A0A087Y7N1_POEFO Loading...

Rho family-interacting cell polarization regulator 2

AlphaFold DB , UniProt , Accession A0A087Y7N1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 940 aa.

						>A0A087Y7N1_POEFO|A0A087Y7N1
MKDMKRNSRLGVLYDLDKQIKSIERYMRRLEFHISKVDELYEAFCIQSRLKDGAIRMKQAFSSSPSTKGTKESIAEVNRRYKEYTENMSAFESELENLLGEFHIKMKGLAGFARLCPGDQYEIFMRYGRQRWKLKGRIEVNSRQSWDGDEMVFMPLISDLINIKVTELKGLATHMLVGSVICETKELFTAMPQVVAVDVNDLGTIKLNLEVTWYPFDVEDLTLSSGNLSKAAALQRRVSVYSQGTPETPTFQDSSFFSTLPDDIFENGGCGVAECKRLSFTFSDTSGSSPSPAQSSFSQSQSNPEITVTPPDTDSLPTPILQTMEDSIAEEHLEEEEEEEDEEEEVYEEDGETGSRGSRNSASLASDEADVADSEWERTESQRNSISNCGSAAPSLCSDGHLSTVAPEDVFLDHADELKPVELDTEEPGNLTRQLVKRLTSSEIVSPAGSSTEGGGSLGWAGEGSRAFLESSLEEAIHSLLTKLESLTHRCRELQDLEQEVMRLEDLLKCRLPGHRSRSSSLSLTVESALESFDFLNTSDFDDDDTGDDNTGICSLPQKSPPLDADPERIESQHPEARGHLSEALTEDTGVGNSVAGSPMPLTTGNENLDVAIVIHLQYCIHLIQMLTSGMGVWQRRGVLLKLSGQTQLLEELAEISVDRLGGVTSAADVLPSLAERPQLMTLWSECSGSAGLFHTTLDRVFKHMNQRYSAVLQERHPHSADAVIGMVVGEMVDRSDLAAAHGPPAAALSRDVLTVFQFHNYILQHDVQDMETHLLHLAREEVFAETLCGDDFSRRLAQLEEVPLSTLWPRNGTLRALASLLTAEDPQVNKAAADYLSSGASDRHFRARAVEYYTQALSEAGVQSQRAACSALSCLQAVESLKAVVALCDSADEELRHVAIETLLTFGEEGRLAYEQLDTVVGDMIRLGTRRGNAVTTAF
					

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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	40.5	Very low	56.6	Low	246 Å²	246	162.2 Å²	162.2	100%	1.212	77%	0.773	S	S	*	*				0	66	0	-161.8	-176.2	-65.3	0	0	109.2
2	K	44.8	Very low	58.3	Low	196 Å²	196	156.8 Å²	156.8	85%	0.852	76%	0.758	S	S	*	*			trans	-141	155.7	170.8	-122.8	179.2	177.6	-175.9	0	103.9
3	D	45.6	Very low	59.8	Low	155 Å²	155	152.5 Å²	152.5	83%	0.829	74%	0.741	S	S	*	*			trans	82.7	43.2	-169.4	-50	-14.1	0	0	0	115.8	K5	D3-K5 PolarHBondContact O-N 3.36Å
4	M	47.1	Very low	61.5	Low	185 Å²	185	152.6 Å²	152.6	91%	0.911	73%	0.731	S	S	*	*			trans	-70.2	85.9	148.3	-77.3	171.9	62.4	0	0	108.7	R6	M4-R6 PolarHBondContact O-N 2.64Å
5	K	50.7	Low	62.8	Low	177 Å²	177	148.5 Å²	148.5	77%	0.77	71%	0.714	S	S	*	*			trans	-53.5	127.4	168.3	-84	-172.4	171.1	-175.8	0	109.1	D3 N7	D3-K5 PolarHBondContact O-N 3.36Å; K5-N7 PolarHBondContact O-N 2.92Å
6	R	52.7	Low	64	Low	245 Å²	245	144.4 Å²	144.4	93%	0.925	70%	0.697	S	S	*	*			trans	-74.6	70.3	172	-81	-178.7	164.1	147.1	-7.4	110.2	M4 S8	M4-R6 PolarHBondContact O-N 2.64Å; R6-S8 PolarHBondContact O-N 2.96Å
7	N	56.6	Low	65.3	Low	136 Å²	136	139.8 Å²	139.8	73%	0.727	68%	0.676	S	S	*	*			trans	-72.4	60.3	166.8	-73	22.2	0	0	0	109.9	K5	K5-N7 PolarHBondContact O-N 2.92Å
8	S	68.2	Low	66.5	Low	65 Å²	65	138.7 Å²	138.7	46%	0.455	67%	0.668	S	S	.	*			trans	-74.4	124.7	168.6	-178.1	0	0	0	0	108.2	R6 L10 G11 V12	R6-S8 PolarHBondContact O-N 2.96Å; S8-L10 PolarHBondContact O-N 3.11Å; S8-L10 VanDerWaalsContact O-N 3.14Å; S8-L10 PolarHBondContact OG-N 3.02Å; S8-G11 PolarHBondContact O-N 3.25Å; S8-V12 PolarHBondContact O-N 3.03Å
9	R	67.8	Low	67.4	Low	217 Å²	217	136.5 Å²	136.5	82%	0.819	66%	0.657	S	S	*	*	H	α-helix	trans	-53.7	-33.2	173.9	-72	173	63.6	-177.3	-0.7	111.7	V12 L13	R9-V12 PolarHBondContact O-N 3.07Å; R9-L13 WeakPolarHBondContact O-CB 3.43Å; R9-L13 VanDerWaalsContact O-CG 3.28Å; R9-L13 WeakPolarHBondContact O-CG 3.43Å; R9-L13 PolarHBondContact O-N 3.12Å
10	L	71.8	Confident	68.3	Low	131 Å²	131	133.8 Å²	133.8	69%	0.686	65%	0.645	S	S	*	*	H	α-helix	trans	-68	-31.7	177.3	-170.5	64.6	0	0	0	113.2	S8 Y14	S8-L10 PolarHBondContact O-N 3.11Å; S8-L10 VanDerWaalsContact O-N 3.14Å; S8-L10 PolarHBondContact OG-N 3.02Å; L10-Y14 WeakPolarHBondContact O-CB 3.31Å; L10-Y14 PolarHBondContact O-N 3.02Å
11	G	76.9	Confident	69.2	Low	31 Å²	31	132 Å²	132	32%	0.32	63%	0.634	S	S	.	*	H	α-helix	trans	-68.8	-47	174.3	0	0	0	0	0	111.3	S8 L13 Y14 D15	S8-G11 PolarHBondContact O-N 3.25Å; G11-L13 VanDerWaalsContact C-N 3.29Å; G11-L13 PolarHBondContact O-N 3.41Å; G11-Y14 WeakPolarHBondContact O-CB 3.33Å; G11-Y14 PolarHBondContact O-N 3.33Å; G11-Y14 VanDerWaalsContact O-N 3.11Å; G11-D15 PolarHBondContact O-N 2.83Å
12	V	76.8	Confident	71.2	Confident	98 Å²	98	122.4 Å²	122.4	59%	0.594	59%	0.592	S	S	*	*	H	α-helix	trans	-61.5	-37.7	176.6	-178.8	0	0	0	0	111.8	S8 R9 L16	S8-V12 PolarHBondContact O-N 3.03Å; R9-V12 PolarHBondContact O-N 3.07Å; V12-L16 VanDerWaalsContact O-CB 3.29Å; V12-L16 WeakPolarHBondContact O-CB 3.45Å; V12-L16 PolarHBondContact O-N 2.88Å
13	L	77.7	Confident	73	Confident	101 Å²	101	118 Å²	118	53%	0.529	58%	0.576	S	S	.	*	H	α-helix	trans	-67.8	-36.7	174.3	-73.2	166.8	0	0	0	112.8	R9 G11 L16 D17	R9-L13 WeakPolarHBondContact O-CB 3.43Å; R9-L13 VanDerWaalsContact O-CG 3.28Å; R9-L13 WeakPolarHBondContact O-CG 3.43Å; R9-L13 PolarHBondContact O-N 3.12Å; G11-L13 VanDerWaalsContact C-N 3.29Å; G11-L13 PolarHBondContact O-N 3.41Å; L13-L16 PolarHBondContact O-N 2.88Å; L13-D17 WeakPolarHBondContact O-CB 3.25Å; L13-D17 PolarHBondContact O-N 3.06Å
14	Y	84.3	Confident	75	Confident	154 Å²	154	113.9 Å²	113.9	60%	0.604	55%	0.552	S	S	*	*	H	α-helix	trans	-68.7	-42.6	175.1	176.6	-95.9	0	0	0	112.2	L10 G11 L16 D17 K18	L10-Y14 WeakPolarHBondContact O-CB 3.31Å; L10-Y14 PolarHBondContact O-N 3.02Å; G11-Y14 WeakPolarHBondContact O-CB 3.33Å; G11-Y14 PolarHBondContact O-N 3.33Å; G11-Y14 VanDerWaalsContact O-N 3.11Å; Y14-L16 VanDerWaalsContact C-N 3.29Å; Y14-L16 PolarHBondContact O-N 3.42Å; Y14-D17 PolarHBondContact O-N 3.06Å; Y14-K18 WeakPolarHBondContact O-CB 3.37Å; Y14-K18 PolarHBondContact O-N 3.38Å
15	D	80.6	Confident	76.9	Confident	90 Å²	90	113.6 Å²	113.6	48%	0.481	54%	0.541	S	S	.	.	H	α-helix	trans	-64.6	-35.7	175.6	-66.6	-34.8	0	0	0	111.2	G11 Q19	G11-D15 PolarHBondContact O-N 2.83Å; D15-Q19 WeakPolarHBondContact O-CG 3.5Å; D15-Q19 PolarHBondContact O-N 3.4Å
16	L	82.6	Confident	78.5	Confident	83 Å²	83	108.4 Å²	108.4	44%	0.435	52%	0.517	S	S	.	.	H	α-helix	trans	-70.4	-44.9	174.7	-174.9	66	0	0	0	112.7	V12 L13 Y14 K18 Q19 I20	V12-L16 VanDerWaalsContact O-CB 3.29Å; V12-L16 WeakPolarHBondContact O-CB 3.45Å; V12-L16 PolarHBondContact O-N 2.88Å; L13-L16 PolarHBondContact O-N 2.88Å; Y14-L16 VanDerWaalsContact C-N 3.29Å; Y14-L16 PolarHBondContact O-N 3.42Å; L16-K18 VanDerWaalsContact C-N 3.26Å; L16-K18 PolarHBondContact O-N 2.84Å; L16-Q19 WeakPolarHBondContact O-CB 3.37Å; L16-Q19 PolarHBondContact O-N 3.14Å; L16-Q19 VanDerWaalsContact O-N 3.08Å; L16-I20 HydrophobicContact CG-CD1 4.09Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 2.84Å
17	D	85.7	Confident	80	Confident	66 Å²	66	101.4 Å²	101.4	35%	0.353	50%	0.496	S	S	.	.	H	α-helix	trans	-56.4	-41.8	173	172.5	83.1	0	0	0	111.5	L13 Y14 I20 K21	L13-D17 WeakPolarHBondContact O-CB 3.25Å; L13-D17 PolarHBondContact O-N 3.06Å; Y14-D17 PolarHBondContact O-N 3.06Å; D17-I20 PolarHBondContact O-N 2.83Å; D17-K21 WeakPolarHBondContact O-CB 3.38Å; D17-K21 WeakPolarHBondContact O-CG 3.5Å; D17-K21 PolarHBondContact O-N 2.99Å; D17-K21 VanDerWaalsContact OD1-CE 3.23Å; D17-K21 WeakPolarHBondContact OD1-CE 3.49Å; D17-K21 IonicContact OD1-NZ 2.66Å; D17-K21 PolarHBondContact OD1-NZ 3.43Å; D17-K21 IonicContact OD2-NZ 2.69Å; D17-K21 PolarHBondContact OD2-NZ 3.45Å
18	K	87.3	Confident	81.6	Confident	120 Å²	120	101.5 Å²	101.5	52%	0.522	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-39	174	-174.9	179.2	176.2	-176.3	0	112.7	Y14 L16 S22	Y14-K18 WeakPolarHBondContact O-CB 3.37Å; Y14-K18 PolarHBondContact O-N 3.38Å; L16-K18 VanDerWaalsContact C-N 3.26Å; L16-K18 PolarHBondContact O-N 2.84Å; K18-S22 WeakPolarHBondContact O-CB 3.48Å; K18-S22 PolarHBondContact O-N 3.04Å; K18-S22 VanDerWaalsContact O-N 3.08Å
19	Q	83.1	Confident	82.5	Confident	97 Å²	97	103 Å²	103	45%	0.453	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-47	175.3	-76.5	171.8	4.4	0	0	111.7	D15 L16 K21 S22 I23 L223	D15-Q19 WeakPolarHBondContact O-CG 3.5Å; D15-Q19 PolarHBondContact O-N 3.4Å; L16-Q19 WeakPolarHBondContact O-CB 3.37Å; L16-Q19 PolarHBondContact O-N 3.14Å; L16-Q19 VanDerWaalsContact O-N 3.08Å; Q19-K21 PolarHBondContact O-N 3.34Å; Q19-S22 WeakPolarHBondContact O-CA 3.2Å; Q19-S22 VanDerWaalsContact O-CB 3.31Å; Q19-S22 WeakPolarHBondContact O-CB 3.36Å; Q19-S22 PolarHBondContact O-N 3.14Å; Q19-I23 WeakPolarHBondContact O-CG1 3.46Å; Q19-I23 PolarHBondContact O-N 3.43Å; Q19-L223 HydrophobicContact CG-CD1 4.38Å
20	I	85.4	Confident	83.4	Confident	82 Å²	82	95.2 Å²	95.2	42%	0.421	46%	0.456	S	S	.	.	H	α-helix	trans	-56	-52.3	176.6	-68.2	164.7	0	0	0	109.9	L16 D17 S22 I23 E24	L16-I20 HydrophobicContact CG-CD1 4.09Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 2.84Å; D17-I20 PolarHBondContact O-N 2.83Å; I20-S22 PolarHBondContact O-N 3.1Å; I20-S22 VanDerWaalsContact O-N 3.16Å; I20-I23 PolarHBondContact O-N 3.47Å; I20-E24 HydrophobicContact CG2-CG 4.29Å; I20-E24 WeakPolarHBondContact O-CG 3.39Å; I20-E24 PolarHBondContact O-N 2.99Å
21	K	86.8	Confident	84.3	Confident	96 Å²	96	94.1 Å²	94.1	42%	0.417	45%	0.447	S	S	.	.	H	α-helix	trans	-62.9	-22.4	177.6	-73.1	166.4	-178.8	161.2	0	114.1	D17 Q19 R25	D17-K21 WeakPolarHBondContact O-CB 3.38Å; D17-K21 WeakPolarHBondContact O-CG 3.5Å; D17-K21 PolarHBondContact O-N 2.99Å; D17-K21 VanDerWaalsContact OD1-CE 3.23Å; D17-K21 WeakPolarHBondContact OD1-CE 3.49Å; D17-K21 IonicContact OD1-NZ 2.66Å; D17-K21 PolarHBondContact OD1-NZ 3.43Å; D17-K21 IonicContact OD2-NZ 2.69Å; D17-K21 PolarHBondContact OD2-NZ 3.45Å; Q19-K21 PolarHBondContact O-N 3.34Å; K21-R25 VanDerWaalsContact O-CD 3.28Å; K21-R25 WeakPolarHBondContact O-CD 3.43Å; K21-R25 WeakPolarHBondContact O-CG 3.32Å
22	S	82.3	Confident	84.9	Confident	46 Å²	46	99.6 Å²	99.6	32%	0.322	46%	0.462	S	S	.	.	H	α-helix	trans	-76	-43	171.6	-155.6	0	0	0	0	111.3	K18 Q19 I20 R25 Y26	K18-S22 WeakPolarHBondContact O-CB 3.48Å; K18-S22 PolarHBondContact O-N 3.04Å; K18-S22 VanDerWaalsContact O-N 3.08Å; Q19-S22 WeakPolarHBondContact O-CA 3.2Å; Q19-S22 VanDerWaalsContact O-CB 3.31Å; Q19-S22 WeakPolarHBondContact O-CB 3.36Å; Q19-S22 PolarHBondContact O-N 3.14Å; I20-S22 PolarHBondContact O-N 3.1Å; I20-S22 VanDerWaalsContact O-N 3.16Å; S22-R25 PolarHBondContact O-N 3.3Å; S22-Y26 PolarHBondContact O-N 3.22Å; S22-Y26 VanDerWaalsContact O-N 3.14Å
23	I	84.3	Confident	85.4	Confident	102 Å²	102	96.4 Å²	96.4	52%	0.523	44%	0.441	S	S	.	.	H	α-helix	trans	-66.1	-45.9	177.7	-67.2	159.7	0	0	0	110.6	Q19 I20 R25 Y26 M27	Q19-I23 WeakPolarHBondContact O-CG1 3.46Å; Q19-I23 PolarHBondContact O-N 3.43Å; I20-I23 PolarHBondContact O-N 3.47Å; I23-R25 PolarHBondContact O-N 2.95Å; I23-Y26 WeakPolarHBondContact O-CA 3.43Å; I23-Y26 WeakPolarHBondContact O-CB 3.5Å; I23-Y26 PolarHBondContact O-N 3.17Å; I23-M27 HydrophobicContact CG2-CG 4.45Å; I23-M27 HydrophobicContact CG2-SD 4.25Å; I23-M27 WeakPolarHBondContact O-CG 3.37Å; I23-M27 PolarHBondContact O-N 3.19Å
24	E	87	Confident	86	Confident	70 Å²	70	96 Å²	96	33%	0.327	44%	0.438	S	S	.	.	H	α-helix	trans	-63.3	-26.5	177.9	-60.1	177.6	-150.5	0	0	113.4	I20 R28	I20-E24 HydrophobicContact CG2-CG 4.29Å; I20-E24 WeakPolarHBondContact O-CG 3.39Å; I20-E24 PolarHBondContact O-N 2.99Å; E24-R28 WeakPolarHBondContact O-CG 3.43Å; E24-R28 PolarHBondContact O-N 3.3Å; E24-R28 PolarHBondContact O-NH1 2.66Å; E24-R28 IonicContact OE2-CZ 3.05Å; E24-R28 IonicContact OE2-NH1 2.71Å; E24-R28 PolarHBondContact OE2-NH1 3.5Å; E24-R28 IonicContact OE2-NH2 2.76Å; E24-R28 PolarHBondContact OE2-NH2 3.19Å
25	R	86.8	Confident	86.3	Confident	178 Å²	178	92 Å²	92	67%	0.672	43%	0.433	S	S	*	.	H	α-helix	trans	-76	-34.2	173.3	-74.4	169.8	-176.7	-174.4	-1.9	111.6	K21 S22 I23 R29	K21-R25 VanDerWaalsContact O-CD 3.28Å; K21-R25 WeakPolarHBondContact O-CD 3.43Å; K21-R25 WeakPolarHBondContact O-CG 3.32Å; S22-R25 PolarHBondContact O-N 3.3Å; I23-R25 PolarHBondContact O-N 2.95Å; R25-R29 WeakPolarHBondContact O-CG 3.38Å; R25-R29 PolarHBondContact O-N 3.12Å; R25-R29 VanDerWaalsContact O-N 3.17Å
26	Y	83.7	Confident	86.8	Confident	68 Å²	68	89.8 Å²	89.8	27%	0.267	42%	0.419	S	S	.	.	H	α-helix	trans	-68.7	-41.5	174.4	-171	-101	0	0	0	111.3	S22 I23 R29 L30 F216 L221	S22-Y26 PolarHBondContact O-N 3.22Å; S22-Y26 VanDerWaalsContact O-N 3.14Å; I23-Y26 WeakPolarHBondContact O-CA 3.43Å; I23-Y26 WeakPolarHBondContact O-CB 3.5Å; I23-Y26 PolarHBondContact O-N 3.17Å; Y26-R29 WeakPolarHBondContact O-CB 3.46Å; Y26-R29 PolarHBondContact O-N 3.31Å; Y26-L30 HydrophobicContact CD1-CD1 3.86Å; Y26-L30 HydrophobicContact CD1-CG 4.41Å; Y26-L30 HydrophobicContact CE1-CD1 3.62Å; Y26-L30 HydrophobicContact CE1-CG 4.17Å; Y26-L30 PolarHBondContact O-N 2.78Å; Y26-F216 HydrophobicContact CD2-CD2 4.48Å; Y26-F216 HydrophobicContact CD2-CE2 4.34Å; Y26-F216 AromaticContact CE2-CD2 3.66Å; Y26-F216 HydrophobicContact CE2-CD2 3.66Å; Y26-F216 AromaticContact CE2-CE2 3.75Å; Y26-F216 HydrophobicContact CE2-CE2 3.75Å; Y26-F216 AromaticContact CZ-CE2 3.98Å; Y26-L221 HydrophobicContact CD2-CD2 4.38Å; Y26-L221 HydrophobicContact CE2-CD1 4.29Å; Y26-L221 HydrophobicContact CE2-CD2 4.27Å; Y26-L221 HydrophobicContact CE2-CG 4.47Å
27	M	85.3	Confident	87.3	Confident	98 Å²	98	87.8 Å²	87.8	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-58.1	-52.8	172.3	-69.9	177.2	64.6	0	0	111.9	I23 R29 L30 E31	I23-M27 HydrophobicContact CG2-CG 4.45Å; I23-M27 HydrophobicContact CG2-SD 4.25Å; I23-M27 WeakPolarHBondContact O-CG 3.37Å; I23-M27 PolarHBondContact O-N 3.19Å; M27-R29 PolarHBondContact O-N 3.1Å; M27-R29 VanDerWaalsContact O-N 3.13Å; M27-L30 CarbonylContact O-C 3.54Å; M27-L30 WeakPolarHBondContact O-CA 3.31Å; M27-L30 WeakPolarHBondContact O-CB 3.33Å; M27-L30 PolarHBondContact O-N 3.11Å; M27-E31 WeakPolarHBondContact O-CG 3.35Å; M27-E31 PolarHBondContact O-N 3.31Å
28	R	89.4	Confident	87.6	Confident	138 Å²	138	88.6 Å²	88.6	52%	0.521	42%	0.415	S	S	.	.	H	α-helix	trans	-59.8	-26.7	176.9	-67.8	177.3	-166.6	102.8	-3.6	114	E24 E31 F32	E24-R28 WeakPolarHBondContact O-CG 3.43Å; E24-R28 PolarHBondContact O-N 3.3Å; E24-R28 PolarHBondContact O-NH1 2.66Å; E24-R28 IonicContact OE2-CZ 3.05Å; E24-R28 IonicContact OE2-NH1 2.71Å; E24-R28 PolarHBondContact OE2-NH1 3.5Å; E24-R28 IonicContact OE2-NH2 2.76Å; E24-R28 PolarHBondContact OE2-NH2 3.19Å; R28-E31 WeakPolarHBondContact CA-OE2 3.04Å; R28-F32 WeakPolarHBondContact O-CB 3.1Å; R28-F32 PolarHBondContact O-N 3.22Å
29	R	86.6	Confident	87.9	Confident	97 Å²	97	89.3 Å²	89.3	37%	0.366	42%	0.42	S	S	.	.	H	α-helix	trans	-74.9	-37.9	171.1	-78.9	172.9	61.7	164.8	-1.6	112.7	R25 Y26 M27 H33 F216 D220	R25-R29 WeakPolarHBondContact O-CG 3.38Å; R25-R29 PolarHBondContact O-N 3.12Å; R25-R29 VanDerWaalsContact O-N 3.17Å; Y26-R29 WeakPolarHBondContact O-CB 3.46Å; Y26-R29 PolarHBondContact O-N 3.31Å; M27-R29 PolarHBondContact O-N 3.1Å; M27-R29 VanDerWaalsContact O-N 3.13Å; R29-H33 WeakPolarHBondContact O-CB 3.25Å; R29-H33 PolarHBondContact O-N 3.12Å; R29-F216 HydrophobicContact CB-CE2 4.39Å; R29-F216 HydrophobicContact CB-CZ 3.97Å; R29-D220 IonicContact CZ-OD2 3.43Å; R29-D220 IonicContact NH1-OD2 2.84Å; R29-D220 PolarHBondContact NH1-OD2 3.46Å; R29-D220 IonicContact NH2-OD2 2.67Å
30	L	88.1	Confident	88.5	Confident	54 Å²	54	85.5 Å²	85.5	28%	0.283	40%	0.403	S	S	.	.	H	α-helix	trans	-65.5	-46.4	172.7	-71.8	169.1	0	0	0	111	Y26 M27 F32 H33 I34 P215 F216	Y26-L30 HydrophobicContact CD1-CD1 3.86Å; Y26-L30 HydrophobicContact CD1-CG 4.41Å; Y26-L30 HydrophobicContact CE1-CD1 3.62Å; Y26-L30 HydrophobicContact CE1-CG 4.17Å; Y26-L30 PolarHBondContact O-N 2.78Å; M27-L30 CarbonylContact O-C 3.54Å; M27-L30 WeakPolarHBondContact O-CA 3.31Å; M27-L30 WeakPolarHBondContact O-CB 3.33Å; M27-L30 PolarHBondContact O-N 3.11Å; L30-F32 PolarHBondContact O-N 3.03Å; L30-H33 PolarHBondContact O-N 3.4Å; L30-H33 VanDerWaalsContact O-N 3.11Å; L30-I34 WeakPolarHBondContact O-CB 3.39Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.19Å; L30-I34 PolarHBondContact O-N 2.61Å; L30-P215 HydrophobicContact CD2-CG 3.87Å; L30-F216 HydrophobicContact CD2-CE2 3.64Å; L30-F216 HydrophobicContact CD2-CZ 3.74Å; L30-F216 HydrophobicContact CG-CE2 4Å; L30-F216 HydrophobicContact CG-CZ 4.12Å
31	E	89.1	Confident	88.8	Confident	107 Å²	107	88.3 Å²	88.3	50%	0.5	41%	0.409	S	S	.	.	H	α-helix	trans	-54.1	-51	176.4	-69	154.1	-155.3	0	0	111.4	M27 R28 H33 S35	M27-E31 WeakPolarHBondContact O-CG 3.35Å; M27-E31 PolarHBondContact O-N 3.31Å; R28-E31 WeakPolarHBondContact CA-OE2 3.04Å; E31-H33 PolarHBondContact O-N 3.48Å; E31-S35 PolarHBondContact O-N 3.34Å; E31-S35 VanDerWaalsContact O-N 3.14Å
32	F	89.3	Confident	89.2	Confident	146 Å²	146	90.2 Å²	90.2	64%	0.64	42%	0.42	S	S	*	.	H	α-helix	trans	-64	-36.9	175.5	178	-99.6	0	0	0	113.4	R28 L30 K36	R28-F32 WeakPolarHBondContact O-CB 3.1Å; R28-F32 PolarHBondContact O-N 3.22Å; L30-F32 PolarHBondContact O-N 3.03Å; F32-K36 PolarHBondContact O-N 2.99Å
33	H	88.1	Confident	89.8	Confident	31 Å²	31	89.6 Å²	89.6	14%	0.144	42%	0.417	C	S	.	.	H	α-helix	trans	-71	-42.7	-179.1	-176	96.8	0	0	0	112.3	R29 L30 E31 K36 V37 L98 F216	R29-H33 WeakPolarHBondContact O-CB 3.25Å; R29-H33 PolarHBondContact O-N 3.12Å; L30-H33 PolarHBondContact O-N 3.4Å; L30-H33 VanDerWaalsContact O-N 3.11Å; E31-H33 PolarHBondContact O-N 3.48Å; H33-K36 PolarHBondContact O-N 3.44Å; H33-V37 PolarHBondContact O-N 2.81Å; H33-L98 PolarHBondContact CE1-O 3.45Å; H33-L98 PolarHBondContact NE2-O 2.93Å; H33-F216 HydrophobicContact CB-CE1 3.85Å; H33-F216 HydrophobicContact CB-CZ 4.16Å; H33-F216 AromaticContact CG-CE1 3.85Å; H33-F216 AromaticContact ND1-CE1 3.68Å
34	I	89.6	Confident	90.2	Very high	92 Å²	92	87.3 Å²	87.3	47%	0.472	40%	0.403	S	S	.	.	H	α-helix	trans	-57.2	-51.4	173.3	-70.2	163.4	0	0	0	109.1	L30 K36 V37 D38	L30-I34 WeakPolarHBondContact O-CB 3.39Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.19Å; L30-I34 PolarHBondContact O-N 2.61Å; I34-K36 PolarHBondContact O-N 3.02Å; I34-V37 WeakPolarHBondContact O-CA 3.25Å; I34-V37 WeakPolarHBondContact O-CB 3.06Å; I34-V37 PolarHBondContact O-N 2.89Å; I34-D38 WeakPolarHBondContact CG2-OD2 3.43Å; I34-D38 VanDerWaalsContact O-CG 3.25Å; I34-D38 PolarHBondContact O-N 3.01Å
35	S	91.8	Very high	90.6	Very high	72 Å²	72	86 Å²	86	50%	0.503	40%	0.401	S	S	.	.	H	α-helix	trans	-55.2	-31.1	177.2	-178.5	0	0	0	0	114.2	E31 E39	E31-S35 PolarHBondContact O-N 3.34Å; E31-S35 VanDerWaalsContact O-N 3.14Å; S35-E39 PolarHBondContact O-N 2.88Å
36	K	91.5	Very high	90.9	Very high	42 Å²	42	82 Å²	82	18%	0.183	39%	0.393	C	S	.	.	H	α-helix	trans	-77.8	-36.1	174.5	-167.3	-174.9	176	-160.3	0	112.6	F32 H33 I34 D38 L40 E94 L98	F32-K36 PolarHBondContact O-N 2.99Å; H33-K36 PolarHBondContact O-N 3.44Å; I34-K36 PolarHBondContact O-N 3.02Å; K36-D38 VanDerWaalsContact C-N 3.32Å; K36-L40 WeakPolarHBondContact O-CG 3.33Å; K36-L40 PolarHBondContact O-N 3.01Å; K36-E94 WeakPolarHBondContact CE-OE1 3.48Å; K36-E94 IonicContact NZ-OE1 2.69Å; K36-E94 PolarHBondContact NZ-OE1 3.43Å; K36-L98 HydrophobicContact CB-CD1 4.47Å; K36-L98 HydrophobicContact CD-CD1 3.93Å; K36-L98 HydrophobicContact CD-CD2 4.17Å; K36-L98 HydrophobicContact CG-CD1 4.09Å
37	V	92.7	Very high	91.4	Very high	42 Å²	42	79.5 Å²	79.5	26%	0.255	38%	0.383	S	S	.	.	H	α-helix	trans	-64.8	-40.2	173.7	172.1	0	0	0	0	110.4	H33 I34 L40 Y41 L95 L98	H33-V37 PolarHBondContact O-N 2.81Å; I34-V37 WeakPolarHBondContact O-CA 3.25Å; I34-V37 WeakPolarHBondContact O-CB 3.06Å; I34-V37 PolarHBondContact O-N 2.89Å; V37-L40 PolarHBondContact O-N 3.18Å; V37-Y41 WeakPolarHBondContact O-CB 3.46Å; V37-Y41 PolarHBondContact O-N 3.06Å; V37-L95 HydrophobicContact CG1-CD1 3.95Å; V37-L95 HydrophobicContact CG2-CD1 4.08Å; V37-L98 HydrophobicContact CG2-CB 4.39Å; V37-L98 HydrophobicContact CG2-CD1 3.94Å
38	D	92.4	Very high	91.8	Very high	82 Å²	82	76.6 Å²	76.6	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-64.1	-46.1	177	-59.7	-29.3	0	0	0	111.8	I34 K36 L40 Y41 E42	I34-D38 WeakPolarHBondContact CG2-OD2 3.43Å; I34-D38 VanDerWaalsContact O-CG 3.25Å; I34-D38 PolarHBondContact O-N 3.01Å; K36-D38 VanDerWaalsContact C-N 3.32Å; D38-L40 VanDerWaalsContact C-N 3.31Å; D38-L40 PolarHBondContact O-N 3.08Å; D38-Y41 WeakPolarHBondContact O-CB 3.43Å; D38-Y41 PolarHBondContact O-N 2.99Å; D38-Y41 VanDerWaalsContact O-N 3.09Å; D38-E42 PolarHBondContact O-N 3.22Å
39	E	93.7	Very high	92.1	Very high	136 Å²	136	79.4 Å²	79.4	64%	0.636	38%	0.383	S	S	*	.	H	α-helix	trans	-56.4	-44	174.8	-176.4	-175.9	-171.9	0	0	111.9	S35 A43	S35-E39 PolarHBondContact O-N 2.88Å; E39-A43 WeakPolarHBondContact O-CB 3.33Å; E39-A43 PolarHBondContact O-N 3.37Å
40	L	94.2	Very high	92.5	Very high	17 Å²	17	78.5 Å²	78.5	9%	0.089	39%	0.385	C	S	.	.	H	α-helix	trans	-67.6	-35.2	176.3	-72.5	168.6	0	0	0	112.3	K36 V37 D38 F44 F91 E94 L98	K36-L40 WeakPolarHBondContact O-CG 3.33Å; K36-L40 PolarHBondContact O-N 3.01Å; V37-L40 PolarHBondContact O-N 3.18Å; D38-L40 VanDerWaalsContact C-N 3.31Å; D38-L40 PolarHBondContact O-N 3.08Å; L40-F44 VanDerWaalsContact O-CB 3.25Å; L40-F44 WeakPolarHBondContact O-CB 3.27Å; L40-F44 PolarHBondContact O-N 2.72Å; L40-F91 HydrophobicContact CD2-CD1 3.95Å; L40-F91 HydrophobicContact CD2-CE1 4.48Å; L40-E94 HydrophobicContact CD1-CB 4.44Å; L40-E94 HydrophobicContact CD1-CG 3.94Å; L40-E94 HydrophobicContact CD2-CB 4.38Å; L40-E94 HydrophobicContact CD2-CG 4.23Å; L40-L98 HydrophobicContact CD1-CD1 3.49Å; L40-L98 VanDerWaalsContact CD1-CD1 3.49Å
41	Y	93.1	Very high	92.8	Very high	141 Å²	141	78 Å²	78	55%	0.553	38%	0.381	S	S	*	.	H	α-helix	trans	-68.5	-44	176.5	-178	-116.4	0	0	0	111.9	V37 D38 A43 F44 C45	V37-Y41 WeakPolarHBondContact O-CB 3.46Å; V37-Y41 PolarHBondContact O-N 3.06Å; D38-Y41 WeakPolarHBondContact O-CB 3.43Å; D38-Y41 PolarHBondContact O-N 2.99Å; D38-Y41 VanDerWaalsContact O-N 3.09Å; Y41-A43 PolarHBondContact O-N 3.36Å; Y41-F44 PolarHBondContact O-N 3.5Å; Y41-C45 WeakPolarHBondContact O-CB 3.24Å; Y41-C45 PolarHBondContact O-N 3.22Å; Y41-C45 PolarHBondContact O-SG 2.94Å; Y41-C45 VanDerWaalsContact O-SG 3.32Å
42	E	94.5	Very high	93	Very high	136 Å²	136	76 Å²	76	64%	0.636	37%	0.373	S	S	*	.	H	α-helix	trans	-59	-47.9	172.6	-72.9	-164.9	175.4	0	0	111.5	D38 F44 C45 I46	D38-E42 PolarHBondContact O-N 3.22Å; E42-F44 VanDerWaalsContact C-N 3.35Å; E42-F44 PolarHBondContact O-N 2.89Å; E42-C45 PolarHBondContact O-N 3.41Å; E42-I46 WeakPolarHBondContact O-CG1 3.45Å; E42-I46 PolarHBondContact O-N 3.08Å
43	A	94.1	Very high	93.2	Very high	32 Å²	32	70.2 Å²	70.2	26%	0.264	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-42.5	178.5	0	0	0	0	0	112.1	E39 Y41 Q47 F91	E39-A43 WeakPolarHBondContact O-CB 3.33Å; E39-A43 PolarHBondContact O-N 3.37Å; Y41-A43 PolarHBondContact O-N 3.36Å; A43-Q47 VanDerWaalsContact O-CB 3.29Å; A43-Q47 WeakPolarHBondContact O-CB 3.41Å; A43-Q47 PolarHBondContact O-N 2.97Å; A43-F91 HydrophobicContact CB-CD1 4.45Å; A43-F91 HydrophobicContact CB-CE1 3.77Å; A43-F91 HydrophobicContact CB-CE2 4.37Å; A43-F91 HydrophobicContact CB-CZ 3.73Å
44	F	94.4	Very high	93.5	Very high	55 Å²	55	68.8 Å²	68.8	24%	0.241	35%	0.349	C	S	.	.	H	α-helix	trans	-63.7	-43.9	174.5	-178.6	-93.1	0	0	0	112.1	L40 Y41 E42 Q47 S48 M88 F91 E92	L40-F44 VanDerWaalsContact O-CB 3.25Å; L40-F44 WeakPolarHBondContact O-CB 3.27Å; L40-F44 PolarHBondContact O-N 2.72Å; Y41-F44 PolarHBondContact O-N 3.5Å; E42-F44 VanDerWaalsContact C-N 3.35Å; E42-F44 PolarHBondContact O-N 2.89Å; F44-Q47 PolarHBondContact O-N 3.45Å; F44-S48 WeakPolarHBondContact O-CB 3.36Å; F44-S48 PolarHBondContact O-N 3.34Å; F44-M88 HydrophobicContact CD2-CB 4.42Å; F44-M88 HydrophobicContact CD2-CE 4.22Å; F44-M88 HydrophobicContact CD2-CG 4.39Å; F44-M88 HydrophobicContact CE1-CE 3.86Å; F44-M88 HydrophobicContact CE2-CB 4.01Å; F44-M88 HydrophobicContact CE2-CE 3.46Å; F44-M88 VanDerWaalsContact CE2-CE 3.46Å; F44-M88 HydrophobicContact CE2-CG 4.17Å; F44-M88 HydrophobicContact CZ-CE 3.26Å; F44-F91 HydrophobicContact CB-CB 4.42Å; F44-F91 HydrophobicContact CB-CD2 4.44Å; F44-F91 HydrophobicContact CD2-CB 3.99Å; F44-F91 HydrophobicContact CD2-CD2 4.47Å; F44-E92 HydrophobicContact CE2-CG 3.96Å
45	C	93.8	Very high	93.6	Very high	42 Å²	42	67.2 Å²	67.2	28%	0.284	34%	0.341	S	S	.	.	H	α-helix	trans	-62.2	-43.7	177.2	-78.7	0	0	0	0	112.4	Y41 E42 S48 R49	Y41-C45 WeakPolarHBondContact O-CB 3.24Å; Y41-C45 PolarHBondContact O-N 3.22Å; Y41-C45 PolarHBondContact O-SG 2.94Å; Y41-C45 VanDerWaalsContact O-SG 3.32Å; E42-C45 PolarHBondContact O-N 3.41Å; C45-S48 PolarHBondContact O-N 3.1Å; C45-R49 WeakPolarHBondContact O-CG 3.5Å; C45-R49 PolarHBondContact O-N 2.96Å; C45-R49 VanDerWaalsContact O-N 3.09Å
46	I	94.1	Very high	93.7	Very high	95 Å²	95	71.5 Å²	71.5	49%	0.487	35%	0.346	S	S	.	.	H	α-helix	trans	-60.8	-46.2	172.3	-67.3	164.8	0	0	0	110.1	E42 S48 R49 L50	E42-I46 WeakPolarHBondContact O-CG1 3.45Å; E42-I46 PolarHBondContact O-N 3.08Å; I46-S48 PolarHBondContact O-N 2.86Å; I46-R49 PolarHBondContact O-N 3.27Å; I46-L50 HydrophobicContact CG2-CD1 4.3Å; I46-L50 WeakPolarHBondContact O-CG 3.19Å; I46-L50 PolarHBondContact O-N 3.05Å; I46-L50 VanDerWaalsContact O-N 3.1Å
47	Q	94	Very high	93.8	Very high	15 Å²	15	73.9 Å²	73.9	7%	0.07	36%	0.359	C	S	.	.	H	α-helix	trans	-66.9	-35.6	-177.7	-173.4	56.7	99.7	0	0	112.8	A43 F44 L50 K51 N87 M88 F91	A43-Q47 VanDerWaalsContact O-CB 3.29Å; A43-Q47 WeakPolarHBondContact O-CB 3.41Å; A43-Q47 PolarHBondContact O-N 2.97Å; F44-Q47 PolarHBondContact O-N 3.45Å; Q47-L50 PolarHBondContact O-N 3.3Å; Q47-K51 PolarHBondContact O-N 2.69Å; Q47-N87 HydrophobicContact CG-CB 3.84Å; Q47-N87 VanDerWaalsContact OE1-CB 3.29Å; Q47-N87 PolarHBondContact OE1-ND2 2.69Å; Q47-M88 HydrophobicContact CB-CG 4.44Å; Q47-M88 HydrophobicContact CG-CG 3.86Å; Q47-F91 HydrophobicContact CB-CD2 4.38Å; Q47-F91 HydrophobicContact CB-CE2 3.87Å; Q47-F91 HydrophobicContact CG-CE2 4.07Å
48	S	93.1	Very high	93.7	Very high	37 Å²	37	75.7 Å²	75.7	26%	0.259	36%	0.363	S	S	.	.	H	α-helix	trans	-63.9	-47.5	173.7	-168.6	0	0	0	0	111.4	F44 C45 I46 L50 K51 D52	F44-S48 WeakPolarHBondContact O-CB 3.36Å; F44-S48 PolarHBondContact O-N 3.34Å; C45-S48 PolarHBondContact O-N 3.1Å; I46-S48 PolarHBondContact O-N 2.86Å; S48-L50 VanDerWaalsContact C-N 3.27Å; S48-L50 PolarHBondContact O-N 3.5Å; S48-K51 WeakPolarHBondContact O-CB 3.49Å; S48-K51 PolarHBondContact O-N 2.69Å; S48-K51 VanDerWaalsContact O-N 3.07Å; S48-D52 PolarHBondContact O-N 2.94Å
49	R	96.1	Very high	93.6	Very high	196 Å²	196	77.4 Å²	77.4	74%	0.74	37%	0.369	S	S	*	.	H	α-helix	trans	-59.1	-36.2	175.5	-70.4	168.1	67.6	-174.3	3.8	112.7	C45 I46 G53	C45-R49 WeakPolarHBondContact O-CG 3.5Å; C45-R49 PolarHBondContact O-N 2.96Å; C45-R49 VanDerWaalsContact O-N 3.09Å; I46-R49 PolarHBondContact O-N 3.27Å; R49-G53 PolarHBondContact O-N 3.41Å
50	L	94.7	Very high	93.5	Very high	78 Å²	78	73.4 Å²	73.4	41%	0.408	36%	0.358	S	S	.	.	H	α-helix	trans	-68.8	-39	174.6	-71	172.6	0	0	0	112.8	I46 Q47 S48 G53 A54 Y84	I46-L50 HydrophobicContact CG2-CD1 4.3Å; I46-L50 WeakPolarHBondContact O-CG 3.19Å; I46-L50 PolarHBondContact O-N 3.05Å; I46-L50 VanDerWaalsContact O-N 3.1Å; Q47-L50 PolarHBondContact O-N 3.3Å; S48-L50 VanDerWaalsContact C-N 3.27Å; S48-L50 PolarHBondContact O-N 3.5Å; L50-G53 PolarHBondContact O-N 3.32Å; L50-A54 PolarHBondContact O-N 3.47Å; L50-Y84 HydrophobicContact CB-CD2 4Å; L50-Y84 HydrophobicContact CB-CE1 4.4Å; L50-Y84 HydrophobicContact CB-CE2 3.83Å; L50-Y84 HydrophobicContact CB-CG 4.36Å; L50-Y84 HydrophobicContact CD1-CE1 4.45Å; L50-Y84 WeakPolarHBondContact O-CD2 3.41Å; L50-Y84 WeakPolarHBondContact O-CE2 3.18Å
51	K	94.7	Very high	93.3	Very high	44 Å²	44	75.6 Å²	75.6	19%	0.191	37%	0.367	C	S	.	.	H	α-helix	trans	-62	-45.6	173.8	178.9	-177	172.4	-169.7	0	111.5	Q47 S48 A54 I55 Y81 M88	Q47-K51 PolarHBondContact O-N 2.69Å; S48-K51 WeakPolarHBondContact O-CB 3.49Å; S48-K51 PolarHBondContact O-N 2.69Å; S48-K51 VanDerWaalsContact O-N 3.07Å; K51-A54 WeakPolarHBondContact O-CA 3.48Å; K51-A54 WeakPolarHBondContact O-CB 3.42Å; K51-A54 PolarHBondContact O-N 3.18Å; K51-A54 VanDerWaalsContact O-N 3.11Å; K51-I55 WeakPolarHBondContact O-CG1 3.25Å; K51-I55 PolarHBondContact O-N 2.75Å; K51-Y81 HydrophobicContact CD-CE2 4.49Å; K51-Y81 HydrophobicContact CG-CD2 3.97Å; K51-Y81 HydrophobicContact CG-CE2 3.72Å; K51-M88 HydrophobicContact CB-SD 4.43Å; K51-M88 HydrophobicContact CD-SD 3.29Å; K51-M88 WeakPolarHBondContact CD-SD 3.37Å; K51-M88 PolarHBondContact NZ-SD 3.29Å; K51-M88 VanDerWaalsContact NZ-SD 3.44Å
52	D	93.2	Very high	93	Very high	64 Å²	64	72.6 Å²	72.6	34%	0.342	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-41.3	175.2	-84.8	11.1	0	0	0	112.6	S48 A54 I55 R56	S48-D52 PolarHBondContact O-N 2.94Å; D52-A54 VanDerWaalsContact C-N 3.26Å; D52-A54 PolarHBondContact O-N 3.35Å; D52-I55 PolarHBondContact O-N 3.42Å; D52-I55 VanDerWaalsContact O-N 3.14Å; D52-R56 WeakPolarHBondContact O-CG 3.14Å; D52-R56 PolarHBondContact O-N 3.12Å; D52-R56 IonicContact OD2-NH2 2.7Å
53	G	94.5	Very high	92.7	Very high	26 Å²	26	71 Å²	71	27%	0.268	37%	0.371	S	S	.	.	H	α-helix	trans	-55.7	-41.6	170.4	0	0	0	0	0	112.2	R49 L50 R56 M57	R49-G53 PolarHBondContact O-N 3.41Å; L50-G53 PolarHBondContact O-N 3.32Å; G53-R56 PolarHBondContact O-N 3.12Å; G53-M57 WeakPolarHBondContact O-CB 3.47Å; G53-M57 WeakPolarHBondContact O-CE 3.42Å; G53-M57 WeakPolarHBondContact O-CG 3.42Å; G53-M57 PolarHBondContact O-N 3.43Å
54	A	93.8	Very high	92.2	Very high	1 Å²	1	72 Å²	72	1%	0.008	38%	0.376	C	S	.	.	H	α-helix	trans	-68.1	-36.5	175	0	0	0	0	0	113.2	L50 K51 D52 K58 V77 Y81 Y84	L50-A54 PolarHBondContact O-N 3.47Å; K51-A54 WeakPolarHBondContact O-CA 3.48Å; K51-A54 WeakPolarHBondContact O-CB 3.42Å; K51-A54 PolarHBondContact O-N 3.18Å; K51-A54 VanDerWaalsContact O-N 3.11Å; D52-A54 VanDerWaalsContact C-N 3.26Å; D52-A54 PolarHBondContact O-N 3.35Å; A54-K58 VanDerWaalsContact O-CB 3.24Å; A54-K58 WeakPolarHBondContact O-CB 3.3Å; A54-K58 PolarHBondContact O-N 3.44Å; A54-V77 HydrophobicContact CB-CG1 4.17Å; A54-V77 WeakPolarHBondContact O-CG1 3.38Å; A54-Y81 HydrophobicContact CB-CD2 4.48Å; A54-Y84 HydrophobicContact CB-CD2 4.18Å; A54-Y84 HydrophobicContact CB-CE2 4.23Å
55	I	91.8	Very high	91.9	Very high	58 Å²	58	74.2 Å²	74.2	30%	0.297	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-50.3	172.4	-64.5	169.5	0	0	0	110.3	K51 D52 K58 Q59 Y81	K51-I55 WeakPolarHBondContact O-CG1 3.25Å; K51-I55 PolarHBondContact O-N 2.75Å; D52-I55 PolarHBondContact O-N 3.42Å; D52-I55 VanDerWaalsContact O-N 3.14Å; I55-K58 WeakPolarHBondContact O-CB 3.41Å; I55-K58 PolarHBondContact O-N 3.41Å; I55-Q59 WeakPolarHBondContact O-CG 3.49Å; I55-Q59 PolarHBondContact O-N 3.47Å; I55-Y81 HydrophobicContact CD1-CE2 3.9Å; I55-Y81 HydrophobicContact CG1-CD2 3.82Å; I55-Y81 HydrophobicContact CG1-CE2 3.55Å
56	R	94.3	Very high	91.5	Very high	163 Å²	163	76.5 Å²	76.5	62%	0.615	41%	0.413	S	S	*	.	H	α-helix	trans	-64	-42.6	-178.8	-64.3	172.7	-158.1	179.4	7.5	111.7	D52 G53 K58 Q59 A60	D52-R56 WeakPolarHBondContact O-CG 3.14Å; D52-R56 PolarHBondContact O-N 3.12Å; D52-R56 IonicContact OD2-NH2 2.7Å; G53-R56 PolarHBondContact O-N 3.12Å; R56-K58 PolarHBondContact O-N 3.45Å; R56-Q59 PolarHBondContact O-N 3.06Å; R56-A60 WeakPolarHBondContact O-CB 3.43Å; R56-A60 PolarHBondContact O-N 3.39Å
57	M	92.9	Very high	91.4	Very high	92 Å²	92	75.6 Å²	75.6	45%	0.453	41%	0.412	S	S	.	.	H	α-helix	trans	-61.2	-42.2	172.4	-77.1	-172.1	-76.9	0	0	112.3	G53 Q59 A60 F61 V77	G53-M57 WeakPolarHBondContact O-CB 3.47Å; G53-M57 WeakPolarHBondContact O-CE 3.42Å; G53-M57 WeakPolarHBondContact O-CG 3.42Å; G53-M57 PolarHBondContact O-N 3.43Å; M57-Q59 VanDerWaalsContact C-N 3.33Å; M57-Q59 PolarHBondContact O-N 3.21Å; M57-A60 PolarHBondContact O-N 3.48Å; M57-F61 HydrophobicContact CB-CD2 4.37Å; M57-F61 HydrophobicContact CB-CE2 4.22Å; M57-F61 WeakPolarHBondContact O-CD2 3.48Å; M57-F61 PolarHBondContact O-N 3.24Å; M57-V77 HydrophobicContact CB-CG1 4.06Å; M57-V77 HydrophobicContact CB-CG2 4.16Å
58	K	90.6	Very high	91.2	Very high	79 Å²	79	82.2 Å²	82.2	34%	0.343	44%	0.44	S	S	.	.	H	α-helix	trans	-62.2	-39.9	177.5	176.2	175	171.5	170.8	0	111.8	A54 I55 R56 S62 V77 N78	A54-K58 VanDerWaalsContact O-CB 3.24Å; A54-K58 WeakPolarHBondContact O-CB 3.3Å; A54-K58 PolarHBondContact O-N 3.44Å; I55-K58 WeakPolarHBondContact O-CB 3.41Å; I55-K58 PolarHBondContact O-N 3.41Å; R56-K58 PolarHBondContact O-N 3.45Å; K58-S62 VanDerWaalsContact O-CB 3.25Å; K58-S62 WeakPolarHBondContact O-CB 3.22Å; K58-S62 PolarHBondContact O-N 2.74Å; K58-S62 VanDerWaalsContact O-N 3.15Å; K58-S62 PolarHBondContact O-OG 2.74Å; K58-V77 HydrophobicContact CB-CG1 3.9Å; K58-N78 WeakPolarHBondContact CD-OD1 3.33Å; K58-N78 VanDerWaalsContact CE-OD1 3.26Å; K58-N78 WeakPolarHBondContact CE-OD1 3.34Å; K58-N78 PolarHBondContact NZ-OD1 2.9Å
59	Q	90.8	Very high	90.9	Very high	119 Å²	119	82 Å²	82	56%	0.556	44%	0.444	S	S	*	.	H	α-helix	trans	-63	-52.9	173	-70.6	166	-29	0	0	110.9	I55 R56 M57 F61 S62 S63	I55-Q59 WeakPolarHBondContact O-CG 3.49Å; I55-Q59 PolarHBondContact O-N 3.47Å; R56-Q59 PolarHBondContact O-N 3.06Å; M57-Q59 VanDerWaalsContact C-N 3.33Å; M57-Q59 PolarHBondContact O-N 3.21Å; Q59-F61 PolarHBondContact O-N 2.98Å; Q59-S62 CarbonylContact O-C 3.41Å; Q59-S62 WeakPolarHBondContact O-CA 3.41Å; Q59-S62 WeakPolarHBondContact O-CB 3.48Å; Q59-S62 PolarHBondContact O-N 3.49Å; Q59-S63 PolarHBondContact O-N 3.31Å; Q59-S63 PolarHBondContact O-OG 3.33Å
60	A	90.3	Very high	90.4	Very high	51 Å²	51	73.5 Å²	73.5	42%	0.421	41%	0.414	S	S	.	.	H	α-helix	trans	-60.8	-38.3	-178.7	0	0	0	0	0	114	R56 M57 S62 S63 S64	R56-A60 WeakPolarHBondContact O-CB 3.43Å; R56-A60 PolarHBondContact O-N 3.39Å; M57-A60 PolarHBondContact O-N 3.48Å; A60-S62 VanDerWaalsContact C-N 3.32Å; A60-S63 PolarHBondContact O-OG 3Å; A60-S63 VanDerWaalsContact O-OG 3.07Å; A60-S64 WeakPolarHBondContact O-CB 3.27Å; A60-S64 PolarHBondContact O-N 3.38Å; A60-S64 PolarHBondContact O-OG 2.97Å
