4	169.5	0	111.9	D308 Q309 T314 A315 A316	D308-K312 WeakPolarHBondContact O-CG 3.32Å; D308-K312 PolarHBondContact O-N 3.05Å; D308-K312 WeakPolarHBondContact OD1-CE 3.45Å; D308-K312 IonicContact OD1-NZ 3.58Å; D308-K312 VanDerWaalsContact OD2-CE 3.23Å; D308-K312 WeakPolarHBondContact OD2-CE 3.42Å; D308-K312 IonicContact OD2-NZ 2.72Å; D308-K312 PolarHBondContact OD2-NZ 2.73Å; Q309-K312 PolarHBondContact O-N 3.43Å; K312-T314 PolarHBondContact O-N 3.48Å; K312-A315 PolarHBondContact O-N 2.74Å; K312-A316 WeakPolarHBondContact O-CB 3.34Å; K312-A316 PolarHBondContact O-N 3.44Å
313	E	96.4	Very high	94.8	Very high	76 Å²	76	89.4 Å²	89.4	36%	0.355	47%	0.474	S	S	.	.	H	α-helix	trans	-63.4	-40.5	175.7	-73.9	-179.5	-142.3	0	0	112.5	Q309 A316 R317	Q309-E313 PolarHBondContact NE2-OE1 3.17Å; Q309-E313 PolarHBondContact O-N 3.34Å; E313-A316 PolarHBondContact O-N 2.99Å; E313-R317 VanDerWaalsContact O-CG 3.27Å; E313-R317 WeakPolarHBondContact O-CG 3.41Å; E313-R317 PolarHBondContact O-N 2.87Å; E313-R317 IonicContact OE2-NH2 3.16Å; E313-R317 PolarHBondContact OE2-NH2 3.48Å
314	T	95.9	Very high	94.8	Very high	58 Å²	58	94.7 Å²	94.7	36%	0.356	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-45.3	177.1	-58.7	0	0	0	0	111.1	F310 L311 K312 A316 R317 E318	F310-T314 WeakPolarHBondContact O-CB 3.44Å; F310-T314 PolarHBondContact O-N 3.33Å; F310-T314 PolarHBondContact O-OG1 3Å; L311-T314 PolarHBondContact O-N 3.38Å; K312-T314 PolarHBondContact O-N 3.48Å; T314-A316 PolarHBondContact O-N 3.45Å; T314-R317 PolarHBondContact O-N 3.27Å; T314-E318 PolarHBondContact O-N 3.17Å
315	A	93.5	Very high	94.8	Very high	54 Å²	54	95.6 Å²	95.6	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-64.3	-38.8	176.8	0	0	0	0	0	112.5	L311 K312 E318 A319	L311-A315 WeakPolarHBondContact O-CB 3.26Å; L311-A315 PolarHBondContact O-N 3.4Å; K312-A315 PolarHBondContact O-N 2.74Å; A315-E318 PolarHBondContact O-N 3.41Å; A315-A319 WeakPolarHBondContact O-CB 3.33Å; A315-A319 PolarHBondContact O-N 3.43Å
316	A	94.6	Very high	94.7	Very high	63 Å²	63	96.3 Å²	96.3	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-40.9	174.4	0	0	0	0	0	112.1	K312 E313 T314 A319 S320	K312-A316 WeakPolarHBondContact O-CB 3.34Å; K312-A316 PolarHBondContact O-N 3.44Å; E313-A316 PolarHBondContact O-N 2.99Å; T314-A316 PolarHBondContact O-N 3.45Å; A316-A319 PolarHBondContact O-N 2.95Å; A316-S320 WeakPolarHBondContact O-CB 3.42Å; A316-S320 PolarHBondContact O-N 3.02Å
317	R	95.3	Very high	94.6	Very high	165 Å²	165	95.9 Å²	95.9	62%	0.623	49%	0.488	S	S	*	.	H	α-helix	trans	-63.7	-45.6	174.1	-69.3	171.5	-158.8	-161.9	9.5	111.2	E313 T314 A319 S320 A321	E313-R317 VanDerWaalsContact O-CG 3.27Å; E313-R317 WeakPolarHBondContact O-CG 3.41Å; E313-R317 PolarHBondContact O-N 2.87Å; E313-R317 IonicContact OE2-NH2 3.16Å; E313-R317 PolarHBondContact OE2-NH2 3.48Å; T314-R317 PolarHBondContact O-N 3.27Å; R317-A319 PolarHBondContact O-N 3.16Å; R317-S320 PolarHBondContact O-N 3.43Å; R317-S320 PolarHBondContact O-OG 2.71Å; R317-A321 PolarHBondContact O-N 3.29Å
318	E	95.6	Very high	94.5	Very high	106 Å²	106	96.3 Å²	96.3	50%	0.495	49%	0.487	S	S	.	.	H	α-helix	trans	-59.6	-45.5	176.8	-168.4	-166.7	140	0	0	111.9	T314 A315 S320 A321 K322	T314-E318 PolarHBondContact O-N 3.17Å; A315-E318 PolarHBondContact O-N 3.41Å; E318-S320 VanDerWaalsContact C-N 3.35Å; E318-S320 PolarHBondContact O-N 2.77Å; E318-A321 PolarHBondContact O-N 2.72Å; E318-K322 HydrophobicContact CG-CD 4.47Å; E318-K322 WeakPolarHBondContact O-CG 3.38Å; E318-K322 PolarHBondContact O-N 3.31Å; E318-K322 VanDerWaalsContact OE1-CE 3.3Å; E318-K322 WeakPolarHBondContact OE1-CE 3.49Å; E318-K322 IonicContact OE1-NZ 3.16Å; E318-K322 PolarHBondContact OE1-NZ 3.47Å
319	A	93.6	Very high	94.6	Very high	50 Å²	50	96.7 Å²	96.7	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-61	-42.4	175.1	0	0	0	0	0	111.9	A315 A316 R317 A321 K322 L323	A315-A319 WeakPolarHBondContact O-CB 3.33Å; A315-A319 PolarHBondContact O-N 3.43Å; A316-A319 PolarHBondContact O-N 2.95Å; R317-A319 PolarHBondContact O-N 3.16Å; A319-A321 VanDerWaalsContact C-N 3.31Å; A319-A321 PolarHBondContact O-N 3.39Å; A319-K322 PolarHBondContact O-N 3.05Å; A319-L323 WeakPolarHBondContact O-CG 3.44Å; A319-L323 PolarHBondContact O-N 2.82Å; A319-L323 VanDerWaalsContact O-N 3.07Å
320	S	94.4	Very high	94.5	Very high	47 Å²	47	96.6 Å²	96.6	33%	0.329	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-32.8	177.2	82	0	0	0	0	113	A316 R317 E318 R324	A316-S320 WeakPolarHBondContact O-CB 3.42Å; A316-S320 PolarHBondContact O-N 3.02Å; R317-S320 PolarHBondContact O-N 3.43Å; R317-S320 PolarHBondContact O-OG 2.71Å; E318-S320 VanDerWaalsContact C-N 3.35Å; E318-S320 PolarHBondContact O-N 2.77Å; S320-R324 WeakPolarHBondContact O-CG 3.25Å; S320-R324 PolarHBondContact O-N 2.96Å
321	A	94.1	Very high	94.5	Very high	57 Å²	57	95.3 Å²	95.3	47%	0.471	48%	0.483	S	S	.	.	H	α-helix	trans	-72.6	-40.2	175.6	0	0	0	0	0	111.9	R317 E318 A319 L323 R324 L325	R317-A321 PolarHBondContact O-N 3.29Å; E318-A321 PolarHBondContact O-N 2.72Å; A319-A321 VanDerWaalsContact C-N 3.31Å; A319-A321 PolarHBondContact O-N 3.39Å; A321-L323 PolarHBondContact O-N 3.26Å; A321-R324 PolarHBondContact O-N 3.34Å; A321-L325 PolarHBondContact O-N 3.1Å
322	K	93.2	Very high	94.5	Very high	124 Å²	124	94.2 Å²	94.2	54%	0.539	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-41.8	174.8	-76.6	171.8	170.3	173	0	112.5	E318 A319 L325 Q326	E318-K322 HydrophobicContact CG-CD 4.47Å; E318-K322 WeakPolarHBondContact O-CG 3.38Å; E318-K322 PolarHBondContact O-N 3.31Å; E318-K322 VanDerWaalsContact OE1-CE 3.3Å; E318-K322 WeakPolarHBondContact OE1-CE 3.49Å; E318-K322 IonicContact OE1-NZ 3.16Å; E318-K322 PolarHBondContact OE1-NZ 3.47Å; A319-K322 PolarHBondContact O-N 3.05Å; K322-L325 PolarHBondContact O-N 2.92Å; K322-Q326 PolarHBondContact O-N 3.21Å
323	L	95.3	Very high	94.4	Very high	105 Å²	105	94.2 Å²	94.2	55%	0.55	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-43.5	176.3	-73.6	168.7	0	0	0	112.4	A319 A321 L325 Q326 Q327	A319-L323 WeakPolarHBondContact O-CG 3.44Å; A319-L323 PolarHBondContact O-N 2.82Å; A319-L323 VanDerWaalsContact O-N 3.07Å; A321-L323 PolarHBondContact O-N 3.26Å; L323-L325 PolarHBondContact O-N 2.86Å; L323-Q326 PolarHBondContact O-N 2.95Å; L323-Q327 WeakPolarHBondContact O-CG 3.42Å; L323-Q327 PolarHBondContact O-N 3.18Å
324	R	94.8	Very high	94.3	Very high	175 Å²	175	95.7 Å²	95.7	66%	0.66	49%	0.489	S	S	*	.	H	α-helix	trans	-63.7	-40.2	175.1	-64.9	175.6	-155	-171.7	4.6	112.4	S320 A321 Q327 F328	S320-R324 WeakPolarHBondContact O-CG 3.25Å; S320-R324 PolarHBondContact O-N 2.96Å; A321-R324 PolarHBondContact O-N 3.34Å; R324-Q327 PolarHBondContact O-N 2.85Å; R324-F328 PolarHBondContact O-N 3.46Å
325	L	94.6	Very high	94.2	Very high	104 Å²	104	98.6 Å²	98.6	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-66.2	-39.4	177.4	-178.1	61.1	0	0	0	111.5	A321 K322 L323 F328 I329	A321-L325 PolarHBondContact O-N 3.1Å; K322-L325 PolarHBondContact O-N 2.92Å; L323-L325 PolarHBondContact O-N 2.86Å; L325-F328 PolarHBondContact O-N 3.26Å; L325-I329 HydrophobicContact CD1-CD1 4.26Å; L325-I329 HydrophobicContact CG-CD1 4.03Å; L325-I329 VanDerWaalsContact O-CG1 3.28Å; L325-I329 WeakPolarHBondContact O-CG1 3.49Å; L325-I329 PolarHBondContact O-N 2.88Å
326	Q	92.4	Very high	94.1	Very high	102 Å²	102	98.7 Å²	98.7	48%	0.477	50%	0.495	S	S	.	.	H	α-helix	trans	-60.3	-50.1	173.6	177.7	177	-12.9	0	0	111.2	K322 L323 F328 I329 E330	K322-Q326 PolarHBondContact O-N 3.21Å; L323-Q326 PolarHBondContact O-N 2.95Å; Q326-F328 VanDerWaalsContact C-N 3.31Å; Q326-F328 PolarHBondContact O-N 3.49Å; Q326-I329 PolarHBondContact O-N 2.96Å; Q326-I329 VanDerWaalsContact O-N 3.09Å; Q326-E330 HydrophobicContact CG-CG 4.47Å; Q326-E330 VanDerWaalsContact CG-OE1 3.22Å; Q326-E330 WeakPolarHBondContact CG-OE1 3.41Å; Q326-E330 PolarHBondContact NE2-OE1 3.27Å; Q326-E330 WeakPolarHBondContact O-CG 3.27Å; Q326-E330 PolarHBondContact O-N 3.33Å
327	Q	94.9	Very high	94	Very high	114 Å²	114	99 Å²	99	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-56.2	-44.3	177	-71.6	169.8	-31.4	0	0	112	L323 R324 I329 E330 E331	L323-Q327 WeakPolarHBondContact O-CG 3.42Å; L323-Q327 PolarHBondContact O-N 3.18Å; R324-Q327 PolarHBondContact O-N 2.85Å; Q327-I329 VanDerWaalsContact C-N 3.34Å; Q327-I329 PolarHBondContact O-N 3.07Å; Q327-E330 PolarHBondContact O-N 3.22Å; Q327-E331 WeakPolarHBondContact O-CG 3.32Å; Q327-E331 PolarHBondContact O-N 2.87Å
328	F	93.5	Very high	93.7	Very high	107 Å²	107	97 Å²	97	47%	0.469	48%	0.48	S	S	.	.	H	α-helix	trans	-65.4	-33.8	177.3	-179.4	-107.3	0	0	0	113.5	R324 L325 Q326 L332	R324-F328 PolarHBondContact O-N 3.46Å; L325-F328 PolarHBondContact O-N 3.26Å; Q326-F328 VanDerWaalsContact C-N 3.31Å; Q326-F328 PolarHBondContact O-N 3.49Å; F328-L332 HydrophobicContact CD1-CD1 3.9Å; F328-L332 HydrophobicContact CE1-CD1 3.48Å; F328-L332 VanDerWaalsContact CE1-CD1 3.48Å; F328-L332 HydrophobicContact CE1-CG 4.28Å; F328-L332 HydrophobicContact CZ-CD1 3.92Å; F328-L332 HydrophobicContact CZ-CG 4.31Å; F328-L332 WeakPolarHBondContact O-CB 3.44Å; F328-L332 WeakPolarHBondContact O-CG 3.48Å; F328-L332 PolarHBondContact O-N 3.03Å
329	I	93.3	Very high	93.4	Very high	80 Å²	80	94 Å²	94	41%	0.41	47%	0.474	S	S	.	.	H	α-helix	trans	-69.9	-41.8	173.9	-70	165.2	0	0	0	110.4	L325 Q326 Q327 L332 L333	L325-I329 HydrophobicContact CD1-CD1 4.26Å; L325-I329 HydrophobicContact CG-CD1 4.03Å; L325-I329 VanDerWaalsContact O-CG1 3.28Å; L325-I329 WeakPolarHBondContact O-CG1 3.49Å; L325-I329 PolarHBondContact O-N 2.88Å; Q326-I329 PolarHBondContact O-N 2.96Å; Q326-I329 VanDerWaalsContact O-N 3.09Å; Q327-I329 VanDerWaalsContact C-N 3.34Å; Q327-I329 PolarHBondContact O-N 3.07Å; I329-L332 WeakPolarHBondContact O-CB 2.87Å; I329-L332 PolarHBondContact O-N 3.03Å; I329-L332 VanDerWaalsContact O-N 3.16Å; I329-L333 HydrophobicContact CG2-CD1 3.97Å; I329-L333 HydrophobicContact CG2-CG 4.4Å; I329-L333 WeakPolarHBondContact O-CG 3.4Å; I329-L333 PolarHBondContact O-N 3.28Å
330	E	93.9	Very high	93.2	Very high	95 Å²	95	97 Å²	97	44%	0.444	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-45.3	175.2	-70.6	165	179.6	0	0	110.9	Q326 Q327 L332 L333 E334	Q326-E330 HydrophobicContact CG-CG 4.47Å; Q326-E330 VanDerWaalsContact CG-OE1 3.22Å; Q326-E330 WeakPolarHBondContact CG-OE1 3.41Å; Q326-E330 PolarHBondContact NE2-OE1 3.27Å; Q326-E330 WeakPolarHBondContact O-CG 3.27Å; Q326-E330 PolarHBondContact O-N 3.33Å; Q327-E330 PolarHBondContact O-N 3.22Å; E330-L332 VanDerWaalsContact C-N 3.3Å; E330-L332 PolarHBondContact O-N 3.03Å; E330-L333 PolarHBondContact O-N 3.28Å; E330-E334 PolarHBondContact O-N 2.83Å
331	E	95.4	Very high	92.9	Very high	107 Å²	107	101.5 Å²	101.5	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-29.5	172.5	-74.9	179.3	-170.3	0	0	114.3	Q327 R335	Q327-E331 WeakPolarHBondContact O-CG 3.32Å; Q327-E331 PolarHBondContact O-N 2.87Å; E331-R335 WeakPolarHBondContact O-CG 3.41Å; E331-R335 PolarHBondContact O-N 3.05Å; E331-R335 PolarHBondContact O-NE 3.48Å
332	L	95.1	Very high	92.4	Very high	76 Å²	76	105.1 Å²	105.1	40%	0.398	50%	0.496	S	S	.	.	H	α-helix	trans	-74.3	-44.7	174.1	-84.2	169.8	0	0	0	111.3	F328 I329 E330 R335 A336	F328-L332 HydrophobicContact CD1-CD1 3.9Å; F328-L332 HydrophobicContact CE1-CD1 3.48Å; F328-L332 VanDerWaalsContact CE1-CD1 3.48Å; F328-L332 HydrophobicContact CE1-CG 4.28Å; F328-L332 HydrophobicContact CZ-CD1 3.92Å; F328-L332 HydrophobicContact CZ-CG 4.31Å; F328-L332 WeakPolarHBondContact O-CB 3.44Å; F328-L332 WeakPolarHBondContact O-CG 3.48Å; F328-L332 PolarHBondContact O-N 3.03Å; I329-L332 WeakPolarHBondContact O-CB 2.87Å; I329-L332 PolarHBondContact O-N 3.03Å; I329-L332 VanDerWaalsContact O-N 3.16Å; E330-L332 VanDerWaalsContact C-N 3.3Å; E330-L332 PolarHBondContact O-N 3.03Å; L332-R335 PolarHBondContact O-N 3.43Å; L332-A336 PolarHBondContact O-N 2.9Å
333	L	92.4	Very high	91.6	Very high	114 Å²	114	104.6 Å²	104.6	60%	0.597	50%	0.499	S	S	*	.	H	α-helix	trans	-63.4	-42.6	178.4	-70.1	169.6	0	0	0	111.4	I329 E330 R335 A336 D337	I329-L333 HydrophobicContact CG2-CD1 3.97Å; I329-L333 HydrophobicContact CG2-CG 4.4Å; I329-L333 WeakPolarHBondContact O-CG 3.4Å; I329-L333 PolarHBondContact O-N 3.28Å; E330-L333 PolarHBondContact O-N 3.28Å; L333-R335 VanDerWaalsContact C-N 3.32Å; L333-R335 PolarHBondContact O-N 3.41Å; L333-A336 PolarHBondContact O-N 3.4Å; L333-D337 PolarHBondContact O-N 2.85Å
334	E	94.6	Very high	90.8	Very high	107 Å²	107	104.5 Å²	104.5	50%	0.5	50%	0.495	S	S	.	.	H	α-helix	trans	-60.1	-39.5	172.4	-78.8	-161.3	178.1	0	0	113.1	E330 A336 R338	E330-E334 PolarHBondContact O-N 2.83Å; E334-A336 VanDerWaalsContact C-N 3.34Å; E334-R338 WeakPolarHBondContact O-CB 3.26Å; E334-R338 WeakPolarHBondContact O-CG 3.41Å; E334-R338 PolarHBondContact O-N 2.68Å; E334-R338 IonicContact OE2-CZ 3.65Å; E334-R338 VanDerWaalsContact OE2-CZ 3.3Å; E334-R338 IonicContact OE2-NH1 2.66Å; E334-R338 PolarHBondContact OE2-NH1 3.37Å; E334-R338 IonicContact OE2-NH2 3.89Å; E334-R338 PolarHBondContact OE2-NH2 2.83Å
335	R	94.4	Very high	90	Very high	118 Å²	118	100.9 Å²	100.9	45%	0.445	49%	0.492	S	S	.	.	H	α-helix	trans	-68	-36.1	177.5	-81	179.3	-74.3	164.1	-8.7	111.6	E331 L332 L333 A339	E331-R335 WeakPolarHBondContact O-CG 3.41Å; E331-R335 PolarHBondContact O-N 3.05Å; E331-R335 PolarHBondContact O-NE 3.48Å; L332-R335 PolarHBondContact O-N 3.43Å; L333-R335 VanDerWaalsContact C-N 3.32Å; L333-R335 PolarHBondContact O-N 3.41Å; R335-A339 WeakPolarHBondContact O-CB 3.36Å; R335-A339 PolarHBondContact O-N 2.82Å
336	A	90.3	Very high	89.1	Confident	57 Å²	57	100.6 Å²	100.6	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-49.4	173.5	0	0	0	0	0	111.6	L332 L333 E334 R338 A339 E340	L332-A336 PolarHBondContact O-N 2.9Å; L333-A336 PolarHBondContact O-N 3.4Å; E334-A336 VanDerWaalsContact C-N 3.34Å; A336-R338 VanDerWaalsContact C-N 3.34Å; A336-R338 PolarHBondContact O-N 2.7Å; A336-A339 PolarHBondContact O-N 3.04Å; A336-A339 VanDerWaalsContact O-N 3.14Å; A336-E340 PolarHBondContact O-N 3.18Å
337	D	92.3	Very high	87.9	Confident	68 Å²	68	99.8 Å²	99.8	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-59.2	-41.5	176.5	170.6	77.1	0	0	0	112.1	L333 E340 R341	L333-D337 PolarHBondContact O-N 2.85Å; D337-E340 PolarHBondContact O-N 3.23Å; D337-R341 VanDerWaalsContact CG-NE 3.26Å; D337-R341 VanDerWaalsContact O-CG 3.28Å; D337-R341 WeakPolarHBondContact O-CG 3.5Å; D337-R341 PolarHBondContact O-N 2.78Å; D337-R341 IonicContact OD1-CZ 2.63Å; D337-R341 VanDerWaalsContact OD1-CZ 3.31Å; D337-R341 IonicContact OD1-NE 3.19Å; D337-R341 PolarHBondContact OD1-NE 2.92Å; D337-R341 VanDerWaalsContact OD1-NE 3.14Å; D337-R341 IonicContact OD1-NH2 3.17Å; D337-R341 PolarHBondContact OD1-NH2 2.99Å; D337-R341 IonicContact OD2-CZ 2.73Å; D337-R341 IonicContact OD2-NE 2.67Å; D337-R341 PolarHBondContact OD2-NE 3.33Å; D337-R341 IonicContact OD2-NH2 2.74Å; D337-R341 PolarHBondContact OD2-NH2 3.2Å
338	R	90.6	Very high	86.3	Confident	123 Å²	123	98.9 Å²	98.9	46%	0.464	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-44.2	173.4	-76.3	-173	-76.6	-95.2	4.8	112.6	E334 A336 Q342	E334-R338 WeakPolarHBondContact O-CB 3.26Å; E334-R338 WeakPolarHBondContact O-CG 3.41Å; E334-R338 PolarHBondContact O-N 2.68Å; E334-R338 IonicContact OE2-CZ 3.65Å; E334-R338 VanDerWaalsContact OE2-CZ 3.3Å; E334-R338 IonicContact OE2-NH1 2.66Å; E334-R338 PolarHBondContact OE2-NH1 3.37Å; E334-R338 IonicContact OE2-NH2 3.89Å; E334-R338 PolarHBondContact OE2-NH2 2.83Å; A336-R338 VanDerWaalsContact C-N 3.34Å; A336-R338 PolarHBondContact O-N 2.7Å; R338-Q342 WeakPolarHBondContact O-CG 3.33Å; R338-Q342 PolarHBondContact O-N 3.33Å
339	A	88.5	Confident	84.7	Confident	45 Å²	45	97.9 Å²	97.9	37%	0.372	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-39.1	177.8	0	0	0	0	0	112.1	R335 A336 Q342 L343	R335-A339 WeakPolarHBondContact O-CB 3.36Å; R335-A339 PolarHBondContact O-N 2.82Å; A336-A339 PolarHBondContact O-N 3.04Å; A336-A339 VanDerWaalsContact O-N 3.14Å; A339-Q342 PolarHBondContact O-N 3.29Å; A339-L343 WeakPolarHBondContact O-CG 3.44Å; A339-L343 PolarHBondContact O-N 3.45Å
340	E	88.2	Confident	82.7	Confident	112 Å²	112	99.3 Å²	99.3	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-44.2	177.3	-162.1	-171.8	147.9	0	0	111.3	A336 D337 Q342 L343 Q344	A336-E340 PolarHBondContact O-N 3.18Å; D337-E340 PolarHBondContact O-N 3.23Å; E340-Q342 VanDerWaalsContact C-N 3.28Å; E340-Q342 PolarHBondContact O-N 2.85Å; E340-L343 CarbonylContact O-C 3.25Å; E340-L343 WeakPolarHBondContact O-CB 3.33Å; E340-L343 PolarHBondContact O-N 2.92Å; E340-L343 VanDerWaalsContact O-N 3.08Å; E340-Q344 WeakPolarHBondContact O-CG 3.19Å; E340-Q344 PolarHBondContact O-N 3.5Å; E340-Q344 PolarHBondContact OE1-NE2 3.25Å
341	R	88.4	Confident	80.5	Confident	142 Å²	142	98 Å²	98	54%	0.536	54%	0.537	S	S	.	.	H	α-helix	trans	-57.6	-39.8	173	-69.6	172	-157.1	-103.3	-1.9	112.2	D337 Q344 V345	D337-R341 VanDerWaalsContact CG-NE 3.26Å; D337-R341 VanDerWaalsContact O-CG 3.28Å; D337-R341 WeakPolarHBondContact O-CG 3.5Å; D337-R341 PolarHBondContact O-N 2.78Å; D337-R341 IonicContact OD1-CZ 2.63Å; D337-R341 VanDerWaalsContact OD1-CZ 3.31Å; D337-R341 IonicContact OD1-NE 3.19Å; D337-R341 PolarHBondContact OD1-NE 2.92Å; D337-R341 VanDerWaalsContact OD1-NE 3.14Å; D337-R341 IonicContact OD1-NH2 3.17Å; D337-R341 PolarHBondContact OD1-NH2 2.99Å; D337-R341 IonicContact OD2-CZ 2.73Å; D337-R341 IonicContact OD2-NE 2.67Å; D337-R341 PolarHBondContact OD2-NE 3.33Å; D337-R341 IonicContact OD2-NH2 2.74Å; D337-R341 PolarHBondContact OD2-NH2 3.2Å; R341-Q344 PolarHBondContact O-N 3.22Å; R341-V345 WeakPolarHBondContact O-CG2 3.18Å; R341-V345 PolarHBondContact O-N 3.46Å
342	Q	84.1	Confident	78.2	Confident	133 Å²	133	98 Å²	98	62%	0.621	55%	0.548	S	S	*	.	H	α-helix	trans	-65.6	-40.4	175	-70.7	-178.1	-60.3	0	0	112	R338 A339 E340 Q344 V345 I346	R338-Q342 WeakPolarHBondContact O-CG 3.33Å; R338-Q342 PolarHBondContact O-N 3.33Å; A339-Q342 PolarHBondContact O-N 3.29Å; E340-Q342 VanDerWaalsContact C-N 3.28Å; E340-Q342 PolarHBondContact O-N 2.85Å; Q342-Q344 VanDerWaalsContact C-N 3.34Å; Q342-Q344 PolarHBondContact O-N 3.29Å; Q342-V345 PolarHBondContact O-N 3.48Å; Q342-I346 WeakPolarHBondContact O-CG1 3.4Å; Q342-I346 PolarHBondContact O-N 2.95Å
343	L	76.3	Confident	75.8	Confident	113 Å²	113	101.2 Å²	101.2	59%	0.592	57%	0.572	S	S	*	*	H	α-helix	trans	-65.7	-34.6	174.1	-70.1	170.1	0	0	0	112.6	A339 E340 I346 S347	A339-L343 WeakPolarHBondContact O-CG 3.44Å; A339-L343 PolarHBondContact O-N 3.45Å; E340-L343 CarbonylContact O-C 3.25Å; E340-L343 WeakPolarHBondContact O-CB 3.33Å; E340-L343 PolarHBondContact O-N 2.92Å; E340-L343 VanDerWaalsContact O-N 3.08Å; L343-I346 PolarHBondContact O-N 3.33Å; L343-S347 WeakPolarHBondContact O-CB 3.27Å; L343-S347 PolarHBondContact O-N 3.45Å; L343-S347 PolarHBondContact O-OG 2.95Å; L343-S347 VanDerWaalsContact O-OG 3.13Å
344	Q	77.9	Confident	73.8	Confident	103 Å²	103	102 Å²	102	48%	0.481	58%	0.583	S	S	.	*	H	α-helix	trans	-67.9	-33.1	173.4	-68.2	172.3	11.7	0	0	112.3	E340 R341 Q342 S347 S348	E340-Q344 WeakPolarHBondContact O-CG 3.19Å; E340-Q344 PolarHBondContact O-N 3.5Å; E340-Q344 PolarHBondContact OE1-NE2 3.25Å; R341-Q344 PolarHBondContact O-N 3.22Å; Q342-Q344 VanDerWaalsContact C-N 3.34Å; Q342-Q344 PolarHBondContact O-N 3.29Å; Q344-S347 PolarHBondContact O-OG 3.14Å; Q344-S348 WeakPolarHBondContact O-CB 3.36Å; Q344-S348 PolarHBondContact O-N 3.03Å; Q344-S348 PolarHBondContact O-OG 3.06Å
345	V	78.9	Confident	71	Confident	98 Å²	98	102.9 Å²	102.9	59%	0.594	60%	0.601	S	S	*	*	H	α-helix	trans	-71.4	-36.6	171.5	171.5	0	0	0	0	112	R341 Q342 S348 S349	R341-V345 WeakPolarHBondContact O-CG2 3.18Å; R341-V345 PolarHBondContact O-N 3.46Å; Q342-V345 PolarHBondContact O-N 3.48Å; V345-S348 WeakPolarHBondContact CA-OG 3.33Å; V345-S348 PolarHBondContact O-OG 2.9Å; V345-S349 PolarHBondContact O-N 3.16Å; V345-S349 PolarHBondContact O-OG 3.03Å
346	I	75.1	Confident	68.1	Low	98 Å²	98	101.6 Å²	101.6	50%	0.503	62%	0.616	S	S	.	*	H	α-helix	trans	-72.7	-41.9	177.4	-66.9	164.4	0	0	0	111.3	Q342 L343 S348 S349 C350	Q342-I346 WeakPolarHBondContact O-CG1 3.4Å; Q342-I346 PolarHBondContact O-N 2.95Å; L343-I346 PolarHBondContact O-N 3.33Å; I346-S348 VanDerWaalsContact C-N 3.33Å; I346-S348 PolarHBondContact O-N 3.08Å; I346-S349 WeakPolarHBondContact CA-OG 3.29Å; I346-S349 PolarHBondContact O-N 2.67Å; I346-S349 PolarHBondContact O-OG 3.08Å; I346-S349 VanDerWaalsContact O-OG 3.05Å; I346-C350 PolarHBondContact O-N 3.3Å
347	S	67.1	Low	65.7	Low	86 Å²	86	104 Å²	104	60%	0.601	63%	0.629	S	S	*	*	H	α-helix	trans	-68.5	-31.6	178.7	64.6	0	0	0	0	113	L343 Q344 S349	L343-S347 WeakPolarHBondContact O-CB 3.27Å; L343-S347 PolarHBondContact O-N 3.45Å; L343-S347 PolarHBondContact O-OG 2.95Å; L343-S347 VanDerWaalsContact O-OG 3.13Å; Q344-S347 PolarHBondContact O-OG 3.14Å; S347-S349 VanDerWaalsContact C-N 3.31Å; S347-S349 PolarHBondContact O-N 3.1Å
348	S	62.1	Low	63.1	Low	95 Å²	95	109.5 Å²	109.5	66%	0.664	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-9.9	174.5	52.7	0	0	0	0	114.6	Q344 V345 I346	Q344-S348 WeakPolarHBondContact O-CB 3.36Å; Q344-S348 PolarHBondContact O-N 3.03Å; Q344-S348 PolarHBondContact O-OG 3.06Å; V345-S348 WeakPolarHBondContact CA-OG 3.33Å; V345-S348 PolarHBondContact O-OG 2.9Å; I346-S348 VanDerWaalsContact C-N 3.33Å; I346-S348 PolarHBondContact O-N 3.08Å
349	S	59.8	Low	60.4	Low	86 Å²	86	106.7 Å²	106.7	60%	0.601	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-18.4	178.5	42.7	0	0	0	0	114.9	V345 I346 S347 G351	V345-S349 PolarHBondContact O-N 3.16Å; V345-S349 PolarHBondContact O-OG 3.03Å; I346-S349 WeakPolarHBondContact CA-OG 3.29Å; I346-S349 PolarHBondContact O-N 2.67Å; I346-S349 PolarHBondContact O-OG 3.08Å; I346-S349 VanDerWaalsContact O-OG 3.05Å; S347-S349 VanDerWaalsContact C-N 3.31Å; S347-S349 PolarHBondContact O-N 3.1Å; S349-G351 PolarHBondContact O-N 2.9Å; S349-G351 VanDerWaalsContact O-N 3.09Å
350	C	51.4	Low	57.8	Low	109 Å²	109	116.8 Å²	116.8	74%	0.736	70%	0.695	S	S	*	*			trans	-82.5	36.1	175.6	-77	0	0	0	0	114.8	I346	I346-C350 PolarHBondContact O-N 3.3Å
351	G	48.2	Very low	55.1	Low	69 Å²	69	115.2 Å²	115.2	71%	0.711	71%	0.71	S	S	*	*			trans	-85.5	-0.9	-174.3	0	0	0	0	0	117.1	S349	S349-G351 PolarHBondContact O-N 2.9Å; S349-G351 VanDerWaalsContact O-N 3.09Å
352	S	46.4	Very low	52.4	Low	106 Å²	106	112.4 Å²	112.4	74%	0.741	73%	0.725	S	S	*	*			trans	-152.3	123.9	-170.3	-67.7	0	0	0	0	113.8
353	T	45.6	Very low	49.9	Very low	144 Å²	144	110.2 Å²	110.2	88%	0.883	74%	0.738	S	S	*	*			trans	156	155.6	140.6	40.9	0	0	0	0	111.5
354	P	48.9	Very low	47.8	Very low	129 Å²	129	108.9 Å²	108.9	84%	0.838	75%	0.751	S	S	*	*			trans	-94.8	165.5	-161.2	37.2	-36.8	0	0	0	114.9
355	S	36.3	Very low	45.7	Very low	126 Å²	126	108.1 Å²	108.1	88%	0.881	77%	0.771	S	S	*	*			trans	-120.2	134.3	172.6	-171.1	0	0	0	0	112.4
356	A	34.2	Very low	43.4	Very low	92 Å²	92	107.5 Å²	107.5	76%	0.76	79%	0.785	S	S	*	*			trans	-155.3	149	170.1	0	0	0	0	0	107.3
357	S	40.3	Very low	41.5	Very low	106 Å²	106	108.2 Å²	108.2	74%	0.741	81%	0.805	S	S	*	*			cis	-172.8	144.6	-10.4	49.5	0	0	0	0	108.3
358	L	36	Very low	39.9	Very low	185 Å²	185	107.6 Å²	107.6	97%	0.969	81%	0.813	S	S	*	*			trans	178.4	142	160.7	-98.4	156.4	0	0	0	108.4
359	G	35.2	Very low	39.5	Very low	64 Å²	64	108.8 Å²	108.8	66%	0.66	82%	0.818	S	S	*	*			cis	162.7	47.4	-6.4	0	0	0	0	0	117.2
360	R	34.2	Very low	38.3	Very low	256 Å²	256	112.5 Å²	112.5	97%	0.966	83%	0.831	S	S	*	*			trans	-178.2	149.5	167.3	-106.6	165.2	179	-124.6	0.2	109.5
361	G	30	Very low	37.4	Very low	80 Å²	80	111.1 Å²	111.1	83%	0.825	83%	0.828	S	S	*	*			cis	154.6	136.1	-8.4	0	0	0	0	0	111.5
362	G	32.2	Very low	36.7	Very low	82 Å²	82	119.6 Å²	119.6	85%	0.845	84%	0.838	S	S	*	*			trans	143.1	109	174.5	0	0	0	0	0	114.2
363	G	32.3	Very low	36.4	Very low	88 Å²	88	118.1 Å²	118.1	91%	0.907	84%	0.839	S	S	*	*			trans	-78.1	-169.3	-171.9	0	0	0	0	0	117.7
364	G	31.4	Very low	36.3	Very low	84 Å²	84	117.9 Å²	117.9	87%	0.866	84%	0.84	S	S	*	*			trans	129	110.1	176.6	0	0	0	0	0	112.1
365	G	33.7	Very low	35.4	Very low	88 Å²	88	115.2 Å²	115.2	91%	0.907	84%	0.836	S	S	*	*			trans	-108.8	154.1	178.8	0	0	0	0	0	113.1
366	G	31	Very low	35.4	Very low	85 Å²	85	121.1 Å²	121.1	88%	0.876	84%	0.839	S	S	*	*			trans	-171.5	143.7	174	0	0	0	0	0	110.2
367	A	34.7	Very low	35.2	Very low	112 Å²	112	124.2 Å²	124.2	93%	0.926	84%	0.84	S	S	*	*			trans	-113.4	148.3	-169.6	0	0	0	0	0	113.3
368	G	33.7	Very low	34.7	Very low	74 Å²	74	128.9 Å²	128.9	76%	0.763	84%	0.841	S	S	*	*			trans	174.6	124.8	175	0	0	0	0	0	112.3
369	P	53.3	Low	34.5	Very low	120 Å²	120	126 Å²	126	78%	0.779	82%	0.823	S	S	*	*			trans	-111.4	170.5	-171.2	40.3	-34.9	0	0	0	116.1
370	N	35.9	Very low	34.5	Very low	163 Å²	163	128.5 Å²	128.5	87%	0.872	82%	0.817	S	S	*	*			trans	70.7	148.2	170.9	-77.7	-30.4	0	0	0	116.8
371	A	32	Very low	34.6	Very low	81 Å²	81	124.5 Å²	124.5	67%	0.669	81%	0.809	S	S	*	*			cis	-151.4	159.1	27	0	0	0	0	0	116
372	R	34.4	Very low	34.6	Very low	247 Å²	247	125.8 Å²	125.8	93%	0.932	81%	0.812	S	S	*	*			trans	56.8	109.9	155.5	-65.1	177.7	-177.8	-168.6	-0.1	119.1
373	G	40.1	Very low	34.5	Very low	74 Å²	74	125.2 Å²	125.2	76%	0.763	81%	0.806	S	S	*	*			trans	-100.2	-171.4	153.6	0	0	0	0	0	112.3
374	P	43.5	Very low	35.5	Very low	139 Å²	139	127.2 Å²	127.2	90%	0.903	80%	0.803	S	S	*	*			trans	-135.7	154.6	142.1	37.8	-26.8	0	0	0	113.3
375	G	29.8	Very low	35.5	Very low	73 Å²	73	127.8 Å²	127.8	75%	0.753	80%	0.8	S	S	*	*			trans	175.9	131.3	168.9	0	0	0	0	0	118.5
376	R	36.5	Very low	35.6	Very low	251 Å²	251	129.9 Å²	129.9	95%	0.947	80%	0.795	S	S	*	*			trans	83.9	157	154	-69	-170.8	167	-132.3	-3.2	121.8
377	M	28.6	Very low	36.3	Very low	157 Å²	157	132 Å²	132	77%	0.773	79%	0.793	S	S	*	*			trans	76.4	145.6	175.7	-73.8	-165.3	144.6	0	0	117.2
378	R	31.5	Very low	36.1	Very low	203 Å²	203	131.5 Å²	131.5	77%	0.766	78%	0.783	S	S	*	*			cis	-145.7	163.4	12.3	-153.6	171.4	174.6	170.1	-2.2	114.4
379	E	30.8	Very low	36.1	Very low	124 Å²	124	133.3 Å²	133.3	58%	0.579	78%	0.779	S	S	*	*			trans	-72.9	161.6	166.4	-47	117.2	97.9	0	0	113.2
380	H	34.8	Very low	34.9	Very low	117 Å²	117	137.4 Å²	137.4	54%	0.542	78%	0.781	S	S	.	*				173.5	131	98.9	-85.5	-68.6	0	0	0	114.5
381	H	35.9	Very low	34.5	Very low	172 Å²	172	134 Å²	134	80%	0.796	78%	0.775	S	S	*	*			trans	40.9	129.2	143.4	-49.5	-33.9	0	0	0	124.2
382	A	29.8	Very low	34.2	Very low	107 Å²	107	137.4 Å²	137.4	88%	0.884	79%	0.787	S	S	*	*				-155.7	150.5	128.5	0	0	0	0	0	111.6
383	G	31.6	Very low	33.9	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	78%	0.775	S	S	*	*			trans	-126.6	-170.3	160.9	0	0	0	0	0	109.1
384	P	52.3	Low	33.2	Very low	129 Å²	129	137.5 Å²	137.5	84%	0.838	78%	0.779	S	S	*	*			cis	-150.6	-163.5	32.6	43.2	-21.7	0	0	0	116.8
385	A	31.1	Very low	32.6	Very low	97 Å²	97	139.6 Å²	139.6	80%	0.802	78%	0.777	S	S	*	*			trans	86.7	164.3	150.1	0	0	0	0	0	121.4
386	V	36.6	Very low	32.4	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	78%	0.78	S	S	*	*			trans	-136.7	166	-160	-140.4	0	0	0	0	110.3
387	P	45.8	Very low	32	Very low	129 Å²	129	133.7 Å²	133.7	84%	0.838	78%	0.775	S	S	*	*				-149.4	-160.1	87.7	40.4	-20.2	0	0	0	115
388	S	29.5	Very low	31.9	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	78%	0.776	S	S	*	*			trans	-133.2	179.7	-165.9	-174	0	0	0	0	113.5
389	T	33.5	Very low	33	Very low	112 Å²	112	127.3 Å²	127.3	69%	0.687	77%	0.774	S	S	*	*			trans	69.8	151.4	-175.1	70.4	0	0	0	0	113.9
390	Y	29.3	Very low	32.8	Very low	206 Å²	206	126.3 Å²	126.3	81%	0.808	78%	0.781	S	S	*	*			cis	-149.2	141.9	21.1	17.7	-100.6	0	0	0	107.8
391	A	28.3	Very low	32.5	Very low	91 Å²	91	127.4 Å²	127.4	75%	0.752	80%	0.796	S	S	*	*			cis	80.4	107.6	41.2	0	0	0	0	0	115.4
392	V	25.3	Very low	31.9	Very low	152 Å²	152	122.8 Å²	122.8	92%	0.921	80%	0.795	S	S	*	*				172	149.2	129.8	152.1	0	0	0	0	110.7
393	S	27.3	Very low	31.7	Very low	98 Å²	98	122.7 Å²	122.7	69%	0.685	79%	0.794	S	S	*	*			trans	-130.8	163.7	-174.8	43.6	0	0	0	0	113.1
394	R	26.3	Very low	31.5	Very low	225 Å²	225	124.4 Å²	124.4	85%	0.849	80%	0.795	S	S	*	*			trans	172.1	127.1	144.5	-92.6	154.2	-165.4	-87.5	-1.9	110.1
395	H	29.4	Very low	30.2	Very low	184 Å²	184	122.7 Å²	122.7	85%	0.852	79%	0.786	S	S	*	*				68	131.7	78.2	-83.1	-81.7	0	0	0	114.8
396	G	26.9	Very low	30.1	Very low	79 Å²	79	128.7 Å²	128.7	81%	0.814	79%	0.788	S	S	*	*			trans	176.7	76.9	173.3	0	0	0	0	0	114.1
397	S	27.7	Very low	29.8	Very low	120 Å²	120	128.7 Å²	128.7	84%	0.839	79%	0.788	S	S	*	*			trans	-90.4	165.1	165	-59.4	0	0	0	0	111
398	S	27.4	Very low	29.6	Very low	113 Å²	113	128.4 Å²	128.4	79%	0.79	79%	0.786	S	S	*	*			trans	-38.1	173.1	168.7	-31	0	0	0	0	117.1
399	P	54	Low	29.6	Very low	113 Å²	113	128 Å²	128	73%	0.734	79%	0.789	S	S	*	*			cis	-139.7	-163.4	-1.1	35.5	-12.6	0	0	0	114.6
400	S	26.8	Very low	29.4	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	80%	0.796	S	S	*	*			trans	120.3	129.7	133.5	76.5	0	0	0	0	121.1
401	T	27.7	Very low	29.3	Very low	140 Å²	140	123 Å²	123	86%	0.859	80%	0.795	S	S	*	*			trans	4	136.2	154.1	49.1	0	0	0	0	123.5
402	G	24.6	Very low	29.4	Very low	74 Å²	74	127.9 Å²	127.9	76%	0.763	80%	0.802	S	S	*	*				133.8	113.5	120.2	0	0	0	0	0	119.7
403	A	25.3	Very low	29.5	Very low	106 Å²	106	126.1 Å²	126.1	88%	0.876	80%	0.796	S	S	*	*			trans	28.9	156.2	138.5	0	0	0	0	0	123.5
404	S	25.9	Very low	29.6	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	80%	0.804	S	S	*	*			cis	-178.5	149.2	-19.9	-179.3	0	0	0	0	110.9
405	S	26.8	Very low	29.6	Very low	93 Å²	93	118.4 Å²	118.4	65%	0.65	78%	0.784	S	S	*	*			trans	70.2	152.8	163.4	86.1	0	0	0	0	117.1
406	R	28.4	Very low	29.4	Very low	224 Å²	224	116 Å²	116	85%	0.845	79%	0.786	S	S	*	*			cis	-135.6	145.2	3.9	-64.8	176.8	-173.2	-162	-1.3	108
407	V	29.6	Very low	29.5	Very low	131 Å²	131	123.1 Å²	123.1	79%	0.794	79%	0.79	S	S	*	*			cis	71.6	139.4	49.5	175.1	0	0	0	0	112.4
408	P	42.3	Very low	29.3	Very low	122 Å²	122	124.8 Å²	124.8	79%	0.792	79%	0.79	S	S	*	*			cis	-106.2	-154	-1.1	45.4	-35.5	0	0	0	110.6
409	A	29.3	Very low	29.4	Very low	96 Å²	96	124.4 Å²	124.4	79%	0.793	79%	0.787	S	S	*	*			cis	-165.4	166.4	-17	0	0	0	0	0	105.9
410	A	30	Very low	28	Very low	100 Å²	100	127.2 Å²	127.2	83%	0.826	80%	0.795	S	S	*	*			cis	-144.6	-165.6	-5.1	0	0	0	0	0	106.8
411	S	27	Very low	27.9	Very low	113 Å²	113	127.3 Å²	127.3	79%	0.79	80%	0.796	S	S	*	*			cis	-131.8	166.8	0.6	60	0	0	0	0	111.1
412	Q	30.3	Very low	28	Very low	192 Å²	192	129.1 Å²	129.1	90%	0.897	80%	0.8	S	S	*	*			trans	-99.3	176.4	-166.1	-54.4	178.5	19.9	0	0	111.1
413	S	25.9	Very low	28.1	Very low	115 Å²	115	134.5 Å²	134.5	80%	0.804	81%	0.805	S	S	*	*			cis	-153.2	173.7	18	62.3	0	0	0	0	114.4
414	S	30.8	Very low	28.2	Very low	121 Å²	121	137.3 Å²	137.3	85%	0.846	81%	0.805	S	S	*	*			trans	-128	135.9	170.4	57.2	0	0	0	0	110.6
415	G	25.7	Very low	28.4	Very low	41 Å²	41	138 Å²	138	42%	0.423	81%	0.806	S	S	.	*			trans	-150.3	145.3	163.6	0	0	0	0	0	108.3
416	C	25.8	Very low	28.4	Very low	134 Å²	134	144.9 Å²	144.9	91%	0.905	82%	0.818	S	S	*	*			cis	59.9	75.6	39.8	-56	0	0	0	0	111.1
417	Y	28.3	Very low	28.5	Very low	228 Å²	228	139.9 Å²	139.9	89%	0.894	81%	0.814	S	S	*	*			trans	-87.2	110.8	168.6	-45.1	-66.6	0	0	0	107.5
418	D	24.1	Very low	28.4	Very low	155 Å²	155	143 Å²	143	83%	0.829	82%	0.821	S	S	*	*			trans	-80.7	-178.5	172.6	-140.5	-42.8	0	0	0	110.7
419	S	28.2	Very low	27.8	Very low	104 Å²	104	147 Å²	147	73%	0.727	83%	0.828	S	S	*	*			trans	-88.1	112	-178.2	-54.9	0	0	0	0	112.3
420	D	24.6	Very low	27.6	Very low	172 Å²	172	146.4 Å²	146.4	92%	0.92	83%	0.832	S	S	*	*			trans	-87.9	108.5	164.7	-89.8	-37.9	0	0	0	110.7
421	S	26.2	Very low	27.6	Very low	106 Å²	106	146.2 Å²	146.2	74%	0.741	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-90.8	130.2	162.7	-60.4	0	0	0	0	109.1
422	L	29.9	Very low	28.2	Very low	178 Å²	178	145.9 Å²	145.9	93%	0.932	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-80	137.9	162.1	-78.1	171.3	0	0	0	109.8
423	E	25	Very low	28.1	Very low	187 Å²	187	145.4 Å²	145.4	87%	0.874	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.8	142.2	-171.4	-58.9	178.9	107.8	0	0	113.4
424	L	27.5	Very low	28.1	Very low	166 Å²	166	146.4 Å²	146.4	87%	0.869	82%	0.82	S	S	*	*			trans	-136.7	148	147.3	-80.4	177.8	0	0	0	109.1
425	P	30.7	Very low	28	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-80.8	154.8	-160	-15.1	32	0	0	0	114.7
426	R	26.5	Very low	28	Very low	237 Å²	237	146.8 Å²	146.8	89%	0.894	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-82.3	138.1	162.7	-77.5	-176.7	175.5	164.5	-1.9	111.1
427	P	31.2	Very low	28.8	Very low	119 Å²	119	147.1 Å²	147.1	77%	0.773	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-75	159.7	145.8	-9.4	27.8	0	0	0	110.8
428	E	27.3	Very low	28.7	Very low	197 Å²	197	140.1 Å²	140.1	92%	0.921	83%	0.826	S	S	*	*			trans	-86.2	-175.1	-174.7	-65	-172	115.5	0	0	114.5
429	E	29.7	Very low	28.8	Very low	205 Å²	205	136.5 Å²	136.5	96%	0.958	82%	0.824	S	S	*	*			trans	-67.2	153.8	-176.4	-59.1	176.7	111.2	0	0	113.3
430	G	25.6	Very low	28.8	Very low	84 Å²	84	140.2 Å²	140.2	87%	0.866	84%	0.835	S	S	*	*			trans	-168.9	73.6	-175.7	0	0	0	0	0	114.1
431	A	29	Very low	28.9	Very low	96 Å²	96	135.8 Å²	135.8	79%	0.793	83%	0.83	S	S	*	*			trans	-141.4	147.3	166.1	0	0	0	0	0	106.5
432	P	40.6	Very low	29	Very low	106 Å²	106	138 Å²	138	69%	0.688	84%	0.839	S	S	*	*				-150.3	-164.5	62.8	42.8	-22.5	0	0	0	115.4
433	E	27.5	Very low	28.8	Very low	183 Å²	183	140.7 Å²	140.7	86%	0.855	84%	0.837	S	S	*	*			trans	69.4	150.6	158.6	-68.6	175.7	177	0	0	118.6