61	F	90	Very high	90.1	Very high	63 Å²	63	75.9 Å²	75.9	28%	0.276	42%	0.421	S	S	.	.	H	α-helix	trans	-72.1	-25.8	173	-70.3	-57	0	0	0	112.8	M57 Q59 S64 T70 I74 V77	M57-F61 HydrophobicContact CB-CD2 4.37Å; M57-F61 HydrophobicContact CB-CE2 4.22Å; M57-F61 WeakPolarHBondContact O-CD2 3.48Å; M57-F61 PolarHBondContact O-N 3.24Å; Q59-F61 PolarHBondContact O-N 2.98Å; F61-S64 PolarHBondContact O-N 3.48Å; F61-T70 HydrophobicContact CB-CG2 4.17Å; F61-T70 HydrophobicContact CD1-CG2 4.31Å; F61-T70 WeakPolarHBondContact O-CG2 3.48Å; F61-I74 HydrophobicContact CB-CD1 4.02Å; F61-I74 HydrophobicContact CB-CG1 3.51Å; F61-I74 HydrophobicContact CG-CG1 4.41Å; F61-V77 HydrophobicContact CD2-CG2 4.17Å; F61-V77 HydrophobicContact CE2-CG2 3.94Å
62	S	87.3	Confident	90	Very high	79 Å²	79	79.1 Å²	79.1	55%	0.552	44%	0.437	S	S	*	.	H	α-helix	trans	-80.8	-27.2	178.6	-60.1	0	0	0	0	112.9	K58 Q59 A60	K58-S62 VanDerWaalsContact O-CB 3.25Å; K58-S62 WeakPolarHBondContact O-CB 3.22Å; K58-S62 PolarHBondContact O-N 2.74Å; K58-S62 VanDerWaalsContact O-N 3.15Å; K58-S62 PolarHBondContact O-OG 2.74Å; Q59-S62 CarbonylContact O-C 3.41Å; Q59-S62 WeakPolarHBondContact O-CA 3.41Å; Q59-S62 WeakPolarHBondContact O-CB 3.48Å; Q59-S62 PolarHBondContact O-N 3.49Å; A60-S62 VanDerWaalsContact C-N 3.32Å
63	S	87.8	Confident	90	Very high	102 Å²	102	78.2 Å²	78.2	71%	0.713	44%	0.436	S	S	*	.	H	α-helix	trans	-81.4	-14.7	167.3	57.7	0	0	0	0	113.3	Q59 A60	Q59-S63 PolarHBondContact O-N 3.31Å; Q59-S63 PolarHBondContact O-OG 3.33Å; A60-S63 PolarHBondContact O-OG 3Å; A60-S63 VanDerWaalsContact O-OG 3.07Å
64	S	84.6	Confident	89.8	Confident	52 Å²	52	79 Å²	79	36%	0.364	43%	0.433	S	S	.	.	S	Bend	trans	-77.6	152.5	177	-67.7	0	0	0	0	112.4	A60 F61 S66	A60-S64 WeakPolarHBondContact O-CB 3.27Å; A60-S64 PolarHBondContact O-N 3.38Å; A60-S64 PolarHBondContact O-OG 2.97Å; F61-S64 PolarHBondContact O-N 3.48Å; S64-S66 PolarHBondContact O-N 3.14Å
65	P	87.3	Confident	89.8	Confident	102 Å²	102	82 Å²	82	66%	0.662	46%	0.458	S	S	*	.			trans	-52.7	135.4	174.1	-27.8	35.7	0	0	0	113	T67 T70	P65-T67 VanDerWaalsContact C-N 3.25Å; P65-T67 PolarHBondContact O-N 2.83Å; P65-T70 PolarHBondContact O-OG1 3.33Å
66	S	85.4	Confident	89.9	Confident	91 Å²	91	82.8 Å²	82.8	64%	0.636	46%	0.46	S	S	*	.			trans	-71.8	68.3	-176	160.6	0	0	0	0	112.9	S64 K71	S64-S66 PolarHBondContact O-N 3.14Å; S66-K71 WeakPolarHBondContact OG-CE 3.34Å; S66-K71 PolarHBondContact OG-NZ 3.46Å
67	T	91.4	Very high	89.9	Confident	76 Å²	76	75.7 Å²	75.7	47%	0.466	44%	0.435	S	S	.	.			trans	-79.5	170	170.2	82.1	0	0	0	0	111.4	P65 G69 T70 K71	P65-T67 VanDerWaalsContact C-N 3.25Å; P65-T67 PolarHBondContact O-N 2.83Å; T67-G69 PolarHBondContact OG1-N 3.16Å; T67-T70 PolarHBondContact N-OG1 3.39Å; T67-T70 PolarHBondContact O-N 3.17Å; T67-T70 PolarHBondContact OG1-N 3.12Å; T67-T70 PolarHBondContact OG1-OG1 3.45Å; T67-K71 WeakPolarHBondContact O-CG 3.42Å; T67-K71 PolarHBondContact O-N 3.4Å
68	K	89.9	Confident	89.9	Confident	153 Å²	153	73.9 Å²	73.9	67%	0.665	43%	0.427	S	S	*	.	H	α-helix	trans	-59.8	-48.1	171.5	-179.7	-178.3	164.5	-176.6	0	111.3	T70 K71 E72	K68-T70 VanDerWaalsContact C-N 3.34Å; K68-T70 PolarHBondContact O-N 3.45Å; K68-K71 PolarHBondContact O-N 2.89Å; K68-K71 VanDerWaalsContact O-N 3.14Å; K68-E72 VanDerWaalsContact CE-CD 3.44Å; K68-E72 WeakPolarHBondContact CE-OE1 3.45Å; K68-E72 IonicContact NZ-OE1 2.72Å; K68-E72 PolarHBondContact NZ-OE1 3.23Å; K68-E72 PolarHBondContact O-N 3.14Å; K68-E72 VanDerWaalsContact O-N 3.09Å
69	G	87.3	Confident	90.1	Very high	34 Å²	34	75.6 Å²	75.6	35%	0.351	43%	0.431	S	S	.	.	H	α-helix	trans	-60.7	-41.8	178.5	0	0	0	0	0	112.3	T67 K71 E72 S73	T67-G69 PolarHBondContact OG1-N 3.16Å; G69-K71 VanDerWaalsContact C-N 3.26Å; G69-K71 PolarHBondContact O-N 2.92Å; G69-E72 PolarHBondContact O-N 3.43Å; G69-E72 VanDerWaalsContact O-N 3.12Å; G69-S73 PolarHBondContact O-N 3.47Å; G69-S73 PolarHBondContact O-OG 3.5Å
70	T	86.2	Confident	90.3	Very high	17 Å²	17	74.1 Å²	74.1	10%	0.104	42%	0.421	C	S	.	.	H	α-helix	trans	-55.9	-41.9	175.5	-38.3	0	0	0	0	111.4	F61 P65 T67 K68 I74	F61-T70 HydrophobicContact CB-CG2 4.17Å; F61-T70 HydrophobicContact CD1-CG2 4.31Å; F61-T70 WeakPolarHBondContact O-CG2 3.48Å; P65-T70 PolarHBondContact O-OG1 3.33Å; T67-T70 PolarHBondContact N-OG1 3.39Å; T67-T70 PolarHBondContact O-N 3.17Å; T67-T70 PolarHBondContact OG1-N 3.12Å; T67-T70 PolarHBondContact OG1-OG1 3.45Å; K68-T70 VanDerWaalsContact C-N 3.34Å; K68-T70 PolarHBondContact O-N 3.45Å; T70-I74 HydrophobicContact CG2-CD1 4.22Å; T70-I74 WeakPolarHBondContact O-CB 3.5Å; T70-I74 WeakPolarHBondContact O-CD1 3.47Å; T70-I74 WeakPolarHBondContact O-CG1 3.46Å; T70-I74 PolarHBondContact O-N 2.97Å
71	K	88.9	Confident	90.5	Very high	127 Å²	127	75.3 Å²	75.3	55%	0.552	42%	0.415	S	S	*	.	H	α-helix	trans	-69.5	-37.6	178.1	-67.9	179.4	-176.2	-176.3	0	112.9	S66 T67 K68 G69 I74 A75	S66-K71 WeakPolarHBondContact OG-CE 3.34Å; S66-K71 PolarHBondContact OG-NZ 3.46Å; T67-K71 WeakPolarHBondContact O-CG 3.42Å; T67-K71 PolarHBondContact O-N 3.4Å; K68-K71 PolarHBondContact O-N 2.89Å; K68-K71 VanDerWaalsContact O-N 3.14Å; G69-K71 VanDerWaalsContact C-N 3.26Å; G69-K71 PolarHBondContact O-N 2.92Å; K71-I74 PolarHBondContact O-N 2.93Å; K71-A75 PolarHBondContact O-N 3.48Å
72	E	92.1	Very high	90.7	Very high	113 Å²	113	77.9 Å²	77.9	53%	0.528	43%	0.426	S	S	.	.	H	α-helix	trans	-67.4	-41.4	176	-70.1	169.8	156.2	0	0	110.9	K68 G69 A75 E76	K68-E72 VanDerWaalsContact CE-CD 3.44Å; K68-E72 WeakPolarHBondContact CE-OE1 3.45Å; K68-E72 IonicContact NZ-OE1 2.72Å; K68-E72 PolarHBondContact NZ-OE1 3.23Å; K68-E72 PolarHBondContact O-N 3.14Å; K68-E72 VanDerWaalsContact O-N 3.09Å; G69-E72 PolarHBondContact O-N 3.43Å; G69-E72 VanDerWaalsContact O-N 3.12Å; E72-A75 PolarHBondContact O-N 2.97Å; E72-E76 PolarHBondContact O-N 3.36Å; E72-E76 VanDerWaalsContact O-N 3.09Å
73	S	91.9	Very high	91.1	Very high	45 Å²	45	76.7 Å²	76.7	32%	0.315	41%	0.412	S	S	.	.	H	α-helix	trans	-62.3	-43.5	170.9	-59.9	0	0	0	0	112.7	G69 A75 E76 V77	G69-S73 PolarHBondContact O-N 3.47Å; G69-S73 PolarHBondContact O-OG 3.5Å; S73-A75 VanDerWaalsContact C-N 3.3Å; S73-A75 PolarHBondContact O-N 2.92Å; S73-E76 PolarHBondContact O-N 3.39Å; S73-V77 WeakPolarHBondContact O-CB 3.38Å; S73-V77 VanDerWaalsContact O-CG2 3.27Å; S73-V77 WeakPolarHBondContact O-CG2 3.26Å; S73-V77 PolarHBondContact O-N 3.36Å
74	I	91.5	Very high	91.5	Very high	42 Å²	42	73.7 Å²	73.7	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-60.7	-39.8	175	-71.7	165	0	0	0	110.9	F61 T70 K71 N78	F61-I74 HydrophobicContact CB-CD1 4.02Å; F61-I74 HydrophobicContact CB-CG1 3.51Å; F61-I74 HydrophobicContact CG-CG1 4.41Å; T70-I74 HydrophobicContact CG2-CD1 4.22Å; T70-I74 WeakPolarHBondContact O-CB 3.5Å; T70-I74 WeakPolarHBondContact O-CD1 3.47Å; T70-I74 WeakPolarHBondContact O-CG1 3.46Å; T70-I74 PolarHBondContact O-N 2.97Å; K71-I74 PolarHBondContact O-N 2.93Å; I74-N78 WeakPolarHBondContact CG2-ND2 3.4Å; I74-N78 WeakPolarHBondContact O-CB 3.3Å; I74-N78 PolarHBondContact O-N 3.01Å; I74-N78 PolarHBondContact O-ND2 3.37Å
75	A	92.4	Very high	91.9	Very high	63 Å²	63	73.2 Å²	73.2	52%	0.521	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-48.1	178.2	0	0	0	0	0	112.1	K71 E72 S73 N78 R79	K71-A75 PolarHBondContact O-N 3.48Å; E72-A75 PolarHBondContact O-N 2.97Å; S73-A75 VanDerWaalsContact C-N 3.3Å; S73-A75 PolarHBondContact O-N 2.92Å; A75-N78 PolarHBondContact O-N 2.95Å; A75-R79 PolarHBondContact O-N 2.66Å
76	E	94.3	Very high	92.3	Very high	76 Å²	76	73.4 Å²	73.4	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-64.6	-41.9	176.7	174.4	60.4	-172.5	0	0	111.9	E72 S73 N78 R79 R80	E72-E76 PolarHBondContact O-N 3.36Å; E72-E76 VanDerWaalsContact O-N 3.09Å; S73-E76 PolarHBondContact O-N 3.39Å; E76-N78 PolarHBondContact O-N 3.05Å; E76-R79 VanDerWaalsContact CD-NH2 3.31Å; E76-R79 WeakPolarHBondContact O-CB 3.45Å; E76-R79 PolarHBondContact O-N 2.88Å; E76-R79 VanDerWaalsContact O-N 3.12Å; E76-R79 IonicContact OE1-CZ 3.85Å; E76-R79 IonicContact OE1-NE 3.91Å; E76-R79 IonicContact OE1-NH2 2.66Å; E76-R79 PolarHBondContact OE1-NH2 3.33Å; E76-R79 IonicContact OE2-CZ 2.69Å; E76-R79 IonicContact OE2-NE 3.57Å; E76-R79 PolarHBondContact OE2-NE 3.46Å; E76-R79 IonicContact OE2-NH2 3.87Å; E76-R79 PolarHBondContact OE2-NH2 2.98Å; E76-R79 VanDerWaalsContact OE2-NH2 3.07Å; E76-R80 WeakPolarHBondContact O-CG 3.44Å; E76-R80 PolarHBondContact O-N 3.33Å; E76-R80 IonicContact OE1-CZ 3.32Å; E76-R80 IonicContact OE1-NE 3.63Å; E76-R80 PolarHBondContact OE1-NE 2.91Å; E76-R80 IonicContact OE1-NH2 2.87Å
77	V	94.8	Very high	92.7	Very high	13 Å²	13	72.1 Å²	72.1	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-64.9	-38	177.5	172.6	0	0	0	0	111.8	A54 M57 K58 F61 S73 R79 R80 Y81	A54-V77 HydrophobicContact CB-CG1 4.17Å; A54-V77 WeakPolarHBondContact O-CG1 3.38Å; M57-V77 HydrophobicContact CB-CG1 4.06Å; M57-V77 HydrophobicContact CB-CG2 4.16Å; K58-V77 HydrophobicContact CB-CG1 3.9Å; F61-V77 HydrophobicContact CD2-CG2 4.17Å; F61-V77 HydrophobicContact CE2-CG2 3.94Å; S73-V77 WeakPolarHBondContact O-CB 3.38Å; S73-V77 VanDerWaalsContact O-CG2 3.27Å; S73-V77 WeakPolarHBondContact O-CG2 3.26Å; S73-V77 PolarHBondContact O-N 3.36Å; V77-R79 VanDerWaalsContact C-N 3.34Å; V77-R80 PolarHBondContact O-N 3.25Å; V77-Y81 VanDerWaalsContact O-CB 3.31Å; V77-Y81 WeakPolarHBondContact O-CB 3.34Å; V77-Y81 PolarHBondContact O-N 2.9Å
78	N	93.1	Very high	92.8	Very high	55 Å²	55	69 Å²	69	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-66.4	-36.3	172	-80.3	-75.7	0	0	0	112.1	K58 I74 A75 E76 K82	K58-N78 WeakPolarHBondContact CD-OD1 3.33Å; K58-N78 VanDerWaalsContact CE-OD1 3.26Å; K58-N78 WeakPolarHBondContact CE-OD1 3.34Å; K58-N78 PolarHBondContact NZ-OD1 2.9Å; I74-N78 WeakPolarHBondContact CG2-ND2 3.4Å; I74-N78 WeakPolarHBondContact O-CB 3.3Å; I74-N78 PolarHBondContact O-N 3.01Å; I74-N78 PolarHBondContact O-ND2 3.37Å; A75-N78 PolarHBondContact O-N 2.95Å; E76-N78 PolarHBondContact O-N 3.05Å; N78-K82 PolarHBondContact O-N 2.91Å
79	R	95.9	Very high	92.9	Very high	115 Å²	115	64.7 Å²	64.7	43%	0.434	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-46.1	174.7	-165	-171.1	66.7	69	1.6	111.2	A75 E76 V77 K82 E83	A75-R79 PolarHBondContact O-N 2.66Å; E76-R79 VanDerWaalsContact CD-NH2 3.31Å; E76-R79 WeakPolarHBondContact O-CB 3.45Å; E76-R79 PolarHBondContact O-N 2.88Å; E76-R79 VanDerWaalsContact O-N 3.12Å; E76-R79 IonicContact OE1-CZ 3.85Å; E76-R79 IonicContact OE1-NE 3.91Å; E76-R79 IonicContact OE1-NH2 2.66Å; E76-R79 PolarHBondContact OE1-NH2 3.33Å; E76-R79 IonicContact OE2-CZ 2.69Å; E76-R79 IonicContact OE2-NE 3.57Å; E76-R79 PolarHBondContact OE2-NE 3.46Å; E76-R79 IonicContact OE2-NH2 3.87Å; E76-R79 PolarHBondContact OE2-NH2 2.98Å; E76-R79 VanDerWaalsContact OE2-NH2 3.07Å; V77-R79 VanDerWaalsContact C-N 3.34Å; R79-K82 PolarHBondContact O-N 3.06Å; R79-E83 IonicContact CZ-OE2 2.76Å; R79-E83 IonicContact NH1-OE2 3.24Å; R79-E83 PolarHBondContact NH1-OE2 3.13Å; R79-E83 IonicContact NH2-OE2 3.47Å; R79-E83 WeakPolarHBondContact O-CB 3.23Å; R79-E83 PolarHBondContact O-N 3.44Å
80	R	94.4	Very high	93.2	Very high	87 Å²	87	65.9 Å²	65.9	33%	0.328	33%	0.334	S	S	.	.	H	α-helix	trans	-64.7	-44.2	175.4	-67.9	-56.5	-173.6	168.7	8.5	112.6	E76 V77 K82 E83 Y84	E76-R80 WeakPolarHBondContact O-CG 3.44Å; E76-R80 PolarHBondContact O-N 3.33Å; E76-R80 IonicContact OE1-CZ 3.32Å; E76-R80 IonicContact OE1-NE 3.63Å; E76-R80 PolarHBondContact OE1-NE 2.91Å; E76-R80 IonicContact OE1-NH2 2.87Å; V77-R80 PolarHBondContact O-N 3.25Å; R80-K82 VanDerWaalsContact C-N 3.25Å; R80-K82 PolarHBondContact O-N 3Å; R80-E83 WeakPolarHBondContact CD-OE2 3.46Å; R80-E83 IonicContact CZ-OE1 3.7Å; R80-E83 IonicContact CZ-OE2 3.33Å; R80-E83 IonicContact NE-OE2 2.74Å; R80-E83 VanDerWaalsContact NH1-CD 3.32Å; R80-E83 IonicContact NH1-OE1 2.67Å; R80-E83 PolarHBondContact NH1-OE1 2.74Å; R80-E83 IonicContact NH1-OE2 3.07Å; R80-E83 PolarHBondContact NH1-OE2 3.3Å; R80-E83 VanDerWaalsContact NH1-OE2 3.1Å; R80-E83 WeakPolarHBondContact O-CB 3.4Å; R80-E83 PolarHBondContact O-N 3.22Å; R80-Y84 HydrophobicContact CB-CD2 4.37Å; R80-Y84 HydrophobicContact CB-CE2 3.86Å; R80-Y84 WeakPolarHBondContact O-CB 3.48Å; R80-Y84 VanDerWaalsContact O-CD2 3.22Å; R80-Y84 WeakPolarHBondContact O-CD2 3.46Å; R80-Y84 PolarHBondContact O-N 3.26Å
81	Y	93.7	Very high	93.5	Very high	77 Å²	77	67.5 Å²	67.5	30%	0.302	34%	0.34	S	S	.	.	H	α-helix	trans	-56.1	-40.7	174.3	174.4	-95.2	0	0	0	112.4	K51 A54 I55 V77 T85	K51-Y81 HydrophobicContact CD-CE2 4.49Å; K51-Y81 HydrophobicContact CG-CD2 3.97Å; K51-Y81 HydrophobicContact CG-CE2 3.72Å; A54-Y81 HydrophobicContact CB-CD2 4.48Å; I55-Y81 HydrophobicContact CD1-CE2 3.9Å; I55-Y81 HydrophobicContact CG1-CD2 3.82Å; I55-Y81 HydrophobicContact CG1-CE2 3.55Å; V77-Y81 VanDerWaalsContact O-CB 3.31Å; V77-Y81 WeakPolarHBondContact O-CB 3.34Å; V77-Y81 PolarHBondContact O-N 2.9Å; Y81-T85 WeakPolarHBondContact O-CB 3.37Å; Y81-T85 PolarHBondContact O-N 3.49Å; Y81-T85 PolarHBondContact O-OG1 3.13Å
82	K	95	Very high	93.6	Very high	116 Å²	116	64 Å²	64	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-66.5	-51.1	175.1	-175.7	-179.7	174.4	-71.6	0	111.5	N78 R79 R80 Y84 T85 E86	N78-K82 PolarHBondContact O-N 2.91Å; R79-K82 PolarHBondContact O-N 3.06Å; R80-K82 VanDerWaalsContact C-N 3.25Å; R80-K82 PolarHBondContact O-N 3Å; K82-Y84 VanDerWaalsContact C-N 3.31Å; K82-Y84 PolarHBondContact O-N 3.32Å; K82-T85 PolarHBondContact O-N 3.01Å; K82-T85 VanDerWaalsContact O-N 3.09Å; K82-E86 WeakPolarHBondContact CE-OE1 3.39Å; K82-E86 IonicContact NZ-OE1 2.84Å; K82-E86 PolarHBondContact NZ-OE1 2.87Å; K82-E86 IonicContact NZ-OE2 3.8Å; K82-E86 PolarHBondContact NZ-OE2 3.16Å; K82-E86 WeakPolarHBondContact O-CG 3.35Å; K82-E86 PolarHBondContact O-N 3.13Å
83	E	95.6	Very high	93.5	Very high	55 Å²	55	61.4 Å²	61.4	26%	0.257	32%	0.32	S	S	.	.	H	α-helix	trans	-52.3	-46.9	175.8	-172.6	-177.3	145.4	0	0	111.6	R79 R80 T85 E86 N87	R79-E83 IonicContact CZ-OE2 2.76Å; R79-E83 IonicContact NH1-OE2 3.24Å; R79-E83 PolarHBondContact NH1-OE2 3.13Å; R79-E83 IonicContact NH2-OE2 3.47Å; R79-E83 WeakPolarHBondContact O-CB 3.23Å; R79-E83 PolarHBondContact O-N 3.44Å; R80-E83 WeakPolarHBondContact CD-OE2 3.46Å; R80-E83 IonicContact CZ-OE1 3.7Å; R80-E83 IonicContact CZ-OE2 3.33Å; R80-E83 IonicContact NE-OE2 2.74Å; R80-E83 VanDerWaalsContact NH1-CD 3.32Å; R80-E83 IonicContact NH1-OE1 2.67Å; R80-E83 PolarHBondContact NH1-OE1 2.74Å; R80-E83 IonicContact NH1-OE2 3.07Å; R80-E83 PolarHBondContact NH1-OE2 3.3Å; R80-E83 VanDerWaalsContact NH1-OE2 3.1Å; R80-E83 WeakPolarHBondContact O-CB 3.4Å; R80-E83 PolarHBondContact O-N 3.22Å; E83-T85 PolarHBondContact O-N 3.39Å; E83-E86 PolarHBondContact O-N 2.99Å; E83-N87 VanDerWaalsContact O-CG 3.23Å; E83-N87 PolarHBondContact O-N 3.24Å; E83-N87 PolarHBondContact O-OD1 3.41Å
84	Y	95.7	Very high	93.6	Very high	39 Å²	39	63 Å²	63	15%	0.153	32%	0.322	C	S	.	.	H	α-helix	trans	-67	-35.5	177.4	-61	-21.8	0	0	0	113.5	L50 A54 R80 K82 M88	L50-Y84 HydrophobicContact CB-CD2 4Å; L50-Y84 HydrophobicContact CB-CE1 4.4Å; L50-Y84 HydrophobicContact CB-CE2 3.83Å; L50-Y84 HydrophobicContact CB-CG 4.36Å; L50-Y84 HydrophobicContact CD1-CE1 4.45Å; L50-Y84 WeakPolarHBondContact O-CD2 3.41Å; L50-Y84 WeakPolarHBondContact O-CE2 3.18Å; A54-Y84 HydrophobicContact CB-CD2 4.18Å; A54-Y84 HydrophobicContact CB-CE2 4.23Å; R80-Y84 HydrophobicContact CB-CD2 4.37Å; R80-Y84 HydrophobicContact CB-CE2 3.86Å; R80-Y84 WeakPolarHBondContact O-CB 3.48Å; R80-Y84 VanDerWaalsContact O-CD2 3.22Å; R80-Y84 WeakPolarHBondContact O-CD2 3.46Å; R80-Y84 PolarHBondContact O-N 3.26Å; K82-Y84 VanDerWaalsContact C-N 3.31Å; K82-Y84 PolarHBondContact O-N 3.32Å; Y84-M88 WeakPolarHBondContact O-CG 3.47Å; Y84-M88 PolarHBondContact O-N 3.39Å; Y84-M88 VanDerWaalsContact O-N 3.08Å
85	T	93.3	Very high	93.6	Very high	42 Å²	42	63.2 Å²	63.2	26%	0.258	32%	0.323	S	S	.	.	H	α-helix	trans	-71	-38.9	175.8	-56.8	0	0	0	0	111.2	Y81 K82 E83 M88 S89	Y81-T85 WeakPolarHBondContact O-CB 3.37Å; Y81-T85 PolarHBondContact O-N 3.49Å; Y81-T85 PolarHBondContact O-OG1 3.13Å; K82-T85 PolarHBondContact O-N 3.01Å; K82-T85 VanDerWaalsContact O-N 3.09Å; E83-T85 PolarHBondContact O-N 3.39Å; T85-M88 PolarHBondContact O-N 3.15Å; T85-S89 PolarHBondContact O-N 3.45Å; T85-S89 PolarHBondContact O-OG 3.26Å
86	E	95.3	Very high	93.5	Very high	106 Å²	106	62.4 Å²	62.4	50%	0.495	31%	0.309	S	S	.	.	H	α-helix	trans	-66.1	-37.4	175.1	-71.1	174.4	137.5	0	0	111.7	K82 E83 S89 A90	K82-E86 WeakPolarHBondContact CE-OE1 3.39Å; K82-E86 IonicContact NZ-OE1 2.84Å; K82-E86 PolarHBondContact NZ-OE1 2.87Å; K82-E86 IonicContact NZ-OE2 3.8Å; K82-E86 PolarHBondContact NZ-OE2 3.16Å; K82-E86 WeakPolarHBondContact O-CG 3.35Å; K82-E86 PolarHBondContact O-N 3.13Å; E83-E86 PolarHBondContact O-N 2.99Å; E86-S89 PolarHBondContact O-N 3.1Å; E86-A90 PolarHBondContact O-N 2.87Å; E86-A90 VanDerWaalsContact O-N 3.08Å
87	N	94.9	Very high	93.3	Very high	64 Å²	64	64.8 Å²	64.8	34%	0.342	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-41	173	-69.6	-4.5	0	0	0	112.7	Q47 E83 S89 A90 F91	Q47-N87 HydrophobicContact CG-CB 3.84Å; Q47-N87 VanDerWaalsContact OE1-CB 3.29Å; Q47-N87 PolarHBondContact OE1-ND2 2.69Å; E83-N87 VanDerWaalsContact O-CG 3.23Å; E83-N87 PolarHBondContact O-N 3.24Å; E83-N87 PolarHBondContact O-OD1 3.41Å; N87-S89 VanDerWaalsContact C-N 3.34Å; N87-S89 PolarHBondContact O-N 3.12Å; N87-A90 WeakPolarHBondContact O-CB 3.39Å; N87-A90 PolarHBondContact O-N 3.47Å; N87-A90 VanDerWaalsContact O-N 3.12Å; N87-F91 HydrophobicContact CB-CE2 4.5Å; N87-F91 WeakPolarHBondContact O-CD2 3.46Å; N87-F91 PolarHBondContact O-N 3.27Å
88	M	92.9	Very high	93	Very high	10 Å²	10	65 Å²	65	5%	0.049	32%	0.324	C	S	.	.	H	α-helix	trans	-59.4	-44.6	174.8	-72.4	-178.1	79.5	0	0	111.7	F44 Q47 K51 Y84 T85 A90 F91 E92	F44-M88 HydrophobicContact CD2-CB 4.42Å; F44-M88 HydrophobicContact CD2-CE 4.22Å; F44-M88 HydrophobicContact CD2-CG 4.39Å; F44-M88 HydrophobicContact CE1-CE 3.86Å; F44-M88 HydrophobicContact CE2-CB 4.01Å; F44-M88 HydrophobicContact CE2-CE 3.46Å; F44-M88 VanDerWaalsContact CE2-CE 3.46Å; F44-M88 HydrophobicContact CE2-CG 4.17Å; F44-M88 HydrophobicContact CZ-CE 3.26Å; Q47-M88 HydrophobicContact CB-CG 4.44Å; Q47-M88 HydrophobicContact CG-CG 3.86Å; K51-M88 HydrophobicContact CB-SD 4.43Å; K51-M88 HydrophobicContact CD-SD 3.29Å; K51-M88 WeakPolarHBondContact CD-SD 3.37Å; K51-M88 PolarHBondContact NZ-SD 3.29Å; K51-M88 VanDerWaalsContact NZ-SD 3.44Å; Y84-M88 WeakPolarHBondContact O-CG 3.47Å; Y84-M88 PolarHBondContact O-N 3.39Å; Y84-M88 VanDerWaalsContact O-N 3.08Å; T85-M88 PolarHBondContact O-N 3.15Å; M88-A90 PolarHBondContact O-N 3.33Å; M88-F91 PolarHBondContact O-N 3.46Å; M88-E92 WeakPolarHBondContact O-CG 3.49Å; M88-E92 PolarHBondContact O-N 3.47Å
89	S	90.9	Very high	92.9	Very high	62 Å²	62	63.9 Å²	63.9	43%	0.434	32%	0.318	S	S	.	.	H	α-helix	trans	-67.6	-22.5	176	-61.9	0	0	0	0	114	T85 E86 N87 E92 S93	T85-S89 PolarHBondContact O-N 3.45Å; T85-S89 PolarHBondContact O-OG 3.26Å; E86-S89 PolarHBondContact O-N 3.1Å; N87-S89 VanDerWaalsContact C-N 3.34Å; N87-S89 PolarHBondContact O-N 3.12Å; S89-E92 WeakPolarHBondContact CA-OE2 3.45Å; S89-S93 WeakPolarHBondContact O-CB 3.25Å; S89-S93 PolarHBondContact O-N 2.98Å; S89-S93 VanDerWaalsContact O-N 3.14Å
90	A	93.9	Very high	92.7	Very high	59 Å²	59	58.7 Å²	58.7	49%	0.488	30%	0.301	S	S	.	.	H	α-helix	trans	-72.4	-44.1	169.8	0	0	0	0	0	111.6	E86 N87 M88 S93 E94	E86-A90 PolarHBondContact O-N 2.87Å; E86-A90 VanDerWaalsContact O-N 3.08Å; N87-A90 WeakPolarHBondContact O-CB 3.39Å; N87-A90 PolarHBondContact O-N 3.47Å; N87-A90 VanDerWaalsContact O-N 3.12Å; M88-A90 PolarHBondContact O-N 3.33Å; A90-S93 PolarHBondContact O-N 2.87Å; A90-E94 PolarHBondContact O-N 3.18Å
91	F	93.3	Very high	92.6	Very high	52 Å²	52	56.4 Å²	56.4	23%	0.228	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-43.1	174.7	-66.4	-53.6	0	0	0	112.4	L40 A43 F44 Q47 N87 M88 S93 E94 L95	L40-F91 HydrophobicContact CD2-CD1 3.95Å; L40-F91 HydrophobicContact CD2-CE1 4.48Å; A43-F91 HydrophobicContact CB-CD1 4.45Å; A43-F91 HydrophobicContact CB-CE1 3.77Å; A43-F91 HydrophobicContact CB-CE2 4.37Å; A43-F91 HydrophobicContact CB-CZ 3.73Å; F44-F91 HydrophobicContact CB-CB 4.42Å; F44-F91 HydrophobicContact CB-CD2 4.44Å; F44-F91 HydrophobicContact CD2-CB 3.99Å; F44-F91 HydrophobicContact CD2-CD2 4.47Å; Q47-F91 HydrophobicContact CB-CD2 4.38Å; Q47-F91 HydrophobicContact CB-CE2 3.87Å; Q47-F91 HydrophobicContact CG-CE2 4.07Å; N87-F91 HydrophobicContact CB-CE2 4.5Å; N87-F91 WeakPolarHBondContact O-CD2 3.46Å; N87-F91 PolarHBondContact O-N 3.27Å; M88-F91 PolarHBondContact O-N 3.46Å; F91-S93 VanDerWaalsContact C-N 3.31Å; F91-S93 PolarHBondContact O-N 3.13Å; F91-E94 PolarHBondContact O-N 2.79Å; F91-E94 VanDerWaalsContact O-N 3.15Å; F91-L95 PolarHBondContact O-N 3.05Å
92	E	91	Very high	92.7	Very high	53 Å²	53	52.7 Å²	52.7	25%	0.248	28%	0.279	C	S	.	.	H	α-helix	trans	-54.8	-47.7	171.9	-72	158.7	-168.7	0	0	110.6	F44 M88 S89 E94 L95 E96	F44-E92 HydrophobicContact CE2-CG 3.96Å; M88-E92 WeakPolarHBondContact O-CG 3.49Å; M88-E92 PolarHBondContact O-N 3.47Å; S89-E92 WeakPolarHBondContact CA-OE2 3.45Å; E92-E94 PolarHBondContact O-N 2.84Å; E92-L95 PolarHBondContact O-N 3.28Å; E92-E96 WeakPolarHBondContact O-CG 3.46Å; E92-E96 PolarHBondContact O-N 3.49Å
93	S	90.6	Very high	92.6	Very high	59 Å²	59	49.7 Å²	49.7	41%	0.413	27%	0.267	S	S	.	.	H	α-helix	trans	-69.3	-27.2	177.8	-174.6	0	0	0	0	113.8	S89 A90 F91 N97	S89-S93 WeakPolarHBondContact O-CB 3.25Å; S89-S93 PolarHBondContact O-N 2.98Å; S89-S93 VanDerWaalsContact O-N 3.14Å; A90-S93 PolarHBondContact O-N 2.87Å; F91-S93 VanDerWaalsContact C-N 3.31Å; F91-S93 PolarHBondContact O-N 3.13Å; S93-N97 PolarHBondContact O-ND2 3.24Å
94	E	92.6	Very high	92.6	Very high	77 Å²	77	47.3 Å²	47.3	36%	0.36	26%	0.256	S	S	.	.	H	α-helix	trans	-75.5	-41	173.8	-172	164.5	-179.4	0	0	111.3	K36 L40 A90 F91 E92 E96 N97 L98	K36-E94 WeakPolarHBondContact CE-OE1 3.48Å; K36-E94 IonicContact NZ-OE1 2.69Å; K36-E94 PolarHBondContact NZ-OE1 3.43Å; L40-E94 HydrophobicContact CD1-CB 4.44Å; L40-E94 HydrophobicContact CD1-CG 3.94Å; L40-E94 HydrophobicContact CD2-CB 4.38Å; L40-E94 HydrophobicContact CD2-CG 4.23Å; A90-E94 PolarHBondContact O-N 3.18Å; F91-E94 PolarHBondContact O-N 2.79Å; F91-E94 VanDerWaalsContact O-N 3.15Å; E92-E94 PolarHBondContact O-N 2.84Å; E94-E96 VanDerWaalsContact C-N 3.34Å; E94-E96 PolarHBondContact O-N 3.47Å; E94-N97 WeakPolarHBondContact O-CB 3.15Å; E94-N97 PolarHBondContact O-N 3.33Å; E94-L98 PolarHBondContact O-N 3.29Å
95	L	92	Very high	92.6	Very high	48 Å²	48	48 Å²	48	25%	0.251	26%	0.259	S	S	.	.	H	α-helix	trans	-62	-40.2	174.4	-175.6	56.9	0	0	0	111.5	V37 F91 E92 N97 L98 L99 I157	V37-L95 HydrophobicContact CG1-CD1 3.95Å; V37-L95 HydrophobicContact CG2-CD1 4.08Å; F91-L95 PolarHBondContact O-N 3.05Å; E92-L95 PolarHBondContact O-N 3.28Å; L95-N97 PolarHBondContact O-N 2.95Å; L95-N97 VanDerWaalsContact O-N 3.17Å; L95-L98 WeakPolarHBondContact O-CA 3.38Å; L95-L98 PolarHBondContact O-N 3.44Å; L95-L99 HydrophobicContact CD1-CD2 4.47Å; L95-L99 HydrophobicContact CG-CG 4.45Å; L95-L99 WeakPolarHBondContact O-CG 3.4Å; L95-L99 PolarHBondContact O-N 3.02Å; L95-L99 VanDerWaalsContact O-N 3.09Å; L95-I157 HydrophobicContact CB-CD1 3.93Å; L95-I157 HydrophobicContact CD2-CD1 3.8Å; L95-I157 HydrophobicContact CG-CD1 3.86Å
96	E	90.8	Very high	92.6	Very high	45 Å²	45	46.4 Å²	46.4	21%	0.21	25%	0.249	C	C	.	.	H	α-helix	trans	-56.6	-28.7	171.6	-75.9	-173.6	166.6	0	0	113.5	E92 E94 L98 L156 I157	E92-E96 WeakPolarHBondContact O-CG 3.46Å; E92-E96 PolarHBondContact O-N 3.49Å; E94-E96 VanDerWaalsContact C-N 3.34Å; E94-E96 PolarHBondContact O-N 3.47Å; E96-L98 VanDerWaalsContact C-N 3.33Å; E96-L156 VanDerWaalsContact OE1-CA 3.29Å; E96-L156 WeakPolarHBondContact OE1-CA 3.31Å; E96-I157 HydrophobicContact CG-CB 4.34Å; E96-I157 HydrophobicContact CG-CD1 3.87Å; E96-I157 HydrophobicContact CG-CG1 3.83Å; E96-I157 PolarHBondContact OE1-N 3.05Å
97	N	89.3	Confident	92.5	Very high	126 Å²	126	46 Å²	46	67%	0.674	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-12.1	174.1	-64.6	-60.1	0	0	0	113.6	S93 E94 L95	S93-N97 PolarHBondContact O-ND2 3.24Å; E94-N97 WeakPolarHBondContact O-CB 3.15Å; E94-N97 PolarHBondContact O-N 3.33Å; L95-N97 PolarHBondContact O-N 2.95Å; L95-N97 VanDerWaalsContact O-N 3.17Å
98	L	89.9	Confident	92.4	Very high	17 Å²	17	43.2 Å²	43.2	9%	0.089	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-26.7	176.5	-63.4	-176.1	0	0	0	112.9	H33 K36 V37 L40 E94 L95 E96 G100	H33-L98 PolarHBondContact CE1-O 3.45Å; H33-L98 PolarHBondContact NE2-O 2.93Å; K36-L98 HydrophobicContact CB-CD1 4.47Å; K36-L98 HydrophobicContact CD-CD1 3.93Å; K36-L98 HydrophobicContact CD-CD2 4.17Å; K36-L98 HydrophobicContact CG-CD1 4.09Å; V37-L98 HydrophobicContact CG2-CB 4.39Å; V37-L98 HydrophobicContact CG2-CD1 3.94Å; L40-L98 HydrophobicContact CD1-CD1 3.49Å; L40-L98 VanDerWaalsContact CD1-CD1 3.49Å; E94-L98 PolarHBondContact O-N 3.29Å; L95-L98 WeakPolarHBondContact O-CA 3.38Å; L95-L98 PolarHBondContact O-N 3.44Å; E96-L98 VanDerWaalsContact C-N 3.33Å; L98-G100 PolarHBondContact O-N 3.04Å
99	L	90.7	Very high	92.4	Very high	32 Å²	32	43 Å²	43	17%	0.168	23%	0.231	C	C	.	.	S	Bend	trans	-62.5	-6.9	-175.4	-68.9	172.4	0	0	0	115.4	L95 P155 I157 F188 W213	L95-L99 HydrophobicContact CD1-CD2 4.47Å; L95-L99 HydrophobicContact CG-CG 4.45Å; L95-L99 WeakPolarHBondContact O-CG 3.4Å; L95-L99 PolarHBondContact O-N 3.02Å; L95-L99 VanDerWaalsContact O-N 3.09Å; L99-P155 HydrophobicContact CB-CB 3.7Å; L99-P155 HydrophobicContact CB-CG 3.85Å; L99-P155 HydrophobicContact CD1-CB 4.04Å; L99-I157 HydrophobicContact CD1-CD1 4.19Å; L99-I157 HydrophobicContact CD1-CG1 3.77Å; L99-F188 HydrophobicContact CB-CE1 4.16Å; L99-F188 HydrophobicContact CD1-CE1 4.45Å; L99-F188 HydrophobicContact CD1-CZ 4.1Å; L99-F188 HydrophobicContact CD2-CE1 3.87Å; L99-F188 HydrophobicContact CD2-CZ 4.13Å; L99-F188 HydrophobicContact CG-CE1 4.37Å; L99-W213 PolarHBondContact O-NE1 3.34Å
100	G	91.1	Very high	92.3	Very high	6 Å²	6	41.7 Å²	41.7	6%	0.062	22%	0.224	C	C	.	.			trans	77.7	-132.9	170.9	0	0	0	0	0	113.8	L98 M154 P155 Y214	L98-G100 PolarHBondContact O-N 3.04Å; G100-M154 WeakPolarHBondContact O-CE 3.19Å; G100-P155 WeakPolarHBondContact O-CD 3.4Å; G100-Y214 CarbonylContact C-O 3.6Å; G100-Y214 WeakPolarHBondContact CA-O 3.15Å
101	E	93.4	Very high	91.8	Very high	39 Å²	39	39.9 Å²	39.9	18%	0.182	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.6	-173.7	-65.3	-167.5	140.2	0	0	112.8	H103 V152 M154 Y214	E101-H103 IonicContact OE2-CD2 2.66Å; E101-H103 IonicContact OE2-CE1 3.51Å; E101-H103 IonicContact OE2-NE2 2.98Å; E101-H103 PolarHBondContact OE2-NE2 2.87Å; E101-V152 HydrophobicContact CB-CG1 3.83Å; E101-V152 HydrophobicContact CG-CG1 3.94Å; E101-M154 HydrophobicContact CG-CE 4.33Å; E101-M154 HydrophobicContact CG-SD 4.13Å; E101-Y214 PolarHBondContact N-O 3.17Å; E101-Y214 PolarHBondContact O-N 2.98Å
102	F	94.2	Very high	90.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	115.6	161.5	-67.5	-47.2	0	0	0	110.3	I104 Y127 V152 F153 P155 L187 F188 V211 W213	F102-I104 HydrophobicContact CB-CG1 4.3Å; F102-Y127 HydrophobicContact CD2-CE1 4.39Å; F102-V152 CarbonylContact O-C 3.45Å; F102-V152 WeakPolarHBondContact O-CA 3.27Å; F102-F153 PolarHBondContact N-O 3.18Å; F102-F153 PolarHBondContact O-N 3.37Å; F102-P155 HydrophobicContact CD2-CB 4.2Å; F102-P155 HydrophobicContact CD2-CG 3.81Å; F102-P155 HydrophobicContact CE1-CG 4.44Å; F102-P155 HydrophobicContact CE2-CB 3.73Å; F102-P155 HydrophobicContact CE2-CG 3.7Å; F102-P155 HydrophobicContact CG-CG 4.25Å; F102-P155 HydrophobicContact CZ-CB 4.21Å; F102-P155 HydrophobicContact CZ-CG 4.03Å; F102-L187 HydrophobicContact CD1-CB 4.19Å; F102-L187 HydrophobicContact CE1-CB 3.59Å; F102-L187 WeakPolarHBondContact CE1-O 3.4Å; F102-L187 HydrophobicContact CE2-CB 4.3Å; F102-L187 HydrophobicContact CE2-CD1 4.42Å; F102-L187 HydrophobicContact CZ-CB 3.65Å; F102-F188 AromaticContact CE1-CD1 3.84Å; F102-F188 HydrophobicContact CE1-CD1 3.84Å; F102-F188 AromaticContact CE1-CE1 3.94Å; F102-F188 HydrophobicContact CE1-CE1 3.94Å; F102-F188 HydrophobicContact CE1-CG 4.18Å; F102-F188 HydrophobicContact CE1-CZ 4.39Å; F102-F188 HydrophobicContact CE2-CE1 4.36Å; F102-F188 HydrophobicContact CE2-CZ 4.14Å; F102-F188 AromaticContact CZ-CD1 3.77Å; F102-F188 HydrophobicContact CZ-CD1 3.77Å; F102-F188 AromaticContact CZ-CD2 4Å; F102-F188 HydrophobicContact CZ-CD2 4Å; F102-F188 AromaticContact CZ-CE1 3.5Å; F102-F188 HydrophobicContact CZ-CE1 3.5Å; F102-F188 AromaticContact CZ-CE2 3.76Å; F102-F188 HydrophobicContact CZ-CE2 3.76Å; F102-F188 HydrophobicContact CZ-CG 4.02Å; F102-F188 AromaticContact CZ-CZ 3.51Å; F102-F188 HydrophobicContact CZ-CZ 3.51Å; F102-V211 HydrophobicContact CD1-CG1 4.27Å; F102-W213 HydrophobicContact CD1-CB 3.99Å; F102-W213 AromaticContact CD1-CD1 3.88Å; F102-W213 HydrophobicContact CD1-CG 4.24Å; F102-W213 HydrophobicContact CE1-CB 4.08Å; F102-W213 AromaticContact CE1-CD1 3.81Å; F102-W213 HydrophobicContact CE1-CG 4.07Å
103	H	94.4	Very high	88.8	Confident	53 Å²	53	47.4 Å²	47.4	25%	0.245	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	108.7	171.5	-74.7	-128.4	0	0	0	108.6	E101 V211 T212 Y214	E101-H103 IonicContact OE2-CD2 2.66Å; E101-H103 IonicContact OE2-CE1 3.51Å; E101-H103 IonicContact OE2-NE2 2.98Å; E101-H103 PolarHBondContact OE2-NE2 2.87Å; H103-V211 WeakPolarHBondContact O-CA 3.18Å; H103-T212 PolarHBondContact N-O 3.38Å; H103-T212 PolarHBondContact O-N 3.4Å; H103-Y214 HydrophobicContact CB-CD2 4.33Å; H103-Y214 HydrophobicContact CB-CE2 4.09Å; H103-Y214 AromaticContact CD2-CD2 3.51Å; H103-Y214 AromaticContact CD2-CE2 3.95Å; H103-Y214 AromaticContact CG-CD2 3.8Å; H103-Y214 AromaticContact CG-CE2 3.75Å; H103-Y214 AromaticContact NE2-CD2 3.87Å
104	I	95.1	Very high	87.8	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.5	-175.1	-53.7	-171.9	0	0	0	109.7	F102 W132 E150 M151 F153 I161 L209 E210 V211	F102-I104 HydrophobicContact CB-CG1 4.3Å; I104-W132 HydrophobicContact CB-CZ3 4.37Å; I104-W132 HydrophobicContact CG2-CH2 4.32Å; I104-W132 HydrophobicContact CG2-CZ3 3.77Å; I104-E150 WeakPolarHBondContact O-CA 3.12Å; I104-M151 PolarHBondContact N-O 3.15Å; I104-M151 PolarHBondContact O-N 3.39Å; I104-F153 HydrophobicContact CD1-CD2 3.67Å; I104-F153 HydrophobicContact CD1-CE2 4.08Å; I104-I161 HydrophobicContact CD1-CD1 4.49Å; I104-L209 HydrophobicContact CG2-CB 4.22Å; I104-L209 HydrophobicContact CG2-CD1 4.12Å; I104-L209 HydrophobicContact CG2-CD2 4.46Å; I104-L209 HydrophobicContact CG2-CG 4.5Å; I104-E210 CarbonylContact C-O 3.59Å; I104-E210 WeakPolarHBondContact CA-O 3.39Å; I104-V211 HydrophobicContact CG1-CG1 4.32Å; I104-V211 HydrophobicContact CG1-CG2 4.18Å; I104-V211 HydrophobicContact CG2-CG2 4.34Å
105	K	94.7	Very high	87.5	Confident	52 Å²	52	48.8 Å²	48.8	23%	0.226	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.2	177.8	-173.1	174	-174.8	76.7	0	111.8	D149 E150 L209 E210	K105-D149 CarbonylContact C-O 3.53Å; K105-D149 VanDerWaalsContact CA-O 3.29Å; K105-D149 WeakPolarHBondContact CA-O 3.49Å; K105-D149 WeakPolarHBondContact CG-O 3.47Å; K105-D149 IonicContact NZ-OD2 3.74Å; K105-D149 PolarHBondContact NZ-OD2 3.23Å; K105-E150 HydrophobicContact CB-CG 4.12Å; K105-E150 HydrophobicContact CD-CG 4.09Å; K105-E150 HydrophobicContact CG-CG 3.8Å; K105-E150 IonicContact NZ-OE1 3.69Å; K105-E150 PolarHBondContact NZ-OE1 2.82Å; K105-L209 CarbonylContact O-C 3.54Å; K105-L209 WeakPolarHBondContact O-CA 3.35Å; K105-E210 HydrophobicContact CB-CB 4.35Å; K105-E210 PolarHBondContact N-O 2.91Å; K105-E210 PolarHBondContact O-N 2.92Å
106	M	94	Very high	87.2	Confident	9 Å²	9	49.7 Å²	49.7	4%	0.044	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	122	175.4	179.6	55.1	169.6	0	0	111.2	L109 I123 W132 L134 W146 D149 L207 L209	M106-L109 HydrophobicContact CE-CG 4.45Å; M106-I123 HydrophobicContact CE-CD1 3.6Å; M106-I123 HydrophobicContact SD-CD1 4.49Å; M106-W132 HydrophobicContact CB-CH2 4.11Å; M106-W132 HydrophobicContact CB-CZ2 4.42Å; M106-L134 HydrophobicContact CB-CD1 3.76Å; M106-L134 HydrophobicContact CE-CD1 4.47Å; M106-L134 HydrophobicContact CG-CD1 3.58Å; M106-L134 HydrophobicContact SD-CD1 4.11Å; M106-W146 HydrophobicContact CE-CD2 3.6Å; M106-W146 HydrophobicContact CE-CE3 3.85Å; M106-W146 HydrophobicContact CE-CG 4.37Å; M106-W146 HydrophobicContact CE-CH2 3.57Å; M106-W146 HydrophobicContact CE-CZ2 3.27Å; M106-W146 HydrophobicContact CE-CZ3 3.83Å; M106-W146 HydrophobicContact CG-CB 4.32Å; M106-W146 HydrophobicContact CG-CD2 3.91Å; M106-W146 HydrophobicContact CG-CE3 4.42Å; M106-W146 HydrophobicContact CG-CG 3.79Å; M106-D149 HydrophobicContact CB-CB 4.27Å; M106-D149 PolarHBondContact N-O 2.65Å; M106-L207 HydrophobicContact CE-CD1 3.46Å; M106-L207 VanDerWaalsContact CE-CD1 3.46Å; M106-L207 HydrophobicContact SD-CD1 3.49Å; M106-L207 WeakPolarHBondContact SD-CD1 3.47Å; M106-L209 HydrophobicContact SD-CD2 3.83Å