434	D	26.2	Very low	28.8	Very low	135 Å²	135	136.2 Å²	136.2	72%	0.722	83%	0.832	S	S	*	*			cis	-162.4	169.3	-27	179.3	45.2	0	0	0	108.3
435	S	28.8	Very low	28.7	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	83%	0.833	S	S	*	*			trans	48.1	115.2	161.8	-71.9	0	0	0	0	117.9
436	G	26.1	Very low	28.5	Very low	74 Å²	74	136.3 Å²	136.3	76%	0.763	84%	0.835	S	S	*	*			cis	81	161.5	47	0	0	0	0	0	111.8
437	P	41.3	Very low	28.5	Very low	140 Å²	140	131.4 Å²	131.4	91%	0.909	83%	0.831	S	S	*	*			cis	-121.3	-175.7	-24.7	41	-27	0	0	0	111.7
438	G	26	Very low	28.4	Very low	82 Å²	82	134.2 Å²	134.2	85%	0.845	84%	0.84	S	S	*	*			trans	170.7	81	169.7	0	0	0	0	0	116.7
439	G	26.4	Very low	28.3	Very low	78 Å²	78	128.5 Å²	128.5	80%	0.804	83%	0.833	S	S	*	*			trans	-99.8	124.5	173.1	0	0	0	0	0	112.9
440	L	29.4	Very low	28	Very low	183 Å²	183	122.5 Å²	122.5	96%	0.958	83%	0.826	S	S	*	*			trans	-134.3	120.1	160.8	-81.8	175.9	0	0	0	109.2
441	G	26.4	Very low	28	Very low	79 Å²	79	124.1 Å²	124.1	81%	0.814	82%	0.824	S	S	*	*			trans	-107.6	132.8	175.8	0	0	0	0	0	111.2
442	T	28.3	Very low	27.8	Very low	151 Å²	151	128.8 Å²	128.8	93%	0.926	83%	0.83	S	S	*	*			trans	-123.9	149.3	170.1	-51.7	0	0	0	0	110.3
443	R	24.7	Very low	27.1	Very low	235 Å²	235	134.9 Å²	134.9	89%	0.887	84%	0.839	S	S	*	*			trans	-98.7	127.5	-158.7	167.3	179	170.4	175.4	-2.7	112.7
444	A	26.1	Very low	27.2	Very low	93 Å²	93	131.1 Å²	131.1	77%	0.769	83%	0.833	S	S	*	*			trans	53.3	125.2	153.2	0	0	0	0	0	119.7
445	Q	25.3	Very low	27.4	Very low	191 Å²	191	132.2 Å²	132.2	89%	0.893	83%	0.834	S	S	*	*				-140.7	136.9	129.1	-152	156	29	0	0	110.1
446	A	25.8	Very low	27.5	Very low	98 Å²	98	131.2 Å²	131.2	81%	0.81	83%	0.825	S	S	*	*			trans	-110.6	128.8	177.7	0	0	0	0	0	109.3
447	T	27.7	Very low	28	Very low	133 Å²	133	131.2 Å²	131.2	82%	0.816	81%	0.812	S	S	*	*			trans	-131.7	146.5	170.7	49.3	0	0	0	0	109.1
448	N	27.9	Very low	28.2	Very low	179 Å²	179	133.4 Å²	133.4	96%	0.957	80%	0.802	S	S	*	*			trans	-79.6	134.2	-168.7	-67.8	-53.8	0	0	0	112.4
449	G	24.8	Very low	28.8	Very low	76 Å²	76	133.7 Å²	133.7	78%	0.784	79%	0.791	S	S	*	*			trans	-149.4	126.1	169.4	0	0	0	0	0	110.3
450	G	25.2	Very low	29.2	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	77%	0.766	S	S	*	*			trans	-70	136.7	-169.3	0	0	0	0	0	114.3	E452	G450-E452 PolarHBondContact O-N 3.32Å
451	S	23.8	Very low	29.8	Very low	118 Å²	118	124.8 Å²	124.8	83%	0.825	74%	0.737	S	S	*	*			trans	-79.6	94.2	175	-173.5	0	0	0	0	111.5	R453	S451-R453 PolarHBondContact O-N 3.19Å
452	E	25.2	Very low	30.5	Very low	195 Å²	195	124.2 Å²	124.2	91%	0.911	72%	0.715	S	S	*	*			trans	-77.4	104.6	162.2	-78.8	-139	98	0	0	110	G450 S454	G450-E452 PolarHBondContact O-N 3.32Å; E452-S454 PolarHBondContact O-N 2.96Å
453	R	27.1	Very low	30.9	Very low	233 Å²	233	126.3 Å²	126.3	88%	0.879	71%	0.706	S	S	*	*			trans	-70	105.8	-176.8	-175.1	-176.3	-174.1	-174	5.2	111.5	S451 Q455	S451-R453 PolarHBondContact O-N 3.19Å; R453-Q455 PolarHBondContact O-N 3.37Å
454	S	28.5	Very low	31.6	Very low	104 Å²	104	121.4 Å²	121.4	73%	0.727	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-53.6	129	175.6	46.9	0	0	0	0	112.1	E452	E452-S454 PolarHBondContact O-N 2.96Å
455	Q	30.8	Very low	32.5	Very low	158 Å²	158	120.6 Å²	120.6	74%	0.738	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-88.5	133.5	178.9	-69	-170.6	-4.3	0	0	110.8	R453	R453-Q455 PolarHBondContact O-N 3.37Å
456	P	30.9	Very low	33.3	Very low	76 Å²	76	113.5 Å²	113.5	49%	0.494	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-68.3	155.8	179.7	29	-35.9	0	0	0	112.4	R458	P456-R458 PolarHBondContact O-N 3.48Å
457	P	35.8	Very low	34.2	Very low	75 Å²	75	113 Å²	113	49%	0.487	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-58.6	129.5	-173.6	19.3	-31.6	0	0	0	113.7	S459 S460	P457-S459 VanDerWaalsContact C-N 3.25Å; P457-S459 PolarHBondContact O-N 3.45Å; P457-S459 VanDerWaalsContact O-N 3.16Å; P457-S460 PolarHBondContact O-N 2.99Å; P457-S460 PolarHBondContact O-OG 3.5Å; P457-S460 VanDerWaalsContact O-OG 3.1Å
458	R	47.2	Very low	34.7	Very low	185 Å²	185	111.8 Å²	111.8	70%	0.698	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-21.1	-167.4	-67	-177.2	174.7	-169	-2.6	114.9	P456 S460 G461 L462	P456-R458 PolarHBondContact O-N 3.48Å; R458-S460 PolarHBondContact O-N 2.92Å; R458-G461 PolarHBondContact O-N 3.29Å; R458-L462 PolarHBondContact O-N 2.66Å
459	S	37	Very low	35.3	Very low	89 Å²	89	106.3 Å²	106.3	62%	0.622	58%	0.581	S	S	*	*	H	α-helix	trans	-55.2	-38.1	173.7	53.5	0	0	0	0	112.4	P457 G461 R463	P457-S459 VanDerWaalsContact C-N 3.25Å; P457-S459 PolarHBondContact O-N 3.45Å; P457-S459 VanDerWaalsContact O-N 3.16Å; S459-G461 VanDerWaalsContact C-N 3.32Å; S459-G461 PolarHBondContact O-N 2.92Å; S459-R463 PolarHBondContact O-N 2.9Å
460	S	35.9	Very low	35.9	Very low	38 Å²	38	111.3 Å²	111.3	27%	0.266	58%	0.576	S	S	.	*	H	α-helix	trans	-74	-22	178	81.5	0	0	0	0	113.6	P457 R458 R464	P457-S460 PolarHBondContact O-N 2.99Å; P457-S460 PolarHBondContact O-OG 3.5Å; P457-S460 VanDerWaalsContact O-OG 3.1Å; R458-S460 PolarHBondContact O-N 2.92Å; S460-R464 VanDerWaalsContact CB-NH2 3.31Å; S460-R464 PolarHBondContact O-N 3.26Å; S460-R464 PolarHBondContact O-NE 3.44Å; S460-R464 PolarHBondContact OG-NH2 2.9Å
461	G	41.4	Very low	36.2	Very low	35 Å²	35	114.2 Å²	114.2	36%	0.361	57%	0.568	S	S	.	*	H	α-helix	trans	-73.7	-50.3	175	0	0	0	0	0	111.5	R458 S459 R463 R464 Q465	R458-G461 PolarHBondContact O-N 3.29Å; S459-G461 VanDerWaalsContact C-N 3.32Å; S459-G461 PolarHBondContact O-N 2.92Å; G461-R463 VanDerWaalsContact C-N 3.32Å; G461-R463 PolarHBondContact O-N 3.07Å; G461-R464 PolarHBondContact O-N 3.35Å; G461-R464 VanDerWaalsContact O-N 3.17Å; G461-Q465 WeakPolarHBondContact O-CB 3.13Å; G461-Q465 PolarHBondContact O-N 3.32Å
462	L	41.8	Very low	36.6	Very low	68 Å²	68	118.1 Å²	118.1	36%	0.356	57%	0.565	S	S	.	*	H	α-helix	trans	-60.5	-39.8	178.4	-65.9	174	0	0	0	112.1	R458 Q465 A466	R458-L462 PolarHBondContact O-N 2.66Å; L462-Q465 PolarHBondContact O-N 2.91Å; L462-A466 WeakPolarHBondContact O-CB 3.49Å; L462-A466 PolarHBondContact O-N 3.46Å
463	R	36.4	Very low	37.2	Very low	194 Å²	194	116.6 Å²	116.6	73%	0.732	55%	0.551	S	S	*	*	H	α-helix	trans	-62.6	-42.3	175.2	-171.3	172.9	179.5	174.9	-1.5	112.3	S459 G461 I467	S459-R463 PolarHBondContact O-N 2.9Å; G461-R463 VanDerWaalsContact C-N 3.32Å; G461-R463 PolarHBondContact O-N 3.07Å; R463-I467 HydrophobicContact CG-CD1 4.47Å; R463-I467 WeakPolarHBondContact O-CD1 3.34Å; R463-I467 WeakPolarHBondContact O-CG1 3.33Å; R463-I467 PolarHBondContact O-N 2.77Å
464	R	39.6	Very low	37.4	Very low	133 Å²	133	111.2 Å²	111.2	50%	0.502	55%	0.546	S	S	.	.	H	α-helix	trans	-68.4	-40.3	175.5	-82.2	177	-97.4	-124.7	8.4	112.4	S460 G461 A466 I467 Q468	S460-R464 VanDerWaalsContact CB-NH2 3.31Å; S460-R464 PolarHBondContact O-N 3.26Å; S460-R464 PolarHBondContact O-NE 3.44Å; S460-R464 PolarHBondContact OG-NH2 2.9Å; G461-R464 PolarHBondContact O-N 3.35Å; G461-R464 VanDerWaalsContact O-N 3.17Å; R464-A466 PolarHBondContact O-N 2.96Å; R464-I467 PolarHBondContact O-N 2.75Å; R464-Q468 WeakPolarHBondContact O-CG 3.3Å; R464-Q468 PolarHBondContact O-N 3.4Å
465	Q	43.7	Very low	37.4	Very low	75 Å²	75	116.9 Å²	116.9	35%	0.35	55%	0.552	S	S	.	*	H	α-helix	trans	-65.6	-37.1	176.9	-167.9	170.3	18.2	0	0	112.1	G461 L462 Q468 N469 W677	G461-Q465 WeakPolarHBondContact O-CB 3.13Å; G461-Q465 PolarHBondContact O-N 3.32Å; L462-Q465 PolarHBondContact O-N 2.91Å; Q465-Q468 PolarHBondContact O-N 2.9Å; Q465-N469 WeakPolarHBondContact O-CB 3.43Å; Q465-N469 PolarHBondContact O-N 3.36Å; Q465-W677 HydrophobicContact CG-CH2 4.44Å
466	A	43.8	Very low	37.4	Very low	42 Å²	42	120.6 Å²	120.6	35%	0.347	56%	0.559	S	S	.	*	H	α-helix	trans	-62.6	-43.3	172.7	0	0	0	0	0	112.2	L462 R464 N469 W470 W677	L462-A466 WeakPolarHBondContact O-CB 3.49Å; L462-A466 PolarHBondContact O-N 3.46Å; R464-A466 PolarHBondContact O-N 2.96Å; A466-N469 PolarHBondContact O-N 2.93Å; A466-W470 WeakPolarHBondContact O-CB 3.39Å; A466-W470 PolarHBondContact O-N 2.66Å; A466-W677 HydrophobicContact CB-CZ2 4.41Å
467	I	43.1	Very low	37.1	Very low	88 Å²	88	124.3 Å²	124.3	45%	0.451	57%	0.569	S	S	.	*	H	α-helix	trans	-63.1	-45.4	176.2	-67.3	163.5	0	0	0	110.9	R463 R464 N469 W470 Q471	R463-I467 HydrophobicContact CG-CD1 4.47Å; R463-I467 WeakPolarHBondContact O-CD1 3.34Å; R463-I467 WeakPolarHBondContact O-CG1 3.33Å; R463-I467 PolarHBondContact O-N 2.77Å; R464-I467 PolarHBondContact O-N 2.75Å; I467-N469 PolarHBondContact O-N 2.94Å; I467-W470 WeakPolarHBondContact O-CB 3.2Å; I467-W470 PolarHBondContact O-N 2.7Å; I467-W470 VanDerWaalsContact O-N 3.15Å; I467-Q471 WeakPolarHBondContact O-CG 3.33Å; I467-Q471 PolarHBondContact O-N 2.77Å
468	Q	38.8	Very low	36.8	Very low	108 Å²	108	126.7 Å²	126.7	51%	0.505	59%	0.588	S	S	.	*	H	α-helix	trans	-64.7	-37.2	177.9	-71.3	175.3	-5.5	0	0	112.7	R464 Q465 Q471 R472	R464-Q468 WeakPolarHBondContact O-CG 3.3Å; R464-Q468 PolarHBondContact O-N 3.4Å; Q465-Q468 PolarHBondContact O-N 2.9Å; Q468-Q471 PolarHBondContact O-N 2.63Å; Q468-R472 WeakPolarHBondContact O-CG 3.37Å; Q468-R472 PolarHBondContact O-N 3.14Å
469	N	40.4	Very low	35.9	Very low	64 Å²	64	123.9 Å²	123.9	34%	0.342	59%	0.591	S	S	.	*	H	α-helix	trans	-69.2	-33.2	172.7	-80.5	-6.8	0	0	0	112.3	Q465 A466 I467 Q471 R472	Q465-N469 WeakPolarHBondContact O-CB 3.43Å; Q465-N469 PolarHBondContact O-N 3.36Å; A466-N469 PolarHBondContact O-N 2.93Å; I467-N469 PolarHBondContact O-N 2.94Å; N469-Q471 VanDerWaalsContact C-N 3.34Å; N469-R472 PolarHBondContact O-N 3.42Å
470	W	37.3	Very low	35.7	Very low	180 Å²	180	129.1 Å²	129.1	68%	0.682	61%	0.606	S	S	*	*	H	α-helix	trans	-67.1	-35.6	174.7	-160.5	87.9	0	0	0	112	A466 I467 R473	A466-W470 WeakPolarHBondContact O-CB 3.39Å; A466-W470 PolarHBondContact O-N 2.66Å; I467-W470 WeakPolarHBondContact O-CB 3.2Å; I467-W470 PolarHBondContact O-N 2.7Å; I467-W470 VanDerWaalsContact O-N 3.15Å; W470-R473 WeakPolarHBondContact O-CD 3.48Å; W470-R473 WeakPolarHBondContact O-CG 3.49Å
471	Q	31.8	Very low	35.4	Very low	141 Å²	141	130.7 Å²	130.7	66%	0.659	63%	0.628	S	S	*	*	H	α-helix	trans	-69.3	-27.9	172.8	-71.1	170	-25.6	0	0	113.2	I467 Q468 N469 R473	I467-Q471 WeakPolarHBondContact O-CG 3.33Å; I467-Q471 PolarHBondContact O-N 2.77Å; Q468-Q471 PolarHBondContact O-N 2.63Å; N469-Q471 VanDerWaalsContact C-N 3.34Å; Q471-R473 VanDerWaalsContact C-N 3.25Å; Q471-R473 PolarHBondContact O-N 2.86Å
472	R	32.8	Very low	34.7	Very low	200 Å²	200	138.4 Å²	138.4	76%	0.755	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	21.3	177.4	-69.2	-178.1	-171.2	-90.8	2.6	114.5	Q468 N469 P474	Q468-R472 WeakPolarHBondContact O-CG 3.37Å; Q468-R472 PolarHBondContact O-N 3.14Å; N469-R472 PolarHBondContact O-N 3.42Å; R472-P474 WeakPolarHBondContact O-CD 3.21Å
473	R	37.5	Very low	34.4	Very low	162 Å²	162	144.5 Å²	144.5	61%	0.611	68%	0.681	S	S	*	*			trans	-68.8	125.3	171.1	-78.8	173.5	171.8	-103.7	-0.9	110.7	W470 Q471 R475	W470-R473 WeakPolarHBondContact O-CD 3.48Å; W470-R473 WeakPolarHBondContact O-CG 3.49Å; Q471-R473 VanDerWaalsContact C-N 3.25Å; Q471-R473 PolarHBondContact O-N 2.86Å; R473-R475 PolarHBondContact O-N 3.03Å
474	P	30.1	Very low	34.1	Very low	121 Å²	121	139.1 Å²	139.1	79%	0.786	69%	0.686	S	S	*	*			trans	-62.3	117.1	160.6	-17	31.2	0	0	0	108.7	R472 R476	R472-P474 WeakPolarHBondContact O-CD 3.21Å; P474-R476 PolarHBondContact O-N 3.33Å
475	R	28.5	Very low	33.6	Very low	223 Å²	223	139.8 Å²	139.8	84%	0.842	70%	0.7	S	S	*	*			trans	-74.1	108.9	165	-70.8	-170.6	-178.9	-152.4	3.8	107.7	R473	R473-R475 PolarHBondContact O-N 3.03Å
476	R	30.5	Very low	32.9	Very low	235 Å²	235	142.9 Å²	142.9	89%	0.887	72%	0.723	S	S	*	*			trans	-103.7	129.9	154.5	-80.5	-172	172.3	-95.1	-0.6	107.6	P474	P474-R476 PolarHBondContact O-N 3.33Å
477	H	26.3	Very low	32.3	Very low	154 Å²	154	145.8 Å²	145.8	71%	0.713	74%	0.741	S	S	*	*			trans	-76.8	149.1	173.5	-70.6	-114.2	0	0	0	108.7
478	S	29.2	Very low	31.6	Very low	125 Å²	125	149.1 Å²	149.1	87%	0.874	76%	0.76	S	S	*	*			trans	-84.1	115.8	167.1	-57.5	0	0	0	0	108.7
479	T	28.1	Very low	31.2	Very low	126 Å²	126	150 Å²	150	77%	0.773	77%	0.772	S	S	*	*			trans	-138.9	130.6	160.4	48.2	0	0	0	0	106.7
480	E	32.9	Very low	30.5	Very low	200 Å²	200	150 Å²	150	94%	0.935	79%	0.787	S	S	*	*			trans	-92.6	157.6	175.2	-64.4	166.5	120.6	0	0	109.2
481	G	29.8	Very low	30	Very low	70 Å²	70	146.7 Å²	146.7	72%	0.722	79%	0.792	S	S	*	*			trans	80	156.7	-169.3	0	0	0	0	0	113.2
482	E	27.1	Very low	29.8	Very low	197 Å²	197	151.2 Å²	151.2	92%	0.921	80%	0.803	S	S	*	*			cis	-148.8	-177.5	-6	-158.5	161.5	106	0	0	109.1
483	E	34.5	Very low	29.7	Very low	196 Å²	196	146.9 Å²	146.9	92%	0.916	80%	0.799	S	S	*	*			trans	-74.5	155.9	-178.3	-56.6	-175.4	161.2	0	0	112.6
484	G	29.9	Very low	29.2	Very low	81 Å²	81	144.6 Å²	144.6	84%	0.835	80%	0.803	S	S	*	*			trans	167.2	98.2	175	0	0	0	0	0	115
485	D	30.4	Very low	29.1	Very low	148 Å²	148	146.5 Å²	146.5	79%	0.791	80%	0.801	S	S	*	*			trans	-98.9	117.4	169.6	176.2	26.5	0	0	0	110.5
486	V	28.6	Very low	29.2	Very low	139 Å²	139	140.3 Å²	140.3	84%	0.842	79%	0.793	S	S	*	*			trans	-147.5	136.1	161	-178.4	0	0	0	0	109
487	S	31.5	Very low	29.1	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	79%	0.789	S	S	*	*			trans	-114.9	133	167.3	-61.3	0	0	0	0	109.7
488	D	27.6	Very low	29.2	Very low	159 Å²	159	134 Å²	134	85%	0.85	79%	0.787	S	S	*	*			trans	-165	171.5	138	-131.9	-16.7	0	0	0	118.2
489	V	29.3	Very low	29.1	Very low	125 Å²	125	136.9 Å²	136.9	76%	0.758	79%	0.787	S	S	*	*			trans	-45.2	126.8	176.5	165	0	0	0	0	118.5
490	G	26	Very low	29	Very low	64 Å²	64	134 Å²	134	66%	0.66	78%	0.783	S	S	*	*				76.9	172.8	100.6	0	0	0	0	0	122.9
491	S	28.4	Very low	29.2	Very low	112 Å²	112	130.1 Å²	130.1	78%	0.783	78%	0.775	S	S	*	*			trans	75.7	136.1	-176.2	-61.3	0	0	0	0	115.7
492	R	27.3	Very low	29.1	Very low	235 Å²	235	134.5 Å²	134.5	89%	0.887	78%	0.781	S	S	*	*				71.9	133.8	50.6	-79.9	-176.3	164	-168.4	-4.6	111.9
493	T	29.4	Very low	29.1	Very low	110 Å²	110	133 Å²	133	68%	0.675	78%	0.779	S	S	*	*			cis	-143.3	178.7	17.2	52.5	0	0	0	0	113.5
494	T	27.6	Very low	28.8	Very low	113 Å²	113	127.3 Å²	127.3	69%	0.693	77%	0.766	S	S	*	*			trans	39.2	167.1	140.2	53.9	0	0	0	0	122.3
495	E	27.3	Very low	29.3	Very low	161 Å²	161	129.7 Å²	129.7	75%	0.752	77%	0.766	S	S	*	*			cis	-149.5	173.8	9.7	30.9	-119	67.8	0	0	113.3
496	S	30.7	Very low	29.2	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	77%	0.771	S	S	*	*			trans	-6.3	164.4	145	-74.1	0	0	0	0	121.8
497	E	29.3	Very low	29.7	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	77%	0.772	S	S	*	*			cis	-162.4	143.6	-2.5	-114.4	161.8	114.7	0	0	109
498	A	28.2	Very low	29.4	Very low	82 Å²	82	131.9 Å²	131.9	68%	0.678	77%	0.771	S	S	*	*				110.6	-178.2	96.2	0	0	0	0	0	114.1
499	E	27.4	Very low	30.1	Very low	185 Å²	185	130.4 Å²	130.4	86%	0.864	77%	0.77	S	S	*	*			trans	77.7	114.2	179.6	-58.7	-57	85.7	0	0	120.6
500	G	25.5	Very low	29.9	Very low	66 Å²	66	129.1 Å²	129.1	68%	0.68	77%	0.773	S	S	*	*			trans	-102.8	-139.6	156.5	0	0	0	0	0	110.3
501	P	37	Very low	29.9	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	79%	0.787	S	S	*	*			cis	-135.2	169.1	16.8	41.3	-23.8	0	0	0	117.2
502	L	28.9	Very low	29.8	Very low	162 Å²	162	134.9 Å²	134.9	85%	0.848	79%	0.79	S	S	*	*			trans	34.8	131.8	142.5	-63.7	167.2	0	0	0	122.1
503	D	26	Very low	29.7	Very low	164 Å²	164	127.3 Å²	127.3	88%	0.877	78%	0.784	S	S	*	*				-154.4	160.7	107.9	-136.9	-23.9	0	0	0	113.1
504	A	28.4	Very low	29.9	Very low	78 Å²	78	128.2 Å²	128.2	65%	0.645	79%	0.792	S	S	*	*			trans	-159.9	156.6	-179.5	0	0	0	0	0	113.5
505	P	39.8	Very low	29.8	Very low	130 Å²	130	131.4 Å²	131.4	84%	0.844	80%	0.804	S	S	*	*				-147.9	176	112	35.4	-18	0	0	0	116.2
506	R	28.4	Very low	29.7	Very low	237 Å²	237	129.6 Å²	129.6	89%	0.894	81%	0.809	S	S	*	*			trans	-110.6	167	172.3	-74.2	178.5	162	-179.6	-4.5	111.4
507	P	39.3	Very low	29.4	Very low	132 Å²	132	130 Å²	130	86%	0.857	81%	0.812	S	S	*	*				-135.9	176.8	97.2	18.9	2.6	0	0	0	114.8
508	G	26	Very low	29.1	Very low	68 Å²	68	126.9 Å²	126.9	70%	0.701	81%	0.808	S	S	*	*			trans	-107.1	-155.7	171.6	0	0	0	0	0	112.6
509	P	41.2	Very low	28.9	Very low	128 Å²	128	133.1 Å²	133.1	83%	0.831	81%	0.814	S	S	*	*			cis	-138.2	166.8	17.4	42.2	-24.5	0	0	0	118.6
510	A	25.7	Very low	28.8	Very low	98 Å²	98	132.4 Å²	132.4	81%	0.81	82%	0.816	S	S	*	*			trans	24.2	129.4	148.7	0	0	0	0	0	124
511	M	25.9	Very low	28.7	Very low	196 Å²	196	134.1 Å²	134.1	97%	0.966	82%	0.817	S	S	*	*				-150.5	166.7	125	-109	-60.4	175.5	0	0	110.4
512	A	27.1	Very low	28.1	Very low	101 Å²	101	133.5 Å²	133.5	84%	0.835	82%	0.822	S	S	*	*			trans	-107.8	157.4	-154.8	0	0	0	0	0	117.2
513	G	25.4	Very low	28	Very low	75 Å²	75	136.1 Å²	136.1	77%	0.773	82%	0.82	S	S	*	*			trans	174.7	106.7	171	0	0	0	0	0	111.8
514	P	31.9	Very low	28.4	Very low	130 Å²	130	134 Å²	134	84%	0.844	82%	0.815	S	S	*	*			trans	-95.9	145.1	-162.8	34.9	-35.2	0	0	0	115.8
515	L	27.3	Very low	28.4	Very low	179 Å²	179	138.4 Å²	138.4	94%	0.937	82%	0.823	S	S	*	*			trans	-106.6	124.8	153.2	-77.6	170	0	0	0	108.6
516	S	24.4	Very low	27.9	Very low	123 Å²	123	136.2 Å²	136.2	86%	0.86	82%	0.823	S	S	*	*			trans	-157.6	151.2	159.3	-164.9	0	0	0	0	112.4
517	S	23.9	Very low	27.8	Very low	102 Å²	102	128.8 Å²	128.8	71%	0.713	82%	0.821	S	S	*	*			trans	-98.6	135.9	170.3	170.2	0	0	0	0	109.5
518	C	23.3	Very low	27.3	Very low	110 Å²	110	128.9 Å²	128.9	74%	0.743	83%	0.825	S	S	*	*			trans	-173.9	140.9	131.8	-100.6	0	0	0	0	114.9
519	R	24.8	Very low	27.4	Very low	213 Å²	213	128.9 Å²	128.9	80%	0.804	83%	0.825	S	S	*	*			trans	25.2	123.1	142.4	-56.7	178.1	-179.4	-135.2	1.9	120.4
520	L	24.1	Very low	26.8	Very low	170 Å²	170	134.9 Å²	134.9	89%	0.89	83%	0.831	S	S	*	*				-127.7	135.5	120.5	-65.5	173.9	0	0	0	106.6
521	S	24.2	Very low	27	Very low	101 Å²	101	133.6 Å²	133.6	71%	0.706	83%	0.828	S	S	*	*			cis	84.2	104.5	29.9	-57.7	0	0	0	0	114.2
522	A	24.8	Very low	27.2	Very low	106 Å²	106	136.5 Å²	136.5	88%	0.876	83%	0.828	S	S	*	*			trans	-135.9	137.4	159.8	0	0	0	0	0	108.7
523	R	26.5	Very low	27.6	Very low	217 Å²	217	141.7 Å²	141.7	82%	0.819	83%	0.826	S	S	*	*			trans	-105.6	149.4	-178.4	-114.8	-171.4	179.5	-165.6	3.1	110	E525	R523-E525 IonicContact NH1-OE1 3.8Å
524	P	33.9	Very low	27.8	Very low	119 Å²	119	142.9 Å²	142.9	77%	0.773	83%	0.828	S	S	*	*			trans	-101.9	142	158.2	35.5	-28.5	0	0	0	112.2
525	E	28.5	Very low	27.7	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.804	82%	0.821	S	S	*	*			trans	-124.8	152.7	154.6	-62.1	-177	163.5	0	0	105.8	R523	R523-E525 IonicContact NH1-OE1 3.8Å
526	G	28.7	Very low	28.3	Very low	83 Å²	83	146.9 Å²	146.9	86%	0.856	82%	0.82	S	S	*	*			cis	164.1	108.6	-4.5	0	0	0	0	0	108.6
527	G	26.1	Very low	28.4	Very low	82 Å²	82	144.5 Å²	144.5	85%	0.845	82%	0.816	S	S	*	*			trans	-164	122.3	-171.4	0	0	0	0	0	114.6
528	S	29.7	Very low	29	Very low	133 Å²	133	144.4 Å²	144.4	93%	0.93	82%	0.815	S	S	*	*			trans	-64.6	140.5	-172.1	-172	0	0	0	0	115.2
529	G	27.3	Very low	29.8	Very low	69 Å²	69	145.3 Å²	145.3	71%	0.711	82%	0.82	S	S	*	*			trans	-167	114.2	172.4	0	0	0	0	0	113	G531	G529-G531 PolarHBondContact O-N 3.38Å
530	R	30.3	Very low	30.2	Very low	253 Å²	253	140.3 Å²	140.3	96%	0.955	82%	0.817	S	S	*	*			trans	-69.8	105.8	-167.2	-70.5	179	173.1	-171.4	-1.7	115.1
531	G	29.3	Very low	31.2	Very low	72 Å²	72	144.3 Å²	144.3	74%	0.742	82%	0.82	S	S	*	*				66.1	120.3	120.5	0	0	0	0	0	121.7	G529	G529-G531 PolarHBondContact O-N 3.38Å
532	R	30.5	Very low	31.9	Very low	257 Å²	257	143.2 Å²	143.2	97%	0.97	81%	0.813	S	S	*	*			trans	-146	145.4	137.4	-107.6	177.2	-172.2	-135.5	0.1	110.2
533	R	33.8	Very low	32.7	Very low	209 Å²	209	146 Å²	146	79%	0.789	81%	0.813	S	S	*	*			trans	-98.4	124.3	-175	-169.7	-178.2	-167	-80.7	-5.3	109.7	E535	R533-E535 IonicContact CZ-OE1 2.88Å; R533-E535 IonicContact NH1-OE1 3.81Å; R533-E535 PolarHBondContact NH1-OE1 3.44Å; R533-E535 IonicContact NH2-OE1 2.67Å; R533-E535 PolarHBondContact NH2-OE1 3.49Å
534	A	31.3	Very low	34	Very low	100 Å²	100	142.7 Å²	142.7	83%	0.826	81%	0.807	S	S	*	*			trans	-143.4	136.7	167.2	0	0	0	0	0	108.2
535	E	30.1	Very low	35.2	Very low	149 Å²	149	143.8 Å²	143.8	70%	0.696	81%	0.811	S	S	*	*			trans	-91.1	161.1	-167.1	-70.2	-168.3	161.3	0	0	114.5	R533 G537	R533-E535 IonicContact CZ-OE1 2.88Å; R533-E535 IonicContact NH1-OE1 3.81Å; R533-E535 PolarHBondContact NH1-OE1 3.44Å; R533-E535 IonicContact NH2-OE1 2.67Å; R533-E535 PolarHBondContact NH2-OE1 3.49Å; E535-G537 PolarHBondContact O-N 3.31Å
536	R	38.3	Very low	37.2	Very low	244 Å²	244	139.3 Å²	139.3	92%	0.921	79%	0.792	S	S	*	*			trans	-79.5	98.8	-177	179.2	-172.2	-64.6	-133.5	-1.5	110.5
537	G	27.2	Very low	39.7	Very low	74 Å²	74	137.3 Å²	137.3	76%	0.763	76%	0.764	S	S	*	*			trans	-94.9	113.8	173	0	0	0	0	0	113.1	E535	E535-G537 PolarHBondContact O-N 3.31Å
538	S	36.2	Very low	42.3	Very low	99 Å²	99	137 Å²	137	69%	0.692	75%	0.747	S	S	*	*			trans	-82.8	131.5	168.7	-62.6	0	0	0	0	110.5	S540	S538-S540 PolarHBondContact O-N 3.02Å
539	P	40.7	Very low	44.9	Very low	130 Å²	130	135.6 Å²	135.6	84%	0.844	73%	0.726	S	S	*	*			trans	-78.2	87.2	174.1	31.5	-33.4	0	0	0	110.7
540	S	33.6	Very low	47.6	Very low	107 Å²	107	135.2 Å²	135.2	75%	0.748	71%	0.707	S	S	*	*			trans	-55.6	144.5	161.9	-64.5	0	0	0	0	110	S538 S542	S538-S540 PolarHBondContact O-N 3.02Å; S540-S542 PolarHBondContact O-N 3.34Å
541	R	45.4	Very low	50.3	Low	254 Å²	254	127.5 Å²	127.5	96%	0.958	69%	0.685	S	S	*	*			trans	-65.4	102.5	174.5	-75.7	-177.4	172.2	-172.8	-1.9	110	N543	R541-N543 PolarHBondContact O-N 3.48Å
542	S	38.5	Very low	53.1	Low	79 Å²	79	130.3 Å²	130.3	55%	0.552	68%	0.677	S	S	*	*			trans	-63.4	126.2	161.9	45	0	0	0	0	108.7	S540 E544	S540-S542 PolarHBondContact O-N 3.34Å; S542-E544 PolarHBondContact O-N 2.9Å; S542-E544 PolarHBondContact OG-OE1 2.93Å
543	N	41.5	Very low	55.9	Low	163 Å²	163	122 Å²	122	87%	0.872	65%	0.649	S	S	*	*			trans	-83.7	64.6	171.9	-161.3	33.8	0	0	0	108.9	R541 V545	R541-N543 PolarHBondContact O-N 3.48Å; N543-V545 PolarHBondContact O-N 3.26Å
544	E	52.4	Low	58.6	Low	149 Å²	149	114.2 Å²	114.2	70%	0.696	62%	0.62	S	S	*	*			trans	-61	116.1	179.8	-82.4	162.1	-140.2	0	0	110.2	S542 I546	S542-E544 PolarHBondContact O-N 2.9Å; S542-E544 PolarHBondContact OG-OE1 2.93Å; E544-I546 PolarHBondContact O-N 3.37Å
545	V	60	Low	61.4	Low	141 Å²	141	112.2 Å²	112.2	86%	0.855	60%	0.603	S	S	*	*			trans	-64.4	104.9	177.1	-179.9	0	0	0	0	108.3	N543 S547	N543-V545 PolarHBondContact O-N 3.26Å; V545-S547 PolarHBondContact O-N 3.03Å; V545-S547 VanDerWaalsContact O-N 3.16Å
546	I	71.4	Confident	64.2	Low	78 Å²	78	107.7 Å²	107.7	40%	0.4	59%	0.592	S	S	.	*			trans	-59.3	119.6	-178.6	-55.1	174.2	0	0	0	108.4	E544 I550 L551	E544-I546 PolarHBondContact O-N 3.37Å; I546-I550 HydrophobicContact CG2-CB 3.83Å; I546-I550 HydrophobicContact CG2-CG2 3.69Å; I546-L551 HydrophobicContact CB-CD2 4.37Å; I546-L551 HydrophobicContact CB-CG 4.49Å; I546-L551 HydrophobicContact CG2-CD2 3.82Å; I546-L551 HydrophobicContact CG2-CG 3.92Å
547	S	80.4	Confident	66.8	Low	41 Å²	41	96.8 Å²	96.8	29%	0.287	55%	0.552	S	S	.	*			trans	-59.6	146.1	-176.4	119.9	0	0	0	0	111.2	V545 E549 I550 L551	V545-S547 PolarHBondContact O-N 3.03Å; V545-S547 VanDerWaalsContact O-N 3.16Å; S547-E549 PolarHBondContact O-N 3.08Å; S547-E549 WeakPolarHBondContact OG-CB 3.24Å; S547-E549 PolarHBondContact OG-N 3.02Å; S547-E549 VanDerWaalsContact OG-N 3.17Å; S547-E549 PolarHBondContact OG-OE2 3.02Å; S547-I550 WeakPolarHBondContact O-CB 3.36Å; S547-I550 PolarHBondContact O-N 2.93Å; S547-L551 PolarHBondContact O-N 3.25Å; S547-L551 VanDerWaalsContact O-N 3.1Å
548	P	80.6	Confident	69.9	Low	75 Å²	75	96.2 Å²	96.2	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-55.4	-26.9	177	-25.5	34.5	0	0	0	113.5	L551 K552	P548-L551 PolarHBondContact O-N 2.82Å; P548-K552 WeakPolarHBondContact O-CB 3.25Å; P548-K552 WeakPolarHBondContact O-CD 3.37Å; P548-K552 WeakPolarHBondContact O-CG 3.49Å; P548-K552 PolarHBondContact O-N 3.12Å
549	E	84.3	Confident	72.5	Confident	104 Å²	104	95.3 Å²	95.3	49%	0.486	52%	0.521	S	S	.	.	H	α-helix	trans	-72.3	-40.7	179.2	-63.6	53.2	-112.7	0	0	110.5	S547 L551 K552 M553	S547-E549 PolarHBondContact O-N 3.08Å; S547-E549 WeakPolarHBondContact OG-CB 3.24Å; S547-E549 PolarHBondContact OG-N 3.02Å; S547-E549 VanDerWaalsContact OG-N 3.17Å; S547-E549 PolarHBondContact OG-OE2 3.02Å; E549-L551 VanDerWaalsContact C-N 3.33Å; E549-K552 PolarHBondContact O-N 2.98Å; E549-K552 IonicContact OE1-NZ 2.72Å; E549-K552 PolarHBondContact OE1-NZ 3.06Å; E549-M553 VanDerWaalsContact O-CB 3.32Å; E549-M553 WeakPolarHBondContact O-CB 3.43Å; E549-M553 PolarHBondContact O-N 3.49Å
550	I	84.3	Confident	75	Confident	61 Å²	61	93.7 Å²	93.7	31%	0.313	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-39.5	173.1	-59.6	172.9	0	0	0	110	I546 S547 M553 R554 D578	I546-I550 HydrophobicContact CG2-CB 3.83Å; I546-I550 HydrophobicContact CG2-CG2 3.69Å; S547-I550 WeakPolarHBondContact O-CB 3.36Å; S547-I550 PolarHBondContact O-N 2.93Å; I550-M553 HydrophobicContact CG2-CE 4.43Å; I550-M553 PolarHBondContact O-N 3.22Å; I550-R554 HydrophobicContact CG2-CG 4.45Å; I550-R554 WeakPolarHBondContact O-CB 3.38Å; I550-R554 VanDerWaalsContact O-CG 3.29Å; I550-R554 WeakPolarHBondContact O-CG 3.43Å; I550-R554 PolarHBondContact O-N 2.93Å; I550-D578 WeakPolarHBondContact CG2-OD1 3.31Å
551	L	86.5	Confident	77.9	Confident	92 Å²	92	88.8 Å²	88.8	48%	0.482	47%	0.469	S	S	.	.	H	α-helix	trans	-65.4	-46.2	174.9	-65.3	175.9	0	0	0	112	I546 S547 P548 E549 M553 R554 A555	I546-L551 HydrophobicContact CB-CD2 4.37Å; I546-L551 HydrophobicContact CB-CG 4.49Å; I546-L551 HydrophobicContact CG2-CD2 3.82Å; I546-L551 HydrophobicContact CG2-CG 3.92Å; S547-L551 PolarHBondContact O-N 3.25Å; S547-L551 VanDerWaalsContact O-N 3.1Å; P548-L551 PolarHBondContact O-N 2.82Å; E549-L551 VanDerWaalsContact C-N 3.33Å; L551-M553 VanDerWaalsContact C-N 3.34Å; L551-M553 PolarHBondContact O-N 2.97Å; L551-R554 PolarHBondContact O-N 3.34Å; L551-A555 WeakPolarHBondContact O-CB 3.31Å; L551-A555 PolarHBondContact O-N 3.21Å
552	K	87.9	Confident	80	Confident	131 Å²	131	79.7 Å²	79.7	57%	0.57	44%	0.442	S	S	*	.	H	α-helix	trans	-57.7	-45	173.5	-69.6	158.6	-162.3	162.6	0	111.3	P548 E549 A555 A556	P548-K552 WeakPolarHBondContact O-CB 3.25Å; P548-K552 WeakPolarHBondContact O-CD 3.37Å; P548-K552 WeakPolarHBondContact O-CG 3.49Å; P548-K552 PolarHBondContact O-N 3.12Å; E549-K552 PolarHBondContact O-N 2.98Å; E549-K552 IonicContact OE1-NZ 2.72Å; E549-K552 PolarHBondContact OE1-NZ 3.06Å; K552-A555 PolarHBondContact O-N 3Å; K552-A556 PolarHBondContact O-N 2.69Å
553	M	90.6	Very high	82.5	Confident	81 Å²	81	85.7 Å²	85.7	40%	0.399	45%	0.454	S	S	.	.	H	α-helix	trans	-62	-47.7	176.4	-178.8	-172.7	67.1	0	0	111.7	E549 I550 L551 A555 A556 L557 D578	E549-M553 VanDerWaalsContact O-CB 3.32Å; E549-M553 WeakPolarHBondContact O-CB 3.43Å; E549-M553 PolarHBondContact O-N 3.49Å; I550-M553 HydrophobicContact CG2-CE 4.43Å; I550-M553 PolarHBondContact O-N 3.22Å; L551-M553 VanDerWaalsContact C-N 3.34Å; L551-M553 PolarHBondContact O-N 2.97Å; M553-A555 VanDerWaalsContact C-N 3.32Å; M553-A555 PolarHBondContact O-N 3.26Å; M553-A556 PolarHBondContact O-N 2.8Å; M553-L557 HydrophobicContact CG-CD1 4.01Å; M553-L557 HydrophobicContact CG-CG 4.42Å; M553-L557 WeakPolarHBondContact O-CB 3.12Å; M553-L557 WeakPolarHBondContact O-CG 3.45Å; M553-L557 PolarHBondContact O-N 2.92Å; M553-D578 HydrophobicContact CE-CB 3.64Å
554	R	89.1	Confident	84.9	Confident	47 Å²	47	80.5 Å²	80.5	18%	0.177	43%	0.426	C	S	.	.	H	α-helix	trans	-63.7	-36.6	178.6	-73.5	177.8	-174	-179.8	9.7	112.2	I550 L551 F558 D578 V582	I550-R554 HydrophobicContact CG2-CG 4.45Å; I550-R554 WeakPolarHBondContact O-CB 3.38Å; I550-R554 VanDerWaalsContact O-CG 3.29Å; I550-R554 WeakPolarHBondContact O-CG 3.43Å; I550-R554 PolarHBondContact O-N 2.93Å; L551-R554 PolarHBondContact O-N 3.34Å; R554-F558 WeakPolarHBondContact O-CB 3.37Å; R554-F558 PolarHBondContact O-N 2.89Å; R554-D578 HydrophobicContact CG-CB 4.48Å; R554-D578 IonicContact CZ-OD1 3.41Å; R554-D578 IonicContact NE-OD1 2.72Å; R554-D578 PolarHBondContact NE-OD1 2.96Å; R554-D578 IonicContact NH2-OD1 3.18Å; R554-D578 PolarHBondContact NH2-OD1 3.34Å; R554-V582 HydrophobicContact CB-CG2 3.8Å; R554-V582 HydrophobicContact CG-CG2 3.89Å
555	A	89.9	Confident	86.7	Confident	57 Å²	57	77.1 Å²	77.1	47%	0.471	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-43.4	173.3	0	0	0	0	0	112.1	L551 K552 M553 F558 C559	L551-A555 WeakPolarHBondContact O-CB 3.31Å; L551-A555 PolarHBondContact O-N 3.21Å; K552-A555 PolarHBondContact O-N 3Å; M553-A555 VanDerWaalsContact C-N 3.32Å; M553-A555 PolarHBondContact O-N 3.26Å; A555-F558 WeakPolarHBondContact O-CB 3.38Å; A555-F558 PolarHBondContact O-N 2.65Å; A555-C559 PolarHBondContact O-N 2.86Å; A555-C559 VanDerWaalsContact O-N 3.12Å; A555-C559 PolarHBondContact O-SG 2.92Å
556	A	89.5	Confident	88.2	Confident	55 Å²	55	70.7 Å²	70.7	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-44.7	174.8	0	0	0	0	0	112.1	K552 M553 F558 C559 I560	K552-A556 PolarHBondContact O-N 2.69Å; M553-A556 PolarHBondContact O-N 2.8Å; A556-F558 VanDerWaalsContact C-N 3.29Å; A556-F558 PolarHBondContact O-N 2.7Å; A556-C559 PolarHBondContact O-N 2.77Å; A556-I560 WeakPolarHBondContact O-CG1 3.5Å; A556-I560 PolarHBondContact O-N 2.76Å; A556-I560 VanDerWaalsContact O-N 3.12Å
557	L	92.6	Very high	89.2	Confident	15 Å²	15	75.4 Å²	75.4	8%	0.079	39%	0.386	C	S	.	.	H	α-helix	trans	-59.6	-39.4	173.6	-71.8	169.9	0	0	0	111.6	M553 I560 F561 W579 V582	M553-L557 HydrophobicContact CG-CD1 4.01Å; M553-L557 HydrophobicContact CG-CG 4.42Å; M553-L557 WeakPolarHBondContact O-CB 3.12Å; M553-L557 WeakPolarHBondContact O-CG 3.45Å; M553-L557 PolarHBondContact O-N 2.92Å; L557-I560 PolarHBondContact O-N 3.02Å; L557-I560 VanDerWaalsContact O-N 3.16Å; L557-F561 HydrophobicContact CB-CE1 4.48Å; L557-F561 HydrophobicContact CB-CZ 4.38Å; L557-F561 HydrophobicContact CD2-CE1 4.01Å; L557-F561 HydrophobicContact CD2-CZ 4.09Å; L557-F561 WeakPolarHBondContact O-CB 3.49Å; L557-F561 VanDerWaalsContact O-CD1 3.23Å; L557-F561 WeakPolarHBondContact O-CD1 3.44Å; L557-F561 WeakPolarHBondContact O-CG 3.47Å; L557-F561 PolarHBondContact O-N 3.47Å; L557-W579 VanDerWaalsContact CD1-CD1 3.47Å; L557-W579 HydrophobicContact CD1-CG 4.32Å; L557-W579 HydrophobicContact CD2-CD2 4.36Å; L557-W579 HydrophobicContact CD2-CZ2 4.05Å; L557-V582 HydrophobicContact CB-CB 4.46Å; L557-V582 HydrophobicContact CB-CG1 4.17Å; L557-V582 HydrophobicContact CB-CG2 4.28Å
558	F	92.4	Very high	89.8	Confident	62 Å²	62	76.5 Å²	76.5	27%	0.272	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-46.9	177.4	178.6	-98.3	0	0	0	111.3	R554 A555 A556 I560 F561 T562 V582 H585 A587 V588	R554-F558 WeakPolarHBondContact O-CB 3.37Å; R554-F558 PolarHBondContact O-N 2.89Å; A555-F558 WeakPolarHBondContact O-CB 3.38Å; A555-F558 PolarHBondContact O-N 2.65Å; A556-F558 VanDerWaalsContact C-N 3.29Å; A556-F558 PolarHBondContact O-N 2.7Å; F558-I560 PolarHBondContact O-N 3.09Å; F558-F561 PolarHBondContact O-N 2.91Å; F558-T562 HydrophobicContact CE1-CG2 4.21Å; F558-T562 HydrophobicContact CZ-CG2 4.1Å; F558-T562 PolarHBondContact O-N 3.29Å; F558-T562 VanDerWaalsContact O-N 3.13Å; F558-T562 PolarHBondContact O-OG1 3.2Å; F558-V582 VanDerWaalsContact CA-CG1 3.48Å; F558-V582 HydrophobicContact CB-CG1 3.79Å; F558-V582 HydrophobicContact CD2-CG1 4.28Å; F558-H585 AromaticContact CE2-ND1 3.64Å; F558-A587 HydrophobicContact CE2-CB 3.77Å; F558-A587 HydrophobicContact CZ-CB 3.6Å; F558-V588 HydrophobicContact CD2-CG1 3.62Å; F558-V588 HydrophobicContact CE2-CG1 3.52Å; F558-V588 HydrophobicContact CZ-CG1 4.48Å
559	C	91.6	Very high	90.4	Very high	79 Å²	79	73 Å²	73	53%	0.534	37%	0.369	S	S	.	.	H	α-helix	trans	-64.7	-22.4	175.8	-64.6	0	0	0	0	114.2	A555 A556 T562 Y563	A555-C559 PolarHBondContact O-N 2.86Å; A555-C559 VanDerWaalsContact O-N 3.12Å; A555-C559 PolarHBondContact O-SG 2.92Å; A556-C559 PolarHBondContact O-N 2.77Å; C559-T562 PolarHBondContact O-OG1 3.49Å; C559-T562 VanDerWaalsContact O-OG1 3.14Å; C559-Y563 VanDerWaalsContact O-CD2 3.23Å; C559-Y563 WeakPolarHBondContact O-CD2 3.36Å; C559-Y563 VanDerWaalsContact O-CE2 3.23Å; C559-Y563 WeakPolarHBondContact O-CE2 3.35Å
560	I	92.6	Very high	90.8	Very high	97 Å²	97	70 Å²	70	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-81.2	-45.3	171.4	-64.8	163.4	0	0	0	109.9	A556 L557 F558 T562 Y563	A556-I560 WeakPolarHBondContact O-CG1 3.5Å; A556-I560 PolarHBondContact O-N 2.76Å; A556-I560 VanDerWaalsContact O-N 3.12Å; L557-I560 PolarHBondContact O-N 3.02Å; L557-I560 VanDerWaalsContact O-N 3.16Å; F558-I560 PolarHBondContact O-N 3.09Å; I560-T562 VanDerWaalsContact C-N 3.27Å; I560-T562 PolarHBondContact O-N 2.94Å; I560-Y563 PolarHBondContact O-N 2.68Å
561	F	94	Very high	91.3	Very high	3 Å²	3	70.4 Å²	70.4	1%	0.013	36%	0.357	C	S	.	.	H	α-helix	trans	-68.6	-23.7	-172.4	-71.9	9.5	0	0	0	113.1	L557 F558 Y563 L564 L569 A572 W579 V582 A583 V588	L557-F561 HydrophobicContact CB-CE1 4.48Å; L557-F561 HydrophobicContact CB-CZ 4.38Å; L557-F561 HydrophobicContact CD2-CE1 4.01Å; L557-F561 HydrophobicContact CD2-CZ 4.09Å; L557-F561 WeakPolarHBondContact O-CB 3.49Å; L557-F561 VanDerWaalsContact O-CD1 3.23Å; L557-F561 WeakPolarHBondContact O-CD1 3.44Å; L557-F561 WeakPolarHBondContact O-CG 3.47Å; L557-F561 PolarHBondContact O-N 3.47Å; F558-F561 PolarHBondContact O-N 2.91Å; F561-Y563 PolarHBondContact O-N 3.19Å; F561-Y563 VanDerWaalsContact O-N 3.12Å; F561-L564 HydrophobicContact CB-CD1 4.37Å; F561-L564 HydrophobicContact CD1-CD1 3.46Å; F561-L564 VanDerWaalsContact CD1-CD1 3.46Å; F561-L564 HydrophobicContact CD1-CG 4.41Å; F561-L564 HydrophobicContact CE1-CD1 3.98Å; F561-L564 HydrophobicContact CG-CD1 4.02Å; F561-L564 PolarHBondContact O-N 3.35Å; F561-L564 VanDerWaalsContact O-N 3.11Å; F561-L569 HydrophobicContact CB-CD2 3.92Å; F561-L569 HydrophobicContact CD2-CD2 4.43Å; F561-L569 HydrophobicContact CG-CD2 4.29Å; F561-A572 HydrophobicContact CE1-CB 4.36Å; F561-A572 HydrophobicContact CE2-CB 4.27Å; F561-A572 HydrophobicContact CZ-CB 3.98Å; F561-W579 HydrophobicContact CE1-CD2 4.46Å; F561-W579 HydrophobicContact CE1-CE3 4.23Å; F561-W579 HydrophobicContact CE1-CZ3 4.43Å; F561-W579 HydrophobicContact CE2-CB 4.43Å; F561-W579 HydrophobicContact CZ-CB 4.14Å; F561-W579 AromaticContact CZ-CD2 3.8Å; F561-W579 HydrophobicContact CZ-CD2 3.8Å; F561-W579 AromaticContact CZ-CE3 3.76Å; F561-W579 HydrophobicContact CZ-CE3 3.76Å; F561-W579 AromaticContact CZ-CG 3.99Å; F561-W579 HydrophobicContact CZ-CG 3.99Å; F561-W579 HydrophobicContact CZ-CZ3 4.39Å; F561-V582 HydrophobicContact CD2-CB 3.99Å; F561-V582 HydrophobicContact CD2-CG1 3.59Å; F561-V582 HydrophobicContact CE2-CB 3.94Å; F561-V582 HydrophobicContact CE2-CG1 4.02Å; F561-V582 HydrophobicContact CG-CG1 4.32Å; F561-A583 HydrophobicContact CD2-CB 3.88Å; F561-A583 HydrophobicContact CE2-CB 3.73Å; F561-V588 HydrophobicContact CB-CB 4.49Å; F561-V588 HydrophobicContact CB-CG1 3.89Å
562	T	90.2	Very high	91.7	Very high	64 Å²	64	66.3 Å²	66.3	39%	0.393	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-11.6	169.3	47.5	0	0	0	0	114.8	F558 C559 I560 V588	F558-T562 HydrophobicContact CE1-CG2 4.21Å; F558-T562 HydrophobicContact CZ-CG2 4.1Å; F558-T562 PolarHBondContact O-N 3.29Å; F558-T562 VanDerWaalsContact O-N 3.13Å; F558-T562 PolarHBondContact O-OG1 3.2Å; C559-T562 PolarHBondContact O-OG1 3.49Å; C559-T562 VanDerWaalsContact O-OG1 3.14Å; I560-T562 VanDerWaalsContact C-N 3.27Å; I560-T562 PolarHBondContact O-N 2.94Å; T562-V588 HydrophobicContact CG2-CG1 4.25Å
563	Y	90.2	Very high	91.9	Very high	205 Å²	205	60.3 Å²	60.3	80%	0.804	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-3.8	174.6	-61.3	-82	0	0	0	113.9	C559 I560 F561	C559-Y563 VanDerWaalsContact O-CD2 3.23Å; C559-Y563 WeakPolarHBondContact O-CD2 3.36Å; C559-Y563 VanDerWaalsContact O-CE2 3.23Å; C559-Y563 WeakPolarHBondContact O-CE2 3.35Å; I560-Y563 PolarHBondContact O-N 2.68Å; F561-Y563 PolarHBondContact O-N 3.19Å; F561-Y563 VanDerWaalsContact O-N 3.12Å
564	L	91.9	Very high	92	Very high	54 Å²	54	62.1 Å²	62.1	28%	0.283	32%	0.318	S	S	.	.	S	Bend	trans	-82.5	147.7	179.5	-63.7	-178.2	0	0	0	111.1	F561 T568 L569 A572	F561-L564 HydrophobicContact CB-CD1 4.37Å; F561-L564 HydrophobicContact CD1-CD1 3.46Å; F561-L564 VanDerWaalsContact CD1-CD1 3.46Å; F561-L564 HydrophobicContact CD1-CG 4.41Å; F561-L564 HydrophobicContact CE1-CD1 3.98Å; F561-L564 HydrophobicContact CG-CD1 4.02Å; F561-L564 PolarHBondContact O-N 3.35Å; F561-L564 VanDerWaalsContact O-N 3.11Å; L564-T568 HydrophobicContact CD1-CG2 4.23Å; L564-T568 HydrophobicContact CD2-CG2 3.92Å; L564-T568 HydrophobicContact CG-CG2 4.49Å; L564-L569 HydrophobicContact CB-CD2 3.95Å; L564-L569 HydrophobicContact CB-CG 3.88Å; L564-L569 HydrophobicContact CD1-CD2 4.24Å; L564-A572 HydrophobicContact CD1-CB 4.39Å
565	D	90.4	Very high	92.3	Very high	77 Å²	77	64.4 Å²	64.4	41%	0.412	34%	0.337	S	S	.	.			trans	-77.9	167.9	173.6	89.1	-62.6	0	0	0	111.5	R567 T568 L569	D565-R567 PolarHBondContact O-N 3.42Å; D565-R567 VanDerWaalsContact OD2-CB 3.24Å; D565-R567 WeakPolarHBondContact OD2-CB 3.2Å; D565-R567 PolarHBondContact OD2-N 2.61Å; D565-T568 PolarHBondContact O-N 3.12Å; D565-T568 WeakPolarHBondContact OD1-CB 3.44Å; D565-T568 PolarHBondContact OD1-N 3.01Å; D565-T568 PolarHBondContact OD1-OG1 3.03Å; D565-L569 WeakPolarHBondContact O-CB 3.41Å; D565-L569 WeakPolarHBondContact O-CG 3.45Å; D565-L569 PolarHBondContact O-N 3.04Å
566	T	91.9	Very high	92.4	Very high	6 Å²	6	63.9 Å²	63.9	4%	0.037	33%	0.329	C	S	.	.	H	α-helix	trans	-54.3	-37.1	178.4	-69.3	0	0	0	0	113.3	L570 W589 V592 L593 L594	T566-L570 VanDerWaalsContact O-CG 3.31Å; T566-L570 WeakPolarHBondContact O-CG 3.44Å; T566-L570 PolarHBondContact O-N 3.14Å; T566-W589 HydrophobicContact CG2-CZ3 4.02Å; T566-V592 WeakPolarHBondContact OG1-CA 3.48Å; T566-L593 VanDerWaalsContact CB-O 3.24Å; T566-L593 WeakPolarHBondContact CB-O 3.27Å; T566-L593 VanDerWaalsContact CG2-O 3.24Å; T566-L593 WeakPolarHBondContact CG2-O 3.22Å; T566-L593 PolarHBondContact OG1-N 3.46Å; T566-L594 HydrophobicContact CG2-CD2 3.65Å; T566-L594 HydrophobicContact CG2-CG 4.46Å
567	R	91.8	Very high	92.6	Very high	177 Å²	177	71.4 Å²	71.4	67%	0.668	35%	0.346	S	S	*	.	H	α-helix	trans	-73.8	-44.2	179.3	-171.6	176.9	177.2	175.4	-1.4	111.9	D565 L569 L570 H571	D565-R567 PolarHBondContact O-N 3.42Å; D565-R567 VanDerWaalsContact OD2-CB 3.24Å; D565-R567 WeakPolarHBondContact OD2-CB 3.2Å; D565-R567 PolarHBondContact OD2-N 2.61Å; R567-L569 VanDerWaalsContact C-N 3.34Å; R567-L569 PolarHBondContact O-N 2.94Å; R567-L570 PolarHBondContact O-N 2.97Å; R567-H571 PolarHBondContact O-CD2 2.7Å; R567-H571 PolarHBondContact O-N 3.21Å
568	T	93.7	Very high	92.5	Very high	65 Å²	65	72.3 Å²	72.3	40%	0.399	35%	0.351	S	S	.	.	H	α-helix	trans	-70.1	-31.4	179.3	-49.5	0	0	0	0	111.8	L564 D565 L570 H571 A572	L564-T568 HydrophobicContact CD1-CG2 4.23Å; L564-T568 HydrophobicContact CD2-CG2 3.92Å; L564-T568 HydrophobicContact CG-CG2 4.49Å; D565-T568 PolarHBondContact O-N 3.12Å; D565-T568 WeakPolarHBondContact OD1-CB 3.44Å; D565-T568 PolarHBondContact OD1-N 3.01Å; D565-T568 PolarHBondContact OD1-OG1 3.03Å; T568-L570 PolarHBondContact O-N 3.28Å; T568-H571 PolarHBondContact O-N 3.03Å; T568-A572 VanDerWaalsContact O-CB 3.27Å; T568-A572 WeakPolarHBondContact O-CB 3.48Å; T568-A572 PolarHBondContact O-N 3.21Å
569	L	93.9	Very high	92.6	Very high	2 Å²	2	73.8 Å²	73.8	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-61.5	-40	170.7	-77.7	174.3	0	0	0	112.8	F561 L564 D565 R567 A572 A573 V588 W589	F561-L569 HydrophobicContact CB-CD2 3.92Å; F561-L569 HydrophobicContact CD2-CD2 4.43Å; F561-L569 HydrophobicContact CG-CD2 4.29Å; L564-L569 HydrophobicContact CB-CD2 3.95Å; L564-L569 HydrophobicContact CB-CG 3.88Å; L564-L569 HydrophobicContact CD1-CD2 4.24Å; D565-L569 WeakPolarHBondContact O-CB 3.41Å; D565-L569 WeakPolarHBondContact O-CG 3.45Å; D565-L569 PolarHBondContact O-N 3.04Å; R567-L569 VanDerWaalsContact C-N 3.34Å; R567-L569 PolarHBondContact O-N 2.94Å; L569-A572 PolarHBondContact O-N 3.36Å; L569-A573 PolarHBondContact O-N 3.26Å; L569-A573 VanDerWaalsContact O-N 3.08Å; L569-V588 HydrophobicContact CD1-CG2 4.34Å; L569-V588 HydrophobicContact CD2-CB 4.36Å; L569-V588 HydrophobicContact CD2-CG2 4.06Å; L569-W589 HydrophobicContact CB-CH2 3.81Å; L569-W589 HydrophobicContact CB-CZ2 3.82Å; L569-W589 HydrophobicContact CD1-CD2 4.41Å; L569-W589 HydrophobicContact CD1-CE3 4.42Å; L569-W589 HydrophobicContact CD1-CH2 4.28Å; L569-W589 HydrophobicContact CD1-CZ2 4.27Å; L569-W589 HydrophobicContact CD1-CZ3 4.35Å
570	L	92.6	Very high	92.7	Very high	40 Å²	40	74.1 Å²	74.1	21%	0.209	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-47.6	175.6	-68.6	166.1	0	0	0	111	T566 R567 T568 A573 W589 F603 L607 W610	T566-L570 VanDerWaalsContact O-CG 3.31Å; T566-L570 WeakPolarHBondContact O-CG 3.44Å; T566-L570 PolarHBondContact O-N 3.14Å; R567-L570 PolarHBondContact O-N 2.97Å; T568-L570 PolarHBondContact O-N 3.28Å; L570-A573 WeakPolarHBondContact O-CB 3.5Å; L570-A573 PolarHBondContact O-N 2.96Å; L570-A573 VanDerWaalsContact O-N 3.16Å; L570-W589 HydrophobicContact CD2-CH2 4.09Å; L570-W589 HydrophobicContact CG-CH2 4.15Å; L570-F603 HydrophobicContact CD1-CE2 4.35Å; L570-F603 HydrophobicContact CD1-CZ 3.88Å; L570-F603 HydrophobicContact CD2-CE2 4.25Å; L570-F603 HydrophobicContact CD2-CZ 4.32Å; L570-L607 HydrophobicContact CD2-CD1 4.45Å; L570-W610 HydrophobicContact CD2-CZ3 4.09Å
571	H	93.9	Very high	92.7	Very high	70 Å²	70	75.5 Å²	75.5	32%	0.324	35%	0.347	S	S	.	.	H	α-helix	trans	-66.4	-36.3	176.7	-67	-48.8	0	0	0	112.9	R567 T568 A573 E574 V575	R567-H571 PolarHBondContact O-CD2 2.7Å; R567-H571 PolarHBondContact O-N 3.21Å; T568-H571 PolarHBondContact O-N 3.03Å; H571-A573 PolarHBondContact O-N 3.14Å; H571-E574 WeakPolarHBondContact CA-OE2 3.39Å; H571-E574 IonicContact CE1-OE2 2.84Å; H571-E574 IonicContact CG-OE2 2.69Å; H571-E574 IonicContact ND1-OE2 2.7Å; H571-E574 PolarHBondContact ND1-OE2 2.99Å; H571-E574 WeakPolarHBondContact O-CB 3.33Å; H571-E574 PolarHBondContact O-N 2.76Å; H571-V575 PolarHBondContact O-N 3.24Å
572	A	94	Very high	92.7	Very high	5 Å²	5	75.6 Å²	75.6	4%	0.041	35%	0.348	C	S	.	.	H	α-helix	trans	-60.3	-34.8	172.6	0	0	0	0	0	111.7	F561 L564 T568 L569 E574 V575 W579 A583	F561-A572 HydrophobicContact CE1-CB 4.36Å; F561-A572 HydrophobicContact CE2-CB 4.27Å; F561-A572 HydrophobicContact CZ-CB 3.98Å; L564-A572 HydrophobicContact CD1-CB 4.39Å; T568-A572 VanDerWaalsContact O-CB 3.27Å; T568-A572 WeakPolarHBondContact O-CB 3.48Å; T568-A572 PolarHBondContact O-N 3.21Å; L569-A572 PolarHBondContact O-N 3.36Å; A572-E574 PolarHBondContact O-N 3.03Å; A572-V575 PolarHBondContact O-N 3.34Å; A572-W579 HydrophobicContact CB-CE3 3.99Å; A572-W579 HydrophobicContact CB-CZ3 4.39Å; A572-W579 WeakPolarHBondContact O-CB 3.46Å; A572-A583 HydrophobicContact CB-CB 4.33Å
573	A	92.9	Very high	92.9	Very high	5 Å²	5	72.5 Å²	72.5	4%	0.041	33%	0.329	C	S	.	.	H	α-helix	trans	-70.9	-9.2	174.2	0	0	0	0	0	114.1	L569 L570 H571 R580 A583	L569-A573 PolarHBondContact O-N 3.26Å; L569-A573 VanDerWaalsContact O-N 3.08Å; L570-A573 WeakPolarHBondContact O-CB 3.5Å; L570-A573 PolarHBondContact O-N 2.96Å; L570-A573 VanDerWaalsContact O-N 3.16Å; H571-A573 PolarHBondContact O-N 3.14Å; A573-R580 HydrophobicContact CB-CG 4.43Å; A573-R580 WeakPolarHBondContact O-CB 3.45Å; A573-R580 WeakPolarHBondContact O-CG 3.35Å; A573-R580 PolarHBondContact O-NE 3.01Å; A573-R580 PolarHBondContact O-NH2 2.74Å; A573-A583 HydrophobicContact CB-CB 3.85Å
574	E	93.6	Very high	93.1	Very high	120 Å²	120	68 Å²	68	56%	0.561	31%	0.311	S	S	*	.	H	α-helix	trans	-87.9	-36.7	176	-63.4	172.3	144.7	0	0	111.1	H571 A572 C576 R580	H571-E574 WeakPolarHBondContact CA-OE2 3.39Å; H571-E574 IonicContact CE1-OE2 2.84Å; H571-E574 IonicContact CG-OE2 2.69Å; H571-E574 IonicContact ND1-OE2 2.7Å; H571-E574 PolarHBondContact ND1-OE2 2.99Å; H571-E574 WeakPolarHBondContact O-CB 3.33Å; H571-E574 PolarHBondContact O-N 2.76Å; A572-E574 PolarHBondContact O-N 3.03Å; E574-C576 PolarHBondContact O-N 3.41Å; E574-R580 PolarHBondContact O-NH2 3.35Å
575	V	94.8	Very high	93.2	Very high	95 Å²	95	69.5 Å²	69.5	58%	0.576	32%	0.316	S	S	*	.	H	α-helix	trans	-50.6	-61.8	-171.9	179.4	0	0	0	0	115.1	H571 A572 W579	H571-V575 PolarHBondContact O-N 3.24Å; A572-V575 PolarHBondContact O-N 3.34Å; V575-W579 HydrophobicContact CB-CB 4.45Å; V575-W579 HydrophobicContact CB-CD2 4.14Å; V575-W579 HydrophobicContact CB-CE3 3.78Å; V575-W579 HydrophobicContact CB-CG 4.45Å; V575-W579 HydrophobicContact CB-CZ3 4.42Å; V575-W579 HydrophobicContact CG1-CD2 4.04Å; V575-W579 HydrophobicContact CG1-CE3 3.99Å; V575-W579 HydrophobicContact CG1-CG 4.46Å; V575-W579 HydrophobicContact CG1-CZ3 4.41Å; V575-W579 HydrophobicContact CG2-CE3 3.74Å; V575-W579 HydrophobicContact CG2-CZ3 3.98Å
576	C	92.4	Very high	93.3	Very high	45 Å²	45	67.3 Å²	67.3	30%	0.304	31%	0.306	S	S	.	.			trans	-152.5	176.2	-177.9	82.8	0	0	0	0	112.7	E574 W579 R580	E574-C576 PolarHBondContact O-N 3.41Å; C576-W579 PolarHBondContact SG-N 2.91Å; C576-W579 VanDerWaalsContact SG-N 3.38Å; C576-R580 WeakPolarHBondContact O-CB 3.4Å; C576-R580 PolarHBondContact O-N 3.27Å
577	R	92.4	Very high	93.3	Very high	213 Å²	213	68 Å²	68	80%	0.804	31%	0.313	S	S	*	.	H	α-helix	trans	-62	-44.9	-178.2	-69.8	-175.2	178.1	-173.8	0.4	112.6	R580 F581	R577-R580 PolarHBondContact O-N 3.09Å; R577-F581 PolarHBondContact O-N 2.91Å
578	D	90.9	Very high	93.4	Very high	35 Å²	35	60 Å²	60	19%	0.187	28%	0.283	C	S	.	.	H	α-helix	trans	-72	-42.3	-178.5	-63.5	-90.2	0	0	0	112.7	I550 M553 R554 R580 F581 V582	I550-D578 WeakPolarHBondContact CG2-OD1 3.31Å; M553-D578 HydrophobicContact CE-CB 3.64Å; R554-D578 HydrophobicContact CG-CB 4.48Å; R554-D578 IonicContact CZ-OD1 3.41Å; R554-D578 IonicContact NE-OD1 2.72Å; R554-D578 PolarHBondContact NE-OD1 2.96Å; R554-D578 IonicContact NH2-OD1 3.18Å; R554-D578 PolarHBondContact NH2-OD1 3.34Å; D578-R580 VanDerWaalsContact C-N 3.3Å; D578-R580 PolarHBondContact O-N 2.95Å; D578-F581 WeakPolarHBondContact O-CB 3.43Å; D578-F581 PolarHBondContact O-N 2.91Å; D578-F581 VanDerWaalsContact O-N 3.15Å; D578-V582 WeakPolarHBondContact O-CG2 3.29Å; D578-V582 PolarHBondContact O-N 3.27Å
579	W	94.9	Very high	93.5	Very high	92 Å²	92	56.9 Å²	56.9	35%	0.348	26%	0.264	S	S	.	.	H	α-helix	trans	-60.7	-42	172.5	-75.3	40.2	0	0	0	110.5	L557 F561 A572 V575 C576 F581 V582 A583	L557-W579 VanDerWaalsContact CD1-CD1 3.47Å; L557-W579 HydrophobicContact CD1-CG 4.32Å; L557-W579 HydrophobicContact CD2-CD2 4.36Å; L557-W579 HydrophobicContact CD2-CZ2 4.05Å; F561-W579 HydrophobicContact CE1-CD2 4.46Å; F561-W579 HydrophobicContact CE1-CE3 4.23Å; F561-W579 HydrophobicContact CE1-CZ3 4.43Å; F561-W579 HydrophobicContact CE2-CB 4.43Å; F561-W579 HydrophobicContact CZ-CB 4.14Å; F561-W579 AromaticContact CZ-CD2 3.8Å; F561-W579 HydrophobicContact CZ-CD2 3.8Å; F561-W579 AromaticContact CZ-CE3 3.76Å; F561-W579 HydrophobicContact CZ-CE3 3.76Å; F561-W579 AromaticContact CZ-CG 3.99Å; F561-W579 HydrophobicContact CZ-CG 3.99Å; F561-W579 HydrophobicContact CZ-CZ3 4.39Å; A572-W579 HydrophobicContact CB-CE3 3.99Å; A572-W579 HydrophobicContact CB-CZ3 4.39Å; A572-W579 WeakPolarHBondContact O-CB 3.46Å; V575-W579 HydrophobicContact CB-CB 4.45Å; V575-W579 HydrophobicContact CB-CD2 4.14Å; V575-W579 HydrophobicContact CB-CE3 3.78Å; V575-W579 HydrophobicContact CB-CG 4.45Å; V575-W579 HydrophobicContact CB-CZ3 4.42Å; V575-W579 HydrophobicContact CG1-CD2 4.04Å; V575-W579 HydrophobicContact CG1-CE3 3.99Å; V575-W579 HydrophobicContact CG1-CG 4.46Å; V575-W579 HydrophobicContact CG1-CZ3 4.41Å; V575-W579 HydrophobicContact CG2-CE3 3.74Å; V575-W579 HydrophobicContact CG2-CZ3 3.98Å; C576-W579 PolarHBondContact SG-N 2.91Å; C576-W579 VanDerWaalsContact SG-N 3.38Å; W579-F581 VanDerWaalsContact C-N 3.32Å; W579-F581 PolarHBondContact O-N 3.3Å; W579-V582 PolarHBondContact O-N 2.99Å; W579-A583 WeakPolarHBondContact O-CB 3.3Å; W579-A583 PolarHBondContact O-N 3.48Å
580	R	93.9	Very high	93.6	Very high	87 Å²	87	59.2 Å²	59.2	33%	0.328	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-32.4	174.2	-173	177.4	-58.6	131.2	15.7	114.1	A573 E574 C576 R577 D578 R584	A573-R580 HydrophobicContact CB-CG 4.43Å; A573-R580 WeakPolarHBondContact O-CB 3.45Å; A573-R580 WeakPolarHBondContact O-CG 3.35Å; A573-R580 PolarHBondContact O-NE 3.01Å; A573-R580 PolarHBondContact O-NH2 2.74Å; E574-R580 PolarHBondContact O-NH2 3.35Å; C576-R580 WeakPolarHBondContact O-CB 3.4Å; C576-R580 PolarHBondContact O-N 3.27Å; R577-R580 PolarHBondContact O-N 3.09Å; D578-R580 VanDerWaalsContact C-N 3.3Å; D578-R580 PolarHBondContact O-N 2.95Å; R580-R584 WeakPolarHBondContact O-CB 3.29Å; R580-R584 WeakPolarHBondContact O-CD 3.33Å; R580-R584 VanDerWaalsContact O-CG 3.23Å; R580-R584 WeakPolarHBondContact O-CG 3.49Å; R580-R584 PolarHBondContact O-N 3.29Å
581	F	92.4	Very high	93.7	Very high	125 Å²	125	66.5 Å²	66.5	55%	0.548	30%	0.304	S	S	.	.	H	α-helix	trans	-67.4	-48.2	174.2	-177.9	-91.7	0	0	0	110.8	R577 D578 W579	R577-F581 PolarHBondContact O-N 2.91Å; D578-F581 WeakPolarHBondContact O-CB 3.43Å; D578-F581 PolarHBondContact O-N 2.91Å; D578-F581 VanDerWaalsContact O-N 3.15Å; W579-F581 VanDerWaalsContact C-N 3.32Å; W579-F581 PolarHBondContact O-N 3.3Å
582	V	94	Very high	93.8	Very high	5 Å²	5	63.3 Å²	63.3	3%	0.03	29%	0.289	C	S	.	.	H	α-helix	trans	-72.6	-43.5	-178.3	-177.7	0	0	0	0	112.1	R554 L557 F558 F561 D578 W579 R584 H585	R554-V582 HydrophobicContact CB-CG2 3.8Å; R554-V582 HydrophobicContact CG-CG2 3.89Å; L557-V582 HydrophobicContact CB-CB 4.46Å; L557-V582 HydrophobicContact CB-CG1 4.17Å; L557-V582 HydrophobicContact CB-CG2 4.28Å; F558-V582 VanDerWaalsContact CA-CG1 3.48Å; F558-V582 HydrophobicContact CB-CG1 3.79Å; F558-V582 HydrophobicContact CD2-CG1 4.28Å; F561-V582 HydrophobicContact CD2-CB 3.99Å; F561-V582 HydrophobicContact CD2-CG1 3.59Å; F561-V582 HydrophobicContact CE2-CB 3.94Å; F561-V582 HydrophobicContact CE2-CG1 4.02Å; F561-V582 HydrophobicContact CG-CG1 4.32Å; D578-V582 WeakPolarHBondContact O-CG2 3.29Å; D578-V582 PolarHBondContact O-N 3.27Å; W579-V582 PolarHBondContact O-N 2.99Å; V582-R584 PolarHBondContact O-N 3.33Å; V582-R584 VanDerWaalsContact O-N 3.15Å; V582-H585 VanDerWaalsContact O-CB 3.23Å; V582-H585 WeakPolarHBondContact O-CB 3.4Å; V582-H585 PolarHBondContact O-N 3.41Å
583	A	94.8	Very high	93.8	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.3	-179.9	0	0	0	0	0	113.8	F561 A572 A573 W579 W589	F561-A583 HydrophobicContact CD2-CB 3.88Å; F561-A583 HydrophobicContact CE2-CB 3.73Å; A572-A583 HydrophobicContact CB-CB 4.33Å; A573-A583 HydrophobicContact CB-CB 3.85Å; W579-A583 WeakPolarHBondContact O-CB 3.3Å; W579-A583 PolarHBondContact O-N 3.48Å; A583-W589 PolarHBondContact O-NE1 2.95Å
584	R	93.9	Very high	94	Very high	109 Å²	109	67.1 Å²	67.1	41%	0.411	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	2.3	173.5	-65.3	-179.8	178	-169.1	-2.1	113.1	R580 V582 W610	R580-R584 WeakPolarHBondContact O-CB 3.29Å; R580-R584 WeakPolarHBondContact O-CD 3.33Å; R580-R584 VanDerWaalsContact O-CG 3.23Å; R580-R584 WeakPolarHBondContact O-CG 3.49Å; R580-R584 PolarHBondContact O-N 3.29Å; V582-R584 PolarHBondContact O-N 3.33Å; V582-R584 VanDerWaalsContact O-N 3.15Å; R584-W610 HydrophobicContact CB-CD2 4.1Å; R584-W610 HydrophobicContact CB-CG 4.21Å; R584-W610 VanDerWaalsContact CD-CZ2 3.47Å; R584-W610 HydrophobicContact CG-CD2 3.91Å; R584-W610 HydrophobicContact CG-CE3 4.22Å; R584-W610 HydrophobicContact CG-CH2 4Å; R584-W610 HydrophobicContact CG-CZ2 3.68Å; R584-W610 HydrophobicContact CG-CZ3 4.26Å; R584-W610 VanDerWaalsContact NE-CZ2 3.32Å
585	H	93.5	Very high	94	Very high	86 Å²	86	65.2 Å²	65.2	40%	0.398	30%	0.298	S	S	.	.	S	Bend	trans	-74.6	127.5	179.1	-171.4	-95.3	0	0	0	110.7	F558 V582 A587 V588	F558-H585 AromaticContact CE2-ND1 3.64Å; V582-H585 VanDerWaalsContact O-CB 3.23Å; V582-H585 WeakPolarHBondContact O-CB 3.4Å; V582-H585 PolarHBondContact O-N 3.41Å; H585-A587 PolarHBondContact O-N 3.48Å; H585-V588 WeakPolarHBondContact O-CG2 3.44Å; H585-V588 PolarHBondContact O-N 2.92Å
586	P	93.6	Very high	93.8	Very high	31 Å²	31	65 Å²	65	20%	0.201	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-57.1	-29.7	-169.7	-30.6	36.7	0	0	0	116.4	V588 W589 W610 T612 Q613	P586-V588 PolarHBondContact O-N 3.41Å; P586-W589 PolarHBondContact O-N 3.27Å; P586-W610 WeakPolarHBondContact CA-O 3.26Å; P586-W610 WeakPolarHBondContact CB-O 3.43Å; P586-T612 WeakPolarHBondContact CB-OG1 3.22Å; P586-Q613 HydrophobicContact CB-CB 4.39Å; P586-Q613 HydrophobicContact CB-CG 4.19Å
587	A	92.1	Very high	93.7	Very high	22 Å²	22	64.6 Å²	64.6	18%	0.182	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-69.2	-10.3	179.5	0	0	0	0	0	115	F558 H585 Q613	F558-A587 HydrophobicContact CE2-CB 3.77Å; F558-A587 HydrophobicContact CZ-CB 3.6Å; H585-A587 PolarHBondContact O-N 3.48Å; A587-Q613 VanDerWaalsContact CA-OE1 3.24Å; A587-Q613 VanDerWaalsContact CB-OE1 3.26Å
588	V	94	Very high	93.7	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.042	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-88.1	-16.8	166.5	-55.4	0	0	0	0	112.6	F558 F561 T562 L569 H585 P586 T590	F558-V588 HydrophobicContact CD2-CG1 3.62Å; F558-V588 HydrophobicContact CE2-CG1 3.52Å; F558-V588 HydrophobicContact CZ-CG1 4.48Å; F561-V588 HydrophobicContact CB-CB 4.49Å; F561-V588 HydrophobicContact CB-CG1 3.89Å; T562-V588 HydrophobicContact CG2-CG1 4.25Å; L569-V588 HydrophobicContact CD1-CG2 4.34Å; L569-V588 HydrophobicContact CD2-CB 4.36Å; L569-V588 HydrophobicContact CD2-CG2 4.06Å; H585-V588 WeakPolarHBondContact O-CG2 3.44Å; H585-V588 PolarHBondContact O-N 2.92Å; P586-V588 PolarHBondContact O-N 3.41Å; V588-T590 VanDerWaalsContact C-N 3.3Å; V588-T590 PolarHBondContact O-N 2.9Å
589	W	95.1	Very high	93.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.273	C	S	.	.			trans	-92.2	29.6	-177.5	-68.8	95.7	0	0	0	113.5	T566 L569 L570 A583 P586 R591 V592 L607 W610 A614	T566-W589 HydrophobicContact CG2-CZ3 4.02Å; L569-W589 HydrophobicContact CB-CH2 3.81Å; L569-W589 HydrophobicContact CB-CZ2 3.82Å; L569-W589 HydrophobicContact CD1-CD2 4.41Å; L569-W589 HydrophobicContact CD1-CE3 4.42Å; L569-W589 HydrophobicContact CD1-CH2 4.28Å; L569-W589 HydrophobicContact CD1-CZ2 4.27Å; L569-W589 HydrophobicContact CD1-CZ3 4.35Å; L570-W589 HydrophobicContact CD2-CH2 4.09Å; L570-W589 HydrophobicContact CG-CH2 4.15Å; A583-W589 PolarHBondContact O-NE1 2.95Å; P586-W589 PolarHBondContact O-N 3.27Å; W589-R591 PolarHBondContact O-N 3.27Å; W589-V592 HydrophobicContact CE3-CG2 4.37Å; W589-L607 HydrophobicContact CE3-CD1 4.16Å; W589-L607 HydrophobicContact CH2-CD1 3.82Å; W589-L607 HydrophobicContact CZ2-CD1 4.38Å; W589-L607 HydrophobicContact CZ3-CD1 3.69Å; W589-W610 WeakPolarHBondContact CB-O 3.25Å; W589-W610 VanDerWaalsContact CD1-CB 3.49Å; W589-W610 HydrophobicContact CD2-CB 4.39Å; W589-W610 AromaticContact CE2-CE3 3.85Å; W589-W610 HydrophobicContact CG-CB 3.96Å; W589-W610 HydrophobicContact CH2-CE3 4.49Å; W589-W610 AromaticContact CZ2-CE3 3.73Å; W589-W610 HydrophobicContact CZ2-CE3 3.73Å; W589-W610 HydrophobicContact CZ2-CZ3 4.16Å; W589-W610 AromaticContact NE1-CE3 3.99Å; W589-A614 WeakPolarHBondContact O-CA 3.37Å; W589-A614 WeakPolarHBondContact O-CB 3.39Å
590	T	95	Very high	93.6	Very high	51 Å²	51	57.7 Å²	57.7	31%	0.313	28%	0.278	S	S	.	.	S	Bend	trans	-65.6	-23.5	180	58.2	0	0	0	0	113.3	V588 Q613 H615 S616	V588-T590 VanDerWaalsContact C-N 3.3Å; V588-T590 PolarHBondContact O-N 2.9Å; T590-Q613 WeakPolarHBondContact CA-O 3.38Å; T590-H615 PolarHBondContact O-N 3.38Å; T590-S616 PolarHBondContact O-N 2.94Å
591	R	94.6	Very high	93.7	Very high	194 Å²	194	55 Å²	55	73%	0.732	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	124.3	176.9	-59.4	-178.3	-178.6	-178.4	-0.5	109.7	W589	W589-R591 PolarHBondContact O-N 3.27Å
592	V	96.2	Very high	93.8	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.9	178.9	-174.9	0	0	0	0	108.8	T566 W589 L594 L607 C611 A614 S616 L617 T618	T566-V592 WeakPolarHBondContact OG1-CA 3.48Å; W589-V592 HydrophobicContact CE3-CG2 4.37Å; V592-L594 HydrophobicContact CG1-CG 4.39Å; V592-L607 HydrophobicContact CG1-CD2 4.05Å; V592-C611 VanDerWaalsContact CG2-SG 3.58Å; V592-A614 HydrophobicContact CG2-CB 4.22Å; V592-S616 PolarHBondContact N-O 3.36Å; V592-L617 HydrophobicContact CB-CD1 3.73Å; V592-L617 HydrophobicContact CG1-CD1 3.68Å; V592-T618 PolarHBondContact O-N 2.97Å
593	L	95.6	Very high	93.9	Very high	78 Å²	78	59.9 Å²	59.9	41%	0.408	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.4	175.5	175.3	60.8	0	0	0	109.3	T566 E595 T618	T566-L593 VanDerWaalsContact CB-O 3.24Å; T566-L593 WeakPolarHBondContact CB-O 3.27Å; T566-L593 VanDerWaalsContact CG2-O 3.24Å; T566-L593 WeakPolarHBondContact CG2-O 3.22Å; T566-L593 PolarHBondContact OG1-N 3.46Å; L593-E595 HydrophobicContact CD1-CB 4.15Å; L593-E595 HydrophobicContact CG-CB 4.45Å; L593-T618 WeakPolarHBondContact CA-O 3.34Å; L593-T618 HydrophobicContact CD1-CG2 3.45Å; L593-T618 VanDerWaalsContact CD1-CG2 3.45Å
594	L	95.3	Very high	93.9	Very high	12 Å²	12	59.9 Å²	59.9	6%	0.063	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.1	171	-61.7	175	0	0	0	108.1	T566 V592 F603 L604 L607 T618 L619 Q620 L622	T566-L594 HydrophobicContact CG2-CD2 3.65Å; T566-L594 HydrophobicContact CG2-CG 4.46Å; V592-L594 HydrophobicContact CG1-CG 4.39Å; L594-F603 HydrophobicContact CD1-CE1 4.2Å; L594-F603 HydrophobicContact CD2-CE1 4.24Å; L594-L604 HydrophobicContact CD1-CD2 3.45Å; L594-L604 VanDerWaalsContact CD1-CD2 3.45Å; L594-L607 HydrophobicContact CD1-CD2 4.05Å; L594-T618 PolarHBondContact N-O 2.97Å; L594-L619 HydrophobicContact CB-CD2 3.88Å; L594-L619 HydrophobicContact CD1-CD2 3.88Å; L594-L619 HydrophobicContact CG-CD2 4.24Å; L594-L619 WeakPolarHBondContact O-CA 3.44Å; L594-Q620 PolarHBondContact O-N 3.49Å; L594-L622 HydrophobicContact CB-CD2 4.13Å; L594-L622 WeakPolarHBondContact O-CD2 3.38Å
595	E	94.5	Very high	94	Very high	79 Å²	79	56.4 Å²	56.4	37%	0.369	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.1	-174.9	-172.6	169.7	-169.6	0	0	112.7	L593 A597 Q620	L593-E595 HydrophobicContact CD1-CB 4.15Å; L593-E595 HydrophobicContact CG-CB 4.45Å; E595-A597 PolarHBondContact O-N 3.09Å; E595-Q620 CarbonylContact C-O 3.54Å; E595-Q620 WeakPolarHBondContact CA-O 3.23Å; E595-Q620 HydrophobicContact CB-CB 4.4Å; E595-Q620 HydrophobicContact CG-CB 3.98Å; E595-Q620 HydrophobicContact CG-CG 4.22Å; E595-Q620 PolarHBondContact OE1-NE2 3.28Å
596	N	91.8	Very high	94.1	Very high	91 Å²	91	55.1 Å²	55.1	49%	0.487	28%	0.283	S	S	.	.	S	Bend	trans	58.9	9.6	173.3	-70.6	-48.1	0	0	0	115.7	Q620 N621	N596-Q620 PolarHBondContact N-O 3.05Å; N596-N621 WeakPolarHBondContact CA-O 3.49Å; N596-N621 WeakPolarHBondContact OD1-CB 3.09Å; N596-N621 PolarHBondContact OD1-ND2 3.1Å
597	A	90	Very high	94.2	Very high	36 Å²	36	53.7 Å²	53.7	30%	0.298	27%	0.273	S	S	.	.			trans	-103.1	157.4	-168.1	0	0	0	0	0	114.1	E595 V599 L622 K623	E595-A597 PolarHBondContact O-N 3.09Å; A597-V599 HydrophobicContact CB-CG1 4.17Å; A597-L622 HydrophobicContact CB-CD2 4.19Å; A597-L622 WeakPolarHBondContact O-CA 3.34Å; A597-K623 PolarHBondContact O-N 2.88Å
598	R	91.3	Very high	94.4	Very high	99 Å²	99	53 Å²	53	37%	0.374	27%	0.267	S	S	.	.			trans	-94.2	108.4	162.9	-69.6	-175.7	-67.1	-167.6	1.8	108.5	D121 K623	D121-R598 IonicContact OD1-CZ 3.6Å; D121-R598 IonicContact OD1-NE 3.72Å; D121-R598 IonicContact OD1-NH2 3.61Å; D121-R598 PolarHBondContact OD1-NH2 3.45Å; D121-R598 IonicContact OD2-CZ 2.8Å; D121-R598 IonicContact OD2-NH2 2.7Å; D121-R598 PolarHBondContact OD2-NH2 2.91Å; R598-K623 HydrophobicContact CG-CB 3.75Å
599	V	92.1	Very high	94.5	Very high	29 Å²	29	58.9 Å²	58.9	18%	0.176	30%	0.295	C	S	.	.			trans	-113.9	162.6	178.4	-61.8	0	0	0	0	110.7	A597 F603 L604 L622 L644	A597-V599 HydrophobicContact CB-CG1 4.17Å; V599-F603 HydrophobicContact CB-CD1 4.24Å; V599-F603 HydrophobicContact CG1-CD1 4.25Å; V599-F603 HydrophobicContact CG1-CE1 4.31Å; V599-L604 HydrophobicContact CG2-CD2 4.42Å; V599-L622 HydrophobicContact CG1-CD2 4.46Å; V599-L622 HydrophobicContact CG2-CD1 3.91Å; V599-L622 HydrophobicContact CG2-CD2 4.28Å; V599-L644 HydrophobicContact CG2-CD1 3.75Å; V599-L644 HydrophobicContact CG2-CD2 4.14Å
600	C	92.8	Very high	94.5	Very high	67 Å²	67	60 Å²	60	45%	0.453	30%	0.298	S	S	.	.			trans	-124.2	155.8	176.4	77	0	0	0	0	111.8	K602 F603 L604	C600-K602 PolarHBondContact O-N 2.94Å; C600-F603 WeakPolarHBondContact O-CB 3.33Å; C600-F603 PolarHBondContact O-N 2.72Å; C600-F603 PolarHBondContact SG-N 3.03Å; C600-F603 VanDerWaalsContact SG-N 3.41Å; C600-L604 PolarHBondContact O-N 3.07Å; C600-L604 VanDerWaalsContact O-N 3.15Å
601	S	94.9	Very high	94.5	Very high	31 Å²	31	57.6 Å²	57.6	22%	0.217	28%	0.284	C	S	.	.	H	α-helix	trans	-55.6	-37.8	-178.6	-155.4	0	0	0	0	112.9	L604 A605 C643 G647	S601-L604 PolarHBondContact O-N 3.5Å; S601-A605 WeakPolarHBondContact O-CB 3.39Å; S601-A605 PolarHBondContact O-N 2.99Å; S601-C643 WeakPolarHBondContact CB-O 3.38Å; S601-C643 PolarHBondContact OG-O 3.3Å; S601-G647 WeakPolarHBondContact O-CA 3.47Å; S601-G647 PolarHBondContact OG-N 3.17Å
602	K	95.6	Very high	94.5	Very high	180 Å²	180	51 Å²	51	78%	0.783	27%	0.265	S	S	*	.	H	α-helix	trans	-64.6	-38.1	175.8	-62	-174.9	-179.1	-179.1	0	112.8	C600 M606	C600-K602 PolarHBondContact O-N 2.94Å; K602-M606 WeakPolarHBondContact O-CB 3.44Å; K602-M606 PolarHBondContact O-N 3.2Å
603	F	94.9	Very high	94.4	Very high	52 Å²	52	55 Å²	55	23%	0.228	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-44	176.3	168.6	-97.3	0	0	0	111.2	L570 L594 V599 C600 A605 M606 L607	L570-F603 HydrophobicContact CD1-CE2 4.35Å; L570-F603 HydrophobicContact CD1-CZ 3.88Å; L570-F603 HydrophobicContact CD2-CE2 4.25Å; L570-F603 HydrophobicContact CD2-CZ 4.32Å; L594-F603 HydrophobicContact CD1-CE1 4.2Å; L594-F603 HydrophobicContact CD2-CE1 4.24Å; V599-F603 HydrophobicContact CB-CD1 4.24Å; V599-F603 HydrophobicContact CG1-CD1 4.25Å; V599-F603 HydrophobicContact CG1-CE1 4.31Å; C600-F603 WeakPolarHBondContact O-CB 3.33Å; C600-F603 PolarHBondContact O-N 2.72Å; C600-F603 PolarHBondContact SG-N 3.03Å; C600-F603 VanDerWaalsContact SG-N 3.41Å; F603-A605 PolarHBondContact O-N 3.45Å; F603-M606 HydrophobicContact CD2-CE 3.57Å; F603-M606 HydrophobicContact CE2-CE 3.69Å; F603-M606 WeakPolarHBondContact O-CB 3.48Å; F603-M606 PolarHBondContact O-N 3.5Å; F603-L607 HydrophobicContact CE1-CD2 4.17Å; F603-L607 HydrophobicContact CZ-CD2 4.37Å; F603-L607 WeakPolarHBondContact O-CB 3.42Å; F603-L607 PolarHBondContact O-N 3.49Å
604	L	96	Very high	94.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-41	176.1	-61.7	179.7	0	0	0	112	L594 V599 C600 S601 M606 L607 A608 L644 L651	L594-L604 HydrophobicContact CD1-CD2 3.45Å; L594-L604 VanDerWaalsContact CD1-CD2 3.45Å; V599-L604 HydrophobicContact CG2-CD2 4.42Å; C600-L604 PolarHBondContact O-N 3.07Å; C600-L604 VanDerWaalsContact O-N 3.15Å; S601-L604 PolarHBondContact O-N 3.5Å; L604-M606 VanDerWaalsContact C-N 3.31Å; L604-M606 PolarHBondContact O-N 3.41Å; L604-L607 PolarHBondContact O-N 3.49Å; L604-A608 WeakPolarHBondContact O-CB 3.39Å; L604-A608 PolarHBondContact O-N 3.5Å; L604-L644 HydrophobicContact CD1-CB 4.03Å; L604-L644 HydrophobicContact CD1-CD1 4.42Å; L604-L644 HydrophobicContact CD1-CD2 4.1Å; L604-L644 HydrophobicContact CD1-CG 4.41Å; L604-L651 HydrophobicContact CB-CD1 3.89Å; L604-L651 HydrophobicContact CD2-CD1 3.91Å; L604-L651 HydrophobicContact CG-CD1 4.35Å
605	A	96.3	Very high	94.6	Very high	36 Å²	36	54.9 Å²	54.9	30%	0.298	28%	0.281	S	S	.	.	H	α-helix	trans	-67.9	-27	175.3	0	0	0	0	0	113.9	S601 F603	S601-A605 WeakPolarHBondContact O-CB 3.39Å; S601-A605 PolarHBondContact O-N 2.99Å; F603-A605 PolarHBondContact O-N 3.45Å
606	M	95.2	Very high	94.7	Very high	60 Å²	60	52.1 Å²	52.1	30%	0.296	27%	0.271	S	S	.	.	H	α-helix	trans	-74.9	-46.9	171.6	-179.7	-77.7	-58.6	0	0	110.8	K602 F603 L604 A608 Q609 W610	K602-M606 WeakPolarHBondContact O-CB 3.44Å; K602-M606 PolarHBondContact O-N 3.2Å; F603-M606 HydrophobicContact CD2-CE 3.57Å; F603-M606 HydrophobicContact CE2-CE 3.69Å; F603-M606 WeakPolarHBondContact O-CB 3.48Å; F603-M606 PolarHBondContact O-N 3.5Å; L604-M606 VanDerWaalsContact C-N 3.31Å; L604-M606 PolarHBondContact O-N 3.41Å; M606-A608 VanDerWaalsContact C-N 3.25Å; M606-A608 PolarHBondContact O-N 3.41Å; M606-Q609 VanDerWaalsContact O-CB 3.3Å; M606-Q609 WeakPolarHBondContact O-CB 3.33Å; M606-Q609 WeakPolarHBondContact O-CG 3.37Å; M606-Q609 PolarHBondContact O-N 3.4Å; M606-Q609 VanDerWaalsContact O-N 3.1Å; M606-W610 HydrophobicContact CE-CH2 4.06Å; M606-W610 HydrophobicContact CE-CZ3 4.45Å; M606-W610 HydrophobicContact SD-CH2 3.28Å; M606-W610 WeakPolarHBondContact SD-CH2 3.33Å; M606-W610 HydrophobicContact SD-CZ2 3.41Å; M606-W610 WeakPolarHBondContact SD-CZ2 3.49Å; M606-W610 HydrophobicContact SD-CZ3 4Å
607	L	95.3	Very high	95	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.3	-36.7	176.7	-171.7	66.4	0	0	0	112.2	L570 W589 V592 L594 F603 L604 Q609 W610 C611 L651	L570-L607 HydrophobicContact CD2-CD1 4.45Å; W589-L607 HydrophobicContact CE3-CD1 4.16Å; W589-L607 HydrophobicContact CH2-CD1 3.82Å; W589-L607 HydrophobicContact CZ2-CD1 4.38Å; W589-L607 HydrophobicContact CZ3-CD1 3.69Å; V592-L607 HydrophobicContact CG1-CD2 4.05Å; L594-L607 HydrophobicContact CD1-CD2 4.05Å; F603-L607 HydrophobicContact CE1-CD2 4.17Å; F603-L607 HydrophobicContact CZ-CD2 4.37Å; F603-L607 WeakPolarHBondContact O-CB 3.42Å; F603-L607 PolarHBondContact O-N 3.49Å; L604-L607 PolarHBondContact O-N 3.49Å; L607-Q609 PolarHBondContact O-N 2.92Å; L607-W610 HydrophobicContact CD1-CE3 4.03Å; L607-W610 HydrophobicContact CD1-CZ3 4.26Å; L607-W610 PolarHBondContact O-N 2.94Å; L607-C611 PolarHBondContact O-N 3Å; L607-C611 PolarHBondContact O-SG 2.99Å; L607-L651 HydrophobicContact CB-CD2 4.5Å; L607-L651 HydrophobicContact CD2-CD2 4.45Å; L607-L651 HydrophobicContact CG-CD2 4.38Å
608	A	96.4	Very high	95.4	Very high	7 Å²	7	47.3 Å²	47.3	6%	0.058	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-27.5	175.5	0	0	0	0	0	114.3	L604 M606 W610 C611 L651 A654	L604-A608 WeakPolarHBondContact O-CB 3.39Å; L604-A608 PolarHBondContact O-N 3.5Å; M606-A608 VanDerWaalsContact C-N 3.25Å; M606-A608 PolarHBondContact O-N 3.41Å; A608-W610 PolarHBondContact O-N 3.39Å; A608-C611 PolarHBondContact O-N 3.22Å; A608-L651 HydrophobicContact CB-CD2 4.05Å; A608-L651 HydrophobicContact CB-CG 4.08Å; A608-A654 HydrophobicContact CB-CB 4.1Å; A608-A654 WeakPolarHBondContact O-CB 3.4Å
609	Q	95.4	Very high	95.6	Very high	132 Å²	132	42.6 Å²	42.6	62%	0.617	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.1	177.7	-59.6	176	11.8	0	0	112.9	M606 L607	M606-Q609 VanDerWaalsContact O-CB 3.3Å; M606-Q609 WeakPolarHBondContact O-CB 3.33Å; M606-Q609 WeakPolarHBondContact O-CG 3.37Å; M606-Q609 PolarHBondContact O-N 3.4Å; M606-Q609 VanDerWaalsContact O-N 3.1Å; L607-Q609 PolarHBondContact O-N 2.92Å