107	K	93.4	Very high	87	Confident	99 Å²	99	51.2 Å²	51.2	43%	0.43	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-33.3	173.5	-62.6	-64.8	-170.6	177.4	0	113.1	N208 E210	K107-N208 WeakPolarHBondContact CA-O 3.22Å; K107-N208 HydrophobicContact CB-CB 4.02Å; K107-N208 WeakPolarHBondContact CB-O 3.5Å; K107-N208 PolarHBondContact N-O 2.94Å; K107-E210 HydrophobicContact CD-CB 4.31Å; K107-E210 WeakPolarHBondContact CE-OE1 3.27Å; K107-E210 WeakPolarHBondContact CE-OE2 3.46Å; K107-E210 HydrophobicContact CG-CB 4.09Å; K107-E210 IonicContact NZ-OE1 2.65Å; K107-E210 PolarHBondContact NZ-OE1 2.76Å; K107-E210 IonicContact NZ-OE2 2.61Å; K107-E210 PolarHBondContact NZ-OE2 3.15Å
108	G	92.6	Very high	86.9	Confident	4 Å²	4	46.9 Å²	46.9	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.8	170.5	176.5	0	0	0	0	0	114.3	Q144 N208	G108-Q144 VanDerWaalsContact CA-OE1 3.27Å; G108-N208 PolarHBondContact N-O 3.34Å; G108-N208 PolarHBondContact O-N 3.28Å
109	L	92.2	Very high	86.9	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.2	162.2	-70.7	173.4	0	0	0	109.5	M106 L115 Y121 I123 Q144 W146 V165 V199 I205 K206 L207	M106-L109 HydrophobicContact CE-CG 4.45Å; L109-L115 HydrophobicContact CB-CD1 4.02Å; L109-L115 WeakPolarHBondContact O-CD1 3.41Å; L109-Y121 HydrophobicContact CD1-CD1 4.14Å; L109-Y121 HydrophobicContact CD1-CD2 3.74Å; L109-Y121 HydrophobicContact CD1-CE2 4.25Å; L109-Y121 HydrophobicContact CD1-CG 3.68Å; L109-I123 HydrophobicContact CD2-CD1 4.19Å; L109-I123 HydrophobicContact CG-CD1 4.38Å; L109-Q144 PolarHBondContact O-NE2 3.33Å; L109-W146 HydrophobicContact CB-CZ2 4.48Å; L109-W146 HydrophobicContact CD1-CH2 3.73Å; L109-W146 HydrophobicContact CD1-CZ2 4.12Å; L109-W146 HydrophobicContact CG-CH2 3.88Å; L109-W146 HydrophobicContact CG-CZ2 3.95Å; L109-V165 HydrophobicContact CD1-CG1 4.34Å; L109-V199 HydrophobicContact CD2-CG2 4.39Å; L109-I205 HydrophobicContact CD2-CG2 4.08Å; L109-K206 CarbonylContact C-O 3.51Å; L109-K206 WeakPolarHBondContact CA-O 3.31Å; L109-L207 HydrophobicContact CD2-CB 4.07Å; L109-L207 HydrophobicContact CD2-CD1 3.95Å
110	A	89	Confident	87	Confident	36 Å²	36	49.7 Å²	49.7	30%	0.298	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	143.8	161.6	0	0	0	0	0	108.6	I205 K206	A110-I205 CarbonylContact O-C 3.5Å; A110-I205 VanDerWaalsContact O-CA 3.28Å; A110-I205 WeakPolarHBondContact O-CA 3.41Å; A110-K206 HydrophobicContact CB-CB 4.39Å; A110-K206 PolarHBondContact N-O 2.91Å; A110-K206 PolarHBondContact O-N 3.5Å
111	G	83	Confident	87.1	Confident	21 Å²	21	49.6 Å²	49.6	22%	0.216	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	113.9	178.6	0	0	0	0	0	112.7	A113 R114 T204	G111-A113 PolarHBondContact O-N 2.89Å; G111-R114 PolarHBondContact O-N 2.88Å; G111-T204 WeakPolarHBondContact CA-O 3.46Å
112	F	62.9	Low	87.1	Confident	151 Å²	151	49 Å²	49	66%	0.662	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	104.9	-174.2	-62.5	-84.2	0	0	0	110	R114 T204	F112-R114 PolarHBondContact O-N 3.18Å; F112-R114 VanDerWaalsContact O-N 3.13Å; F112-T204 PolarHBondContact N-O 3.39Å; F112-T204 VanDerWaalsContact N-O 3.13Å
113	A	58.8	Low	87.2	Confident	112 Å²	112	49 Å²	49	93%	0.926	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	15.8	-175.3	0	0	0	0	0	116.5	G111	G111-A113 PolarHBondContact O-N 2.89Å
114	R	70.6	Confident	87.3	Confident	127 Å²	127	48.2 Å²	48.2	48%	0.479	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-18.8	-176	-73.3	-170.5	179	-143	4.6	116.4	G111 F112 T204 I205	G111-R114 PolarHBondContact O-N 2.88Å; F112-R114 PolarHBondContact O-N 3.18Å; F112-R114 VanDerWaalsContact O-N 3.13Å; R114-T204 PolarHBondContact NE-OG1 3.18Å; R114-I205 HydrophobicContact CB-CD1 4.14Å; R114-I205 HydrophobicContact CB-CG1 4.21Å
115	L	84.5	Confident	87.3	Confident	38 Å²	38	48 Å²	48	20%	0.199	27%	0.271	C	S	.	.			trans	-96.4	117.2	-177.4	-55.4	179.1	0	0	0	110.5	L109 Y121 I138	L109-L115 HydrophobicContact CB-CD1 4.02Å; L109-L115 WeakPolarHBondContact O-CD1 3.41Å; L115-Y121 HydrophobicContact CD2-CE2 3.8Å; L115-Y121 WeakPolarHBondContact CD2-OH 3.39Å; L115-I138 HydrophobicContact CB-CD1 4.49Å; L115-I138 HydrophobicContact CB-CG1 4.42Å; L115-I138 HydrophobicContact CD1-CD1 4.37Å
116	C	85.9	Confident	87.4	Confident	66 Å²	66	51.8 Å²	51.8	45%	0.446	28%	0.284	S	S	.	.			trans	-107.2	146.3	-179.9	-62.4	0	0	0	0	112.3	G118 D119 I138	C116-G118 PolarHBondContact O-N 3.01Å; C116-D119 WeakPolarHBondContact CA-OD2 3.22Å; C116-D119 VanDerWaalsContact CB-OD2 3.3Å; C116-D119 WeakPolarHBondContact CB-OD2 3.43Å; C116-D119 PolarHBondContact N-OD2 2.72Å; C116-D119 VanDerWaalsContact O-CB 3.26Å; C116-D119 WeakPolarHBondContact O-CB 3.41Å; C116-D119 PolarHBondContact O-N 3.09Å; C116-D119 VanDerWaalsContact O-N 3.13Å; C116-I138 WeakPolarHBondContact O-CB 3.29Å
117	P	87.9	Confident	87.4	Confident	77 Å²	77	51.3 Å²	51.3	50%	0.5	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	124.8	169.1	-34.5	40.6	0	0	0	114.3	V140	P117-V140 HydrophobicContact CB-CG2 4.47Å
118	G	86.7	Confident	87.4	Confident	36 Å²	36	46.8 Å²	46.8	37%	0.371	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.2	-19	-178.9	0	0	0	0	0	114.3	C116 R137 I138	C116-G118 PolarHBondContact O-N 3.01Å; G118-R137 PolarHBondContact O-NH1 3.3Å; G118-I138 PolarHBondContact N-O 3.39Å
119	D	90.3	Very high	87.4	Confident	37 Å²	37	58.2 Å²	58.2	20%	0.198	31%	0.305	C	S	.	.			trans	-56.1	147.9	177.7	-67.9	-8.6	0	0	0	111.3	C116 Y121 R137 I138	C116-D119 WeakPolarHBondContact CA-OD2 3.22Å; C116-D119 VanDerWaalsContact CB-OD2 3.3Å; C116-D119 WeakPolarHBondContact CB-OD2 3.43Å; C116-D119 PolarHBondContact N-OD2 2.72Å; C116-D119 VanDerWaalsContact O-CB 3.26Å; C116-D119 WeakPolarHBondContact O-CB 3.41Å; C116-D119 PolarHBondContact O-N 3.09Å; C116-D119 VanDerWaalsContact O-N 3.13Å; D119-Y121 HydrophobicContact CB-CE2 3.86Å; D119-R137 VanDerWaalsContact O-CA 3.31Å; D119-R137 WeakPolarHBondContact O-CA 3.44Å; D119-I138 HydrophobicContact CB-CB 4.48Å; D119-I138 HydrophobicContact CB-CG1 4.04Å; D119-I138 PolarHBondContact O-N 2.86Å
120	Q	92.3	Very high	87.5	Confident	70 Å²	70	60 Å²	60	33%	0.327	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	137	-179.4	-77.9	161.5	103.7	0	0	110.2	G136 R137 E167 L168	Q120-G136 VanDerWaalsContact CA-O 3.27Å; Q120-G136 WeakPolarHBondContact CA-O 3.45Å; Q120-R137 VanDerWaalsContact CD-CZ 3.46Å; Q120-R137 HydrophobicContact CG-CB 4.33Å; Q120-R137 HydrophobicContact CG-CG 4.33Å; Q120-R137 VanDerWaalsContact CG-NH1 3.3Å; Q120-R137 VanDerWaalsContact NE2-NH1 3.11Å; Q120-E167 WeakPolarHBondContact O-CA 3.24Å; Q120-L168 HydrophobicContact CB-CB 3.92Å; Q120-L168 HydrophobicContact CB-CD1 4.38Å; Q120-L168 HydrophobicContact CB-CG 4.49Å; Q120-L168 PolarHBondContact O-N 3.46Å
121	Y	92.8	Very high	87.8	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.016	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	150	179.5	-62.5	-80.4	0	0	0	110.5	L109 L115 D119 K135 G136 I138 V165 T166 E167 V177	L109-Y121 HydrophobicContact CD1-CD1 4.14Å; L109-Y121 HydrophobicContact CD1-CD2 3.74Å; L109-Y121 HydrophobicContact CD1-CE2 4.25Å; L109-Y121 HydrophobicContact CD1-CG 3.68Å; L115-Y121 HydrophobicContact CD2-CE2 3.8Å; L115-Y121 WeakPolarHBondContact CD2-OH 3.39Å; D119-Y121 HydrophobicContact CB-CE2 3.86Å; Y121-K135 CarbonylContact O-C 3.53Å; Y121-K135 VanDerWaalsContact O-CA 3.23Å; Y121-K135 WeakPolarHBondContact O-CA 3.4Å; Y121-G136 PolarHBondContact N-O 3.43Å; Y121-G136 PolarHBondContact O-N 3.45Å; Y121-I138 HydrophobicContact CD2-CD1 4.38Å; Y121-I138 HydrophobicContact CD2-CG1 4.39Å; Y121-I138 HydrophobicContact CE2-CD1 4.16Å; Y121-I138 HydrophobicContact CE2-CG1 3.91Å; Y121-V165 HydrophobicContact CD1-CG1 4.38Å; Y121-T166 CarbonylContact C-O 3.37Å; Y121-T166 VanDerWaalsContact CA-O 3.31Å; Y121-T166 WeakPolarHBondContact CA-O 3.45Å; Y121-E167 HydrophobicContact CD1-CB 3.95Å; Y121-E167 HydrophobicContact CD1-CG 4.1Å; Y121-E167 HydrophobicContact CE1-CB 3.78Å; Y121-E167 HydrophobicContact CE1-CG 3.65Å; Y121-V177 HydrophobicContact CD1-CG2 4.09Å; Y121-V177 HydrophobicContact CE1-CG2 3.96Å
122	E	94.5	Very high	88.5	Confident	26 Å²	26	66 Å²	66	12%	0.121	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	117.9	168.1	-178	176.7	109.8	0	0	107.2	K133 L134 K135 T166 L168	E122-K133 HydrophobicContact CG-CG 4.45Å; E122-K133 WeakPolarHBondContact OE1-CE 3.49Å; E122-K133 IonicContact OE1-NZ 3.97Å; E122-K133 PolarHBondContact OE1-NZ 3.42Å; E122-K133 WeakPolarHBondContact OE2-CE 3.49Å; E122-K133 IonicContact OE2-NZ 2.81Å; E122-K133 PolarHBondContact OE2-NZ 3.43Å; E122-L134 WeakPolarHBondContact CA-O 3.47Å; E122-K135 HydrophobicContact CB-CG 4.27Å; E122-K135 HydrophobicContact CG-CG 4.18Å; E122-K135 WeakPolarHBondContact OE2-CE 3.3Å; E122-K135 IonicContact OE2-NZ 3.37Å; E122-T166 PolarHBondContact N-O 3.18Å; E122-T166 PolarHBondContact O-N 2.73Å; E122-L168 HydrophobicContact CB-CD1 4.14Å; E122-L168 HydrophobicContact CB-CD2 3.86Å; E122-L168 HydrophobicContact CB-CG 4.14Å
123	I	95.1	Very high	90	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.1	173.4	-55.6	178	0	0	0	106.9	M106 L109 M125 K133 L134 W146 I163 K164 V165 L207	M106-I123 HydrophobicContact CE-CD1 3.6Å; M106-I123 HydrophobicContact SD-CD1 4.49Å; L109-I123 HydrophobicContact CD2-CD1 4.19Å; L109-I123 HydrophobicContact CG-CD1 4.38Å; I123-M125 HydrophobicContact CG2-CE 4.04Å; I123-M125 HydrophobicContact CG2-CG 4.29Å; I123-K133 WeakPolarHBondContact O-CA 3.44Å; I123-L134 HydrophobicContact CB-CD2 3.66Å; I123-L134 HydrophobicContact CB-CG 3.97Å; I123-L134 HydrophobicContact CG2-CD2 3.86Å; I123-L134 PolarHBondContact N-O 2.98Å; I123-L134 PolarHBondContact O-N 3.38Å; I123-W146 HydrophobicContact CD1-CE3 4.43Å; I123-W146 HydrophobicContact CD1-CH2 3.67Å; I123-W146 HydrophobicContact CD1-CZ3 3.54Å; I123-W146 HydrophobicContact CG1-CH2 4.24Å; I123-W146 HydrophobicContact CG1-CZ3 3.87Å; I123-I163 HydrophobicContact CG2-CG2 3.92Å; I123-K164 WeakPolarHBondContact CA-O 3.28Å; I123-V165 HydrophobicContact CG1-CG1 4.19Å; I123-V165 HydrophobicContact CG1-CG2 4.12Å; I123-V165 HydrophobicContact CG2-CG2 4.36Å; I123-L207 HydrophobicContact CD1-CD1 3.62Å; I123-L207 HydrophobicContact CD1-CD2 4.28Å; I123-L207 HydrophobicContact CG2-CD2 4.19Å
124	F	95.9	Very high	91.7	Very high	38 Å²	38	58.7 Å²	58.7	17%	0.167	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.6	175.3	174.7	-103.2	0	0	0	108.6	R126 R131 W132 K133 K164	F124-R126 HydrophobicContact CE1-CB 3.91Å; F124-R126 HydrophobicContact CZ-CB 4.05Å; F124-R131 HydrophobicContact CE2-CB 4.17Å; F124-R131 HydrophobicContact CE2-CG 4.43Å; F124-R131 HydrophobicContact CZ-CB 4.43Å; F124-R131 HydrophobicContact CZ-CG 4.23Å; F124-R131 VanDerWaalsContact CZ-NE 3.32Å; F124-W132 WeakPolarHBondContact CD2-O 3.47Å; F124-K133 HydrophobicContact CD2-CB 4.14Å; F124-K164 PolarHBondContact N-O 3.13Å; F124-K164 PolarHBondContact O-N 3.34Å
125	M	96.4	Very high	92.8	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.2	173.2	-51.8	-165.8	-164.1	0	0	109.9	I123 R131 W132 L134 F153 N162 I163 L207 L209	I123-M125 HydrophobicContact CG2-CE 4.04Å; I123-M125 HydrophobicContact CG2-CG 4.29Å; M125-R131 WeakPolarHBondContact O-CA 3.46Å; M125-W132 HydrophobicContact CB-CB 4.37Å; M125-W132 HydrophobicContact CE-CE3 3.63Å; M125-W132 HydrophobicContact CE-CH2 4.35Å; M125-W132 HydrophobicContact CE-CZ3 3.39Å; M125-W132 HydrophobicContact CG-CE3 4.15Å; M125-W132 PolarHBondContact N-O 3.31Å; M125-W132 PolarHBondContact O-N 3.47Å; M125-W132 HydrophobicContact SD-CE3 3.51Å; M125-W132 VanDerWaalsContact SD-CE3 3.51Å; M125-W132 HydrophobicContact SD-CZ3 3.75Å; M125-L134 HydrophobicContact CE-CD2 4.38Å; M125-F153 HydrophobicContact CB-CZ 4.27Å; M125-N162 CarbonylContact C-O 3.57Å; M125-N162 WeakPolarHBondContact CA-O 3.39Å; M125-I163 HydrophobicContact CE-CD1 4.31Å; M125-I163 HydrophobicContact CG-CD1 4.46Å; M125-I163 HydrophobicContact CG-CG1 4.01Å; M125-I163 HydrophobicContact CG-CG2 4.22Å; M125-I163 HydrophobicContact SD-CD1 4Å; M125-I163 HydrophobicContact SD-CG1 4.15Å; M125-L207 HydrophobicContact CE-CD2 4.06Å; M125-L209 HydrophobicContact CE-CD1 3.78Å; M125-L209 HydrophobicContact CE-CD2 3.79Å; M125-L209 HydrophobicContact CE-CG 4.44Å; M125-L209 HydrophobicContact SD-CD1 4.32Å
126	R	95.9	Very high	93.2	Very high	130 Å²	130	55.3 Å²	55.3	49%	0.491	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.5	172.5	175.1	-176	168.5	-147.8	-14	108.9	F124 G128 Q130 N162	F124-R126 HydrophobicContact CE1-CB 3.91Å; F124-R126 HydrophobicContact CZ-CB 4.05Å; R126-G128 PolarHBondContact NE-O 3.22Å; R126-G128 PolarHBondContact NH2-O 3.2Å; R126-Q130 WeakPolarHBondContact CA-O 3.41Å; R126-N162 PolarHBondContact N-O 3.32Å; R126-N162 PolarHBondContact O-N 3.24Å
127	Y	95.3	Very high	93.5	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	99.7	174.1	-174.3	-153.6	0	0	0	107.9	F102 R129 Q130 F153 M154 L156 D159 I161 T184	F102-Y127 HydrophobicContact CD2-CE1 4.39Å; Y127-R129 PolarHBondContact O-N 3.24Å; Y127-Q130 PolarHBondContact N-O 2.76Å; Y127-Q130 WeakPolarHBondContact O-CA 3.45Å; Y127-Q130 VanDerWaalsContact O-CB 3.3Å; Y127-Q130 WeakPolarHBondContact O-CB 3.26Å; Y127-Q130 PolarHBondContact O-N 3.42Å; Y127-F153 HydrophobicContact CD1-CB 3.97Å; Y127-F153 HydrophobicContact CD1-CD2 4.16Å; Y127-F153 HydrophobicContact CD1-CG 4.11Å; Y127-F153 HydrophobicContact CE1-CB 4.45Å; Y127-M154 VanDerWaalsContact CE1-O 3.27Å; Y127-M154 WeakPolarHBondContact CE1-O 3.41Å; Y127-L156 HydrophobicContact CD1-CD1 4.5Å; Y127-L156 HydrophobicContact CD2-CD1 4.26Å; Y127-L156 HydrophobicContact CE1-CB 4.42Å; Y127-L156 HydrophobicContact CE1-CG 4.37Å; Y127-L156 HydrophobicContact CE2-CB 3.93Å; Y127-L156 HydrophobicContact CE2-CD1 4.36Å; Y127-L156 HydrophobicContact CE2-CG 4.45Å; Y127-L156 HydrophobicContact CG-CD1 4.33Å; Y127-L156 PolarHBondContact OH-N 3.3Å; Y127-L156 PolarHBondContact OH-O 3.19Å; Y127-D159 HydrophobicContact CD2-CB 4.19Å; Y127-D159 HydrophobicContact CE2-CB 4.21Å; Y127-D159 WeakPolarHBondContact CE2-O 3.02Å; Y127-I161 HydrophobicContact CD1-CG1 4.16Å; Y127-I161 HydrophobicContact CD2-CG1 3.67Å; Y127-I161 HydrophobicContact CE1-CG1 4.48Å; Y127-I161 HydrophobicContact CE2-CG1 4.06Å; Y127-I161 HydrophobicContact CG-CG1 3.74Å; Y127-T184 HydrophobicContact CE2-CG2 3.88Å
128	G	92.8	Very high	93.7	Very high	4 Å²	4	53.6 Å²	53.6	4%	0.041	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	-108.6	-167.2	0	0	0	0	0	113.8	R126 D159	R126-G128 PolarHBondContact NE-O 3.22Å; R126-G128 PolarHBondContact NH2-O 3.2Å; G128-D159 VanDerWaalsContact CA-OD1 3.24Å; G128-D159 WeakPolarHBondContact CA-OD1 3.38Å; G128-D159 WeakPolarHBondContact CA-OD2 3.33Å; G128-D159 PolarHBondContact N-OD1 3.19Å
129	R	92.4	Very high	93.9	Very high	243 Å²	243	54.7 Å²	54.7	92%	0.917	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-17.6	175.9	-56.9	-175.5	-171.7	-164	3.7	113.2	Y127	Y127-R129 PolarHBondContact O-N 3.24Å
130	Q	95.1	Very high	93.6	Very high	42 Å²	42	59.3 Å²	59.3	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	145.8	-178.4	-52.1	179	91.4	0	0	110.4	R126 Y127 F153 M154	R126-Q130 WeakPolarHBondContact CA-O 3.41Å; Y127-Q130 PolarHBondContact N-O 2.76Å; Y127-Q130 WeakPolarHBondContact O-CA 3.45Å; Y127-Q130 VanDerWaalsContact O-CB 3.3Å; Y127-Q130 WeakPolarHBondContact O-CB 3.26Å; Y127-Q130 PolarHBondContact O-N 3.42Å; Q130-F153 HydrophobicContact CB-CD1 3.7Å; Q130-F153 HydrophobicContact CB-CE1 3.83Å; Q130-F153 HydrophobicContact CG-CD1 4.48Å; Q130-M154 PolarHBondContact NE2-O 2.96Å
131	R	95.4	Very high	93.1	Very high	171 Å²	171	60.4 Å²	60.4	65%	0.645	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.4	127.5	-170.7	-61.4	179.1	68	168.3	5.8	110.7	F124 M125	F124-R131 HydrophobicContact CE2-CB 4.17Å; F124-R131 HydrophobicContact CE2-CG 4.43Å; F124-R131 HydrophobicContact CZ-CB 4.43Å; F124-R131 HydrophobicContact CZ-CG 4.23Å; F124-R131 VanDerWaalsContact CZ-NE 3.32Å; M125-R131 WeakPolarHBondContact O-CA 3.46Å
132	W	96.6	Very high	92.3	Very high	14 Å²	14	64.7 Å²	64.7	5%	0.053	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.9	170.4	-177.4	35	0	0	0	109.1	I104 M106 F124 M125 L134 G148 M151 F153	I104-W132 HydrophobicContact CB-CZ3 4.37Å; I104-W132 HydrophobicContact CG2-CH2 4.32Å; I104-W132 HydrophobicContact CG2-CZ3 3.77Å; M106-W132 HydrophobicContact CB-CH2 4.11Å; M106-W132 HydrophobicContact CB-CZ2 4.42Å; F124-W132 WeakPolarHBondContact CD2-O 3.47Å; M125-W132 HydrophobicContact CB-CB 4.37Å; M125-W132 HydrophobicContact CE-CE3 3.63Å; M125-W132 HydrophobicContact CE-CH2 4.35Å; M125-W132 HydrophobicContact CE-CZ3 3.39Å; M125-W132 HydrophobicContact CG-CE3 4.15Å; M125-W132 PolarHBondContact N-O 3.31Å; M125-W132 PolarHBondContact O-N 3.47Å; M125-W132 HydrophobicContact SD-CE3 3.51Å; M125-W132 VanDerWaalsContact SD-CE3 3.51Å; M125-W132 HydrophobicContact SD-CZ3 3.75Å; W132-L134 HydrophobicContact CD2-CD2 3.86Å; W132-L134 HydrophobicContact CE3-CD2 4.16Å; W132-L134 HydrophobicContact CG-CD2 4.38Å; W132-L134 HydrophobicContact CH2-CD1 4.21Å; W132-L134 HydrophobicContact CH2-CD2 4.36Å; W132-L134 HydrophobicContact CZ2-CD1 3.88Å; W132-L134 HydrophobicContact CZ2-CD2 4.06Å; W132-L134 HydrophobicContact CZ2-CG 4.42Å; W132-L134 HydrophobicContact CZ3-CD2 4.4Å; W132-G148 VanDerWaalsContact CZ2-O 3.3Å; W132-G148 WeakPolarHBondContact CZ2-O 3.43Å; W132-G148 PolarHBondContact NE1-O 2.88Å; W132-M151 HydrophobicContact CB-CB 4.32Å; W132-M151 HydrophobicContact CB-CE 4.47Å; W132-M151 HydrophobicContact CB-CG 3.8Å; W132-M151 HydrophobicContact CB-SD 4.04Å; W132-M151 HydrophobicContact CD2-CB 3.49Å; W132-M151 VanDerWaalsContact CD2-CB 3.49Å; W132-M151 HydrophobicContact CD2-CG 4Å; W132-M151 HydrophobicContact CE3-CB 3.86Å; W132-M151 HydrophobicContact CE3-CG 4.4Å; W132-M151 HydrophobicContact CG-CB 3.71Å; W132-M151 HydrophobicContact CG-CG 3.72Å; W132-M151 HydrophobicContact CG-SD 4.03Å; W132-M151 HydrophobicContact CH2-CB 4.47Å; W132-M151 HydrophobicContact CZ2-CB 4.16Å; W132-M151 HydrophobicContact CZ3-CB 4.33Å; W132-F153 HydrophobicContact CB-CE1 4.29Å; W132-F153 HydrophobicContact CB-CZ 3.88Å
133	K	95.1	Very high	91.9	Very high	109 Å²	109	71.5 Å²	71.5	47%	0.474	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	113.1	-179.5	178.8	166.2	163.9	143.5	0	108.3	E122 I123 F124	E122-K133 HydrophobicContact CG-CG 4.45Å; E122-K133 WeakPolarHBondContact OE1-CE 3.49Å; E122-K133 IonicContact OE1-NZ 3.97Å; E122-K133 PolarHBondContact OE1-NZ 3.42Å; E122-K133 WeakPolarHBondContact OE2-CE 3.49Å; E122-K133 IonicContact OE2-NZ 2.81Å; E122-K133 PolarHBondContact OE2-NZ 3.43Å; I123-K133 WeakPolarHBondContact O-CA 3.44Å; F124-K133 HydrophobicContact CD2-CB 4.14Å
134	L	94.8	Very high	91.7	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151	-179.3	64.7	161.9	0	0	0	110.8	M106 E122 I123 M125 W132 W146 D147	M106-L134 HydrophobicContact CB-CD1 3.76Å; M106-L134 HydrophobicContact CE-CD1 4.47Å; M106-L134 HydrophobicContact CG-CD1 3.58Å; M106-L134 HydrophobicContact SD-CD1 4.11Å; E122-L134 WeakPolarHBondContact CA-O 3.47Å; I123-L134 HydrophobicContact CB-CD2 3.66Å; I123-L134 HydrophobicContact CB-CG 3.97Å; I123-L134 HydrophobicContact CG2-CD2 3.86Å; I123-L134 PolarHBondContact N-O 2.98Å; I123-L134 PolarHBondContact O-N 3.38Å; M125-L134 HydrophobicContact CE-CD2 4.38Å; W132-L134 HydrophobicContact CD2-CD2 3.86Å; W132-L134 HydrophobicContact CE3-CD2 4.16Å; W132-L134 HydrophobicContact CG-CD2 4.38Å; W132-L134 HydrophobicContact CH2-CD1 4.21Å; W132-L134 HydrophobicContact CH2-CD2 4.36Å; W132-L134 HydrophobicContact CZ2-CD1 3.88Å; W132-L134 HydrophobicContact CZ2-CD2 4.06Å; W132-L134 HydrophobicContact CZ2-CG 4.42Å; W132-L134 HydrophobicContact CZ3-CD2 4.4Å; L134-W146 HydrophobicContact CD1-CD2 4.38Å; L134-W146 HydrophobicContact CD1-CE3 3.76Å; L134-W146 HydrophobicContact CD1-CZ3 4.42Å; L134-W146 HydrophobicContact CG-CE3 4.16Å; L134-D147 WeakPolarHBondContact CA-OD1 3.29Å; L134-D147 VanDerWaalsContact CB-O 3.24Å; L134-D147 WeakPolarHBondContact CB-O 3.28Å
135	K	93.3	Very high	91.4	Very high	87 Å²	87	75 Å²	75	38%	0.378	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.2	177.9	-68.9	179.9	171.7	-174.6	0	110.7	Y121 E122 W146 D147 L168	Y121-K135 CarbonylContact O-C 3.53Å; Y121-K135 VanDerWaalsContact O-CA 3.23Å; Y121-K135 WeakPolarHBondContact O-CA 3.4Å; E122-K135 HydrophobicContact CB-CG 4.27Å; E122-K135 HydrophobicContact CG-CG 4.18Å; E122-K135 WeakPolarHBondContact OE2-CE 3.3Å; E122-K135 IonicContact OE2-NZ 3.37Å; K135-W146 CarbonylContact O-C 3.54Å; K135-W146 WeakPolarHBondContact O-CA 3.35Å; K135-D147 PolarHBondContact N-OD1 2.9Å; K135-D147 PolarHBondContact O-N 3.15Å; K135-L168 HydrophobicContact CD-CD1 4.37Å
136	G	92.7	Very high	91.2	Very high	6 Å²	6	76.8 Å²	76.8	6%	0.062	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	155	-179	0	0	0	0	0	112.8	Q120 Y121 S145 W146	Q120-G136 VanDerWaalsContact CA-O 3.27Å; Q120-G136 WeakPolarHBondContact CA-O 3.45Å; Y121-G136 PolarHBondContact N-O 3.43Å; Y121-G136 PolarHBondContact O-N 3.45Å; G136-S145 CarbonylContact C-O 3.53Å; G136-S145 VanDerWaalsContact CA-O 3.27Å; G136-S145 WeakPolarHBondContact CA-O 3.21Å; G136-W146 VanDerWaalsContact N-CE3 3.27Å; G136-W146 VanDerWaalsContact N-CZ3 3.3Å
137	R	92.1	Very high	91	Very high	102 Å²	102	74.6 Å²	74.6	39%	0.385	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	139.4	161.9	-177.6	-174.2	-57.3	-70	-7.3	110	G118 D119 Q120 Q144 S145	G118-R137 PolarHBondContact O-NH1 3.3Å; D119-R137 VanDerWaalsContact O-CA 3.31Å; D119-R137 WeakPolarHBondContact O-CA 3.44Å; Q120-R137 VanDerWaalsContact CD-CZ 3.46Å; Q120-R137 HydrophobicContact CG-CB 4.33Å; Q120-R137 HydrophobicContact CG-CG 4.33Å; Q120-R137 VanDerWaalsContact CG-NH1 3.3Å; Q120-R137 VanDerWaalsContact NE2-NH1 3.11Å; R137-Q144 WeakPolarHBondContact O-CA 3.36Å; R137-S145 PolarHBondContact N-O 2.57Å; R137-S145 PolarHBondContact O-N 2.9Å
138	I	92.1	Very high	90.4	Very high	5 Å²	5	77 Å²	77	3%	0.026	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	123.4	169	-48.2	-57	0	0	0	109.2	L115 C116 G118 D119 Y121 Q144	L115-I138 HydrophobicContact CB-CD1 4.49Å; L115-I138 HydrophobicContact CB-CG1 4.42Å; L115-I138 HydrophobicContact CD1-CD1 4.37Å; C116-I138 WeakPolarHBondContact O-CB 3.29Å; G118-I138 PolarHBondContact N-O 3.39Å; D119-I138 HydrophobicContact CB-CB 4.48Å; D119-I138 HydrophobicContact CB-CG1 4.04Å; D119-I138 PolarHBondContact O-N 2.86Å; Y121-I138 HydrophobicContact CD2-CD1 4.38Å; Y121-I138 HydrophobicContact CD2-CG1 4.39Å; Y121-I138 HydrophobicContact CE2-CD1 4.16Å; Y121-I138 HydrophobicContact CE2-CG1 3.91Å; I138-Q144 HydrophobicContact CD1-CG 3.8Å
139	E	90.2	Very high	90.1	Very high	60 Å²	60	79.9 Å²	79.9	28%	0.28	39%	0.387	S	S	.	.			trans	-83.2	164.2	178.4	-71.3	-172.1	-174.5	0	0	112.7	N141 S142 R143	E139-N141 WeakPolarHBondContact CB-OD1 3.24Å; E139-N141 PolarHBondContact O-N 3.44Å; E139-N141 VanDerWaalsContact O-N 3.14Å; E139-N141 PolarHBondContact OE2-ND2 2.87Å; E139-N141 PolarHBondContact OE2-OD1 3.34Å; E139-S142 PolarHBondContact O-N 3.46Å; E139-R143 HydrophobicContact CB-CB 4.36Å; E139-R143 WeakPolarHBondContact CB-O 3.47Å; E139-R143 PolarHBondContact N-O 2.82Å
140	V	84.4	Confident	90.1	Very high	134 Å²	134	74.3 Å²	74.3	81%	0.812	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-12	179.8	-168.1	0	0	0	0	113.7	P117	P117-V140 HydrophobicContact CB-CG2 4.47Å
141	N	81.9	Confident	90	Very high	92 Å²	92	74.9 Å²	74.9	49%	0.492	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	13.1	177.5	57.3	21.5	0	0	0	112.1	E139 R143	E139-N141 WeakPolarHBondContact CB-OD1 3.24Å; E139-N141 PolarHBondContact O-N 3.44Å; E139-N141 VanDerWaalsContact O-N 3.14Å; E139-N141 PolarHBondContact OE2-ND2 2.87Å; E139-N141 PolarHBondContact OE2-OD1 3.34Å; N141-R143 WeakPolarHBondContact ND2-CD 3.25Å; N141-R143 PolarHBondContact O-N 3.32Å; N141-R143 VanDerWaalsContact O-N 3.15Å; N141-R143 WeakPolarHBondContact OD1-CB 3.45Å; N141-R143 WeakPolarHBondContact OD1-CG 3.41Å; N141-R143 PolarHBondContact OD1-N 2.96Å
142	S	75.8	Confident	90	Very high	95 Å²	95	69.2 Å²	69.2	66%	0.664	36%	0.359	S	S	*	.	S	Bend	trans	61	9.4	-172.7	-54	0	0	0	0	116.3	E139	E139-S142 PolarHBondContact O-N 3.46Å
143	R	85.8	Confident	89.9	Confident	169 Å²	169	68.6 Å²	68.6	64%	0.638	36%	0.357	S	S	*	.			trans	-72.2	168.8	164.4	-55.7	174.3	83.3	-140	7	109.4	E139 N141	E139-R143 HydrophobicContact CB-CB 4.36Å; E139-R143 WeakPolarHBondContact CB-O 3.47Å; E139-R143 PolarHBondContact N-O 2.82Å; N141-R143 WeakPolarHBondContact ND2-CD 3.25Å; N141-R143 PolarHBondContact O-N 3.32Å; N141-R143 VanDerWaalsContact O-N 3.15Å; N141-R143 WeakPolarHBondContact OD1-CB 3.45Å; N141-R143 WeakPolarHBondContact OD1-CG 3.41Å; N141-R143 PolarHBondContact OD1-N 2.96Å
144	Q	91.3	Very high	89.8	Confident	57 Å²	57	67 Å²	67	27%	0.266	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	136.6	-177.8	-53.6	-178.9	12.7	0	0	109.7	G108 L109 R137 I138	G108-Q144 VanDerWaalsContact CA-OE1 3.27Å; L109-Q144 PolarHBondContact O-NE2 3.33Å; R137-Q144 WeakPolarHBondContact O-CA 3.36Å; I138-Q144 HydrophobicContact CD1-CG 3.8Å
145	S	89.9	Confident	89.8	Confident	54 Å²	54	67.1 Å²	67.1	38%	0.378	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.9	174.7	64.8	0	0	0	0	109	G136 R137	G136-S145 CarbonylContact C-O 3.53Å; G136-S145 VanDerWaalsContact CA-O 3.27Å; G136-S145 WeakPolarHBondContact CA-O 3.21Å; R137-S145 PolarHBondContact N-O 2.57Å; R137-S145 PolarHBondContact O-N 2.9Å
146	W	92.7	Very high	89.7	Confident	38 Å²	38	64.4 Å²	64.4	14%	0.144	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.6	179.3	-63.5	91.1	0	0	0	110.1	M106 L109 I123 L134 K135 G136	M106-W146 HydrophobicContact CE-CD2 3.6Å; M106-W146 HydrophobicContact CE-CE3 3.85Å; M106-W146 HydrophobicContact CE-CG 4.37Å; M106-W146 HydrophobicContact CE-CH2 3.57Å; M106-W146 HydrophobicContact CE-CZ2 3.27Å; M106-W146 HydrophobicContact CE-CZ3 3.83Å; M106-W146 HydrophobicContact CG-CB 4.32Å; M106-W146 HydrophobicContact CG-CD2 3.91Å; M106-W146 HydrophobicContact CG-CE3 4.42Å; M106-W146 HydrophobicContact CG-CG 3.79Å; L109-W146 HydrophobicContact CB-CZ2 4.48Å; L109-W146 HydrophobicContact CD1-CH2 3.73Å; L109-W146 HydrophobicContact CD1-CZ2 4.12Å; L109-W146 HydrophobicContact CG-CH2 3.88Å; L109-W146 HydrophobicContact CG-CZ2 3.95Å; I123-W146 HydrophobicContact CD1-CE3 4.43Å; I123-W146 HydrophobicContact CD1-CH2 3.67Å; I123-W146 HydrophobicContact CD1-CZ3 3.54Å; I123-W146 HydrophobicContact CG1-CH2 4.24Å; I123-W146 HydrophobicContact CG1-CZ3 3.87Å; L134-W146 HydrophobicContact CD1-CD2 4.38Å; L134-W146 HydrophobicContact CD1-CE3 3.76Å; L134-W146 HydrophobicContact CD1-CZ3 4.42Å; L134-W146 HydrophobicContact CG-CE3 4.16Å; K135-W146 CarbonylContact O-C 3.54Å; K135-W146 WeakPolarHBondContact O-CA 3.35Å; G136-W146 VanDerWaalsContact N-CE3 3.27Å; G136-W146 VanDerWaalsContact N-CZ3 3.3Å
147	D	91.1	Very high	89.4	Confident	84 Å²	84	67.9 Å²	67.9	45%	0.449	36%	0.358	S	S	.	.	S	Bend	trans	-86.4	140.5	165.5	65.3	20.3	0	0	0	111.1	L134 K135	L134-D147 WeakPolarHBondContact CA-OD1 3.29Å; L134-D147 VanDerWaalsContact CB-O 3.24Å; L134-D147 WeakPolarHBondContact CB-O 3.28Å; K135-D147 PolarHBondContact N-OD1 2.9Å; K135-D147 PolarHBondContact O-N 3.15Å
148	G	82.3	Confident	89.1	Confident	50 Å²	50	67.5 Å²	67.5	52%	0.515	37%	0.371	S	S	.	.	S	Bend	trans	52.2	61.5	-178.8	0	0	0	0	0	113.6	W132 E150	W132-G148 VanDerWaalsContact CZ2-O 3.3Å; W132-G148 WeakPolarHBondContact CZ2-O 3.43Å; W132-G148 PolarHBondContact NE1-O 2.88Å; G148-E150 PolarHBondContact O-N 3.08Å
149	D	86.6	Confident	89	Confident	65 Å²	65	70.3 Å²	70.3	35%	0.348	39%	0.386	S	S	.	.			trans	-73.1	-0.5	-172.2	66.9	-61.7	0	0	0	115.1	K105 M106	K105-D149 CarbonylContact C-O 3.53Å; K105-D149 VanDerWaalsContact CA-O 3.29Å; K105-D149 WeakPolarHBondContact CA-O 3.49Å; K105-D149 WeakPolarHBondContact CG-O 3.47Å; K105-D149 IonicContact NZ-OD2 3.74Å; K105-D149 PolarHBondContact NZ-OD2 3.23Å; M106-D149 HydrophobicContact CB-CB 4.27Å; M106-D149 PolarHBondContact N-O 2.65Å
150	E	92.9	Very high	89.2	Confident	126 Å²	126	71.4 Å²	71.4	59%	0.589	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.5	175.7	-70.8	173.1	173.6	0	0	110.7	I104 K105 G148	I104-E150 WeakPolarHBondContact O-CA 3.12Å; K105-E150 HydrophobicContact CB-CG 4.12Å; K105-E150 HydrophobicContact CD-CG 4.09Å; K105-E150 HydrophobicContact CG-CG 3.8Å; K105-E150 IonicContact NZ-OE1 3.69Å; K105-E150 PolarHBondContact NZ-OE1 2.82Å; G148-E150 PolarHBondContact O-N 3.08Å
151	M	94.1	Very high	89.7	Confident	54 Å²	54	65.4 Å²	65.4	27%	0.266	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	144.5	175.5	-176.7	73.2	-174.3	0	0	110.2	I104 W132 F153	I104-M151 PolarHBondContact N-O 3.15Å; I104-M151 PolarHBondContact O-N 3.39Å; W132-M151 HydrophobicContact CB-CB 4.32Å; W132-M151 HydrophobicContact CB-CE 4.47Å; W132-M151 HydrophobicContact CB-CG 3.8Å; W132-M151 HydrophobicContact CB-SD 4.04Å; W132-M151 HydrophobicContact CD2-CB 3.49Å; W132-M151 VanDerWaalsContact CD2-CB 3.49Å; W132-M151 HydrophobicContact CD2-CG 4Å; W132-M151 HydrophobicContact CE3-CB 3.86Å; W132-M151 HydrophobicContact CE3-CG 4.4Å; W132-M151 HydrophobicContact CG-CB 3.71Å; W132-M151 HydrophobicContact CG-CG 3.72Å; W132-M151 HydrophobicContact CG-SD 4.03Å; W132-M151 HydrophobicContact CH2-CB 4.47Å; W132-M151 HydrophobicContact CZ2-CB 4.16Å; W132-M151 HydrophobicContact CZ3-CB 4.33Å; M151-F153 HydrophobicContact CE-CD1 4.03Å; M151-F153 HydrophobicContact CE-CE1 3.76Å; M151-F153 HydrophobicContact CG-CD1 4.19Å; M151-F153 HydrophobicContact CG-CE1 3.93Å; M151-F153 HydrophobicContact CG-CZ 4.24Å
152	V	94.1	Very high	90.3	Very high	53 Å²	53	63.4 Å²	63.4	32%	0.321	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.5	168.6	-174.2	0	0	0	0	109.7	E101 F102	E101-V152 HydrophobicContact CB-CG1 3.83Å; E101-V152 HydrophobicContact CG-CG1 3.94Å; F102-V152 CarbonylContact O-C 3.45Å; F102-V152 WeakPolarHBondContact O-CA 3.27Å
153	F	94.8	Very high	91.3	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.2	168.5	-72.2	-36.7	0	0	0	110.4	F102 I104 M125 Y127 Q130 W132 M151	F102-F153 PolarHBondContact N-O 3.18Å; F102-F153 PolarHBondContact O-N 3.37Å; I104-F153 HydrophobicContact CD1-CD2 3.67Å; I104-F153 HydrophobicContact CD1-CE2 4.08Å; M125-F153 HydrophobicContact CB-CZ 4.27Å; Y127-F153 HydrophobicContact CD1-CB 3.97Å; Y127-F153 HydrophobicContact CD1-CD2 4.16Å; Y127-F153 HydrophobicContact CD1-CG 4.11Å; Y127-F153 HydrophobicContact CE1-CB 4.45Å; Q130-F153 HydrophobicContact CB-CD1 3.7Å; Q130-F153 HydrophobicContact CB-CE1 3.83Å; Q130-F153 HydrophobicContact CG-CD1 4.48Å; W132-F153 HydrophobicContact CB-CE1 4.29Å; W132-F153 HydrophobicContact CB-CZ 3.88Å; M151-F153 HydrophobicContact CE-CD1 4.03Å; M151-F153 HydrophobicContact CE-CE1 3.76Å; M151-F153 HydrophobicContact CG-CD1 4.19Å; M151-F153 HydrophobicContact CG-CE1 3.93Å; M151-F153 HydrophobicContact CG-CZ 4.24Å
154	M	93.8	Very high	91.7	Very high	77 Å²	77	55.2 Å²	55.2	38%	0.379	30%	0.303	S	S	.	.			trans	-66.2	135.2	162.2	-51.1	-51	-61.9	0	0	108.4	G100 E101 Y127 Q130	G100-M154 WeakPolarHBondContact O-CE 3.19Å; E101-M154 HydrophobicContact CG-CE 4.33Å; E101-M154 HydrophobicContact CG-SD 4.13Å; Y127-M154 VanDerWaalsContact CE1-O 3.27Å; Y127-M154 WeakPolarHBondContact CE1-O 3.41Å; Q130-M154 PolarHBondContact NE2-O 2.96Å
155	P	93.3	Very high	91.9	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	29%	0.291	C	S	.	.			trans	-63.3	150.5	169.9	-21.6	34.8	0	0	0	111.9	L99 G100 F102 F188	L99-P155 HydrophobicContact CB-CB 3.7Å; L99-P155 HydrophobicContact CB-CG 3.85Å; L99-P155 HydrophobicContact CD1-CB 4.04Å; G100-P155 WeakPolarHBondContact O-CD 3.4Å; F102-P155 HydrophobicContact CD2-CB 4.2Å; F102-P155 HydrophobicContact CD2-CG 3.81Å; F102-P155 HydrophobicContact CE1-CG 4.44Å; F102-P155 HydrophobicContact CE2-CB 3.73Å; F102-P155 HydrophobicContact CE2-CG 3.7Å; F102-P155 HydrophobicContact CG-CG 4.25Å; F102-P155 HydrophobicContact CZ-CB 4.21Å; F102-P155 HydrophobicContact CZ-CG 4.03Å; P155-F188 HydrophobicContact CB-CE1 3.88Å; P155-F188 HydrophobicContact CB-CZ 3.72Å; P155-F188 HydrophobicContact CG-CE1 3.95Å; P155-F188 HydrophobicContact CG-CZ 4.28Å
156	L	91.9	Very high	92.1	Very high	30 Å²	30	50.8 Å²	50.8	16%	0.157	28%	0.278	C	S	.	.			trans	-137.4	139	178	-59.5	172.3	0	0	0	107.7	E96 Y127 D159	E96-L156 VanDerWaalsContact OE1-CA 3.29Å; E96-L156 WeakPolarHBondContact OE1-CA 3.31Å; Y127-L156 HydrophobicContact CD1-CD1 4.5Å; Y127-L156 HydrophobicContact CD2-CD1 4.26Å; Y127-L156 HydrophobicContact CE1-CB 4.42Å; Y127-L156 HydrophobicContact CE1-CG 4.37Å; Y127-L156 HydrophobicContact CE2-CB 3.93Å; Y127-L156 HydrophobicContact CE2-CD1 4.36Å; Y127-L156 HydrophobicContact CE2-CG 4.45Å; Y127-L156 HydrophobicContact CG-CD1 4.33Å; Y127-L156 PolarHBondContact OH-N 3.3Å; Y127-L156 PolarHBondContact OH-O 3.19Å; L156-D159 HydrophobicContact CB-CB 3.99Å; L156-D159 HydrophobicContact CD1-CB 3.86Å
157	I	87.3	Confident	92	Very high	80 Å²	80	50.3 Å²	50.3	41%	0.41	28%	0.277	S	S	.	.	S	Bend	trans	-87.7	-39.2	-174.9	-62.1	168	0	0	0	110.7	L95 E96 L99	L95-I157 HydrophobicContact CB-CD1 3.93Å; L95-I157 HydrophobicContact CD2-CD1 3.8Å; L95-I157 HydrophobicContact CG-CD1 3.86Å; E96-I157 HydrophobicContact CG-CB 4.34Å; E96-I157 HydrophobicContact CG-CD1 3.87Å; E96-I157 HydrophobicContact CG-CG1 3.83Å; E96-I157 PolarHBondContact OE1-N 3.05Å; L99-I157 HydrophobicContact CD1-CD1 4.19Å; L99-I157 HydrophobicContact CD1-CG1 3.77Å