610	W	94.6	Very high	95.8	Very high	22 Å²	22	42.9 Å²	42.9	8%	0.083	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-19.3	-179.5	-42.2	-32.5	0	0	0	111.9	L570 R584 P586 W589 M606 L607 A608 T612	L570-W610 HydrophobicContact CD2-CZ3 4.09Å; R584-W610 HydrophobicContact CB-CD2 4.1Å; R584-W610 HydrophobicContact CB-CG 4.21Å; R584-W610 VanDerWaalsContact CD-CZ2 3.47Å; R584-W610 HydrophobicContact CG-CD2 3.91Å; R584-W610 HydrophobicContact CG-CE3 4.22Å; R584-W610 HydrophobicContact CG-CH2 4Å; R584-W610 HydrophobicContact CG-CZ2 3.68Å; R584-W610 HydrophobicContact CG-CZ3 4.26Å; R584-W610 VanDerWaalsContact NE-CZ2 3.32Å; P586-W610 WeakPolarHBondContact CA-O 3.26Å; P586-W610 WeakPolarHBondContact CB-O 3.43Å; W589-W610 WeakPolarHBondContact CB-O 3.25Å; W589-W610 VanDerWaalsContact CD1-CB 3.49Å; W589-W610 HydrophobicContact CD2-CB 4.39Å; W589-W610 AromaticContact CE2-CE3 3.85Å; W589-W610 HydrophobicContact CG-CB 3.96Å; W589-W610 HydrophobicContact CH2-CE3 4.49Å; W589-W610 AromaticContact CZ2-CE3 3.73Å; W589-W610 HydrophobicContact CZ2-CE3 3.73Å; W589-W610 HydrophobicContact CZ2-CZ3 4.16Å; W589-W610 AromaticContact NE1-CE3 3.99Å; M606-W610 HydrophobicContact CE-CH2 4.06Å; M606-W610 HydrophobicContact CE-CZ3 4.45Å; M606-W610 HydrophobicContact SD-CH2 3.28Å; M606-W610 WeakPolarHBondContact SD-CH2 3.33Å; M606-W610 HydrophobicContact SD-CZ2 3.41Å; M606-W610 WeakPolarHBondContact SD-CZ2 3.49Å; M606-W610 HydrophobicContact SD-CZ3 4Å; L607-W610 HydrophobicContact CD1-CE3 4.03Å; L607-W610 HydrophobicContact CD1-CZ3 4.26Å; L607-W610 PolarHBondContact O-N 2.94Å; A608-W610 PolarHBondContact O-N 3.39Å; W610-T612 VanDerWaalsContact C-N 3.26Å; W610-T612 PolarHBondContact O-N 3.5Å; W610-T612 VanDerWaalsContact O-N 3.15Å
611	C	95.2	Very high	95.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-82	20.9	-176.6	-61.4	0	0	0	0	115.4	V592 L607 A608 Q613 A614 L651	V592-C611 VanDerWaalsContact CG2-SG 3.58Å; L607-C611 PolarHBondContact O-N 3Å; L607-C611 PolarHBondContact O-SG 2.99Å; A608-C611 PolarHBondContact O-N 3.22Å; C611-Q613 PolarHBondContact O-N 3.37Å; C611-A614 HydrophobicContact CB-CB 3.93Å; C611-A614 WeakPolarHBondContact O-CB 3.38Å; C611-A614 PolarHBondContact O-N 2.91Å; C611-L651 HydrophobicContact CB-CD2 3.87Å
612	T	95.4	Very high	95.8	Very high	56 Å²	56	41.1 Å²	41.1	34%	0.344	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-67	-20.2	-177	57.3	0	0	0	0	113.8	P586 W610 A654 N658	P586-T612 WeakPolarHBondContact CB-OG1 3.22Å; W610-T612 VanDerWaalsContact C-N 3.26Å; W610-T612 PolarHBondContact O-N 3.5Å; W610-T612 VanDerWaalsContact O-N 3.15Å; T612-A654 WeakPolarHBondContact CA-O 3.47Å; T612-A654 HydrophobicContact CG2-CB 4.31Å; T612-N658 PolarHBondContact O-ND2 3.25Å
613	Q	95.1	Very high	95.6	Very high	86 Å²	86	37.4 Å²	37.4	40%	0.402	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-110	22.8	173.1	-63.3	-178.3	-11.8	0	0	112.4	P586 A587 T590 C611 H615	P586-Q613 HydrophobicContact CB-CB 4.39Å; P586-Q613 HydrophobicContact CB-CG 4.19Å; A587-Q613 VanDerWaalsContact CA-OE1 3.24Å; A587-Q613 VanDerWaalsContact CB-OE1 3.26Å; T590-Q613 WeakPolarHBondContact CA-O 3.38Å; C611-Q613 PolarHBondContact O-N 3.37Å; Q613-H615 PolarHBondContact O-CE1 3.44Å; Q613-H615 PolarHBondContact O-N 3.04Å; Q613-H615 PolarHBondContact O-ND1 3.35Å
614	A	96.3	Very high	95.2	Very high	3 Å²	3	36.6 Å²	36.6	3%	0.025	19%	0.19	C	C	.	.			trans	-72.6	119.8	177.7	0	0	0	0	0	111.7	W589 V592 C611 A655 N658	W589-A614 WeakPolarHBondContact O-CA 3.37Å; W589-A614 WeakPolarHBondContact O-CB 3.39Å; V592-A614 HydrophobicContact CG2-CB 4.22Å; C611-A614 HydrophobicContact CB-CB 3.93Å; C611-A614 WeakPolarHBondContact O-CB 3.38Å; C611-A614 PolarHBondContact O-N 2.91Å; A614-A655 HydrophobicContact CB-CB 4.12Å; A614-N658 CarbonylContact O-C 3.5Å
615	H	96.8	Very high	95	Very high	85 Å²	85	42.3 Å²	42.3	39%	0.394	21%	0.211	S	C	.	.	S	Bend	trans	-95.5	-24.3	177.6	-65.2	68.8	0	0	0	112.3	T590 Q613 N658 L660 I661	T590-H615 PolarHBondContact O-N 3.38Å; Q613-H615 PolarHBondContact O-CE1 3.44Å; Q613-H615 PolarHBondContact O-N 3.04Å; Q613-H615 PolarHBondContact O-ND1 3.35Å; H615-N658 WeakPolarHBondContact CA-O 3.5Å; H615-L660 PolarHBondContact O-N 3.44Å; H615-I661 PolarHBondContact O-N 3.22Å
616	S	97.7	Very high	94.7	Very high	21 Å²	21	47.2 Å²	47.2	15%	0.147	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	129.3	179.5	-176.6	0	0	0	0	111.4	T590 V592 I661	T590-S616 PolarHBondContact O-N 2.94Å; V592-S616 PolarHBondContact N-O 3.36Å; S616-I661 WeakPolarHBondContact CA-O 3.45Å
617	L	97.9	Very high	94.4	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.4	174.5	176.7	60.1	0	0	0	110.2	V592 L619 L648 L651 L659 I661 L662 R663	V592-L617 HydrophobicContact CB-CD1 3.73Å; V592-L617 HydrophobicContact CG1-CD1 3.68Å; L617-L619 HydrophobicContact CD1-CD2 3.97Å; L617-L619 HydrophobicContact CD1-CG 4.37Å; L617-L619 HydrophobicContact CG-CG 4.46Å; L617-L648 HydrophobicContact CD2-CD1 3.84Å; L617-L651 HydrophobicContact CD2-CB 4.34Å; L617-L659 HydrophobicContact CB-CD1 3.85Å; L617-I661 PolarHBondContact N-O 3.43Å; L617-L662 HydrophobicContact CB-CD1 4.18Å; L617-L662 HydrophobicContact CD2-CD1 3.98Å; L617-L662 HydrophobicContact CG-CD1 4.11Å; L617-L662 WeakPolarHBondContact O-CA 3.41Å; L617-R663 PolarHBondContact O-N 3.36Å
618	T	97.6	Very high	94.1	Very high	22 Å²	22	52.2 Å²	52.2	14%	0.135	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.5	177.8	-60.9	0	0	0	0	110.6	V592 L593 L594 Q620 R663	V592-T618 PolarHBondContact O-N 2.97Å; L593-T618 WeakPolarHBondContact CA-O 3.34Å; L593-T618 HydrophobicContact CD1-CG2 3.45Å; L593-T618 VanDerWaalsContact CD1-CG2 3.45Å; L594-T618 PolarHBondContact N-O 2.97Å; T618-Q620 HydrophobicContact CG2-CB 4.39Å; T618-R663 CarbonylContact C-O 3.4Å; T618-R663 WeakPolarHBondContact CA-O 3.23Å; T618-R663 HydrophobicContact CG2-CB 4.11Å; T618-R663 HydrophobicContact CG2-CG 3.96Å
619	L	97.3	Very high	93.8	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	110.6	174.8	-55.7	-176	0	0	0	108.2	L594 L617 L622 L648 R663 I664 S665 L671	L594-L619 HydrophobicContact CB-CD2 3.88Å; L594-L619 HydrophobicContact CD1-CD2 3.88Å; L594-L619 HydrophobicContact CG-CD2 4.24Å; L594-L619 WeakPolarHBondContact O-CA 3.44Å; L617-L619 HydrophobicContact CD1-CD2 3.97Å; L617-L619 HydrophobicContact CD1-CG 4.37Å; L617-L619 HydrophobicContact CG-CG 4.46Å; L619-L622 HydrophobicContact CB-CD1 3.85Å; L619-L622 HydrophobicContact CD2-CD1 4.13Å; L619-L622 HydrophobicContact CG-CD1 4.38Å; L619-L648 HydrophobicContact CD1-CD1 4.08Å; L619-R663 PolarHBondContact N-O 3.26Å; L619-I664 HydrophobicContact CB-CG1 4.48Å; L619-I664 HydrophobicContact CD1-CG1 4.48Å; L619-I664 WeakPolarHBondContact O-CA 3.47Å; L619-S665 PolarHBondContact O-N 3.1Å; L619-L671 HydrophobicContact CD1-CD1 3.79Å
620	Q	95.8	Very high	93.5	Very high	35 Å²	35	66.4 Å²	66.4	16%	0.164	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.8	-171.2	-174.1	162	-70.3	0	0	112.6	L594 E595 N596 T618 L622 R663 S665	L594-Q620 PolarHBondContact O-N 3.49Å; E595-Q620 CarbonylContact C-O 3.54Å; E595-Q620 WeakPolarHBondContact CA-O 3.23Å; E595-Q620 HydrophobicContact CB-CB 4.4Å; E595-Q620 HydrophobicContact CG-CB 3.98Å; E595-Q620 HydrophobicContact CG-CG 4.22Å; E595-Q620 PolarHBondContact OE1-NE2 3.28Å; N596-Q620 PolarHBondContact N-O 3.05Å; T618-Q620 HydrophobicContact CG2-CB 4.39Å; Q620-L622 PolarHBondContact O-N 3.32Å; Q620-L622 VanDerWaalsContact O-N 3.07Å; Q620-R663 VanDerWaalsContact OE1-NE 3.1Å; Q620-S665 CarbonylContact C-O 3.59Å; Q620-S665 VanDerWaalsContact CA-O 3.3Å; Q620-S665 WeakPolarHBondContact CA-O 3.46Å
621	N	94	Very high	93.5	Very high	59 Å²	59	66.4 Å²	66.4	32%	0.316	31%	0.313	S	S	.	.	S	Bend	trans	48	38.2	179.8	-161.1	17.2	0	0	0	114.2	N596 S665 H666	N596-N621 WeakPolarHBondContact CA-O 3.49Å; N596-N621 WeakPolarHBondContact OD1-CB 3.09Å; N596-N621 PolarHBondContact OD1-ND2 3.1Å; N621-S665 PolarHBondContact N-O 3.12Å; N621-H666 VanDerWaalsContact CA-O 3.3Å; N621-H666 WeakPolarHBondContact CA-O 3.23Å; N621-H666 HydrophobicContact CB-CB 4.37Å
622	L	93.6	Very high	93.4	Very high	2 Å²	2	68.7 Å²	68.7	1%	0.01	33%	0.33	C	S	.	.			trans	-73	137.1	177.2	-64.6	-179.3	0	0	0	109.5	L594 A597 V599 L619 Q620 L644 I670	L594-L622 HydrophobicContact CB-CD2 4.13Å; L594-L622 WeakPolarHBondContact O-CD2 3.38Å; A597-L622 HydrophobicContact CB-CD2 4.19Å; A597-L622 WeakPolarHBondContact O-CA 3.34Å; V599-L622 HydrophobicContact CG1-CD2 4.46Å; V599-L622 HydrophobicContact CG2-CD1 3.91Å; V599-L622 HydrophobicContact CG2-CD2 4.28Å; L619-L622 HydrophobicContact CB-CD1 3.85Å; L619-L622 HydrophobicContact CD2-CD1 4.13Å; L619-L622 HydrophobicContact CG-CD1 4.38Å; Q620-L622 PolarHBondContact O-N 3.32Å; Q620-L622 VanDerWaalsContact O-N 3.07Å; L622-L644 HydrophobicContact CD1-CD1 4.27Å; L622-I670 HydrophobicContact CB-CD1 3.71Å; L622-I670 WeakPolarHBondContact O-CD1 3.45Å
623	K	90.4	Very high	93.2	Very high	102 Å²	102	72.7 Å²	72.7	44%	0.443	34%	0.342	S	S	.	.			trans	-107.2	140	-172.4	-67.9	171.7	-174.6	171.7	0	110.9	A597 R598	A597-K623 PolarHBondContact O-N 2.88Å; R598-K623 HydrophobicContact CG-CB 3.75Å
624	P	87.9	Confident	92.8	Very high	35 Å²	35	73.8 Å²	73.8	23%	0.227	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-62.4	167.9	172.8	25.7	-34.3	0	0	0	112.4	Y636 T640 I670	P624-Y636 WeakPolarHBondContact CB-OH 3.28Å; P624-Y636 WeakPolarHBondContact CG-OH 3.38Å; P624-T640 HydrophobicContact CB-CG2 4.21Å; P624-I670 HydrophobicContact CB-CG2 3.65Å; P624-I670 HydrophobicContact CG-CG2 4.41Å
625	R	91.1	Very high	92.5	Very high	119 Å²	119	78.2 Å²	78.2	45%	0.449	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-57.1	160.2	164.8	64.8	161.2	178.7	89.8	-5.4	110.5	E631 Y636 S639 T640	R625-E631 IonicContact CZ-OE1 3.14Å; R625-E631 IonicContact CZ-OE2 3.31Å; R625-E631 IonicContact NH1-OE1 3.3Å; R625-E631 IonicContact NH1-OE2 2.94Å; R625-E631 PolarHBondContact NH1-OE2 3.23Å; R625-E631 IonicContact NH2-OE1 2.61Å; R625-E631 PolarHBondContact NH2-OE1 3.08Å; R625-E631 IonicContact NH2-OE2 2.76Å; R625-E631 PolarHBondContact NH2-OE2 3.29Å; R625-Y636 WeakPolarHBondContact O-CE2 3.33Å; R625-Y636 PolarHBondContact O-OH 3.5Å; R625-S639 PolarHBondContact NH2-OG 3.45Å; R625-T640 HydrophobicContact CG-CG2 4.04Å
626	Q	89	Confident	92.3	Very high	140 Å²	140	76.4 Å²	76.4	65%	0.654	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-63.4	148.5	169.4	-76.3	165.7	-15	0	0	111.4
627	R	90	Very high	91.9	Very high	131 Å²	131	77.3 Å²	77.3	49%	0.494	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-70.3	137.2	170.9	177.2	173.4	167.3	-150.1	-7.7	109.8	E631 S632 Y636	R627-E631 HydrophobicContact CG-CB 4.22Å; R627-E631 PolarHBondContact NE-O 3.24Å; R627-E631 PolarHBondContact NH2-O 2.91Å; R627-S632 PolarHBondContact NE-O 2.82Å; R627-Y636 HydrophobicContact CB-CD1 4.28Å; R627-Y636 HydrophobicContact CB-CD2 3.59Å; R627-Y636 HydrophobicContact CB-CE1 4.42Å; R627-Y636 HydrophobicContact CB-CE2 3.74Å; R627-Y636 HydrophobicContact CB-CG 3.85Å; R627-Y636 HydrophobicContact CG-CD1 4.47Å; R627-Y636 HydrophobicContact CG-CD2 3.95Å; R627-Y636 HydrophobicContact CG-CG 3.86Å
628	G	89.3	Confident	91.5	Very high	33 Å²	33	86.6 Å²	86.6	34%	0.34	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-69	145.8	177.5	0	0	0	0	0	112.1	K630 E631	G628-K630 PolarHBondContact O-N 3.48Å; G628-E631 PolarHBondContact N-OE2 3.11Å; G628-E631 WeakPolarHBondContact O-CB 3.35Å; G628-E631 PolarHBondContact O-N 3.47Å
629	K	89.6	Confident	91.1	Very high	225 Å²	225	88.3 Å²	88.3	98%	0.978	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-22.4	179.3	-68.9	-173.4	177.9	-176.8	0	114.3
630	K	89.9	Confident	90.9	Very high	213 Å²	213	88.4 Å²	88.4	93%	0.926	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-1.6	178.3	-61.4	-171.2	177.8	-172.8	0	114	G628	G628-K630 PolarHBondContact O-N 3.48Å
631	E	93.2	Very high	90.8	Very high	21 Å²	21	91.8 Å²	91.8	10%	0.098	43%	0.426	C	S	.	.			trans	-85.9	137.2	-172.9	-170.7	178.3	-163.4	0	0	110.3	R625 R627 G628 E635 Y636 S639	R625-E631 IonicContact CZ-OE1 3.14Å; R625-E631 IonicContact CZ-OE2 3.31Å; R625-E631 IonicContact NH1-OE1 3.3Å; R625-E631 IonicContact NH1-OE2 2.94Å; R625-E631 PolarHBondContact NH1-OE2 3.23Å; R625-E631 IonicContact NH2-OE1 2.61Å; R625-E631 PolarHBondContact NH2-OE1 3.08Å; R625-E631 IonicContact NH2-OE2 2.76Å; R625-E631 PolarHBondContact NH2-OE2 3.29Å; R627-E631 HydrophobicContact CG-CB 4.22Å; R627-E631 PolarHBondContact NE-O 3.24Å; R627-E631 PolarHBondContact NH2-O 2.91Å; G628-E631 PolarHBondContact N-OE2 3.11Å; G628-E631 WeakPolarHBondContact O-CB 3.35Å; G628-E631 PolarHBondContact O-N 3.47Å; E631-E635 WeakPolarHBondContact CA-OE2 3.47Å; E631-E635 HydrophobicContact CG-CB 4.19Å; E631-E635 HydrophobicContact CG-CG 3.93Å; E631-E635 WeakPolarHBondContact CG-OE2 3.41Å; E631-Y636 VanDerWaalsContact OE1-CA 3.26Å; E631-Y636 WeakPolarHBondContact OE1-CA 3.28Å; E631-S639 PolarHBondContact OE1-OG 3.34Å
632	S	93.5	Very high	90.7	Very high	50 Å²	50	89.5 Å²	89.5	35%	0.35	42%	0.416	S	S	.	.			trans	-71.6	166	175	83.6	0	0	0	0	111.7	R627 E634 E635 Y636	R627-S632 PolarHBondContact NE-O 2.82Å; S632-E634 VanDerWaalsContact C-N 3.27Å; S632-E635 PolarHBondContact N-OE2 3.18Å; S632-E635 VanDerWaalsContact N-OE2 3.1Å; S632-E635 WeakPolarHBondContact OG-CB 3.14Å; S632-E635 PolarHBondContact OG-N 3.44Å; S632-Y636 WeakPolarHBondContact O-CB 3.32Å; S632-Y636 PolarHBondContact O-N 2.95Å
633	K	90.4	Very high	90.8	Very high	140 Å²	140	92 Å²	92	61%	0.609	43%	0.434	S	S	*	.	H	α-helix	trans	-70.1	-33.6	179.2	173.6	-172.3	174.5	-167.3	0	110.3	A637	K633-A637 WeakPolarHBondContact O-CB 3.37Å; K633-A637 PolarHBondContact O-N 3.06Å
634	E	88.6	Confident	91	Very high	108 Å²	108	87.4 Å²	87.4	51%	0.505	41%	0.413	S	S	.	.	H	α-helix	trans	-79.4	-39.8	-176.6	-63.9	57.4	-124.7	0	0	110.5	S632 A637 R638	S632-E634 VanDerWaalsContact C-N 3.27Å; E634-A637 PolarHBondContact O-N 3.47Å; E634-R638 VanDerWaalsContact O-CB 3.23Å; E634-R638 WeakPolarHBondContact O-CB 3.43Å; E634-R638 PolarHBondContact O-N 3.2Å
635	E	89.8	Confident	91.4	Very high	96 Å²	96	86.2 Å²	86.2	45%	0.449	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-45.2	169.6	-179.3	-177.5	-154	0	0	111	E631 S632 R638 S639	E631-E635 WeakPolarHBondContact CA-OE2 3.47Å; E631-E635 HydrophobicContact CG-CB 4.19Å; E631-E635 HydrophobicContact CG-CG 3.93Å; E631-E635 WeakPolarHBondContact CG-OE2 3.41Å; S632-E635 PolarHBondContact N-OE2 3.18Å; S632-E635 VanDerWaalsContact N-OE2 3.1Å; S632-E635 WeakPolarHBondContact OG-CB 3.14Å; S632-E635 PolarHBondContact OG-N 3.44Å; E635-R638 CarbonylContact O-C 3.58Å; E635-R638 PolarHBondContact O-N 3.33Å; E635-S639 VanDerWaalsContact O-CB 3.26Å; E635-S639 WeakPolarHBondContact O-CB 3.35Å; E635-S639 PolarHBondContact O-N 2.9Å; E635-S639 PolarHBondContact O-OG 3.21Å
636	Y	91.5	Very high	91.7	Very high	47 Å²	47	83.4 Å²	83.4	18%	0.184	41%	0.407	C	S	.	.	H	α-helix	trans	-62	-42.8	174.8	172.7	-103.7	0	0	0	112.9	P624 R625 R627 E631 S632 S639 T640	P624-Y636 WeakPolarHBondContact CB-OH 3.28Å; P624-Y636 WeakPolarHBondContact CG-OH 3.38Å; R625-Y636 WeakPolarHBondContact O-CE2 3.33Å; R625-Y636 PolarHBondContact O-OH 3.5Å; R627-Y636 HydrophobicContact CB-CD1 4.28Å; R627-Y636 HydrophobicContact CB-CD2 3.59Å; R627-Y636 HydrophobicContact CB-CE1 4.42Å; R627-Y636 HydrophobicContact CB-CE2 3.74Å; R627-Y636 HydrophobicContact CB-CG 3.85Å; R627-Y636 HydrophobicContact CG-CD1 4.47Å; R627-Y636 HydrophobicContact CG-CD2 3.95Å; R627-Y636 HydrophobicContact CG-CG 3.86Å; E631-Y636 VanDerWaalsContact OE1-CA 3.26Å; E631-Y636 WeakPolarHBondContact OE1-CA 3.28Å; S632-Y636 WeakPolarHBondContact O-CB 3.32Å; S632-Y636 PolarHBondContact O-N 2.95Å; Y636-S639 PolarHBondContact O-N 3.46Å; Y636-S639 PolarHBondContact O-OG 3.46Å; Y636-T640 HydrophobicContact CD2-CG2 3.88Å; Y636-T640 HydrophobicContact CE2-CG2 3.59Å; Y636-T640 WeakPolarHBondContact O-CB 3.35Å; Y636-T640 WeakPolarHBondContact O-CG2 3.44Å; Y636-T640 PolarHBondContact O-N 3.08Å; Y636-T640 PolarHBondContact O-OG1 3.09Å
637	A	88.9	Confident	92.1	Very high	41 Å²	41	76.8 Å²	76.8	34%	0.339	38%	0.376	S	S	.	.	H	α-helix	trans	-60.4	-46.6	172.2	0	0	0	0	0	110.7	K633 E634 S639 R641 N669	K633-A637 WeakPolarHBondContact O-CB 3.37Å; K633-A637 PolarHBondContact O-N 3.06Å; E634-A637 PolarHBondContact O-N 3.47Å; A637-S639 PolarHBondContact O-N 3.48Å; A637-R641 VanDerWaalsContact O-CB 3.32Å; A637-R641 WeakPolarHBondContact O-CB 3.36Å; A637-R641 PolarHBondContact O-N 2.84Å; A637-R641 VanDerWaalsContact O-N 3.13Å; A637-N669 PolarHBondContact O-ND2 2.92Å
638	R	89.9	Confident	92.4	Very high	199 Å²	199	70.5 Å²	70.5	75%	0.751	35%	0.353	S	S	*	.	H	α-helix	trans	-64.1	-38.7	179.4	-168.2	-173.3	-58.5	163.2	0.3	113.1	E634 E635	E634-R638 VanDerWaalsContact O-CB 3.23Å; E634-R638 WeakPolarHBondContact O-CB 3.43Å; E634-R638 PolarHBondContact O-N 3.2Å; E635-R638 CarbonylContact O-C 3.58Å; E635-R638 PolarHBondContact O-N 3.33Å
639	S	89.8	Confident	92.8	Very high	58 Å²	58	71 Å²	71	41%	0.406	35%	0.346	S	S	.	.	H	α-helix	trans	-83.5	-24.1	-175.5	76.7	0	0	0	0	113.7	R625 E631 E635 Y636 A637	R625-S639 PolarHBondContact NH2-OG 3.45Å; E631-S639 PolarHBondContact OE1-OG 3.34Å; E635-S639 VanDerWaalsContact O-CB 3.26Å; E635-S639 WeakPolarHBondContact O-CB 3.35Å; E635-S639 PolarHBondContact O-N 2.9Å; E635-S639 PolarHBondContact O-OG 3.21Å; Y636-S639 PolarHBondContact O-N 3.46Å; Y636-S639 PolarHBondContact O-OG 3.46Å; A637-S639 PolarHBondContact O-N 3.48Å
640	T	91.9	Very high	93.2	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-92.1	-12	173.5	58.1	0	0	0	0	113.8	P624 R625 Y636 G642 C643 N669	P624-T640 HydrophobicContact CB-CG2 4.21Å; R625-T640 HydrophobicContact CG-CG2 4.04Å; Y636-T640 HydrophobicContact CD2-CG2 3.88Å; Y636-T640 HydrophobicContact CE2-CG2 3.59Å; Y636-T640 WeakPolarHBondContact O-CB 3.35Å; Y636-T640 WeakPolarHBondContact O-CG2 3.44Å; Y636-T640 PolarHBondContact O-N 3.08Å; Y636-T640 PolarHBondContact O-OG1 3.09Å; T640-G642 PolarHBondContact O-N 3.35Å; T640-C643 WeakPolarHBondContact O-CB 3.41Å; T640-C643 PolarHBondContact O-N 2.72Å; T640-C643 PolarHBondContact O-SG 2.73Å; T640-N669 PolarHBondContact OG1-ND2 3.45Å
641	R	93.6	Very high	93.6	Very high	106 Å²	106	52.3 Å²	52.3	40%	0.4	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	120.7	-176.9	-173.1	161.4	176.8	72.6	2.5	112.5	A637 C643 N669 T672 D696	A637-R641 VanDerWaalsContact O-CB 3.32Å; A637-R641 WeakPolarHBondContact O-CB 3.36Å; A637-R641 PolarHBondContact O-N 2.84Å; A637-R641 VanDerWaalsContact O-N 3.13Å; R641-C643 PolarHBondContact O-N 3.27Å; R641-N669 CarbonylContact C-O 3.59Å; R641-N669 VanDerWaalsContact CA-O 3.31Å; R641-N669 WeakPolarHBondContact CA-O 3.37Å; R641-N669 WeakPolarHBondContact CB-OD1 3.4Å; R641-N669 WeakPolarHBondContact CG-OD1 3.44Å; R641-N669 PolarHBondContact N-ND2 3.11Å; R641-N669 PolarHBondContact NH1-OD1 3.12Å; R641-T672 HydrophobicContact CG-CG2 4.15Å; R641-D696 IonicContact CZ-OD1 2.82Å; R641-D696 IonicContact CZ-OD2 3.77Å; R641-D696 VanDerWaalsContact NH1-CG 3.26Å; R641-D696 IonicContact NH1-OD1 2.65Å; R641-D696 PolarHBondContact NH1-OD1 3.4Å; R641-D696 IonicContact NH1-OD2 3.92Å; R641-D696 PolarHBondContact NH1-OD2 2.77Å; R641-D696 IonicContact NH2-OD1 3.4Å; R641-D696 PolarHBondContact NH2-OD1 3.05Å
642	G	93.9	Very high	93.8	Very high	11 Å²	11	51.3 Å²	51.3	11%	0.113	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	16.4	-178.6	0	0	0	0	0	114.6	T640 L644 E645 N669 I670	T640-G642 PolarHBondContact O-N 3.35Å; G642-L644 PolarHBondContact O-N 2.7Å; G642-E645 VanDerWaalsContact CA-OE1 3.25Å; G642-E645 WeakPolarHBondContact CA-OE1 3.37Å; G642-E645 VanDerWaalsContact O-CB 3.28Å; G642-E645 WeakPolarHBondContact O-CB 3.46Å; G642-E645 VanDerWaalsContact O-CG 3.3Å; G642-E645 WeakPolarHBondContact O-CG 3.42Å; G642-E645 PolarHBondContact O-N 3.09Å; G642-N669 PolarHBondContact N-O 3.05Å; G642-I670 CarbonylContact C-O 3.52Å; G642-I670 VanDerWaalsContact C-O 3.25Å; G642-I670 WeakPolarHBondContact CA-O 3.46Å
643	C	94.3	Very high	94	Very high	55 Å²	55	54 Å²	54	37%	0.372	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.3	-168	72.1	0	0	0	0	114.5	S601 T640 R641 I670	S601-C643 WeakPolarHBondContact CB-O 3.38Å; S601-C643 PolarHBondContact OG-O 3.3Å; T640-C643 WeakPolarHBondContact O-CB 3.41Å; T640-C643 PolarHBondContact O-N 2.72Å; T640-C643 PolarHBondContact O-SG 2.73Å; R641-C643 PolarHBondContact O-N 3.27Å; C643-I670 PolarHBondContact N-O 3.24Å
644	L	95.9	Very high	94.3	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-11	175.7	-63.4	-175.8	0	0	0	113.9	V599 L604 L622 G642 A646 G647 L648 I670 L671	V599-L644 HydrophobicContact CG2-CD1 3.75Å; V599-L644 HydrophobicContact CG2-CD2 4.14Å; L604-L644 HydrophobicContact CD1-CB 4.03Å; L604-L644 HydrophobicContact CD1-CD1 4.42Å; L604-L644 HydrophobicContact CD1-CD2 4.1Å; L604-L644 HydrophobicContact CD1-CG 4.41Å; L622-L644 HydrophobicContact CD1-CD1 4.27Å; G642-L644 PolarHBondContact O-N 2.7Å; L644-A646 VanDerWaalsContact C-N 3.34Å; L644-A646 PolarHBondContact O-N 3.42Å; L644-G647 PolarHBondContact O-N 3.43Å; L644-G647 VanDerWaalsContact O-N 3.08Å; L644-L648 PolarHBondContact O-N 2.89Å; L644-I670 HydrophobicContact CD1-CB 4.33Å; L644-I670 HydrophobicContact CD1-CD1 3.86Å; L644-I670 HydrophobicContact CD1-CG1 4.26Å; L644-I670 HydrophobicContact CG-CB 4.39Å; L644-I670 PolarHBondContact N-O 3.34Å; L644-L671 HydrophobicContact CB-CD2 3.66Å; L644-L671 HydrophobicContact CB-CG 4.14Å; L644-L671 HydrophobicContact CD1-CG 4.4Å
645	E	96.1	Very high	94.6	Very high	11 Å²	11	43.8 Å²	43.8	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-36.8	-169.3	-71.5	173.1	-168.4	0	0	113.6	G642 L648 E649 L671 T672 R674 L678	G642-E645 VanDerWaalsContact CA-OE1 3.25Å; G642-E645 WeakPolarHBondContact CA-OE1 3.37Å; G642-E645 VanDerWaalsContact O-CB 3.28Å; G642-E645 WeakPolarHBondContact O-CB 3.46Å; G642-E645 VanDerWaalsContact O-CG 3.3Å; G642-E645 WeakPolarHBondContact O-CG 3.42Å; G642-E645 PolarHBondContact O-N 3.09Å; E645-L648 PolarHBondContact O-N 2.84Å; E645-E649 VanDerWaalsContact O-CB 3.25Å; E645-E649 WeakPolarHBondContact O-CB 3.27Å; E645-E649 PolarHBondContact O-N 3.37Å; E645-L671 HydrophobicContact CG-CD2 4.31Å; E645-T672 WeakPolarHBondContact OE1-CB 3.46Å; E645-T672 PolarHBondContact OE1-N 2.99Å; E645-T672 PolarHBondContact OE1-OG1 3.3Å; E645-R674 VanDerWaalsContact OE2-CD 3.31Å; E645-R674 WeakPolarHBondContact OE2-CD 3.4Å; E645-R674 IonicContact OE2-CZ 2.63Å; E645-R674 IonicContact OE2-NE 3.73Å; E645-R674 IonicContact OE2-NH1 3.19Å; E645-R674 PolarHBondContact OE2-NH1 2.89Å; E645-L678 HydrophobicContact CB-CD1 4.17Å
646	A	96.4	Very high	94.8	Very high	60 Å²	60	39.9 Å²	39.9	50%	0.496	22%	0.217	S	C	.	.	H	α-helix	trans	-69.5	-32.5	178.1	0	0	0	0	0	113.3	L644 S650	L644-A646 VanDerWaalsContact C-N 3.34Å; L644-A646 PolarHBondContact O-N 3.42Å; A646-S650 PolarHBondContact O-N 2.87Å; A646-S650 PolarHBondContact O-OG 2.73Å
647	G	96.9	Very high	94.8	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-77.2	-37.2	174	0	0	0	0	0	112.2	S601 L644 S650 L651	S601-G647 WeakPolarHBondContact O-CA 3.47Å; S601-G647 PolarHBondContact OG-N 3.17Å; L644-G647 PolarHBondContact O-N 3.43Å; L644-G647 VanDerWaalsContact O-N 3.08Å; G647-S650 WeakPolarHBondContact O-CB 3.31Å; G647-S650 PolarHBondContact O-N 3.39Å; G647-L651 PolarHBondContact O-N 2.94Å; G647-L651 VanDerWaalsContact O-N 3.09Å
648	L	97.4	Very high	95.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-41.6	169.5	175.8	58.6	0	0	0	111.6	L617 L619 L644 E645 S650 L651 L652 I664 L671	L617-L648 HydrophobicContact CD2-CD1 3.84Å; L619-L648 HydrophobicContact CD1-CD1 4.08Å; L644-L648 PolarHBondContact O-N 2.89Å; E645-L648 PolarHBondContact O-N 2.84Å; L648-S650 PolarHBondContact O-N 3.39Å; L648-L651 WeakPolarHBondContact O-CB 3.41Å; L648-L651 PolarHBondContact O-N 2.81Å; L648-L651 VanDerWaalsContact O-N 3.13Å; L648-L652 HydrophobicContact CD1-CD1 3.96Å; L648-L652 HydrophobicContact CD1-CD2 4.38Å; L648-L652 HydrophobicContact CD1-CG 3.89Å; L648-L652 HydrophobicContact CD2-CD1 4.44Å; L648-L652 HydrophobicContact CG-CD1 3.78Å; L648-L652 HydrophobicContact CG-CG 4.21Å; L648-L652 WeakPolarHBondContact O-CB 3.39Å; L648-L652 VanDerWaalsContact O-CG 3.29Å; L648-L652 WeakPolarHBondContact O-CG 3.37Å; L648-L652 PolarHBondContact O-N 3.33Å; L648-I664 HydrophobicContact CD2-CD1 3.89Å; L648-L671 HydrophobicContact CB-CD2 4.4Å; L648-L671 HydrophobicContact CD2-CD2 3.74Å
649	E	98	Very high	95.5	Very high	43 Å²	43	32.2 Å²	32.2	20%	0.201	20%	0.199	C	C	.	.	H	α-helix	trans	-58.1	-36.9	173.7	178	171.3	177	0	0	111.3	E645 K653 L678 Y682	E645-E649 VanDerWaalsContact O-CB 3.25Å; E645-E649 WeakPolarHBondContact O-CB 3.27Å; E645-E649 PolarHBondContact O-N 3.37Å; E649-K653 HydrophobicContact CG-CD 4.13Å; E649-K653 VanDerWaalsContact CG-CE 3.5Å; E649-K653 WeakPolarHBondContact O-CB 3.34Å; E649-K653 VanDerWaalsContact O-CG 3.22Å; E649-K653 WeakPolarHBondContact O-CG 3.49Å; E649-K653 PolarHBondContact O-N 2.94Å; E649-K653 WeakPolarHBondContact OE1-CE 3.43Å; E649-K653 IonicContact OE1-NZ 2.79Å; E649-K653 PolarHBondContact OE1-NZ 2.83Å; E649-L678 HydrophobicContact CB-CD1 4.14Å; E649-L678 HydrophobicContact CB-CD2 4.04Å; E649-L678 HydrophobicContact CG-CD2 3.91Å; E649-Y682 HydrophobicContact CG-CE2 3.89Å; E649-Y682 PolarHBondContact OE1-OH 3.49Å
650	S	98	Very high	95.9	Very high	41 Å²	41	32 Å²	32	29%	0.287	19%	0.193	S	C	.	.	H	α-helix	trans	-66.7	-44	174.7	-56.2	0	0	0	0	111.9	A646 G647 L648 K653 A654	A646-S650 PolarHBondContact O-N 2.87Å; A646-S650 PolarHBondContact O-OG 2.73Å; G647-S650 WeakPolarHBondContact O-CB 3.31Å; G647-S650 PolarHBondContact O-N 3.39Å; L648-S650 PolarHBondContact O-N 3.39Å; S650-K653 PolarHBondContact O-N 3.24Å; S650-A654 WeakPolarHBondContact O-CB 3.42Å; S650-A654 PolarHBondContact O-N 2.85Å
651	L	97.1	Very high	96.2	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-46.1	174.4	-79.3	162.2	0	0	0	112.4	L604 L607 A608 C611 L617 G647 L648 A654 A655	L604-L651 HydrophobicContact CB-CD1 3.89Å; L604-L651 HydrophobicContact CD2-CD1 3.91Å; L604-L651 HydrophobicContact CG-CD1 4.35Å; L607-L651 HydrophobicContact CB-CD2 4.5Å; L607-L651 HydrophobicContact CD2-CD2 4.45Å; L607-L651 HydrophobicContact CG-CD2 4.38Å; A608-L651 HydrophobicContact CB-CD2 4.05Å; A608-L651 HydrophobicContact CB-CG 4.08Å; C611-L651 HydrophobicContact CB-CD2 3.87Å; L617-L651 HydrophobicContact CD2-CB 4.34Å; G647-L651 PolarHBondContact O-N 2.94Å; G647-L651 VanDerWaalsContact O-N 3.09Å; L648-L651 WeakPolarHBondContact O-CB 3.41Å; L648-L651 PolarHBondContact O-N 2.81Å; L648-L651 VanDerWaalsContact O-N 3.13Å; L651-A654 PolarHBondContact O-N 2.82Å; L651-A655 PolarHBondContact O-N 2.79Å
652	L	97.5	Very high	96.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-37	179.6	-66.5	168.8	0	0	0	111.9	L648 G656 L659 L662 L678 A679 Y682 C683	L648-L652 HydrophobicContact CD1-CD1 3.96Å; L648-L652 HydrophobicContact CD1-CD2 4.38Å; L648-L652 HydrophobicContact CD1-CG 3.89Å; L648-L652 HydrophobicContact CD2-CD1 4.44Å; L648-L652 HydrophobicContact CG-CD1 3.78Å; L648-L652 HydrophobicContact CG-CG 4.21Å; L648-L652 WeakPolarHBondContact O-CB 3.39Å; L648-L652 VanDerWaalsContact O-CG 3.29Å; L648-L652 WeakPolarHBondContact O-CG 3.37Å; L648-L652 PolarHBondContact O-N 3.33Å; L652-G656 WeakPolarHBondContact O-CA 3.44Å; L652-G656 PolarHBondContact O-N 2.98Å; L652-L659 HydrophobicContact CD2-CD2 3.73Å; L652-L662 HydrophobicContact CD2-CD1 4.44Å; L652-L662 HydrophobicContact CD2-CD2 4.29Å; L652-L678 HydrophobicContact CD1-CB 3.79Å; L652-A679 HydrophobicContact CD1-CB 4.3Å; L652-A679 HydrophobicContact CD2-CB 4.32Å; L652-Y682 HydrophobicContact CB-CD2 4.23Å; L652-C683 PolarHBondContact O-SG 3.38Å
653	K	97.1	Very high	96.6	Very high	107 Å²	107	34.4 Å²	34.4	47%	0.465	20%	0.203	S	C	.	.	H	α-helix	trans	-65.9	-40.6	171.7	-77.1	170.3	-175.5	170.7	0	112.8	E649 S650 Y682	E649-K653 HydrophobicContact CG-CD 4.13Å; E649-K653 VanDerWaalsContact CG-CE 3.5Å; E649-K653 WeakPolarHBondContact O-CB 3.34Å; E649-K653 VanDerWaalsContact O-CG 3.22Å; E649-K653 WeakPolarHBondContact O-CG 3.49Å; E649-K653 PolarHBondContact O-N 2.94Å; E649-K653 WeakPolarHBondContact OE1-CE 3.43Å; E649-K653 IonicContact OE1-NZ 2.79Å; E649-K653 PolarHBondContact OE1-NZ 2.83Å; S650-K653 PolarHBondContact O-N 3.24Å; K653-Y682 HydrophobicContact CD-CE1 4.35Å; K653-Y682 WeakPolarHBondContact CE-OH 3.36Å; K653-Y682 HydrophobicContact CG-CD1 3.75Å; K653-Y682 HydrophobicContact CG-CD2 3.99Å; K653-Y682 HydrophobicContact CG-CE1 3.8Å; K653-Y682 HydrophobicContact CG-CE2 4.04Å; K653-Y682 HydrophobicContact CG-CG 3.87Å
654	A	96.7	Very high	96.8	Very high	28 Å²	28	31.9 Å²	31.9	23%	0.231	19%	0.186	C	C	.	.	H	α-helix	trans	-70	-47.4	-178.2	0	0	0	0	0	112.3	A608 T612 S650 L651	A608-A654 HydrophobicContact CB-CB 4.1Å; A608-A654 WeakPolarHBondContact O-CB 3.4Å; T612-A654 WeakPolarHBondContact CA-O 3.47Å; T612-A654 HydrophobicContact CG2-CB 4.31Å; S650-A654 WeakPolarHBondContact O-CB 3.42Å; S650-A654 PolarHBondContact O-N 2.85Å; L651-A654 PolarHBondContact O-N 2.82Å
655	A	95.8	Very high	96.8	Very high	6 Å²	6	32 Å²	32	5%	0.05	19%	0.187	C	C	.	.	H	α-helix	trans	-71.1	-37.3	176.6	0	0	0	0	0	111.9	A614 L651 G657 N658 L659	A614-A655 HydrophobicContact CB-CB 4.12Å; L651-A655 PolarHBondContact O-N 2.79Å; A655-G657 PolarHBondContact O-N 2.98Å; A655-N658 WeakPolarHBondContact O-CB 3.36Å; A655-N658 PolarHBondContact O-N 3.42Å; A655-L659 HydrophobicContact CB-CB 4.06Å; A655-L659 HydrophobicContact CB-CD1 4.4Å
656	G	94.3	Very high	96.5	Very high	14 Å²	14	35.8 Å²	35.8	14%	0.144	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	51.1	-123.5	172.3	0	0	0	0	0	113	L652 N658 Y682 C683	L652-G656 WeakPolarHBondContact O-CA 3.44Å; L652-G656 PolarHBondContact O-N 2.98Å; G656-N658 VanDerWaalsContact C-N 3.25Å; G656-N658 PolarHBondContact O-N 3.29Å; G656-Y682 CarbonylContact C-O 3.56Å; G656-C683 WeakPolarHBondContact O-CA 3.12Å; G656-C683 PolarHBondContact O-SG 3.2Å
657	G	92	Very high	96.3	Very high	48 Å²	48	33.1 Å²	33.1	50%	0.495	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-70	-10.4	179	0	0	0	0	0	115.8	A655 A685	A655-G657 PolarHBondContact O-N 2.98Å; G657-A685 VanDerWaalsContact O-CB 3.26Å; G657-A685 WeakPolarHBondContact O-CB 3.19Å
658	N	95.6	Very high	95.7	Very high	77 Å²	77	36 Å²	36	41%	0.412	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-82.4	-18.4	179.5	-60.2	-36.7	0	0	0	112.7	T612 A614 H615 A655 G656 L660	T612-N658 PolarHBondContact O-ND2 3.25Å; A614-N658 CarbonylContact O-C 3.5Å; H615-N658 WeakPolarHBondContact CA-O 3.5Å; A655-N658 WeakPolarHBondContact O-CB 3.36Å; A655-N658 PolarHBondContact O-N 3.42Å; G656-N658 VanDerWaalsContact C-N 3.25Å; G656-N658 PolarHBondContact O-N 3.29Å; N658-L660 PolarHBondContact O-N 2.88Å
659	L	97.5	Very high	95.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	21%	0.208	C	C	.	.			trans	-77.8	109	-175	-166.4	72.2	0	0	0	111.5	L617 L652 A655 L662 C683 L686	L617-L659 HydrophobicContact CB-CD1 3.85Å; L652-L659 HydrophobicContact CD2-CD2 3.73Å; A655-L659 HydrophobicContact CB-CB 4.06Å; A655-L659 HydrophobicContact CB-CD1 4.4Å; L659-L662 HydrophobicContact CD2-CB 4.38Å; L659-C683 HydrophobicContact CB-CB 4.28Å; L659-C683 HydrophobicContact CD2-CB 4.3Å; L659-L686 HydrophobicContact CD2-CD2 4.11Å; L659-L686 HydrophobicContact CG-CD2 4.01Å; L659-L686 WeakPolarHBondContact O-CD2 3.49Å; L659-L686 PolarHBondContact O-N 3.43Å
660	L	98.1	Very high	95.1	Very high	53 Å²	53	35.3 Å²	35.3	28%	0.277	20%	0.199	S	C	.	.			trans	-95.8	-29.8	178.4	-56	-178.8	0	0	0	112.5	H615 N658 A685 Q687 A688	H615-L660 PolarHBondContact O-N 3.44Å; N658-L660 PolarHBondContact O-N 2.88Å; L660-A685 HydrophobicContact CD2-CB 4.08Å; L660-A685 WeakPolarHBondContact CD2-O 3.42Å; L660-Q687 PolarHBondContact O-N 3.38Å; L660-A688 PolarHBondContact O-N 3.32Å
661	I	98.4	Very high	94.9	Very high	75 Å²	75	33.3 Å²	33.3	39%	0.385	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125.3	-175.8	-50.5	-178	0	0	0	110.4	H615 S616 L617 A688	H615-I661 PolarHBondContact O-N 3.22Å; S616-I661 WeakPolarHBondContact CA-O 3.45Å; L617-I661 PolarHBondContact N-O 3.43Å; I661-A688 WeakPolarHBondContact CA-O 3.49Å; I661-A688 HydrophobicContact CG1-CB 4.23Å; I661-A688 HydrophobicContact CG2-CB 4.25Å
662	L	98.3	Very high	94.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	120.8	171.4	177.8	62.6	0	0	0	110.1	L617 L652 L659 I664 A679 L686 A688 V689 T690	L617-L662 HydrophobicContact CB-CD1 4.18Å; L617-L662 HydrophobicContact CD2-CD1 3.98Å; L617-L662 HydrophobicContact CG-CD1 4.11Å; L617-L662 WeakPolarHBondContact O-CA 3.41Å; L652-L662 HydrophobicContact CD2-CD1 4.44Å; L652-L662 HydrophobicContact CD2-CD2 4.29Å; L659-L662 HydrophobicContact CD2-CB 4.38Å; L662-I664 HydrophobicContact CD1-CD1 4.26Å; L662-I664 HydrophobicContact CD1-CG1 4.15Å; L662-I664 HydrophobicContact CG-CG1 4.45Å; L662-A679 HydrophobicContact CD2-CB 3.56Å; L662-L686 HydrophobicContact CB-CD1 4.44Å; L662-L686 HydrophobicContact CB-CD2 3.74Å; L662-L686 HydrophobicContact CD2-CD1 4.4Å; L662-A688 PolarHBondContact N-O 3.22Å; L662-V689 CarbonylContact O-C 3.55Å; L662-V689 WeakPolarHBondContact O-CA 3.42Å; L662-T690 PolarHBondContact O-N 3.02Å
663	R	98.3	Very high	94.6	Very high	95 Å²	95	34.5 Å²	34.5	36%	0.358	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.9	176.1	176.2	170.8	173	137	-6	110.5	L617 T618 L619 Q620 T690	L617-R663 PolarHBondContact O-N 3.36Å; T618-R663 CarbonylContact C-O 3.4Å; T618-R663 WeakPolarHBondContact CA-O 3.23Å; T618-R663 HydrophobicContact CG2-CB 4.11Å; T618-R663 HydrophobicContact CG2-CG 3.96Å; L619-R663 PolarHBondContact N-O 3.26Å; Q620-R663 VanDerWaalsContact OE1-NE 3.1Å; R663-T690 CarbonylContact C-O 3.58Å; R663-T690 WeakPolarHBondContact CA-O 3.34Å; R663-T690 HydrophobicContact CG-CG2 4.05Å