158	S	84.2	Confident	92	Very high	94 Å²	94	47.3 Å²	47.3	66%	0.657	26%	0.261	S	S	*	.	S	Bend	trans	-92.4	-7.9	-175.5	-72.7	0	0	0	0	115.1
159	D	91.2	Very high	91.9	Very high	64 Å²	64	49.4 Å²	49.4	34%	0.342	26%	0.256	S	S	.	.			trans	-111.1	156.9	-176.1	-103.5	-60.1	0	0	0	111.3	Y127 G128 L156	Y127-D159 HydrophobicContact CD2-CB 4.19Å; Y127-D159 HydrophobicContact CE2-CB 4.21Å; Y127-D159 WeakPolarHBondContact CE2-O 3.02Å; G128-D159 VanDerWaalsContact CA-OD1 3.24Å; G128-D159 WeakPolarHBondContact CA-OD1 3.38Å; G128-D159 WeakPolarHBondContact CA-OD2 3.33Å; G128-D159 PolarHBondContact N-OD1 3.19Å; L156-D159 HydrophobicContact CB-CB 3.99Å; L156-D159 HydrophobicContact CD1-CB 3.86Å
160	L	93.6	Very high	91	Very high	82 Å²	82	48.8 Å²	48.8	43%	0.429	27%	0.266	S	S	.	.			trans	-121.8	156.4	177.7	-58.2	178.7	0	0	0	110.9	N162 I181 E183	L160-N162 PolarHBondContact O-N 2.68Å; L160-I181 HydrophobicContact CB-CG2 3.6Å; L160-I181 HydrophobicContact CD1-CG2 3.7Å; L160-I181 HydrophobicContact CG-CG2 4.31Å; L160-E183 HydrophobicContact CD2-CG 4.1Å
161	I	94.6	Very high	89.6	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.041	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	102.7	179.2	-56.3	179	0	0	0	109.3	I104 Y127 I163 I181 C182 T184 L187	I104-I161 HydrophobicContact CD1-CD1 4.49Å; Y127-I161 HydrophobicContact CD1-CG1 4.16Å; Y127-I161 HydrophobicContact CD2-CG1 3.67Å; Y127-I161 HydrophobicContact CE1-CG1 4.48Å; Y127-I161 HydrophobicContact CE2-CG1 4.06Å; Y127-I161 HydrophobicContact CG-CG1 3.74Å; I161-I163 HydrophobicContact CG2-CD1 4.36Å; I161-I163 HydrophobicContact CG2-CG1 3.91Å; I161-I181 WeakPolarHBondContact O-CA 3.28Å; I161-C182 HydrophobicContact CB-CB 4.32Å; I161-C182 PolarHBondContact N-O 2.98Å; I161-C182 PolarHBondContact O-N 3.3Å; I161-T184 HydrophobicContact CD1-CG2 3.69Å; I161-T184 HydrophobicContact CG1-CG2 3.69Å; I161-L187 HydrophobicContact CD1-CD1 3.85Å
162	N	95.8	Very high	87.9	Confident	50 Å²	50	53.6 Å²	53.6	27%	0.267	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	122.5	169.7	177	-111.6	0	0	0	110.4	M125 R126 L160 V180 I181	M125-N162 CarbonylContact C-O 3.57Å; M125-N162 WeakPolarHBondContact CA-O 3.39Å; R126-N162 PolarHBondContact N-O 3.32Å; R126-N162 PolarHBondContact O-N 3.24Å; L160-N162 PolarHBondContact O-N 2.68Å; N162-V180 PolarHBondContact ND2-O 3.11Å; N162-I181 HydrophobicContact CB-CG1 4.44Å
163	I	95.9	Very high	86.7	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.015	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.8	175.8	-52.5	-176	0	0	0	109.1	I123 M125 I161 V165 S179 V180 L207 L209	I123-I163 HydrophobicContact CG2-CG2 3.92Å; M125-I163 HydrophobicContact CE-CD1 4.31Å; M125-I163 HydrophobicContact CG-CD1 4.46Å; M125-I163 HydrophobicContact CG-CG1 4.01Å; M125-I163 HydrophobicContact CG-CG2 4.22Å; M125-I163 HydrophobicContact SD-CD1 4Å; M125-I163 HydrophobicContact SD-CG1 4.15Å; I161-I163 HydrophobicContact CG2-CD1 4.36Å; I161-I163 HydrophobicContact CG2-CG1 3.91Å; I163-V165 HydrophobicContact CG2-CG2 4.33Å; I163-S179 CarbonylContact O-C 3.55Å; I163-S179 WeakPolarHBondContact O-CA 3.46Å; I163-S179 WeakPolarHBondContact O-CB 3.39Å; I163-S179 PolarHBondContact O-OG 3.19Å; I163-V180 HydrophobicContact CB-CG1 3.87Å; I163-V180 PolarHBondContact N-O 3.47Å; I163-V180 PolarHBondContact O-N 3.33Å; I163-L207 HydrophobicContact CD1-CD2 4.12Å; I163-L207 HydrophobicContact CG2-CD2 3.73Å; I163-L209 HydrophobicContact CD1-CD1 4.35Å
164	K	95.6	Very high	86.2	Confident	89 Å²	89	60.9 Å²	60.9	39%	0.387	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.8	175.6	-175.8	177.9	-177.8	175.4	0	110	I123 F124 L176	I123-K164 WeakPolarHBondContact CA-O 3.28Å; F124-K164 PolarHBondContact N-O 3.13Å; F124-K164 PolarHBondContact O-N 3.34Å; K164-L176 HydrophobicContact CD-CD1 4.31Å; K164-L176 HydrophobicContact CG-CD1 3.77Å
165	V	94.7	Very high	85.9	Confident	1 Å²	1	62 Å²	62	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.2	-179.9	-175.9	0	0	0	0	109.7	L109 Y121 I123 I163 V177 G178 V199	L109-V165 HydrophobicContact CD1-CG1 4.34Å; Y121-V165 HydrophobicContact CD1-CG1 4.38Å; I123-V165 HydrophobicContact CG1-CG1 4.19Å; I123-V165 HydrophobicContact CG1-CG2 4.12Å; I123-V165 HydrophobicContact CG2-CG2 4.36Å; I163-V165 HydrophobicContact CG2-CG2 4.33Å; V165-V177 HydrophobicContact CB-CB 4.23Å; V165-V177 HydrophobicContact CG1-CB 4.03Å; V165-V177 HydrophobicContact CG1-CG1 4.38Å; V165-V177 HydrophobicContact CG1-CG2 4.25Å; V165-V177 WeakPolarHBondContact O-CB 3.48Å; V165-V177 PolarHBondContact O-N 3.47Å; V165-G178 PolarHBondContact N-O 2.91Å; V165-G178 PolarHBondContact O-N 3.16Å; V165-V199 HydrophobicContact CB-CG1 3.56Å; V165-V199 HydrophobicContact CG1-CG1 4.23Å; V165-V199 HydrophobicContact CG2-CB 4.39Å; V165-V199 HydrophobicContact CG2-CG1 3.51Å; V165-V199 HydrophobicContact CG2-CG2 3.92Å
166	T	93.2	Very high	85.8	Confident	18 Å²	18	66.7 Å²	66.7	11%	0.11	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	130.5	-173.9	-48.7	0	0	0	0	110	Y121 E122 H174 M175	Y121-T166 CarbonylContact C-O 3.37Å; Y121-T166 VanDerWaalsContact CA-O 3.31Å; Y121-T166 WeakPolarHBondContact CA-O 3.45Å; E122-T166 PolarHBondContact N-O 3.18Å; E122-T166 PolarHBondContact O-N 2.73Å; T166-H174 HydrophobicContact CG2-CB 3.79Å; T166-M175 CarbonylContact C-O 3.55Å; T166-M175 WeakPolarHBondContact CA-O 3.37Å; T166-M175 WeakPolarHBondContact CG2-O 3.37Å
167	E	92	Very high	85.7	Confident	27 Å²	27	66.5 Å²	66.5	13%	0.126	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	133.8	175.5	-167.4	-161.7	144.5	0	0	110.6	Q120 Y121 K169 H174 M175 V177	Q120-E167 WeakPolarHBondContact O-CA 3.24Å; Y121-E167 HydrophobicContact CD1-CB 3.95Å; Y121-E167 HydrophobicContact CD1-CG 4.1Å; Y121-E167 HydrophobicContact CE1-CB 3.78Å; Y121-E167 HydrophobicContact CE1-CG 3.65Å; E167-K169 HydrophobicContact CG-CG 4.42Å; E167-K169 PolarHBondContact O-N 3.37Å; E167-K169 WeakPolarHBondContact OE1-CE 3.31Å; E167-K169 WeakPolarHBondContact OE1-CG 3.27Å; E167-K169 IonicContact OE1-NZ 2.92Å; E167-K169 PolarHBondContact OE1-NZ 3.11Å; E167-K169 IonicContact OE2-NZ 2.64Å; E167-K169 PolarHBondContact OE2-NZ 3.38Å; E167-H174 WeakPolarHBondContact O-CA 3.36Å; E167-M175 HydrophobicContact CB-CB 4.35Å; E167-M175 PolarHBondContact N-O 3Å; E167-M175 PolarHBondContact O-N 3.24Å; E167-V177 HydrophobicContact CB-CG2 3.8Å
168	L	89.4	Confident	85.9	Confident	21 Å²	21	63.3 Å²	63.3	11%	0.11	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	75.8	-173.4	-56.6	-177	0	0	0	111.3	Q120 E122 K135 G170	Q120-L168 HydrophobicContact CB-CB 3.92Å; Q120-L168 HydrophobicContact CB-CD1 4.38Å; Q120-L168 HydrophobicContact CB-CG 4.49Å; Q120-L168 PolarHBondContact O-N 3.46Å; E122-L168 HydrophobicContact CB-CD1 4.14Å; E122-L168 HydrophobicContact CB-CD2 3.86Å; E122-L168 HydrophobicContact CB-CG 4.14Å; K135-L168 HydrophobicContact CD-CD1 4.37Å; L168-G170 VanDerWaalsContact C-N 3.26Å; L168-G170 PolarHBondContact O-N 3.34Å
169	K	81.2	Confident	86.3	Confident	94 Å²	94	61.6 Å²	61.6	41%	0.409	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	74.4	175.4	-69.7	-175.2	161.1	88.9	0	111.2	E167 T173 M175	E167-K169 HydrophobicContact CG-CG 4.42Å; E167-K169 PolarHBondContact O-N 3.37Å; E167-K169 WeakPolarHBondContact OE1-CE 3.31Å; E167-K169 WeakPolarHBondContact OE1-CG 3.27Å; E167-K169 IonicContact OE1-NZ 2.92Å; E167-K169 PolarHBondContact OE1-NZ 3.11Å; E167-K169 IonicContact OE2-NZ 2.64Å; E167-K169 PolarHBondContact OE2-NZ 3.38Å; K169-T173 CarbonylContact C-O 3.49Å; K169-T173 WeakPolarHBondContact CA-O 3.45Å; K169-T173 WeakPolarHBondContact CB-O 3.35Å; K169-T173 PolarHBondContact N-O 3.4Å; K169-T173 VanDerWaalsContact N-O 3.15Å; K169-T173 PolarHBondContact O-OG1 3.09Å; K169-M175 PolarHBondContact NZ-SD 2.97Å
170	G	68.2	Low	86.5	Confident	53 Å²	53	60.1 Å²	60.1	55%	0.546	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-154.7	172.1	0	0	0	0	0	114.9	L168	L168-G170 VanDerWaalsContact C-N 3.26Å; L168-G170 PolarHBondContact O-N 3.34Å
171	L	63.6	Low	86.4	Confident	188 Å²	188	61.4 Å²	61.4	98%	0.984	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-6.3	-169.5	-70.5	174.3	0	0	0	115.7
172	A	58	Low	86.2	Confident	93 Å²	93	62.2 Å²	62.2	77%	0.769	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.8	-23.5	-170.5	0	0	0	0	0	115.5
173	T	69.3	Low	85.9	Confident	94 Å²	94	66.9 Å²	66.9	58%	0.577	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	103.1	-176.1	38.8	0	0	0	0	110.9	K169	K169-T173 CarbonylContact C-O 3.49Å; K169-T173 WeakPolarHBondContact CA-O 3.45Å; K169-T173 WeakPolarHBondContact CB-O 3.35Å; K169-T173 PolarHBondContact N-O 3.4Å; K169-T173 VanDerWaalsContact N-O 3.15Å; K169-T173 PolarHBondContact O-OG1 3.09Å
174	H	84.6	Confident	85.6	Confident	112 Å²	112	67.4 Å²	67.4	52%	0.519	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.9	170.3	-67.2	-174.4	0	0	0	109	T166 E167	T166-H174 HydrophobicContact CG2-CB 3.79Å; E167-H174 WeakPolarHBondContact O-CA 3.36Å
175	M	87.4	Confident	85.2	Confident	99 Å²	99	71.1 Å²	71.1	49%	0.488	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.2	-176.1	178.1	174.4	-77.1	0	0	109.9	T166 E167 K169 V177	T166-M175 CarbonylContact C-O 3.55Å; T166-M175 WeakPolarHBondContact CA-O 3.37Å; T166-M175 WeakPolarHBondContact CG2-O 3.37Å; E167-M175 HydrophobicContact CB-CB 4.35Å; E167-M175 PolarHBondContact N-O 3Å; E167-M175 PolarHBondContact O-N 3.24Å; K169-M175 PolarHBondContact NZ-SD 2.97Å; M175-V177 PolarHBondContact O-N 3.17Å
176	L	90.4	Very high	84.7	Confident	101 Å²	101	78.9 Å²	78.9	53%	0.529	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	120.1	173.9	-179.3	57.2	0	0	0	109.2	K164 G178	K164-L176 HydrophobicContact CD-CD1 4.31Å; K164-L176 HydrophobicContact CG-CD1 3.77Å; L176-G178 WeakPolarHBondContact CD1-O 3.18Å
177	V	90	Very high	84.6	Confident	26 Å²	26	78.7 Å²	78.7	16%	0.158	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-32.3	176.9	-177.5	0	0	0	0	110.7	Y121 V165 E167 M175 V199 N200 I205	Y121-V177 HydrophobicContact CD1-CG2 4.09Å; Y121-V177 HydrophobicContact CE1-CG2 3.96Å; V165-V177 HydrophobicContact CB-CB 4.23Å; V165-V177 HydrophobicContact CG1-CB 4.03Å; V165-V177 HydrophobicContact CG1-CG1 4.38Å; V165-V177 HydrophobicContact CG1-CG2 4.25Å; V165-V177 WeakPolarHBondContact O-CB 3.48Å; V165-V177 PolarHBondContact O-N 3.47Å; E167-V177 HydrophobicContact CB-CG2 3.8Å; M175-V177 PolarHBondContact O-N 3.17Å; V177-V199 HydrophobicContact CG1-CG1 4.12Å; V177-N200 PolarHBondContact O-ND2 2.94Å; V177-I205 HydrophobicContact CG1-CD1 3.46Å; V177-I205 VanDerWaalsContact CG1-CD1 3.46Å; V177-I205 HydrophobicContact CG1-CG2 4.49Å
178	G	91.4	Very high	84.5	Confident	12 Å²	12	80.4 Å²	80.4	12%	0.124	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.2	174.3	173.8	0	0	0	0	0	111.8	V165 L176 V199	V165-G178 PolarHBondContact N-O 2.91Å; V165-G178 PolarHBondContact O-N 3.16Å; L176-G178 WeakPolarHBondContact CD1-O 3.18Å; G178-V199 CarbonylContact C-O 3.35Å; G178-V199 VanDerWaalsContact CA-O 3.24Å; G178-V199 WeakPolarHBondContact CA-O 3.38Å
179	S	92.9	Very high	84.5	Confident	58 Å²	58	81.6 Å²	81.6	41%	0.406	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	138	174.9	-164.3	0	0	0	0	109.1	I163 V199	I163-S179 CarbonylContact O-C 3.55Å; I163-S179 WeakPolarHBondContact O-CA 3.46Å; I163-S179 WeakPolarHBondContact O-CB 3.39Å; I163-S179 PolarHBondContact O-OG 3.19Å; S179-V199 PolarHBondContact N-O 2.98Å
180	V	94.3	Very high	84.5	Confident	34 Å²	34	81.7 Å²	81.7	21%	0.206	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	153.5	-171.7	58.3	0	0	0	0	109	N162 I163 V197	N162-V180 PolarHBondContact ND2-O 3.11Å; I163-V180 HydrophobicContact CB-CG1 3.87Å; I163-V180 PolarHBondContact N-O 3.47Å; I163-V180 PolarHBondContact O-N 3.33Å; V180-V197 HydrophobicContact CB-CG1 4.47Å; V180-V197 HydrophobicContact CG1-CG1 3.66Å; V180-V197 HydrophobicContact CG2-CG1 4.01Å
181	I	92.6	Very high	85.4	Confident	109 Å²	109	85.9 Å²	85.9	56%	0.559	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.8	173.7	-61.9	172.3	0	0	0	106.3	L160 I161 N162	L160-I181 HydrophobicContact CB-CG2 3.6Å; L160-I181 HydrophobicContact CD1-CG2 3.7Å; L160-I181 HydrophobicContact CG-CG2 4.31Å; I161-I181 WeakPolarHBondContact O-CA 3.28Å; N162-I181 HydrophobicContact CB-CG1 4.44Å
182	C	90.3	Very high	86.7	Confident	24 Å²	24	80.4 Å²	80.4	16%	0.162	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.4	-176.8	-41.3	0	0	0	0	109.1	I161	I161-C182 HydrophobicContact CB-CB 4.32Å; I161-C182 PolarHBondContact N-O 2.98Å; I161-C182 PolarHBondContact O-N 3.3Å
183	E	89.3	Confident	88.3	Confident	149 Å²	149	78.4 Å²	78.4	70%	0.696	42%	0.421	S	S	*	.			trans	-75.9	155.5	167.3	-66	-178.7	-147.2	0	0	110.5	L160	L160-E183 HydrophobicContact CD2-CG 4.1Å
184	T	89.7	Confident	89.4	Confident	14 Å²	14	78.5 Å²	78.5	9%	0.086	42%	0.421	C	S	.	.	S	Bend	trans	-109.1	-6.4	-172.5	51.9	0	0	0	0	113.9	Y127 I161 E186 L187 F188	Y127-T184 HydrophobicContact CE2-CG2 3.88Å; I161-T184 HydrophobicContact CD1-CG2 3.69Å; I161-T184 HydrophobicContact CG1-CG2 3.69Å; T184-E186 VanDerWaalsContact C-N 3.28Å; T184-E186 PolarHBondContact O-N 3.35Å; T184-L187 HydrophobicContact CG2-CD1 4.06Å; T184-L187 WeakPolarHBondContact O-CB 3.31Å; T184-L187 PolarHBondContact O-N 3.41Å; T184-F188 WeakPolarHBondContact O-CD2 3.42Å
185	K	86.1	Confident	89.8	Confident	166 Å²	166	75 Å²	75	72%	0.722	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-55.3	-43	179.5	-172	176.6	-178.8	177.3	0	112	L187	K185-L187 PolarHBondContact O-N 3.1Å
186	E	84.8	Confident	90.1	Very high	164 Å²	164	72.9 Å²	72.9	77%	0.766	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-72.9	-9.8	179.4	-61.1	-175.6	167.9	0	0	113.9	T184 Q193	T184-E186 VanDerWaalsContact C-N 3.28Å; T184-E186 PolarHBondContact O-N 3.35Å; E186-Q193 PolarHBondContact O-NE2 2.95Å
187	L	90.7	Very high	90.2	Very high	15 Å²	15	69 Å²	69	8%	0.079	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-83.9	-16.8	-179.1	-56.5	-174	0	0	0	113.4	F102 I161 T184 K185 T189 V195 V211	F102-L187 HydrophobicContact CD1-CB 4.19Å; F102-L187 HydrophobicContact CE1-CB 3.59Å; F102-L187 WeakPolarHBondContact CE1-O 3.4Å; F102-L187 HydrophobicContact CE2-CB 4.3Å; F102-L187 HydrophobicContact CE2-CD1 4.42Å; F102-L187 HydrophobicContact CZ-CB 3.65Å; I161-L187 HydrophobicContact CD1-CD1 3.85Å; T184-L187 HydrophobicContact CG2-CD1 4.06Å; T184-L187 WeakPolarHBondContact O-CB 3.31Å; T184-L187 PolarHBondContact O-N 3.41Å; K185-L187 PolarHBondContact O-N 3.1Å; L187-T189 VanDerWaalsContact C-N 3.28Å; L187-T189 PolarHBondContact O-N 3.05Å; L187-V195 HydrophobicContact CD2-CG2 4.06Å; L187-V211 HydrophobicContact CB-CG1 4.28Å; L187-V211 HydrophobicContact CD2-CB 4.47Å; L187-V211 HydrophobicContact CD2-CG1 4.36Å; L187-V211 HydrophobicContact CD2-CG2 4.18Å
188	F	90.6	Very high	90.3	Very high	62 Å²	62	70.5 Å²	70.5	27%	0.272	39%	0.393	S	S	.	.			trans	-78.4	70.6	178.9	-65.7	-77.7	0	0	0	111.6	L99 F102 P155 T184 W213	L99-F188 HydrophobicContact CB-CE1 4.16Å; L99-F188 HydrophobicContact CD1-CE1 4.45Å; L99-F188 HydrophobicContact CD1-CZ 4.1Å; L99-F188 HydrophobicContact CD2-CE1 3.87Å; L99-F188 HydrophobicContact CD2-CZ 4.13Å; L99-F188 HydrophobicContact CG-CE1 4.37Å; F102-F188 AromaticContact CE1-CD1 3.84Å; F102-F188 HydrophobicContact CE1-CD1 3.84Å; F102-F188 AromaticContact CE1-CE1 3.94Å; F102-F188 HydrophobicContact CE1-CE1 3.94Å; F102-F188 HydrophobicContact CE1-CG 4.18Å; F102-F188 HydrophobicContact CE1-CZ 4.39Å; F102-F188 HydrophobicContact CE2-CE1 4.36Å; F102-F188 HydrophobicContact CE2-CZ 4.14Å; F102-F188 AromaticContact CZ-CD1 3.77Å; F102-F188 HydrophobicContact CZ-CD1 3.77Å; F102-F188 AromaticContact CZ-CD2 4Å; F102-F188 HydrophobicContact CZ-CD2 4Å; F102-F188 AromaticContact CZ-CE1 3.5Å; F102-F188 HydrophobicContact CZ-CE1 3.5Å; F102-F188 AromaticContact CZ-CE2 3.76Å; F102-F188 HydrophobicContact CZ-CE2 3.76Å; F102-F188 HydrophobicContact CZ-CG 4.02Å; F102-F188 AromaticContact CZ-CZ 3.51Å; F102-F188 HydrophobicContact CZ-CZ 3.51Å; P155-F188 HydrophobicContact CB-CE1 3.88Å; P155-F188 HydrophobicContact CB-CZ 3.72Å; P155-F188 HydrophobicContact CG-CE1 3.95Å; P155-F188 HydrophobicContact CG-CZ 4.28Å; T184-F188 WeakPolarHBondContact O-CD2 3.42Å; F188-W213 HydrophobicContact CB-CE3 4.48Å; F188-W213 HydrophobicContact CD1-CD2 4.06Å; F188-W213 AromaticContact CD1-CE2 3.73Å; F188-W213 HydrophobicContact CD1-CG 4.27Å; F188-W213 HydrophobicContact CD1-CZ2 4.12Å; F188-W213 AromaticContact CD1-NE1 3.74Å
189	T	88.3	Confident	90.2	Very high	46 Å²	46	70 Å²	70	28%	0.282	39%	0.387	S	S	.	.			trans	-119.7	134.4	-179.5	57.3	0	0	0	0	111.9	L187 M191 Q193	L187-T189 VanDerWaalsContact C-N 3.28Å; L187-T189 PolarHBondContact O-N 3.05Å; T189-M191 PolarHBondContact O-N 3.15Å; T189-M191 VanDerWaalsContact O-N 3.11Å; T189-M191 PolarHBondContact OG1-O 3.06Å; T189-Q193 VanDerWaalsContact CG2-NE2 3.28Å; T189-Q193 WeakPolarHBondContact OG1-CG 3.12Å; T189-Q193 PolarHBondContact OG1-NE2 3.19Å
190	A	82.8	Confident	89.9	Confident	96 Å²	96	68.4 Å²	68.4	79%	0.793	37%	0.374	S	S	*	.	S	Bend	trans	-65.6	-12.3	179	0	0	0	0	0	114.5
191	M	86.9	Confident	89.3	Confident	141 Å²	141	72.8 Å²	72.8	70%	0.695	40%	0.397	S	S	*	.	S	Bend	trans	-115.3	144.4	176.3	-69.4	-62.9	-65.8	0	0	110.8	T189 Q193	T189-M191 PolarHBondContact O-N 3.15Å; T189-M191 VanDerWaalsContact O-N 3.11Å; T189-M191 PolarHBondContact OG1-O 3.06Å; M191-Q193 PolarHBondContact O-N 3.14Å
192	P	90.9	Very high	88.9	Confident	73 Å²	73	74 Å²	74	47%	0.474	40%	0.404	S	S	.	.			trans	-56.4	128.4	168.4	-24.2	33.5	0	0	0	111.5	V211 T212	P192-V211 WeakPolarHBondContact CA-O 3.25Å; P192-T212 WeakPolarHBondContact CB-OG1 3.33Å; P192-T212 HydrophobicContact CG-CG2 3.94Å
193	Q	91.2	Very high	88.5	Confident	52 Å²	52	73.6 Å²	73.6	24%	0.243	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	150.2	-176.5	54.7	165.4	-37.2	0	0	112	E186 T189 M191 V195 E210 V211	E186-Q193 PolarHBondContact O-NE2 2.95Å; T189-Q193 VanDerWaalsContact CG2-NE2 3.28Å; T189-Q193 WeakPolarHBondContact OG1-CG 3.12Å; T189-Q193 PolarHBondContact OG1-NE2 3.19Å; M191-Q193 PolarHBondContact O-N 3.14Å; Q193-V195 HydrophobicContact CG-CG2 4.38Å; Q193-E210 CarbonylContact O-C 3.53Å; Q193-E210 VanDerWaalsContact O-CA 3.25Å; Q193-E210 WeakPolarHBondContact O-CA 3.35Å; Q193-V211 HydrophobicContact CG-CB 4.45Å; Q193-V211 PolarHBondContact N-O 3.31Å; Q193-V211 PolarHBondContact O-N 2.69Å
194	V	93.1	Very high	88.2	Confident	95 Å²	95	67.9 Å²	67.9	58%	0.576	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	107.2	178.2	-178.3	0	0	0	0	109.8	L209 E210	V194-L209 CarbonylContact C-O 3.51Å; V194-L209 VanDerWaalsContact CA-O 3.27Å; V194-L209 WeakPolarHBondContact CA-O 3.23Å; V194-E210 HydrophobicContact CG2-CB 4.35Å
195	V	92.8	Very high	88.2	Confident	38 Å²	38	67.5 Å²	67.5	23%	0.23	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	129.4	-178.3	-173.2	0	0	0	0	109.4	L187 Q193 V197 N208 L209 V211	L187-V195 HydrophobicContact CD2-CG2 4.06Å; Q193-V195 HydrophobicContact CG-CG2 4.38Å; V195-V197 HydrophobicContact CG1-CG2 3.89Å; V195-N208 WeakPolarHBondContact O-CA 3.37Å; V195-L209 PolarHBondContact N-O 3.32Å; V195-L209 PolarHBondContact O-N 3.1Å; V195-V211 HydrophobicContact CG2-CG2 4.18Å
196	A	92.7	Very high	88.5	Confident	56 Å²	56	62.5 Å²	62.5	46%	0.463	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	98	177.2	0	0	0	0	0	110.1
197	V	92.4	Very high	88.9	Confident	18 Å²	18	54.7 Å²	54.7	11%	0.109	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	125.6	-174.4	-172.4	0	0	0	0	110.8	V180 V195 V199 K206 L207	V180-V197 HydrophobicContact CB-CG1 4.47Å; V180-V197 HydrophobicContact CG1-CG1 3.66Å; V180-V197 HydrophobicContact CG2-CG1 4.01Å; V195-V197 HydrophobicContact CG1-CG2 3.89Å; V197-V199 PolarHBondContact O-N 3.44Å; V197-K206 CarbonylContact O-C 3.44Å; V197-K206 WeakPolarHBondContact O-CA 3.49Å; V197-L207 HydrophobicContact CB-CB 4.43Å; V197-L207 PolarHBondContact N-O 3.49Å; V197-L207 PolarHBondContact O-N 2.88Å
198	D	91.8	Very high	89.1	Confident	58 Å²	58	56.3 Å²	56.3	31%	0.31	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	121	178.2	-75.7	18.6	0	0	0	110.8	G203 K206	D198-G203 VanDerWaalsContact OD2-CA 3.29Å; D198-G203 WeakPolarHBondContact OD2-CA 3.45Å; D198-K206 WeakPolarHBondContact OD1-CD 3.45Å; D198-K206 VanDerWaalsContact OD1-CE 3.29Å; D198-K206 WeakPolarHBondContact OD1-CE 3.45Å; D198-K206 VanDerWaalsContact OD1-CG 3.23Å; D198-K206 WeakPolarHBondContact OD1-CG 3.2Å; D198-K206 IonicContact OD1-NZ 3.07Å; D198-K206 PolarHBondContact OD1-NZ 2.81Å; D198-K206 IonicContact OD2-NZ 3.76Å; D198-K206 PolarHBondContact OD2-NZ 3.31Å
199	V	90.5	Very high	89.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	32%	0.316	C	S	.	.	S	Bend	trans	-79.9	-24	-170.9	174.1	0	0	0	0	111.9	L109 V165 V177 G178 S179 V197 I205 L207	L109-V199 HydrophobicContact CD2-CG2 4.39Å; V165-V199 HydrophobicContact CB-CG1 3.56Å; V165-V199 HydrophobicContact CG1-CG1 4.23Å; V165-V199 HydrophobicContact CG2-CB 4.39Å; V165-V199 HydrophobicContact CG2-CG1 3.51Å; V165-V199 HydrophobicContact CG2-CG2 3.92Å; V177-V199 HydrophobicContact CG1-CG1 4.12Å; G178-V199 CarbonylContact C-O 3.35Å; G178-V199 VanDerWaalsContact CA-O 3.24Å; G178-V199 WeakPolarHBondContact CA-O 3.38Å; S179-V199 PolarHBondContact N-O 2.98Å; V197-V199 PolarHBondContact O-N 3.44Å; V199-I205 HydrophobicContact CB-CB 4.4Å; V199-I205 HydrophobicContact CB-CG2 4.15Å; V199-I205 WeakPolarHBondContact CB-O 3.3Å; V199-I205 HydrophobicContact CG2-CG2 4.11Å; V199-I205 PolarHBondContact N-O 3.4Å; V199-L207 HydrophobicContact CG2-CB 3.77Å
200	N	86.8	Confident	89.6	Confident	25 Å²	25	54 Å²	54	13%	0.134	31%	0.314	C	S	.	.	S	Bend	trans	-143	155.8	176.6	54.1	61.5	0	0	0	111.4	V177 L202 G203 T204	V177-N200 PolarHBondContact O-ND2 2.94Å; N200-L202 PolarHBondContact O-N 3.16Å; N200-G203 PolarHBondContact O-N 2.83Å; N200-T204 PolarHBondContact ND2-OG1 3.33Å; N200-T204 PolarHBondContact OD1-N 2.93Å; N200-T204 PolarHBondContact OD1-OG1 3.27Å
201	D	81.9	Confident	90.3	Very high	126 Å²	126	49.5 Å²	49.5	67%	0.674	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-14.4	-175.9	-44.2	-3.6	0	0	0	114.9
202	L	82.5	Confident	90.6	Very high	135 Å²	135	43.9 Å²	43.9	71%	0.707	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-0	178.8	-57.3	177.2	0	0	0	113.1	N200 T204	N200-L202 PolarHBondContact O-N 3.16Å; L202-T204 HydrophobicContact CB-CG2 3.73Å; L202-T204 PolarHBondContact O-N 2.84Å
203	G	82.2	Confident	90.8	Very high	16 Å²	16	43.3 Å²	43.3	17%	0.165	24%	0.239	C	C	.	.			trans	61.1	9.5	-176.6	0	0	0	0	0	115.1	D198 N200 I205	D198-G203 VanDerWaalsContact OD2-CA 3.29Å; D198-G203 WeakPolarHBondContact OD2-CA 3.45Å; N200-G203 PolarHBondContact O-N 2.83Å; G203-I205 VanDerWaalsContact C-N 3.29Å; G203-I205 PolarHBondContact O-N 2.87Å
204	T	84.5	Confident	90.7	Very high	29 Å²	29	44.1 Å²	44.1	18%	0.178	24%	0.24	C	C	.	.			trans	-72.8	-22.6	-167.5	57.5	0	0	0	0	113.9	G111 F112 R114 N200 L202	G111-T204 WeakPolarHBondContact CA-O 3.46Å; F112-T204 PolarHBondContact N-O 3.39Å; F112-T204 VanDerWaalsContact N-O 3.13Å; R114-T204 PolarHBondContact NE-OG1 3.18Å; N200-T204 PolarHBondContact ND2-OG1 3.33Å; N200-T204 PolarHBondContact OD1-N 2.93Å; N200-T204 PolarHBondContact OD1-OG1 3.27Å; L202-T204 HydrophobicContact CB-CG2 3.73Å; L202-T204 PolarHBondContact O-N 2.84Å
205	I	88.8	Confident	90.4	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.031	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.9	173.6	-66.3	171.1	0	0	0	106.8	L109 A110 R114 V177 V199 G203	L109-I205 HydrophobicContact CD2-CG2 4.08Å; A110-I205 CarbonylContact O-C 3.5Å; A110-I205 VanDerWaalsContact O-CA 3.28Å; A110-I205 WeakPolarHBondContact O-CA 3.41Å; R114-I205 HydrophobicContact CB-CD1 4.14Å; R114-I205 HydrophobicContact CB-CG1 4.21Å; V177-I205 HydrophobicContact CG1-CD1 3.46Å; V177-I205 VanDerWaalsContact CG1-CD1 3.46Å; V177-I205 HydrophobicContact CG1-CG2 4.49Å; V199-I205 HydrophobicContact CB-CB 4.4Å; V199-I205 HydrophobicContact CB-CG2 4.15Å; V199-I205 WeakPolarHBondContact CB-O 3.3Å; V199-I205 HydrophobicContact CG2-CG2 4.11Å; V199-I205 PolarHBondContact N-O 3.4Å; G203-I205 VanDerWaalsContact C-N 3.29Å; G203-I205 PolarHBondContact O-N 2.87Å
206	K	93.1	Very high	89.9	Confident	61 Å²	61	39.8 Å²	39.8	27%	0.265	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.6	178.7	-51.1	-168.5	173.3	-107.5	0	109.4	L109 A110 V197 D198	L109-K206 CarbonylContact C-O 3.51Å; L109-K206 WeakPolarHBondContact CA-O 3.31Å; A110-K206 HydrophobicContact CB-CB 4.39Å; A110-K206 PolarHBondContact N-O 2.91Å; A110-K206 PolarHBondContact O-N 3.5Å; V197-K206 CarbonylContact O-C 3.44Å; V197-K206 WeakPolarHBondContact O-CA 3.49Å; D198-K206 WeakPolarHBondContact OD1-CD 3.45Å; D198-K206 VanDerWaalsContact OD1-CE 3.29Å; D198-K206 WeakPolarHBondContact OD1-CE 3.45Å; D198-K206 VanDerWaalsContact OD1-CG 3.23Å; D198-K206 WeakPolarHBondContact OD1-CG 3.2Å; D198-K206 IonicContact OD1-NZ 3.07Å; D198-K206 PolarHBondContact OD1-NZ 2.81Å; D198-K206 IonicContact OD2-NZ 3.76Å; D198-K206 PolarHBondContact OD2-NZ 3.31Å
207	L	93.6	Very high	88.6	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	111.8	179.2	170.9	57.5	0	0	0	109	M106 L109 I123 M125 I163 V197 V199 L209	M106-L207 HydrophobicContact CE-CD1 3.46Å; M106-L207 VanDerWaalsContact CE-CD1 3.46Å; M106-L207 HydrophobicContact SD-CD1 3.49Å; M106-L207 WeakPolarHBondContact SD-CD1 3.47Å; L109-L207 HydrophobicContact CD2-CB 4.07Å; L109-L207 HydrophobicContact CD2-CD1 3.95Å; I123-L207 HydrophobicContact CD1-CD1 3.62Å; I123-L207 HydrophobicContact CD1-CD2 4.28Å; I123-L207 HydrophobicContact CG2-CD2 4.19Å; M125-L207 HydrophobicContact CE-CD2 4.06Å; I163-L207 HydrophobicContact CD1-CD2 4.12Å; I163-L207 HydrophobicContact CG2-CD2 3.73Å; V197-L207 HydrophobicContact CB-CB 4.43Å; V197-L207 PolarHBondContact N-O 3.49Å; V197-L207 PolarHBondContact O-N 2.88Å; V199-L207 HydrophobicContact CG2-CB 3.77Å; L207-L209 HydrophobicContact CD1-CD2 3.93Å; L207-L209 HydrophobicContact CD2-CD1 4.48Å; L207-L209 HydrophobicContact CD2-CD2 4.38Å; L207-L209 HydrophobicContact CG-CD2 4Å; L207-L209 HydrophobicContact CG-CG 4.09Å
208	N	94	Very high	87	Confident	49 Å²	49	42.4 Å²	42.4	26%	0.262	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.7	-179.4	-61.3	-8.5	0	0	0	109.4	K107 G108 V195	K107-N208 WeakPolarHBondContact CA-O 3.22Å; K107-N208 HydrophobicContact CB-CB 4.02Å; K107-N208 WeakPolarHBondContact CB-O 3.5Å; K107-N208 PolarHBondContact N-O 2.94Å; G108-N208 PolarHBondContact N-O 3.34Å; G108-N208 PolarHBondContact O-N 3.28Å; V195-N208 WeakPolarHBondContact O-CA 3.37Å
209	L	94.9	Very high	85.3	Confident	8 Å²	8	47.8 Å²	47.8	4%	0.042	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153.1	174.7	-54.9	177.3	0	0	0	108.9	I104 K105 M106 M125 I163 V194 V195 L207	I104-L209 HydrophobicContact CG2-CB 4.22Å; I104-L209 HydrophobicContact CG2-CD1 4.12Å; I104-L209 HydrophobicContact CG2-CD2 4.46Å; I104-L209 HydrophobicContact CG2-CG 4.5Å; K105-L209 CarbonylContact O-C 3.54Å; K105-L209 WeakPolarHBondContact O-CA 3.35Å; M106-L209 HydrophobicContact SD-CD2 3.83Å; M125-L209 HydrophobicContact CE-CD1 3.78Å; M125-L209 HydrophobicContact CE-CD2 3.79Å; M125-L209 HydrophobicContact CE-CG 4.44Å; M125-L209 HydrophobicContact SD-CD1 4.32Å; I163-L209 HydrophobicContact CD1-CD1 4.35Å; V194-L209 CarbonylContact C-O 3.51Å; V194-L209 VanDerWaalsContact CA-O 3.27Å; V194-L209 WeakPolarHBondContact CA-O 3.23Å; V195-L209 PolarHBondContact N-O 3.32Å; V195-L209 PolarHBondContact O-N 3.1Å; L207-L209 HydrophobicContact CD1-CD2 3.93Å; L207-L209 HydrophobicContact CD2-CD1 4.48Å; L207-L209 HydrophobicContact CD2-CD2 4.38Å; L207-L209 HydrophobicContact CG-CD2 4Å; L207-L209 HydrophobicContact CG-CG 4.09Å
210	E	95.5	Very high	83.3	Confident	50 Å²	50	53 Å²	53	23%	0.234	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.7	164.5	172.9	176.8	73	0	0	107.7	I104 K105 K107 Q193 V194	I104-E210 CarbonylContact C-O 3.59Å; I104-E210 WeakPolarHBondContact CA-O 3.39Å; K105-E210 HydrophobicContact CB-CB 4.35Å; K105-E210 PolarHBondContact N-O 2.91Å; K105-E210 PolarHBondContact O-N 2.92Å; K107-E210 HydrophobicContact CD-CB 4.31Å; K107-E210 WeakPolarHBondContact CE-OE1 3.27Å; K107-E210 WeakPolarHBondContact CE-OE2 3.46Å; K107-E210 HydrophobicContact CG-CB 4.09Å; K107-E210 IonicContact NZ-OE1 2.65Å; K107-E210 PolarHBondContact NZ-OE1 2.76Å; K107-E210 IonicContact NZ-OE2 2.61Å; K107-E210 PolarHBondContact NZ-OE2 3.15Å; Q193-E210 CarbonylContact O-C 3.53Å; Q193-E210 VanDerWaalsContact O-CA 3.25Å; Q193-E210 WeakPolarHBondContact O-CA 3.35Å; V194-E210 HydrophobicContact CG2-CB 4.35Å
211	V	95.7	Very high	81.4	Confident	3 Å²	3	56 Å²	56	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.3	-178.5	-175.7	0	0	0	0	108	F102 H103 I104 L187 P192 Q193 V195	F102-V211 HydrophobicContact CD1-CG1 4.27Å; H103-V211 WeakPolarHBondContact O-CA 3.18Å; I104-V211 HydrophobicContact CG1-CG1 4.32Å; I104-V211 HydrophobicContact CG1-CG2 4.18Å; I104-V211 HydrophobicContact CG2-CG2 4.34Å; L187-V211 HydrophobicContact CB-CG1 4.28Å; L187-V211 HydrophobicContact CD2-CB 4.47Å; L187-V211 HydrophobicContact CD2-CG1 4.36Å; L187-V211 HydrophobicContact CD2-CG2 4.18Å; P192-V211 WeakPolarHBondContact CA-O 3.25Å; Q193-V211 HydrophobicContact CG-CB 4.45Å; Q193-V211 PolarHBondContact N-O 3.31Å; Q193-V211 PolarHBondContact O-N 2.69Å; V195-V211 HydrophobicContact CG2-CG2 4.18Å
212	T	94.8	Very high	79.5	Confident	23 Å²	23	55.7 Å²	55.7	14%	0.141	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.5	168.5	-52.7	0	0	0	0	107.8	H103 P192 Y214	H103-T212 PolarHBondContact N-O 3.38Å; H103-T212 PolarHBondContact O-N 3.4Å; P192-T212 WeakPolarHBondContact CB-OG1 3.33Å; P192-T212 HydrophobicContact CG-CG2 3.94Å; T212-Y214 HydrophobicContact CG2-CD2 4.21Å; T212-Y214 HydrophobicContact CG2-CE1 4.2Å; T212-Y214 HydrophobicContact CG2-CE2 3.62Å
213	W	93.8	Very high	77.5	Confident	61 Å²	61	54.1 Å²	54.1	23%	0.231	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134	172	173.3	53.3	0	0	0	110	L99 F102 F188 P215	L99-W213 PolarHBondContact O-NE1 3.34Å; F102-W213 HydrophobicContact CD1-CB 3.99Å; F102-W213 AromaticContact CD1-CD1 3.88Å; F102-W213 HydrophobicContact CD1-CG 4.24Å; F102-W213 HydrophobicContact CE1-CB 4.08Å; F102-W213 AromaticContact CE1-CD1 3.81Å; F102-W213 HydrophobicContact CE1-CG 4.07Å; F188-W213 HydrophobicContact CB-CE3 4.48Å; F188-W213 HydrophobicContact CD1-CD2 4.06Å; F188-W213 AromaticContact CD1-CE2 3.73Å; F188-W213 HydrophobicContact CD1-CG 4.27Å; F188-W213 HydrophobicContact CD1-CZ2 4.12Å; F188-W213 AromaticContact CD1-NE1 3.74Å; W213-P215 HydrophobicContact CH2-CB 4.16Å; W213-P215 HydrophobicContact CZ2-CB 3.75Å
214	Y	89.9	Confident	75.4	Confident	68 Å²	68	59.2 Å²	59.2	27%	0.267	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.4	170.4	-66.6	-77.7	0	0	0	108.8	G100 E101 H103 T212 F216 V218 L221	G100-Y214 CarbonylContact C-O 3.6Å; G100-Y214 WeakPolarHBondContact CA-O 3.15Å; E101-Y214 PolarHBondContact N-O 3.17Å; E101-Y214 PolarHBondContact O-N 2.98Å; H103-Y214 HydrophobicContact CB-CD2 4.33Å; H103-Y214 HydrophobicContact CB-CE2 4.09Å; H103-Y214 AromaticContact CD2-CD2 3.51Å; H103-Y214 AromaticContact CD2-CE2 3.95Å; H103-Y214 AromaticContact CG-CD2 3.8Å; H103-Y214 AromaticContact CG-CE2 3.75Å; H103-Y214 AromaticContact NE2-CD2 3.87Å; T212-Y214 HydrophobicContact CG2-CD2 4.21Å; T212-Y214 HydrophobicContact CG2-CE1 4.2Å; T212-Y214 HydrophobicContact CG2-CE2 3.62Å; Y214-F216 PolarHBondContact O-N 3.37Å; Y214-F216 VanDerWaalsContact O-N 3.13Å; Y214-V218 HydrophobicContact CD1-CG2 4.48Å; Y214-V218 HydrophobicContact CD2-CG2 3.97Å; Y214-V218 HydrophobicContact CE2-CG2 4.48Å; Y214-V218 HydrophobicContact CG-CG2 3.96Å; Y214-L221 HydrophobicContact CD1-CD1 4.05Å; Y214-L221 HydrophobicContact CE1-CD1 4.07Å
215	P	87.3	Confident	72.8	Confident	14 Å²	14	63.6 Å²	63.6	9%	0.091	35%	0.345	C	S	.	.	S	Bend	trans	-72.3	2.2	177.7	27.9	-34.1	0	0	0	114.1	L30 W213	L30-P215 HydrophobicContact CD2-CG 3.87Å; W213-P215 HydrophobicContact CH2-CB 4.16Å; W213-P215 HydrophobicContact CZ2-CB 3.75Å
216	F	80.8	Confident	70.1	Confident	29 Å²	29	66.5 Å²	66.5	13%	0.127	38%	0.377	C	S	.	.	S	Bend	trans	-145.3	155	-178.3	-49.6	-66.2	0	0	0	111.5	Y26 R29 L30 H33 Y214 V218	Y26-F216 HydrophobicContact CD2-CD2 4.48Å; Y26-F216 HydrophobicContact CD2-CE2 4.34Å; Y26-F216 AromaticContact CE2-CD2 3.66Å; Y26-F216 HydrophobicContact CE2-CD2 3.66Å; Y26-F216 AromaticContact CE2-CE2 3.75Å; Y26-F216 HydrophobicContact CE2-CE2 3.75Å; Y26-F216 AromaticContact CZ-CE2 3.98Å; R29-F216 HydrophobicContact CB-CE2 4.39Å; R29-F216 HydrophobicContact CB-CZ 3.97Å; L30-F216 HydrophobicContact CD2-CE2 3.64Å; L30-F216 HydrophobicContact CD2-CZ 3.74Å; L30-F216 HydrophobicContact CG-CE2 4Å; L30-F216 HydrophobicContact CG-CZ 4.12Å; H33-F216 HydrophobicContact CB-CE1 3.85Å; H33-F216 HydrophobicContact CB-CZ 4.16Å; H33-F216 AromaticContact CG-CE1 3.85Å; H33-F216 AromaticContact ND1-CE1 3.68Å; Y214-F216 PolarHBondContact O-N 3.37Å; Y214-F216 VanDerWaalsContact O-N 3.13Å; F216-V218 PolarHBondContact O-N 3.25Å
217	D	65.5	Low	67.3	Low	82 Å²	82	71.2 Å²	71.2	44%	0.439	41%	0.405	S	S	.	.			trans	-47.2	130.4	164	-63.3	-0.2	0	0	0	110.7	E219 S239	D217-E219 PolarHBondContact O-N 3.4Å; D217-S239 PolarHBondContact OD2-OG 2.74Å; D217-S239 VanDerWaalsContact OD2-OG 3.04Å