664	I	97.3	Very high	94.5	Very high	3 Å²	3	33 Å²	33	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.2	173.5	-58.5	177.7	0	0	0	107	L619 L648 L662 C667 L671 T690 Y691 R692	L619-I664 HydrophobicContact CB-CG1 4.48Å; L619-I664 HydrophobicContact CD1-CG1 4.48Å; L619-I664 WeakPolarHBondContact O-CA 3.47Å; L648-I664 HydrophobicContact CD2-CD1 3.89Å; L662-I664 HydrophobicContact CD1-CD1 4.26Å; L662-I664 HydrophobicContact CD1-CG1 4.15Å; L662-I664 HydrophobicContact CG-CG1 4.45Å; I664-C667 HydrophobicContact CG2-CB 4.41Å; I664-L671 HydrophobicContact CG2-CB 4.41Å; I664-L671 HydrophobicContact CG2-CD1 3.91Å; I664-T690 PolarHBondContact N-O 3.26Å; I664-Y691 HydrophobicContact CB-CD2 3.94Å; I664-Y691 HydrophobicContact CD1-CD2 4.43Å; I664-Y691 HydrophobicContact CG2-CD2 3.97Å; I664-Y691 HydrophobicContact CG2-CE2 4.08Å; I664-Y691 CarbonylContact O-C 3.54Å; I664-Y691 VanDerWaalsContact O-CA 3.25Å; I664-Y691 WeakPolarHBondContact O-CA 3.39Å; I664-R692 PolarHBondContact O-N 3.19Å
665	S	95.6	Very high	94.5	Very high	5 Å²	5	31.7 Å²	31.7	4%	0.035	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	136.2	-172.2	-169.2	0	0	0	0	111.6	L619 Q620 N621 C667 R692	L619-S665 PolarHBondContact O-N 3.1Å; Q620-S665 CarbonylContact C-O 3.59Å; Q620-S665 VanDerWaalsContact CA-O 3.3Å; Q620-S665 WeakPolarHBondContact CA-O 3.46Å; N621-S665 PolarHBondContact N-O 3.12Å; S665-C667 VanDerWaalsContact C-N 3.28Å; S665-C667 PolarHBondContact O-N 3.07Å; S665-C667 PolarHBondContact O-SG 3.39Å; S665-C667 VanDerWaalsContact O-SG 3.42Å; S665-R692 WeakPolarHBondContact CA-O 3.45Å
666	H	90.4	Very high	94.6	Very high	92 Å²	92	31.5 Å²	31.5	43%	0.426	17%	0.17	S	C	.	.	S	Bend	trans	56.8	37	178.1	-58.7	73.2	0	0	0	113.7	N621 P668 R692 L721	N621-H666 VanDerWaalsContact CA-O 3.3Å; N621-H666 WeakPolarHBondContact CA-O 3.23Å; N621-H666 HydrophobicContact CB-CB 4.37Å; H666-P668 WeakPolarHBondContact O-CD 3.48Å; H666-R692 PolarHBondContact N-O 2.9Å; H666-L721 HydrophobicContact CB-CD1 4.31Å
667	C	91.6	Very high	94.7	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.027	17%	0.167	C	C	.	.			trans	-108	62.5	177.7	-65	0	0	0	0	111.3	I664 S665 I670 L671	I664-C667 HydrophobicContact CG2-CB 4.41Å; S665-C667 VanDerWaalsContact C-N 3.28Å; S665-C667 PolarHBondContact O-N 3.07Å; S665-C667 PolarHBondContact O-SG 3.39Å; S665-C667 VanDerWaalsContact O-SG 3.42Å; C667-I670 HydrophobicContact CB-CD1 4.19Å; C667-I670 HydrophobicContact CB-CG1 4.06Å; C667-L671 HydrophobicContact CB-CB 4.22Å; C667-L671 HydrophobicContact CB-CD1 4.05Å; C667-L671 HydrophobicContact CB-CG 4.5Å
668	P	83.9	Confident	94.9	Very high	59 Å²	59	29.6 Å²	29.6	38%	0.383	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	137.6	-168.7	28	-36.7	0	0	0	112.3	H666 I670 T695	H666-P668 WeakPolarHBondContact O-CD 3.48Å; P668-I670 PolarHBondContact O-N 2.69Å; P668-T695 HydrophobicContact CB-CG2 3.71Å
669	N	88.8	Confident	95	Very high	28 Å²	28	26 Å²	26	15%	0.15	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	-39	-178.3	-162	47.6	0	0	0	116.6	A637 T640 R641 G642 L671 T695	A637-N669 PolarHBondContact O-ND2 2.92Å; T640-N669 PolarHBondContact OG1-ND2 3.45Å; R641-N669 CarbonylContact C-O 3.59Å; R641-N669 VanDerWaalsContact CA-O 3.31Å; R641-N669 WeakPolarHBondContact CA-O 3.37Å; R641-N669 WeakPolarHBondContact CB-OD1 3.4Å; R641-N669 WeakPolarHBondContact CG-OD1 3.44Å; R641-N669 PolarHBondContact N-ND2 3.11Å; R641-N669 PolarHBondContact NH1-OD1 3.12Å; G642-N669 PolarHBondContact N-O 3.05Å; N669-L671 VanDerWaalsContact C-N 3.33Å; N669-L671 PolarHBondContact O-N 2.87Å; N669-T695 PolarHBondContact N-OG1 2.93Å
670	I	93.9	Very high	94.9	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-22.8	-174.4	60.3	179.6	0	0	0	115	L622 P624 G642 C643 L644 C667 P668	L622-I670 HydrophobicContact CB-CD1 3.71Å; L622-I670 WeakPolarHBondContact O-CD1 3.45Å; P624-I670 HydrophobicContact CB-CG2 3.65Å; P624-I670 HydrophobicContact CG-CG2 4.41Å; G642-I670 CarbonylContact C-O 3.52Å; G642-I670 VanDerWaalsContact C-O 3.25Å; G642-I670 WeakPolarHBondContact CA-O 3.46Å; C643-I670 PolarHBondContact N-O 3.24Å; L644-I670 HydrophobicContact CD1-CB 4.33Å; L644-I670 HydrophobicContact CD1-CD1 3.86Å; L644-I670 HydrophobicContact CD1-CG1 4.26Å; L644-I670 HydrophobicContact CG-CB 4.39Å; L644-I670 PolarHBondContact N-O 3.34Å; C667-I670 HydrophobicContact CB-CD1 4.19Å; C667-I670 HydrophobicContact CB-CG1 4.06Å; P668-I670 PolarHBondContact O-N 2.69Å
671	L	94.8	Very high	94.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-135.3	108	176	-74.3	175.2	0	0	0	108.1	L619 L644 E645 L648 I664 C667 N669 Y691	L619-L671 HydrophobicContact CD1-CD1 3.79Å; L644-L671 HydrophobicContact CB-CD2 3.66Å; L644-L671 HydrophobicContact CB-CG 4.14Å; L644-L671 HydrophobicContact CD1-CG 4.4Å; E645-L671 HydrophobicContact CG-CD2 4.31Å; L648-L671 HydrophobicContact CB-CD2 4.4Å; L648-L671 HydrophobicContact CD2-CD2 3.74Å; I664-L671 HydrophobicContact CG2-CB 4.41Å; I664-L671 HydrophobicContact CG2-CD1 3.91Å; C667-L671 HydrophobicContact CB-CB 4.22Å; C667-L671 HydrophobicContact CB-CD1 4.05Å; C667-L671 HydrophobicContact CB-CG 4.5Å; N669-L671 VanDerWaalsContact C-N 3.33Å; N669-L671 PolarHBondContact O-N 2.87Å; L671-Y691 PolarHBondContact O-OH 3.29Å
672	T	94.6	Very high	94.7	Very high	12 Å²	12	25.5 Å²	25.5	7%	0.074	12%	0.123	C	C	.	.			trans	-84.4	177.7	176.1	71.8	0	0	0	0	111	R641 E645 R674 S675	R641-T672 HydrophobicContact CG-CG2 4.15Å; E645-T672 WeakPolarHBondContact OE1-CB 3.46Å; E645-T672 PolarHBondContact OE1-N 2.99Å; E645-T672 PolarHBondContact OE1-OG1 3.3Å; T672-R674 PolarHBondContact O-N 3.42Å; T672-R674 VanDerWaalsContact O-N 3.12Å; T672-R674 VanDerWaalsContact OG1-CB 3.29Å; T672-R674 WeakPolarHBondContact OG1-CB 3.49Å; T672-R674 PolarHBondContact OG1-N 2.64Å; T672-S675 WeakPolarHBondContact O-CB 3.34Å; T672-S675 PolarHBondContact O-N 3.28Å; T672-S675 PolarHBondContact O-OG 3.15Å
673	D	93.6	Very high	94.6	Very high	16 Å²	16	25.5 Å²	25.5	9%	0.086	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-20	172.2	65.2	-39	0	0	0	113.4	S675 L676 W677 Y691 V702 R729	D673-S675 PolarHBondContact O-N 3.18Å; D673-L676 WeakPolarHBondContact O-CB 3.48Å; D673-L676 PolarHBondContact O-N 2.94Å; D673-W677 PolarHBondContact O-N 3.15Å; D673-Y691 PolarHBondContact N-OH 2.85Å; D673-Y691 VanDerWaalsContact N-OH 3.11Å; D673-V702 HydrophobicContact CB-CG2 4.39Å; D673-V702 VanDerWaalsContact OD2-CG2 3.28Å; D673-V702 WeakPolarHBondContact OD2-CG2 3.42Å; D673-R729 IonicContact OD1-NH1 2.68Å; D673-R729 IonicContact OD2-CZ 2.93Å; D673-R729 IonicContact OD2-NH1 2.71Å; D673-R729 PolarHBondContact OD2-NH1 3.33Å; D673-R729 IonicContact OD2-NH2 2.74Å; D673-R729 PolarHBondContact OD2-NH2 2.59Å
674	R	95.4	Very high	94.5	Very high	76 Å²	76	27.3 Å²	27.3	29%	0.287	13%	0.13	S	C	.	.	H	α-helix	trans	-53.6	-23.1	167.3	-175.7	163.4	171.4	-121.1	3.4	113	E645 T672 L676 W677 L678	E645-R674 VanDerWaalsContact OE2-CD 3.31Å; E645-R674 WeakPolarHBondContact OE2-CD 3.4Å; E645-R674 IonicContact OE2-CZ 2.63Å; E645-R674 IonicContact OE2-NE 3.73Å; E645-R674 IonicContact OE2-NH1 3.19Å; E645-R674 PolarHBondContact OE2-NH1 2.89Å; T672-R674 PolarHBondContact O-N 3.42Å; T672-R674 VanDerWaalsContact O-N 3.12Å; T672-R674 VanDerWaalsContact OG1-CB 3.29Å; T672-R674 WeakPolarHBondContact OG1-CB 3.49Å; T672-R674 PolarHBondContact OG1-N 2.64Å; R674-L676 VanDerWaalsContact C-N 3.29Å; R674-L676 PolarHBondContact O-N 3.28Å; R674-W677 HydrophobicContact CG-CE3 4.38Å; R674-W677 WeakPolarHBondContact O-CB 3.39Å; R674-W677 PolarHBondContact O-N 3.2Å; R674-W677 VanDerWaalsContact O-N 3.15Å; R674-L678 HydrophobicContact CG-CD1 4.49Å; R674-L678 HydrophobicContact CG-CG 4.42Å; R674-L678 WeakPolarHBondContact O-CG 3.43Å; R674-L678 PolarHBondContact O-N 3.25Å
675	S	96.6	Very high	94.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.8	-40.3	170	-53.6	0	0	0	0	112.7	T672 D673 A679	T672-S675 WeakPolarHBondContact O-CB 3.34Å; T672-S675 PolarHBondContact O-N 3.28Å; T672-S675 PolarHBondContact O-OG 3.15Å; D673-S675 PolarHBondContact O-N 3.18Å; S675-A679 PolarHBondContact O-N 3.49Å; S675-A679 VanDerWaalsContact O-N 3.07Å
676	L	96.9	Very high	94.5	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-74.5	-35.5	174.8	-70.4	179.3	0	0	0	112.1	D673 R674 L678 A679 S680 V689 Y691 V698 V702 L706	D673-L676 WeakPolarHBondContact O-CB 3.48Å; D673-L676 PolarHBondContact O-N 2.94Å; R674-L676 VanDerWaalsContact C-N 3.29Å; R674-L676 PolarHBondContact O-N 3.28Å; L676-L678 VanDerWaalsContact C-N 3.34Å; L676-A679 WeakPolarHBondContact O-CB 3.33Å; L676-A679 PolarHBondContact O-N 3.09Å; L676-S680 PolarHBondContact O-N 3.45Å; L676-V689 HydrophobicContact CD2-CG1 3.51Å; L676-Y691 HydrophobicContact CD1-CD1 4.3Å; L676-Y691 HydrophobicContact CD1-CG 3.95Å; L676-Y691 HydrophobicContact CG-CD2 4.17Å; L676-Y691 HydrophobicContact CG-CG 4.04Å; L676-V698 HydrophobicContact CD1-CG1 3.88Å; L676-V698 HydrophobicContact CD1-CG2 3.82Å; L676-V702 HydrophobicContact CB-CG1 3.57Å; L676-V702 HydrophobicContact CD1-CG1 4.2Å; L676-L706 HydrophobicContact CD2-CD2 4.35Å
677	W	96.3	Very high	94.8	Very high	23 Å²	23	28.4 Å²	28.4	9%	0.087	14%	0.14	C	C	.	.	H	α-helix	trans	-61.9	-43	173.4	-178.7	87.4	0	0	0	111.3	Q465 A466 D673 R674 S680 C681	Q465-W677 HydrophobicContact CG-CH2 4.44Å; A466-W677 HydrophobicContact CB-CZ2 4.41Å; D673-W677 PolarHBondContact O-N 3.15Å; R674-W677 HydrophobicContact CG-CE3 4.38Å; R674-W677 WeakPolarHBondContact O-CB 3.39Å; R674-W677 PolarHBondContact O-N 3.2Å; R674-W677 VanDerWaalsContact O-N 3.15Å; W677-S680 WeakPolarHBondContact O-CB 3.47Å; W677-S680 PolarHBondContact O-N 3.43Å; W677-S680 PolarHBondContact O-OG 2.98Å; W677-C681 PolarHBondContact O-N 3.47Å; W677-C681 PolarHBondContact O-SG 3.28Å
678	L	97.2	Very high	95.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-44.8	172.7	-70.2	167.7	0	0	0	111.3	E645 E649 L652 R674 L676 S680 C681 Y682	E645-L678 HydrophobicContact CB-CD1 4.17Å; E649-L678 HydrophobicContact CB-CD1 4.14Å; E649-L678 HydrophobicContact CB-CD2 4.04Å; E649-L678 HydrophobicContact CG-CD2 3.91Å; L652-L678 HydrophobicContact CD1-CB 3.79Å; R674-L678 HydrophobicContact CG-CD1 4.49Å; R674-L678 HydrophobicContact CG-CG 4.42Å; R674-L678 WeakPolarHBondContact O-CG 3.43Å; R674-L678 PolarHBondContact O-N 3.25Å; L676-L678 VanDerWaalsContact C-N 3.34Å; L678-S680 VanDerWaalsContact C-N 3.29Å; L678-S680 PolarHBondContact O-N 3.44Å; L678-C681 WeakPolarHBondContact O-CB 3.37Å; L678-C681 PolarHBondContact O-N 3.13Å; L678-C681 VanDerWaalsContact O-N 3.12Å; L678-Y682 HydrophobicContact CD2-CE2 4.25Å; L678-Y682 WeakPolarHBondContact O-CD2 3.3Å; L678-Y682 PolarHBondContact O-N 3.22Å
679	A	97.1	Very high	95.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.6	-40.9	176.2	0	0	0	0	0	112.1	L652 L662 S675 L676 C681 Y682 C683 L686	L652-A679 HydrophobicContact CD1-CB 4.3Å; L652-A679 HydrophobicContact CD2-CB 4.32Å; L662-A679 HydrophobicContact CD2-CB 3.56Å; S675-A679 PolarHBondContact O-N 3.49Å; S675-A679 VanDerWaalsContact O-N 3.07Å; L676-A679 WeakPolarHBondContact O-CB 3.33Å; L676-A679 PolarHBondContact O-N 3.09Å; A679-C681 PolarHBondContact O-N 2.99Å; A679-Y682 PolarHBondContact O-N 3.41Å; A679-C683 PolarHBondContact O-N 2.91Å; A679-L686 HydrophobicContact CB-CD1 3.98Å
680	S	96.1	Very high	96.3	Very high	10 Å²	10	26.4 Å²	26.4	7%	0.07	13%	0.13	C	C	.	.	H	α-helix	trans	-61.6	-28.1	176.9	84.6	0	0	0	0	114.1	L676 W677 L678 A705 G709	L676-S680 PolarHBondContact O-N 3.45Å; W677-S680 WeakPolarHBondContact O-CB 3.47Å; W677-S680 PolarHBondContact O-N 3.43Å; W677-S680 PolarHBondContact O-OG 2.98Å; L678-S680 VanDerWaalsContact C-N 3.29Å; L678-S680 PolarHBondContact O-N 3.44Å; S680-A705 WeakPolarHBondContact CB-O 3.35Å; S680-G709 VanDerWaalsContact O-CA 3.23Å; S680-G709 WeakPolarHBondContact O-CA 3.46Å
681	C	95.7	Very high	96.4	Very high	50 Å²	50	26.5 Å²	26.5	34%	0.338	13%	0.13	S	C	.	.	H	α-helix	trans	-77.1	-32.4	178.1	-66.2	0	0	0	0	113	W677 L678 A679	W677-C681 PolarHBondContact O-N 3.47Å; W677-C681 PolarHBondContact O-SG 3.28Å; L678-C681 WeakPolarHBondContact O-CB 3.37Å; L678-C681 PolarHBondContact O-N 3.13Å; L678-C681 VanDerWaalsContact O-N 3.12Å; A679-C681 PolarHBondContact O-N 2.99Å
682	Y	96.6	Very high	96.4	Very high	59 Å²	59	28.3 Å²	28.3	23%	0.231	14%	0.137	C	C	.	.	H	α-helix	trans	-118	-33.4	-165.9	-55	-58	0	0	0	114.7	E649 L652 K653 G656 L678 A679	E649-Y682 HydrophobicContact CG-CE2 3.89Å; E649-Y682 PolarHBondContact OE1-OH 3.49Å; L652-Y682 HydrophobicContact CB-CD2 4.23Å; K653-Y682 HydrophobicContact CD-CE1 4.35Å; K653-Y682 WeakPolarHBondContact CE-OH 3.36Å; K653-Y682 HydrophobicContact CG-CD1 3.75Å; K653-Y682 HydrophobicContact CG-CD2 3.99Å; K653-Y682 HydrophobicContact CG-CE1 3.8Å; K653-Y682 HydrophobicContact CG-CE2 4.04Å; K653-Y682 HydrophobicContact CG-CG 3.87Å; G656-Y682 CarbonylContact C-O 3.56Å; L678-Y682 HydrophobicContact CD2-CE2 4.25Å; L678-Y682 WeakPolarHBondContact O-CD2 3.3Å; L678-Y682 PolarHBondContact O-N 3.22Å; A679-Y682 PolarHBondContact O-N 3.41Å
683	C	96.2	Very high	96.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.			trans	-109.4	70	-167.9	-60.2	0	0	0	0	112.5	L652 G656 L659 A679 A685 L686 C710	L652-C683 PolarHBondContact O-SG 3.38Å; G656-C683 WeakPolarHBondContact O-CA 3.12Å; G656-C683 PolarHBondContact O-SG 3.2Å; L659-C683 HydrophobicContact CB-CB 4.28Å; L659-C683 HydrophobicContact CD2-CB 4.3Å; A679-C683 PolarHBondContact O-N 2.91Å; C683-A685 PolarHBondContact O-N 2.86Å; C683-L686 HydrophobicContact CB-CD1 3.66Å; C683-L686 HydrophobicContact CB-CG 3.78Å; C683-L686 WeakPolarHBondContact O-CG 3.48Å; C683-L686 PolarHBondContact O-N 3.17Å; C683-C710 PolarHBondContact O-SG 2.93Å
684	R	95.3	Very high	96.2	Very high	134 Å²	134	28.4 Å²	28.4	51%	0.506	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-25.3	-172.5	-56.4	-161.5	68.4	70.6	7.8	114.8	A708 G709	R684-A708 PolarHBondContact NH2-O 2.95Å; R684-G709 PolarHBondContact NH1-O 3.37Å; R684-G709 PolarHBondContact NH2-O 2.92Å
685	A	95.7	Very high	95.9	Very high	31 Å²	31	25.4 Å²	25.4	26%	0.256	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	10.7	-176.5	0	0	0	0	0	114.5	G657 L660 C683 Q687	G657-A685 VanDerWaalsContact O-CB 3.26Å; G657-A685 WeakPolarHBondContact O-CB 3.19Å; L660-A685 HydrophobicContact CD2-CB 4.08Å; L660-A685 WeakPolarHBondContact CD2-O 3.42Å; C683-A685 PolarHBondContact O-N 2.86Å; A685-Q687 PolarHBondContact O-N 3.38Å
686	L	97.6	Very high	95.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.131	C	C	.	.			trans	-58.2	124.2	177.9	-80.8	170.1	0	0	0	111.4	L659 L662 A679 C683 V689 C710 E712 I713	L659-L686 HydrophobicContact CD2-CD2 4.11Å; L659-L686 HydrophobicContact CG-CD2 4.01Å; L659-L686 WeakPolarHBondContact O-CD2 3.49Å; L659-L686 PolarHBondContact O-N 3.43Å; L662-L686 HydrophobicContact CB-CD1 4.44Å; L662-L686 HydrophobicContact CB-CD2 3.74Å; L662-L686 HydrophobicContact CD2-CD1 4.4Å; A679-L686 HydrophobicContact CB-CD1 3.98Å; C683-L686 HydrophobicContact CB-CD1 3.66Å; C683-L686 HydrophobicContact CB-CG 3.78Å; C683-L686 WeakPolarHBondContact O-CG 3.48Å; C683-L686 PolarHBondContact O-N 3.17Å; L686-V689 HydrophobicContact CB-CG2 4Å; L686-V689 HydrophobicContact CD1-CG2 4.12Å; L686-V689 HydrophobicContact CD2-CG2 4.38Å; L686-V689 HydrophobicContact CG-CG2 4.4Å; L686-C710 HydrophobicContact CB-CB 4.26Å; L686-E712 CarbonylContact O-C 3.54Å; L686-I713 HydrophobicContact CB-CG1 4.5Å; L686-I713 WeakPolarHBondContact O-CG1 3.5Å; L686-I713 PolarHBondContact O-N 3.05Å
687	Q	97.4	Very high	95.4	Very high	91 Å²	91	25.4 Å²	25.4	43%	0.425	13%	0.131	S	C	.	.			trans	-108.1	-34.6	179.4	-70.5	179.9	7.4	0	0	112.2	L660 A685 E712 I713 V714 S715	L660-Q687 PolarHBondContact O-N 3.38Å; A685-Q687 PolarHBondContact O-N 3.38Å; Q687-E712 WeakPolarHBondContact CA-O 3.47Å; Q687-I713 WeakPolarHBondContact O-CA 3.34Å; Q687-V714 HydrophobicContact CB-CG2 4.17Å; Q687-V714 WeakPolarHBondContact O-CG2 3.34Å; Q687-V714 PolarHBondContact O-N 2.87Å; Q687-S715 PolarHBondContact O-N 3.03Å
688	A	98.2	Very high	95.3	Very high	25 Å²	25	24.3 Å²	24.3	21%	0.207	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	118.7	178.3	0	0	0	0	0	110.8	L660 I661 L662 S715	L660-A688 PolarHBondContact O-N 3.32Å; I661-A688 WeakPolarHBondContact CA-O 3.49Å; I661-A688 HydrophobicContact CG1-CB 4.23Å; I661-A688 HydrophobicContact CG2-CB 4.25Å; L662-A688 PolarHBondContact N-O 3.22Å; A688-S715 WeakPolarHBondContact CA-O 3.45Å
689	V	98.3	Very high	95.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119	-178.1	179.3	0	0	0	0	110.3	L662 L676 L686 L706 I713 S715 L716 Q717	L662-V689 CarbonylContact O-C 3.55Å; L662-V689 WeakPolarHBondContact O-CA 3.42Å; L676-V689 HydrophobicContact CD2-CG1 3.51Å; L686-V689 HydrophobicContact CB-CG2 4Å; L686-V689 HydrophobicContact CD1-CG2 4.12Å; L686-V689 HydrophobicContact CD2-CG2 4.38Å; L686-V689 HydrophobicContact CG-CG2 4.4Å; V689-L706 HydrophobicContact CG1-CD2 4.27Å; V689-I713 HydrophobicContact CB-CD1 4.39Å; V689-I713 HydrophobicContact CG2-CD1 3.69Å; V689-I713 HydrophobicContact CG2-CG1 4.14Å; V689-S715 PolarHBondContact N-O 3.34Å; V689-L716 HydrophobicContact CB-CD1 4Å; V689-L716 HydrophobicContact CG1-CD1 4.21Å; V689-L716 CarbonylContact O-C 3.57Å; V689-L716 WeakPolarHBondContact O-CA 3.46Å; V689-Q717 PolarHBondContact O-N 3.48Å
690	T	97.9	Very high	94.9	Very high	24 Å²	24	26.9 Å²	26.9	15%	0.147	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.9	169	-58.5	0	0	0	0	109.6	L662 R663 I664 R692 Q717	L662-T690 PolarHBondContact O-N 3.02Å; R663-T690 CarbonylContact C-O 3.58Å; R663-T690 WeakPolarHBondContact CA-O 3.34Å; R663-T690 HydrophobicContact CG-CG2 4.05Å; I664-T690 PolarHBondContact N-O 3.26Å; T690-R692 HydrophobicContact CG2-CG 4.22Å; T690-Q717 CarbonylContact C-O 3.6Å; T690-Q717 WeakPolarHBondContact CA-O 3.29Å; T690-Q717 HydrophobicContact CG2-CB 3.92Å; T690-Q717 WeakPolarHBondContact OG1-CB 3.41Å
691	Y	97.3	Very high	94.9	Very high	3 Å²	3	30.4 Å²	30.4	1%	0.012	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	108.5	166.2	178.7	-82.7	0	0	0	108.5	I664 L671 D673 L676 S693 D696 V698 Q717 V718	I664-Y691 HydrophobicContact CB-CD2 3.94Å; I664-Y691 HydrophobicContact CD1-CD2 4.43Å; I664-Y691 HydrophobicContact CG2-CD2 3.97Å; I664-Y691 HydrophobicContact CG2-CE2 4.08Å; I664-Y691 CarbonylContact O-C 3.54Å; I664-Y691 VanDerWaalsContact O-CA 3.25Å; I664-Y691 WeakPolarHBondContact O-CA 3.39Å; L671-Y691 PolarHBondContact O-OH 3.29Å; D673-Y691 PolarHBondContact N-OH 2.85Å; D673-Y691 VanDerWaalsContact N-OH 3.11Å; L676-Y691 HydrophobicContact CD1-CD1 4.3Å; L676-Y691 HydrophobicContact CD1-CG 3.95Å; L676-Y691 HydrophobicContact CG-CD2 4.17Å; L676-Y691 HydrophobicContact CG-CG 4.04Å; Y691-S693 WeakPolarHBondContact OH-CB 3.34Å; Y691-D696 VanDerWaalsContact CE1-O 3.23Å; Y691-D696 WeakPolarHBondContact CE1-O 3.39Å; Y691-D696 PolarHBondContact OH-O 2.74Å; Y691-V698 HydrophobicContact CD1-CG2 3.37Å; Y691-V698 HydrophobicContact CE1-CG2 3.87Å; Y691-V698 HydrophobicContact CG-CG2 4.29Å; Y691-Q717 PolarHBondContact N-O 3.42Å; Y691-V718 WeakPolarHBondContact O-CA 3.47Å
692	R	94.7	Very high	94.9	Very high	38 Å²	38	28.4 Å²	28.4	14%	0.143	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.8	178.8	-66.8	-173.1	165	-124.2	9.2	109.4	I664 S665 H666 T690 A719 L721 E774 D776	I664-R692 PolarHBondContact O-N 3.19Å; S665-R692 WeakPolarHBondContact CA-O 3.45Å; H666-R692 PolarHBondContact N-O 2.9Å; T690-R692 HydrophobicContact CG2-CG 4.22Å; R692-A719 WeakPolarHBondContact CG-O 3.49Å; R692-L721 HydrophobicContact CB-CD1 4.29Å; R692-L721 HydrophobicContact CB-CD2 3.84Å; R692-L721 HydrophobicContact CB-CG 3.86Å; R692-L721 WeakPolarHBondContact O-CD1 3.47Å; R692-E774 IonicContact NH2-OE2 2.87Å; R692-E774 PolarHBondContact NH2-OE2 3.29Å; R692-D776 IonicContact CZ-OD2 2.63Å; R692-D776 IonicContact NH1-OD2 3.41Å; R692-D776 PolarHBondContact NH1-OD2 3.16Å; R692-D776 IonicContact NH2-OD2 3.28Å
693	S	92.9	Very high	94.9	Very high	4 Å²	4	25.8 Å²	25.8	3%	0.028	13%	0.131	C	C	.	.			trans	-140.4	145.2	-174.6	-176.3	0	0	0	0	111.6	Y691 D696 L721	Y691-S693 WeakPolarHBondContact OH-CB 3.34Å; S693-D696 PolarHBondContact OG-N 3.36Å; S693-L721 PolarHBondContact O-N 2.99Å
694	A	90.4	Very high	94.9	Very high	26 Å²	26	33.6 Å²	33.6	22%	0.215	16%	0.16	C	C	.	.	S	Bend	trans	-93.5	-32.9	177.1	0	0	0	0	0	112.6	L721 Q725	A694-L721 WeakPolarHBondContact CA-O 3.36Å; A694-L721 HydrophobicContact CB-CB 3.97Å; A694-Q725 PolarHBondContact O-N 2.73Å
695	T	89.8	Confident	94.9	Very high	13 Å²	13	27.8 Å²	27.8	8%	0.08	14%	0.141	C	C	.	.	S	Bend	trans	-86	-33.2	-179	61.3	0	0	0	0	112.2	P668 N669	P668-T695 HydrophobicContact CB-CG2 3.71Å; N669-T695 PolarHBondContact N-OG1 2.93Å
696	D	90.8	Very high	95	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.13	C	C	.	.	S	Bend	trans	-137.5	66.1	-166.9	-69.3	-80.8	0	0	0	111.3	R641 Y691 S693	R641-D696 IonicContact CZ-OD1 2.82Å; R641-D696 IonicContact CZ-OD2 3.77Å; R641-D696 VanDerWaalsContact NH1-CG 3.26Å; R641-D696 IonicContact NH1-OD1 2.65Å; R641-D696 PolarHBondContact NH1-OD1 3.4Å; R641-D696 IonicContact NH1-OD2 3.92Å; R641-D696 PolarHBondContact NH1-OD2 2.77Å; R641-D696 IonicContact NH2-OD1 3.4Å; R641-D696 PolarHBondContact NH2-OD1 3.05Å; Y691-D696 VanDerWaalsContact CE1-O 3.23Å; Y691-D696 WeakPolarHBondContact CE1-O 3.39Å; Y691-D696 PolarHBondContact OH-O 2.74Å; S693-D696 PolarHBondContact OG-N 3.36Å
697	P	92.6	Very high	94.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-61.9	151.3	173.4	28.8	-36.8	0	0	0	111.3	G699 P720 Q726 R729	P697-G699 PolarHBondContact O-N 3.23Å; P697-P720 HydrophobicContact CB-CB 4.03Å; P697-P720 HydrophobicContact CB-CG 3.91Å; P697-Q726 HydrophobicContact CG-CB 3.87Å; P697-Q726 WeakPolarHBondContact CG-O 3.41Å; P697-R729 HydrophobicContact CG-CB 4.17Å; P697-R729 PolarHBondContact O-NH1 2.71Å
698	V	93.8	Very high	94.8	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-69.7	130.7	-171.1	-164.3	0	0	0	0	111.9	L676 Y691 V702 I703 V718 F730	L676-V698 HydrophobicContact CD1-CG1 3.88Å; L676-V698 HydrophobicContact CD1-CG2 3.82Å; Y691-V698 HydrophobicContact CD1-CG2 3.37Å; Y691-V698 HydrophobicContact CE1-CG2 3.87Å; Y691-V698 HydrophobicContact CG-CG2 4.29Å; V698-V702 HydrophobicContact CG1-CB 4Å; V698-V702 HydrophobicContact CG1-CG1 3.93Å; V698-I703 HydrophobicContact CG1-CD1 4.3Å; V698-I703 HydrophobicContact CG1-CG1 3.75Å; V698-V718 HydrophobicContact CG2-CB 4.17Å; V698-V718 HydrophobicContact CG2-CG1 4.27Å; V698-F730 HydrophobicContact CB-CD2 4.44Å
699	G	93.1	Very high	94.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-86.5	151.6	170.2	0	0	0	0	0	113.5	P697 E701 V702 I703	P697-G699 PolarHBondContact O-N 3.23Å; G699-E701 VanDerWaalsContact C-OE2 3.23Å; G699-E701 WeakPolarHBondContact CA-OE2 3.43Å; G699-E701 PolarHBondContact O-N 3.41Å; G699-E701 VanDerWaalsContact O-N 3.14Å; G699-V702 PolarHBondContact O-N 2.87Å; G699-I703 PolarHBondContact O-N 2.99Å; G699-I703 VanDerWaalsContact O-N 3.1Å
700	H	93.4	Very high	94.5	Very high	53 Å²	53	23.8 Å²	23.8	25%	0.245	13%	0.125	C	C	.	.	H	α-helix	trans	-53.9	-30.6	176.3	66	-72.6	0	0	0	113.9	I703 W704 R733 C734	H700-I703 PolarHBondContact O-N 3.26Å; H700-W704 WeakPolarHBondContact O-CB 3.42Å; H700-W704 PolarHBondContact O-N 2.84Å; H700-R733 HydrophobicContact CB-CB 4.33Å; H700-R733 HydrophobicContact CB-CG 4.08Å; H700-R733 WeakPolarHBondContact CD2-CD 3.3Å; H700-R733 PolarHBondContact CD2-NE 3.04Å; H700-R733 PolarHBondContact NE2-NH1 3.35Å; H700-C734 PolarHBondContact N-SG 3.35Å; H700-C734 VanDerWaalsContact N-SG 3.4Å
701	E	94.8	Very high	94.3	Very high	84 Å²	84	30.9 Å²	30.9	39%	0.393	15%	0.149	S	C	.	.	H	α-helix	trans	-66	-34.5	175.2	66	-79.6	-167.1	0	0	113.1	G699 A705 R729	G699-E701 VanDerWaalsContact C-OE2 3.23Å; G699-E701 WeakPolarHBondContact CA-OE2 3.43Å; G699-E701 PolarHBondContact O-N 3.41Å; G699-E701 VanDerWaalsContact O-N 3.14Å; E701-A705 PolarHBondContact O-N 3.33Å; E701-R729 IonicContact OE1-CZ 3.62Å; E701-R729 IonicContact OE1-NE 3.3Å; E701-R729 IonicContact OE1-NH2 3.69Å; E701-R729 PolarHBondContact OE1-NH2 2.94Å
702	V	96.1	Very high	94.2	Very high	9 Å²	9	36.4 Å²	36.4	6%	0.055	18%	0.175	C	C	.	.	H	α-helix	trans	-80.1	-36.4	174.9	172.5	0	0	0	0	110.9	D673 L676 V698 G699 W704 A705 L706	D673-V702 HydrophobicContact CB-CG2 4.39Å; D673-V702 VanDerWaalsContact OD2-CG2 3.28Å; D673-V702 WeakPolarHBondContact OD2-CG2 3.42Å; L676-V702 HydrophobicContact CB-CG1 3.57Å; L676-V702 HydrophobicContact CD1-CG1 4.2Å; V698-V702 HydrophobicContact CG1-CB 4Å; V698-V702 HydrophobicContact CG1-CG1 3.93Å; G699-V702 PolarHBondContact O-N 2.87Å; V702-W704 VanDerWaalsContact C-N 3.33Å; V702-W704 PolarHBondContact O-N 3.08Å; V702-A705 PolarHBondContact O-N 2.83Å; V702-L706 WeakPolarHBondContact O-CB 3.41Å; V702-L706 PolarHBondContact O-N 3.23Å
703	I	97.1	Very high	94.4	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-59.6	-44.8	172.5	-68.3	170.4	0	0	0	110.7	V698 G699 H700 L706 G707 F730 C734 M737 I738 W742	V698-I703 HydrophobicContact CG1-CD1 4.3Å; V698-I703 HydrophobicContact CG1-CG1 3.75Å; G699-I703 PolarHBondContact O-N 2.99Å; G699-I703 VanDerWaalsContact O-N 3.1Å; H700-I703 PolarHBondContact O-N 3.26Å; I703-L706 PolarHBondContact O-N 3.5Å; I703-G707 PolarHBondContact O-N 3.02Å; I703-F730 HydrophobicContact CD1-CE2 3.86Å; I703-F730 HydrophobicContact CD1-CZ 4.5Å; I703-C734 HydrophobicContact CD1-CB 3.48Å; I703-C734 VanDerWaalsContact CD1-CB 3.48Å; I703-M737 HydrophobicContact CG2-CB 3.79Å; I703-I738 HydrophobicContact CD1-CD1 4.27Å; I703-I738 HydrophobicContact CD1-CG1 4.29Å; I703-I738 HydrophobicContact CG2-CG1 3.87Å; I703-W742 HydrophobicContact CG2-CH2 4.09Å; I703-W742 HydrophobicContact CG2-CZ3 3.89Å
704	W	95.6	Very high	94.6	Very high	164 Å²	164	37.1 Å²	37.1	62%	0.621	18%	0.183	S	C	*	.	H	α-helix	trans	-61.9	-44.5	175.5	176	67.2	0	0	0	112.6	H700 V702 L706 G707 A708 M737	H700-W704 WeakPolarHBondContact O-CB 3.42Å; H700-W704 PolarHBondContact O-N 2.84Å; V702-W704 VanDerWaalsContact C-N 3.33Å; V702-W704 PolarHBondContact O-N 3.08Å; W704-L706 PolarHBondContact O-N 2.97Å; W704-G707 PolarHBondContact O-N 3.06Å; W704-A708 PolarHBondContact O-N 3.19Å; W704-M737 HydrophobicContact CB-CE 4.1Å; W704-M737 HydrophobicContact CG-CE 4.18Å
705	A	96.6	Very high	94.9	Very high	13 Å²	13	37.6 Å²	37.6	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-45.2	175.4	0	0	0	0	0	111.5	S680 E701 V702 G707 A708 G709	S680-A705 WeakPolarHBondContact CB-O 3.35Å; E701-A705 PolarHBondContact O-N 3.33Å; V702-A705 PolarHBondContact O-N 2.83Å; A705-G707 PolarHBondContact O-N 3.1Å; A705-A708 PolarHBondContact O-N 3.02Å; A705-G709 PolarHBondContact O-N 3.18Å
706	L	97.1	Very high	95.3	Very high	2 Å²	2	37 Å²	37	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-59.1	-44.4	176.3	-169.4	67.6	0	0	0	111.7	L676 V689 V702 I703 W704 A708 G709 C710 I713 L716 W742	L676-L706 HydrophobicContact CD2-CD2 4.35Å; V689-L706 HydrophobicContact CG1-CD2 4.27Å; V702-L706 WeakPolarHBondContact O-CB 3.41Å; V702-L706 PolarHBondContact O-N 3.23Å; I703-L706 PolarHBondContact O-N 3.5Å; W704-L706 PolarHBondContact O-N 2.97Å; L706-A708 PolarHBondContact O-N 2.95Å; L706-G709 PolarHBondContact O-N 3.14Å; L706-C710 HydrophobicContact CD1-CB 4.37Å; L706-C710 WeakPolarHBondContact O-CB 3.49Å; L706-C710 PolarHBondContact O-N 3.39Å; L706-I713 HydrophobicContact CD1-CD1 4.37Å; L706-I713 HydrophobicContact CD2-CD1 3.98Å; L706-I713 HydrophobicContact CG-CD1 3.94Å; L706-L716 HydrophobicContact CD2-CD1 4.26Å; L706-W742 HydrophobicContact CB-CH2 4.17Å; L706-W742 HydrophobicContact CB-CZ2 4.16Å; L706-W742 HydrophobicContact CD2-CH2 4.02Å; L706-W742 HydrophobicContact CD2-CZ2 4.12Å; L706-W742 HydrophobicContact CG-CH2 4.18Å; L706-W742 HydrophobicContact CG-CZ2 3.93Å
707	G	95.7	Very high	95.6	Very high	6 Å²	6	38 Å²	38	6%	0.062	19%	0.185	C	C	.	.	H	α-helix	trans	-69.1	-27.3	176.8	0	0	0	0	0	114.7	I703 W704 A705 W742	I703-G707 PolarHBondContact O-N 3.02Å; W704-G707 PolarHBondContact O-N 3.06Å; A705-G707 PolarHBondContact O-N 3.1Å; G707-W742 VanDerWaalsContact CA-CZ2 3.4Å
708	A	94.6	Very high	95.8	Very high	50 Å²	50	38 Å²	38	41%	0.413	19%	0.186	S	C	.	.	H	α-helix	trans	-74.9	-31.6	171.2	0	0	0	0	0	112.6	R684 W704 A705 L706	R684-A708 PolarHBondContact NH2-O 2.95Å; W704-A708 PolarHBondContact O-N 3.19Å; A705-A708 PolarHBondContact O-N 3.02Å; L706-A708 PolarHBondContact O-N 2.95Å
709	G	94.3	Very high	95.8	Very high	5 Å²	5	38 Å²	38	5%	0.052	19%	0.185	C	C	.	.	H	α-helix	trans	-80.7	-51.7	178.5	0	0	0	0	0	114.4	S680 R684 A705 L706	S680-G709 VanDerWaalsContact O-CA 3.23Å; S680-G709 WeakPolarHBondContact O-CA 3.46Å; R684-G709 PolarHBondContact NH1-O 3.37Å; R684-G709 PolarHBondContact NH2-O 2.92Å; A705-G709 PolarHBondContact O-N 3.18Å; L706-G709 PolarHBondContact O-N 3.14Å
710	C	96	Very high	95.8	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.			trans	-124.3	93.5	-164.8	-52.3	0	0	0	0	109.1	C683 L686 L706 I713 W742	C683-C710 PolarHBondContact O-SG 2.93Å; L686-C710 HydrophobicContact CB-CB 4.26Å; L706-C710 HydrophobicContact CD1-CB 4.37Å; L706-C710 WeakPolarHBondContact O-CB 3.49Å; L706-C710 PolarHBondContact O-N 3.39Å; C710-I713 HydrophobicContact CB-CD1 3.78Å; C710-I713 HydrophobicContact CB-CG1 4.06Å; C710-W742 PolarHBondContact O-NE1 2.99Å
711	R	94.8	Very high	95.7	Very high	173 Å²	173	36.6 Å²	36.6	65%	0.653	18%	0.18	S	C	*	.			trans	-85.8	-23.3	-176.9	-69.8	-174.6	176.2	-167.8	-2.5	113.7	I713	R711-I713 PolarHBondContact O-N 3.16Å
712	E	94.8	Very high	95.2	Very high	119 Å²	119	35.6 Å²	35.6	56%	0.556	18%	0.175	S	C	*	.			trans	-84.1	14.2	-173.4	-48.6	-44.7	121.8	0	0	114.2	L686 Q687 V714	L686-E712 CarbonylContact O-C 3.54Å; Q687-E712 WeakPolarHBondContact CA-O 3.47Å; E712-V714 PolarHBondContact O-N 3.43Å; E712-V714 VanDerWaalsContact O-N 3.17Å
713	I	97.4	Very high	94.7	Very high	3 Å²	3	41 Å²	41	2%	0.015	21%	0.21	C	C	.	.			trans	-69	115.1	-179.6	-61	175.7	0	0	0	109.6	L686 Q687 V689 L706 C710 R711 S715 L716 W742 L745	L686-I713 HydrophobicContact CB-CG1 4.5Å; L686-I713 WeakPolarHBondContact O-CG1 3.5Å; L686-I713 PolarHBondContact O-N 3.05Å; Q687-I713 WeakPolarHBondContact O-CA 3.34Å; V689-I713 HydrophobicContact CB-CD1 4.39Å; V689-I713 HydrophobicContact CG2-CD1 3.69Å; V689-I713 HydrophobicContact CG2-CG1 4.14Å; L706-I713 HydrophobicContact CD1-CD1 4.37Å; L706-I713 HydrophobicContact CD2-CD1 3.98Å; L706-I713 HydrophobicContact CG-CD1 3.94Å; C710-I713 HydrophobicContact CB-CD1 3.78Å; C710-I713 HydrophobicContact CB-CG1 4.06Å; R711-I713 PolarHBondContact O-N 3.16Å; I713-S715 WeakPolarHBondContact CG2-O 3.3Å; I713-L716 HydrophobicContact CG2-CB 4.05Å; I713-L716 HydrophobicContact CG2-CD1 4.46Å; I713-W742 HydrophobicContact CB-CG 4.3Å; I713-W742 HydrophobicContact CD1-CZ2 3.81Å; I713-L745 HydrophobicContact CG2-CD1 4.02Å; I713-L745 WeakPolarHBondContact O-CD1 3.47Å
714	V	97.4	Very high	94.1	Very high	54 Å²	54	41.9 Å²	41.9	33%	0.327	22%	0.216	S	C	.	.			trans	-104.3	-16.2	175.7	-66.3	0	0	0	0	112.8	Q687 E712 R746 A747	Q687-V714 HydrophobicContact CB-CG2 4.17Å; Q687-V714 WeakPolarHBondContact O-CG2 3.34Å; Q687-V714 PolarHBondContact O-N 2.87Å; E712-V714 PolarHBondContact O-N 3.43Å; E712-V714 VanDerWaalsContact O-N 3.17Å; V714-R746 PolarHBondContact O-N 3.12Å; V714-A747 PolarHBondContact O-N 3.03Å; V714-A747 VanDerWaalsContact O-N 3.11Å
715	S	98.1	Very high	93.7	Very high	35 Å²	35	40.5 Å²	40.5	25%	0.245	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	119.8	176	-177.2	0	0	0	0	110.7	Q687 A688 V689 I713 A747	Q687-S715 PolarHBondContact O-N 3.03Å; A688-S715 WeakPolarHBondContact CA-O 3.45Å; V689-S715 PolarHBondContact N-O 3.34Å; I713-S715 WeakPolarHBondContact CG2-O 3.3Å; S715-A747 WeakPolarHBondContact CA-O 3.49Å
716	L	98.3	Very high	93.2	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	129.5	-177.6	-176.2	66.3	0	0	0	111.1	V689 L706 I713 V718 I738 W742 L745 A747 L748 G749	V689-L716 HydrophobicContact CB-CD1 4Å; V689-L716 HydrophobicContact CG1-CD1 4.21Å; V689-L716 CarbonylContact O-C 3.57Å; V689-L716 WeakPolarHBondContact O-CA 3.46Å; L706-L716 HydrophobicContact CD2-CD1 4.26Å; I713-L716 HydrophobicContact CG2-CB 4.05Å; I713-L716 HydrophobicContact CG2-CD1 4.46Å; L716-V718 HydrophobicContact CD1-CG1 3.65Å; L716-V718 HydrophobicContact CD2-CG2 4.34Å; L716-V718 HydrophobicContact CG-CG1 3.95Å; L716-V718 HydrophobicContact CG-CG2 4.19Å; L716-I738 HydrophobicContact CD2-CD1 4.26Å; L716-I738 HydrophobicContact CD2-CG1 3.97Å; L716-I738 HydrophobicContact CD2-CG2 4.12Å; L716-W742 HydrophobicContact CD2-CE3 3.78Å; L716-W742 HydrophobicContact CD2-CH2 4.18Å; L716-W742 HydrophobicContact CD2-CZ3 3.5Å; L716-L745 HydrophobicContact CB-CD1 3.88Å; L716-L745 HydrophobicContact CB-CD2 4.29Å; L716-A747 PolarHBondContact N-O 3.27Å; L716-L748 HydrophobicContact CB-CD1 3.99Å; L716-L748 HydrophobicContact CD2-CD1 4.1Å; L716-L748 HydrophobicContact CG-CD1 4.23Å; L716-L748 CarbonylContact O-C 3.56Å; L716-L748 VanDerWaalsContact O-CA 3.25Å; L716-L748 WeakPolarHBondContact O-CA 3.23Å; L716-G749 PolarHBondContact O-N 2.95Å