218	V	60.1	Low	64.2	Low	46 Å²	46	79.6 Å²	79.6	28%	0.279	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-74.6	2.3	-163.3	178.9	0	0	0	0	114.9	Y214 F216 D220	Y214-V218 HydrophobicContact CD1-CG2 4.48Å; Y214-V218 HydrophobicContact CD2-CG2 3.97Å; Y214-V218 HydrophobicContact CE2-CG2 4.48Å; Y214-V218 HydrophobicContact CG-CG2 3.96Å; F216-V218 PolarHBondContact O-N 3.25Å; V218-D220 VanDerWaalsContact C-N 3.29Å; V218-D220 PolarHBondContact O-N 3.06Å; V218-D220 VanDerWaalsContact O-N 3.12Å
219	E	54.6	Low	61.1	Low	171 Å²	171	82.3 Å²	82.3	80%	0.799	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-64.1	-22	-168	-60.9	-154.9	136.3	0	0	115.6	D217	D217-E219 PolarHBondContact O-N 3.4Å
220	D	49.4	Very low	58.4	Low	112 Å²	112	92.4 Å²	92.4	60%	0.599	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-95	-16.3	-174.8	-84.4	-55.9	0	0	0	116.2	R29 V218 T222	R29-D220 IonicContact CZ-OD2 3.43Å; R29-D220 IonicContact NH1-OD2 2.84Å; R29-D220 PolarHBondContact NH1-OD2 3.46Å; R29-D220 IonicContact NH2-OD2 2.67Å; V218-D220 VanDerWaalsContact C-N 3.29Å; V218-D220 PolarHBondContact O-N 3.06Å; V218-D220 VanDerWaalsContact O-N 3.12Å; D220-T222 VanDerWaalsContact C-N 3.34Å; D220-T222 PolarHBondContact O-N 2.94Å
221	L	47.2	Very low	55.2	Low	88 Å²	88	94.7 Å²	94.7	46%	0.461	54%	0.543	S	S	.	.			trans	-82.9	-2.4	-169.6	-81.9	168.4	0	0	0	115	Y26 Y214 L223	Y26-L221 HydrophobicContact CD2-CD2 4.38Å; Y26-L221 HydrophobicContact CE2-CD1 4.29Å; Y26-L221 HydrophobicContact CE2-CD2 4.27Å; Y26-L221 HydrophobicContact CE2-CG 4.47Å; Y214-L221 HydrophobicContact CD1-CD1 4.05Å; Y214-L221 HydrophobicContact CE1-CD1 4.07Å; L221-L223 VanDerWaalsContact C-N 3.31Å; L221-L223 PolarHBondContact O-N 3.36Å
222	T	42.2	Very low	52	Low	119 Å²	119	99.2 Å²	99.2	73%	0.73	58%	0.58	S	S	*	*			trans	-80.5	65.6	-172.2	59.6	0	0	0	0	114.4	D220 S224	D220-T222 VanDerWaalsContact C-N 3.34Å; D220-T222 PolarHBondContact O-N 2.94Å; T222-S224 PolarHBondContact O-N 2.9Å
223	L	40.4	Very low	49.2	Very low	101 Å²	101	102.7 Å²	102.7	53%	0.529	61%	0.611	S	S	.	*			trans	-68.1	100.9	169.1	-75.5	176.3	0	0	0	111.3	Q19 L221 S225	Q19-L223 HydrophobicContact CG-CD1 4.38Å; L221-L223 VanDerWaalsContact C-N 3.31Å; L221-L223 PolarHBondContact O-N 3.36Å; L223-S225 PolarHBondContact O-N 3.2Å; L223-S225 VanDerWaalsContact O-N 3.14Å
224	S	36.4	Very low	46.2	Very low	123 Å²	123	108.1 Å²	108.1	86%	0.86	64%	0.644	S	S	*	*			trans	-23.7	102.5	176.8	167.3	0	0	0	0	116.9	T222	T222-S224 PolarHBondContact O-N 2.9Å
225	S	31.6	Very low	43.5	Very low	121 Å²	121	111.8 Å²	111.8	85%	0.846	66%	0.664	S	S	*	*			trans	-128	148.6	148.4	-165.9	0	0	0	0	109.7	L223	L223-S225 PolarHBondContact O-N 3.2Å; L223-S225 VanDerWaalsContact O-N 3.14Å
226	G	31.1	Very low	41.1	Very low	68 Å²	68	120.6 Å²	120.6	70%	0.701	70%	0.695	S	S	*	*			trans	-83	136.3	-157.4	0	0	0	0	0	116.2
227	N	34.4	Very low	38.9	Very low	160 Å²	160	131.1 Å²	131.1	86%	0.856	73%	0.734	S	S	*	*			trans	60.7	103.9	166.1	-67.9	-17.2	0	0	0	117.8
228	L	29.6	Very low	37.2	Very low	175 Å²	175	133.5 Å²	133.5	92%	0.916	75%	0.751	S	S	*	*				-141.3	176.8	128.2	-132.6	68	0	0	0	110.4
229	S	28.3	Very low	35.9	Very low	107 Å²	107	134 Å²	134	75%	0.748	76%	0.757	S	S	*	*			trans	-62.9	142.9	-158.8	40.5	0	0	0	0	117.6	A231	S229-A231 PolarHBondContact O-N 2.99Å
230	K	38	Very low	35.1	Very low	220 Å²	220	131.7 Å²	131.7	96%	0.957	75%	0.754	S	S	*	*			trans	-77.3	102.3	164	-74.1	-172.7	175.3	-172.8	0	112.1
231	A	28.7	Very low	34.5	Very low	97 Å²	97	134.9 Å²	134.9	80%	0.802	76%	0.759	S	S	*	*			trans	-160.8	149.4	152.5	0	0	0	0	0	107.7	S229	S229-A231 PolarHBondContact O-N 2.99Å
232	A	28.8	Very low	34	Very low	98 Å²	98	135.8 Å²	135.8	81%	0.81	77%	0.773	S	S	*	*			cis	-127.8	165.6	0.2	0	0	0	0	0	111.3
233	A	34.8	Very low	33.6	Very low	96 Å²	96	140 Å²	140	79%	0.793	78%	0.784	S	S	*	*			trans	-101.7	116.6	173.8	0	0	0	0	0	110.6
234	L	31.3	Very low	33.2	Very low	176 Å²	176	138.7 Å²	138.7	92%	0.921	80%	0.795	S	S	*	*			trans	-118.7	151.8	162.1	-78	172.2	0	0	0	109.3
235	Q	33.3	Very low	33.3	Very low	145 Å²	145	139.6 Å²	139.6	68%	0.678	80%	0.795	S	S	*	*			trans	-112	128.2	-159.3	-69.2	-173	-6.6	0	0	114.1
236	R	37.3	Very low	33.4	Very low	199 Å²	199	139.8 Å²	139.8	75%	0.751	79%	0.794	S	S	*	*			trans	60.6	107	155.4	-55.7	180	-148.6	78.1	7.3	117.4
237	R	32.8	Very low	33.3	Very low	249 Å²	249	145.8 Å²	145.8	94%	0.94	80%	0.804	S	S	*	*				-119.6	171.3	110	-74.1	-168.3	169.8	-174.9	-4	109
238	V	29.9	Very low	33.1	Very low	133 Å²	133	145 Å²	145	81%	0.806	80%	0.804	S	S	*	*			trans	-94.6	122.7	-179.1	173.7	0	0	0	0	107.6
239	S	32.9	Very low	33.1	Very low	55 Å²	55	142.8 Å²	142.8	39%	0.385	80%	0.801	S	S	.	*			trans	-70.5	140.7	168.8	-169.3	0	0	0	0	109.3	D217	D217-S239 PolarHBondContact OD2-OG 2.74Å; D217-S239 VanDerWaalsContact OD2-OG 3.04Å
240	V	38.2	Very low	33.1	Very low	124 Å²	124	144.4 Å²	144.4	75%	0.752	81%	0.807	S	S	*	*	S	Bend	trans	-96.9	-13.3	-172.5	178.4	0	0	0	0	111.7
241	Y	38	Very low	32.5	Very low	179 Å²	179	143.4 Å²	143.4	70%	0.702	80%	0.802	S	S	*	*			trans	-108	59.3	-169.2	-78.3	-79.5	0	0	0	114
242	S	35.8	Very low	32.3	Very low	106 Å²	106	148 Å²	148	74%	0.741	81%	0.808	S	S	*	*			trans	-149.4	95.2	167.4	70.1	0	0	0	0	113.8
243	Q	33.5	Very low	32.2	Very low	208 Å²	208	150.7 Å²	150.7	97%	0.972	81%	0.808	S	S	*	*			trans	-144.2	134.6	163.2	-145.1	165.5	3.7	0	0	109.4
244	G	33	Very low	31.6	Very low	73 Å²	73	152.4 Å²	152.4	75%	0.753	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-103.1	164.2	-163.4	0	0	0	0	0	115.7
245	T	38.8	Very low	31.3	Very low	142 Å²	142	148.4 Å²	148.4	87%	0.871	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82.1	138.6	-177.7	50.1	0	0	0	0	114.1
246	P	32.8	Very low	30.9	Very low	126 Å²	126	150.1 Å²	150.1	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-95.1	166.3	167.3	36.9	-32.8	0	0	0	113.6
247	E	28.6	Very low	30.3	Very low	194 Å²	194	149.1 Å²	149.1	91%	0.907	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-100.2	164	178	-62.3	-176.1	143.2	0	0	113
248	T	31.6	Very low	29.9	Very low	142 Å²	142	142.1 Å²	142.1	87%	0.871	80%	0.797	S	S	*	*			trans	-105.9	146.9	-172	44.3	0	0	0	0	115.5
249	P	29.4	Very low	29.8	Very low	129 Å²	129	142.3 Å²	142.3	84%	0.838	80%	0.799	S	S	*	*			trans	-125.7	174.6	159.2	33.8	-18.2	0	0	0	114.4
250	T	27	Very low	29.6	Very low	142 Å²	142	146.4 Å²	146.4	87%	0.871	82%	0.816	S	S	*	*			trans	-105.8	160.3	-158.5	43.3	0	0	0	0	118.5
251	F	25	Very low	29.3	Very low	198 Å²	198	146.8 Å²	146.8	87%	0.868	82%	0.82	S	S	*	*			trans	-47.9	155.4	178	-72.3	-98.3	0	0	0	120.2
252	Q	24.9	Very low	28.8	Very low	195 Å²	195	144.8 Å²	144.8	91%	0.911	82%	0.822	S	S	*	*			trans	-158.7	163.6	132.2	-115.8	167.3	52.6	0	0	114.1
253	D	26.7	Very low	28.6	Very low	154 Å²	154	146.8 Å²	146.8	82%	0.824	83%	0.825	S	S	*	*			trans	-78.1	154.2	-166.1	-67.7	-73.8	0	0	0	117.8
254	S	22.4	Very low	28.5	Very low	131 Å²	131	143.6 Å²	143.6	92%	0.916	81%	0.813	S	S	*	*				177	174.6	117.7	44.2	0	0	0	0	113.6
255	S	24.4	Very low	28.4	Very low	92 Å²	92	149.4 Å²	149.4	64%	0.643	82%	0.817	S	S	*	*			trans	-126.4	168.7	-161.8	56.2	0	0	0	0	115
256	F	25.1	Very low	28	Very low	181 Å²	181	150.1 Å²	150.1	79%	0.794	81%	0.811	S	S	*	*				161.1	116.2	127.6	-92.5	-73.3	0	0	0	117
257	F	25.1	Very low	27.8	Very low	178 Å²	178	151 Å²	151	78%	0.781	81%	0.809	S	S	*	*			trans	55.2	121.8	133.7	-87.7	-117.2	0	0	0	126.5
258	S	25.3	Very low	27.8	Very low	102 Å²	102	145.7 Å²	145.7	71%	0.713	81%	0.806	S	S	*	*			trans	71.6	162.9	133.7	-54.6	0	0	0	0	120.6
259	T	27	Very low	27.5	Very low	138 Å²	138	143 Å²	143	85%	0.847	81%	0.807	S	S	*	*			cis	-140.2	164.7	15.1	44.8	0	0	0	0	114.8
260	L	29.5	Very low	27.4	Very low	141 Å²	141	143.3 Å²	143.3	74%	0.738	81%	0.811	S	S	*	*			trans	-72.4	174.4	168.5	-64.6	166	0	0	0	113.7
261	P	31.6	Very low	27.4	Very low	131 Å²	131	140 Å²	140	85%	0.851	80%	0.804	S	S	*	*				-142.8	163.9	92.1	37.4	-21.8	0	0	0	117
262	D	27.4	Very low	27.5	Very low	137 Å²	137	137 Å²	137	73%	0.733	80%	0.802	S	S	*	*			trans	-104.9	158.3	176.5	-70	-73.3	0	0	0	113.8
263	D	32.3	Very low	27.7	Very low	149 Å²	149	132.5 Å²	132.5	80%	0.797	80%	0.798	S	S	*	*			trans	175.5	151.2	151.5	-111.8	-3.3	0	0	0	110
264	I	30.7	Very low	27.7	Very low	141 Å²	141	133.9 Å²	133.9	72%	0.723	80%	0.8	S	S	*	*			cis	-157.3	-167.6	-17.7	-146.7	173.8	0	0	0	110
265	F	30.9	Very low	27.9	Very low	194 Å²	194	134 Å²	134	85%	0.851	80%	0.799	S	S	*	*			trans	-78.4	179	-178.7	-70.3	-105.3	0	0	0	113.8
266	E	30.5	Very low	28	Very low	158 Å²	158	139.2 Å²	139.2	74%	0.738	81%	0.81	S	S	*	*			cis	-166.2	157.3	27.5	-150.4	-170.5	154.7	0	0	115.2
267	N	29.4	Very low	28.1	Very low	143 Å²	143	142.2 Å²	142.2	77%	0.765	82%	0.816	S	S	*	*			trans	48.3	112.7	149.1	-90.2	-34.2	0	0	0	125.1
268	G	27.3	Very low	28.1	Very low	83 Å²	83	140.3 Å²	140.3	86%	0.856	81%	0.814	S	S	*	*				103.5	108.6	109.4	0	0	0	0	0	121.7
269	G	24.6	Very low	28	Very low	86 Å²	86	141 Å²	141	89%	0.887	82%	0.818	S	S	*	*			trans	-177.6	133.1	166.1	0	0	0	0	0	115.3
270	C	27.8	Very low	28	Very low	136 Å²	136	142.2 Å²	142.2	92%	0.919	81%	0.812	S	S	*	*			trans	-88	151.4	-174.8	-179.4	0	0	0	0	113.8
271	G	26.7	Very low	27.8	Very low	71 Å²	71	142.2 Å²	142.2	73%	0.732	82%	0.818	S	S	*	*			trans	158.1	53.6	159.9	0	0	0	0	0	122
272	V	27.5	Very low	27.6	Very low	136 Å²	136	144.6 Å²	144.6	82%	0.824	82%	0.816	S	S	*	*			trans	16	120.5	154.3	-175.1	0	0	0	0	120.4
273	A	30.6	Very low	27.6	Very low	101 Å²	101	142.8 Å²	142.8	84%	0.835	81%	0.813	S	S	*	*			trans	-157.9	144.7	136.5	0	0	0	0	0	110.2
274	E	26	Very low	27.6	Very low	183 Å²	183	142.9 Å²	142.9	86%	0.855	81%	0.814	S	S	*	*			trans	-107.4	148.3	-170	-60.5	173	112.8	0	0	113.7
275	C	27.1	Very low	27.7	Very low	134 Å²	134	142.1 Å²	142.1	91%	0.905	82%	0.816	S	S	*	*				-174.5	112.7	128.7	-100	0	0	0	0	111.1
276	K	25.5	Very low	27.6	Very low	201 Å²	201	138.5 Å²	138.5	87%	0.874	82%	0.815	S	S	*	*			trans	-140.8	128	159.2	-146	173.9	-171.9	-180	0	111.1
277	R	27	Very low	27.5	Very low	243 Å²	243	133.8 Å²	133.8	92%	0.917	81%	0.808	S	S	*	*			trans	-41.7	128.7	178.1	177.6	-178.1	-70.5	151.9	-5.2	112.4
278	L	26.1	Very low	27.5	Very low	139 Å²	139	132.4 Å²	132.4	73%	0.728	81%	0.81	S	S	*	*			trans	-108.8	136.4	172.4	-72.5	168.8	0	0	0	110.6	F280	L278-F280 HydrophobicContact CB-CE2 4.42Å; L278-F280 HydrophobicContact CD1-CE2 4.13Å; L278-F280 HydrophobicContact CD2-CE2 3.97Å; L278-F280 HydrophobicContact CD2-CZ 4.23Å; L278-F280 HydrophobicContact CG-CE2 4.41Å
279	S	23.6	Very low	27.5	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	81%	0.809	S	S	*	*			trans	-133.5	118.7	166.1	52.3	0	0	0	0	107.1
280	F	25.6	Very low	28.3	Very low	164 Å²	164	136 Å²	136	72%	0.719	81%	0.806	S	S	*	*			trans	-114.4	111.9	-178.1	-84.2	-67.7	0	0	0	111.4	L278	L278-F280 HydrophobicContact CB-CE2 4.42Å; L278-F280 HydrophobicContact CD1-CE2 4.13Å; L278-F280 HydrophobicContact CD2-CE2 3.97Å; L278-F280 HydrophobicContact CD2-CZ 4.23Å; L278-F280 HydrophobicContact CG-CE2 4.41Å
281	T	25.2	Very low	28.2	Very low	142 Å²	142	134.9 Å²	134.9	87%	0.871	80%	0.799	S	S	*	*			trans	-94.9	137.4	149.5	48.5	0	0	0	0	108
282	F	27.6	Very low	29	Very low	181 Å²	181	137.8 Å²	137.8	79%	0.794	81%	0.805	S	S	*	*			trans	-108.6	142.6	179.4	-134.6	-82.2	0	0	0	111.4
283	S	28	Very low	28.9	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	80%	0.801	S	S	*	*			trans	-159.4	-178.3	172.8	-77.2	0	0	0	0	108.7
284	D	31.1	Very low	28.7	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	80%	0.803	S	S	*	*			trans	83.4	145.7	-176.4	-63.1	-10.5	0	0	0	115.8
285	T	32.7	Very low	28.5	Very low	125 Å²	125	135.5 Å²	135.5	77%	0.767	79%	0.794	S	S	*	*			cis	-162.2	169.9	-9.8	22.8	0	0	0	0	106.8
286	S	30.7	Very low	28.3	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	78%	0.782	S	S	*	*			cis	-167.8	175.1	-12.4	57	0	0	0	0	106.2
287	G	28.1	Very low	28.4	Very low	58 Å²	58	133.6 Å²	133.6	60%	0.598	78%	0.783	S	S	*	*			cis	164.1	159.4	-4.2	0	0	0	0	0	110.3
288	S	29.4	Very low	28.5	Very low	114 Å²	114	126.8 Å²	126.8	80%	0.797	77%	0.772	S	S	*	*			trans	55.3	114.2	173.1	54	0	0	0	0	118.7
289	S	26.8	Very low	28.6	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	78%	0.775	S	S	*	*				77.8	146.7	69.4	-63.3	0	0	0	0	114.8
290	P	40.6	Very low	28.8	Very low	126 Å²	126	127.3 Å²	127.3	82%	0.818	77%	0.769	S	S	*	*			cis	-129.2	-172.4	-1	42.1	-25.4	0	0	0	115.1
291	S	26.6	Very low	29.1	Very low	111 Å²	111	127.8 Å²	127.8	78%	0.776	77%	0.773	S	S	*	*			trans	-75.4	173.6	173.5	-26.4	0	0	0	0	112.9
292	P	43.1	Very low	29.4	Very low	132 Å²	132	125.8 Å²	125.8	86%	0.857	77%	0.765	S	S	*	*			cis	-137.9	-169.7	45.3	40.2	-19.4	0	0	0	115.8
293	A	25.9	Very low	29.4	Very low	90 Å²	90	124.5 Å²	124.5	74%	0.744	77%	0.766	S	S	*	*			trans	-100.8	158.1	-171.6	0	0	0	0	0	115
294	Q	25.4	Very low	30	Very low	188 Å²	188	123.9 Å²	123.9	88%	0.879	76%	0.76	S	S	*	*				-177	144.9	127.5	-102.3	174.9	19	0	0	115.4
295	S	22.6	Very low	29.7	Very low	95 Å²	95	124.5 Å²	124.5	66%	0.664	76%	0.758	S	S	*	*			trans	42.3	108.3	149.9	65	0	0	0	0	123.9
296	S	23.3	Very low	29.6	Very low	94 Å²	94	125.4 Å²	125.4	66%	0.657	76%	0.757	S	S	*	*				65.7	142.5	111	-47.5	0	0	0	0	124.4
297	F	26.1	Very low	29.4	Very low	201 Å²	201	125.2 Å²	125.2	88%	0.882	75%	0.751	S	S	*	*			trans	71.2	146.1	164.6	-52.6	-69.8	0	0	0	117.2
298	S	29.7	Very low	29.4	Very low	99 Å²	99	128.8 Å²	128.8	69%	0.692	76%	0.761	S	S	*	*			cis	-163.4	162.9	-21.1	58.7	0	0	0	0	107
299	Q	27.8	Very low	29.2	Very low	170 Å²	170	129 Å²	129	79%	0.794	76%	0.757	S	S	*	*				-176.8	140.2	69.2	-138.6	172.7	12.9	0	0	112.5
300	S	29.3	Very low	30	Very low	95 Å²	95	128.7 Å²	128.7	66%	0.664	75%	0.752	S	S	*	*			trans	59.7	140.3	148.2	54.3	0	0	0	0	121.5
301	Q	31.9	Very low	29.6	Very low	174 Å²	174	128.6 Å²	128.6	81%	0.813	75%	0.752	S	S	*	*			cis	-160.9	141.4	3.6	-129.6	167.7	-4.3	0	0	114.1
302	S	31.1	Very low	29.6	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	75%	0.752	S	S	*	*			trans	57.7	138.8	153.7	51.6	0	0	0	0	120.6
303	N	27.3	Very low	28.9	Very low	154 Å²	154	130.1 Å²	130.1	82%	0.824	75%	0.749	S	S	*	*			cis	-153.7	167	1.5	-116.7	21.4	0	0	0	112.7
304	P	41.3	Very low	28.9	Very low	86 Å²	86	132.6 Å²	132.6	56%	0.558	75%	0.749	S	S	*	*			trans	-87.9	-164.5	-173.4	41.6	-41.3	0	0	0	113.4
305	E	24.8	Very low	28.7	Very low	164 Å²	164	129.3 Å²	129.3	77%	0.766	75%	0.747	S	S	*	*			cis	-156.9	154.6	20.6	-135.6	148.3	117.9	0	0	108.6
306	I	29.1	Very low	28.9	Very low	144 Å²	144	132 Å²	132	74%	0.738	75%	0.753	S	S	*	*			cis	91.5	135.7	22.8	-69.6	165.6	0	0	0	114.5
307	T	26.9	Very low	29.8	Very low	115 Å²	115	133.1 Å²	133.1	71%	0.706	76%	0.759	S	S	*	*			cis	-172.5	156.7	-18.1	-84.1	0	0	0	0	111.1
308	V	27.5	Very low	29.8	Very low	133 Å²	133	129.1 Å²	129.1	81%	0.806	75%	0.751	S	S	*	*			trans	92.4	155.3	156	138.6	0	0	0	0	123
309	T	25.6	Very low	30.3	Very low	118 Å²	118	129.7 Å²	129.7	72%	0.724	75%	0.752	S	S	*	*			trans	-78	-168.4	175.1	35.8	0	0	0	0	114.5
310	P	43.7	Very low	30.2	Very low	113 Å²	113	128.6 Å²	128.6	73%	0.734	75%	0.75	S	S	*	*				-121.8	-165	-51.4	38.5	-22.8	0	0	0	110.6
311	P	33	Very low	30	Very low	125 Å²	125	130.6 Å²	130.6	81%	0.812	75%	0.753	S	S	*	*			trans	-143.3	156.5	155.8	39.4	-24.7	0	0	0	116.5
312	D	25.9	Very low	29.7	Very low	147 Å²	147	130.1 Å²	130.1	79%	0.786	75%	0.75	S	S	*	*			trans	-159.5	147.5	156.3	-136.9	-24	0	0	0	111.8
313	T	28.6	Very low	29.3	Very low	127 Å²	127	131.1 Å²	131.1	78%	0.779	75%	0.752	S	S	*	*			trans	60.4	152.6	177.9	67.5	0	0	0	0	117.6
314	D	25.7	Very low	29.2	Very low	142 Å²	142	132.1 Å²	132.1	76%	0.759	75%	0.754	S	S	*	*			cis	-158.3	159.3	2.4	-145.5	-17.8	0	0	0	112.7
315	S	22.3	Very low	28.5	Very low	119 Å²	119	135.9 Å²	135.9	83%	0.832	77%	0.765	S	S	*	*			trans	158.8	151.1	146	50.5	0	0	0	0	117.7
316	L	26.4	Very low	28.5	Very low	152 Å²	152	135 Å²	135	80%	0.796	77%	0.765	S	S	*	*			trans	-105.2	176.5	-169.5	-86.2	156.6	0	0	0	113.2
317	P	41.2	Very low	28.4	Very low	118 Å²	118	133.1 Å²	133.1	77%	0.766	76%	0.764	S	S	*	*			cis	-146.9	-179.7	27	43.9	-22.1	0	0	0	120.8
318	T	26.4	Very low	28.4	Very low	117 Å²	117	135.5 Å²	135.5	72%	0.718	77%	0.771	S	S	*	*			trans	-63.7	175.8	172	36.1	0	0	0	0	115.3
319	P	39.9	Very low	28.3	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	77%	0.769	S	S	*	*			cis	-165.9	177.3	46.8	45.9	-20.5	0	0	0	124.9
320	I	25.4	Very low	28.5	Very low	146 Å²	146	136 Å²	136	75%	0.749	77%	0.772	S	S	*	*			trans	68.8	117.8	157.5	-13.9	176.3	0	0	0	123.8
321	L	25.7	Very low	27.8	Very low	138 Å²	138	139.4 Å²	139.4	72%	0.723	78%	0.778	S	S	*	*				156.4	114.7	118	-81.8	173	0	0	0	111.4
322	Q	25.4	Very low	27.4	Very low	163 Å²	163	141.5 Å²	141.5	76%	0.762	78%	0.777	S	S	*	*				64.8	107.4	100.4	-75.3	-173	-15.3	0	0	114.7
323	T	23.9	Very low	27.6	Very low	121 Å²	121	140.5 Å²	140.5	74%	0.742	77%	0.771	S	S	*	*				101.5	132.4	52.1	48.8	0	0	0	0	112.9
324	M	25.2	Very low	27.6	Very low	176 Å²	176	141.7 Å²	141.7	87%	0.867	77%	0.767	S	S	*	*			trans	69.1	156.8	178.9	-77	161.4	150.8	0	0	114.8
325	E	25.3	Very low	27.8	Very low	165 Å²	165	143.2 Å²	143.2	77%	0.771	77%	0.77	S	S	*	*			cis	-149.2	-171.9	16.1	-141.7	155	-151.6	0	0	112.7
326	D	25	Very low	28.1	Very low	146 Å²	146	147 Å²	147	78%	0.781	78%	0.775	S	S	*	*			trans	-83.9	176.3	-160.2	-54.3	-60.1	0	0	0	119.3
327	S	26.8	Very low	28.3	Very low	103 Å²	103	148.6 Å²	148.6	72%	0.72	78%	0.778	S	S	*	*			trans	107.5	107.8	140	-62	0	0	0	0	123.1
328	I	28	Very low	27.8	Very low	165 Å²	165	152.7 Å²	152.7	85%	0.846	79%	0.787	S	S	*	*				41.6	115.8	116.3	-52.6	160.8	0	0	0	120.9
329	A	25.9	Very low	28.1	Very low	91 Å²	91	156.1 Å²	156.1	75%	0.752	80%	0.795	S	S	*	*			trans	178	144.2	131.9	0	0	0	0	0	108
330	E	29.9	Very low	27.6	Very low	171 Å²	171	160.8 Å²	160.8	80%	0.799	81%	0.807	S	S	*	*			cis	77.6	143.7	37	-82.2	-71.2	-171.3	0	0	116.6
331	E	28	Very low	27.7	Very low	185 Å²	185	160.9 Å²	160.9	86%	0.864	81%	0.809	S	S	*	*			trans	76.7	119.1	-162.3	-56.7	-175.3	163.3	0	0	114.3
332	H	25.3	Very low	28.2	Very low	168 Å²	168	162.5 Å²	162.5	78%	0.778	81%	0.813	S	S	*	*			cis	100.5	141.9	17.4	-153.9	83.9	0	0	0	114.5
333	L	29.6	Very low	28.4	Very low	127 Å²	127	163.3 Å²	163.3	67%	0.665	82%	0.817	S	S	*	*			trans	71	149.5	-174.4	-43.6	179.8	0	0	0	115.4
334	E	28.3	Very low	28.7	Very low	151 Å²	151	165.7 Å²	165.7	71%	0.706	82%	0.82	S	S	*	*			cis	-157.6	162.7	-16.2	-117	162.1	-177.8	0	0	109.7
335	E	29.7	Very low	28.8	Very low	174 Å²	174	166 Å²	166	81%	0.813	82%	0.819	S	S	*	*			trans	-4	140.6	162.3	-60.9	166	-177.8	0	0	121.8
336	E	29	Very low	29	Very low	199 Å²	199	161.8 Å²	161.8	93%	0.93	80%	0.804	S	S	*	*				-160.7	144.7	120.5	-113.4	171.9	-165.1	0	0	110.9
337	E	31.3	Very low	29.5	Very low	186 Å²	186	164.5 Å²	164.5	87%	0.869	81%	0.805	S	S	*	*			trans	-108	150.5	-178.8	-58	173	139.7	0	0	110.9
338	E	29.3	Very low	29.6	Very low	204 Å²	204	167.2 Å²	167.2	95%	0.953	81%	0.806	S	S	*	*			trans	-142.8	127.3	150.6	-75.7	-164.3	146.4	0	0	110.2
339	E	32.3	Very low	29.8	Very low	188 Å²	188	167.4 Å²	167.4	88%	0.879	80%	0.803	S	S	*	*			trans	-108.5	147.1	165.4	-65.5	-173	145	0	0	109.2
340	E	29.5	Very low	29.9	Very low	209 Å²	209	170.4 Å²	170.4	98%	0.977	81%	0.807	S	S	*	*			trans	-136.5	141.7	153	-76.3	-163.7	144.3	0	0	108.9
341	D	29.4	Very low	29.7	Very low	149 Å²	149	165.5 Å²	165.5	80%	0.797	80%	0.803	S	S	*	*			trans	-126.5	-168	-166.1	-152.4	-6.5	0	0	0	110.1
342	E	35.7	Very low	29.7	Very low	172 Å²	172	165.1 Å²	165.1	80%	0.804	80%	0.801	S	S	*	*			trans	76.5	149	171.7	-50.1	-175.4	151.7	0	0	115.9
343	E	28.8	Very low	29.7	Very low	180 Å²	180	163.8 Å²	163.8	84%	0.841	81%	0.805	S	S	*	*			cis	-150.7	155.3	14	-149.6	172.9	-156.8	0	0	111.8
344	E	31.1	Very low	29.5	Very low	171 Å²	171	161.3 Å²	161.3	80%	0.799	81%	0.81	S	S	*	*			trans	-96.9	155.6	172	-73.7	-166.6	141.9	0	0	112.7
345	E	26.9	Very low	29.4	Very low	182 Å²	182	159.7 Å²	159.7	85%	0.85	82%	0.815	S	S	*	*			trans	-149.2	149.4	154.6	-98.4	-65.7	-169.1	0	0	110.6
346	V	30.3	Very low	29.2	Very low	76 Å²	76	162.9 Å²	162.9	46%	0.461	82%	0.82	S	S	.	*			trans	-141.6	173.9	-160.4	-170.3	0	0	0	0	112.4
347	Y	34.4	Very low	29	Very low	203 Å²	203	157.5 Å²	157.5	80%	0.796	82%	0.818	S	S	*	*			trans	83.8	140.6	166	-53.7	-64	0	0	0	116.5
348	E	30.1	Very low	28.7	Very low	161 Å²	161	154.6 Å²	154.6	75%	0.752	82%	0.818	S	S	*	*			cis	-158.8	179.7	5.8	-107.7	-81.3	-146.8	0	0	113.7
349	E	30.4	Very low	28.6	Very low	168 Å²	168	155.5 Å²	155.5	79%	0.785	81%	0.812	S	S	*	*			trans	-28.4	149.8	-175	-113.3	-177	170.3	0	0	126.8
350	D	29.5	Very low	28.3	Very low	154 Å²	154	154.3 Å²	154.3	82%	0.824	81%	0.812	S	S	*	*			trans	83.2	145.2	134.1	-156.4	28.4	0	0	0	124.2
351	G	25.4	Very low	28.1	Very low	69 Å²	69	150 Å²	150	71%	0.711	81%	0.805	S	S	*	*			trans	143.4	115	166.9	0	0	0	0	0	117.6
352	E	27.4	Very low	27.9	Very low	176 Å²	176	148 Å²	148	82%	0.822	81%	0.81	S	S	*	*			trans	-82.8	165.3	-176.3	-65.2	-170.3	110.7	0	0	118
353	T	25.8	Very low	27.4	Very low	141 Å²	141	145.3 Å²	145.3	87%	0.865	81%	0.81	S	S	*	*			trans	86.2	145.5	155.8	76.9	0	0	0	0	119.6
354	G	24.5	Very low	27.3	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	81%	0.811	S	S	*	*			trans	152.9	4.8	157.5	0	0	0	0	0	123.2
355	S	27	Very low	27.1	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	82%	0.816	S	S	*	*			trans	2.4	115.4	172.8	-174.6	0	0	0	0	120.1
356	R	25.8	Very low	27.3	Very low	242 Å²	242	138.6 Å²	138.6	91%	0.913	81%	0.814	S	S	*	*			trans	-178.3	123.5	130.5	-97.7	156.6	88.4	143.5	7.6	111.1
357	G	23.8	Very low	27.3	Very low	86 Å²	86	141.7 Å²	141.7	89%	0.887	83%	0.828	S	S	*	*			trans	-99.8	179.5	-174	0	0	0	0	0	115.8
358	S	25.3	Very low	27.1	Very low	125 Å²	125	140.5 Å²	140.5	87%	0.874	83%	0.83	S	S	*	*			trans	-137.5	159.3	158.3	-169.7	0	0	0	0	109.3
359	R	26.8	Very low	27.5	Very low	222 Å²	222	136 Å²	136	84%	0.838	82%	0.82	S	S	*	*			trans	-82.2	150.3	-179	-66.9	167.4	167.8	157.7	-8.7	111.3
360	N	26.5	Very low	27.7	Very low	164 Å²	164	131.3 Å²	131.3	88%	0.877	80%	0.8	S	S	*	*				-175.5	95	113.8	-91.2	-1.5	0	0	0	110
361	S	25.6	Very low	27.9	Very low	117 Å²	117	128.4 Å²	128.4	82%	0.818	79%	0.788	S	S	*	*			trans	-97.8	125.3	168.9	40.5	0	0	0	0	109.9
362	A	26	Very low	28.4	Very low	109 Å²	109	128 Å²	128	90%	0.901	78%	0.778	S	S	*	*			trans	-95.9	102.7	162.1	0	0	0	0	0	107.2
363	S	23.4	Very low	29	Very low	115 Å²	115	121.7 Å²	121.7	80%	0.804	75%	0.75	S	S	*	*			trans	-104	134.4	173.9	-166.3	0	0	0	0	109.3
364	L	28.1	Very low	29.7	Very low	167 Å²	167	116.6 Å²	116.6	87%	0.874	72%	0.72	S	S	*	*			trans	-71.3	152.1	172.6	-63.6	166.2	0	0	0	109.6
365	A	25.6	Very low	30.3	Very low	109 Å²	109	120 Å²	120	90%	0.901	72%	0.716	S	S	*	*			trans	-91.5	118.4	178.2	0	0	0	0	0	110.3
366	S	32.2	Very low	31.1	Very low	115 Å²	115	118.5 Å²	118.5	80%	0.804	69%	0.693	S	S	*	*			trans	-161.7	79	174.8	178.2	0	0	0	0	110.7
367	D	30.1	Very low	31.9	Very low	141 Å²	141	111.2 Å²	111.2	75%	0.754	67%	0.669	S	S	*	*			trans	-149	-7.6	176.8	-123.7	-11.7	0	0	0	114.3
368	E	30.6	Very low	32.7	Very low	178 Å²	178	114.3 Å²	114.3	83%	0.832	65%	0.654	S	S	*	*	S	Bend	trans	-88.1	-7.5	-174.3	-64.2	-70.7	153	0	0	114.1
369	A	36.9	Very low	33.4	Very low	67 Å²	67	111.8 Å²	111.8	55%	0.554	63%	0.633	S	S	*	*	S	Bend	trans	-82.7	-46.6	-176.6	0	0	0	0	0	113	V371 A372	A369-V371 PolarHBondContact O-N 2.97Å; A369-A372 PolarHBondContact O-N 3.41Å
370	D	36.2	Very low	34	Very low	69 Å²	69	104.2 Å²	104.2	37%	0.369	61%	0.607	S	S	.	*	H	α-helix	trans	-61.3	-19.5	-175.3	-78.6	28.1	0	0	0	113.7	S374 K883	D370-S374 WeakPolarHBondContact O-CB 3.35Å; D370-S374 PolarHBondContact O-N 3.1Å; D370-S374 PolarHBondContact O-OG 2.83Å; D370-K883 IonicContact OD2-NZ 3.92Å; D370-K883 PolarHBondContact OD2-NZ 3.07Å
371	V	33.6	Very low	34.4	Very low	93 Å²	93	99.7 Å²	99.7	56%	0.564	59%	0.589	S	S	*	*	H	α-helix	trans	-70.5	-31.4	177.8	-172.7	0	0	0	0	111.8	A369 S374	A369-V371 PolarHBondContact O-N 2.97Å; V371-S374 WeakPolarHBondContact O-CB 3.22Å
372	A	34.5	Very low	34.8	Very low	61 Å²	61	100.6 Å²	100.6	50%	0.504	58%	0.58	S	S	.	*	H	α-helix	trans	-75.9	-49	-176.9	0	0	0	0	0	112.6	A369 S374 E375	A369-A372 PolarHBondContact O-N 3.41Å; A372-S374 PolarHBondContact O-N 3.45Å; A372-E375 PolarHBondContact O-N 3.11Å
373	D	41.2	Very low	35.1	Very low	43 Å²	43	105.2 Å²	105.2	23%	0.23	57%	0.574	C	S	.	*	H	α-helix	trans	-55.5	-42.1	173.2	-89.1	-37.3	0	0	0	110.5	E375 W376 E377	D373-E375 VanDerWaalsContact C-N 3.29Å; D373-E375 PolarHBondContact O-N 2.99Å; D373-W376 PolarHBondContact O-N 3.5Å; D373-E377 WeakPolarHBondContact O-CG 3.21Å; D373-E377 PolarHBondContact O-N 3.12Å
374	S	40.3	Very low	35.5	Very low	35 Å²	35	105 Å²	105	25%	0.245	56%	0.564	C	S	.	*	H	α-helix	trans	-57	-31.2	179.9	-69.8	0	0	0	0	115	D370 V371 A372 R378	D370-S374 WeakPolarHBondContact O-CB 3.35Å; D370-S374 PolarHBondContact O-N 3.1Å; D370-S374 PolarHBondContact O-OG 2.83Å; V371-S374 WeakPolarHBondContact O-CB 3.22Å; A372-S374 PolarHBondContact O-N 3.45Å; S374-R378 VanDerWaalsContact C-NH1 3.31Å; S374-R378 WeakPolarHBondContact O-CD 3.46Å; S374-R378 VanDerWaalsContact O-CG 3.28Å; S374-R378 WeakPolarHBondContact O-CG 3.13Å; S374-R378 VanDerWaalsContact O-CZ 3.24Å; S374-R378 PolarHBondContact O-NE 3.43Å; S374-R378 PolarHBondContact O-NH1 2.87Å
375	E	36.6	Very low	35.6	Very low	146 Å²	146	101.3 Å²	101.3	68%	0.682	55%	0.552	S	S	*	*	H	α-helix	trans	-74.3	-38.9	175.3	-74.3	-148	125.2	0	0	111.8	A372 D373	A372-E375 PolarHBondContact O-N 3.11Å; D373-E375 VanDerWaalsContact C-N 3.29Å; D373-E375 PolarHBondContact O-N 2.99Å
376	W	43.3	Very low	35.9	Very low	84 Å²	84	103 Å²	103	32%	0.318	55%	0.545	S	S	.	.	H	α-helix	trans	-68.7	-51	-179.7	-173.1	-97.2	0	0	0	111.8	D373 R378 T379 E380 H489 R636	D373-W376 PolarHBondContact O-N 3.5Å; W376-R378 VanDerWaalsContact C-N 3.3Å; W376-R378 PolarHBondContact O-N 2.7Å; W376-T379 PolarHBondContact O-N 2.97Å; W376-T379 PolarHBondContact O-OG1 3.39Å; W376-E380 HydrophobicContact CZ2-CG 4.44Å; W376-E380 PolarHBondContact NE1-OE1 2.91Å; W376-E380 PolarHBondContact NE1-OE2 3.19Å; W376-E380 PolarHBondContact O-N 3.47Å; W376-H489 HydrophobicContact CE3-CB 4.38Å; W376-H489 HydrophobicContact CH2-CB 4.26Å; W376-H489 HydrophobicContact CZ3-CB 3.49Å; W376-H489 VanDerWaalsContact CZ3-CB 3.49Å; W376-H489 AromaticContact CZ3-CD2 3.73Å; W376-H489 AromaticContact CZ3-CG 3.64Å; W376-R636 VanDerWaalsContact CD1-NH1 3.26Å
377	E	44.2	Very low	35.7	Very low	89 Å²	89	101.6 Å²	101.6	42%	0.416	54%	0.535	S	S	.	.	H	α-helix	trans	-55	-40.9	-177.3	-72.2	-176	146.3	0	0	113.5	D373 T379 S381	D373-E377 WeakPolarHBondContact O-CG 3.21Å; D373-E377 PolarHBondContact O-N 3.12Å; E377-T379 PolarHBondContact O-N 2.86Å; E377-S381 VanDerWaalsContact O-CB 3.28Å; E377-S381 WeakPolarHBondContact O-CB 3.29Å; E377-S381 PolarHBondContact O-N 3.29Å; E377-S381 PolarHBondContact O-OG 2.93Å
378	R	39.7	Very low	35.6	Very low	151 Å²	151	102 Å²	102	57%	0.57	54%	0.537	S	S	*	.	H	α-helix	trans	-61.2	-28.9	179	-71	177.2	-164	116.3	-2.5	112.6	S374 W376 Q382	S374-R378 VanDerWaalsContact C-NH1 3.31Å; S374-R378 WeakPolarHBondContact O-CD 3.46Å; S374-R378 VanDerWaalsContact O-CG 3.28Å; S374-R378 WeakPolarHBondContact O-CG 3.13Å; S374-R378 VanDerWaalsContact O-CZ 3.24Å; S374-R378 PolarHBondContact O-NE 3.43Å; S374-R378 PolarHBondContact O-NH1 2.87Å; W376-R378 VanDerWaalsContact C-N 3.3Å; W376-R378 PolarHBondContact O-N 2.7Å; R378-Q382 WeakPolarHBondContact O-CG 3.37Å; R378-Q382 PolarHBondContact O-N 3.03Å
379	T	41.1	Very low	35.4	Very low	72 Å²	72	99.3 Å²	99.3	44%	0.442	54%	0.536	S	S	.	.	H	α-helix	trans	-90.1	-38.5	-177.1	68.2	0	0	0	0	112.9	W376 E377 S381 Q382 R383	W376-T379 PolarHBondContact O-N 2.97Å; W376-T379 PolarHBondContact O-OG1 3.39Å; E377-T379 PolarHBondContact O-N 2.86Å; T379-S381 VanDerWaalsContact C-N 3.31Å; T379-S381 PolarHBondContact O-N 2.74Å; T379-Q382 PolarHBondContact O-N 3.34Å; T379-R383 PolarHBondContact O-N 3.43Å; T379-R383 VanDerWaalsContact O-N 3.1Å
380	E	38.2	Very low	34.7	Very low	64 Å²	64	100 Å²	100	30%	0.299	55%	0.551	S	S	.	*	H	α-helix	trans	-62.9	-39.6	170.3	-75	-170.1	137	0	0	111.3	W376 Q382 R383 N384 R636	W376-E380 HydrophobicContact CZ2-CG 4.44Å; W376-E380 PolarHBondContact NE1-OE1 2.91Å; W376-E380 PolarHBondContact NE1-OE2 3.19Å; W376-E380 PolarHBondContact O-N 3.47Å; E380-Q382 PolarHBondContact O-N 3.41Å; E380-R383 WeakPolarHBondContact O-CB 3.09Å; E380-R383 PolarHBondContact O-N 3.24Å; E380-R383 VanDerWaalsContact O-N 3.12Å; E380-N384 PolarHBondContact O-N 2.95Å; E380-R636 IonicContact OE1-CZ 2.76Å; E380-R636 IonicContact OE1-NH1 3.58Å; E380-R636 IonicContact OE1-NH2 2.78Å; E380-R636 PolarHBondContact OE1-NH2 3.18Å; E380-R636 IonicContact OE2-CZ 3.13Å; E380-R636 IonicContact OE2-NH1 3.5Å; E380-R636 PolarHBondContact OE2-NH1 2.91Å; E380-R636 IonicContact OE2-NH2 2.69Å; E380-R636 PolarHBondContact OE2-NH2 3.03Å; E380-R636 VanDerWaalsContact OE2-NH2 3.13Å
381	S	34.6	Very low	34.3	Very low	69 Å²	69	102.4 Å²	102.4	48%	0.483	57%	0.573	S	S	.	*	H	α-helix	trans	-58	-46.1	175.8	-61.9	0	0	0	0	112.5	E377 T379 R383 N384 S385	E377-S381 VanDerWaalsContact O-CB 3.28Å; E377-S381 WeakPolarHBondContact O-CB 3.29Å; E377-S381 PolarHBondContact O-N 3.29Å; E377-S381 PolarHBondContact O-OG 2.93Å; T379-S381 VanDerWaalsContact C-N 3.31Å; T379-S381 PolarHBondContact O-N 2.74Å; S381-R383 VanDerWaalsContact C-N 3.32Å; S381-R383 PolarHBondContact O-N 3.17Å; S381-N384 PolarHBondContact O-N 3.49Å; S381-S385 WeakPolarHBondContact O-CB 3.21Å; S381-S385 PolarHBondContact O-N 2.92Å; S381-S385 VanDerWaalsContact O-N 3.11Å; S381-S385 PolarHBondContact O-OG 2.85Å
382	Q	33.9	Very low	33.9	Very low	136 Å²	136	103 Å²	103	64%	0.636	59%	0.588	S	S	*	*	H	α-helix	trans	-65.9	-33.4	176.3	-73.1	177.9	6.3	0	0	112.6	R378 T379 E380 I386	R378-Q382 WeakPolarHBondContact O-CG 3.37Å; R378-Q382 PolarHBondContact O-N 3.03Å; T379-Q382 PolarHBondContact O-N 3.34Å; E380-Q382 PolarHBondContact O-N 3.41Å; Q382-I386 WeakPolarHBondContact O-CD1 3.43Å; Q382-I386 WeakPolarHBondContact O-CG1 3.28Å
383	R	33.3	Very low	33.4	Very low	205 Å²	205	104.6 Å²	104.6	77%	0.774	60%	0.6	S	S	*	*	H	α-helix	trans	-69.8	-41.6	178.3	-157	177.6	-167.7	-175.1	5.1	112.4	T379 E380 S381	T379-R383 PolarHBondContact O-N 3.43Å; T379-R383 VanDerWaalsContact O-N 3.1Å; E380-R383 WeakPolarHBondContact O-CB 3.09Å; E380-R383 PolarHBondContact O-N 3.24Å; E380-R383 VanDerWaalsContact O-N 3.12Å; S381-R383 VanDerWaalsContact C-N 3.32Å; S381-R383 PolarHBondContact O-N 3.17Å
384	N	30.6	Very low	33.3	Very low	110 Å²	110	108 Å²	108	59%	0.588	63%	0.625	S	S	*	*	H	α-helix	trans	-71.2	-38.6	178.5	-72.5	-18.8	0	0	0	112.1	E380 S381 I386 S387	E380-N384 PolarHBondContact O-N 2.95Å; S381-N384 PolarHBondContact O-N 3.49Å; N384-I386 PolarHBondContact O-N 2.76Å; N384-I386 VanDerWaalsContact O-N 3.09Å; N384-S387 PolarHBondContact O-N 3.24Å; N384-S387 PolarHBondContact O-OG 3.43Å
385	S	31.8	Very low	32.6	Very low	91 Å²	91	111.1 Å²	111.1	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-60.8	-20.6	-178.8	-60.1	0	0	0	0	114.3	S381 S387	S381-S385 WeakPolarHBondContact O-CB 3.21Å; S381-S385 PolarHBondContact O-N 2.92Å; S381-S385 VanDerWaalsContact O-N 3.11Å; S381-S385 PolarHBondContact O-OG 2.85Å; S385-S387 VanDerWaalsContact C-N 3.34Å
386	I	30.4	Very low	32	Very low	144 Å²	144	111.3 Å²	111.3	74%	0.738	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-9.4	179.3	-67.1	168.1	0	0	0	112.3	Q382 N384	Q382-I386 WeakPolarHBondContact O-CD1 3.43Å; Q382-I386 WeakPolarHBondContact O-CG1 3.28Å; N384-I386 PolarHBondContact O-N 2.76Å; N384-I386 VanDerWaalsContact O-N 3.09Å
387	S	29.7	Very low	31	Very low	86 Å²	86	112.7 Å²	112.7	60%	0.601	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-17.3	-172	69	0	0	0	0	116.5	N384 S385	N384-S387 PolarHBondContact O-N 3.24Å; N384-S387 PolarHBondContact O-OG 3.43Å; S385-S387 VanDerWaalsContact C-N 3.34Å
388	N	27.8	Very low	30.2	Very low	149 Å²	149	112.9 Å²	112.9	80%	0.797	68%	0.684	S	S	*	*			trans	-126.3	89.1	-172.8	-98	-4.3	0	0	0	113
389	C	24.9	Very low	29.5	Very low	121 Å²	121	112.7 Å²	112.7	82%	0.818	69%	0.694	S	S	*	*			trans	-147.2	52.7	167.4	56.3	0	0	0	0	113.1	S391	C389-S391 PolarHBondContact O-N 3.29Å
390	G	22.9	Very low	28.7	Very low	83 Å²	83	113.1 Å²	113.1	86%	0.856	71%	0.713	S	S	*	*			trans	-88	82	-177.7	0	0	0	0	0	115.6
391	S	28.8	Very low	28.1	Very low	119 Å²	119	118.4 Å²	118.4	83%	0.832	74%	0.737	S	S	*	*			trans	57.3	112.8	157.2	-163.6	0	0	0	0	120.4	C389	C389-S391 PolarHBondContact O-N 3.29Å
392	A	25	Very low	27.6	Very low	106 Å²	106	122.8 Å²	122.8	88%	0.876	75%	0.754	S	S	*	*			trans	-142.9	141.1	141.2	0	0	0	0	0	109.3
393	A	22.8	Very low	27.1	Very low	93 Å²	93	120.6 Å²	120.6	77%	0.769	75%	0.754	S	S	*	*			trans	-138.1	-179.3	-175.9	0	0	0	0	0	109.2
394	P	40.6	Very low	26.7	Very low	115 Å²	115	116.9 Å²	116.9	75%	0.747	75%	0.754	S	S	*	*			cis	-133.8	-175.8	-4	39.9	-22.5	0	0	0	114.1
395	S	23.7	Very low	26.5	Very low	100 Å²	100	118.1 Å²	118.1	70%	0.699	77%	0.765	S	S	*	*				151.7	139.2	114.2	62.7	0	0	0	0	117.6
396	L	24.5	Very low	26.2	Very low	151 Å²	151	117.8 Å²	117.8	79%	0.791	77%	0.768	S	S	*	*			trans	63.6	109.7	145.5	-65.2	163.9	0	0	0	122.8
397	C	23.1	Very low	26.5	Very low	113 Å²	113	115.9 Å²	115.9	76%	0.764	77%	0.765	S	S	*	*				60.7	147.5	125.9	-63.2	0	0	0	0	121.5
398	S	26.1	Very low	26.5	Very low	93 Å²	93	119.9 Å²	119.9	65%	0.65	77%	0.774	S	S	*	*			cis	-158	159.8	2.6	-121.3	0	0	0	0	113.3
399	D	25.6	Very low	26.4	Very low	147 Å²	147	120.1 Å²	120.1	79%	0.786	78%	0.776	S	S	*	*			trans	20.9	128.8	149.8	-52	-77.4	0	0	0	122.2