717	Q	97.3	Very high	92.6	Very high	20 Å²	20	45.9 Å²	45.9	9%	0.093	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	91.4	-170.9	-85.2	-74	-11.9	0	0	109.3	V689 T690 Y691 E774	V689-Q717 PolarHBondContact O-N 3.48Å; T690-Q717 CarbonylContact C-O 3.6Å; T690-Q717 WeakPolarHBondContact CA-O 3.29Å; T690-Q717 HydrophobicContact CG2-CB 3.92Å; T690-Q717 WeakPolarHBondContact OG1-CB 3.41Å; Y691-Q717 PolarHBondContact N-O 3.42Å; Q717-E774 PolarHBondContact NE2-OE1 3.13Å; Q717-E774 VanDerWaalsContact NE2-OE1 3.15Å; Q717-E774 PolarHBondContact NE2-OE2 3.19Å; Q717-E774 PolarHBondContact OE1-OE2 2.82Å
718	V	96.3	Very high	92.1	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.018	27%	0.274	C	S	.	.			trans	-130.2	11.9	-166.8	-67.1	0	0	0	0	114.6	Y691 V698 L716 F730 I738 G749 V750	Y691-V718 WeakPolarHBondContact O-CA 3.47Å; V698-V718 HydrophobicContact CG2-CB 4.17Å; V698-V718 HydrophobicContact CG2-CG1 4.27Å; L716-V718 HydrophobicContact CD1-CG1 3.65Å; L716-V718 HydrophobicContact CD2-CG2 4.34Å; L716-V718 HydrophobicContact CG-CG1 3.95Å; L716-V718 HydrophobicContact CG-CG2 4.19Å; V718-F730 HydrophobicContact CB-CE2 4.22Å; V718-F730 HydrophobicContact CG2-CE2 3.66Å; V718-F730 HydrophobicContact CG2-CZ 3.96Å; V718-I738 HydrophobicContact CG2-CD1 4.11Å; V718-G749 PolarHBondContact N-O 2.82Å; V718-V750 HydrophobicContact CG2-CG1 4.01Å
719	A	93.6	Very high	91.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-55.1	133.2	171.5	0	0	0	0	0	112	R692 G749 D776	R692-A719 WeakPolarHBondContact CG-O 3.49Å; A719-G749 PolarHBondContact N-O 2.97Å; A719-D776 HydrophobicContact CB-CB 3.76Å
720	P	92.3	Very high	91.9	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-57	146.3	170.5	-24.3	35.1	0	0	0	112.3	P697 H722 C724 F730 G751	P697-P720 HydrophobicContact CB-CB 4.03Å; P697-P720 HydrophobicContact CB-CG 3.91Å; P720-H722 PolarHBondContact O-ND1 3.32Å; P720-C724 HydrophobicContact CB-CB 4.35Å; P720-F730 HydrophobicContact CG-CB 3.92Å; P720-F730 HydrophobicContact CG-CG 4.46Å; P720-G751 VanDerWaalsContact CD-O 3.27Å; P720-G751 WeakPolarHBondContact CD-O 3.49Å
721	L	90.8	Very high	91.7	Very high	23 Å²	23	52.2 Å²	52.2	12%	0.12	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-83	143.9	166.4	-64.2	174.2	0	0	0	109.6	H666 R692 S693 A694 C724	H666-L721 HydrophobicContact CB-CD1 4.31Å; R692-L721 HydrophobicContact CB-CD1 4.29Å; R692-L721 HydrophobicContact CB-CD2 3.84Å; R692-L721 HydrophobicContact CB-CG 3.86Å; R692-L721 WeakPolarHBondContact O-CD1 3.47Å; S693-L721 PolarHBondContact O-N 2.99Å; A694-L721 WeakPolarHBondContact CA-O 3.36Å; A694-L721 HydrophobicContact CB-CB 3.97Å; L721-C724 WeakPolarHBondContact O-CA 3.28Å; L721-C724 WeakPolarHBondContact O-CB 3.39Å
722	H	85.1	Confident	91.7	Very high	63 Å²	63	46.4 Å²	46.4	29%	0.292	25%	0.252	S	S	.	.	S	Bend	trans	-108	145.4	-179.5	-69.1	81.1	0	0	0	111.2	P720 H777	P720-H722 PolarHBondContact O-ND1 3.32Å; H722-H777 WeakPolarHBondContact CB-NE2 3.3Å; H722-H777 AromaticContact CD2-CD2 3.67Å; H722-H777 AromaticContact CD2-CG 3.85Å; H722-H777 VanDerWaalsContact CE1-CB 3.41Å; H722-H777 WeakPolarHBondContact CE1-CB 3.36Å; H722-H777 AromaticContact CE1-CG 3.51Å; H722-H777 AromaticContact CE1-ND1 3.74Å; H722-H777 AromaticContact CG-CD2 3.44Å; H722-H777 VanDerWaalsContact CG-CD2 3.44Å; H722-H777 AromaticContact CG-CE1 3.6Å; H722-H777 AromaticContact CG-CG 3.56Å; H722-H777 AromaticContact CG-ND1 3.64Å; H722-H777 AromaticContact CG-NE2 3.45Å; H722-H777 AromaticContact ND1-CD2 3.74Å; H722-H777 AromaticContact ND1-CE1 3.54Å; H722-H777 AromaticContact ND1-CG 3.33Å; H722-H777 VanDerWaalsContact ND1-CG 3.33Å; H722-H777 AromaticContact ND1-ND1 3.18Å; H722-H777 PolarHBondContact ND1-ND1 3.21Å; H722-H777 VanDerWaalsContact ND1-ND1 3.18Å; H722-H777 AromaticContact ND1-NE2 3.84Å; H722-H777 AromaticContact NE2-CG 3.86Å
723	P	85.1	Confident	91.8	Very high	122 Å²	122	47.8 Å²	47.8	79%	0.792	25%	0.253	S	S	*	.	S	Bend	cis	-68	132.8	-4.2	29.3	-35.3	0	0	0	112.5
724	C	85.6	Confident	91.7	Very high	21 Å²	21	47.7 Å²	47.7	14%	0.142	25%	0.252	C	S	.	.			trans	-96.1	135.1	-174.6	-170.6	0	0	0	0	111.5	P720 L721	P720-C724 HydrophobicContact CB-CB 4.35Å; L721-C724 WeakPolarHBondContact O-CA 3.28Å; L721-C724 WeakPolarHBondContact O-CB 3.39Å
725	Q	86.3	Confident	91.6	Very high	136 Å²	136	45.1 Å²	45.1	64%	0.636	24%	0.236	S	C	*	.	S	Bend	trans	-77.1	-18.4	178.9	-65.4	-175	-15.1	0	0	113.9	A694	A694-Q725 PolarHBondContact O-N 2.73Å
726	Q	87	Confident	91.5	Very high	76 Å²	76	46.3 Å²	46.3	36%	0.355	24%	0.238	S	C	.	.			trans	-140.3	61.5	-176.8	-60	-178.8	23.5	0	0	111.1	P697 T728 R729	P697-Q726 HydrophobicContact CG-CB 3.87Å; P697-Q726 WeakPolarHBondContact CG-O 3.41Å; Q726-T728 PolarHBondContact O-N 3.47Å; Q726-T728 VanDerWaalsContact O-N 3.08Å; Q726-R729 HydrophobicContact CB-CB 4.13Å; Q726-R729 WeakPolarHBondContact O-CB 3.47Å; Q726-R729 PolarHBondContact O-N 3.25Å
727	P	83	Confident	91.4	Very high	52 Å²	52	47.6 Å²	47.6	34%	0.338	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.6	-167.7	26.4	-36	0	0	0	114.6	G754	P727-G754 PolarHBondContact O-N 2.77Å
728	T	85.8	Confident	91.4	Very high	111 Å²	111	46.7 Å²	46.7	68%	0.681	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.9	177.8	52.6	0	0	0	0	114.1	Q726	Q726-T728 PolarHBondContact O-N 3.47Å; Q726-T728 VanDerWaalsContact O-N 3.08Å
729	R	90.8	Very high	91.3	Very high	55 Å²	55	46.6 Å²	46.6	21%	0.208	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-44.2	-176.5	-177	168.2	-171.5	-132.3	4.8	111.8	D673 P697 E701 Q726 S731	D673-R729 IonicContact OD1-NH1 2.68Å; D673-R729 IonicContact OD2-CZ 2.93Å; D673-R729 IonicContact OD2-NH1 2.71Å; D673-R729 PolarHBondContact OD2-NH1 3.33Å; D673-R729 IonicContact OD2-NH2 2.74Å; D673-R729 PolarHBondContact OD2-NH2 2.59Å; P697-R729 HydrophobicContact CG-CB 4.17Å; P697-R729 PolarHBondContact O-NH1 2.71Å; E701-R729 IonicContact OE1-CZ 3.62Å; E701-R729 IonicContact OE1-NE 3.3Å; E701-R729 IonicContact OE1-NH2 3.69Å; E701-R729 PolarHBondContact OE1-NH2 2.94Å; Q726-R729 HydrophobicContact CB-CB 4.13Å; Q726-R729 WeakPolarHBondContact O-CB 3.47Å; Q726-R729 PolarHBondContact O-N 3.25Å; R729-S731 PolarHBondContact O-OG 3.48Å
730	F	93.5	Very high	91.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-77.6	120.8	167.1	-161.8	-80.3	0	0	0	108.4	V698 I703 V718 P720 C734 L735 I738 V750 G751 G754 C755	V698-F730 HydrophobicContact CB-CD2 4.44Å; I703-F730 HydrophobicContact CD1-CE2 3.86Å; I703-F730 HydrophobicContact CD1-CZ 4.5Å; V718-F730 HydrophobicContact CB-CE2 4.22Å; V718-F730 HydrophobicContact CG2-CE2 3.66Å; V718-F730 HydrophobicContact CG2-CZ 3.96Å; P720-F730 HydrophobicContact CG-CB 3.92Å; P720-F730 HydrophobicContact CG-CG 4.46Å; F730-C734 HydrophobicContact CD1-CB 4.24Å; F730-C734 HydrophobicContact CD2-CB 4.1Å; F730-C734 HydrophobicContact CE1-CB 3.99Å; F730-C734 HydrophobicContact CE2-CB 3.86Å; F730-C734 HydrophobicContact CG-CB 4.28Å; F730-C734 HydrophobicContact CZ-CB 3.79Å; F730-L735 HydrophobicContact CE1-CD2 3.93Å; F730-L735 HydrophobicContact CE1-CG 4.29Å; F730-L735 HydrophobicContact CZ-CD2 4.31Å; F730-I738 HydrophobicContact CE2-CD1 4.41Å; F730-I738 HydrophobicContact CZ-CD1 3.82Å; F730-V750 HydrophobicContact CE1-CB 4.06Å; F730-V750 HydrophobicContact CE1-CG1 4.11Å; F730-V750 HydrophobicContact CZ-CB 4.13Å; F730-V750 HydrophobicContact CZ-CG1 3.69Å; F730-G751 WeakPolarHBondContact CD1-O 3.5Å; F730-G754 VanDerWaalsContact O-CA 3.3Å; F730-G754 WeakPolarHBondContact O-CA 3.39Å; F730-C755 VanDerWaalsContact CD1-SG 3.55Å; F730-C755 VanDerWaalsContact CE1-SG 3.6Å
731	S	93.3	Very high	91.5	Very high	27 Å²	27	55.8 Å²	55.8	19%	0.189	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-147.1	171.5	-160.3	53.8	0	0	0	0	113.2	R729 R733 C734 L735 G754	R729-S731 PolarHBondContact O-OG 3.48Å; S731-R733 PolarHBondContact O-N 2.95Å; S731-C734 PolarHBondContact N-SG 3.38Å; S731-C734 VanDerWaalsContact N-SG 3.38Å; S731-C734 WeakPolarHBondContact O-CA 3.43Å; S731-C734 WeakPolarHBondContact O-CB 3.41Å; S731-C734 PolarHBondContact O-N 3.02Å; S731-L735 PolarHBondContact O-N 2.98Å; S731-G754 CarbonylContact C-O 3.55Å; S731-G754 VanDerWaalsContact CA-O 3.27Å; S731-G754 WeakPolarHBondContact CA-O 3.33Å
732	N	94.8	Very high	91.8	Very high	52 Å²	52	54.8 Å²	54.8	28%	0.278	27%	0.272	S	S	.	.	H	α-helix	trans	-48	-34.7	170.8	-74.8	-27.8	0	0	0	113.8	C734 L735 Q736 G754 G756 G759	N732-C734 VanDerWaalsContact C-N 3.32Å; N732-C734 PolarHBondContact O-N 2.96Å; N732-L735 PolarHBondContact O-N 3.13Å; N732-Q736 VanDerWaalsContact O-CG 3.27Å; N732-Q736 WeakPolarHBondContact O-CG 3.14Å; N732-Q736 PolarHBondContact O-N 3.28Å; N732-G754 PolarHBondContact N-O 2.84Å; N732-G756 PolarHBondContact OD1-N 2.9Å; N732-G756 PolarHBondContact OD1-O 2.96Å; N732-G756 VanDerWaalsContact OD1-O 3.08Å; N732-G759 WeakPolarHBondContact OD1-CA 3.46Å; N732-G759 PolarHBondContact OD1-N 3.13Å
733	R	95.4	Very high	92.1	Very high	148 Å²	148	54.9 Å²	54.9	56%	0.558	28%	0.279	S	S	*	.	H	α-helix	trans	-66	-33.4	174.8	-165.1	173.3	-171.3	-174	15.8	112.3	H700 S731 M737	H700-R733 HydrophobicContact CB-CB 4.33Å; H700-R733 HydrophobicContact CB-CG 4.08Å; H700-R733 WeakPolarHBondContact CD2-CD 3.3Å; H700-R733 PolarHBondContact CD2-NE 3.04Å; H700-R733 PolarHBondContact NE2-NH1 3.35Å; S731-R733 PolarHBondContact O-N 2.95Å; R733-M737 VanDerWaalsContact O-CG 3.29Å; R733-M737 WeakPolarHBondContact O-CG 3.41Å; R733-M737 PolarHBondContact O-N 2.76Å
734	C	96.1	Very high	92.4	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-48.6	173	-58.5	0	0	0	0	110.9	H700 I703 F730 S731 N732 Q736 M737 I738	H700-C734 PolarHBondContact N-SG 3.35Å; H700-C734 VanDerWaalsContact N-SG 3.4Å; I703-C734 HydrophobicContact CD1-CB 3.48Å; I703-C734 VanDerWaalsContact CD1-CB 3.48Å; F730-C734 HydrophobicContact CD1-CB 4.24Å; F730-C734 HydrophobicContact CD2-CB 4.1Å; F730-C734 HydrophobicContact CE1-CB 3.99Å; F730-C734 HydrophobicContact CE2-CB 3.86Å; F730-C734 HydrophobicContact CG-CB 4.28Å; F730-C734 HydrophobicContact CZ-CB 3.79Å; S731-C734 PolarHBondContact N-SG 3.38Å; S731-C734 VanDerWaalsContact N-SG 3.38Å; S731-C734 WeakPolarHBondContact O-CA 3.43Å; S731-C734 WeakPolarHBondContact O-CB 3.41Å; S731-C734 PolarHBondContact O-N 3.02Å; N732-C734 VanDerWaalsContact C-N 3.32Å; N732-C734 PolarHBondContact O-N 2.96Å; C734-Q736 PolarHBondContact O-N 2.98Å; C734-M737 PolarHBondContact O-N 2.94Å; C734-I738 WeakPolarHBondContact O-CG1 3.27Å; C734-I738 PolarHBondContact O-N 2.93Å
735	L	96	Very high	93	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.3	-44.2	177.4	-62.7	176.2	0	0	0	112.4	F730 S731 N732 M737 I738 G739 V750 C755 L760	F730-L735 HydrophobicContact CE1-CD2 3.93Å; F730-L735 HydrophobicContact CE1-CG 4.29Å; F730-L735 HydrophobicContact CZ-CD2 4.31Å; S731-L735 PolarHBondContact O-N 2.98Å; N732-L735 PolarHBondContact O-N 3.13Å; L735-M737 VanDerWaalsContact C-N 3.33Å; L735-M737 PolarHBondContact O-N 2.76Å; L735-I738 PolarHBondContact O-N 2.93Å; L735-G739 PolarHBondContact O-N 3.07Å; L735-V750 HydrophobicContact CD2-CB 3.83Å; L735-V750 HydrophobicContact CD2-CG1 3.84Å; L735-V750 HydrophobicContact CD2-CG2 3.8Å; L735-C755 HydrophobicContact CD1-CB 4.04Å; L735-L760 HydrophobicContact CD1-CD2 3.99Å; L735-L760 HydrophobicContact CD1-CG 4.25Å
736	Q	95.5	Very high	93.4	Very high	61 Å²	61	52.7 Å²	52.7	29%	0.285	25%	0.25	S	C	.	.	H	α-helix	trans	-61.4	-38	174.8	-70.7	171.2	6.5	0	0	112.7	N732 C734 R740	N732-Q736 VanDerWaalsContact O-CG 3.27Å; N732-Q736 WeakPolarHBondContact O-CG 3.14Å; N732-Q736 PolarHBondContact O-N 3.28Å; C734-Q736 PolarHBondContact O-N 2.98Å; Q736-R740 WeakPolarHBondContact O-CD 3.33Å; Q736-R740 VanDerWaalsContact O-CG 3.29Å; Q736-R740 WeakPolarHBondContact O-CG 3.35Å; Q736-R740 PolarHBondContact O-N 3.42Å
737	M	95.9	Very high	93.9	Very high	29 Å²	29	50 Å²	50	14%	0.143	24%	0.241	C	C	.	.	H	α-helix	trans	-72.9	-37.7	176.1	-68.9	-48.6	-56.5	0	0	112.4	I703 W704 R733 C734 L735 G739 R740 C741	I703-M737 HydrophobicContact CG2-CB 3.79Å; W704-M737 HydrophobicContact CB-CE 4.1Å; W704-M737 HydrophobicContact CG-CE 4.18Å; R733-M737 VanDerWaalsContact O-CG 3.29Å; R733-M737 WeakPolarHBondContact O-CG 3.41Å; R733-M737 PolarHBondContact O-N 2.76Å; C734-M737 PolarHBondContact O-N 2.94Å; L735-M737 VanDerWaalsContact C-N 3.33Å; L735-M737 PolarHBondContact O-N 2.76Å; M737-G739 PolarHBondContact O-N 3.12Å; M737-R740 PolarHBondContact O-N 3.01Å; M737-C741 WeakPolarHBondContact O-CB 3.18Å; M737-C741 PolarHBondContact O-N 3.02Å; M737-C741 PolarHBondContact O-SG 3.5Å; M737-C741 VanDerWaalsContact O-SG 3.33Å
738	I	96.9	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.6	-51.2	173.2	-70.2	164.3	0	0	0	110.3	I703 L716 V718 F730 C734 L735 R740 C741 W742 L745 L748 V750 L763	I703-I738 HydrophobicContact CD1-CD1 4.27Å; I703-I738 HydrophobicContact CD1-CG1 4.29Å; I703-I738 HydrophobicContact CG2-CG1 3.87Å; L716-I738 HydrophobicContact CD2-CD1 4.26Å; L716-I738 HydrophobicContact CD2-CG1 3.97Å; L716-I738 HydrophobicContact CD2-CG2 4.12Å; V718-I738 HydrophobicContact CG2-CD1 4.11Å; F730-I738 HydrophobicContact CE2-CD1 4.41Å; F730-I738 HydrophobicContact CZ-CD1 3.82Å; C734-I738 WeakPolarHBondContact O-CG1 3.27Å; C734-I738 PolarHBondContact O-N 2.93Å; L735-I738 PolarHBondContact O-N 2.93Å; I738-R740 VanDerWaalsContact C-N 3.34Å; I738-R740 PolarHBondContact O-N 3.32Å; I738-C741 PolarHBondContact O-N 3.05Å; I738-W742 HydrophobicContact CB-CE3 4.34Å; I738-W742 HydrophobicContact CB-CZ3 4.34Å; I738-W742 HydrophobicContact CG1-CE3 4.48Å; I738-W742 HydrophobicContact CG1-CZ3 4.03Å; I738-W742 HydrophobicContact CG2-CE3 4.13Å; I738-W742 HydrophobicContact CG2-CZ3 4.49Å; I738-W742 PolarHBondContact O-N 3.11Å; I738-L745 HydrophobicContact CG2-CD2 4.28Å; I738-L748 HydrophobicContact CD1-CD1 4.41Å; I738-L748 HydrophobicContact CG2-CD1 3.89Å; I738-L748 HydrophobicContact CG2-CD2 4.39Å; I738-V750 HydrophobicContact CD1-CG1 3.81Å; I738-L763 HydrophobicContact CB-CD1 4.23Å; I738-L763 HydrophobicContact CG2-CD1 3.67Å
739	G	95.1	Very high	95.2	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-43.6	178.6	0	0	0	0	0	113.2	L735 M737 N766	L735-G739 PolarHBondContact O-N 3.07Å; M737-G739 PolarHBondContact O-N 3.12Å; G739-N766 WeakPolarHBondContact O-CB 3.21Å
740	R	94.7	Very high	95.4	Very high	169 Å²	169	39.6 Å²	39.6	64%	0.638	18%	0.183	S	C	*	.	H	α-helix	trans	-69.5	-29.9	178.6	-73.5	171	174.3	178.7	-2.4	114.1	Q736 M737 I738	Q736-R740 WeakPolarHBondContact O-CD 3.33Å; Q736-R740 VanDerWaalsContact O-CG 3.29Å; Q736-R740 WeakPolarHBondContact O-CG 3.35Å; Q736-R740 PolarHBondContact O-N 3.42Å; M737-R740 PolarHBondContact O-N 3.01Å; I738-R740 VanDerWaalsContact C-N 3.34Å; I738-R740 PolarHBondContact O-N 3.32Å
741	C	95.9	Very high	95.3	Very high	25 Å²	25	39.6 Å²	39.6	17%	0.169	18%	0.183	C	C	.	.	H	α-helix	trans	-87.9	-32.2	-176	-72.7	0	0	0	0	113.4	M737 I738	M737-C741 WeakPolarHBondContact O-CB 3.18Å; M737-C741 PolarHBondContact O-N 3.02Å; M737-C741 PolarHBondContact O-SG 3.5Å; M737-C741 VanDerWaalsContact O-SG 3.33Å; I738-C741 PolarHBondContact O-N 3.05Å
742	W	96.1	Very high	95.1	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.008	17%	0.174	C	C	.	.			trans	-133.5	73	-173.2	-54.7	-69.6	0	0	0	113	I703 L706 G707 C710 I713 L716 I738 H744 L745 C767	I703-W742 HydrophobicContact CG2-CH2 4.09Å; I703-W742 HydrophobicContact CG2-CZ3 3.89Å; L706-W742 HydrophobicContact CB-CH2 4.17Å; L706-W742 HydrophobicContact CB-CZ2 4.16Å; L706-W742 HydrophobicContact CD2-CH2 4.02Å; L706-W742 HydrophobicContact CD2-CZ2 4.12Å; L706-W742 HydrophobicContact CG-CH2 4.18Å; L706-W742 HydrophobicContact CG-CZ2 3.93Å; G707-W742 VanDerWaalsContact CA-CZ2 3.4Å; C710-W742 PolarHBondContact O-NE1 2.99Å; I713-W742 HydrophobicContact CB-CG 4.3Å; I713-W742 HydrophobicContact CD1-CZ2 3.81Å; L716-W742 HydrophobicContact CD2-CE3 3.78Å; L716-W742 HydrophobicContact CD2-CH2 4.18Å; L716-W742 HydrophobicContact CD2-CZ3 3.5Å; I738-W742 HydrophobicContact CB-CE3 4.34Å; I738-W742 HydrophobicContact CB-CZ3 4.34Å; I738-W742 HydrophobicContact CG1-CE3 4.48Å; I738-W742 HydrophobicContact CG1-CZ3 4.03Å; I738-W742 HydrophobicContact CG2-CE3 4.13Å; I738-W742 HydrophobicContact CG2-CZ3 4.49Å; I738-W742 PolarHBondContact O-N 3.11Å; W742-H744 PolarHBondContact O-N 3.19Å; W742-H744 VanDerWaalsContact O-N 3.1Å; W742-L745 HydrophobicContact CB-CB 4.11Å; W742-L745 HydrophobicContact CB-CD1 4.29Å; W742-L745 VanDerWaalsContact O-CB 3.32Å; W742-L745 WeakPolarHBondContact O-CB 3.33Å; W742-L745 PolarHBondContact O-N 3.49Å; W742-C767 PolarHBondContact O-SG 3.05Å
743	P	91.9	Very high	94.6	Very high	65 Å²	65	39.4 Å²	39.4	42%	0.422	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-6.4	178	30.3	-37.3	0	0	0	113.8
744	H	91.9	Very high	94.1	Very high	103 Å²	103	33.2 Å²	33.2	48%	0.477	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	9.5	178.3	-64.2	-11.6	0	0	0	113.5	W742 R746 R769	W742-H744 PolarHBondContact O-N 3.19Å; W742-H744 VanDerWaalsContact O-N 3.1Å; H744-R746 PolarHBondContact O-N 3.32Å; H744-R769 PolarHBondContact ND1-NH1 2.66Å
745	L	96.4	Very high	93.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.			trans	-59.1	131.3	177.7	-162.3	76.6	0	0	0	111.2	I713 L716 I738 W742 A747 L748 R769 L770	I713-L745 HydrophobicContact CG2-CD1 4.02Å; I713-L745 WeakPolarHBondContact O-CD1 3.47Å; L716-L745 HydrophobicContact CB-CD1 3.88Å; L716-L745 HydrophobicContact CB-CD2 4.29Å; I738-L745 HydrophobicContact CG2-CD2 4.28Å; W742-L745 HydrophobicContact CB-CB 4.11Å; W742-L745 HydrophobicContact CB-CD1 4.29Å; W742-L745 VanDerWaalsContact O-CB 3.32Å; W742-L745 WeakPolarHBondContact O-CB 3.33Å; W742-L745 PolarHBondContact O-N 3.49Å; L745-A747 WeakPolarHBondContact CG-O 3.45Å; L745-L748 HydrophobicContact CD2-CB 3.76Å; L745-L748 HydrophobicContact CD2-CD1 3.61Å; L745-L748 HydrophobicContact CD2-CG 4.15Å; L745-R769 CarbonylContact O-C 3.57Å; L745-R769 VanDerWaalsContact O-C 3.3Å; L745-L770 HydrophobicContact CD2-CD1 4.24Å; L745-L770 HydrophobicContact CG-CD1 4.35Å; L745-L770 WeakPolarHBondContact O-CA 3.3Å; L745-L770 PolarHBondContact O-N 3.43Å
746	R	96.2	Very high	93.6	Very high	130 Å²	130	33.9 Å²	33.9	49%	0.491	18%	0.179	S	C	.	.			trans	-104.9	-31.6	179.8	-67.8	177.7	178.2	-104.8	10.5	112.8	V714 H744 Q771 V772	V714-R746 PolarHBondContact O-N 3.12Å; H744-R746 PolarHBondContact O-N 3.32Å; R746-Q771 WeakPolarHBondContact O-CA 3.37Å; R746-Q771 PolarHBondContact O-N 3.12Å; R746-V772 PolarHBondContact O-N 3.12Å
747	A	97.7	Very high	93.5	Very high	20 Å²	20	32.9 Å²	32.9	17%	0.165	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.6	177.4	0	0	0	0	0	111	V714 S715 L716 L745 V772	V714-A747 PolarHBondContact O-N 3.03Å; V714-A747 VanDerWaalsContact O-N 3.11Å; S715-A747 WeakPolarHBondContact CA-O 3.49Å; L716-A747 PolarHBondContact N-O 3.27Å; L745-A747 WeakPolarHBondContact CG-O 3.45Å; A747-V772 WeakPolarHBondContact CA-O 3.29Å; A747-V772 HydrophobicContact CB-CB 4Å; A747-V772 HydrophobicContact CB-CG2 4.42Å
748	L	97.9	Very high	93.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.2	176.8	-175	72.2	0	0	0	111.2	L716 I738 L745 V750 L763 L770 V772 L773 E774	L716-L748 HydrophobicContact CB-CD1 3.99Å; L716-L748 HydrophobicContact CD2-CD1 4.1Å; L716-L748 HydrophobicContact CG-CD1 4.23Å; L716-L748 CarbonylContact O-C 3.56Å; L716-L748 VanDerWaalsContact O-CA 3.25Å; L716-L748 WeakPolarHBondContact O-CA 3.23Å; I738-L748 HydrophobicContact CD1-CD1 4.41Å; I738-L748 HydrophobicContact CG2-CD1 3.89Å; I738-L748 HydrophobicContact CG2-CD2 4.39Å; L745-L748 HydrophobicContact CD2-CB 3.76Å; L745-L748 HydrophobicContact CD2-CD1 3.61Å; L745-L748 HydrophobicContact CD2-CG 4.15Å; L748-V750 HydrophobicContact CD1-CG1 3.72Å; L748-V750 HydrophobicContact CD2-CB 4.44Å; L748-V750 HydrophobicContact CD2-CG1 3.75Å; L748-V750 HydrophobicContact CD2-CG2 3.82Å; L748-V750 HydrophobicContact CG-CG1 3.72Å; L748-V750 HydrophobicContact CG-CG2 4.2Å; L748-L763 HydrophobicContact CD2-CD1 3.63Å; L748-L763 HydrophobicContact CD2-CD2 3.3Å; L748-L763 HydrophobicContact CD2-CG 4.04Å; L748-L770 HydrophobicContact CB-CD1 3.78Å; L748-L770 HydrophobicContact CB-CD2 4.42Å; L748-V772 PolarHBondContact N-O 3.16Å; L748-L773 HydrophobicContact CB-CD1 4.45Å; L748-L773 HydrophobicContact CD2-CD1 4.18Å; L748-L773 CarbonylContact O-C 3.54Å; L748-L773 WeakPolarHBondContact O-CA 3.48Å; L748-E774 PolarHBondContact O-N 3.29Å
749	G	96.7	Very high	93.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.1	160.7	0	0	0	0	0	111.6	L716 V718 A719 E774	L716-G749 PolarHBondContact O-N 2.95Å; V718-G749 PolarHBondContact N-O 2.82Å; A719-G749 PolarHBondContact N-O 2.97Å; G749-E774 WeakPolarHBondContact CA-O 3.23Å
750	V	95.9	Very high	93.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	158.1	-177.3	-74.8	0	0	0	0	110.8	V718 F730 L735 I738 L748 L773 E774 L775 D776	V718-V750 HydrophobicContact CG2-CG1 4.01Å; F730-V750 HydrophobicContact CE1-CB 4.06Å; F730-V750 HydrophobicContact CE1-CG1 4.11Å; F730-V750 HydrophobicContact CZ-CB 4.13Å; F730-V750 HydrophobicContact CZ-CG1 3.69Å; L735-V750 HydrophobicContact CD2-CB 3.83Å; L735-V750 HydrophobicContact CD2-CG1 3.84Å; L735-V750 HydrophobicContact CD2-CG2 3.8Å; I738-V750 HydrophobicContact CD1-CG1 3.81Å; L748-V750 HydrophobicContact CD1-CG1 3.72Å; L748-V750 HydrophobicContact CD2-CB 4.44Å; L748-V750 HydrophobicContact CD2-CG1 3.75Å; L748-V750 HydrophobicContact CD2-CG2 3.82Å; L748-V750 HydrophobicContact CG-CG1 3.72Å; L748-V750 HydrophobicContact CG-CG2 4.2Å; V750-L773 HydrophobicContact CG2-CD1 4.47Å; V750-E774 PolarHBondContact N-O 3.14Å; V750-L775 HydrophobicContact CG2-CD2 3.89Å; V750-L775 WeakPolarHBondContact O-CA 3.49Å; V750-D776 PolarHBondContact O-N 2.9Å
751	G	91.4	Very high	93.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176	-178.2	-169.6	0	0	0	0	0	116.6	P720 F730 C755 D776	P720-G751 VanDerWaalsContact CD-O 3.27Å; P720-G751 WeakPolarHBondContact CD-O 3.49Å; F730-G751 WeakPolarHBondContact CD1-O 3.5Å; G751-C755 PolarHBondContact O-SG 3.07Å; G751-D776 CarbonylContact C-O 3.57Å; G751-D776 WeakPolarHBondContact CA-O 3.22Å
752	G	88.3	Confident	93.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	85.4	155.5	-179.1	0	0	0	0	0	113.7	G754 C755 D776 H777	G752-G754 PolarHBondContact O-N 3.01Å; G752-C755 WeakPolarHBondContact O-CB 3.5Å; G752-C755 PolarHBondContact O-N 3.05Å; G752-D776 PolarHBondContact N-O 2.57Å; G752-H777 CarbonylContact C-O 3.3Å; G752-H777 VanDerWaalsContact CA-O 3.26Å; G752-H777 WeakPolarHBondContact CA-O 3.25Å; G752-H777 PolarHBondContact N-O 2.87Å
753	A	84.3	Confident	93.2	Very high	74 Å²	74	29.3 Å²	29.3	61%	0.612	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.6	-170.6	0	0	0	0	0	115.9	C755	A753-C755 VanDerWaalsContact C-N 3.26Å; A753-C755 PolarHBondContact O-N 3.21Å
754	G	85.7	Confident	93.3	Very high	18 Å²	18	26.3 Å²	26.3	19%	0.186	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-76.2	-7.6	172	0	0	0	0	0	114.9	P727 F730 S731 N732 G752	P727-G754 PolarHBondContact O-N 2.77Å; F730-G754 VanDerWaalsContact O-CA 3.3Å; F730-G754 WeakPolarHBondContact O-CA 3.39Å; S731-G754 CarbonylContact C-O 3.55Å; S731-G754 VanDerWaalsContact CA-O 3.27Å; S731-G754 WeakPolarHBondContact CA-O 3.33Å; N732-G754 PolarHBondContact N-O 2.84Å; G752-G754 PolarHBondContact O-N 3.01Å
755	C	91	Very high	93.5	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.014	15%	0.146	C	C	.	.			trans	-81	120.7	171.8	-66.4	0	0	0	0	110.8	F730 L735 G751 G752 A753 V778 S779	F730-C755 VanDerWaalsContact CD1-SG 3.55Å; F730-C755 VanDerWaalsContact CE1-SG 3.6Å; L735-C755 HydrophobicContact CD1-CB 4.04Å; G751-C755 PolarHBondContact O-SG 3.07Å; G752-C755 WeakPolarHBondContact O-CB 3.5Å; G752-C755 PolarHBondContact O-N 3.05Å; A753-C755 VanDerWaalsContact C-N 3.26Å; A753-C755 PolarHBondContact O-N 3.21Å; C755-V778 HydrophobicContact CB-CG1 3.95Å; C755-V778 HydrophobicContact CB-CG2 3.99Å; C755-S779 PolarHBondContact O-OG 3.31Å
756	G	90.8	Very high	93.3	Very high	13 Å²	13	29.9 Å²	29.9	13%	0.134	16%	0.16	C	C	.	.			trans	-137	178.7	173.8	0	0	0	0	0	112.8	N732 Q758 G759 L760	N732-G756 PolarHBondContact OD1-N 2.9Å; N732-G756 PolarHBondContact OD1-O 2.96Å; N732-G756 VanDerWaalsContact OD1-O 3.08Å; G756-Q758 PolarHBondContact O-N 3Å; G756-G759 PolarHBondContact O-N 3.26Å; G756-L760 PolarHBondContact O-N 3.3Å; G756-L760 VanDerWaalsContact O-N 3.16Å
757	V	92.6	Very high	93.3	Very high	39 Å²	39	23.7 Å²	23.7	24%	0.236	14%	0.137	C	C	.	.	H	α-helix	trans	-50.1	-51.2	-168.8	-161.7	0	0	0	0	113	G759 L760 A761 V785 E788	V757-G759 VanDerWaalsContact C-N 3.26Å; V757-G759 PolarHBondContact O-N 2.86Å; V757-L760 PolarHBondContact O-N 2.78Å; V757-A761 WeakPolarHBondContact O-CB 3.24Å; V757-A761 PolarHBondContact O-N 2.98Å; V757-V785 HydrophobicContact CG1-CG1 4.2Å; V757-V785 HydrophobicContact CG2-CB 4.43Å; V757-V785 HydrophobicContact CG2-CG1 4.15Å; V757-V785 HydrophobicContact CG2-CG2 3.72Å; V757-E788 HydrophobicContact CG1-CB 4.02Å; V757-E788 VanDerWaalsContact CG1-CD 3.42Å; V757-E788 HydrophobicContact CG1-CG 4.14Å; V757-E788 WeakPolarHBondContact CG1-OE2 3.47Å
758	Q	93.1	Very high	92.8	Very high	126 Å²	126	29.3 Å²	29.3	59%	0.589	16%	0.161	S	C	*	.	H	α-helix	trans	-61.2	-28.8	-178.9	-72.4	-73.7	-64.8	0	0	114.1	G756 S762 E788	G756-Q758 PolarHBondContact O-N 3Å; Q758-S762 WeakPolarHBondContact O-CB 3.24Å; Q758-S762 PolarHBondContact O-N 2.77Å; Q758-E788 PolarHBondContact NE2-OE1 2.95Å
759	G	94.7	Very high	92.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-74.6	-44.7	172.2	0	0	0	0	0	112	N732 G756 V757 S762 L763	N732-G759 WeakPolarHBondContact OD1-CA 3.46Å; N732-G759 PolarHBondContact OD1-N 3.13Å; G756-G759 PolarHBondContact O-N 3.26Å; V757-G759 VanDerWaalsContact C-N 3.26Å; V757-G759 PolarHBondContact O-N 2.86Å; G759-S762 PolarHBondContact O-N 3.18Å; G759-L763 WeakPolarHBondContact O-CB 3.41Å; G759-L763 PolarHBondContact O-N 3.29Å
760	L	94.9	Very high	92.5	Very high	6 Å²	6	36 Å²	36	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-40.2	178.7	-63.4	173.3	0	0	0	112.4	L735 G756 V757 L763 A764 L775 V778 I781 V789	L735-L760 HydrophobicContact CD1-CD2 3.99Å; L735-L760 HydrophobicContact CD1-CG 4.25Å; G756-L760 PolarHBondContact O-N 3.3Å; G756-L760 VanDerWaalsContact O-N 3.16Å; V757-L760 PolarHBondContact O-N 2.78Å; L760-L763 WeakPolarHBondContact O-CB 3.49Å; L760-L763 PolarHBondContact O-N 3.32Å; L760-A764 WeakPolarHBondContact O-CB 3.21Å; L760-A764 PolarHBondContact O-N 2.98Å; L760-L775 HydrophobicContact CD1-CD1 4.45Å; L760-L775 HydrophobicContact CD2-CD2 3.78Å; L760-V778 HydrophobicContact CD1-CG1 4.31Å; L760-I781 HydrophobicContact CD1-CD1 4.22Å; L760-V789 HydrophobicContact CB-CG1 4.45Å; L760-V789 HydrophobicContact CB-CG2 3.66Å
761	A	94.8	Very high	92.5	Very high	2 Å²	2	38.2 Å²	38.2	2%	0.017	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-45.9	175.1	0	0	0	0	0	111.3	V757 L763 A764 R765 E788 E792	V757-A761 WeakPolarHBondContact O-CB 3.24Å; V757-A761 PolarHBondContact O-N 2.98Å; A761-L763 PolarHBondContact O-N 2.83Å; A761-A764 PolarHBondContact O-N 3.36Å; A761-R765 WeakPolarHBondContact O-CB 3.44Å; A761-R765 PolarHBondContact O-N 3.2Å; A761-E788 HydrophobicContact CB-CG 4.06Å; A761-E792 HydrophobicContact CB-CG 4.19Å
762	S	95.3	Very high	92.8	Very high	16 Å²	16	39.7 Å²	39.7	11%	0.112	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-37.8	175.1	-167.9	0	0	0	0	112.5	Q758 G759 N766	Q758-S762 WeakPolarHBondContact O-CB 3.24Å; Q758-S762 PolarHBondContact O-N 2.77Å; G759-S762 PolarHBondContact O-N 3.18Å; S762-N766 PolarHBondContact O-N 2.73Å; S762-N766 PolarHBondContact O-ND2 3.37Å
763	L	95.6	Very high	93.2	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-52.3	172.5	177.7	80.6	0	0	0	111.2	I738 L748 G759 L760 A761 R765 N766 C767 L773	I738-L763 HydrophobicContact CB-CD1 4.23Å; I738-L763 HydrophobicContact CG2-CD1 3.67Å; L748-L763 HydrophobicContact CD2-CD1 3.63Å; L748-L763 HydrophobicContact CD2-CD2 3.3Å; L748-L763 HydrophobicContact CD2-CG 4.04Å; G759-L763 WeakPolarHBondContact O-CB 3.41Å; G759-L763 PolarHBondContact O-N 3.29Å; L760-L763 WeakPolarHBondContact O-CB 3.49Å; L760-L763 PolarHBondContact O-N 3.32Å; A761-L763 PolarHBondContact O-N 2.83Å; L763-R765 VanDerWaalsContact C-N 3.3Å; L763-R765 PolarHBondContact O-N 2.63Å; L763-N766 PolarHBondContact O-N 3.41Å; L763-N766 VanDerWaalsContact O-N 3.15Å; L763-C767 WeakPolarHBondContact O-CB 3.4Å; L763-C767 PolarHBondContact O-N 3.3Å; L763-L773 HydrophobicContact CD2-CD1 4.31Å
764	A	94.6	Very high	93.8	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.008	19%	0.19	C	C	.	.	H	α-helix	trans	-58.4	-40.7	-178.3	0	0	0	0	0	112.6	L760 A761 N766 V789 E792 L794	L760-A764 WeakPolarHBondContact O-CB 3.21Å; L760-A764 PolarHBondContact O-N 2.98Å; A761-A764 PolarHBondContact O-N 3.36Å; A764-N766 VanDerWaalsContact C-N 3.34Å; A764-N766 PolarHBondContact O-N 2.8Å; A764-V789 HydrophobicContact CB-CG1 3.78Å; A764-V789 WeakPolarHBondContact CB-O 3.25Å; A764-E792 HydrophobicContact CB-CB 4.31Å; A764-L794 HydrophobicContact CB-CD2 4.15Å; A764-L794 HydrophobicContact CB-CG 3.91Å
765	R	94.8	Very high	94.3	Very high	120 Å²	120	38.3 Å²	38.3	45%	0.453	18%	0.182	S	C	.	.	H	α-helix	trans	-58.4	-40.3	175.9	-170.6	-176.2	-65.5	137.2	-2.7	113.3	A761 L763 E792	A761-R765 WeakPolarHBondContact O-CB 3.44Å; A761-R765 PolarHBondContact O-N 3.2Å; L763-R765 VanDerWaalsContact C-N 3.3Å; L763-R765 PolarHBondContact O-N 2.63Å; R765-E792 WeakPolarHBondContact CA-O 3.32Å; R765-E792 HydrophobicContact CB-CB 4.24Å; R765-E792 IonicContact CZ-OE1 2.73Å; R765-E792 IonicContact CZ-OE2 3.27Å; R765-E792 VanDerWaalsContact CZ-OE2 3.29Å; R765-E792 IonicContact NE-OE1 3.21Å; R765-E792 IonicContact NE-OE2 3.47Å; R765-E792 PolarHBondContact NE-OE2 2.94Å; R765-E792 IonicContact NH2-OE1 2.7Å; R765-E792 PolarHBondContact NH2-OE1 2.84Å; R765-E792 IonicContact NH2-OE2 3.3Å; R765-E792 PolarHBondContact NH2-OE2 3.21Å; R765-E792 VanDerWaalsContact NH2-OE2 3.12Å
766	N	94.2	Very high	94.4	Very high	58 Å²	58	38.9 Å²	38.9	31%	0.31	19%	0.185	S	C	.	.	H	α-helix	trans	-93.6	-38.9	-173.8	-69	-82.8	0	0	0	113.1	G739 S762 L763 A764 M768	G739-N766 WeakPolarHBondContact O-CB 3.21Å; S762-N766 PolarHBondContact O-N 2.73Å; S762-N766 PolarHBondContact O-ND2 3.37Å; L763-N766 PolarHBondContact O-N 3.41Å; L763-N766 VanDerWaalsContact O-N 3.15Å; A764-N766 VanDerWaalsContact C-N 3.34Å; A764-N766 PolarHBondContact O-N 2.8Å; N766-M768 VanDerWaalsContact C-N 3.28Å; N766-M768 PolarHBondContact O-N 3.18Å
767	C	94.1	Very high	94.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.192	C	C	.	.			trans	-86.8	57.6	-178.1	-65.7	0	0	0	0	112.1	W742 L763 R769 L770	W742-C767 PolarHBondContact O-SG 3.05Å; L763-C767 WeakPolarHBondContact O-CB 3.4Å; L763-C767 PolarHBondContact O-N 3.3Å; C767-R769 PolarHBondContact O-N 3.39Å; C767-L770 HydrophobicContact CB-CB 4.35Å; C767-L770 VanDerWaalsContact O-CB 3.31Å; C767-L770 WeakPolarHBondContact O-CB 3.01Å; C767-L770 PolarHBondContact O-N 3.26Å
768	M	88.4	Confident	94.4	Very high	138 Å²	138	39.5 Å²	39.5	68%	0.68	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.9	-174.3	-58.3	-166.9	83	0	0	114.9	N766	N766-M768 VanDerWaalsContact C-N 3.28Å; N766-M768 PolarHBondContact O-N 3.18Å
769	R	91.9	Very high	94.2	Very high	139 Å²	139	36 Å²	36	53%	0.525	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	9.2	177.5	-67.6	-174	174.3	166.4	-1.6	114.2	H744 L745 C767 Q771	H744-R769 PolarHBondContact ND1-NH1 2.66Å; L745-R769 CarbonylContact O-C 3.57Å; L745-R769 VanDerWaalsContact O-C 3.3Å; C767-R769 PolarHBondContact O-N 3.39Å; R769-Q771 PolarHBondContact O-N 2.63Å
770	L	95.3	Very high	94.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	19%	0.192	C	C	.	.			trans	-69.1	118.9	-176.7	-161.4	73.5	0	0	0	111.8	L745 L748 C767 V772 L773 L794 G796 L797	L745-L770 HydrophobicContact CD2-CD1 4.24Å; L745-L770 HydrophobicContact CG-CD1 4.35Å; L745-L770 WeakPolarHBondContact O-CA 3.3Å; L745-L770 PolarHBondContact O-N 3.43Å; L748-L770 HydrophobicContact CB-CD1 3.78Å; L748-L770 HydrophobicContact CB-CD2 4.42Å; C767-L770 HydrophobicContact CB-CB 4.35Å; C767-L770 VanDerWaalsContact O-CB 3.31Å; C767-L770 WeakPolarHBondContact O-CB 3.01Å; C767-L770 PolarHBondContact O-N 3.26Å; L770-V772 WeakPolarHBondContact CD1-O 3.13Å; L770-L773 HydrophobicContact CD2-CB 3.91Å; L770-L773 HydrophobicContact CD2-CD1 4.02Å; L770-L773 HydrophobicContact CD2-CG 4.39Å; L770-L794 HydrophobicContact CD2-CD2 3.9Å; L770-G796 CarbonylContact O-C 3.56Å; L770-L797 PolarHBondContact O-N 3.24Å
771	Q	96.3	Very high	94.1	Very high	48 Å²	48	40 Å²	40	22%	0.224	19%	0.191	C	C	.	.			trans	-103.9	-28.9	178.9	-64.4	173.9	-87.9	0	0	111.9	R746 R769 E798 M799	R746-Q771 WeakPolarHBondContact O-CA 3.37Å; R746-Q771 PolarHBondContact O-N 3.12Å; R769-Q771 PolarHBondContact O-N 2.63Å; Q771-E798 HydrophobicContact CB-CG 4.31Å; Q771-E798 PolarHBondContact NE2-OE1 3.35Å; Q771-E798 WeakPolarHBondContact O-CA 3.44Å; Q771-E798 PolarHBondContact O-N 3.06Å; Q771-M799 PolarHBondContact O-N 3.29Å
772	V	97.4	Very high	94.1	Very high	31 Å²	31	41.5 Å²	41.5	19%	0.188	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.3	177.1	-172.4	0	0	0	0	109.6	R746 A747 L748 L770 E774 M799	R746-V772 PolarHBondContact O-N 3.12Å; A747-V772 WeakPolarHBondContact CA-O 3.29Å; A747-V772 HydrophobicContact CB-CB 4Å; A747-V772 HydrophobicContact CB-CG2 4.42Å; L748-V772 PolarHBondContact N-O 3.16Å; L770-V772 WeakPolarHBondContact CD1-O 3.13Å; V772-E774 HydrophobicContact CG1-CG 4.28Å; V772-M799 WeakPolarHBondContact CA-O 3.47Å; V772-M799 HydrophobicContact CG1-CB 4.2Å; V772-M799 HydrophobicContact CG1-CG 4.18Å; V772-M799 HydrophobicContact CG1-SD 4.31Å; V772-M799 HydrophobicContact CG2-CB 4.25Å
773	L	97.2	Very high	94.1	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.8	172.6	178.2	60.3	0	0	0	109.4	L748 V750 L763 L770 L775 L794 L797 M799 L800 V801	L748-L773 HydrophobicContact CB-CD1 4.45Å; L748-L773 HydrophobicContact CD2-CD1 4.18Å; L748-L773 CarbonylContact O-C 3.54Å; L748-L773 WeakPolarHBondContact O-CA 3.48Å; V750-L773 HydrophobicContact CG2-CD1 4.47Å; L763-L773 HydrophobicContact CD2-CD1 4.31Å; L770-L773 HydrophobicContact CD2-CB 3.91Å; L770-L773 HydrophobicContact CD2-CD1 4.02Å; L770-L773 HydrophobicContact CD2-CG 4.39Å; L773-L775 HydrophobicContact CD1-CD2 3.86Å; L773-L775 HydrophobicContact CD2-CD2 4.35Å; L773-L775 HydrophobicContact CG-CD2 4.11Å; L773-L775 HydrophobicContact CG-CG 4.29Å; L773-L794 HydrophobicContact CD2-CD1 3.84Å; L773-L794 HydrophobicContact CD2-CD2 4.41Å; L773-L797 HydrophobicContact CB-CD1 3.72Å; L773-M799 PolarHBondContact N-O 3.22Å; L773-L800 HydrophobicContact CB-CD1 4.29Å; L773-L800 HydrophobicContact CD2-CD1 4.2Å; L773-L800 HydrophobicContact CG-CD1 4.26Å; L773-L800 CarbonylContact O-C 3.43Å; L773-L800 WeakPolarHBondContact O-CA 3.45Å; L773-V801 PolarHBondContact O-N 3.29Å
774	E	97	Very high	94	Very high	51 Å²	51	50 Å²	50	24%	0.238	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.3	171.8	-44.3	176.8	-178	0	0	108.8	R692 Q717 L748 G749 V750 V772 V801	R692-E774 IonicContact NH2-OE2 2.87Å; R692-E774 PolarHBondContact NH2-OE2 3.29Å; Q717-E774 PolarHBondContact NE2-OE1 3.13Å; Q717-E774 VanDerWaalsContact NE2-OE1 3.15Å; Q717-E774 PolarHBondContact NE2-OE2 3.19Å; Q717-E774 PolarHBondContact OE1-OE2 2.82Å; L748-E774 PolarHBondContact O-N 3.29Å; G749-E774 WeakPolarHBondContact CA-O 3.23Å; V750-E774 PolarHBondContact N-O 3.14Å; V772-E774 HydrophobicContact CG1-CG 4.28Å; E774-V801 CarbonylContact C-O 3.51Å; E774-V801 WeakPolarHBondContact CA-O 3.38Å; E774-V801 HydrophobicContact CB-CB 4.05Å; E774-V801 HydrophobicContact CG-CB 3.93Å; E774-V801 HydrophobicContact CG-CG2 4.05Å
775	L	96	Very high	94	Very high	6 Å²	6	50.7 Å²	50.7	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.4	171.7	-56.8	-176.1	0	0	0	108.7	V750 L760 L773 V778 I781 V801 L802 T803 T805	V750-L775 HydrophobicContact CG2-CD2 3.89Å; V750-L775 WeakPolarHBondContact O-CA 3.49Å; L760-L775 HydrophobicContact CD1-CD1 4.45Å; L760-L775 HydrophobicContact CD2-CD2 3.78Å; L773-L775 HydrophobicContact CD1-CD2 3.86Å; L773-L775 HydrophobicContact CD2-CD2 4.35Å; L773-L775 HydrophobicContact CG-CD2 4.11Å; L773-L775 HydrophobicContact CG-CG 4.29Å; L775-V778 HydrophobicContact CB-CB 4.41Å; L775-V778 HydrophobicContact CB-CG2 3.96Å; L775-V778 HydrophobicContact CD2-CG2 4.49Å; L775-I781 HydrophobicContact CD1-CD1 4.09Å; L775-I781 HydrophobicContact CD1-CG1 4.39Å; L775-V801 PolarHBondContact N-O 2.69Å; L775-L802 HydrophobicContact CB-CD2 3.85Å; L775-L802 HydrophobicContact CD1-CD2 3.83Å; L775-L802 HydrophobicContact CG-CD2 4.06Å; L775-T803 PolarHBondContact O-N 3.01Å; L775-T805 HydrophobicContact CB-CG2 4.35Å; L775-T805 PolarHBondContact O-OG1 3.11Å
776	D	93.8	Very high	94.1	Very high	14 Å²	14	45 Å²	45	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	111.3	-167.4	-164.3	-31.5	0	0	0	109.9	R692 A719 V750 G751 G752 V778 T803	R692-D776 IonicContact CZ-OD2 2.63Å; R692-D776 IonicContact NH1-OD2 3.41Å; R692-D776 PolarHBondContact NH1-OD2 3.16Å; R692-D776 IonicContact NH2-OD2 3.28Å; A719-D776 HydrophobicContact CB-CB 3.76Å; V750-D776 PolarHBondContact O-N 2.9Å; G751-D776 CarbonylContact C-O 3.57Å; G751-D776 WeakPolarHBondContact CA-O 3.22Å; G752-D776 PolarHBondContact N-O 2.57Å; D776-V778 VanDerWaalsContact C-N 3.35Å; D776-V778 PolarHBondContact O-N 3.04Å; D776-T803 CarbonylContact C-O 3.6Å; D776-T803 WeakPolarHBondContact CA-O 3.33Å
777	H	91.8	Very high	94.1	Very high	60 Å²	60	43.3 Å²	43.3	28%	0.278	21%	0.214	S	C	.	.	S	Bend	trans	50.3	48.7	-172.4	-58.3	72.1	0	0	0	113.7	H722 G752 T803 A804 T805	H722-H777 WeakPolarHBondContact CB-NE2 3.3Å; H722-H777 AromaticContact CD2-CD2 3.67Å; H722-H777 AromaticContact CD2-CG 3.85Å; H722-H777 VanDerWaalsContact CE1-CB 3.41Å; H722-H777 WeakPolarHBondContact CE1-CB 3.36Å; H722-H777 AromaticContact CE1-CG 3.51Å; H722-H777 AromaticContact CE1-ND1 3.74Å; H722-H777 AromaticContact CG-CD2 3.44Å; H722-H777 VanDerWaalsContact CG-CD2 3.44Å; H722-H777 AromaticContact CG-CE1 3.6Å; H722-H777 AromaticContact CG-CG 3.56Å; H722-H777 AromaticContact CG-ND1 3.64Å; H722-H777 AromaticContact CG-NE2 3.45Å; H722-H777 AromaticContact ND1-CD2 3.74Å; H722-H777 AromaticContact ND1-CE1 3.54Å; H722-H777 AromaticContact ND1-CG 3.33Å; H722-H777 VanDerWaalsContact ND1-CG 3.33Å; H722-H777 AromaticContact ND1-ND1 3.18Å; H722-H777 PolarHBondContact ND1-ND1 3.21Å; H722-H777 VanDerWaalsContact ND1-ND1 3.18Å; H722-H777 AromaticContact ND1-NE2 3.84Å; H722-H777 AromaticContact NE2-CG 3.86Å; G752-H777 CarbonylContact C-O 3.3Å; G752-H777 VanDerWaalsContact CA-O 3.26Å; G752-H777 WeakPolarHBondContact CA-O 3.25Å; G752-H777 PolarHBondContact N-O 2.87Å; H777-T803 PolarHBondContact N-O 3.47Å; H777-A804 WeakPolarHBondContact CA-O 3.31Å; H777-A804 VanDerWaalsContact CE1-CB 3.42Å; H777-A804 WeakPolarHBondContact CE1-CB 3.21Å; H777-A804 WeakPolarHBondContact NE2-CB 3.39Å; H777-T805 PolarHBondContact N-OG1 3.19Å
778	V	91.6	Very high	94.1	Very high	5 Å²	5	46 Å²	46	3%	0.03	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-95	156	175.9	179	0	0	0	0	110.2	C755 L760 L775 D776 I781 T805	C755-V778 HydrophobicContact CB-CG1 3.95Å; C755-V778 HydrophobicContact CB-CG2 3.99Å; L760-V778 HydrophobicContact CD1-CG1 4.31Å; L775-V778 HydrophobicContact CB-CB 4.41Å; L775-V778 HydrophobicContact CB-CG2 3.96Å; L775-V778 HydrophobicContact CD2-CG2 4.49Å; D776-V778 VanDerWaalsContact C-N 3.35Å; D776-V778 PolarHBondContact O-N 3.04Å; V778-I781 HydrophobicContact CG1-CD1 4.28Å; V778-T805 HydrophobicContact CB-CG2 3.89Å; V778-T805 PolarHBondContact N-OG1 2.89Å; V778-T805 VanDerWaalsContact N-OG1 3.12Å
779	S	89.2	Confident	94.4	Very high	53 Å²	53	39.8 Å²	39.8	37%	0.371	20%	0.197	S	C	.	.	S	Bend	trans	-54.3	154.7	172.3	61.7	0	0	0	0	112.6	C755 I781	C755-S779 PolarHBondContact O-OG 3.31Å; S779-I781 WeakPolarHBondContact O-CD1 3.28Å; S779-I781 PolarHBondContact O-N 3.23Å
780	E	91.3	Very high	94.5	Very high	89 Å²	89	33.3 Å²	33.3	42%	0.416	17%	0.172	S	C	.	.	P	Polyproline II helix	trans	-50.5	129.9	-173.7	-173.1	179.8	-152.8	0	0	114.3	T782 P806 T808	E780-T782 HydrophobicContact CG-CG2 4.18Å; E780-T782 PolarHBondContact O-N 3.2Å; E780-P806 WeakPolarHBondContact CA-O 3.24Å; E780-P806 HydrophobicContact CB-CB 3.89Å; E780-P806 HydrophobicContact CG-CB 3.88Å; E780-T808 WeakPolarHBondContact OE1-CG2 3.33Å
781	I	94.9	Very high	94.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-90.7	89.5	175.8	-50	-59.1	0	0	0	109	L760 L775 V778 S779 V785 T805 P806 V807 T808 A811 F815	L760-I781 HydrophobicContact CD1-CD1 4.22Å; L775-I781 HydrophobicContact CD1-CD1 4.09Å; L775-I781 HydrophobicContact CD1-CG1 4.39Å; V778-I781 HydrophobicContact CG1-CD1 4.28Å; S779-I781 WeakPolarHBondContact O-CD1 3.28Å; S779-I781 PolarHBondContact O-N 3.23Å; I781-V785 HydrophobicContact CD1-CG1 3.88Å; I781-V785 HydrophobicContact CG2-CB 4.47Å; I781-V785 HydrophobicContact CG2-CG1 4.2Å; I781-T805 HydrophobicContact CD1-CG2 4.48Å; I781-T805 HydrophobicContact CG1-CG2 3.8Å; I781-P806 PolarHBondContact N-O 3.36Å; I781-V807 HydrophobicContact CB-CB 4.42Å; I781-V807 HydrophobicContact CB-CG2 4.16Å; I781-T808 PolarHBondContact O-N 2.96Å; I781-T808 VanDerWaalsContact O-N 3.09Å; I781-T808 PolarHBondContact O-OG1 3.18Å; I781-A811 HydrophobicContact CG2-CB 4.16Å; I781-A811 WeakPolarHBondContact O-CB 3.19Å; I781-F815 HydrophobicContact CG2-CE2 3.81Å; I781-F815 HydrophobicContact CG2-CZ 4.21Å
782	T	95	Very high	94.2	Very high	32 Å²	32	42.7 Å²	42.7	20%	0.196	21%	0.208	C	C	.	.			trans	-77.6	174.4	173	82.4	0	0	0	0	111.7	E780 E784 V785 A786 T808 A811	E780-T782 HydrophobicContact CG-CG2 4.18Å; E780-T782 PolarHBondContact O-N 3.2Å; T782-E784 WeakPolarHBondContact CB-OE2 3.32Å; T782-E784 PolarHBondContact O-N 2.89Å; T782-E784 PolarHBondContact OG1-N 3.15Å; T782-E784 PolarHBondContact OG1-OE2 2.94Å; T782-V785 PolarHBondContact O-N 3.02Å; T782-V785 PolarHBondContact OG1-N 2.93Å; T782-A786 WeakPolarHBondContact O-CB 3.17Å; T782-A786 PolarHBondContact O-N 3.34Å; T782-T808 HydrophobicContact CG2-CG2 4.5Å; T782-A811 WeakPolarHBondContact O-CB 3.46Å
783	Q	95.1	Very high	93.8	Very high	74 Å²	74	41.4 Å²	41.4	35%	0.346	20%	0.201	S	C	.	.	H	α-helix	trans	-60.7	-36.2	175.8	179.4	-177.1	-35.6	0	0	111.6	A786 A787 K810	Q783-A786 PolarHBondContact O-N 2.87Å; Q783-A787 VanDerWaalsContact O-CB 3.26Å; Q783-A787 WeakPolarHBondContact O-CB 3.21Å; Q783-A787 PolarHBondContact O-N 3.34Å; Q783-K810 HydrophobicContact CB-CB 3.89Å; Q783-K810 HydrophobicContact CG-CB 4.28Å
784	E	94.5	Very high	93.4	Very high	124 Å²	124	41.4 Å²	41.4	58%	0.579	20%	0.201	S	C	*	.	H	α-helix	trans	-69.1	-45.8	-178	-58.6	64.2	-136.2	0	0	109.9	T782 A787 E788	T782-E784 WeakPolarHBondContact CB-OE2 3.32Å; T782-E784 PolarHBondContact O-N 2.89Å; T782-E784 PolarHBondContact OG1-N 3.15Å; T782-E784 PolarHBondContact OG1-OE2 2.94Å; E784-A787 PolarHBondContact O-N 3.2Å; E784-E788 PolarHBondContact O-N 3.3Å
785	V	94.9	Very high	93	Very high	15 Å²	15	45.7 Å²	45.7	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-48.7	172.9	-180	0	0	0	0	110.9	V757 I781 T782 A787 E788 V789	V757-V785 HydrophobicContact CG1-CG1 4.2Å; V757-V785 HydrophobicContact CG2-CB 4.43Å; V757-V785 HydrophobicContact CG2-CG1 4.15Å; V757-V785 HydrophobicContact CG2-CG2 3.72Å; I781-V785 HydrophobicContact CD1-CG1 3.88Å; I781-V785 HydrophobicContact CG2-CB 4.47Å; I781-V785 HydrophobicContact CG2-CG1 4.2Å; T782-V785 PolarHBondContact O-N 3.02Å; T782-V785 PolarHBondContact OG1-N 2.93Å; V785-A787 VanDerWaalsContact C-N 3.3Å; V785-A787 PolarHBondContact O-N 3.32Å; V785-E788 PolarHBondContact O-N 3.36Å; V785-V789 VanDerWaalsContact O-CG2 3.32Å; V785-V789 WeakPolarHBondContact O-CG2 3.31Å; V785-V789 PolarHBondContact O-N 3.06Å; V785-V789 VanDerWaalsContact O-N 3.11Å
786	A	95.6	Very high	92.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-39	177.3	0	0	0	0	0	112.1	T782 Q783 C790 A811 H814 F815	T782-A786 WeakPolarHBondContact O-CB 3.17Å; T782-A786 PolarHBondContact O-N 3.34Å; Q783-A786 PolarHBondContact O-N 2.87Å; A786-C790 WeakPolarHBondContact O-CB 3.36Å; A786-C790 PolarHBondContact O-N 2.97Å; A786-C790 PolarHBondContact O-SG 3.09Å; A786-A811 HydrophobicContact CB-CB 3.87Å; A786-H814 HydrophobicContact CB-CB 4.24Å; A786-F815 HydrophobicContact CB-CD2 4Å; A786-F815 HydrophobicContact CB-CE2 3.55Å; A786-F815 HydrophobicContact CB-CZ 3.86Å
787	A	94.7	Very high	92.7	Very high	22 Å²	22	45.8 Å²	45.8	18%	0.182	23%	0.225	C	C	.	.	H	α-helix	trans	-72.3	-34.3	179.7	0	0	0	0	0	113.8	Q783 E784 V785 R791 H814	Q783-A787 VanDerWaalsContact O-CB 3.26Å; Q783-A787 WeakPolarHBondContact O-CB 3.21Å; Q783-A787 PolarHBondContact O-N 3.34Å; E784-A787 PolarHBondContact O-N 3.2Å; V785-A787 VanDerWaalsContact C-N 3.3Å; V785-A787 PolarHBondContact O-N 3.32Å; A787-R791 WeakPolarHBondContact O-CB 3.31Å; A787-R791 PolarHBondContact O-N 3.47Å; A787-R791 VanDerWaalsContact O-N 3.12Å; A787-H814 WeakPolarHBondContact CA-NE2 3.38Å
788	E	94.3	Very high	92.9	Very high	56 Å²	56	45.3 Å²	45.3	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-65.9	-51	172	-170.4	176.3	138.5	0	0	110.3	V757 Q758 A761 E784 V785 C790 R791 E792	V757-E788 HydrophobicContact CG1-CB 4.02Å; V757-E788 VanDerWaalsContact CG1-CD 3.42Å; V757-E788 HydrophobicContact CG1-CG 4.14Å; V757-E788 WeakPolarHBondContact CG1-OE2 3.47Å; Q758-E788 PolarHBondContact NE2-OE1 2.95Å; A761-E788 HydrophobicContact CB-CG 4.06Å; E784-E788 PolarHBondContact O-N 3.3Å; V785-E788 PolarHBondContact O-N 3.36Å; E788-C790 PolarHBondContact O-N 2.93Å; E788-R791 WeakPolarHBondContact O-CB 3.36Å; E788-R791 PolarHBondContact O-N 3.26Å; E788-E792 WeakPolarHBondContact O-CG 3.42Å; E788-E792 PolarHBondContact O-N 3.44Å
789	V	94.2	Very high	93.1	Very high	9 Å²	9	47.5 Å²	47.5	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-38	-176.8	-177.5	0	0	0	0	112.1	L760 A764 V785 G793 L794	L760-V789 HydrophobicContact CB-CG1 4.45Å; L760-V789 HydrophobicContact CB-CG2 3.66Å; A764-V789 HydrophobicContact CB-CG1 3.78Å; A764-V789 WeakPolarHBondContact CB-O 3.25Å; V785-V789 VanDerWaalsContact O-CG2 3.32Å; V785-V789 WeakPolarHBondContact O-CG2 3.31Å; V785-V789 PolarHBondContact O-N 3.06Å; V785-V789 VanDerWaalsContact O-N 3.11Å; V789-G793 PolarHBondContact O-N 3.43Å; V789-G793 VanDerWaalsContact O-N 3.17Å; V789-L794 HydrophobicContact CG1-CD1 3.59Å; V789-L794 HydrophobicContact CG1-CG 4.21Å
790	C	93.8	Very high	93.5	Very high	2 Å²	2	45 Å²	45	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-75.3	-22.3	176.1	-67.1	0	0	0	0	114.1	A786 E788 F815 I818	A786-C790 WeakPolarHBondContact O-CB 3.36Å; A786-C790 PolarHBondContact O-N 2.97Å; A786-C790 PolarHBondContact O-SG 3.09Å; E788-C790 PolarHBondContact O-N 2.93Å; C790-F815 WeakPolarHBondContact SG-CD1 3.21Å; C790-F815 VanDerWaalsContact SG-CE1 3.55Å; C790-I818 HydrophobicContact CB-CB 4.03Å; C790-I818 HydrophobicContact CB-CG1 4.08Å; C790-I818 HydrophobicContact CB-CG2 3.98Å
791	R	93.1	Very high	93.8	Very high	186 Å²	186	41.7 Å²	41.7	70%	0.702	20%	0.202	S	C	*	.	H	α-helix	trans	-69.1	-42.1	172.4	-177.7	-171	-54.2	169.5	4.4	110.8	A787 E788	A787-R791 WeakPolarHBondContact O-CB 3.31Å; A787-R791 PolarHBondContact O-N 3.47Å; A787-R791 VanDerWaalsContact O-N 3.12Å; E788-R791 WeakPolarHBondContact O-CB 3.36Å; E788-R791 PolarHBondContact O-N 3.26Å
792	E	92.5	Very high	93.8	Very high	61 Å²	61	41.6 Å²	41.6	29%	0.285	20%	0.201	S	C	.	.	H	α-helix	trans	-76.6	-31.1	-177.6	-66	-65.8	173.8	0	0	113.7	A761 A764 R765 E788	A761-E792 HydrophobicContact CB-CG 4.19Å; A764-E792 HydrophobicContact CB-CB 4.31Å; R765-E792 WeakPolarHBondContact CA-O 3.32Å; R765-E792 HydrophobicContact CB-CB 4.24Å; R765-E792 IonicContact CZ-OE1 2.73Å; R765-E792 IonicContact CZ-OE2 3.27Å; R765-E792 VanDerWaalsContact CZ-OE2 3.29Å; R765-E792 IonicContact NE-OE1 3.21Å; R765-E792 IonicContact NE-OE2 3.47Å; R765-E792 PolarHBondContact NE-OE2 2.94Å; R765-E792 IonicContact NH2-OE1 2.7Å; R765-E792 PolarHBondContact NH2-OE1 2.84Å; R765-E792 IonicContact NH2-OE2 3.3Å; R765-E792 PolarHBondContact NH2-OE2 3.21Å; R765-E792 VanDerWaalsContact NH2-OE2 3.12Å; E788-E792 WeakPolarHBondContact O-CG 3.42Å; E788-E792 PolarHBondContact O-N 3.44Å
793	G	89.4	Confident	93.8	Very high	4 Å²	4	41.8 Å²	41.8	4%	0.041	20%	0.202	C	C	.	.	S	Bend	trans	-172	-138	-177.5	0	0	0	0	0	115.7	V789 K795	V789-G793 PolarHBondContact O-N 3.43Å; V789-G793 VanDerWaalsContact O-N 3.17Å; G793-K795 PolarHBondContact O-N 2.92Å
794	L	89.7	Confident	93.6	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.026	19%	0.19	C	C	.	.			trans	55.5	7.3	179.3	-54.3	-171.4	0	0	0	117.7	A764 L770 L773 V789 G796 L797 F815	A764-L794 HydrophobicContact CB-CD2 4.15Å; A764-L794 HydrophobicContact CB-CG 3.91Å; L770-L794 HydrophobicContact CD2-CD2 3.9Å; L773-L794 HydrophobicContact CD2-CD1 3.84Å; L773-L794 HydrophobicContact CD2-CD2 4.41Å; V789-L794 HydrophobicContact CG1-CD1 3.59Å; V789-L794 HydrophobicContact CG1-CG 4.21Å; L794-G796 PolarHBondContact O-N 3.05Å; L794-L797 HydrophobicContact CB-CB 4.35Å; L794-L797 HydrophobicContact CD1-CD2 4.48Å; L794-L797 WeakPolarHBondContact O-CB 3.44Å; L794-L797 PolarHBondContact O-N 2.97Å; L794-F815 HydrophobicContact CD1-CE1 4.27Å
795	K	87.1	Confident	93.5	Very high	140 Å²	140	32.9 Å²	32.9	61%	0.609	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-25.6	179.6	-61.6	176	-175	172.1	0	114.4	G793	G793-K795 PolarHBondContact O-N 2.92Å
796	G	88.9	Confident	93.4	Very high	22 Å²	22	32.9 Å²	32.9	23%	0.227	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.6	176.4	0	0	0	0	0	115.7	L770 L794 E798	L770-G796 CarbonylContact O-C 3.56Å; L794-G796 PolarHBondContact O-N 3.05Å; G796-E798 PolarHBondContact O-N 3.08Å
797	L	95.3	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.163	C	C	.	.			trans	-66.2	128.5	-173.7	-168.6	73.3	0	0	0	111.6	L770 L773 L794 L800 C819 N821 L822	L770-L797 PolarHBondContact O-N 3.24Å; L773-L797 HydrophobicContact CB-CD1 3.72Å; L794-L797 HydrophobicContact CB-CB 4.35Å; L794-L797 HydrophobicContact CD1-CD2 4.48Å; L794-L797 WeakPolarHBondContact O-CB 3.44Å; L794-L797 PolarHBondContact O-N 2.97Å; L797-L800 HydrophobicContact CD2-CB 4.13Å; L797-L800 HydrophobicContact CD2-CD1 4.39Å; L797-C819 HydrophobicContact CB-CB 4.38Å; L797-N821 CarbonylContact O-C 3.5Å; L797-N821 VanDerWaalsContact O-C 3.29Å; L797-L822 HydrophobicContact CD2-CD1 4.31Å; L797-L822 HydrophobicContact CG-CD1 4.36Å; L797-L822 WeakPolarHBondContact O-CA 3.23Å; L797-L822 PolarHBondContact O-N 3.19Å
798	E	95.7	Very high	93.2	Very high	50 Å²	50	33.2 Å²	33.2	23%	0.234	16%	0.163	C	C	.	.			trans	-107.7	-26.7	178.6	-61	-173.4	-154.4	0	0	112.8	Q771 G796 N821 K823 S824	Q771-E798 HydrophobicContact CB-CG 4.31Å; Q771-E798 PolarHBondContact NE2-OE1 3.35Å; Q771-E798 WeakPolarHBondContact O-CA 3.44Å; Q771-E798 PolarHBondContact O-N 3.06Å; G796-E798 PolarHBondContact O-N 3.08Å; E798-N821 WeakPolarHBondContact CA-O 3.4Å; E798-N821 HydrophobicContact CG-CB 4.41Å; E798-K823 HydrophobicContact CB-CD 4.33Å; E798-K823 VanDerWaalsContact CD-NZ 3.33Å; E798-K823 PolarHBondContact O-N 3.5Å; E798-K823 IonicContact OE1-NZ 3.7Å; E798-K823 WeakPolarHBondContact OE2-CE 3.48Å; E798-K823 IonicContact OE2-NZ 2.7Å; E798-K823 PolarHBondContact OE2-NZ 3.1Å; E798-S824 PolarHBondContact O-N 3.37Å
799	M	96.6	Very high	93.1	Very high	51 Å²	51	32.2 Å²	32.2	25%	0.251	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	124.2	-177.9	179	168.6	-85.3	0	0	111	Q771 V772 L773 V801 S824	Q771-M799 PolarHBondContact O-N 3.29Å; V772-M799 WeakPolarHBondContact CA-O 3.47Å; V772-M799 HydrophobicContact CG1-CB 4.2Å; V772-M799 HydrophobicContact CG1-CG 4.18Å; V772-M799 HydrophobicContact CG1-SD 4.31Å; V772-M799 HydrophobicContact CG2-CB 4.25Å; L773-M799 PolarHBondContact N-O 3.22Å; M799-V801 HydrophobicContact CG-CG2 4.11Å; M799-S824 WeakPolarHBondContact CA-O 3.32Å
800	L	96.8	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.6	170.5	-178.2	62.1	0	0	0	108.9	L773 L797 L802 F815 L822 S824 I825 V826	L773-L800 HydrophobicContact CB-CD1 4.29Å; L773-L800 HydrophobicContact CD2-CD1 4.2Å; L773-L800 HydrophobicContact CG-CD1 4.26Å; L773-L800 CarbonylContact O-C 3.43Å; L773-L800 WeakPolarHBondContact O-CA 3.45Å; L797-L800 HydrophobicContact CD2-CB 4.13Å; L797-L800 HydrophobicContact CD2-CD1 4.39Å; L800-L802 HydrophobicContact CD1-CD2 4Å; L800-L802 HydrophobicContact CD2-CD1 4.36Å; L800-L802 HydrophobicContact CD2-CD2 4.48Å; L800-L802 HydrophobicContact CD2-CG 4.43Å; L800-L802 HydrophobicContact CG-CD2 4.17Å; L800-L802 HydrophobicContact CG-CG 4.18Å; L800-F815 HydrophobicContact CD2-CD1 4.25Å; L800-F815 HydrophobicContact CD2-CD2 3.88Å; L800-F815 HydrophobicContact CD2-CE1 4.47Å; L800-F815 HydrophobicContact CD2-CE2 4.12Å; L800-F815 HydrophobicContact CD2-CG 3.96Å; L800-F815 HydrophobicContact CD2-CZ 4.42Å; L800-L822 HydrophobicContact CB-CD1 4.28Å; L800-S824 PolarHBondContact N-O 2.86Å; L800-I825 CarbonylContact O-C 3.2Å; L800-I825 WeakPolarHBondContact O-CA 3.47Å; L800-V826 PolarHBondContact O-N 3.23Å
801	V	96.9	Very high	93.1	Very high	21 Å²	21	38 Å²	38	13%	0.127	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.5	172.5	-175.4	0	0	0	0	108.4	L773 E774 L775 M799 V826	L773-V801 PolarHBondContact O-N 3.29Å; E774-V801 CarbonylContact C-O 3.51Å; E774-V801 WeakPolarHBondContact CA-O 3.38Å; E774-V801 HydrophobicContact CB-CB 4.05Å; E774-V801 HydrophobicContact CG-CB 3.93Å; E774-V801 HydrophobicContact CG-CG2 4.05Å; L775-V801 PolarHBondContact N-O 2.69Å; M799-V801 HydrophobicContact CG-CG2 4.11Å; V801-V826 CarbonylContact C-O 3.59Å; V801-V826 WeakPolarHBondContact CA-O 3.39Å; V801-V826 HydrophobicContact CG1-CB 4.24Å; V801-V826 HydrophobicContact CG1-CG1 4.46Å; V801-V826 HydrophobicContact CG2-CB 4.29Å
802	L	96.1	Very high	93.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	103	176.7	-57.4	178.7	0	0	0	107.3	L775 L800 T805 V807 L812 V826 V827 Q828	L775-L802 HydrophobicContact CB-CD2 3.85Å; L775-L802 HydrophobicContact CD1-CD2 3.83Å; L775-L802 HydrophobicContact CG-CD2 4.06Å; L800-L802 HydrophobicContact CD1-CD2 4Å; L800-L802 HydrophobicContact CD2-CD1 4.36Å; L800-L802 HydrophobicContact CD2-CD2 4.48Å; L800-L802 HydrophobicContact CD2-CG 4.43Å; L800-L802 HydrophobicContact CG-CD2 4.17Å; L800-L802 HydrophobicContact CG-CG 4.18Å; L802-T805 HydrophobicContact CD2-CG2 4.34Å; L802-V807 HydrophobicContact CD1-CB 3.8Å; L802-V807 HydrophobicContact CD1-CG1 3.85Å; L802-V807 HydrophobicContact CD1-CG2 3.69Å; L802-L812 HydrophobicContact CD1-CD2 4.06Å; L802-V826 PolarHBondContact N-O 3.46Å; L802-V827 HydrophobicContact CD1-CG2 4.38Å; L802-V827 WeakPolarHBondContact O-CA 3.23Å; L802-Q828 PolarHBondContact O-N 3.13Å
803	T	94.3	Very high	93.1	Very high	35 Å²	35	28.6 Å²	28.6	22%	0.215	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.9	178.8	-56.6	0	0	0	0	108.7	L775 D776 H777 T805 Q828	L775-T803 PolarHBondContact O-N 3.01Å; D776-T803 CarbonylContact C-O 3.6Å; D776-T803 WeakPolarHBondContact CA-O 3.33Å; H777-T803 PolarHBondContact N-O 3.47Å; T803-T805 PolarHBondContact O-N 2.77Å; T803-T805 PolarHBondContact O-OG1 3.48Å; T803-Q828 CarbonylContact C-O 3.55Å
804	A	91.7	Very high	93.3	Very high	12 Å²	12	30.7 Å²	30.7	10%	0.099	16%	0.159	C	C	.	.	S	Bend	trans	45.8	32.2	-177	0	0	0	0	0	114	H777 Q828 D833	H777-A804 WeakPolarHBondContact CA-O 3.31Å; H777-A804 VanDerWaalsContact CE1-CB 3.42Å; H777-A804 WeakPolarHBondContact CE1-CB 3.21Å; H777-A804 WeakPolarHBondContact NE2-CB 3.39Å; A804-Q828 PolarHBondContact N-O 3.18Å; A804-D833 VanDerWaalsContact CA-OD2 3.27Å; A804-D833 WeakPolarHBondContact CA-OD2 3.12Å; A804-D833 WeakPolarHBondContact CB-OD1 3.44Å
805	T	93.1	Very high	93.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.16	C	C	.	.			trans	-119.9	102.6	-172.3	-66.2	0	0	0	0	107.2	L775 H777 V778 I781 L802 T803 V807	L775-T805 HydrophobicContact CB-CG2 4.35Å; L775-T805 PolarHBondContact O-OG1 3.11Å; H777-T805 PolarHBondContact N-OG1 3.19Å; V778-T805 HydrophobicContact CB-CG2 3.89Å; V778-T805 PolarHBondContact N-OG1 2.89Å; V778-T805 VanDerWaalsContact N-OG1 3.12Å; I781-T805 HydrophobicContact CD1-CG2 4.48Å; I781-T805 HydrophobicContact CG1-CG2 3.8Å; L802-T805 HydrophobicContact CD2-CG2 4.34Å; T803-T805 PolarHBondContact O-N 2.77Å; T803-T805 PolarHBondContact O-OG1 3.48Å; T805-V807 PolarHBondContact O-N 3.49Å
806	P	90.9	Very high	93.6	Very high	15 Å²	15	26.4 Å²	26.4	10%	0.097	14%	0.143	C	C	.	.			trans	-47	133.1	175.9	-35.5	40.7	0	0	0	112.8	E780 I781 Y834	E780-P806 WeakPolarHBondContact CA-O 3.24Å; E780-P806 HydrophobicContact CB-CB 3.89Å; E780-P806 HydrophobicContact CG-CB 3.88Å; I781-P806 PolarHBondContact N-O 3.36Å; P806-Y834 HydrophobicContact CB-CD1 3.79Å; P806-Y834 HydrophobicContact CB-CE1 3.39Å; P806-Y834 HydrophobicContact CG-CD1 3.9Å; P806-Y834 HydrophobicContact CG-CE1 3.9Å; P806-Y834 HydrophobicContact CG-CG 4.28Å
807	V	94.3	Very high	93.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-146.9	130.2	-176	62.2	0	0	0	0	113	I781 L802 T805 A811 L812 V827 Y834	I781-V807 HydrophobicContact CB-CB 4.42Å; I781-V807 HydrophobicContact CB-CG2 4.16Å; L802-V807 HydrophobicContact CD1-CB 3.8Å; L802-V807 HydrophobicContact CD1-CG1 3.85Å; L802-V807 HydrophobicContact CD1-CG2 3.69Å; T805-V807 PolarHBondContact O-N 3.49Å; V807-A811 HydrophobicContact CG2-CB 4.06Å; V807-L812 HydrophobicContact CG2-CD2 3.68Å; V807-L812 HydrophobicContact CG2-CG 3.91Å; V807-V827 HydrophobicContact CG1-CG1 3.8Å; V807-V827 HydrophobicContact CG1-CG2 4.35Å; V807-Y834 PolarHBondContact N-OH 2.92Å
808	T	93.1	Very high	93.4	Very high	29 Å²	29	32.2 Å²	32.2	18%	0.178	17%	0.174	C	C	.	.			trans	-78	145.3	178.6	66.1	0	0	0	0	111.8	E780 I781 T782 K810 A811 L812	E780-T808 WeakPolarHBondContact OE1-CG2 3.33Å; I781-T808 PolarHBondContact O-N 2.96Å; I781-T808 VanDerWaalsContact O-N 3.09Å; I781-T808 PolarHBondContact O-OG1 3.18Å; T782-T808 HydrophobicContact CG2-CG2 4.5Å; T808-K810 PolarHBondContact O-N 3.31Å; T808-K810 VanDerWaalsContact O-N 3.14Å; T808-A811 WeakPolarHBondContact O-CB 3.32Å; T808-A811 PolarHBondContact O-N 3.47Å; T808-A811 WeakPolarHBondContact OG1-CB 3.38Å; T808-A811 PolarHBondContact OG1-N 3.3Å; T808-A811 VanDerWaalsContact OG1-N 3.16Å; T808-L812 PolarHBondContact O-N 3.45Å
809	P	92.3	Very high	93.2	Very high	34 Å²	34	29.9 Å²	29.9	22%	0.221	16%	0.163	C	C	.	.	H	α-helix	trans	-56.1	-30.7	172.9	-26.3	33	0	0	0	113.7	L813 K853 L854 L857	P809-L813 WeakPolarHBondContact O-CG 3.11Å; P809-L813 PolarHBondContact O-N 2.98Å; P809-K853 HydrophobicContact CG-CB 3.94Å; P809-L854 HydrophobicContact CB-CD2 4.4Å; P809-L854 HydrophobicContact CG-CD2 3.92Å; P809-L854 HydrophobicContact CG-CG 4.26Å; P809-L857 HydrophobicContact CB-CD1 3.94Å; P809-L857 HydrophobicContact CB-CD2 4.41Å; P809-L857 HydrophobicContact CB-CG 4.28Å
810	K	93.1	Very high	92.7	Very high	134 Å²	134	38.2 Å²	38.2	58%	0.583	19%	0.192	S	C	*	.	H	α-helix	trans	-71	-35.4	177.4	-60	-168.4	-166.2	173	0	112.7	Q783 T808 L813 H814	Q783-K810 HydrophobicContact CB-CB 3.89Å; Q783-K810 HydrophobicContact CG-CB 4.28Å; T808-K810 PolarHBondContact O-N 3.31Å; T808-K810 VanDerWaalsContact O-N 3.14Å; K810-L813 PolarHBondContact O-N 3.43Å; K810-H814 PolarHBondContact O-N 3.41Å
811	A	95.1	Very high	92.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-46.6	173.4	0	0	0	0	0	111.9	I781 T782 A786 V807 T808 L813 H814 F815	I781-A811 HydrophobicContact CG2-CB 4.16Å; I781-A811 WeakPolarHBondContact O-CB 3.19Å; T782-A811 WeakPolarHBondContact O-CB 3.46Å; A786-A811 HydrophobicContact CB-CB 3.87Å; V807-A811 HydrophobicContact CG2-CB 4.06Å; T808-A811 WeakPolarHBondContact O-CB 3.32Å; T808-A811 PolarHBondContact O-N 3.47Å; T808-A811 WeakPolarHBondContact OG1-CB 3.38Å; T808-A811 PolarHBondContact OG1-N 3.3Å; T808-A811 VanDerWaalsContact OG1-N 3.16Å; A811-L813 VanDerWaalsContact C-N 3.34Å; A811-L813 PolarHBondContact O-N 2.87Å; A811-H814 WeakPolarHBondContact O-CA 3.4Å; A811-H814 WeakPolarHBondContact O-CB 3.48Å; A811-H814 PolarHBondContact O-N 3.41Å; A811-F815 WeakPolarHBondContact O-CD2 3.43Å; A811-F815 PolarHBondContact O-N 3.29Å
812	L	93.8	Very high	92.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-41.9	178.5	-60.7	-176	0	0	0	112	L802 V807 T808 H814 F815 N816 I825 V827 L854 L857 F863 L867	L802-L812 HydrophobicContact CD1-CD2 4.06Å; V807-L812 HydrophobicContact CG2-CD2 3.68Å; V807-L812 HydrophobicContact CG2-CG 3.91Å; T808-L812 PolarHBondContact O-N 3.45Å; L812-H814 VanDerWaalsContact C-N 3.29Å; L812-H814 PolarHBondContact O-N 2.93Å; L812-F815 PolarHBondContact O-N 3.25Å; L812-N816 PolarHBondContact O-N 2.79Å; L812-N816 VanDerWaalsContact O-N 3.09Å; L812-I825 HydrophobicContact CD2-CG2 4.08Å; L812-V827 HydrophobicContact CD1-CG2 4.17Å; L812-V827 HydrophobicContact CD2-CG2 4.47Å; L812-L854 HydrophobicContact CD1-CD2 3.74Å; L812-L857 HydrophobicContact CB-CD1 4.04Å; L812-L857 HydrophobicContact CD1-CD1 4.03Å; L812-F863 HydrophobicContact CB-CE1 4.23Å; L812-F863 WeakPolarHBondContact O-CZ 3.15Å; L812-L867 HydrophobicContact CD1-CD1 4.18Å; L812-L867 HydrophobicContact CD1-CD2 4.36Å
813	L	91.3	Very high	92.1	Very high	49 Å²	49	48.5 Å²	48.5	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-38.1	171.9	-70.5	170.7	0	0	0	112.2	P809 K810 A811 S817 L857 F863	P809-L813 WeakPolarHBondContact O-CG 3.11Å; P809-L813 PolarHBondContact O-N 2.98Å; K810-L813 PolarHBondContact O-N 3.43Å; A811-L813 VanDerWaalsContact C-N 3.34Å; A811-L813 PolarHBondContact O-N 2.87Å; L813-S817 WeakPolarHBondContact O-CB 3.32Å; L813-S817 PolarHBondContact O-N 3.38Å; L813-S817 VanDerWaalsContact O-N 3.15Å; L813-L857 HydrophobicContact CD1-CD2 4.08Å; L813-L857 HydrophobicContact CD2-CD2 4.06Å; L813-L857 HydrophobicContact CG-CD2 4.02Å; L813-F863 HydrophobicContact CD2-CD2 4.45Å; L813-F863 HydrophobicContact CD2-CE2 3.74Å; L813-F863 HydrophobicContact CD2-CZ 3.96Å
814	H	93	Very high	92.1	Very high	48 Å²	48	47.5 Å²	47.5	22%	0.222	23%	0.234	C	C	.	.	H	α-helix	trans	-68.4	-47	176.9	-161.4	87.6	0	0	0	112.2	A786 A787 K810 A811 L812 N816 S817 I818	A786-H814 HydrophobicContact CB-CB 4.24Å; A787-H814 WeakPolarHBondContact CA-NE2 3.38Å; K810-H814 PolarHBondContact O-N 3.41Å; A811-H814 WeakPolarHBondContact O-CA 3.4Å; A811-H814 WeakPolarHBondContact O-CB 3.48Å; A811-H814 PolarHBondContact O-N 3.41Å; L812-H814 VanDerWaalsContact C-N 3.29Å; L812-H814 PolarHBondContact O-N 2.93Å; H814-N816 VanDerWaalsContact C-N 3.35Å; H814-N816 PolarHBondContact O-N 3.46Å; H814-S817 WeakPolarHBondContact O-CB 3.35Å; H814-S817 PolarHBondContact O-N 3.5Å; H814-I818 PolarHBondContact O-N 3.46Å; H814-I818 VanDerWaalsContact O-N 3.12Å
815	F	92.9	Very high	92.3	Very high	7 Å²	7	46.9 Å²	46.9	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-55.5	-47.7	175.6	-78.3	-68.8	0	0	0	111.8	I781 A786 C790 L794 L800 A811 L812 S817 I818 C819 L822	I781-F815 HydrophobicContact CG2-CE2 3.81Å; I781-F815 HydrophobicContact CG2-CZ 4.21Å; A786-F815 HydrophobicContact CB-CD2 4Å; A786-F815 HydrophobicContact CB-CE2 3.55Å; A786-F815 HydrophobicContact CB-CZ 3.86Å; C790-F815 WeakPolarHBondContact SG-CD1 3.21Å; C790-F815 VanDerWaalsContact SG-CE1 3.55Å; L794-F815 HydrophobicContact CD1-CE1 4.27Å; L800-F815 HydrophobicContact CD2-CD1 4.25Å; L800-F815 HydrophobicContact CD2-CD2 3.88Å; L800-F815 HydrophobicContact CD2-CE1 4.47Å; L800-F815 HydrophobicContact CD2-CE2 4.12Å; L800-F815 HydrophobicContact CD2-CG 3.96Å; L800-F815 HydrophobicContact CD2-CZ 4.42Å; A811-F815 WeakPolarHBondContact O-CD2 3.43Å; A811-F815 PolarHBondContact O-N 3.29Å; L812-F815 PolarHBondContact O-N 3.25Å; F815-S817 VanDerWaalsContact C-N 3.26Å; F815-S817 PolarHBondContact O-N 3.15Å; F815-I818 PolarHBondContact O-N 2.78Å; F815-C819 WeakPolarHBondContact O-CA 3.44Å; F815-C819 WeakPolarHBondContact O-CB 3.41Å; F815-C819 PolarHBondContact O-N 3.02Å; F815-C819 PolarHBondContact O-SG 2.91Å; F815-L822 HydrophobicContact CB-CD2 4.48Å
816	N	90.5	Very high	92.3	Very high	48 Å²	48	48.1 Å²	48.1	26%	0.257	24%	0.237	S	C	.	.	H	α-helix	trans	-66.2	-25	178.2	-171.7	100.7	0	0	0	113.4	L812 H814 F863	L812-N816 PolarHBondContact O-N 2.79Å; L812-N816 VanDerWaalsContact O-N 3.09Å; H814-N816 VanDerWaalsContact C-N 3.35Å; H814-N816 PolarHBondContact O-N 3.46Å; N816-F863 HydrophobicContact CB-CE1 4.31Å; N816-F863 HydrophobicContact CB-CE2 3.59Å; N816-F863 HydrophobicContact CB-CZ 3.34Å; N816-F863 VanDerWaalsContact CG-CE2 3.47Å
817	S	90	Very high	92.6	Very high	81 Å²	81	47.4 Å²	47.4	57%	0.566	23%	0.232	S	C	*	.	H	α-helix	trans	-75	-41.3	177.1	-169.6	0	0	0	0	112.2	L813 H814 F815	L813-S817 WeakPolarHBondContact O-CB 3.32Å; L813-S817 PolarHBondContact O-N 3.38Å; L813-S817 VanDerWaalsContact O-N 3.15Å; H814-S817 WeakPolarHBondContact O-CB 3.35Å; H814-S817 PolarHBondContact O-N 3.5Å; F815-S817 VanDerWaalsContact C-N 3.26Å; F815-S817 PolarHBondContact O-N 3.15Å
818	I	90.9	Very high	92.5	Very high	62 Å²	62	49.6 Å²	49.6	32%	0.318	24%	0.242	S	C	.	.	H	α-helix	trans	-91	-41.9	-176	-51.4	-56.3	0	0	0	112.5	C790 H814 F815 R820	C790-I818 HydrophobicContact CB-CB 4.03Å; C790-I818 HydrophobicContact CB-CG1 4.08Å; C790-I818 HydrophobicContact CB-CG2 3.98Å; H814-I818 PolarHBondContact O-N 3.46Å; H814-I818 VanDerWaalsContact O-N 3.12Å; F815-I818 PolarHBondContact O-N 2.78Å; I818-R820 PolarHBondContact O-N 2.77Å
819	C	90.6	Very high	92.5	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.007	23%	0.234	C	C	.	.			trans	-84.1	74.6	-177.2	-55	0	0	0	0	110.5	L797 F815 N821 L822	L797-C819 HydrophobicContact CB-CB 4.38Å; F815-C819 WeakPolarHBondContact O-CA 3.44Å; F815-C819 WeakPolarHBondContact O-CB 3.41Å; F815-C819 PolarHBondContact O-N 3.02Å; F815-C819 PolarHBondContact O-SG 2.91Å; C819-N821 PolarHBondContact O-N 3.08Å; C819-L822 HydrophobicContact CB-CB 4.16Å; C819-L822 HydrophobicContact CB-CD2 4.41Å; C819-L822 WeakPolarHBondContact O-CB 3.45Å; C819-L822 PolarHBondContact O-N 3.26Å
820	R	86.8	Confident	92.3	Very high	226 Å²	226	47 Å²	47	85%	0.853	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.2	-175.4	-63.4	-177.2	-178.6	178.5	-0.5	115.1	I818	I818-R820 PolarHBondContact O-N 2.77Å
821	N	90.3	Very high	91.9	Very high	90 Å²	90	42.1 Å²	42.1	48%	0.481	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	1.9	179.6	-67.7	-6.3	0	0	0	113.7	L797 E798 C819 K823	L797-N821 CarbonylContact O-C 3.5Å; L797-N821 VanDerWaalsContact O-C 3.29Å; E798-N821 WeakPolarHBondContact CA-O 3.4Å; E798-N821 HydrophobicContact CG-CB 4.41Å; C819-N821 PolarHBondContact O-N 3.08Å; N821-K823 PolarHBondContact O-N 3.34Å
822	L	92.4	Very high	91.4	Very high	12 Å²	12	45.3 Å²	45.3	6%	0.063	23%	0.234	C	C	.	.			trans	-67.9	113.9	-172.1	-168.4	61.5	0	0	0	111.3	L797 L800 F815 C819 I825	L797-L822 HydrophobicContact CD2-CD1 4.31Å; L797-L822 HydrophobicContact CG-CD1 4.36Å; L797-L822 WeakPolarHBondContact O-CA 3.23Å; L797-L822 PolarHBondContact O-N 3.19Å; L800-L822 HydrophobicContact CB-CD1 4.28Å; F815-L822 HydrophobicContact CB-CD2 4.48Å; C819-L822 HydrophobicContact CB-CB 4.16Å; C819-L822 HydrophobicContact CB-CD2 4.41Å; C819-L822 WeakPolarHBondContact O-CB 3.45Å; C819-L822 PolarHBondContact O-N 3.26Å; L822-I825 HydrophobicContact CD1-CG1 4.34Å; L822-I825 HydrophobicContact CD2-CD1 3.72Å; L822-I825 HydrophobicContact CD2-CG1 3.66Å; L822-I825 HydrophobicContact CG-CG1 4.05Å