400	G	25.3	Very low	26.5	Very low	80 Å²	80	118.6 Å²	118.6	83%	0.825	76%	0.763	S	S	*	*			trans	-158.8	115	163.7	0	0	0	0	0	111.8
401	H	24.4	Very low	26.7	Very low	175 Å²	175	123 Å²	123	81%	0.81	76%	0.758	S	S	*	*			trans	-104.9	163.1	-163	-130.5	-90.9	0	0	0	113.9
402	L	24.8	Very low	26.6	Very low	161 Å²	161	124 Å²	124	84%	0.843	75%	0.754	S	S	*	*			trans	81.5	156.8	168.7	-54.3	159.3	0	0	0	117.5
403	S	23.4	Very low	26.8	Very low	90 Å²	90	124.8 Å²	124.8	63%	0.629	74%	0.743	S	S	*	*			cis	-178.9	169.2	-32	-166.8	0	0	0	0	109.7
404	T	24.6	Very low	27.1	Very low	127 Å²	127	128 Å²	128	78%	0.779	74%	0.742	S	S	*	*			trans	69.3	147.4	166.7	71.7	0	0	0	0	117.3
405	V	26.1	Very low	26.5	Very low	136 Å²	136	126.4 Å²	126.4	82%	0.824	74%	0.739	S	S	*	*			cis	-155.6	154.1	-10.6	117.2	0	0	0	0	109.7
406	A	25.8	Very low	26.8	Very low	85 Å²	85	128.9 Å²	128.9	70%	0.702	74%	0.744	S	S	*	*			trans	-112.8	162.1	170.5	0	0	0	0	0	111.3
407	P	37.6	Very low	27	Very low	103 Å²	103	130.3 Å²	130.3	67%	0.669	75%	0.747	S	S	*	*				-139.1	144	104.8	22	-0.8	0	0	0	113.8
408	E	27.9	Very low	27.2	Very low	170 Å²	170	133.3 Å²	133.3	79%	0.794	75%	0.754	S	S	*	*				70	132.9	94.3	-54.4	177.7	142.7	0	0	113.3
409	D	26.4	Very low	27.1	Very low	154 Å²	154	137.9 Å²	137.9	82%	0.824	76%	0.763	S	S	*	*				-139.4	121.7	62.8	-80.9	-38.3	0	0	0	117.6
410	V	28.3	Very low	27.5	Very low	90 Å²	90	136 Å²	136	55%	0.545	76%	0.759	S	S	.	*				35	126.2	127.1	-138.1	0	0	0	0	122.5
411	F	25.6	Very low	27.5	Very low	174 Å²	174	138 Å²	138	76%	0.763	75%	0.754	S	S	*	*				170	111	102.6	-92.6	-69.9	0	0	0	116
412	L	28.3	Very low	27.6	Very low	142 Å²	142	138.1 Å²	138.1	74%	0.743	76%	0.755	S	S	*	*			trans	59.4	127.8	150.4	-59.8	164.5	0	0	0	119.4
413	D	27.2	Very low	27.7	Very low	121 Å²	121	138.2 Å²	138.2	65%	0.647	76%	0.756	S	S	*	*			cis	89.4	145.4	47.5	-76.7	-41.1	0	0	0	114.4
414	H	29.4	Very low	27.8	Very low	160 Å²	160	141.8 Å²	141.8	74%	0.741	77%	0.768	S	S	*	*			cis	-159.6	158.4	14.4	-125.7	9.1	0	0	0	112
415	A	29.1	Very low	27.9	Very low	83 Å²	83	141.9 Å²	141.9	69%	0.686	77%	0.768	S	S	*	*			trans	58.3	158.2	142.9	0	0	0	0	0	121.5
416	D	29.3	Very low	27.9	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	77%	0.773	S	S	*	*			cis	-122.5	142.2	-9.2	-71.4	-67.9	0	0	0	107.8
417	E	29.4	Very low	28.2	Very low	180 Å²	180	149.4 Å²	149.4	84%	0.841	78%	0.78	S	S	*	*				66	98.3	60.7	-107.3	-161.4	-156.2	0	0	117.1
418	L	26.6	Very low	28.2	Very low	177 Å²	177	150.1 Å²	150.1	93%	0.927	78%	0.784	S	S	*	*			trans	-152.5	124.5	142.3	-84	-167.7	0	0	0	111.7
419	K	24.8	Very low	28.4	Very low	189 Å²	189	144.9 Å²	144.9	82%	0.822	78%	0.776	S	S	*	*			trans	-134.7	171.3	160.2	-109.3	-164.5	175.6	-169.1	0	106.4
420	P	34.2	Very low	28.8	Very low	108 Å²	108	142.5 Å²	142.5	70%	0.701	76%	0.763	S	S	*	*			cis	-127.9	-178.4	6.7	42.8	-28.4	0	0	0	113.9
421	V	23.6	Very low	29	Very low	122 Å²	122	143.3 Å²	143.3	74%	0.739	76%	0.764	S	S	*	*				-169.2	136.1	123.6	142.8	0	0	0	0	107.3	L423	V421-L423 HydrophobicContact CG1-CG 4.34Å
422	E	27.1	Very low	29.6	Very low	177 Å²	177	139.1 Å²	139.1	83%	0.827	75%	0.753	S	S	*	*			trans	-102.8	130	172.8	-70.6	167.3	168	0	0	108.8
423	L	26.6	Very low	30	Very low	162 Å²	162	142.6 Å²	142.6	85%	0.848	76%	0.756	S	S	*	*			trans	-146.8	111.2	168.5	-85.8	176.2	0	0	0	108.4	V421	V421-L423 HydrophobicContact CG1-CG 4.34Å
424	D	25.1	Very low	30.5	Very low	166 Å²	166	143 Å²	143	89%	0.888	75%	0.754	S	S	*	*			trans	-73.1	123	170.8	-66	-56	0	0	0	110.8
425	T	26.8	Very low	30.8	Very low	129 Å²	129	138.1 Å²	138.1	79%	0.791	73%	0.733	S	S	*	*			trans	-156.6	95.2	146.6	49.4	0	0	0	0	110.9
426	E	26.8	Very low	31.3	Very low	199 Å²	199	138.5 Å²	138.5	93%	0.93	73%	0.727	S	S	*	*			trans	60.3	162.5	148.1	-53.5	-169.2	164.5	0	0	120.4
427	E	33.2	Very low	31.5	Very low	180 Å²	180	139.7 Å²	139.7	84%	0.841	73%	0.725	S	S	*	*			trans	-74.5	160.2	-178	-51.8	-172.8	108	0	0	112.2
428	P	37.3	Very low	31.7	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	72%	0.716	S	S	*	*				-138.4	129	87.1	33.5	-19.1	0	0	0	114.3	N430	P428-N430 PolarHBondContact O-N 3.28Å
429	G	30.7	Very low	31.9	Very low	60 Å²	60	136.7 Å²	136.7	62%	0.619	70%	0.702	S	S	*	*			trans	-72.5	110.6	171.5	0	0	0	0	0	113.2	L431	G429-L431 PolarHBondContact O-N 2.92Å
430	N	35.1	Very low	32.2	Very low	104 Å²	104	133 Å²	133	56%	0.556	70%	0.695	S	S	*	*			trans	33.8	68.2	150.6	-164.7	-16.5	0	0	0	117	P428 T432	P428-N430 PolarHBondContact O-N 3.28Å; N430-T432 PolarHBondContact O-N 3.02Å; N430-T432 WeakPolarHBondContact OD1-CB 3.36Å; N430-T432 PolarHBondContact OD1-N 2.82Å
431	L	33.5	Very low	32	Very low	108 Å²	108	131.6 Å²	131.6	57%	0.565	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-21.3	170.4	-99.2	76.7	0	0	0	113.3	G429 R433 Q434 L435	G429-L431 PolarHBondContact O-N 2.92Å; L431-R433 VanDerWaalsContact C-N 3.25Å; L431-R433 PolarHBondContact O-N 2.72Å; L431-Q434 WeakPolarHBondContact O-CA 3.37Å; L431-Q434 PolarHBondContact O-N 3.45Å; L431-L435 HydrophobicContact CB-CD1 3.98Å; L431-L435 HydrophobicContact CD2-CD1 4.12Å; L431-L435 HydrophobicContact CG-CD1 4.45Å; L431-L435 PolarHBondContact O-N 3.43Å
432	T	37	Very low	32.3	Very low	86 Å²	86	131.5 Å²	131.5	53%	0.528	69%	0.693	S	S	.	*	H	α-helix	trans	-57	-36.4	-172.4	-42.2	0	0	0	0	112.4	N430 L435 V436	N430-T432 PolarHBondContact O-N 3.02Å; N430-T432 WeakPolarHBondContact OD1-CB 3.36Å; N430-T432 PolarHBondContact OD1-N 2.82Å; T432-L435 PolarHBondContact O-N 3.37Å; T432-V436 WeakPolarHBondContact O-CG2 3.23Å; T432-V436 PolarHBondContact O-N 3.47Å
433	R	38.2	Very low	32.2	Very low	214 Å²	214	131.4 Å²	131.4	81%	0.808	69%	0.692	S	S	*	*	H	α-helix	trans	-72.7	-22.8	175.3	-75.2	-172.4	170.9	-172.7	-2.8	114.5	L431	L431-R433 VanDerWaalsContact C-N 3.25Å; L431-R433 PolarHBondContact O-N 2.72Å
434	Q	35.7	Very low	32.3	Very low	131 Å²	131	131.2 Å²	131.2	61%	0.612	69%	0.69	S	S	*	*	H	α-helix	trans	-86.7	-29.3	171	-82.6	-167	-3.6	0	0	113	L431	L431-Q434 WeakPolarHBondContact O-CA 3.37Å; L431-Q434 PolarHBondContact O-N 3.45Å
435	L	36.8	Very low	32.2	Very low	57 Å²	57	129 Å²	129	30%	0.298	68%	0.683	S	S	.	*	H	α-helix	trans	-71.3	-38.2	172.7	-92.3	87.4	0	0	0	112.3	L431 T432 K437 R438 L439	L431-L435 HydrophobicContact CB-CD1 3.98Å; L431-L435 HydrophobicContact CD2-CD1 4.12Å; L431-L435 HydrophobicContact CG-CD1 4.45Å; L431-L435 PolarHBondContact O-N 3.43Å; T432-L435 PolarHBondContact O-N 3.37Å; L435-K437 PolarHBondContact O-N 3.14Å; L435-R438 CarbonylContact O-C 3.59Å; L435-R438 WeakPolarHBondContact O-CA 3.37Å; L435-R438 PolarHBondContact O-N 3.41Å; L435-L439 HydrophobicContact CB-CD1 4.25Å; L435-L439 HydrophobicContact CD2-CD1 4.27Å; L435-L439 WeakPolarHBondContact O-CB 3.23Å; L435-L439 WeakPolarHBondContact O-CG 3.27Å; L435-L439 PolarHBondContact O-N 2.78Å
436	V	40.1	Very low	32	Very low	90 Å²	90	127.6 Å²	127.6	55%	0.545	68%	0.678	S	S	.	*	H	α-helix	trans	-58.3	-36.9	176.3	169.3	0	0	0	0	111.6	T432 R438 T440	T432-V436 WeakPolarHBondContact O-CG2 3.23Å; T432-V436 PolarHBondContact O-N 3.47Å; V436-R438 PolarHBondContact O-N 2.77Å; V436-T440 PolarHBondContact O-N 2.95Å; V436-T440 PolarHBondContact O-OG1 3.03Å
437	K	33.6	Very low	32	Very low	178 Å²	178	124.1 Å²	124.1	77%	0.774	67%	0.673	S	S	*	*	H	α-helix	trans	-79.4	5.3	174.3	-149.6	-171.7	175.9	-177.3	0	114.5	L435	L435-K437 PolarHBondContact O-N 3.14Å
438	R	33.1	Very low	31.7	Very low	174 Å²	174	120.9 Å²	120.9	66%	0.657	68%	0.677	S	S	*	*	H	α-helix	trans	-118.6	-25.9	171.2	-77.4	-171.1	169.3	109.7	-3.1	113.2	L435 V436 S441	L435-R438 CarbonylContact O-C 3.59Å; L435-R438 WeakPolarHBondContact O-CA 3.37Å; L435-R438 PolarHBondContact O-N 3.41Å; V436-R438 PolarHBondContact O-N 2.77Å; R438-S441 WeakPolarHBondContact O-CB 3.49Å; R438-S441 PolarHBondContact O-N 2.93Å
439	L	30.7	Very low	31	Very low	119 Å²	119	118.4 Å²	118.4	62%	0.623	67%	0.672	S	S	*	*	H	α-helix	trans	-86.5	-14.5	-179.6	-67.6	175.7	0	0	0	113.5	L435 S441	L435-L439 HydrophobicContact CB-CD1 4.25Å; L435-L439 HydrophobicContact CD2-CD1 4.27Å; L435-L439 WeakPolarHBondContact O-CB 3.23Å; L435-L439 WeakPolarHBondContact O-CG 3.27Å; L435-L439 PolarHBondContact O-N 2.78Å; L439-S441 PolarHBondContact O-N 3.17Å
440	T	31.8	Very low	30.6	Very low	111 Å²	111	121.9 Å²	121.9	68%	0.681	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-1.1	164.5	57.4	0	0	0	0	112.9	V436	V436-T440 PolarHBondContact O-N 2.95Å; V436-T440 PolarHBondContact O-OG1 3.03Å
441	S	29.6	Very low	30.3	Very low	79 Å²	79	122.4 Å²	122.4	55%	0.552	70%	0.699	S	S	*	*	S	Bend	trans	-98.3	96.9	173.1	-56.4	0	0	0	0	109.3	R438 L439 E443	R438-S441 WeakPolarHBondContact O-CB 3.49Å; R438-S441 PolarHBondContact O-N 2.93Å; L439-S441 PolarHBondContact O-N 3.17Å; S441-E443 PolarHBondContact O-N 3.07Å; S441-E443 VanDerWaalsContact O-N 3.09Å
442	S	28.9	Very low	29.8	Very low	120 Å²	120	124.1 Å²	124.1	84%	0.839	71%	0.714	S	S	*	*			trans	-74.4	96.9	-178.9	-69.6	0	0	0	0	111.8
443	E	25.7	Very low	29.4	Very low	175 Å²	175	129.9 Å²	129.9	82%	0.818	74%	0.735	S	S	*	*			trans	-100.4	98.2	174.1	-170.4	174.3	-126.6	0	0	110.6	S441 V445	S441-E443 PolarHBondContact O-N 3.07Å; S441-E443 VanDerWaalsContact O-N 3.09Å; E443-V445 PolarHBondContact O-N 2.78Å
444	I	28.8	Very low	28.6	Very low	158 Å²	158	123.3 Å²	123.3	81%	0.81	73%	0.734	S	S	*	*			trans	-84.2	104	172.5	-65.3	179.4	0	0	0	108.9	S446	I444-S446 PolarHBondContact O-N 3.36Å
445	V	22.6	Very low	28.3	Very low	120 Å²	120	121.1 Å²	121.1	73%	0.727	75%	0.746	S	S	*	*			trans	-69.9	127.7	177.1	175.2	0	0	0	0	111.3	E443	E443-V445 PolarHBondContact O-N 2.78Å
446	S	22	Very low	27.6	Very low	99 Å²	99	122.1 Å²	122.1	69%	0.692	77%	0.77	S	S	*	*			trans	-146.3	159.9	162.3	-85.6	0	0	0	0	109.3	I444	I444-S446 PolarHBondContact O-N 3.36Å
447	P	28.5	Very low	27.2	Very low	127 Å²	127	121.9 Å²	121.9	83%	0.825	77%	0.773	S	S	*	*				-76.4	153.6	-127.7	25	-35.2	0	0	0	116.8
448	A	25.3	Very low	27.3	Very low	111 Å²	111	120.7 Å²	120.7	92%	0.917	77%	0.774	S	S	*	*			trans	-63.2	144.1	-167.7	0	0	0	0	0	116.1
449	G	24.3	Very low	27.8	Very low	65 Å²	65	113.9 Å²	113.9	67%	0.67	76%	0.758	S	S	*	*			trans	-164.2	89.8	170.8	0	0	0	0	0	114
450	S	22.1	Very low	29	Very low	133 Å²	133	109.3 Å²	109.3	93%	0.93	73%	0.733	S	S	*	*			trans	58.1	137.7	166.8	46.2	0	0	0	0	119.5
451	S	29	Very low	29.8	Very low	115 Å²	115	104.2 Å²	104.2	80%	0.804	70%	0.701	S	S	*	*			trans	-98.4	133.6	-176.5	53.4	0	0	0	0	114
452	T	22.4	Very low	30.3	Very low	144 Å²	144	102.7 Å²	102.7	88%	0.883	70%	0.698	S	S	*	*			trans	-148.2	149.2	152.5	29.5	0	0	0	0	108.7
453	E	28	Very low	30.7	Very low	208 Å²	208	104.9 Å²	104.9	97%	0.972	70%	0.695	S	S	*	*			trans	-82.9	139.3	-173.5	-63.2	172.4	128.8	0	0	112.1
454	G	22.7	Very low	31.3	Very low	75 Å²	75	98.4 Å²	98.4	77%	0.773	68%	0.675	S	S	*	*			trans	174.6	141.2	177.8	0	0	0	0	0	111.5	G456	G454-G456 PolarHBondContact O-N 2.69Å
455	G	27.6	Very low	31.9	Very low	85 Å²	85	91.3 Å²	91.3	88%	0.876	64%	0.64	S	S	*	*			trans	-72.4	115	-176.6	0	0	0	0	0	112.6	S457	G455-S457 PolarHBondContact O-N 3.05Å
456	G	23.5	Very low	32.8	Very low	78 Å²	78	93.3 Å²	93.3	80%	0.804	63%	0.634	S	S	*	*			trans	-72.6	114.5	179.2	0	0	0	0	0	112.8	G454	G454-G456 PolarHBondContact O-N 2.69Å
457	S	32	Very low	33.8	Very low	86 Å²	86	90.5 Å²	90.5	60%	0.601	62%	0.617	S	S	*	*			trans	-78.7	128.4	170.6	-168.6	0	0	0	0	110.5	G455 G459	G455-S457 PolarHBondContact O-N 3.05Å; S457-G459 PolarHBondContact O-N 3.04Å
458	L	35.8	Very low	34.8	Very low	153 Å²	153	85 Å²	85	80%	0.801	58%	0.58	S	S	*	*			trans	-80	80	177.9	-82.8	158.1	0	0	0	110.7	W460 H622	L458-W460 PolarHBondContact O-N 3.16Å; L458-H622 PolarHBondContact O-CE1 3.35Å
459	G	43.5	Very low	36	Very low	31 Å²	31	86.1 Å²	86.1	32%	0.32	57%	0.57	S	S	.	*			trans	-61	121.2	178.2	0	0	0	0	0	112.8	S457	S457-G459 PolarHBondContact O-N 3.04Å
460	W	55.8	Low	37.5	Very low	23 Å²	23	91 Å²	91	9%	0.087	58%	0.576	C	S	.	*	H	α-helix	trans	-74.4	-41.8	-171.3	56.6	-86	0	0	0	113.9	L458 G462 F468 Y619 H622 V733	L458-W460 PolarHBondContact O-N 3.16Å; W460-G462 VanDerWaalsContact C-N 3.29Å; W460-G462 PolarHBondContact O-N 3.35Å; W460-F468 AromaticContact CE3-CZ 3.9Å; W460-F468 HydrophobicContact CE3-CZ 3.9Å; W460-F468 HydrophobicContact CZ3-CE1 4.48Å; W460-F468 HydrophobicContact CZ3-CE2 4.47Å; W460-F468 AromaticContact CZ3-CZ 3.73Å; W460-F468 HydrophobicContact CZ3-CZ 3.73Å; W460-Y619 HydrophobicContact CD2-CD2 4.15Å; W460-Y619 AromaticContact CE2-CD2 3.77Å; W460-Y619 HydrophobicContact CH2-CD2 4.25Å; W460-Y619 AromaticContact CZ2-CD2 3.82Å; W460-Y619 HydrophobicContact CZ2-CD2 3.82Å; W460-Y619 HydrophobicContact CZ2-CE2 4.26Å; W460-H622 HydrophobicContact CB-CB 4.17Å; W460-H622 AromaticContact CD1-CD2 3.64Å; W460-H622 AromaticContact CD1-NE2 3.63Å; W460-H622 AromaticContact CG-CD2 3.71Å; W460-H622 AromaticContact CG-NE2 3.97Å; W460-V733 HydrophobicContact CH2-CB 4.34Å; W460-V733 HydrophobicContact CZ2-CB 3.88Å; W460-V733 WeakPolarHBondContact CZ2-O 3.43Å; W460-V733 PolarHBondContact NE1-O 2.79Å
461	A	47.5	Very low	39.6	Very low	3 Å²	3	85.8 Å²	85.8	3%	0.025	54%	0.539	C	S	.	.	H	α-helix	trans	-78.7	74.9	173.4	0	0	0	0	0	110.9	R735 D752	A461-R735 HydrophobicContact CB-CG 4.35Å; A461-R735 PolarHBondContact O-NH1 3.12Å; A461-D752 HydrophobicContact CB-CB 4.28Å
462	G	39.9	Very low	42.2	Very low	47 Å²	47	82.2 Å²	82.2	49%	0.485	51%	0.514	S	S	.	.	H	α-helix	trans	-161.8	-61.6	173.8	0	0	0	0	0	112.7	W460	W460-G462 VanDerWaalsContact C-N 3.29Å; W460-G462 PolarHBondContact O-N 3.35Å
463	E	38.2	Very low	45.3	Very low	166 Å²	166	75.8 Å²	75.8	78%	0.776	47%	0.474	S	S	*	.	H	α-helix	trans	-88.3	-44.1	176.8	-156.2	102.5	-113.1	0	0	111.1	S465 R466	E463-S465 PolarHBondContact O-N 2.88Å; E463-R466 WeakPolarHBondContact O-CG 3.23Å
464	G	38.6	Very low	48.1	Very low	39 Å²	39	69.3 Å²	69.3	40%	0.402	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-67.8	-22.1	172.6	0	0	0	0	0	113.7	R466 A467	G464-R466 PolarHBondContact O-N 3.4Å; G464-A467 PolarHBondContact O-N 2.86Å
465	S	40.3	Very low	51.2	Low	9 Å²	9	70.9 Å²	70.9	6%	0.063	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-62	-5.6	-178	-158.3	0	0	0	0	114.8	E463 D752	E463-S465 PolarHBondContact O-N 2.88Å; S465-D752 VanDerWaalsContact CB-OD1 3.23Å; S465-D752 WeakPolarHBondContact CB-OD1 3.46Å; S465-D752 PolarHBondContact OG-OD1 3.14Å
466	R	41.5	Very low	54.1	Low	162 Å²	162	67 Å²	67	61%	0.611	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-80.6	-19.5	174.1	-51.9	179.5	79.2	124.2	-0.7	112.6	E463 G464	E463-R466 WeakPolarHBondContact O-CG 3.23Å; G464-R466 PolarHBondContact O-N 3.4Å
467	A	43.8	Very low	57.3	Low	41 Å²	41	63.3 Å²	63.3	34%	0.339	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-21	-175	0	0	0	0	0	114.7	G464 L469 E470 S471	G464-A467 PolarHBondContact O-N 2.86Å; A467-L469 PolarHBondContact O-N 2.88Å; A467-E470 PolarHBondContact O-N 3.29Å; A467-S471 PolarHBondContact O-N 3.38Å; A467-S471 PolarHBondContact O-OG 3.41Å
468	F	48.6	Very low	60	Low	11 Å²	11	63.3 Å²	63.3	5%	0.048	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.1	-172.9	-67.9	-49.2	0	0	0	115.6	W460 I615 Q618	W460-F468 AromaticContact CE3-CZ 3.9Å; W460-F468 HydrophobicContact CE3-CZ 3.9Å; W460-F468 HydrophobicContact CZ3-CE1 4.48Å; W460-F468 HydrophobicContact CZ3-CE2 4.47Å; W460-F468 AromaticContact CZ3-CZ 3.73Å; W460-F468 HydrophobicContact CZ3-CZ 3.73Å; F468-I615 HydrophobicContact CD1-CG1 4.23Å; F468-Q618 HydrophobicContact CD1-CB 4.37Å; F468-Q618 HydrophobicContact CE1-CB 3.87Å; F468-Q618 HydrophobicContact CE1-CG 4.49Å; F468-Q618 VanDerWaalsContact CE1-OE1 3.25Å
469	L	51.3	Low	62.6	Low	135 Å²	135	58.6 Å²	58.6	71%	0.707	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	3.4	179.2	-63.8	175.7	0	0	0	113.2	A467	A467-L469 PolarHBondContact O-N 2.88Å
470	E	54.6	Low	64.8	Low	167 Å²	167	57.1 Å²	57.1	78%	0.78	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-27.6	-178.9	-64.6	-172.4	173.5	0	0	112.4	A467	A467-E470 PolarHBondContact O-N 3.29Å
471	S	67.6	Low	66.5	Low	23 Å²	23	57.1 Å²	57.1	16%	0.161	31%	0.309	C	S	.	.	S	Bend	trans	-80.4	134.5	176.5	63.2	0	0	0	0	113	A467 E475 Q618	A467-S471 PolarHBondContact O-N 3.38Å; A467-S471 PolarHBondContact O-OG 3.41Å; S471-E475 WeakPolarHBondContact CA-OE2 3.48Å; S471-Q618 PolarHBondContact OG-NE2 2.87Å
472	S	83.2	Confident	68.5	Low	41 Å²	41	60.6 Å²	60.6	29%	0.287	33%	0.33	S	S	.	.			trans	-70.7	163	168.6	65.3	0	0	0	0	113.4	E474 E475 A476	S472-E474 PolarHBondContact O-N 3.09Å; S472-E475 VanDerWaalsContact CB-OE1 3.25Å; S472-E475 WeakPolarHBondContact CB-OE1 3.44Å; S472-E475 PolarHBondContact N-OE1 3.37Å; S472-E475 VanDerWaalsContact N-OE1 3.13Å; S472-E475 PolarHBondContact O-N 3.16Å; S472-E475 VanDerWaalsContact OG-CD 3.23Å; S472-E475 VanDerWaalsContact OG-CG 3.29Å; S472-E475 WeakPolarHBondContact OG-CG 3.06Å; S472-E475 PolarHBondContact OG-N 2.92Å; S472-E475 VanDerWaalsContact OG-N 3.12Å; S472-E475 PolarHBondContact OG-OE1 2.82Å; S472-A476 PolarHBondContact O-N 2.68Å
473	L	86.4	Confident	70.7	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-35	172.2	-178.6	54.2	0	0	0	111.8	A476 I477 L508 L602 D610 I613 V614 L617	L473-A476 PolarHBondContact O-N 2.87Å; L473-I477 HydrophobicContact CD1-CD1 4.29Å; L473-I477 HydrophobicContact CG-CD1 4.36Å; L473-I477 WeakPolarHBondContact O-CG1 3.37Å; L473-I477 PolarHBondContact O-N 2.73Å; L473-I477 VanDerWaalsContact O-N 3.1Å; L473-L508 HydrophobicContact CD1-CD1 4.46Å; L473-L508 HydrophobicContact CD2-CD1 3.59Å; L473-L508 HydrophobicContact CD2-CD2 3.89Å; L473-L508 HydrophobicContact CD2-CG 4.37Å; L473-L508 HydrophobicContact CG-CD1 4.01Å; L473-L602 HydrophobicContact CB-CB 4.49Å; L473-L602 HydrophobicContact CD2-CB 4.37Å; L473-L602 HydrophobicContact CG-CB 4.32Å; L473-D610 HydrophobicContact CD2-CB 4.5Å; L473-I613 HydrophobicContact CD1-CB 4.22Å; L473-I613 HydrophobicContact CD1-CG2 3.57Å; L473-V614 HydrophobicContact CB-CG2 4.15Å; L473-V614 HydrophobicContact CD1-CG2 4.03Å; L473-L617 HydrophobicContact CD1-CD1 3.79Å
474	E	87.4	Confident	73	Confident	73 Å²	73	52.8 Å²	52.8	34%	0.341	28%	0.28	S	S	.	.	H	α-helix	trans	-64.6	-47.9	174.5	-168.7	174.8	160.7	0	0	112	S472 A476 I477 H478 L602	S472-E474 PolarHBondContact O-N 3.09Å; E474-A476 PolarHBondContact O-N 3.19Å; E474-I477 PolarHBondContact O-N 2.64Å; E474-H478 WeakPolarHBondContact O-CB 3.47Å; E474-H478 PolarHBondContact O-N 3.37Å; E474-H478 PolarHBondContact O-ND1 2.76Å; E474-L602 HydrophobicContact CB-CD1 4.14Å; E474-L602 HydrophobicContact CB-CG 4.14Å; E474-L602 HydrophobicContact CG-CD1 4.24Å; E474-L602 HydrophobicContact CG-CG 4.32Å
475	E	87.7	Confident	75.2	Confident	108 Å²	108	56.5 Å²	56.5	51%	0.505	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-40.6	174.6	-74.2	155.7	-112.6	0	0	112.7	S471 S472 S479	S471-E475 WeakPolarHBondContact CA-OE2 3.48Å; S472-E475 VanDerWaalsContact CB-OE1 3.25Å; S472-E475 WeakPolarHBondContact CB-OE1 3.44Å; S472-E475 PolarHBondContact N-OE1 3.37Å; S472-E475 VanDerWaalsContact N-OE1 3.13Å; S472-E475 PolarHBondContact O-N 3.16Å; S472-E475 VanDerWaalsContact OG-CD 3.23Å; S472-E475 VanDerWaalsContact OG-CG 3.29Å; S472-E475 WeakPolarHBondContact OG-CG 3.06Å; S472-E475 PolarHBondContact OG-N 2.92Å; S472-E475 VanDerWaalsContact OG-N 3.12Å; S472-E475 PolarHBondContact OG-OE1 2.82Å; E475-S479 WeakPolarHBondContact O-CB 2.89Å; E475-S479 PolarHBondContact O-N 2.7Å
476	A	89.2	Confident	77.1	Confident	3 Å²	3	60 Å²	60	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-43.7	179.7	0	0	0	0	0	111.8	S472 L473 E474 L480 V614 L617	S472-A476 PolarHBondContact O-N 2.68Å; L473-A476 PolarHBondContact O-N 2.87Å; E474-A476 PolarHBondContact O-N 3.19Å; A476-L480 WeakPolarHBondContact O-CB 3.42Å; A476-L480 PolarHBondContact O-N 2.67Å; A476-L480 VanDerWaalsContact O-N 3.17Å; A476-V614 HydrophobicContact CB-CG1 4.34Å; A476-V614 HydrophobicContact CB-CG2 4.2Å; A476-L617 HydrophobicContact CB-CB 4.15Å; A476-L617 HydrophobicContact CB-CD1 3.91Å
477	I	91	Very high	79	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-52.8	174.8	-70.8	171.7	0	0	0	110.7	L473 E474 S479 L480 L481 V501 L504 E505 L508 L602 L617	L473-I477 HydrophobicContact CD1-CD1 4.29Å; L473-I477 HydrophobicContact CG-CD1 4.36Å; L473-I477 WeakPolarHBondContact O-CG1 3.37Å; L473-I477 PolarHBondContact O-N 2.73Å; L473-I477 VanDerWaalsContact O-N 3.1Å; E474-I477 PolarHBondContact O-N 2.64Å; I477-S479 VanDerWaalsContact C-N 3.31Å; I477-S479 PolarHBondContact O-N 3.25Å; I477-L480 PolarHBondContact O-N 3.1Å; I477-L480 VanDerWaalsContact O-N 3.12Å; I477-L481 HydrophobicContact CG2-CD1 3.83Å; I477-L481 HydrophobicContact CG2-CG 4.36Å; I477-L481 WeakPolarHBondContact O-CG 3.43Å; I477-L481 PolarHBondContact O-N 3.01Å; I477-V501 HydrophobicContact CB-CG1 4.46Å; I477-V501 HydrophobicContact CG1-CG1 4.44Å; I477-V501 HydrophobicContact CG2-CG1 3.81Å; I477-L504 HydrophobicContact CD1-CG 4.5Å; I477-E505 HydrophobicContact CD1-CB 4.15Å; I477-E505 HydrophobicContact CD1-CG 4.04Å; I477-E505 HydrophobicContact CG2-CB 4.1Å; I477-E505 HydrophobicContact CG2-CG 3.86Å; I477-L508 HydrophobicContact CD1-CD1 3.88Å; I477-L602 HydrophobicContact CD1-CD1 4.05Å; I477-L617 HydrophobicContact CG1-CD1 3.64Å; I477-L617 HydrophobicContact CG1-CD2 4.45Å
478	H	88.9	Confident	79.5	Confident	87 Å²	87	57.5 Å²	57.5	40%	0.403	31%	0.31	S	S	.	.	H	α-helix	trans	-61.1	-38.2	-178.6	-77.8	81.9	0	0	0	112.5	E474 T482 E505	E474-H478 WeakPolarHBondContact O-CB 3.47Å; E474-H478 PolarHBondContact O-N 3.37Å; E474-H478 PolarHBondContact O-ND1 2.76Å; H478-T482 VanDerWaalsContact O-CB 3.3Å; H478-T482 WeakPolarHBondContact O-CB 3.01Å; H478-T482 PolarHBondContact O-N 3.09Å; H478-T482 PolarHBondContact O-OG1 2.9Å; H478-E505 IonicContact CE1-OE1 2.67Å; H478-E505 PolarHBondContact CE1-OE1 3.28Å
479	S	89.5	Confident	80.3	Confident	53 Å²	53	62.6 Å²	62.6	37%	0.371	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-39.7	176.3	-165.1	0	0	0	0	112	E475 I477 K483	E475-S479 WeakPolarHBondContact O-CB 2.89Å; E475-S479 PolarHBondContact O-N 2.7Å; I477-S479 VanDerWaalsContact C-N 3.31Å; I477-S479 PolarHBondContact O-N 3.25Å; S479-K483 WeakPolarHBondContact O-CB 3.14Å; S479-K483 WeakPolarHBondContact O-CD 3.35Å; S479-K483 VanDerWaalsContact O-CG 3.31Å; S479-K483 WeakPolarHBondContact O-CG 3.38Å; S479-K483 PolarHBondContact O-N 2.75Å; S479-K483 VanDerWaalsContact O-N 3.1Å
480	L	90.8	Very high	81.2	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-68.3	-46	177.3	179.6	52	0	0	0	111.7	A476 I477 K483 L484 L497 V501 L617 C620 I621 I624	A476-L480 WeakPolarHBondContact O-CB 3.42Å; A476-L480 PolarHBondContact O-N 2.67Å; A476-L480 VanDerWaalsContact O-N 3.17Å; I477-L480 PolarHBondContact O-N 3.1Å; I477-L480 VanDerWaalsContact O-N 3.12Å; L480-K483 WeakPolarHBondContact O-CB 3.24Å; L480-K483 PolarHBondContact O-N 2.88Å; L480-L484 HydrophobicContact CD1-CD1 4.08Å; L480-L484 HydrophobicContact CD1-CG 4.32Å; L480-L484 HydrophobicContact CG-CD1 4.08Å; L480-L484 WeakPolarHBondContact O-CG 3.41Å; L480-L484 PolarHBondContact O-N 3.06Å; L480-L497 HydrophobicContact CD1-CD2 4.45Å; L480-V501 HydrophobicContact CD2-CG1 4.36Å; L480-V501 HydrophobicContact CD2-CG2 3.62Å; L480-V501 HydrophobicContact CG-CG2 4.39Å; L480-L617 HydrophobicContact CD2-CB 4.47Å; L480-L617 HydrophobicContact CD2-CD2 3.67Å; L480-C620 HydrophobicContact CD1-CB 4.02Å; L480-C620 HydrophobicContact CD2-CB 3.86Å; L480-I621 HydrophobicContact CB-CD1 4.07Å; L480-I621 HydrophobicContact CB-CG1 3.85Å; L480-I621 HydrophobicContact CD1-CG1 3.86Å; L480-I621 HydrophobicContact CG-CG1 4.38Å; L480-I624 HydrophobicContact CD1-CD1 3.46Å; L480-I624 VanDerWaalsContact CD1-CD1 3.46Å
481	L	90.8	Very high	82.5	Confident	24 Å²	24	54.2 Å²	54.2	13%	0.126	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-49	175.4	-67.5	174.5	0	0	0	111.4	I477 K483 L484 E485 E498 V501 M502	I477-L481 HydrophobicContact CG2-CD1 3.83Å; I477-L481 HydrophobicContact CG2-CG 4.36Å; I477-L481 WeakPolarHBondContact O-CG 3.43Å; I477-L481 PolarHBondContact O-N 3.01Å; L481-K483 PolarHBondContact O-N 2.82Å; L481-K483 VanDerWaalsContact O-N 3.16Å; L481-L484 PolarHBondContact O-N 2.76Å; L481-E485 WeakPolarHBondContact O-CG 3.46Å; L481-E485 PolarHBondContact O-N 3.37Å; L481-E498 HydrophobicContact CD2-CG 4.36Å; L481-V501 HydrophobicContact CD1-CG1 4.46Å; L481-V501 HydrophobicContact CD2-CB 4.25Å; L481-V501 HydrophobicContact CD2-CG1 3.89Å; L481-V501 HydrophobicContact CG-CG1 3.95Å; L481-M502 HydrophobicContact CD1-CG 4.47Å; L481-M502 HydrophobicContact CD2-CG 4.01Å
482	T	88.3	Confident	83.4	Confident	76 Å²	76	61.4 Å²	61.4	47%	0.466	32%	0.315	S	S	.	.	H	α-helix	trans	-57	-34.2	176.6	-56.1	0	0	0	0	112.3	H478 S486	H478-T482 VanDerWaalsContact O-CB 3.3Å; H478-T482 WeakPolarHBondContact O-CB 3.01Å; H478-T482 PolarHBondContact O-N 3.09Å; H478-T482 PolarHBondContact O-OG1 2.9Å; T482-S486 PolarHBondContact O-N 2.75Å
483	K	87	Confident	83.7	Confident	48 Å²	48	62 Å²	62	21%	0.209	31%	0.313	C	S	.	.	H	α-helix	trans	-72.1	-43.2	175.1	-79.6	161	173.8	-85	0	111.9	S479 L480 L481 E485 S486 I621	S479-K483 WeakPolarHBondContact O-CB 3.14Å; S479-K483 WeakPolarHBondContact O-CD 3.35Å; S479-K483 VanDerWaalsContact O-CG 3.31Å; S479-K483 WeakPolarHBondContact O-CG 3.38Å; S479-K483 PolarHBondContact O-N 2.75Å; S479-K483 VanDerWaalsContact O-N 3.1Å; L480-K483 WeakPolarHBondContact O-CB 3.24Å; L480-K483 PolarHBondContact O-N 2.88Å; L481-K483 PolarHBondContact O-N 2.82Å; L481-K483 VanDerWaalsContact O-N 3.16Å; K483-E485 VanDerWaalsContact C-N 3.32Å; K483-E485 PolarHBondContact O-N 3.47Å; K483-S486 PolarHBondContact O-N 2.85Å; K483-S486 VanDerWaalsContact O-N 3.16Å; K483-S486 PolarHBondContact O-OG 3.13Å; K483-I621 HydrophobicContact CD-CB 4.11Å; K483-I621 HydrophobicContact CD-CD1 4.21Å; K483-I621 HydrophobicContact CD-CG1 3.75Å; K483-I621 HydrophobicContact CD-CG2 3.65Å; K483-I621 VanDerWaalsContact CE-CG2 3.41Å
484	L	87	Confident	83.9	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-37.7	175.6	-71.3	162.2	0	0	0	112	L480 L481 S486 L487 R490 L494 L497 E498 I624	L480-L484 HydrophobicContact CD1-CD1 4.08Å; L480-L484 HydrophobicContact CD1-CG 4.32Å; L480-L484 HydrophobicContact CG-CD1 4.08Å; L480-L484 WeakPolarHBondContact O-CG 3.41Å; L480-L484 PolarHBondContact O-N 3.06Å; L481-L484 PolarHBondContact O-N 2.76Å; L484-S486 VanDerWaalsContact C-N 3.33Å; L484-S486 PolarHBondContact O-N 3.36Å; L484-L487 HydrophobicContact CD2-CD1 4.34Å; L484-L487 WeakPolarHBondContact O-CB 3.47Å; L484-L487 PolarHBondContact O-N 2.76Å; L484-R490 PolarHBondContact O-NE 3.39Å; L484-R490 VanDerWaalsContact O-NE 3.07Å; L484-R490 PolarHBondContact O-NH2 3.36Å; L484-R490 VanDerWaalsContact O-NH2 3.17Å; L484-L494 HydrophobicContact CD2-CB 4.2Å; L484-L494 HydrophobicContact CD2-CD2 3.82Å; L484-L497 HydrophobicContact CD1-CG 4.45Å; L484-E498 HydrophobicContact CD1-CB 4.05Å; L484-E498 HydrophobicContact CD1-CG 4.48Å; L484-I624 HydrophobicContact CD2-CD1 3.67Å; L484-I624 HydrophobicContact CG-CD1 3.97Å
485	E	85.1	Confident	84	Confident	117 Å²	117	62.8 Å²	62.8	55%	0.547	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-34.7	172.1	-72.5	-178.6	164.8	0	0	113.6	L481 K483 L487 R490	L481-E485 WeakPolarHBondContact O-CG 3.46Å; L481-E485 PolarHBondContact O-N 3.37Å; K483-E485 VanDerWaalsContact C-N 3.32Å; K483-E485 PolarHBondContact O-N 3.47Å; E485-L487 PolarHBondContact O-N 3.09Å; E485-R490 VanDerWaalsContact CA-NH2 3.3Å
486	S	79.6	Confident	84.2	Confident	83 Å²	83	60.2 Å²	60.2	58%	0.58	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.7	178.5	77.1	0	0	0	0	114	T482 K483 L484 T488	T482-S486 PolarHBondContact O-N 2.75Å; K483-S486 PolarHBondContact O-N 2.85Å; K483-S486 VanDerWaalsContact O-N 3.16Å; K483-S486 PolarHBondContact O-OG 3.13Å; L484-S486 VanDerWaalsContact C-N 3.33Å; L484-S486 PolarHBondContact O-N 3.36Å; S486-T488 PolarHBondContact O-N 2.83Å
487	L	80.4	Confident	84.4	Confident	24 Å²	24	60 Å²	60	13%	0.126	31%	0.305	C	S	.	.			trans	-84.3	103.2	-179.9	-54.4	-179.7	0	0	0	110.5	L484 E485 H489 R490 L494 I624 T628	L484-L487 HydrophobicContact CD2-CD1 4.34Å; L484-L487 WeakPolarHBondContact O-CB 3.47Å; L484-L487 PolarHBondContact O-N 2.76Å; E485-L487 PolarHBondContact O-N 3.09Å; L487-H489 PolarHBondContact O-N 2.89Å; L487-R490 HydrophobicContact CB-CG 4.38Å; L487-L494 HydrophobicContact CD1-CD1 3.72Å; L487-L494 HydrophobicContact CD1-CD2 4.11Å; L487-L494 HydrophobicContact CD1-CG 4.48Å; L487-I624 HydrophobicContact CD1-CG2 4.01Å; L487-I624 HydrophobicContact CD2-CG2 4.22Å; L487-T628 HydrophobicContact CD2-CG2 3.43Å; L487-T628 VanDerWaalsContact CD2-CG2 3.43Å
488	T	55.4	Low	84.5	Confident	127 Å²	127	61.5 Å²	61.5	78%	0.779	31%	0.312	S	S	*	.	S	Bend	trans	-63.9	-5.4	178.6	57.8	0	0	0	0	114.7	S486	S486-T488 PolarHBondContact O-N 2.83Å
489	H	64.8	Low	84.7	Confident	118 Å²	118	62.8 Å²	62.8	55%	0.546	32%	0.318	S	S	.	.	S	Bend	trans	-144.8	136.6	173.9	-53.7	-81.2	0	0	0	108.6	W376 L487	W376-H489 HydrophobicContact CE3-CB 4.38Å; W376-H489 HydrophobicContact CH2-CB 4.26Å; W376-H489 HydrophobicContact CZ3-CB 3.49Å; W376-H489 VanDerWaalsContact CZ3-CB 3.49Å; W376-H489 AromaticContact CZ3-CD2 3.73Å; W376-H489 AromaticContact CZ3-CG 3.64Å; L487-H489 PolarHBondContact O-N 2.89Å
490	R	69.7	Low	84.9	Confident	81 Å²	81	60.9 Å²	60.9	31%	0.306	30%	0.304	S	S	.	.			trans	-130.7	113.7	-178.4	-62.9	177.7	178.8	168.9	-8	109.9	L484 E485 L487 L494 Q495 E498	L484-R490 PolarHBondContact O-NE 3.39Å; L484-R490 VanDerWaalsContact O-NE 3.07Å; L484-R490 PolarHBondContact O-NH2 3.36Å; L484-R490 VanDerWaalsContact O-NH2 3.17Å; E485-R490 VanDerWaalsContact CA-NH2 3.3Å; L487-R490 HydrophobicContact CB-CG 4.38Å; R490-L494 HydrophobicContact CB-CB 4.35Å; R490-Q495 HydrophobicContact CB-CG 3.93Å; R490-Q495 PolarHBondContact O-NE2 3.04Å; R490-E498 IonicContact CZ-OE1 3.1Å; R490-E498 IonicContact CZ-OE2 2.72Å; R490-E498 IonicContact NE-OE1 2.82Å; R490-E498 IonicContact NH1-OE1 3.69Å; R490-E498 PolarHBondContact NH1-OE1 2.98Å; R490-E498 IonicContact NH1-OE2 3.76Å; R490-E498 PolarHBondContact NH1-OE2 2.77Å; R490-E498 IonicContact NH2-OE1 3.55Å; R490-E498 PolarHBondContact NH2-OE1 3.23Å; R490-E498 IonicContact NH2-OE2 3.33Å
491	C	81.8	Confident	85.1	Confident	45 Å²	45	60.9 Å²	60.9	30%	0.304	30%	0.304	S	S	.	.			trans	-66.8	173.4	163.9	60.3	0	0	0	0	110.4	E493 L494 Q495 L640	C491-E493 VanDerWaalsContact C-N 3.35Å; C491-E493 WeakPolarHBondContact CB-OE2 3.35Å; C491-E493 PolarHBondContact O-N 2.82Å; C491-E493 PolarHBondContact SG-OE2 2.88Å; C491-L494 PolarHBondContact O-N 2.71Å; C491-Q495 PolarHBondContact O-N 2.87Å; C491-L640 WeakPolarHBondContact SG-CD2 3.5Å
492	R	86.9	Confident	85.1	Confident	174 Å²	174	63.8 Å²	63.8	66%	0.657	32%	0.318	S	S	*	.	H	α-helix	trans	-60.6	-43.7	-173.9	177.2	179.3	166.5	-173.1	-7.3	112.2	L494 Q495 D496	R492-L494 PolarHBondContact O-N 2.85Å; R492-Q495 CarbonylContact O-C 3.57Å; R492-Q495 WeakPolarHBondContact O-CA 3.42Å; R492-Q495 WeakPolarHBondContact O-CB 3.5Å; R492-Q495 PolarHBondContact O-N 2.83Å; R492-D496 WeakPolarHBondContact CG-OD2 3.24Å; R492-D496 IonicContact CZ-OD2 3.21Å; R492-D496 IonicContact NE-OD1 3.45Å; R492-D496 IonicContact NE-OD2 3.4Å; R492-D496 PolarHBondContact NE-OD2 2.74Å; R492-D496 IonicContact NH2-OD2 2.72Å; R492-D496 PolarHBondContact NH2-OD2 3.38Å; R492-D496 PolarHBondContact O-N 2.89Å
493	E	90.4	Very high	85.2	Confident	54 Å²	54	64.2 Å²	64.2	25%	0.252	31%	0.311	S	S	.	.	H	α-helix	trans	-60.1	-33.9	-175.1	-55.7	72.1	-158.5	0	0	111.7	C491 L497 L640	C491-E493 VanDerWaalsContact C-N 3.35Å; C491-E493 WeakPolarHBondContact CB-OE2 3.35Å; C491-E493 PolarHBondContact O-N 2.82Å; C491-E493 PolarHBondContact SG-OE2 2.88Å; E493-L497 VanDerWaalsContact O-CB 3.32Å; E493-L497 WeakPolarHBondContact O-CB 3.48Å; E493-L497 PolarHBondContact O-N 2.94Å; E493-L640 HydrophobicContact CB-CD2 4.25Å; E493-L640 HydrophobicContact CG-CB 4.31Å; E493-L640 HydrophobicContact CG-CD2 4.47Å
494	L	89.8	Confident	85.4	Confident	8 Å²	8	62 Å²	62	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-75.5	-31.2	175.6	-66.1	169.8	0	0	0	112.7	L484 L487 R490 C491 R492 E498 I624 L627 L643	L484-L494 HydrophobicContact CD2-CB 4.2Å; L484-L494 HydrophobicContact CD2-CD2 3.82Å; L487-L494 HydrophobicContact CD1-CD1 3.72Å; L487-L494 HydrophobicContact CD1-CD2 4.11Å; L487-L494 HydrophobicContact CD1-CG 4.48Å; R490-L494 HydrophobicContact CB-CB 4.35Å; C491-L494 PolarHBondContact O-N 2.71Å; R492-L494 PolarHBondContact O-N 2.85Å; L494-E498 VanDerWaalsContact O-CB 3.32Å; L494-E498 WeakPolarHBondContact O-CB 3.45Å; L494-E498 PolarHBondContact O-N 3.24Å; L494-E498 VanDerWaalsContact O-N 3.08Å; L494-I624 HydrophobicContact CD2-CD1 4.39Å; L494-I624 HydrophobicContact CD2-CG1 4Å; L494-L627 HydrophobicContact CD1-CD1 4.48Å; L494-L627 HydrophobicContact CD2-CD1 4.25Å; L494-L643 HydrophobicContact CD2-CD1 4Å
495	Q	89.4	Confident	85.5	Confident	88 Å²	88	63.1 Å²	63.1	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-76.5	-38.4	175.3	-62.5	175	42.8	0	0	111.3	R490 C491 R492 E498 Q499	R490-Q495 HydrophobicContact CB-CG 3.93Å; R490-Q495 PolarHBondContact O-NE2 3.04Å; C491-Q495 PolarHBondContact O-N 2.87Å; R492-Q495 CarbonylContact O-C 3.57Å; R492-Q495 WeakPolarHBondContact O-CA 3.42Å; R492-Q495 WeakPolarHBondContact O-CB 3.5Å; R492-Q495 PolarHBondContact O-N 2.83Å; Q495-E498 PolarHBondContact O-N 3.23Å; Q495-Q499 WeakPolarHBondContact O-CG 3.37Å; Q495-Q499 PolarHBondContact O-N 2.84Å; Q495-Q499 PolarHBondContact O-NE2 3.37Å
496	D	91.9	Very high	85.6	Confident	54 Å²	54	61.7 Å²	61.7	29%	0.289	30%	0.302	S	S	.	.	H	α-helix	trans	-67.9	-40.8	176.4	-68.7	-1.5	0	0	0	109.7	R492 E500	R492-D496 WeakPolarHBondContact CG-OD2 3.24Å; R492-D496 IonicContact CZ-OD2 3.21Å; R492-D496 IonicContact NE-OD1 3.45Å; R492-D496 IonicContact NE-OD2 3.4Å; R492-D496 PolarHBondContact NE-OD2 2.74Å; R492-D496 IonicContact NH2-OD2 2.72Å; R492-D496 PolarHBondContact NH2-OD2 3.38Å; R492-D496 PolarHBondContact O-N 2.89Å; D496-E500 PolarHBondContact O-N 2.99Å; D496-E500 VanDerWaalsContact O-N 3.12Å
497	L	94.2	Very high	85.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-44.7	170.8	179.3	61.2	0	0	0	113.1	L480 L484 E493 Q499 E500 V501 C620 I624 L643 T647 L650	L480-L497 HydrophobicContact CD1-CD2 4.45Å; L484-L497 HydrophobicContact CD1-CG 4.45Å; E493-L497 VanDerWaalsContact O-CB 3.32Å; E493-L497 WeakPolarHBondContact O-CB 3.48Å; E493-L497 PolarHBondContact O-N 2.94Å; L497-Q499 PolarHBondContact O-N 3.48Å; L497-E500 PolarHBondContact O-N 2.73Å; L497-V501 HydrophobicContact CD1-CG2 3.82Å; L497-V501 HydrophobicContact CG-CG2 4.27Å; L497-V501 VanDerWaalsContact O-CG2 3.27Å; L497-V501 WeakPolarHBondContact O-CG2 3.38Å; L497-V501 PolarHBondContact O-N 3.02Å; L497-C620 HydrophobicContact CD2-CB 4.17Å; L497-I624 HydrophobicContact CD2-CD1 4.35Å; L497-L643 HydrophobicContact CD2-CD2 3.79Å; L497-T647 WeakPolarHBondContact CA-OG1 3.34Å; L497-T647 WeakPolarHBondContact CB-OG1 3.42Å; L497-L650 HydrophobicContact CD1-CD1 3.97Å
498	E	92.9	Very high	85.9	Confident	30 Å²	30	59.3 Å²	59.3	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-44.7	179.3	-177.3	177.6	-133.9	0	0	112	L481 L484 R490 L494 Q495 V501 M502	L481-E498 HydrophobicContact CD2-CG 4.36Å; L484-E498 HydrophobicContact CD1-CB 4.05Å; L484-E498 HydrophobicContact CD1-CG 4.48Å; R490-E498 IonicContact CZ-OE1 3.1Å; R490-E498 IonicContact CZ-OE2 2.72Å; R490-E498 IonicContact NE-OE1 2.82Å; R490-E498 IonicContact NH1-OE1 3.69Å; R490-E498 PolarHBondContact NH1-OE1 2.98Å; R490-E498 IonicContact NH1-OE2 3.76Å; R490-E498 PolarHBondContact NH1-OE2 2.77Å; R490-E498 IonicContact NH2-OE1 3.55Å; R490-E498 PolarHBondContact NH2-OE1 3.23Å; R490-E498 IonicContact NH2-OE2 3.33Å; L494-E498 VanDerWaalsContact O-CB 3.32Å; L494-E498 WeakPolarHBondContact O-CB 3.45Å; L494-E498 PolarHBondContact O-N 3.24Å; L494-E498 VanDerWaalsContact O-N 3.08Å; Q495-E498 PolarHBondContact O-N 3.23Å; E498-V501 PolarHBondContact O-N 3.25Å; E498-M502 HydrophobicContact CG-CE 4.17Å; E498-M502 WeakPolarHBondContact O-CG 3.32Å; E498-M502 PolarHBondContact O-N 2.97Å; E498-M502 VanDerWaalsContact O-N 3.13Å
499	Q	92.5	Very high	87.1	Confident	115 Å²	115	58.2 Å²	58.2	54%	0.537	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-44.2	175.7	-75.6	167.1	93.3	0	0	111.9	Q495 L497 M502 R503	Q495-Q499 WeakPolarHBondContact O-CG 3.37Å; Q495-Q499 PolarHBondContact O-N 2.84Å; Q495-Q499 PolarHBondContact O-NE2 3.37Å; L497-Q499 PolarHBondContact O-N 3.48Å; Q499-M502 HydrophobicContact CG-CE 4.49Å; Q499-M502 PolarHBondContact O-N 3.13Å; Q499-R503 PolarHBondContact O-N 3.32Å
500	E	94.8	Very high	86.8	Confident	13 Å²	13	57.8 Å²	57.8	6%	0.061	28%	0.276	C	S	.	.	H	α-helix	trans	-68.6	-39.1	180	-177.9	48.6	-144.5	0	0	112.5	D496 L497 M502 R503 L504 T647 L650 E651	D496-E500 PolarHBondContact O-N 2.99Å; D496-E500 VanDerWaalsContact O-N 3.12Å; L497-E500 PolarHBondContact O-N 2.73Å; E500-M502 VanDerWaalsContact C-N 3.34Å; E500-M502 PolarHBondContact O-N 2.99Å; E500-R503 VanDerWaalsContact CD-NH2 3.34Å; E500-R503 PolarHBondContact O-N 2.65Å; E500-R503 IonicContact OE1-CZ 3.71Å; E500-R503 IonicContact OE1-NE 3.61Å; E500-R503 PolarHBondContact OE1-NE 3.07Å; E500-R503 IonicContact OE1-NH2 3.59Å; E500-R503 PolarHBondContact OE1-NH2 3.38Å; E500-R503 IonicContact OE2-CZ 3.92Å; E500-R503 IonicContact OE2-NE 2.76Å; E500-R503 PolarHBondContact OE2-NE 3.15Å; E500-R503 IonicContact OE2-NH2 3.38Å; E500-R503 PolarHBondContact OE2-NH2 3.42Å; E500-L504 WeakPolarHBondContact O-CB 3.23Å; E500-L504 PolarHBondContact O-N 3.49Å; E500-T647 HydrophobicContact CB-CG2 3.87Å; E500-T647 HydrophobicContact CG-CG2 4.33Å; E500-L650 HydrophobicContact CG-CB 4.03Å; E500-E651 HydrophobicContact CG-CB 4.29Å; E500-E651 WeakPolarHBondContact OE1-CA 3.36Å
501	V	93.9	Very high	86.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-36.7	178.2	173.6	0	0	0	0	111.6	I477 L480 L481 L497 E498 E505 L617 L650	I477-V501 HydrophobicContact CB-CG1 4.46Å; I477-V501 HydrophobicContact CG1-CG1 4.44Å; I477-V501 HydrophobicContact CG2-CG1 3.81Å; L480-V501 HydrophobicContact CD2-CG1 4.36Å; L480-V501 HydrophobicContact CD2-CG2 3.62Å; L480-V501 HydrophobicContact CG-CG2 4.39Å; L481-V501 HydrophobicContact CD1-CG1 4.46Å; L481-V501 HydrophobicContact CD2-CB 4.25Å; L481-V501 HydrophobicContact CD2-CG1 3.89Å; L481-V501 HydrophobicContact CG-CG1 3.95Å; L497-V501 HydrophobicContact CD1-CG2 3.82Å; L497-V501 HydrophobicContact CG-CG2 4.27Å; L497-V501 VanDerWaalsContact O-CG2 3.27Å; L497-V501 WeakPolarHBondContact O-CG2 3.38Å; L497-V501 PolarHBondContact O-N 3.02Å; E498-V501 PolarHBondContact O-N 3.25Å; V501-E505 PolarHBondContact O-N 3.45Å; V501-E505 VanDerWaalsContact O-N 3.09Å; V501-L617 HydrophobicContact CG1-CD2 4.43Å; V501-L617 HydrophobicContact CG2-CD2 4.09Å; V501-L650 HydrophobicContact CG2-CD1 4.21Å
502	M	90.8	Very high	84.7	Confident	85 Å²	85	61.2 Å²	61.2	42%	0.419	29%	0.293	S	S	.	.	H	α-helix	trans	-66	-43.1	170.3	-68.1	-175.9	-63.3	0	0	112.1	L481 E498 Q499 E500 L504 E505 D506	L481-M502 HydrophobicContact CD1-CG 4.47Å; L481-M502 HydrophobicContact CD2-CG 4.01Å; E498-M502 HydrophobicContact CG-CE 4.17Å; E498-M502 WeakPolarHBondContact O-CG 3.32Å; E498-M502 PolarHBondContact O-N 2.97Å; E498-M502 VanDerWaalsContact O-N 3.13Å; Q499-M502 HydrophobicContact CG-CE 4.49Å; Q499-M502 PolarHBondContact O-N 3.13Å; E500-M502 VanDerWaalsContact C-N 3.34Å; E500-M502 PolarHBondContact O-N 2.99Å; M502-L504 PolarHBondContact O-N 3.21Å; M502-E505 WeakPolarHBondContact O-CB 3.45Å; M502-E505 PolarHBondContact O-N 3.36Å; M502-D506 PolarHBondContact O-N 2.9Å; M502-D506 VanDerWaalsContact O-N 3.08Å
503	R	90.9	Very high	82.5	Confident	84 Å²	84	58.8 Å²	58.8	32%	0.317	30%	0.3	S	S	.	.	H	α-helix	trans	-60.9	-45	177.7	-169.3	-170	72	119.5	3.6	111.6	Q499 E500 E505 D506 L507 E651 A654	Q499-R503 PolarHBondContact O-N 3.32Å; E500-R503 VanDerWaalsContact CD-NH2 3.34Å; E500-R503 PolarHBondContact O-N 2.65Å; E500-R503 IonicContact OE1-CZ 3.71Å; E500-R503 IonicContact OE1-NE 3.61Å; E500-R503 PolarHBondContact OE1-NE 3.07Å; E500-R503 IonicContact OE1-NH2 3.59Å; E500-R503 PolarHBondContact OE1-NH2 3.38Å; E500-R503 IonicContact OE2-CZ 3.92Å; E500-R503 IonicContact OE2-NE 2.76Å; E500-R503 PolarHBondContact OE2-NE 3.15Å; E500-R503 IonicContact OE2-NH2 3.38Å; E500-R503 PolarHBondContact OE2-NH2 3.42Å; R503-E505 VanDerWaalsContact C-N 3.35Å; R503-D506 PolarHBondContact O-N 3.29Å; R503-L507 HydrophobicContact CG-CD1 4.15Å; R503-L507 WeakPolarHBondContact O-CB 3.47Å; R503-L507 VanDerWaalsContact O-CG 3.27Å; R503-L507 WeakPolarHBondContact O-CG 3.49Å; R503-L507 PolarHBondContact O-N 3.32Å; R503-E651 PolarHBondContact NH2-O 3.03Å; R503-A654 VanDerWaalsContact NH2-CB 3.3Å
504	L	90.4	Very high	80	Confident	1 Å²	1	59 Å²	59	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-46.1	174.7	172.9	62.3	0	0	0	111	I477 E500 M502 D506 L507 L508 I613 L617 L650 A654	I477-L504 HydrophobicContact CD1-CG 4.5Å; E500-L504 WeakPolarHBondContact O-CB 3.23Å; E500-L504 PolarHBondContact O-N 3.49Å; M502-L504 PolarHBondContact O-N 3.21Å; L504-D506 PolarHBondContact O-N 2.87Å; L504-L507 PolarHBondContact O-N 3.37Å; L504-L508 HydrophobicContact CD1-CD1 3.89Å; L504-L508 HydrophobicContact CD1-CG 4.26Å; L504-L508 HydrophobicContact CG-CD1 3.93Å; L504-L508 WeakPolarHBondContact O-CD1 3.27Å; L504-L508 WeakPolarHBondContact O-CG 3.31Å; L504-L508 PolarHBondContact O-N 2.98Å; L504-L508 VanDerWaalsContact O-N 3.09Å; L504-I613 HydrophobicContact CD2-CG2 3.95Å; L504-L617 HydrophobicContact CD2-CD2 4.39Å; L504-L650 HydrophobicContact CD2-CD2 4.06Å; L504-A654 HydrophobicContact CD1-CB 4.07Å
505	E	90.3	Very high	77.1	Confident	24 Å²	24	67.7 Å²	67.7	11%	0.112	36%	0.356	C	S	.	.	H	α-helix	trans	-58.7	-48.8	178.5	-155.3	-156.8	173.1	0	0	112	I477 H478 V501 M502 R503 L507 L508 K509 L602	I477-E505 HydrophobicContact CD1-CB 4.15Å; I477-E505 HydrophobicContact CD1-CG 4.04Å; I477-E505 HydrophobicContact CG2-CB 4.1Å; I477-E505 HydrophobicContact CG2-CG 3.86Å; H478-E505 IonicContact CE1-OE1 2.67Å; H478-E505 PolarHBondContact CE1-OE1 3.28Å; V501-E505 PolarHBondContact O-N 3.45Å; V501-E505 VanDerWaalsContact O-N 3.09Å; M502-E505 WeakPolarHBondContact O-CB 3.45Å; M502-E505 PolarHBondContact O-N 3.36Å; R503-E505 VanDerWaalsContact C-N 3.35Å; E505-L507 PolarHBondContact O-N 2.81Å; E505-L508 WeakPolarHBondContact O-CB 3.45Å; E505-L508 PolarHBondContact O-N 3.45Å; E505-L508 VanDerWaalsContact O-N 3.12Å; E505-K509 WeakPolarHBondContact O-CG 3.35Å; E505-K509 PolarHBondContact O-N 2.94Å; E505-K509 WeakPolarHBondContact OE1-CE 3.38Å; E505-K509 IonicContact OE1-NZ 2.59Å; E505-K509 PolarHBondContact OE1-NZ 3Å; E505-K509 WeakPolarHBondContact OE2-CE 3.48Å; E505-K509 IonicContact OE2-NZ 3.81Å; E505-K509 PolarHBondContact OE2-NZ 2.77Å; E505-L602 HydrophobicContact CG-CD1 3.56Å
506	D	86.3	Confident	74.8	Confident	87 Å²	87	75.6 Å²	75.6	47%	0.465	38%	0.382	S	S	.	.	H	α-helix	trans	-64.7	-38.2	178.9	-75.5	-10.8	0	0	0	112.5	M502 R503 L504 L508 K509 C510	M502-D506 PolarHBondContact O-N 2.9Å; M502-D506 VanDerWaalsContact O-N 3.08Å; R503-D506 PolarHBondContact O-N 3.29Å; L504-D506 PolarHBondContact O-N 2.87Å; D506-L508 PolarHBondContact O-N 3.41Å; D506-K509 PolarHBondContact O-N 3.27Å; D506-K509 IonicContact OD1-NZ 2.66Å; D506-K509 PolarHBondContact OD1-NZ 2.78Å; D506-C510 PolarHBondContact O-N 2.72Å; D506-C510 PolarHBondContact O-SG 3.41Å
507	L	84.6	Confident	72.1	Confident	52 Å²	52	78 Å²	78	27%	0.272	40%	0.403	S	S	.	.	H	α-helix	trans	-65.5	-22.6	174.4	-73	173.3	0	0	0	113.6	R503 L504 E505 R511 A654 V658	R503-L507 HydrophobicContact CG-CD1 4.15Å; R503-L507 WeakPolarHBondContact O-CB 3.47Å; R503-L507 VanDerWaalsContact O-CG 3.27Å; R503-L507 WeakPolarHBondContact O-CG 3.49Å; R503-L507 PolarHBondContact O-N 3.32Å; L504-L507 PolarHBondContact O-N 3.37Å; E505-L507 PolarHBondContact O-N 2.81Å; L507-R511 PolarHBondContact O-NE 3.36Å; L507-A654 HydrophobicContact CD1-CB 4.03Å; L507-V658 HydrophobicContact CD1-CG2 4.29Å; L507-V658 HydrophobicContact CD2-CG2 3.94Å
508	L	83.3	Confident	69.5	Low	6 Å²	6	89.2 Å²	89.2	3%	0.031	45%	0.445	C	S	.	.	H	α-helix	trans	-85.5	-42.1	173.5	-65.5	161	0	0	0	111.4	L473 I477 L504 E505 D506 C510 L602 T603 T604	L473-L508 HydrophobicContact CD1-CD1 4.46Å; L473-L508 HydrophobicContact CD2-CD1 3.59Å; L473-L508 HydrophobicContact CD2-CD2 3.89Å; L473-L508 HydrophobicContact CD2-CG 4.37Å; L473-L508 HydrophobicContact CG-CD1 4.01Å; I477-L508 HydrophobicContact CD1-CD1 3.88Å; L504-L508 HydrophobicContact CD1-CD1 3.89Å; L504-L508 HydrophobicContact CD1-CG 4.26Å; L504-L508 HydrophobicContact CG-CD1 3.93Å; L504-L508 WeakPolarHBondContact O-CD1 3.27Å; L504-L508 WeakPolarHBondContact O-CG 3.31Å; L504-L508 PolarHBondContact O-N 2.98Å; L504-L508 VanDerWaalsContact O-N 3.09Å; E505-L508 WeakPolarHBondContact O-CB 3.45Å; E505-L508 PolarHBondContact O-N 3.45Å; E505-L508 VanDerWaalsContact O-N 3.12Å; D506-L508 PolarHBondContact O-N 3.41Å; L508-C510 PolarHBondContact O-N 2.83Å; L508-L602 HydrophobicContact CB-CB 4.05Å; L508-L602 HydrophobicContact CB-CD2 4.17Å; L508-L602 HydrophobicContact CD1-CB 4.4Å; L508-T603 VanDerWaalsContact CD2-C 3.44Å; L508-T604 HydrophobicContact CD2-CG2 3.76Å
509	K	79.1	Confident	66.4	Low	104 Å²	104	93.9 Å²	93.9	45%	0.452	48%	0.482	S	S	.	.	H	α-helix	trans	-55.8	-34.8	175.9	-71.5	170.5	-165.6	152.2	0	112.7	E505 D506 R511 L602	E505-K509 WeakPolarHBondContact O-CG 3.35Å; E505-K509 PolarHBondContact O-N 2.94Å; E505-K509 WeakPolarHBondContact OE1-CE 3.38Å; E505-K509 IonicContact OE1-NZ 2.59Å; E505-K509 PolarHBondContact OE1-NZ 3Å; E505-K509 WeakPolarHBondContact OE2-CE 3.48Å; E505-K509 IonicContact OE2-NZ 3.81Å; E505-K509 PolarHBondContact OE2-NZ 2.77Å; D506-K509 PolarHBondContact O-N 3.27Å; D506-K509 IonicContact OD1-NZ 2.66Å; D506-K509 PolarHBondContact OD1-NZ 2.78Å; K509-R511 VanDerWaalsContact C-N 3.3Å; K509-R511 PolarHBondContact O-N 3.22Å; K509-L602 HydrophobicContact CB-CD2 4.39Å; K509-L602 HydrophobicContact CG-CD2 3.61Å
510	C	59.2	Low	63.6	Low	108 Å²	108	93.3 Å²	93.3	73%	0.73	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	14.9	-172.1	-69.4	0	0	0	0	116.7	D506 L508	D506-C510 PolarHBondContact O-N 2.72Å; D506-C510 PolarHBondContact O-SG 3.41Å; L508-C510 PolarHBondContact O-N 2.83Å
511	R	60.5	Low	60.8	Low	52 Å²	52	97.6 Å²	97.6	20%	0.196	52%	0.521	C	S	.	.			trans	-110.4	117.2	-168	-62.5	-175.9	-173	-142.7	-6.6	115.2	L507 K509 T604 S657	L507-R511 PolarHBondContact O-NE 3.36Å; K509-R511 VanDerWaalsContact C-N 3.3Å; K509-R511 PolarHBondContact O-N 3.22Å; R511-T604 PolarHBondContact NH1-O 3.49Å; R511-S657 PolarHBondContact NH1-O 2.92Å; R511-S657 PolarHBondContact NH2-O 2.82Å; R511-S657 PolarHBondContact NH2-OG 3.35Å
512	L	46.4	Very low	58.4	Low	147 Å²	147	105.2 Å²	105.2	77%	0.77	56%	0.561	S	S	*	*			trans	-119.1	123.1	157.3	-77.3	90.9	0	0	0	110.7	G514	L512-G514 PolarHBondContact O-N 2.98Å
513	P	41.2	Very low	55.6	Low	123 Å²	123	106.6 Å²	106.6	80%	0.799	58%	0.579	S	S	*	*			trans	-82.6	88.5	172	30.6	-29.8	0	0	0	111.2
514	G	37.5	Very low	53.1	Low	57 Å²	57	109.9 Å²	109.9	59%	0.588	60%	0.602	S	S	*	*	S	Bend	trans	176.2	134	171.7	0	0	0	0	0	114.3	L512	L512-G514 PolarHBondContact O-N 2.98Å
515	H	29.8	Very low	50.8	Low	191 Å²	191	114.7 Å²	114.7	88%	0.884	63%	0.632	S	S	*	*			trans	73.9	42.7	173.8	-62.1	-78.5	0	0	0	119.8	S517	H515-S517 PolarHBondContact O-N 3.39Å
516	R	40.9	Very low	48.5	Very low	255 Å²	255	118.6 Å²	118.6	96%	0.962	66%	0.657	S	S	*	*			trans	-72.3	74.5	151.2	-92.4	-165.1	177.2	-175.6	3	111.6
517	S	33.8	Very low	46.5	Very low	103 Å²	103	121.6 Å²	121.6	72%	0.72	67%	0.669	S	S	*	*			trans	-175	134.9	153.3	-94.3	0	0	0	0	114.5	H515	H515-S517 PolarHBondContact O-N 3.39Å
518	R	40.2	Very low	44.8	Very low	236 Å²	236	124.1 Å²	124.1	89%	0.891	69%	0.691	S	S	*	*			trans	67	80	165.3	-52.5	-178.5	77.3	159.5	6.1	117.7
519	S	27.1	Very low	42.7	Very low	129 Å²	129	126.8 Å²	126.8	90%	0.902	71%	0.713	S	S	*	*				-163.6	159	106.3	-105.9	0	0	0	0	112.9
520	S	34.1	Very low	40.7	Very low	103 Å²	103	128.1 Å²	128.1	72%	0.72	73%	0.725	S	S	*	*			trans	-93.6	149.9	179.1	52.9	0	0	0	0	112.1
521	S	36.1	Very low	39.8	Very low	102 Å²	102	131.4 Å²	131.4	71%	0.713	73%	0.729	S	S	*	*	S	Bend	trans	54	117.3	148.9	61.8	0	0	0	0	119.7
522	L	42.8	Very low	38.6	Very low	160 Å²	160	133 Å²	133	84%	0.838	75%	0.748	S	S	*	*			trans	57.4	100.6	141.8	-163.1	104.1	0	0	0	117.2
523	S	33.7	Very low	38.3	Very low	114 Å²	114	135.1 Å²	135.1	80%	0.797	75%	0.752	S	S	*	*			trans	-145.2	95.4	157.4	-73.5	0	0	0	0	109.9	T525	S523-T525 PolarHBondContact O-N 2.98Å
524	L	38.5	Very low	38.3	Very low	153 Å²	153	136.9 Å²	136.9	80%	0.801	76%	0.755	S	S	*	*			trans	-69.5	113.2	158.8	-71.1	164.1	0	0	0	106.9
525	T	42.4	Very low	38.3	Very low	103 Å²	103	143 Å²	143	63%	0.632	77%	0.765	S	S	*	*			trans	-71	143.2	169.5	40.7	0	0	0	0	109.7	S523 E527	S523-T525 PolarHBondContact O-N 2.98Å; T525-E527 PolarHBondContact O-N 2.8Å; T525-E527 VanDerWaalsContact O-N 3.14Å
526	V	41.1	Very low	38.5	Very low	105 Å²	105	140 Å²	140	64%	0.636	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-82.6	6	-157.5	178.5	0	0	0	0	113.4	A529	V526-A529 PolarHBondContact O-N 2.98Å
527	E	45	Very low	38.1	Very low	151 Å²	151	135.4 Å²	135.4	71%	0.706	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-71.9	-42.2	-176.1	-72.3	159.4	134.3	0	0	112.3	T525 A529 L530	T525-E527 PolarHBondContact O-N 2.8Å; T525-E527 VanDerWaalsContact O-N 3.14Å; E527-A529 PolarHBondContact O-N 2.8Å; E527-L530 PolarHBondContact O-N 3.05Å
528	S	47.5	Very low	38	Very low	105 Å²	105	136.4 Å²	136.4	73%	0.734	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-70.7	8	177.8	87	0	0	0	0	114.7
529	A	40.1	Very low	37.7	Very low	61 Å²	61	129.5 Å²	129.5	50%	0.504	74%	0.74	S	S	.	*	G	3₁₀ helix	trans	-113.2	-6.6	178.8	0	0	0	0	0	113.2	V526 E527	V526-A529 PolarHBondContact O-N 2.98Å; E527-A529 PolarHBondContact O-N 2.8Å
530	L	37.5	Very low	38.1	Very low	133 Å²	133	130.3 Å²	130.3	70%	0.696	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	-16.9	-176.9	-68.8	173.7	0	0	0	114.2	E527 S532	E527-L530 PolarHBondContact O-N 3.05Å; L530-S532 PolarHBondContact O-N 2.91Å
531	E	38.5	Very low	38	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.822	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-2.3	176.2	-60.3	-175.6	140.7	0	0	113.9	F533	E531-F533 PolarHBondContact O-N 3.31Å
532	S	36.5	Very low	38	Very low	86 Å²	86	137.4 Å²	137.4	60%	0.601	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	7.3	-176	59.5	0	0	0	0	115.2	L530	L530-S532 PolarHBondContact O-N 2.91Å
533	F	39.8	Very low	37.7	Very low	191 Å²	191	136.9 Å²	136.9	84%	0.838	75%	0.745	S	S	*	*			trans	-139.3	70.7	179.9	-81.2	-78.3	0	0	0	113.5	E531	E531-F533 PolarHBondContact O-N 3.31Å
534	D	40.4	Very low	37.8	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	75%	0.748	S	S	*	*			trans	-144	51.8	156.7	-150.6	4.4	0	0	0	112.3
535	F	38.8	Very low	37.6	Very low	184 Å²	184	138.1 Å²	138.1	81%	0.807	74%	0.743	S	S	*	*			trans	-100.1	117.4	176.6	-167	-115.3	0	0	0	110.7
536	L	33.3	Very low	37.3	Very low	129 Å²	129	139.2 Å²	139.2	68%	0.675	75%	0.75	S	S	*	*			trans	81.4	89.2	173.2	-51.2	175.8	0	0	0	118
537	N	31.8	Very low	36.8	Very low	158 Å²	158	137.8 Å²	137.8	85%	0.845	76%	0.756	S	S	*	*			trans	-166.9	133.5	134.1	-95.8	-34	0	0	0	108.9
538	T	33.4	Very low	36.2	Very low	124 Å²	124	138.2 Å²	138.2	76%	0.761	76%	0.763	S	S	*	*			cis	-137.8	158.6	-4.1	47.4	0	0	0	0	110
539	S	32.8	Very low	35.6	Very low	92 Å²	92	139.1 Å²	139.1	64%	0.643	76%	0.76	S	S	*	*			trans	-98.6	160.3	159.5	67.4	0	0	0	0	111.3
540	D	35	Very low	35.2	Very low	146 Å²	146	142.5 Å²	142.5	78%	0.781	77%	0.77	S	S	*	*			trans	76.1	148.6	160.1	-50	-53.7	0	0	0	119.3
541	F	32.6	Very low	34.8	Very low	197 Å²	197	142.1 Å²	142.1	86%	0.864	77%	0.773	S	S	*	*			trans	-101.5	163.6	-172.9	-75.4	-121	0	0	0	110.7
542	D	35.5	Very low	34.3	Very low	156 Å²	156	137 Å²	137	83%	0.834	77%	0.768	S	S	*	*				-166.9	170.4	116.5	-95.6	-14.4	0	0	0	111
543	D	37.3	Very low	34	Very low	150 Å²	150	140.3 Å²	140.3	80%	0.802	78%	0.777	S	S	*	*			trans	-50	162	-173.5	-66.7	-44.4	0	0	0	115.6
544	D	35.6	Very low	33.4	Very low	160 Å²	160	136.8 Å²	136.8	86%	0.856	78%	0.775	S	S	*	*				-167.3	180	54.2	-144.4	-17.3	0	0	0	116.5
545	D	34.7	Very low	32.7	Very low	132 Å²	132	134.8 Å²	134.8	71%	0.706	77%	0.773	S	S	*	*			trans	-68	173.3	-160.3	-168.7	22.4	0	0	0	121.2
546	T	34.9	Very low	32.2	Very low	127 Å²	127	133.3 Å²	133.3	78%	0.779	77%	0.773	S	S	*	*			trans	85.9	150.2	158.4	73.2	0	0	0	0	121.4
547	G	31.8	Very low	32.7	Very low	74 Å²	74	132.5 Å²	132.5	76%	0.763	78%	0.776	S	S	*	*			trans	-178.6	-40.5	162	0	0	0	0	0	125.4
548	D	32.7	Very low	32.6	Very low	160 Å²	160	133.1 Å²	133.1	86%	0.856	77%	0.774	S	S	*	*			trans	55.6	162.9	169.4	-138	-7.1	0	0	0	123.7
549	D	34.6	Very low	32.3	Very low	125 Å²	125	137 Å²	137	67%	0.668	78%	0.78	S	S	*	*			trans	58.5	97.8	149.5	-111.5	-7.6	0	0	0	125.5
550	N	31.7	Very low	32.2	Very low	131 Å²	131	137.5 Å²	137.5	70%	0.701	78%	0.783	S	S	*	*				75.1	155.9	102.6	-162.5	14.7	0	0	0	126.1
551	T	29.6	Very low	32.8	Very low	125 Å²	125	135.8 Å²	135.8	77%	0.767	78%	0.78	S	S	*	*			trans	77	133.1	158.3	28.9	0	0	0	0	125.7
552	G	27.2	Very low	33.5	Very low	70 Å²	70	131.3 Å²	131.3	72%	0.722	77%	0.771	S	S	*	*			trans	105.4	144.2	144.7	0	0	0	0	0	119.1
553	I	29.7	Very low	33.4	Very low	154 Å²	154	131.5 Å²	131.5	79%	0.79	77%	0.771	S	S	*	*			cis	172.1	122.1	-38.5	-94.3	167.7	0	0	0	107.3
554	C	27.4	Very low	33	Very low	118 Å²	118	132.4 Å²	132.4	80%	0.797	78%	0.776	S	S	*	*			trans	58.4	165.2	164.4	-59.2	0	0	0	0	119
555	S	26.4	Very low	33	Very low	118 Å²	118	129 Å²	129	83%	0.825	77%	0.771	S	S	*	*			cis	-152.2	165.1	15.1	-41.9	0	0	0	0	113.7
556	L	28.9	Very low	32.9	Very low	154 Å²	154	130.7 Å²	130.7	81%	0.806	78%	0.779	S	S	*	*			trans	-106.9	164.6	162.4	-145.2	83.3	0	0	0	109.4
557	P	42.5	Very low	33.8	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	78%	0.776	S	S	*	*				-159	151.3	78.3	39.9	-18	0	0	0	120.1
558	Q	30.2	Very low	33.9	Very low	171 Å²	171	132.9 Å²	132.9	80%	0.799	77%	0.77	S	S	*	*			trans	41.3	131.9	138.7	-60.1	-177.7	-15.8	0	0	124.3
559	K	26.7	Very low	33.8	Very low	204 Å²	204	135 Å²	135	89%	0.887	77%	0.766	S	S	*	*				-171.8	160.1	107.2	-114.4	179.9	176.8	178.9	0	116.8
560	S	30.7	Very low	33.6	Very low	103 Å²	103	136.9 Å²	136.9	72%	0.72	78%	0.775	S	S	*	*			trans	-153.7	-170.6	167.1	62.9	0	0	0	0	107.3
561	P	48.4	Very low	33.4	Very low	111 Å²	111	139.4 Å²	139.4	72%	0.721	78%	0.782	S	S	*	*			cis	-129.1	-134.5	-6.2	42	-20.6	0	0	0	109.8
562	P	47.5	Very low	33.2	Very low	102 Å²	102	139.5 Å²	139.5	66%	0.662	79%	0.788	S	S	*	*			cis	-133.9	168.4	-29.2	38.3	-20.4	0	0	0	117.3
563	L	33.5	Very low	33.3	Very low	161 Å²	161	145.4 Å²	145.4	84%	0.843	80%	0.797	S	S	*	*			trans	36.7	140.7	139	-60.9	169.9	0	0	0	124.9
564	D	28.9	Very low	33.4	Very low	168 Å²	168	147 Å²	147	90%	0.898	80%	0.801	S	S	*	*				-168	163	113.8	-105.2	-14.1	0	0	0	112.8
565	A	34.4	Very low	34.3	Very low	90 Å²	90	146.3 Å²	146.3	74%	0.744	79%	0.794	S	S	*	*			trans	-164.8	152.3	179.9	0	0	0	0	0	114
566	D	33.6	Very low	34.6	Very low	166 Å²	166	149.3 Å²	149.3	89%	0.888	80%	0.796	S	S	*	*			trans	-172.4	171.7	158.8	-110.4	-8.2	0	0	0	113.2
567	P	53.8	Low	34.6	Very low	110 Å²	110	145.7 Å²	145.7	71%	0.714	79%	0.788	S	S	*	*			trans	-141.2	-150.5	-146	42.7	-19.8	0	0	0	117
568	E	32.8	Very low	34.1	Very low	138 Å²	138	152.5 Å²	152.5	65%	0.645	80%	0.799	S	S	*	*			trans	105.8	116.7	160.2	-66.7	-114.3	101.6	0	0	121.9
569	R	30.4	Very low	34	Very low	204 Å²	204	147.9 Å²	147.9	77%	0.77	80%	0.797	S	S	*	*			trans	59.4	151.6	133.8	-65.9	-178.7	155.2	129.3	-9.6	120.8
570	I	31.6	Very low	34.6	Very low	165 Å²	165	147.5 Å²	147.5	85%	0.846	80%	0.798	S	S	*	*				-153.4	167.2	55.3	-78.7	172.6	0	0	0	112.6
571	E	26.6	Very low	34.6	Very low	184 Å²	184	151 Å²	151	86%	0.86	81%	0.808	S	S	*	*			trans	-86.1	164	-175.2	-54.3	161.6	107.3	0	0	116.9
572	S	27.1	Very low	33.9	Very low	126 Å²	126	151.9 Å²	151.9	88%	0.881	82%	0.817	S	S	*	*			trans	-165.1	177.7	146.3	49.5	0	0	0	0	112.3
573	Q	28.2	Very low	33.7	Very low	195 Å²	195	156 Å²	156	91%	0.911	83%	0.827	S	S	*	*			trans	-117.8	163.1	-156.4	-66.7	175.8	-19.3	0	0	116.8
574	H	32	Very low	33.9	Very low	187 Å²	187	152.5 Å²	152.5	87%	0.866	82%	0.821	S	S	*	*			trans	-58.8	176.1	171.3	-79	-76.5	0	0	0	115.4
575	P	47.1	Very low	34.1	Very low	103 Å²	103	153 Å²	153	67%	0.669	82%	0.823	S	S	*	*			cis	-137.6	-173.6	8.9	41.3	-22	0	0	0	117.7
576	E	31.2	Very low	34.1	Very low	182 Å²	182	155.4 Å²	155.4	85%	0.85	83%	0.829	S	S	*	*			trans	86.7	125.8	145.8	-90.8	175.2	-128	0	0	124.8
577	A	28.8	Very low	34.6	Very low	77 Å²	77	156.8 Å²	156.8	64%	0.636	83%	0.83	S	S	*	*			trans	83	118.1	139.3	0	0	0	0	0	123.5
578	R	32.4	Very low	34	Very low	255 Å²	255	158.8 Å²	158.8	96%	0.962	84%	0.835	S	S	*	*			trans	66.3	131.5	151.9	-66.5	-177.4	169.2	102.7	-2.7	119.7
579	G	28.5	Very low	34.1	Very low	75 Å²	75	158.8 Å²	158.8	77%	0.773	84%	0.844	S	S	*	*			trans	153.7	114.6	160.4	0	0	0	0	0	112.9	L581	G579-L581 PolarHBondContact O-N 2.84Å
580	H	38.1	Very low	34.8	Very low	195 Å²	195	152.8 Å²	152.8	90%	0.903	85%	0.846	S	S	*	*			trans	-73.1	117.2	174.4	-60.7	-113.6	0	0	0	110
581	L	32.6	Very low	34.9	Very low	178 Å²	178	150.7 Å²	150.7	93%	0.932	84%	0.841	S	S	*	*			trans	-152.6	110.7	158.2	-76.4	-175	0	0	0	109.1	G579	G579-L581 PolarHBondContact O-N 2.84Å
582	S	33.7	Very low	35.1	Very low	129 Å²	129	145.3 Å²	145.3	90%	0.902	84%	0.835	S	S	*	*			trans	-151	59.8	172.2	63.2	0	0	0	0	110.1
583	E	42.9	Very low	35.4	Very low	188 Å²	188	146.5 Å²	146.5	88%	0.879	83%	0.831	S	S	*	*			trans	-138.9	154.3	173.6	-171.3	170.6	-166.2	0	0	107.8
584	A	37.5	Very low	35.7	Very low	87 Å²	87	142.7 Å²	142.7	72%	0.719	83%	0.826	S	S	*	*			trans	62.3	82.9	-176.1	0	0	0	0	0	116.8
585	L	32.1	Very low	35.9	Very low	178 Å²	178	139.9 Å²	139.9	93%	0.932	82%	0.822	S	S	*	*			trans	-158	65.2	137.4	-87.1	-159.2	0	0	0	111
586	T	35	Very low	35.5	Very low	141 Å²	141	139.5 Å²	139.5	87%	0.865	83%	0.827	S	S	*	*			trans	-144	67.8	168.2	53.9	0	0	0	0	111.1
587	E	44	Very low	35.7	Very low	196 Å²	196	134.1 Å²	134.1	92%	0.916	82%	0.82	S	S	*	*			trans	-129	151.2	161.4	-74.4	-166.2	152.9	0	0	110
588	D	41.7	Very low	36.2	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	82%	0.824	S	S	*	*			trans	55.6	84.1	176.9	-158	10.3	0	0	0	118.4
589	T	35.1	Very low	37.1	Very low	138 Å²	138	128.5 Å²	128.5	85%	0.847	81%	0.813	S	S	*	*				-153.2	94.9	127	-7.1	0	0	0	0	109.6	V591	T589-V591 PolarHBondContact O-N 2.85Å
590	G	44.6	Very low	38.4	Very low	78 Å²	78	131.9 Å²	131.9	80%	0.804	81%	0.81	S	S	*	*			trans	-71.8	85.4	-173.6	0	0	0	0	0	114.7
591	V	34.1	Very low	40	Very low	122 Å²	122	126.8 Å²	126.8	74%	0.739	80%	0.795	S	S	*	*			trans	-133.8	84.4	164.4	-170.2	0	0	0	0	109.1	T589 N593	T589-V591 PolarHBondContact O-N 2.85Å; V591-N593 PolarHBondContact O-N 3.36Å; V591-N593 VanDerWaalsContact O-N 3.14Å
592	G	31.3	Very low	42.4	Very low	71 Å²	71	119.2 Å²	119.2	73%	0.732	76%	0.755	S	S	*	*			trans	-75.2	97.5	-178.1	0	0	0	0	0	112.6	S594	G592-S594 PolarHBondContact O-N 3.49Å
593	N	32.8	Very low	44.7	Very low	151 Å²	151	115.7 Å²	115.7	81%	0.807	73%	0.728	S	S	*	*			trans	-72.8	69.4	161	-88.4	13.8	0	0	0	109.8	V591 V595	V591-N593 PolarHBondContact O-N 3.36Å; V591-N593 VanDerWaalsContact O-N 3.14Å; N593-V595 VanDerWaalsContact C-N 3.27Å; N593-V595 PolarHBondContact O-N 3.33Å
594	S	33.6	Very low	46.5	Very low	114 Å²	114	107 Å²	107	80%	0.797	69%	0.687	S	S	*	*			trans	-71.7	85.6	169	-63.2	0	0	0	0	109.2	G592 A596	G592-S594 PolarHBondContact O-N 3.49Å; S594-A596 PolarHBondContact O-N 2.66Å
595	V	36.8	Very low	48.4	Very low	129 Å²	129	105.8 Å²	105.8	78%	0.782	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-58.6	119.4	159	178.2	0	0	0	0	106.2	N593 G597	N593-V595 VanDerWaalsContact C-N 3.27Å; N593-V595 PolarHBondContact O-N 3.33Å; V595-G597 PolarHBondContact O-N 2.67Å; V595-G597 VanDerWaalsContact O-N 3.15Å
596	A	38.8	Very low	50.7	Low	94 Å²	94	99.3 Å²	99.3	78%	0.777	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57.4	121.5	171.6	0	0	0	0	0	107.7	S594	S594-A596 PolarHBondContact O-N 2.66Å
597	G	35.9	Very low	53	Low	69 Å²	69	100.3 Å²	100.3	71%	0.711	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-63.4	146.6	-173.3	0	0	0	0	0	111.3	V595	V595-G597 PolarHBondContact O-N 2.67Å; V595-G597 VanDerWaalsContact O-N 3.15Å
598	S	38	Very low	54.8	Low	103 Å²	103	92.4 Å²	92.4	72%	0.72	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-51.2	145.7	151.2	50.5	0	0	0	0	108.9	M600	S598-M600 PolarHBondContact O-N 2.69Å
599	P	52	Low	57	Low	112 Å²	112	85.7 Å²	85.7	73%	0.727	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-50.6	133.5	169.9	23.3	-33.2	0	0	0	108.9
600	M	56.8	Low	59.4	Low	145 Å²	145	80.1 Å²	80.1	71%	0.714	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-73.1	134.2	176.7	-63.9	-168.3	72.3	0	0	107.8	S598	S598-M600 PolarHBondContact O-N 2.69Å
601	P	70.9	Confident	61.4	Low	89 Å²	89	78 Å²	78	58%	0.578	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-61.2	144.6	-175.8	26.2	-35.2	0	0	0	110.5	T603	P601-T603 PolarHBondContact O-N 3.3Å
602	L	82	Confident	64.1	Low	19 Å²	19	72.2 Å²	72.2	10%	0.099	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-58.7	125.9	-179.6	-56.9	-173.5	0	0	0	110.9	L473 E474 I477 E505 L508 K509	L473-L602 HydrophobicContact CB-CB 4.49Å; L473-L602 HydrophobicContact CD2-CB 4.37Å; L473-L602 HydrophobicContact CG-CB 4.32Å; E474-L602 HydrophobicContact CB-CD1 4.14Å; E474-L602 HydrophobicContact CB-CG 4.14Å; E474-L602 HydrophobicContact CG-CD1 4.24Å; E474-L602 HydrophobicContact CG-CG 4.32Å; I477-L602 HydrophobicContact CD1-CD1 4.05Å; E505-L602 HydrophobicContact CG-CD1 3.56Å; L508-L602 HydrophobicContact CB-CB 4.05Å; L508-L602 HydrophobicContact CB-CD2 4.17Å; L508-L602 HydrophobicContact CD1-CB 4.4Å; K509-L602 HydrophobicContact CB-CD2 4.39Å; K509-L602 HydrophobicContact CG-CD2 3.61Å
603	T	83.1	Confident	66.9	Low	55 Å²	55	68.8 Å²	68.8	34%	0.337	44%	0.44	S	S	.	.			trans	-151.8	144	177.6	174.9	0	0	0	0	111	L508 P601 G605 D610	L508-T603 VanDerWaalsContact CD2-C 3.44Å; P601-T603 PolarHBondContact O-N 3.3Å; T603-G605 PolarHBondContact O-N 3.45Å; T603-G605 PolarHBondContact OG1-N 2.92Å; T603-D610 WeakPolarHBondContact CB-OD2 3.42Å; T603-D610 PolarHBondContact OG1-OD2 3.46Å
604	T	81.3	Confident	69.6	Low	4 Å²	4	61.9 Å²	61.9	3%	0.025	40%	0.403	C	S	.	.			trans	-69.4	-19	167.7	59.3	0	0	0	0	112.4	L508 R511 N606 L609 D610 I613 L661	L508-T604 HydrophobicContact CD2-CG2 3.76Å; R511-T604 PolarHBondContact NH1-O 3.49Å; T604-N606 PolarHBondContact OG1-N 3.26Å; T604-N606 PolarHBondContact OG1-O 3.1Å; T604-L609 HydrophobicContact CG2-CD2 3.94Å; T604-L609 HydrophobicContact CG2-CG 4.14Å; T604-D610 VanDerWaalsContact CB-OD1 3.26Å; T604-D610 WeakPolarHBondContact CB-OD1 3.49Å; T604-D610 VanDerWaalsContact CG2-OD1 3.32Å; T604-D610 WeakPolarHBondContact CG2-OD1 3.36Å; T604-D610 PolarHBondContact N-OD1 3.42Å; T604-D610 PolarHBondContact OG1-OD1 3.37Å; T604-I613 HydrophobicContact CG2-CD1 3.51Å; T604-L661 WeakPolarHBondContact O-CD1 3.48Å
605	G	76.7	Confident	72.2	Confident	63 Å²	63	56.5 Å²	56.5	65%	0.649	37%	0.365	S	S	*	.	S	Bend	trans	93.7	7.2	-166.3	0	0	0	0	0	114.1	T603	T603-G605 PolarHBondContact O-N 3.45Å; T603-G605 PolarHBondContact OG1-N 2.92Å
606	N	80.2	Confident	74.9	Confident	42 Å²	42	50.4 Å²	50.4	23%	0.225	33%	0.328	C	S	.	.			trans	-140.8	110.3	174.9	-176.6	-17.6	0	0	0	110.7	T604 N608 L609 D610	T604-N606 PolarHBondContact OG1-N 3.26Å; T604-N606 PolarHBondContact OG1-O 3.1Å; N606-N608 PolarHBondContact O-N 3.14Å; N606-N608 VanDerWaalsContact O-N 3.13Å; N606-N608 WeakPolarHBondContact OD1-CB 3.44Å; N606-N608 PolarHBondContact OD1-N 2.98Å; N606-N608 VanDerWaalsContact OD1-N 3.1Å; N606-L609 HydrophobicContact CB-CB 4.08Å; N606-L609 WeakPolarHBondContact O-CA 3.47Å; N606-L609 WeakPolarHBondContact O-CB 3.42Å; N606-L609 PolarHBondContact O-N 3.41Å; N606-D610 PolarHBondContact O-N 3.12Å
607	E	82.4	Confident	77.4	Confident	161 Å²	161	46 Å²	46	75%	0.752	29%	0.291	S	S	*	.	H	α-helix	trans	-54.4	-34.5	-177.2	-60.9	174.8	175.1	0	0	113.4	L609 V611	E607-L609 VanDerWaalsContact C-N 3.32Å; E607-L609 PolarHBondContact O-N 3.22Å; E607-V611 WeakPolarHBondContact O-CG2 3.35Å; E607-V611 PolarHBondContact O-N 2.96Å; E607-V611 VanDerWaalsContact O-N 3.12Å
608	N	83.6	Confident	79.9	Confident	31 Å²	31	44.2 Å²	44.2	17%	0.166	27%	0.265	C	S	.	.	H	α-helix	trans	-69.4	-31.6	177.1	-80.1	-116.9	0	0	0	112.1	N606 A612 A691 L693 F694 H695	N606-N608 PolarHBondContact O-N 3.14Å; N606-N608 VanDerWaalsContact O-N 3.13Å; N606-N608 WeakPolarHBondContact OD1-CB 3.44Å; N606-N608 PolarHBondContact OD1-N 2.98Å; N606-N608 VanDerWaalsContact OD1-N 3.1Å; N608-A612 PolarHBondContact O-N 3.33Å; N608-A691 PolarHBondContact OD1-O 2.96Å; N608-L693 HydrophobicContact CB-CB 4.35Å; N608-L693 PolarHBondContact OD1-N 3.47Å; N608-F694 HydrophobicContact CB-CD2 3.81Å; N608-H695 PolarHBondContact O-CD2 3.47Å
609	L	85.9	Confident	82.4	Confident	9 Å²	9	40 Å²	40	5%	0.047	23%	0.233	C	C	.	.	H	α-helix	trans	-80.7	-38.8	179.9	-171.6	60.8	0	0	0	110.3	T604 N606 E607 V611 A612 I613 L653 F694	T604-L609 HydrophobicContact CG2-CD2 3.94Å; T604-L609 HydrophobicContact CG2-CG 4.14Å; N606-L609 HydrophobicContact CB-CB 4.08Å; N606-L609 WeakPolarHBondContact O-CA 3.47Å; N606-L609 WeakPolarHBondContact O-CB 3.42Å; N606-L609 PolarHBondContact O-N 3.41Å; E607-L609 VanDerWaalsContact C-N 3.32Å; E607-L609 PolarHBondContact O-N 3.22Å; L609-V611 PolarHBondContact O-N 3Å; L609-A612 PolarHBondContact O-N 3.26Å; L609-I613 HydrophobicContact CG-CD1 4.1Å; L609-I613 WeakPolarHBondContact O-CG1 3.38Å; L609-I613 PolarHBondContact O-N 3.15Å; L609-L653 HydrophobicContact CD1-CD2 3.75Å; L609-F694 HydrophobicContact CB-CD2 3.91Å; L609-F694 HydrophobicContact CB-CE2 3.8Å; L609-F694 HydrophobicContact CD1-CD2 4.04Å; L609-F694 HydrophobicContact CD1-CE1 4.47Å; L609-F694 HydrophobicContact CD1-CE2 3.96Å; L609-F694 HydrophobicContact CD1-CG 4.33Å; L609-F694 HydrophobicContact CD1-CZ 4.16Å; L609-F694 HydrophobicContact CG-CE2 4.36Å
610	D	87	Confident	84.3	Confident	21 Å²	21	34.7 Å²	34.7	11%	0.112	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-46.5	174.2	-63.2	-18.1	0	0	0	111.1	L473 T603 T604 N606 A612 I613 V614	L473-D610 HydrophobicContact CD2-CB 4.5Å; T603-D610 WeakPolarHBondContact CB-OD2 3.42Å; T603-D610 PolarHBondContact OG1-OD2 3.46Å; T604-D610 VanDerWaalsContact CB-OD1 3.26Å; T604-D610 WeakPolarHBondContact CB-OD1 3.49Å; T604-D610 VanDerWaalsContact CG2-OD1 3.32Å; T604-D610 WeakPolarHBondContact CG2-OD1 3.36Å; T604-D610 PolarHBondContact N-OD1 3.42Å; T604-D610 PolarHBondContact OG1-OD1 3.37Å; N606-D610 PolarHBondContact O-N 3.12Å; D610-A612 PolarHBondContact O-N 2.93Å; D610-I613 PolarHBondContact O-N 3.41Å; D610-V614 WeakPolarHBondContact O-CG2 3.38Å; D610-V614 PolarHBondContact O-N 3.31Å