823	K	92.9	Very high	90.8	Very high	136 Å²	136	47.8 Å²	47.8	59%	0.591	25%	0.247	S	C	*	.			trans	-99.5	-25.2	-178.2	-65.9	164.6	-167.4	173.5	0	112.3	E798 N821	E798-K823 HydrophobicContact CB-CD 4.33Å; E798-K823 VanDerWaalsContact CD-NZ 3.33Å; E798-K823 PolarHBondContact O-N 3.5Å; E798-K823 IonicContact OE1-NZ 3.7Å; E798-K823 WeakPolarHBondContact OE2-CE 3.48Å; E798-K823 IonicContact OE2-NZ 2.7Å; E798-K823 PolarHBondContact OE2-NZ 3.1Å; N821-K823 PolarHBondContact O-N 3.34Å
824	S	94.8	Very high	90.2	Very high	13 Å²	13	47.6 Å²	47.6	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	138.9	179.4	-167.2	0	0	0	0	112.1	E798 M799 L800 I866 H868	E798-S824 PolarHBondContact O-N 3.37Å; M799-S824 WeakPolarHBondContact CA-O 3.32Å; L800-S824 PolarHBondContact N-O 2.86Å; S824-I866 CarbonylContact C-O 3.29Å; S824-I866 WeakPolarHBondContact CA-O 3.47Å; S824-H868 PolarHBondContact OG-CD2 2.97Å; S824-H868 VanDerWaalsContact OG-CD2 3.28Å; S824-H868 PolarHBondContact OG-NE2 3Å
825	I	95.4	Very high	89.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.7	164.6	-57.6	169.5	0	0	0	106.5	L800 L812 L822 V827 F863 I866 L867 H868	L800-I825 CarbonylContact O-C 3.2Å; L800-I825 WeakPolarHBondContact O-CA 3.47Å; L812-I825 HydrophobicContact CD2-CG2 4.08Å; L822-I825 HydrophobicContact CD1-CG1 4.34Å; L822-I825 HydrophobicContact CD2-CD1 3.72Å; L822-I825 HydrophobicContact CD2-CG1 3.66Å; L822-I825 HydrophobicContact CG-CG1 4.05Å; I825-V827 HydrophobicContact CG2-CG2 4.01Å; I825-F863 HydrophobicContact CD1-CE1 4.06Å; I825-I866 HydrophobicContact CD1-CG2 4.25Å; I825-I866 HydrophobicContact CG1-CG2 3.96Å; I825-I866 PolarHBondContact N-O 2.85Å; I825-L867 HydrophobicContact CB-CD1 3.96Å; I825-L867 HydrophobicContact CG2-CD1 3.74Å; I825-H868 PolarHBondContact O-N 3.44Å
826	V	95.1	Very high	89	Confident	26 Å²	26	57.4 Å²	57.4	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.7	171.9	-176.9	0	0	0	0	108.4	L800 V801 L802 H868	L800-V826 PolarHBondContact O-N 3.23Å; V801-V826 CarbonylContact C-O 3.59Å; V801-V826 WeakPolarHBondContact CA-O 3.39Å; V801-V826 HydrophobicContact CG1-CB 4.24Å; V801-V826 HydrophobicContact CG1-CG1 4.46Å; V801-V826 HydrophobicContact CG2-CB 4.29Å; L802-V826 PolarHBondContact N-O 3.46Å; V826-H868 WeakPolarHBondContact CA-O 3.41Å; V826-H868 HydrophobicContact CG2-CB 4.48Å
827	V	95.3	Very high	88.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.5	173.1	-175.7	0	0	0	0	107.6	L802 V807 L812 I825 I829 L867 H868 I869 K870	L802-V827 HydrophobicContact CD1-CG2 4.38Å; L802-V827 WeakPolarHBondContact O-CA 3.23Å; V807-V827 HydrophobicContact CG1-CG1 3.8Å; V807-V827 HydrophobicContact CG1-CG2 4.35Å; L812-V827 HydrophobicContact CD1-CG2 4.17Å; L812-V827 HydrophobicContact CD2-CG2 4.47Å; I825-V827 HydrophobicContact CG2-CG2 4.01Å; V827-I829 HydrophobicContact CG1-CD1 4.34Å; V827-I829 HydrophobicContact CG1-CG1 4.27Å; V827-I829 HydrophobicContact CG1-CG2 3.95Å; V827-L867 HydrophobicContact CG2-CD1 3.96Å; V827-H868 PolarHBondContact N-O 2.72Å; V827-I869 CarbonylContact O-C 3.44Å; V827-I869 WeakPolarHBondContact O-CA 3.43Å; V827-K870 PolarHBondContact O-N 3.28Å
828	Q	94.1	Very high	88	Confident	45 Å²	45	60 Å²	60	21%	0.21	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	111.3	176.7	179.5	166.4	-27.7	0	0	107.7	L802 T803 A804 K870 E872	L802-Q828 PolarHBondContact O-N 3.13Å; T803-Q828 CarbonylContact C-O 3.55Å; A804-Q828 PolarHBondContact N-O 3.18Å; Q828-K870 WeakPolarHBondContact CA-O 3.45Å; Q828-K870 HydrophobicContact CB-CB 4.26Å; Q828-K870 HydrophobicContact CB-CD 4.43Å; Q828-K870 HydrophobicContact CG-CB 4.22Å; Q828-K870 HydrophobicContact CG-CD 4.32Å; Q828-E872 PolarHBondContact NE2-OE1 3.17Å
829	I	91.1	Very high	87.6	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.9	-172.6	50.8	171	0	0	0	111.6	V827 D833 Y834 F847 V851 L854 K870 V871 E872	V827-I829 HydrophobicContact CG1-CD1 4.34Å; V827-I829 HydrophobicContact CG1-CG1 4.27Å; V827-I829 HydrophobicContact CG1-CG2 3.95Å; I829-D833 WeakPolarHBondContact CA-OD2 3.2Å; I829-Y834 HydrophobicContact CB-CE2 4.06Å; I829-Y834 HydrophobicContact CD1-CE2 4.1Å; I829-Y834 HydrophobicContact CG2-CE2 4.1Å; I829-F847 HydrophobicContact CD1-CE2 4.47Å; I829-V851 HydrophobicContact CD1-CG2 4.41Å; I829-L854 HydrophobicContact CD1-CD1 3.73Å; I829-K870 PolarHBondContact N-O 2.88Å; I829-K870 VanDerWaalsContact N-O 3.13Å; I829-V871 CarbonylContact O-C 3.59Å; I829-V871 VanDerWaalsContact O-CA 3.26Å; I829-V871 WeakPolarHBondContact O-CA 3.49Å; I829-E872 PolarHBondContact O-N 2.67Å
830	G	88.2	Confident	87.5	Confident	7 Å²	7	63.4 Å²	63.4	7%	0.072	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	165.9	167.8	0	0	0	0	0	111.6	A832 D833 F847 E872	G830-A832 PolarHBondContact O-N 2.65Å; G830-D833 PolarHBondContact N-OD2 2.82Å; G830-D833 WeakPolarHBondContact O-CB 3.27Å; G830-D833 PolarHBondContact O-N 3.39Å; G830-D833 VanDerWaalsContact O-N 3.13Å; G830-F847 VanDerWaalsContact C-CE2 3.44Å; G830-F847 VanDerWaalsContact C-CZ 3.45Å; G830-F847 WeakPolarHBondContact O-CE2 3.44Å; G830-E872 WeakPolarHBondContact CA-O 3.4Å
831	I	86.1	Confident	87.4	Confident	32 Å²	32	57.3 Å²	57.3	16%	0.164	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-61.8	-31.1	-178.3	-176	167.2	0	0	0	113.1	D833 Y834 F835 P838 A843 Q844 F847	I831-D833 PolarHBondContact O-N 3.15Å; I831-Y834 PolarHBondContact O-N 3.02Å; I831-F835 HydrophobicContact CG1-CD2 4.05Å; I831-F835 PolarHBondContact O-N 3.01Å; I831-F835 VanDerWaalsContact O-N 3.17Å; I831-P838 HydrophobicContact CB-CB 4.27Å; I831-P838 HydrophobicContact CD1-CB 4.25Å; I831-P838 WeakPolarHBondContact CD1-O 3.15Å; I831-P838 HydrophobicContact CG1-CB 3.86Å; I831-P838 HydrophobicContact CG2-CB 3.65Å; I831-A843 HydrophobicContact CD1-CB 4.44Å; I831-Q844 HydrophobicContact CD1-CB 4.17Å; I831-Q844 HydrophobicContact CD1-CG 3.48Å; I831-Q844 VanDerWaalsContact CD1-CG 3.48Å; I831-F847 HydrophobicContact CB-CD1 3.96Å; I831-F847 HydrophobicContact CB-CD2 4.16Å; I831-F847 HydrophobicContact CB-CE1 4.15Å; I831-F847 HydrophobicContact CB-CE2 4.35Å; I831-F847 HydrophobicContact CB-CG 3.96Å; I831-F847 HydrophobicContact CB-CZ 4.34Å; I831-F847 HydrophobicContact CD1-CB 4.16Å; I831-F847 HydrophobicContact CD1-CG 4.44Å; I831-F847 HydrophobicContact CG1-CB 4.09Å; I831-F847 HydrophobicContact CG1-CD1 4.41Å; I831-F847 HydrophobicContact CG1-CD2 4.42Å; I831-F847 HydrophobicContact CG1-CG 4.07Å
832	A	84.2	Confident	87.3	Confident	68 Å²	68	60.2 Å²	60.2	56%	0.562	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-68.6	-16.5	177.8	0	0	0	0	0	114.1	G830 Y834 P838	G830-A832 PolarHBondContact O-N 2.65Å; A832-Y834 VanDerWaalsContact C-N 3.33Å; A832-P838 HydrophobicContact CB-CG 4.43Å
833	D	81.7	Confident	87	Confident	51 Å²	51	59.8 Å²	59.8	27%	0.273	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-76.8	-25.1	178.8	-51.3	-25.9	0	0	0	112.1	A804 I829 G830 I831	A804-D833 VanDerWaalsContact CA-OD2 3.27Å; A804-D833 WeakPolarHBondContact CA-OD2 3.12Å; A804-D833 WeakPolarHBondContact CB-OD1 3.44Å; I829-D833 WeakPolarHBondContact CA-OD2 3.2Å; G830-D833 PolarHBondContact N-OD2 2.82Å; G830-D833 WeakPolarHBondContact O-CB 3.27Å; G830-D833 PolarHBondContact O-N 3.39Å; G830-D833 VanDerWaalsContact O-N 3.13Å; I831-D833 PolarHBondContact O-N 3.15Å
834	Y	77.6	Confident	86.7	Confident	46 Å²	46	57.7 Å²	57.7	18%	0.18	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-33	-178	-68.4	-92.3	0	0	0	112.4	P806 V807 I829 I831 A832 F847 M850	P806-Y834 HydrophobicContact CB-CD1 3.79Å; P806-Y834 HydrophobicContact CB-CE1 3.39Å; P806-Y834 HydrophobicContact CG-CD1 3.9Å; P806-Y834 HydrophobicContact CG-CE1 3.9Å; P806-Y834 HydrophobicContact CG-CG 4.28Å; V807-Y834 PolarHBondContact N-OH 2.92Å; I829-Y834 HydrophobicContact CB-CE2 4.06Å; I829-Y834 HydrophobicContact CD1-CE2 4.1Å; I829-Y834 HydrophobicContact CG2-CE2 4.1Å; I831-Y834 PolarHBondContact O-N 3.02Å; A832-Y834 VanDerWaalsContact C-N 3.33Å; Y834-F847 AromaticContact CD2-CD2 3.85Å; Y834-F847 HydrophobicContact CD2-CD2 3.85Å; Y834-F847 AromaticContact CD2-CE2 3.74Å; Y834-F847 HydrophobicContact CD2-CE2 3.74Å; Y834-F847 HydrophobicContact CE2-CD2 4.2Å; Y834-F847 AromaticContact CE2-CE2 3.82Å; Y834-F847 HydrophobicContact CE2-CE2 3.82Å; Y834-M850 HydrophobicContact CD1-CE 3.27Å; Y834-M850 HydrophobicContact CD1-SD 3.98Å; Y834-M850 HydrophobicContact CD2-CE 4.16Å; Y834-M850 HydrophobicContact CE1-CE 3.25Å; Y834-M850 HydrophobicContact CE1-SD 3.36Å; Y834-M850 WeakPolarHBondContact CE1-SD 3.26Å; Y834-M850 HydrophobicContact CE2-CE 4.16Å; Y834-M850 HydrophobicContact CG-CE 3.73Å
835	F	82.6	Confident	86.5	Confident	51 Å²	51	64.5 Å²	64.5	22%	0.224	34%	0.338	C	S	.	.			trans	-128.9	130	-169.9	-57.3	-79.8	0	0	0	111.9	I831 E837 A843 L846 F847	I831-F835 HydrophobicContact CG1-CD2 4.05Å; I831-F835 PolarHBondContact O-N 3.01Å; I831-F835 VanDerWaalsContact O-N 3.17Å; F835-E837 PolarHBondContact O-N 3.41Å; F835-A843 HydrophobicContact CB-CB 3.79Å; F835-A843 HydrophobicContact CD1-CB 3.69Å; F835-A843 HydrophobicContact CD2-CB 3.69Å; F835-A843 HydrophobicContact CE1-CB 4.17Å; F835-A843 HydrophobicContact CE2-CB 4.18Å; F835-A843 WeakPolarHBondContact CE2-O 3.23Å; F835-A843 HydrophobicContact CG-CB 3.43Å; F835-A843 VanDerWaalsContact CG-CB 3.43Å; F835-A843 HydrophobicContact CZ-CB 4.4Å; F835-L846 HydrophobicContact CE1-CB 4.49Å; F835-L846 HydrophobicContact CE1-CD1 4.24Å; F835-L846 HydrophobicContact CE2-CB 4.47Å; F835-L846 HydrophobicContact CZ-CB 3.74Å; F835-L846 HydrophobicContact CZ-CD1 4.28Å; F835-F847 HydrophobicContact CE2-CB 4.11Å
836	K	78.2	Confident	86.1	Confident	210 Å²	210	69.1 Å²	69.1	91%	0.913	36%	0.363	S	S	*	.	S	Bend	trans	-62.2	-28.4	173.6	-63.7	179.9	-178.1	175.7	0	112.7	P838	K836-P838 WeakPolarHBondContact O-CD 3.28Å
837	E	80.6	Confident	85.8	Confident	139 Å²	139	68.2 Å²	68.2	65%	0.65	36%	0.357	S	S	*	.			trans	-121.3	75.7	-178.8	-70.6	175.9	-137.6	0	0	110.3	F835 S839 S840	F835-E837 PolarHBondContact O-N 3.41Å; E837-S839 PolarHBondContact O-N 3Å; E837-S839 VanDerWaalsContact O-N 3.14Å; E837-S840 PolarHBondContact O-N 3.21Å; E837-S840 VanDerWaalsContact O-N 3.09Å; E837-S840 PolarHBondContact O-OG 2.65Å
838	P	78.9	Confident	85.6	Confident	45 Å²	45	73.1 Å²	73.1	29%	0.292	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.1	-177.5	28.3	-36.2	0	0	0	113.9	I831 A832 K836 S840 Q844	I831-P838 HydrophobicContact CB-CB 4.27Å; I831-P838 HydrophobicContact CD1-CB 4.25Å; I831-P838 WeakPolarHBondContact CD1-O 3.15Å; I831-P838 HydrophobicContact CG1-CB 3.86Å; I831-P838 HydrophobicContact CG2-CB 3.65Å; A832-P838 HydrophobicContact CB-CG 4.43Å; K836-P838 WeakPolarHBondContact O-CD 3.28Å; P838-S840 VanDerWaalsContact C-N 3.33Å; P838-Q844 PolarHBondContact O-NE2 3.2Å; P838-Q844 VanDerWaalsContact O-NE2 3.12Å
839	S	82.3	Confident	85.4	Confident	97 Å²	97	74.4 Å²	74.4	68%	0.678	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-10.1	172.9	48.2	0	0	0	0	114	E837	E837-S839 PolarHBondContact O-N 3Å; E837-S839 VanDerWaalsContact O-N 3.14Å
840	S	88.9	Confident	85.3	Confident	36 Å²	36	76 Å²	76	25%	0.252	40%	0.396	S	S	.	.	S	Bend	trans	-75.9	136.1	179.5	62.4	0	0	0	0	111.5	E837 P838 E842 A843 Q844	E837-S840 PolarHBondContact O-N 3.21Å; E837-S840 VanDerWaalsContact O-N 3.09Å; E837-S840 PolarHBondContact O-OG 2.65Å; P838-S840 VanDerWaalsContact C-N 3.33Å; S840-E842 PolarHBondContact O-N 2.83Å; S840-A843 PolarHBondContact O-N 2.76Å; S840-A843 WeakPolarHBondContact OG-CB 3.3Å; S840-Q844 WeakPolarHBondContact O-CG 3.32Å; S840-Q844 PolarHBondContact O-N 2.89Å; S840-Q844 VanDerWaalsContact O-N 3.09Å
841	P	85.8	Confident	85.4	Confident	98 Å²	98	75.8 Å²	75.8	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-67.4	-26.6	-176	27	-34.8	0	0	0	112.4	K845	P841-K845 WeakPolarHBondContact O-CB 3.38Å; P841-K845 PolarHBondContact O-N 2.88Å
842	E	87.9	Confident	85.6	Confident	151 Å²	151	78.2 Å²	78.2	71%	0.706	41%	0.409	S	S	*	.	H	α-helix	trans	-69.7	-44.5	174.6	-60.6	-171.5	168	0	0	111.7	S840 Q844 K845 L846	S840-E842 PolarHBondContact O-N 2.83Å; E842-Q844 VanDerWaalsContact C-N 3.33Å; E842-Q844 PolarHBondContact O-N 3.29Å; E842-K845 PolarHBondContact O-N 3.01Å; E842-L846 WeakPolarHBondContact O-CB 3.48Å; E842-L846 VanDerWaalsContact O-CG 3.27Å; E842-L846 WeakPolarHBondContact O-CG 3.4Å; E842-L846 PolarHBondContact O-N 3.1Å
843	A	85.9	Confident	85.9	Confident	3 Å²	3	80 Å²	80	3%	0.025	41%	0.405	C	S	.	.	H	α-helix	trans	-60.1	-43.2	173.1	0	0	0	0	0	111.7	I831 F835 S840 L846 F847	I831-A843 HydrophobicContact CD1-CB 4.44Å; F835-A843 HydrophobicContact CB-CB 3.79Å; F835-A843 HydrophobicContact CD1-CB 3.69Å; F835-A843 HydrophobicContact CD2-CB 3.69Å; F835-A843 HydrophobicContact CE1-CB 4.17Å; F835-A843 HydrophobicContact CE2-CB 4.18Å; F835-A843 WeakPolarHBondContact CE2-O 3.23Å; F835-A843 HydrophobicContact CG-CB 3.43Å; F835-A843 VanDerWaalsContact CG-CB 3.43Å; F835-A843 HydrophobicContact CZ-CB 4.4Å; S840-A843 PolarHBondContact O-N 2.76Å; S840-A843 WeakPolarHBondContact OG-CB 3.3Å; A843-L846 PolarHBondContact O-N 2.76Å; A843-F847 WeakPolarHBondContact O-CB 3.43Å; A843-F847 PolarHBondContact O-N 3.19Å
844	Q	87.2	Confident	86.3	Confident	93 Å²	93	77.6 Å²	77.6	44%	0.435	39%	0.392	S	S	.	.	H	α-helix	trans	-60.8	-47.7	177	-71.1	170	10.5	0	0	111.5	I831 P838 S840 E842 L846 F847 E848	I831-Q844 HydrophobicContact CD1-CB 4.17Å; I831-Q844 HydrophobicContact CD1-CG 3.48Å; I831-Q844 VanDerWaalsContact CD1-CG 3.48Å; P838-Q844 PolarHBondContact O-NE2 3.2Å; P838-Q844 VanDerWaalsContact O-NE2 3.12Å; S840-Q844 WeakPolarHBondContact O-CG 3.32Å; S840-Q844 PolarHBondContact O-N 2.89Å; S840-Q844 VanDerWaalsContact O-N 3.09Å; E842-Q844 VanDerWaalsContact C-N 3.33Å; E842-Q844 PolarHBondContact O-N 3.29Å; Q844-L846 PolarHBondContact O-N 2.83Å; Q844-F847 PolarHBondContact O-N 3.42Å; Q844-E848 PolarHBondContact O-N 2.79Å
845	K	88.9	Confident	86.9	Confident	155 Å²	155	80 Å²	80	67%	0.674	41%	0.405	S	S	*	.	H	α-helix	trans	-61.2	-46.1	176.7	-173	177.3	-179.7	-179.2	0	112.1	P841 E842 F847 E848 D849	P841-K845 WeakPolarHBondContact O-CB 3.38Å; P841-K845 PolarHBondContact O-N 2.88Å; E842-K845 PolarHBondContact O-N 3.01Å; K845-F847 VanDerWaalsContact C-N 3.35Å; K845-E848 PolarHBondContact O-N 3.42Å; K845-D849 WeakPolarHBondContact O-CB 3.38Å; K845-D849 PolarHBondContact O-N 2.88Å
846	L	87.2	Confident	87.3	Confident	97 Å²	97	80 Å²	80	51%	0.508	41%	0.414	S	S	.	.	H	α-helix	trans	-66.5	-35	178.9	-70.6	171	0	0	0	112.6	F835 E842 A843 Q844 M850	F835-L846 HydrophobicContact CE1-CB 4.49Å; F835-L846 HydrophobicContact CE1-CD1 4.24Å; F835-L846 HydrophobicContact CE2-CB 4.47Å; F835-L846 HydrophobicContact CZ-CB 3.74Å; F835-L846 HydrophobicContact CZ-CD1 4.28Å; E842-L846 WeakPolarHBondContact O-CB 3.48Å; E842-L846 VanDerWaalsContact O-CG 3.27Å; E842-L846 WeakPolarHBondContact O-CG 3.4Å; E842-L846 PolarHBondContact O-N 3.1Å; A843-L846 PolarHBondContact O-N 2.76Å; Q844-L846 PolarHBondContact O-N 2.83Å; L846-M850 VanDerWaalsContact O-CB 3.31Å; L846-M850 WeakPolarHBondContact O-CB 3.26Å; L846-M850 PolarHBondContact O-N 3.1Å; L846-M850 VanDerWaalsContact O-N 3.12Å
847	F	89.6	Confident	87.7	Confident	8 Å²	8	70.5 Å²	70.5	4%	0.035	37%	0.373	C	S	.	.	H	α-helix	trans	-67.1	-48.4	174.5	-174.7	-106.2	0	0	0	111.5	I829 G830 I831 Y834 F835 A843 Q844 K845 D849 M850 V851 V871	I829-F847 HydrophobicContact CD1-CE2 4.47Å; G830-F847 VanDerWaalsContact C-CE2 3.44Å; G830-F847 VanDerWaalsContact C-CZ 3.45Å; G830-F847 WeakPolarHBondContact O-CE2 3.44Å; I831-F847 HydrophobicContact CB-CD1 3.96Å; I831-F847 HydrophobicContact CB-CD2 4.16Å; I831-F847 HydrophobicContact CB-CE1 4.15Å; I831-F847 HydrophobicContact CB-CE2 4.35Å; I831-F847 HydrophobicContact CB-CG 3.96Å; I831-F847 HydrophobicContact CB-CZ 4.34Å; I831-F847 HydrophobicContact CD1-CB 4.16Å; I831-F847 HydrophobicContact CD1-CG 4.44Å; I831-F847 HydrophobicContact CG1-CB 4.09Å; I831-F847 HydrophobicContact CG1-CD1 4.41Å; I831-F847 HydrophobicContact CG1-CD2 4.42Å; I831-F847 HydrophobicContact CG1-CG 4.07Å; Y834-F847 AromaticContact CD2-CD2 3.85Å; Y834-F847 HydrophobicContact CD2-CD2 3.85Å; Y834-F847 AromaticContact CD2-CE2 3.74Å; Y834-F847 HydrophobicContact CD2-CE2 3.74Å; Y834-F847 HydrophobicContact CE2-CD2 4.2Å; Y834-F847 AromaticContact CE2-CE2 3.82Å; Y834-F847 HydrophobicContact CE2-CE2 3.82Å; F835-F847 HydrophobicContact CE2-CB 4.11Å; A843-F847 WeakPolarHBondContact O-CB 3.43Å; A843-F847 PolarHBondContact O-N 3.19Å; Q844-F847 PolarHBondContact O-N 3.42Å; K845-F847 VanDerWaalsContact C-N 3.35Å; F847-D849 PolarHBondContact O-N 3.43Å; F847-M850 CarbonylContact O-C 3.35Å; F847-M850 WeakPolarHBondContact O-CB 3.18Å; F847-M850 PolarHBondContact O-N 2.86Å; F847-M850 VanDerWaalsContact O-N 3.07Å; F847-V851 HydrophobicContact CD1-CG2 4.03Å; F847-V851 HydrophobicContact CD2-CG2 4.5Å; F847-V851 HydrophobicContact CE1-CG2 3.7Å; F847-V851 HydrophobicContact CE2-CG2 4.19Å; F847-V851 HydrophobicContact CG-CG2 4.43Å; F847-V851 HydrophobicContact CZ-CG2 3.79Å; F847-V851 WeakPolarHBondContact O-CB 3.44Å; F847-V851 WeakPolarHBondContact O-CG2 3.49Å; F847-V851 PolarHBondContact O-N 3.07Å; F847-V871 HydrophobicContact CE1-CG1 3.71Å; F847-V871 HydrophobicContact CZ-CG1 3.88Å
848	E	89.8	Confident	87.9	Confident	102 Å²	102	69.3 Å²	69.3	48%	0.477	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-40	176.4	-77.4	-57.4	148.8	0	0	112.6	Q844 K845 M850 V851 T852	Q844-E848 PolarHBondContact O-N 2.79Å; K845-E848 PolarHBondContact O-N 3.42Å; E848-M850 PolarHBondContact O-N 3.17Å; E848-V851 PolarHBondContact O-N 2.88Å; E848-T852 WeakPolarHBondContact O-CB 3.43Å; E848-T852 PolarHBondContact O-N 2.79Å; E848-T852 PolarHBondContact O-OG1 3.43Å
849	D	89.9	Confident	88.1	Confident	73 Å²	73	77.8 Å²	77.8	39%	0.39	39%	0.389	S	S	.	.	H	α-helix	trans	-55.9	-40.7	171.7	-117.3	36.3	0	0	0	111.8	K845 F847 K853	K845-D849 WeakPolarHBondContact O-CB 3.38Å; K845-D849 PolarHBondContact O-N 2.88Å; F847-D849 PolarHBondContact O-N 3.43Å; D849-K853 WeakPolarHBondContact O-CD 3.34Å; D849-K853 VanDerWaalsContact O-CE 3.23Å; D849-K853 WeakPolarHBondContact O-CE 3.13Å; D849-K853 WeakPolarHBondContact O-CG 3.11Å; D849-K853 PolarHBondContact O-N 3.28Å; D849-K853 IonicContact OD2-NZ 2.75Å; D849-K853 PolarHBondContact OD2-NZ 3.29Å
850	M	89.4	Confident	88.2	Confident	33 Å²	33	79.4 Å²	79.4	16%	0.163	38%	0.38	C	S	.	.	H	α-helix	trans	-78.4	-43.3	-178.1	175.8	155.2	48.8	0	0	112.7	Y834 L846 F847 E848 T852 K853 L854	Y834-M850 HydrophobicContact CD1-CE 3.27Å; Y834-M850 HydrophobicContact CD1-SD 3.98Å; Y834-M850 HydrophobicContact CD2-CE 4.16Å; Y834-M850 HydrophobicContact CE1-CE 3.25Å; Y834-M850 HydrophobicContact CE1-SD 3.36Å; Y834-M850 WeakPolarHBondContact CE1-SD 3.26Å; Y834-M850 HydrophobicContact CE2-CE 4.16Å; Y834-M850 HydrophobicContact CG-CE 3.73Å; L846-M850 VanDerWaalsContact O-CB 3.31Å; L846-M850 WeakPolarHBondContact O-CB 3.26Å; L846-M850 PolarHBondContact O-N 3.1Å; L846-M850 VanDerWaalsContact O-N 3.12Å; F847-M850 CarbonylContact O-C 3.35Å; F847-M850 WeakPolarHBondContact O-CB 3.18Å; F847-M850 PolarHBondContact O-N 2.86Å; F847-M850 VanDerWaalsContact O-N 3.07Å; E848-M850 PolarHBondContact O-N 3.17Å; M850-T852 VanDerWaalsContact C-N 3.28Å; M850-T852 PolarHBondContact O-N 3.38Å; M850-K853 PolarHBondContact O-N 3.44Å; M850-L854 HydrophobicContact CG-CD1 4.34Å; M850-L854 WeakPolarHBondContact O-CG 3.32Å; M850-L854 PolarHBondContact O-N 3.39Å
851	V	90.2	Very high	87.4	Confident	3 Å²	3	83.5 Å²	83.5	2%	0.018	41%	0.406	C	S	.	.	H	α-helix	trans	-57.2	-44.2	170.1	167.6	0	0	0	0	109.7	I829 F847 E848 K853 L854 Q855 V871	I829-V851 HydrophobicContact CD1-CG2 4.41Å; F847-V851 HydrophobicContact CD1-CG2 4.03Å; F847-V851 HydrophobicContact CD2-CG2 4.5Å; F847-V851 HydrophobicContact CE1-CG2 3.7Å; F847-V851 HydrophobicContact CE2-CG2 4.19Å; F847-V851 HydrophobicContact CG-CG2 4.43Å; F847-V851 HydrophobicContact CZ-CG2 3.79Å; F847-V851 WeakPolarHBondContact O-CB 3.44Å; F847-V851 WeakPolarHBondContact O-CG2 3.49Å; F847-V851 PolarHBondContact O-N 3.07Å; E848-V851 PolarHBondContact O-N 2.88Å; V851-K853 PolarHBondContact O-N 3.47Å; V851-L854 PolarHBondContact O-N 3.45Å; V851-Q855 HydrophobicContact CG1-CG 4.26Å; V851-Q855 VanDerWaalsContact CG1-NE2 3.3Å; V851-Q855 WeakPolarHBondContact O-CB 3.29Å; V851-Q855 VanDerWaalsContact O-CG 3.3Å; V851-Q855 WeakPolarHBondContact O-CG 3.43Å; V851-Q855 PolarHBondContact O-N 3.43Å; V851-V871 HydrophobicContact CG1-CG2 3.91Å; V851-V871 HydrophobicContact CG2-CG1 4.45Å; V851-V871 HydrophobicContact CG2-CG2 4.13Å
852	T	91.9	Very high	86.9	Confident	83 Å²	83	81 Å²	81	51%	0.509	40%	0.397	S	S	.	.	H	α-helix	trans	-60.3	-45.8	174.6	-63.7	0	0	0	0	112	E848 M850 L854 Q855 A856	E848-T852 WeakPolarHBondContact O-CB 3.43Å; E848-T852 PolarHBondContact O-N 2.79Å; E848-T852 PolarHBondContact O-OG1 3.43Å; M850-T852 VanDerWaalsContact C-N 3.28Å; M850-T852 PolarHBondContact O-N 3.38Å; T852-L854 VanDerWaalsContact C-N 3.33Å; T852-L854 PolarHBondContact O-N 3.06Å; T852-Q855 PolarHBondContact O-N 3.15Å; T852-A856 WeakPolarHBondContact O-CB 3.32Å; T852-A856 PolarHBondContact O-N 2.77Å
853	K	90.6	Very high	86.5	Confident	107 Å²	107	74 Å²	74	47%	0.465	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-35.1	176.4	-70.1	154.7	-159.3	161	0	112.3	P809 D849 M850 V851	P809-K853 HydrophobicContact CG-CB 3.94Å; D849-K853 WeakPolarHBondContact O-CD 3.34Å; D849-K853 VanDerWaalsContact O-CE 3.23Å; D849-K853 WeakPolarHBondContact O-CE 3.13Å; D849-K853 WeakPolarHBondContact O-CG 3.11Å; D849-K853 PolarHBondContact O-N 3.28Å; D849-K853 IonicContact OD2-NZ 2.75Å; D849-K853 PolarHBondContact OD2-NZ 3.29Å; M850-K853 PolarHBondContact O-N 3.44Å; V851-K853 PolarHBondContact O-N 3.47Å
854	L	90.1	Very high	86	Confident	0 Å²	0	77 Å²	77	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-73.7	-44.9	174.4	-70.5	168.3	0	0	0	111.9	P809 L812 I829 M850 V851 T852 A856 L857 I869	P809-L854 HydrophobicContact CB-CD2 4.4Å; P809-L854 HydrophobicContact CG-CD2 3.92Å; P809-L854 HydrophobicContact CG-CG 4.26Å; L812-L854 HydrophobicContact CD1-CD2 3.74Å; I829-L854 HydrophobicContact CD1-CD1 3.73Å; M850-L854 HydrophobicContact CG-CD1 4.34Å; M850-L854 WeakPolarHBondContact O-CG 3.32Å; M850-L854 PolarHBondContact O-N 3.39Å; V851-L854 PolarHBondContact O-N 3.45Å; T852-L854 VanDerWaalsContact C-N 3.33Å; T852-L854 PolarHBondContact O-N 3.06Å; L854-A856 VanDerWaalsContact C-N 3.27Å; L854-A856 PolarHBondContact O-N 2.99Å; L854-L857 VanDerWaalsContact O-CB 3.32Å; L854-L857 WeakPolarHBondContact O-CB 3.4Å; L854-L857 PolarHBondContact O-N 3.31Å; L854-L857 VanDerWaalsContact O-N 3.08Å; L854-I869 VanDerWaalsContact C-CD1 3.44Å; L854-I869 HydrophobicContact CB-CD1 3.81Å; L854-I869 WeakPolarHBondContact O-CD1 3.45Å
855	Q	89.6	Confident	85.7	Confident	97 Å²	97	81.3 Å²	81.3	45%	0.453	40%	0.403	S	S	.	.	H	α-helix	trans	-60.6	-36.1	175.5	-73.3	-172.7	30.9	0	0	112.1	V851 T852 L857 R858 I869	V851-Q855 HydrophobicContact CG1-CG 4.26Å; V851-Q855 VanDerWaalsContact CG1-NE2 3.3Å; V851-Q855 WeakPolarHBondContact O-CB 3.29Å; V851-Q855 VanDerWaalsContact O-CG 3.3Å; V851-Q855 WeakPolarHBondContact O-CG 3.43Å; V851-Q855 PolarHBondContact O-N 3.43Å; T852-Q855 PolarHBondContact O-N 3.15Å; Q855-L857 PolarHBondContact O-N 2.94Å; Q855-R858 WeakPolarHBondContact O-CB 3.42Å; Q855-R858 PolarHBondContact O-N 3.35Å; Q855-I869 HydrophobicContact CG-CD1 4.33Å
856	A	89.5	Confident	85.7	Confident	50 Å²	50	75.3 Å²	75.3	41%	0.413	38%	0.378	S	S	.	.	H	α-helix	trans	-58.4	-30.1	174.7	0	0	0	0	0	113	T852 L854 R858 R859	T852-A856 WeakPolarHBondContact O-CB 3.32Å; T852-A856 PolarHBondContact O-N 2.77Å; L854-A856 VanDerWaalsContact C-N 3.27Å; L854-A856 PolarHBondContact O-N 2.99Å; A856-R858 VanDerWaalsContact C-N 3.28Å; A856-R858 PolarHBondContact O-N 3.16Å; A856-R859 WeakPolarHBondContact O-CB 3.45Å; A856-R859 PolarHBondContact O-N 2.95Å
857	L	87.9	Confident	85.9	Confident	10 Å²	10	70.7 Å²	70.7	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-33.5	173.5	-63.8	-177.8	0	0	0	112.5	P809 L812 L813 L854 Q855 R859 R860 F863 L867	P809-L857 HydrophobicContact CB-CD1 3.94Å; P809-L857 HydrophobicContact CB-CD2 4.41Å; P809-L857 HydrophobicContact CB-CG 4.28Å; L812-L857 HydrophobicContact CB-CD1 4.04Å; L812-L857 HydrophobicContact CD1-CD1 4.03Å; L813-L857 HydrophobicContact CD1-CD2 4.08Å; L813-L857 HydrophobicContact CD2-CD2 4.06Å; L813-L857 HydrophobicContact CG-CD2 4.02Å; L854-L857 VanDerWaalsContact O-CB 3.32Å; L854-L857 WeakPolarHBondContact O-CB 3.4Å; L854-L857 PolarHBondContact O-N 3.31Å; L854-L857 VanDerWaalsContact O-N 3.08Å; Q855-L857 PolarHBondContact O-N 2.94Å; L857-R859 PolarHBondContact O-N 2.84Å; L857-R859 VanDerWaalsContact O-N 3.14Å; L857-R860 WeakPolarHBondContact O-CB 3.23Å; L857-R860 PolarHBondContact O-N 3.04Å; L857-F863 HydrophobicContact CB-CD1 4.33Å; L857-F863 WeakPolarHBondContact O-CB 3.4Å; L857-L867 HydrophobicContact CB-CD2 3.8Å; L857-L867 HydrophobicContact CD1-CD2 4.3Å
858	R	85	Confident	86	Confident	114 Å²	114	74.5 Å²	74.5	43%	0.43	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-17.5	177.9	-58.8	-177	69.2	-146.8	-6.1	112.8	Q855 A856 S864 L867 I869	Q855-R858 WeakPolarHBondContact O-CB 3.42Å; Q855-R858 PolarHBondContact O-N 3.35Å; A856-R858 VanDerWaalsContact C-N 3.28Å; A856-R858 PolarHBondContact O-N 3.16Å; R858-S864 VanDerWaalsContact O-CA 3.28Å; R858-S864 WeakPolarHBondContact O-CA 3.41Å; R858-S864 WeakPolarHBondContact O-CB 3.35Å; R858-L867 HydrophobicContact CG-CB 4.37Å; R858-L867 HydrophobicContact CG-CD2 3.99Å; R858-L867 HydrophobicContact CG-CG 4.07Å; R858-L867 PolarHBondContact NE-O 3.02Å; R858-L867 VanDerWaalsContact NE-O 3.07Å; R858-I869 HydrophobicContact CG-CD1 4.13Å
859	R	83.5	Confident	86.1	Confident	224 Å²	224	71.1 Å²	71.1	85%	0.845	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.7	173.2	-57.4	-176.3	-177.2	176.1	1.8	113.2	A856 L857	A856-R859 WeakPolarHBondContact O-CB 3.45Å; A856-R859 PolarHBondContact O-N 2.95Å; L857-R859 PolarHBondContact O-N 2.84Å; L857-R859 VanDerWaalsContact O-N 3.14Å
860	R	83.5	Confident	86.2	Confident	130 Å²	130	73.1 Å²	73.1	49%	0.491	36%	0.362	S	S	.	.	S	Bend	trans	-78.1	141.7	178.2	-61.9	-176.9	67.7	147.6	1.3	110.8	L857 F863 S864	L857-R860 WeakPolarHBondContact O-CB 3.23Å; L857-R860 PolarHBondContact O-N 3.04Å; R860-F863 HydrophobicContact CB-CB 4.45Å; R860-F863 PolarHBondContact O-N 3.01Å; R860-S864 PolarHBondContact O-N 3.03Å
861	P	72.9	Confident	86	Confident	122 Å²	122	74 Å²	74	79%	0.792	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	146.6	170.2	25.3	-33.5	0	0	0	110.7	F863	P861-F863 VanDerWaalsContact C-N 3.26Å; P861-F863 PolarHBondContact O-N 2.75Å
862	G	73.9	Confident	85.4	Confident	45 Å²	45	79 Å²	79	46%	0.464	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-55.1	-168.2	0	0	0	0	0	113	S864 I866	G862-S864 PolarHBondContact O-N 2.98Å; G862-I866 WeakPolarHBondContact O-CD1 3.4Å
863	F	79.8	Confident	83.7	Confident	6 Å²	6	78.7 Å²	78.7	3%	0.026	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-69.6	-31.8	-174.1	-88.2	-97.4	0	0	0	114.7	L812 L813 N816 I825 L857 R860 P861 K865 I866 L867	L812-F863 HydrophobicContact CB-CE1 4.23Å; L812-F863 WeakPolarHBondContact O-CZ 3.15Å; L813-F863 HydrophobicContact CD2-CD2 4.45Å; L813-F863 HydrophobicContact CD2-CE2 3.74Å; L813-F863 HydrophobicContact CD2-CZ 3.96Å; N816-F863 HydrophobicContact CB-CE1 4.31Å; N816-F863 HydrophobicContact CB-CE2 3.59Å; N816-F863 HydrophobicContact CB-CZ 3.34Å; N816-F863 VanDerWaalsContact CG-CE2 3.47Å; I825-F863 HydrophobicContact CD1-CE1 4.06Å; L857-F863 HydrophobicContact CB-CD1 4.33Å; L857-F863 WeakPolarHBondContact O-CB 3.4Å; R860-F863 HydrophobicContact CB-CB 4.45Å; R860-F863 PolarHBondContact O-N 3.01Å; P861-F863 VanDerWaalsContact C-N 3.26Å; P861-F863 PolarHBondContact O-N 2.75Å; F863-K865 PolarHBondContact O-N 3.5Å; F863-K865 VanDerWaalsContact O-N 3.1Å; F863-I866 PolarHBondContact O-N 3.16Å; F863-L867 HydrophobicContact CD1-CB 3.93Å; F863-L867 HydrophobicContact CD1-CD2 3.86Å; F863-L867 HydrophobicContact CE1-CD2 4.44Å; F863-L867 PolarHBondContact O-N 2.7Å
864	S	74.7	Confident	81.2	Confident	65 Å²	65	76.3 Å²	76.3	46%	0.455	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-56.5	-29.7	-173.7	61	0	0	0	0	115.4	R858 R860 G862	R858-S864 VanDerWaalsContact O-CA 3.28Å; R858-S864 WeakPolarHBondContact O-CA 3.41Å; R858-S864 WeakPolarHBondContact O-CB 3.35Å; R860-S864 PolarHBondContact O-N 3.03Å; G862-S864 PolarHBondContact O-N 2.98Å
865	K	81.6	Confident	78.3	Confident	183 Å²	183	86.1 Å²	86.1	80%	0.796	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-98.1	-12.1	178.8	-64.8	-176.4	178.9	-179	0	114.1	F863	F863-K865 PolarHBondContact O-N 3.5Å; F863-K865 VanDerWaalsContact O-N 3.1Å
866	I	89.3	Confident	77.7	Confident	30 Å²	30	85.6 Å²	85.6	15%	0.154	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-39.9	-170.8	-64.9	174.7	0	0	0	111	S824 I825 G862 F863 H868	S824-I866 CarbonylContact C-O 3.29Å; S824-I866 WeakPolarHBondContact CA-O 3.47Å; I825-I866 HydrophobicContact CD1-CG2 4.25Å; I825-I866 HydrophobicContact CG1-CG2 3.96Å; I825-I866 PolarHBondContact N-O 2.85Å; G862-I866 WeakPolarHBondContact O-CD1 3.4Å; F863-I866 PolarHBondContact O-N 3.16Å; I866-H868 PolarHBondContact O-CD2 3.18Å; I866-H868 VanDerWaalsContact O-CD2 3.26Å
867	L	92.3	Very high	77.1	Confident	0 Å²	0	87.5 Å²	87.5	0%	0	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.9	-172.8	177.8	60.7	0	0	0	112.3	L812 I825 V827 L857 R858 F863 I869	L812-L867 HydrophobicContact CD1-CD1 4.18Å; L812-L867 HydrophobicContact CD1-CD2 4.36Å; I825-L867 HydrophobicContact CB-CD1 3.96Å; I825-L867 HydrophobicContact CG2-CD1 3.74Å; V827-L867 HydrophobicContact CG2-CD1 3.96Å; L857-L867 HydrophobicContact CB-CD2 3.8Å; L857-L867 HydrophobicContact CD1-CD2 4.3Å; R858-L867 HydrophobicContact CG-CB 4.37Å; R858-L867 HydrophobicContact CG-CD2 3.99Å; R858-L867 HydrophobicContact CG-CG 4.07Å; R858-L867 PolarHBondContact NE-O 3.02Å; R858-L867 VanDerWaalsContact NE-O 3.07Å; F863-L867 HydrophobicContact CD1-CB 3.93Å; F863-L867 HydrophobicContact CD1-CD2 3.86Å; F863-L867 HydrophobicContact CE1-CD2 4.44Å; F863-L867 PolarHBondContact O-N 2.7Å; L867-I869 HydrophobicContact CD1-CG1 4.08Å; L867-I869 HydrophobicContact CD2-CD1 4.18Å; L867-I869 HydrophobicContact CD2-CG1 4.4Å; L867-I869 HydrophobicContact CG-CD1 4.33Å; L867-I869 HydrophobicContact CG-CG1 4.06Å
868	H	91.6	Very high	76.5	Confident	88 Å²	88	91.8 Å²	91.8	41%	0.407	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118.7	171.8	-47.8	-86.1	0	0	0	108.7	S824 I825 V826 V827 I866	S824-H868 PolarHBondContact OG-CD2 2.97Å; S824-H868 VanDerWaalsContact OG-CD2 3.28Å; S824-H868 PolarHBondContact OG-NE2 3Å; I825-H868 PolarHBondContact O-N 3.44Å; V826-H868 WeakPolarHBondContact CA-O 3.41Å; V826-H868 HydrophobicContact CG2-CB 4.48Å; V827-H868 PolarHBondContact N-O 2.72Å; I866-H868 PolarHBondContact O-CD2 3.18Å; I866-H868 VanDerWaalsContact O-CD2 3.26Å
869	I	91	Very high	76	Confident	30 Å²	30	90.5 Å²	90.5	15%	0.154	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.3	174.2	-58.4	164.3	0	0	0	107.5	V827 L854 Q855 R858 L867 V871	V827-I869 CarbonylContact O-C 3.44Å; V827-I869 WeakPolarHBondContact O-CA 3.43Å; L854-I869 VanDerWaalsContact C-CD1 3.44Å; L854-I869 HydrophobicContact CB-CD1 3.81Å; L854-I869 WeakPolarHBondContact O-CD1 3.45Å; Q855-I869 HydrophobicContact CG-CD1 4.33Å; R858-I869 HydrophobicContact CG-CD1 4.13Å; L867-I869 HydrophobicContact CD1-CG1 4.08Å; L867-I869 HydrophobicContact CD2-CD1 4.18Å; L867-I869 HydrophobicContact CD2-CG1 4.4Å; L867-I869 HydrophobicContact CG-CD1 4.33Å; L867-I869 HydrophobicContact CG-CG1 4.06Å; I869-V871 HydrophobicContact CG2-CG2 4.12Å
870	K	91.1	Very high	75.5	Confident	116 Å²	116	82.1 Å²	82.1	50%	0.504	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.2	166.8	-61.7	178.5	-178.1	178.8	0	107.6	V827 Q828 I829	V827-K870 PolarHBondContact O-N 3.28Å; Q828-K870 WeakPolarHBondContact CA-O 3.45Å; Q828-K870 HydrophobicContact CB-CB 4.26Å; Q828-K870 HydrophobicContact CB-CD 4.43Å; Q828-K870 HydrophobicContact CG-CB 4.22Å; Q828-K870 HydrophobicContact CG-CD 4.32Å; I829-K870 PolarHBondContact N-O 2.88Å; I829-K870 VanDerWaalsContact N-O 3.13Å
871	V	86.6	Confident	75	Confident	50 Å²	50	78.9 Å²	78.9	30%	0.303	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.4	175.7	-176.9	0	0	0	0	108.2	I829 F847 V851 I869	I829-V871 CarbonylContact O-C 3.59Å; I829-V871 VanDerWaalsContact O-CA 3.26Å; I829-V871 WeakPolarHBondContact O-CA 3.49Å; F847-V871 HydrophobicContact CE1-CG1 3.71Å; F847-V871 HydrophobicContact CZ-CG1 3.88Å; V851-V871 HydrophobicContact CG1-CG2 3.91Å; V851-V871 HydrophobicContact CG2-CG1 4.45Å; V851-V871 HydrophobicContact CG2-CG2 4.13Å; I869-V871 HydrophobicContact CG2-CG2 4.12Å
872	E	76.3	Confident	75.1	Confident	109 Å²	109	75.9 Å²	75.9	51%	0.509	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.1	170.8	-70.6	-170.1	-158.9	0	0	109.8	Q828 I829 G830	Q828-E872 PolarHBondContact NE2-OE1 3.17Å; I829-E872 PolarHBondContact O-N 2.67Å; G830-E872 WeakPolarHBondContact CA-O 3.4Å
873	G	57.9	Low	75.2	Confident	76 Å²	76	78.2 Å²	78.2	78%	0.784	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	94	5.1	-176.7	0	0	0	0	0	115.7
874	G	37.2	Very low	74.8	Confident	57 Å²	57	84.3 Å²	84.3	59%	0.588	50%	0.504	S	S	*	.			trans	-69.9	128.8	166.1	0	0	0	0	0	111.3
875	C	28.6	Very low	74.9	Confident	207 Å²	207	86 Å²	86	100%	1.399	51%	0.509	S	S	*	.			trans	-76.3	0	170.8	-66	0	0	0	0	112.1

Retrieved 875 of 875 residues in 283.6 ms (Link to these results)

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