611	V	86.8	Confident	85.9	Confident	34 Å²	34	28.6 Å²	28.6	21%	0.206	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-40.7	174.8	170.6	0	0	0	0	112	E607 L609 V614 I615	E607-V611 WeakPolarHBondContact O-CG2 3.35Å; E607-V611 PolarHBondContact O-N 2.96Å; E607-V611 VanDerWaalsContact O-N 3.12Å; L609-V611 PolarHBondContact O-N 3Å; V611-V614 PolarHBondContact O-N 3.28Å; V611-I615 HydrophobicContact CG1-CD1 4.03Å; V611-I615 WeakPolarHBondContact O-CD1 3.24Å; V611-I615 WeakPolarHBondContact O-CG1 3.41Å; V611-I615 PolarHBondContact O-N 2.94Å; V611-I615 VanDerWaalsContact O-N 3.09Å
612	A	89.1	Confident	86.7	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.3	-45.6	176.8	0	0	0	0	0	111.7	N608 L609 D610 V614 I615 H616 F694 T755 F757	N608-A612 PolarHBondContact O-N 3.33Å; L609-A612 PolarHBondContact O-N 3.26Å; D610-A612 PolarHBondContact O-N 2.93Å; A612-V614 PolarHBondContact O-N 3.39Å; A612-I615 PolarHBondContact O-N 2.73Å; A612-H616 PolarHBondContact O-CD2 2.87Å; A612-H616 PolarHBondContact O-N 3.02Å; A612-H616 VanDerWaalsContact O-N 3.16Å; A612-F694 HydrophobicContact CB-CB 3.96Å; A612-T755 HydrophobicContact CB-CG2 4.35Å; A612-F757 HydrophobicContact CB-CE2 4.22Å
613	I	90.5	Very high	87	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-43.3	176.9	-66.8	163.4	0	0	0	110.8	L473 L504 T604 L609 D610 I615 H616 L617 L650 L653	L473-I613 HydrophobicContact CD1-CB 4.22Å; L473-I613 HydrophobicContact CD1-CG2 3.57Å; L504-I613 HydrophobicContact CD2-CG2 3.95Å; T604-I613 HydrophobicContact CG2-CD1 3.51Å; L609-I613 HydrophobicContact CG-CD1 4.1Å; L609-I613 WeakPolarHBondContact O-CG1 3.38Å; L609-I613 PolarHBondContact O-N 3.15Å; D610-I613 PolarHBondContact O-N 3.41Å; I613-I615 VanDerWaalsContact C-N 3.33Å; I613-I615 PolarHBondContact O-N 2.59Å; I613-H616 PolarHBondContact O-N 2.86Å; I613-H616 VanDerWaalsContact O-N 3.16Å; I613-L617 HydrophobicContact CG2-CD1 3.79Å; I613-L617 HydrophobicContact CG2-CG 4.17Å; I613-L617 WeakPolarHBondContact O-CG 3.32Å; I613-L617 PolarHBondContact O-N 2.85Å; I613-L650 HydrophobicContact CG2-CD2 4.26Å; I613-L653 HydrophobicContact CG1-CB 4.35Å; I613-L653 HydrophobicContact CG1-CD1 4.1Å
614	V	90.5	Very high	87.2	Confident	6 Å²	6	22.1 Å²	22.1	4%	0.036	13%	0.126	C	C	.	.	H	α-helix	trans	-57.3	-43.1	175.5	166.7	0	0	0	0	112	L473 A476 D610 V611 A612 H616 L617 Q618	L473-V614 HydrophobicContact CB-CG2 4.15Å; L473-V614 HydrophobicContact CD1-CG2 4.03Å; A476-V614 HydrophobicContact CB-CG1 4.34Å; A476-V614 HydrophobicContact CB-CG2 4.2Å; D610-V614 WeakPolarHBondContact O-CG2 3.38Å; D610-V614 PolarHBondContact O-N 3.31Å; V611-V614 PolarHBondContact O-N 3.28Å; A612-V614 PolarHBondContact O-N 3.39Å; V614-H616 PolarHBondContact O-N 3.18Å; V614-L617 PolarHBondContact O-N 2.98Å; V614-Q618 WeakPolarHBondContact O-CB 3.47Å; V614-Q618 WeakPolarHBondContact O-CG 3.44Å; V614-Q618 PolarHBondContact O-N 3.04Å
615	I	88.6	Confident	87.5	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-61.2	-44.1	176.9	-68	160.9	0	0	0	110.9	F468 V611 A612 I613 Q618 Y619 V753 T755	F468-I615 HydrophobicContact CD1-CG1 4.23Å; V611-I615 HydrophobicContact CG1-CD1 4.03Å; V611-I615 WeakPolarHBondContact O-CD1 3.24Å; V611-I615 WeakPolarHBondContact O-CG1 3.41Å; V611-I615 PolarHBondContact O-N 2.94Å; V611-I615 VanDerWaalsContact O-N 3.09Å; A612-I615 PolarHBondContact O-N 2.73Å; I613-I615 VanDerWaalsContact C-N 3.33Å; I613-I615 PolarHBondContact O-N 2.59Å; I615-Q618 PolarHBondContact O-N 2.85Å; I615-Y619 WeakPolarHBondContact O-CB 3.38Å; I615-Y619 PolarHBondContact O-N 2.84Å; I615-V753 HydrophobicContact CD1-CB 3.89Å; I615-V753 HydrophobicContact CD1-CG1 3.56Å; I615-T755 HydrophobicContact CB-CG2 4.13Å; I615-T755 HydrophobicContact CD1-CG2 3.97Å; I615-T755 HydrophobicContact CG2-CG2 3.92Å
616	H	92.2	Very high	87.8	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-68	-41.7	179.3	-74.3	-67.6	0	0	0	112.9	A612 I613 V614 Q618 Y619 C620 Q646 L649 L650 T755 F757	A612-H616 PolarHBondContact O-CD2 2.87Å; A612-H616 PolarHBondContact O-N 3.02Å; A612-H616 VanDerWaalsContact O-N 3.16Å; I613-H616 PolarHBondContact O-N 2.86Å; I613-H616 VanDerWaalsContact O-N 3.16Å; V614-H616 PolarHBondContact O-N 3.18Å; H616-Q618 PolarHBondContact O-N 3.45Å; H616-Y619 PolarHBondContact O-N 2.93Å; H616-C620 PolarHBondContact O-N 3.27Å; H616-C620 PolarHBondContact O-SG 2.85Å; H616-Q646 PolarHBondContact ND1-OE1 3.06Å; H616-L649 WeakPolarHBondContact CE1-CD2 3.44Å; H616-L649 WeakPolarHBondContact ND1-CD2 3.28Å; H616-L650 HydrophobicContact CB-CD2 4.33Å; H616-T755 PolarHBondContact CE1-OG1 2.85Å; H616-T755 PolarHBondContact NE2-OG1 3.41Å; H616-F757 AromaticContact NE2-CD2 3.99Å
617	L	92.8	Very high	87.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-42.8	173.2	-68.4	168.4	0	0	0	112	L473 A476 I477 L480 V501 L504 I613 V614 Y619 C620 I621 L650	L473-L617 HydrophobicContact CD1-CD1 3.79Å; A476-L617 HydrophobicContact CB-CB 4.15Å; A476-L617 HydrophobicContact CB-CD1 3.91Å; I477-L617 HydrophobicContact CG1-CD1 3.64Å; I477-L617 HydrophobicContact CG1-CD2 4.45Å; L480-L617 HydrophobicContact CD2-CB 4.47Å; L480-L617 HydrophobicContact CD2-CD2 3.67Å; V501-L617 HydrophobicContact CG1-CD2 4.43Å; V501-L617 HydrophobicContact CG2-CD2 4.09Å; L504-L617 HydrophobicContact CD2-CD2 4.39Å; I613-L617 HydrophobicContact CG2-CD1 3.79Å; I613-L617 HydrophobicContact CG2-CG 4.17Å; I613-L617 WeakPolarHBondContact O-CG 3.32Å; I613-L617 PolarHBondContact O-N 2.85Å; V614-L617 PolarHBondContact O-N 2.98Å; L617-Y619 VanDerWaalsContact C-N 3.34Å; L617-C620 WeakPolarHBondContact O-CB 3.34Å; L617-C620 PolarHBondContact O-N 3.37Å; L617-I621 WeakPolarHBondContact O-CG1 3.27Å; L617-I621 PolarHBondContact O-N 2.85Å; L617-L650 HydrophobicContact CD2-CD1 3.98Å; L617-L650 HydrophobicContact CD2-CD2 4.17Å; L617-L650 HydrophobicContact CG-CD2 4.34Å
618	Q	88.2	Confident	87.8	Confident	32 Å²	32	22 Å²	22	15%	0.15	12%	0.115	C	C	.	.	H	α-helix	trans	-69.6	-29.9	176.7	-72.3	-169.2	34.5	0	0	113.2	F468 S471 V614 I615 H616 I621 H622	F468-Q618 HydrophobicContact CD1-CB 4.37Å; F468-Q618 HydrophobicContact CE1-CB 3.87Å; F468-Q618 HydrophobicContact CE1-CG 4.49Å; F468-Q618 VanDerWaalsContact CE1-OE1 3.25Å; S471-Q618 PolarHBondContact OG-NE2 2.87Å; V614-Q618 WeakPolarHBondContact O-CB 3.47Å; V614-Q618 WeakPolarHBondContact O-CG 3.44Å; V614-Q618 PolarHBondContact O-N 3.04Å; I615-Q618 PolarHBondContact O-N 2.85Å; H616-Q618 PolarHBondContact O-N 3.45Å; Q618-I621 WeakPolarHBondContact O-CB 3.12Å; Q618-I621 PolarHBondContact O-N 3.25Å; Q618-H622 PolarHBondContact O-N 3.32Å
619	Y	90.3	Very high	87.4	Confident	15 Å²	15	24.7 Å²	24.7	6%	0.059	14%	0.136	C	C	.	.	H	α-helix	trans	-71.4	-38.1	172.3	172.4	-105.7	0	0	0	111.7	W460 I615 H616 L617 I621 H622 L623 Q646 D734	W460-Y619 HydrophobicContact CD2-CD2 4.15Å; W460-Y619 AromaticContact CE2-CD2 3.77Å; W460-Y619 HydrophobicContact CH2-CD2 4.25Å; W460-Y619 AromaticContact CZ2-CD2 3.82Å; W460-Y619 HydrophobicContact CZ2-CD2 3.82Å; W460-Y619 HydrophobicContact CZ2-CE2 4.26Å; I615-Y619 WeakPolarHBondContact O-CB 3.38Å; I615-Y619 PolarHBondContact O-N 2.84Å; H616-Y619 PolarHBondContact O-N 2.93Å; L617-Y619 VanDerWaalsContact C-N 3.34Å; Y619-I621 VanDerWaalsContact C-N 3.31Å; Y619-I621 PolarHBondContact O-N 2.86Å; Y619-H622 WeakPolarHBondContact O-CB 3.24Å; Y619-H622 PolarHBondContact O-N 3Å; Y619-H622 VanDerWaalsContact O-N 3.12Å; Y619-L623 HydrophobicContact CD1-CD1 4.11Å; Y619-L623 HydrophobicContact CE1-CD1 3.6Å; Y619-L623 HydrophobicContact CE1-CG 4.24Å; Y619-L623 HydrophobicContact CE2-CD1 4.5Å; Y619-L623 HydrophobicContact CE2-CD2 4.21Å; Y619-L623 HydrophobicContact CE2-CG 4.27Å; Y619-L623 WeakPolarHBondContact O-CG 3.38Å; Y619-L623 PolarHBondContact O-N 2.66Å; Y619-Q646 HydrophobicContact CD1-CG 3.64Å; Y619-Q646 VanDerWaalsContact CD1-OE1 3.28Å; Y619-Q646 HydrophobicContact CE1-CG 3.59Å; Y619-D734 HydrophobicContact CE2-CB 4.44Å; Y619-D734 PolarHBondContact OH-OD2 2.98Å
620	C	92.3	Very high	86.1	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-57	-43.2	166.9	-70.2	0	0	0	0	112.4	L480 L497 H616 L617 H622 L623 I624 L643 Q646	L480-C620 HydrophobicContact CD1-CB 4.02Å; L480-C620 HydrophobicContact CD2-CB 3.86Å; L497-C620 HydrophobicContact CD2-CB 4.17Å; H616-C620 PolarHBondContact O-N 3.27Å; H616-C620 PolarHBondContact O-SG 2.85Å; L617-C620 WeakPolarHBondContact O-CB 3.34Å; L617-C620 PolarHBondContact O-N 3.37Å; C620-H622 VanDerWaalsContact C-N 3.29Å; C620-H622 PolarHBondContact O-N 3.49Å; C620-L623 PolarHBondContact O-N 2.67Å; C620-I624 WeakPolarHBondContact O-CG1 3.26Å; C620-I624 PolarHBondContact O-N 3.25Å; C620-L643 HydrophobicContact CB-CD2 4.35Å; C620-Q646 WeakPolarHBondContact SG-CB 3.39Å
621	I	90	Very high	85	Confident	17 Å²	17	27.6 Å²	27.6	9%	0.087	17%	0.167	C	C	.	.	H	α-helix	trans	-56.4	-41.8	174	-77.3	175.9	0	0	0	111.8	L480 K483 L617 Q618 Y619 Q625	L480-I621 HydrophobicContact CB-CD1 4.07Å; L480-I621 HydrophobicContact CB-CG1 3.85Å; L480-I621 HydrophobicContact CD1-CG1 3.86Å; L480-I621 HydrophobicContact CG-CG1 4.38Å; K483-I621 HydrophobicContact CD-CB 4.11Å; K483-I621 HydrophobicContact CD-CD1 4.21Å; K483-I621 HydrophobicContact CD-CG1 3.75Å; K483-I621 HydrophobicContact CD-CG2 3.65Å; K483-I621 VanDerWaalsContact CE-CG2 3.41Å; L617-I621 WeakPolarHBondContact O-CG1 3.27Å; L617-I621 PolarHBondContact O-N 2.85Å; Q618-I621 WeakPolarHBondContact O-CB 3.12Å; Q618-I621 PolarHBondContact O-N 3.25Å; Y619-I621 VanDerWaalsContact C-N 3.31Å; Y619-I621 PolarHBondContact O-N 2.86Å; I621-Q625 WeakPolarHBondContact O-CG 3.35Å; I621-Q625 PolarHBondContact O-N 3.25Å; I621-Q625 VanDerWaalsContact O-N 3.12Å
622	H	86.6	Confident	83.7	Confident	24 Å²	24	28 Å²	28	11%	0.111	18%	0.178	C	C	.	.	H	α-helix	trans	-68.4	-44.2	176.9	170.1	64	0	0	0	112.5	L458 W460 Q618 Y619 C620 I624 Q625 M626	L458-H622 PolarHBondContact O-CE1 3.35Å; W460-H622 HydrophobicContact CB-CB 4.17Å; W460-H622 AromaticContact CD1-CD2 3.64Å; W460-H622 AromaticContact CD1-NE2 3.63Å; W460-H622 AromaticContact CG-CD2 3.71Å; W460-H622 AromaticContact CG-NE2 3.97Å; Q618-H622 PolarHBondContact O-N 3.32Å; Y619-H622 WeakPolarHBondContact O-CB 3.24Å; Y619-H622 PolarHBondContact O-N 3Å; Y619-H622 VanDerWaalsContact O-N 3.12Å; C620-H622 VanDerWaalsContact C-N 3.29Å; C620-H622 PolarHBondContact O-N 3.49Å; H622-I624 VanDerWaalsContact C-N 3.28Å; H622-I624 PolarHBondContact O-N 2.94Å; H622-Q625 CarbonylContact O-C 3.48Å; H622-Q625 WeakPolarHBondContact O-CA 3.49Å; H622-Q625 WeakPolarHBondContact O-CB 3.12Å; H622-Q625 PolarHBondContact O-N 2.87Å; H622-M626 PolarHBondContact O-N 3.33Å
623	L	88.5	Confident	82.4	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.4	-40.1	176.3	-68	173.9	0	0	0	111.5	Y619 C620 M626 L627 V639 K642 L643 Q646	Y619-L623 HydrophobicContact CD1-CD1 4.11Å; Y619-L623 HydrophobicContact CE1-CD1 3.6Å; Y619-L623 HydrophobicContact CE1-CG 4.24Å; Y619-L623 HydrophobicContact CE2-CD1 4.5Å; Y619-L623 HydrophobicContact CE2-CD2 4.21Å; Y619-L623 HydrophobicContact CE2-CG 4.27Å; Y619-L623 WeakPolarHBondContact O-CG 3.38Å; Y619-L623 PolarHBondContact O-N 2.66Å; C620-L623 PolarHBondContact O-N 2.67Å; L623-M626 HydrophobicContact CD2-CE 3.83Å; L623-M626 WeakPolarHBondContact O-CB 3.41Å; L623-M626 PolarHBondContact O-N 3.37Å; L623-L627 PolarHBondContact O-N 3.04Å; L623-V639 HydrophobicContact CB-CG1 3.9Å; L623-V639 HydrophobicContact CD2-CG1 3.99Å; L623-V639 WeakPolarHBondContact O-CG1 3.48Å; L623-K642 HydrophobicContact CD1-CB 3.88Å; L623-K642 HydrophobicContact CD2-CB 4.08Å; L623-K642 HydrophobicContact CD2-CD 4.33Å; L623-L643 HydrophobicContact CB-CD1 4.29Å; L623-L643 HydrophobicContact CB-CD2 3.68Å; L623-L643 HydrophobicContact CB-CG 3.79Å; L623-L643 HydrophobicContact CD1-CD2 3.91Å; L623-L643 HydrophobicContact CD1-CG 3.89Å; L623-L643 HydrophobicContact CG-CD2 4.47Å; L623-L643 HydrophobicContact CG-CG 4.49Å; L623-Q646 HydrophobicContact CD1-CG 4.34Å
624	I	88.4	Confident	80.9	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-37.3	174.1	-67.8	163.2	0	0	0	112.2	L480 L484 L487 L494 L497 C620 H622 M626 L627 T628 L643	L480-I624 HydrophobicContact CD1-CD1 3.46Å; L480-I624 VanDerWaalsContact CD1-CD1 3.46Å; L484-I624 HydrophobicContact CD2-CD1 3.67Å; L484-I624 HydrophobicContact CG-CD1 3.97Å; L487-I624 HydrophobicContact CD1-CG2 4.01Å; L487-I624 HydrophobicContact CD2-CG2 4.22Å; L494-I624 HydrophobicContact CD2-CD1 4.39Å; L494-I624 HydrophobicContact CD2-CG1 4Å; L497-I624 HydrophobicContact CD2-CD1 4.35Å; C620-I624 WeakPolarHBondContact O-CG1 3.26Å; C620-I624 PolarHBondContact O-N 3.25Å; H622-I624 VanDerWaalsContact C-N 3.28Å; H622-I624 PolarHBondContact O-N 2.94Å; I624-M626 VanDerWaalsContact C-N 3.31Å; I624-L627 PolarHBondContact O-N 3.21Å; I624-T628 PolarHBondContact O-N 2.92Å; I624-T628 VanDerWaalsContact O-N 3.13Å; I624-T628 PolarHBondContact O-OG1 2.88Å; I624-L643 HydrophobicContact CG1-CD1 4.49Å; I624-L643 HydrophobicContact CG1-CD2 4.19Å
625	Q	86.8	Confident	79.9	Confident	99 Å²	99	39.7 Å²	39.7	46%	0.463	23%	0.232	S	C	.	.	H	α-helix	trans	-64.6	-35.9	172.3	-74.9	173.8	-58.9	0	0	112.1	I621 H622 T628 S629	I621-Q625 WeakPolarHBondContact O-CG 3.35Å; I621-Q625 PolarHBondContact O-N 3.25Å; I621-Q625 VanDerWaalsContact O-N 3.12Å; H622-Q625 CarbonylContact O-C 3.48Å; H622-Q625 WeakPolarHBondContact O-CA 3.49Å; H622-Q625 WeakPolarHBondContact O-CB 3.12Å; H622-Q625 PolarHBondContact O-N 2.87Å; Q625-T628 WeakPolarHBondContact CA-OG1 3.16Å; Q625-T628 PolarHBondContact O-OG1 2.9Å; Q625-S629 PolarHBondContact O-N 2.96Å
626	M	83.5	Confident	79.3	Confident	51 Å²	51	40.8 Å²	40.8	25%	0.251	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-52.7	171.8	-70.9	-150.2	-72.2	0	0	110.9	H622 L623 I624 T628 S629 M631 V639	H622-M626 PolarHBondContact O-N 3.33Å; L623-M626 HydrophobicContact CD2-CE 3.83Å; L623-M626 WeakPolarHBondContact O-CB 3.41Å; L623-M626 PolarHBondContact O-N 3.37Å; I624-M626 VanDerWaalsContact C-N 3.31Å; M626-T628 PolarHBondContact O-N 3.25Å; M626-T628 VanDerWaalsContact O-N 3.1Å; M626-S629 WeakPolarHBondContact O-CB 3.45Å; M626-S629 PolarHBondContact O-N 2.69Å; M626-S629 PolarHBondContact O-OG 3.38Å; M626-M631 HydrophobicContact CB-CE 4.07Å; M626-M631 HydrophobicContact CB-SD 3.68Å; M626-M631 VanDerWaalsContact O-CG 3.28Å; M626-M631 WeakPolarHBondContact O-CG 3.49Å; M626-M631 HydrophobicContact SD-CE 4.23Å; M626-V639 HydrophobicContact CB-CG2 4.48Å; M626-V639 HydrophobicContact CE-CG2 3.92Å
627	L	82.9	Confident	78.6	Confident	29 Å²	29	46 Å²	46	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-51.5	-39.3	178.5	-70.9	-178.6	0	0	0	113.5	L494 L623 I624 R636 V639 L640 L643	L494-L627 HydrophobicContact CD1-CD1 4.48Å; L494-L627 HydrophobicContact CD2-CD1 4.25Å; L623-L627 PolarHBondContact O-N 3.04Å; I624-L627 PolarHBondContact O-N 3.21Å; L627-R636 HydrophobicContact CD2-CB 4.4Å; L627-R636 HydrophobicContact CD2-CG 4.04Å; L627-V639 HydrophobicContact CD1-CG1 4.4Å; L627-V639 HydrophobicContact CD2-CB 3.85Å; L627-V639 HydrophobicContact CD2-CG1 3.6Å; L627-V639 HydrophobicContact CG-CB 4.43Å; L627-V639 HydrophobicContact CG-CG1 3.63Å; L627-L640 HydrophobicContact CD1-CD2 3.86Å; L627-L640 HydrophobicContact CD2-CD2 4.35Å; L627-L640 HydrophobicContact CD2-CG 4.29Å; L627-L643 HydrophobicContact CD1-CD1 3.54Å; L627-L643 HydrophobicContact CG-CD1 4.38Å
628	T	79.3	Confident	78.1	Confident	89 Å²	89	47.5 Å²	47.5	55%	0.546	27%	0.272	S	S	.	.	H	α-helix	trans	-80.2	-12.2	-179.1	47.1	0	0	0	0	114.4	L487 I624 Q625 M626 G630	L487-T628 HydrophobicContact CD2-CG2 3.43Å; L487-T628 VanDerWaalsContact CD2-CG2 3.43Å; I624-T628 PolarHBondContact O-N 2.92Å; I624-T628 VanDerWaalsContact O-N 3.13Å; I624-T628 PolarHBondContact O-OG1 2.88Å; Q625-T628 WeakPolarHBondContact CA-OG1 3.16Å; Q625-T628 PolarHBondContact O-OG1 2.9Å; M626-T628 PolarHBondContact O-N 3.25Å; M626-T628 VanDerWaalsContact O-N 3.1Å; T628-G630 VanDerWaalsContact C-N 3.31Å; T628-G630 PolarHBondContact O-N 2.81Å
629	S	74.5	Confident	77.9	Confident	87 Å²	87	46.3 Å²	46.3	61%	0.608	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-9	-176.8	71.2	0	0	0	0	115.5	Q625 M626	Q625-S629 PolarHBondContact O-N 2.96Å; M626-S629 WeakPolarHBondContact O-CB 3.45Å; M626-S629 PolarHBondContact O-N 2.69Å; M626-S629 PolarHBondContact O-OG 3.38Å
630	G	58.4	Low	77.8	Confident	67 Å²	67	46.6 Å²	46.6	69%	0.691	27%	0.269	S	S	*	.			trans	92.5	43.4	178.5	0	0	0	0	0	114.5	T628	T628-G630 VanDerWaalsContact C-N 3.31Å; T628-G630 PolarHBondContact O-N 2.81Å
631	M	64.4	Low	77.6	Confident	24 Å²	24	52.1 Å²	52.1	12%	0.118	30%	0.298	C	S	.	.			trans	-73	162.2	-179.5	-50.9	172.1	87.4	0	0	113.4	M626 Q635 V639	M626-M631 HydrophobicContact CB-CE 4.07Å; M626-M631 HydrophobicContact CB-SD 3.68Å; M626-M631 VanDerWaalsContact O-CG 3.28Å; M626-M631 WeakPolarHBondContact O-CG 3.49Å; M626-M631 HydrophobicContact SD-CE 4.23Å; M631-Q635 HydrophobicContact CB-CB 4.24Å; M631-Q635 HydrophobicContact CE-CB 4.05Å; M631-Q635 HydrophobicContact CE-CG 3.59Å; M631-V639 HydrophobicContact CE-CG2 3.86Å; M631-V639 HydrophobicContact SD-CG2 4.19Å
632	G	59.2	Low	77.5	Confident	43 Å²	43	55 Å²	55	44%	0.443	31%	0.31	S	S	.	.			trans	-70.4	157.6	170.5	0	0	0	0	0	113.4	W634 Q635 R636	G632-W634 PolarHBondContact O-N 3.04Å; G632-Q635 WeakPolarHBondContact O-CB 3.46Å; G632-Q635 PolarHBondContact O-N 2.96Å; G632-Q635 VanDerWaalsContact O-N 3.09Å; G632-R636 PolarHBondContact O-N 3.43Å
633	V	62	Low	77.8	Confident	53 Å²	53	53.9 Å²	53.9	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-54.1	-46.3	-171.2	-177.7	0	0	0	0	113.2	R636 R637	V633-R636 WeakPolarHBondContact O-CB 3.18Å; V633-R636 PolarHBondContact O-N 3.43Å; V633-R637 PolarHBondContact O-N 2.88Å
634	W	60.2	Low	78	Confident	86 Å²	86	56.8 Å²	56.8	33%	0.326	33%	0.325	S	S	.	.	H	α-helix	trans	-71.3	-34.6	-179.7	-65	86.3	0	0	0	112.9	G632 R636 R637 G638 T855 Q856	G632-W634 PolarHBondContact O-N 3.04Å; W634-R636 VanDerWaalsContact C-N 3.33Å; W634-R637 PolarHBondContact O-N 2.9Å; W634-G638 PolarHBondContact O-N 3.39Å; W634-T855 HydrophobicContact CH2-CG2 3.7Å; W634-T855 HydrophobicContact CZ2-CG2 4.01Å; W634-T855 HydrophobicContact CZ3-CG2 4.22Å; W634-Q856 HydrophobicContact CB-CG 4Å
635	Q	68.1	Low	78.1	Confident	111 Å²	111	58.2 Å²	58.2	52%	0.519	34%	0.34	S	S	.	.	H	α-helix	trans	-67.1	-37.3	174.5	-139.1	-168.9	-3.5	0	0	111	M631 G632 G638 V639	M631-Q635 HydrophobicContact CB-CB 4.24Å; M631-Q635 HydrophobicContact CE-CB 4.05Å; M631-Q635 HydrophobicContact CE-CG 3.59Å; G632-Q635 WeakPolarHBondContact O-CB 3.46Å; G632-Q635 PolarHBondContact O-N 2.96Å; G632-Q635 VanDerWaalsContact O-N 3.09Å; Q635-G638 PolarHBondContact O-N 2.58Å; Q635-V639 WeakPolarHBondContact O-CG2 3.41Å; Q635-V639 PolarHBondContact O-N 3.37Å; Q635-V639 VanDerWaalsContact O-N 3.12Å
636	R	77.1	Confident	78.5	Confident	24 Å²	24	54.5 Å²	54.5	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-59.6	-49.4	169.2	166.5	-171.5	-64.8	149.7	-6.1	111.3	W376 E380 L627 G632 V633 W634 G638 V639 L640	W376-R636 VanDerWaalsContact CD1-NH1 3.26Å; E380-R636 IonicContact OE1-CZ 2.76Å; E380-R636 IonicContact OE1-NH1 3.58Å; E380-R636 IonicContact OE1-NH2 2.78Å; E380-R636 PolarHBondContact OE1-NH2 3.18Å; E380-R636 IonicContact OE2-CZ 3.13Å; E380-R636 IonicContact OE2-NH1 3.5Å; E380-R636 PolarHBondContact OE2-NH1 2.91Å; E380-R636 IonicContact OE2-NH2 2.69Å; E380-R636 PolarHBondContact OE2-NH2 3.03Å; E380-R636 VanDerWaalsContact OE2-NH2 3.13Å; L627-R636 HydrophobicContact CD2-CB 4.4Å; L627-R636 HydrophobicContact CD2-CG 4.04Å; G632-R636 PolarHBondContact O-N 3.43Å; V633-R636 WeakPolarHBondContact O-CB 3.18Å; V633-R636 PolarHBondContact O-N 3.43Å; W634-R636 VanDerWaalsContact C-N 3.33Å; R636-G638 PolarHBondContact O-N 2.91Å; R636-V639 PolarHBondContact O-N 3.45Å; R636-V639 VanDerWaalsContact O-N 3.15Å; R636-L640 HydrophobicContact CG-CD1 4.18Å; R636-L640 WeakPolarHBondContact O-CG 3.39Å; R636-L640 PolarHBondContact O-N 3.14Å
637	R	78.1	Confident	79	Confident	110 Å²	110	52.8 Å²	52.8	42%	0.415	32%	0.316	S	S	.	.	H	α-helix	trans	-58.1	-43.6	176.3	-178.9	171.5	172.1	155.3	-3.3	112.6	V633 W634 V639 L640 L641	V633-R637 PolarHBondContact O-N 2.88Å; W634-R637 PolarHBondContact O-N 2.9Å; R637-V639 VanDerWaalsContact C-N 3.32Å; R637-V639 PolarHBondContact O-N 3.03Å; R637-L640 PolarHBondContact O-N 3.24Å; R637-L641 HydrophobicContact CG-CD1 4.5Å; R637-L641 WeakPolarHBondContact O-CG 3.36Å; R637-L641 PolarHBondContact O-N 2.87Å
638	G	80.4	Confident	79.4	Confident	33 Å²	33	56.7 Å²	56.7	34%	0.34	33%	0.333	S	S	.	.	H	α-helix	trans	-61.3	-36.3	175.4	0	0	0	0	0	113.7	W634 Q635 R636 K642	W634-G638 PolarHBondContact O-N 3.39Å; Q635-G638 PolarHBondContact O-N 2.58Å; R636-G638 PolarHBondContact O-N 2.91Å; G638-K642 WeakPolarHBondContact O-CG 3.4Å; G638-K642 PolarHBondContact O-N 3.26Å
639	V	85.6	Confident	80.1	Confident	6 Å²	6	53.4 Å²	53.4	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-74.3	-35	175.6	172.9	0	0	0	0	112.2	L623 M626 L627 M631 Q635 R636 R637 K642 L643	L623-V639 HydrophobicContact CB-CG1 3.9Å; L623-V639 HydrophobicContact CD2-CG1 3.99Å; L623-V639 WeakPolarHBondContact O-CG1 3.48Å; M626-V639 HydrophobicContact CB-CG2 4.48Å; M626-V639 HydrophobicContact CE-CG2 3.92Å; L627-V639 HydrophobicContact CD1-CG1 4.4Å; L627-V639 HydrophobicContact CD2-CB 3.85Å; L627-V639 HydrophobicContact CD2-CG1 3.6Å; L627-V639 HydrophobicContact CG-CB 4.43Å; L627-V639 HydrophobicContact CG-CG1 3.63Å; M631-V639 HydrophobicContact CE-CG2 3.86Å; M631-V639 HydrophobicContact SD-CG2 4.19Å; Q635-V639 WeakPolarHBondContact O-CG2 3.41Å; Q635-V639 PolarHBondContact O-N 3.37Å; Q635-V639 VanDerWaalsContact O-N 3.12Å; R636-V639 PolarHBondContact O-N 3.45Å; R636-V639 VanDerWaalsContact O-N 3.15Å; R637-V639 VanDerWaalsContact C-N 3.32Å; R637-V639 PolarHBondContact O-N 3.03Å; V639-K642 PolarHBondContact O-N 2.88Å; V639-L643 HydrophobicContact CG1-CD1 4.32Å; V639-L643 PolarHBondContact O-N 3.41Å
640	L	87.6	Confident	80.9	Confident	22 Å²	22	49.3 Å²	49.3	12%	0.115	28%	0.283	C	S	.	.	H	α-helix	trans	-65.4	-41.5	174	-70.2	173.5	0	0	0	112.5	C491 E493 L627 R636 R637 K642 L643 S644	C491-L640 WeakPolarHBondContact SG-CD2 3.5Å; E493-L640 HydrophobicContact CB-CD2 4.25Å; E493-L640 HydrophobicContact CG-CB 4.31Å; E493-L640 HydrophobicContact CG-CD2 4.47Å; L627-L640 HydrophobicContact CD1-CD2 3.86Å; L627-L640 HydrophobicContact CD2-CD2 4.35Å; L627-L640 HydrophobicContact CD2-CG 4.29Å; R636-L640 HydrophobicContact CG-CD1 4.18Å; R636-L640 WeakPolarHBondContact O-CG 3.39Å; R636-L640 PolarHBondContact O-N 3.14Å; R637-L640 PolarHBondContact O-N 3.24Å; L640-K642 VanDerWaalsContact C-N 3.31Å; L640-K642 PolarHBondContact O-N 3.15Å; L640-L643 HydrophobicContact CD2-CD1 4.34Å; L640-L643 PolarHBondContact O-N 3.43Å; L640-S644 PolarHBondContact O-N 2.95Å
641	L	86.9	Confident	82.5	Confident	115 Å²	115	50.4 Å²	50.4	60%	0.602	27%	0.271	S	S	*	.	H	α-helix	trans	-59.9	-41.4	172.8	-71.6	170	0	0	0	111.7	R637 S644 G645	R637-L641 HydrophobicContact CG-CD1 4.5Å; R637-L641 WeakPolarHBondContact O-CG 3.36Å; R637-L641 PolarHBondContact O-N 2.87Å; L641-S644 PolarHBondContact O-N 3.38Å; L641-G645 PolarHBondContact O-N 3.3Å
642	K	89.8	Confident	83.6	Confident	79 Å²	79	52.8 Å²	52.8	34%	0.343	28%	0.281	S	S	.	.	H	α-helix	trans	-65.2	-41.4	175.5	-74.3	175.4	171	-166.6	0	112.6	L623 G638 V639 L640 G645 Q646 D734	L623-K642 HydrophobicContact CD1-CB 3.88Å; L623-K642 HydrophobicContact CD2-CB 4.08Å; L623-K642 HydrophobicContact CD2-CD 4.33Å; G638-K642 WeakPolarHBondContact O-CG 3.4Å; G638-K642 PolarHBondContact O-N 3.26Å; V639-K642 PolarHBondContact O-N 2.88Å; L640-K642 VanDerWaalsContact C-N 3.31Å; L640-K642 PolarHBondContact O-N 3.15Å; K642-G645 PolarHBondContact O-N 2.82Å; K642-Q646 WeakPolarHBondContact O-CG 3.37Å; K642-Q646 PolarHBondContact O-N 3.28Å; K642-D734 WeakPolarHBondContact CE-OD2 3.42Å; K642-D734 IonicContact NZ-OD1 2.66Å; K642-D734 PolarHBondContact NZ-OD1 2.83Å; K642-D734 IonicContact NZ-OD2 2.73Å; K642-D734 PolarHBondContact NZ-OD2 3.41Å
643	L	92.2	Very high	84.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-47	173.6	-78.5	163.3	0	0	0	111.3	L494 L497 C620 L623 I624 L627 V639 L640 G645 Q646 T647	L494-L643 HydrophobicContact CD2-CD1 4Å; L497-L643 HydrophobicContact CD2-CD2 3.79Å; C620-L643 HydrophobicContact CB-CD2 4.35Å; L623-L643 HydrophobicContact CB-CD1 4.29Å; L623-L643 HydrophobicContact CB-CD2 3.68Å; L623-L643 HydrophobicContact CB-CG 3.79Å; L623-L643 HydrophobicContact CD1-CD2 3.91Å; L623-L643 HydrophobicContact CD1-CG 3.89Å; L623-L643 HydrophobicContact CG-CD2 4.47Å; L623-L643 HydrophobicContact CG-CG 4.49Å; I624-L643 HydrophobicContact CG1-CD1 4.49Å; I624-L643 HydrophobicContact CG1-CD2 4.19Å; L627-L643 HydrophobicContact CD1-CD1 3.54Å; L627-L643 HydrophobicContact CG-CD1 4.38Å; V639-L643 HydrophobicContact CG1-CD1 4.32Å; V639-L643 PolarHBondContact O-N 3.41Å; L640-L643 HydrophobicContact CD2-CD1 4.34Å; L640-L643 PolarHBondContact O-N 3.43Å; L643-G645 VanDerWaalsContact C-N 3.33Å; L643-G645 PolarHBondContact O-N 2.96Å; L643-Q646 WeakPolarHBondContact O-CA 3.49Å; L643-Q646 PolarHBondContact O-N 3.06Å; L643-T647 PolarHBondContact O-N 3.03Å; L643-T647 PolarHBondContact O-OG1 3.25Å
644	S	92.4	Very high	85.9	Confident	61 Å²	61	48.2 Å²	48.2	43%	0.427	25%	0.245	S	C	.	.	H	α-helix	trans	-58.2	-42.6	176.8	-179.8	0	0	0	0	112.4	L640 L641 Q646 T647 Q648	L640-S644 PolarHBondContact O-N 2.95Å; L641-S644 PolarHBondContact O-N 3.38Å; S644-Q646 VanDerWaalsContact C-N 3.32Å; S644-Q646 PolarHBondContact O-N 3.34Å; S644-T647 WeakPolarHBondContact O-CB 3.23Å; S644-T647 PolarHBondContact O-N 3.38Å; S644-Q648 PolarHBondContact O-N 3.43Å; S644-Q648 VanDerWaalsContact O-N 3.11Å
645	G	91.4	Very high	87	Confident	33 Å²	33	49.6 Å²	49.6	34%	0.34	26%	0.255	S	S	.	.	H	α-helix	trans	-65.5	-29.7	173.8	0	0	0	0	0	114.1	L641 K642 L643 L649	L641-G645 PolarHBondContact O-N 3.3Å; K642-G645 PolarHBondContact O-N 2.82Å; L643-G645 VanDerWaalsContact C-N 3.33Å; L643-G645 PolarHBondContact O-N 2.96Å; G645-L649 WeakPolarHBondContact O-CB 3.48Å; G645-L649 PolarHBondContact O-N 3.32Å
646	Q	93.8	Very high	87.4	Confident	22 Å²	22	45.6 Å²	45.6	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-74.9	-34.9	170.8	-63.9	-52.3	-90.8	0	0	112.9	H616 Y619 C620 L623 K642 L643 S644 L649 L650	H616-Q646 PolarHBondContact ND1-OE1 3.06Å; Y619-Q646 HydrophobicContact CD1-CG 3.64Å; Y619-Q646 VanDerWaalsContact CD1-OE1 3.28Å; Y619-Q646 HydrophobicContact CE1-CG 3.59Å; C620-Q646 WeakPolarHBondContact SG-CB 3.39Å; L623-Q646 HydrophobicContact CD1-CG 4.34Å; K642-Q646 WeakPolarHBondContact O-CG 3.37Å; K642-Q646 PolarHBondContact O-N 3.28Å; L643-Q646 WeakPolarHBondContact O-CA 3.49Å; L643-Q646 PolarHBondContact O-N 3.06Å; S644-Q646 VanDerWaalsContact C-N 3.32Å; S644-Q646 PolarHBondContact O-N 3.34Å; Q646-L649 PolarHBondContact O-N 2.89Å; Q646-L650 WeakPolarHBondContact O-CG 3.31Å; Q646-L650 PolarHBondContact O-N 3.12Å
647	T	94.1	Very high	87.2	Confident	15 Å²	15	44.7 Å²	44.7	9%	0.092	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-50.4	173	-54.8	0	0	0	0	110.7	L497 E500 L643 S644 L649 L650 E651	L497-T647 WeakPolarHBondContact CA-OG1 3.34Å; L497-T647 WeakPolarHBondContact CB-OG1 3.42Å; E500-T647 HydrophobicContact CB-CG2 3.87Å; E500-T647 HydrophobicContact CG-CG2 4.33Å; L643-T647 PolarHBondContact O-N 3.03Å; L643-T647 PolarHBondContact O-OG1 3.25Å; S644-T647 WeakPolarHBondContact O-CB 3.23Å; S644-T647 PolarHBondContact O-N 3.38Å; T647-L649 VanDerWaalsContact C-N 3.32Å; T647-L649 PolarHBondContact O-N 3.12Å; T647-L650 PolarHBondContact O-N 3.41Å; T647-E651 PolarHBondContact O-N 3.26Å
648	Q	92.6	Very high	86.9	Confident	110 Å²	110	42.8 Å²	42.8	51%	0.514	24%	0.235	S	C	.	.	H	α-helix	trans	-59.3	-42.8	176.3	-174.5	-170.9	-33.6	0	0	111.7	S644 L650 E651 E652	S644-Q648 PolarHBondContact O-N 3.43Å; S644-Q648 VanDerWaalsContact O-N 3.11Å; Q648-L650 PolarHBondContact O-N 2.84Å; Q648-E651 WeakPolarHBondContact O-CB 3.36Å; Q648-E651 PolarHBondContact O-N 3.13Å; Q648-E652 PolarHBondContact NE2-OE1 3.26Å; Q648-E652 WeakPolarHBondContact O-CG 2.94Å; Q648-E652 PolarHBondContact O-N 3.02Å
649	L	92.1	Very high	86	Confident	21 Å²	21	48 Å²	48	11%	0.11	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-38.4	178.5	177.5	59	0	0	0	112.5	H616 G645 Q646 T647 E651 L653 F757	H616-L649 WeakPolarHBondContact CE1-CD2 3.44Å; H616-L649 WeakPolarHBondContact ND1-CD2 3.28Å; G645-L649 WeakPolarHBondContact O-CB 3.48Å; G645-L649 PolarHBondContact O-N 3.32Å; Q646-L649 PolarHBondContact O-N 2.89Å; T647-L649 VanDerWaalsContact C-N 3.32Å; T647-L649 PolarHBondContact O-N 3.12Å; L649-E651 VanDerWaalsContact C-N 3.34Å; L649-L653 HydrophobicContact CD1-CD1 4.06Å; L649-L653 HydrophobicContact CD1-CG 4.12Å; L649-L653 HydrophobicContact CG-CD1 3.87Å; L649-L653 HydrophobicContact CG-CG 4.41Å; L649-L653 VanDerWaalsContact O-CB 3.3Å; L649-L653 WeakPolarHBondContact O-CB 3Å; L649-L653 WeakPolarHBondContact O-CD1 3.47Å; L649-L653 WeakPolarHBondContact O-CG 3.49Å; L649-L653 PolarHBondContact O-N 2.69Å; L649-F757 HydrophobicContact CD1-CB 3.82Å; L649-F757 HydrophobicContact CD1-CD1 3.71Å; L649-F757 HydrophobicContact CD1-CG 3.88Å; L649-F757 HydrophobicContact CD2-CB 3.79Å; L649-F757 HydrophobicContact CG-CB 4.45Å
650	L	92.7	Very high	84.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.2	-37.6	173.5	-69.3	169.7	0	0	0	111.3	L497 E500 V501 L504 I613 H616 L617 Q646 T647 Q648 L653 A654	L497-L650 HydrophobicContact CD1-CD1 3.97Å; E500-L650 HydrophobicContact CG-CB 4.03Å; V501-L650 HydrophobicContact CG2-CD1 4.21Å; L504-L650 HydrophobicContact CD2-CD2 4.06Å; I613-L650 HydrophobicContact CG2-CD2 4.26Å; H616-L650 HydrophobicContact CB-CD2 4.33Å; L617-L650 HydrophobicContact CD2-CD1 3.98Å; L617-L650 HydrophobicContact CD2-CD2 4.17Å; L617-L650 HydrophobicContact CG-CD2 4.34Å; Q646-L650 WeakPolarHBondContact O-CG 3.31Å; Q646-L650 PolarHBondContact O-N 3.12Å; T647-L650 PolarHBondContact O-N 3.41Å; Q648-L650 PolarHBondContact O-N 2.84Å; L650-L653 HydrophobicContact CD2-CD1 4.48Å; L650-L653 PolarHBondContact O-N 2.81Å; L650-A654 WeakPolarHBondContact O-CB 3.38Å; L650-A654 PolarHBondContact O-N 2.81Å
651	E	91.3	Very high	83.3	Confident	91 Å²	91	58.1 Å²	58.1	43%	0.425	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-49.5	174.9	-175.6	175.1	-156.4	0	0	111.8	E500 R503 T647 Q648 L649 A654 E655	E500-E651 HydrophobicContact CG-CB 4.29Å; E500-E651 WeakPolarHBondContact OE1-CA 3.36Å; R503-E651 PolarHBondContact NH2-O 3.03Å; T647-E651 PolarHBondContact O-N 3.26Å; Q648-E651 WeakPolarHBondContact O-CB 3.36Å; Q648-E651 PolarHBondContact O-N 3.13Å; L649-E651 VanDerWaalsContact C-N 3.34Å; E651-A654 PolarHBondContact O-N 2.84Å; E651-E655 PolarHBondContact O-N 2.69Å; E651-E655 VanDerWaalsContact O-N 3.11Å
652	E	87.7	Confident	81.8	Confident	74 Å²	74	56.9 Å²	56.9	35%	0.346	31%	0.313	S	S	.	.	H	α-helix	trans	-60.1	-49.3	174.5	-71.3	175	-158.5	0	0	111.5	Q648 A654 E655 I656	Q648-E652 PolarHBondContact NE2-OE1 3.26Å; Q648-E652 WeakPolarHBondContact O-CG 2.94Å; Q648-E652 PolarHBondContact O-N 3.02Å; E652-A654 VanDerWaalsContact C-N 3.26Å; E652-A654 PolarHBondContact O-N 2.67Å; E652-E655 PolarHBondContact O-N 2.94Å; E652-E655 VanDerWaalsContact O-N 3.12Å; E652-I656 HydrophobicContact CB-CD1 4.41Å; E652-I656 WeakPolarHBondContact O-CB 3.46Å; E652-I656 VanDerWaalsContact O-CD1 3.28Å; E652-I656 WeakPolarHBondContact O-CD1 3.44Å; E652-I656 VanDerWaalsContact O-CG1 3.25Å; E652-I656 WeakPolarHBondContact O-CG1 3.2Å; E652-I656 PolarHBondContact O-N 2.78Å
653	L	86.3	Confident	80.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.5	-38.4	179.4	-76	166.7	0	0	0	112.2	L609 I613 L649 L650 S657 F757	L609-L653 HydrophobicContact CD1-CD2 3.75Å; I613-L653 HydrophobicContact CG1-CB 4.35Å; I613-L653 HydrophobicContact CG1-CD1 4.1Å; L649-L653 HydrophobicContact CD1-CD1 4.06Å; L649-L653 HydrophobicContact CD1-CG 4.12Å; L649-L653 HydrophobicContact CG-CD1 3.87Å; L649-L653 HydrophobicContact CG-CG 4.41Å; L649-L653 VanDerWaalsContact O-CB 3.3Å; L649-L653 WeakPolarHBondContact O-CB 3Å; L649-L653 WeakPolarHBondContact O-CD1 3.47Å; L649-L653 WeakPolarHBondContact O-CG 3.49Å; L649-L653 PolarHBondContact O-N 2.69Å; L650-L653 HydrophobicContact CD2-CD1 4.48Å; L650-L653 PolarHBondContact O-N 2.81Å; L653-S657 WeakPolarHBondContact O-CB 3.4Å; L653-S657 PolarHBondContact O-N 2.66Å; L653-F757 HydrophobicContact CD2-CD1 4.4Å; L653-F757 HydrophobicContact CD2-CD2 4.28Å; L653-F757 HydrophobicContact CD2-CE1 3.82Å; L653-F757 HydrophobicContact CD2-CE2 3.68Å; L653-F757 HydrophobicContact CD2-CZ 3.43Å; L653-F757 VanDerWaalsContact CD2-CZ 3.43Å
654	A	83.8	Confident	79.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.6	-45.9	174.4	0	0	0	0	0	111.7	R503 L504 L507 L650 E651 E652 S657 V658	R503-A654 VanDerWaalsContact NH2-CB 3.3Å; L504-A654 HydrophobicContact CD1-CB 4.07Å; L507-A654 HydrophobicContact CD1-CB 4.03Å; L650-A654 WeakPolarHBondContact O-CB 3.38Å; L650-A654 PolarHBondContact O-N 2.81Å; E651-A654 PolarHBondContact O-N 2.84Å; E652-A654 VanDerWaalsContact C-N 3.26Å; E652-A654 PolarHBondContact O-N 2.67Å; A654-S657 PolarHBondContact O-N 2.78Å; A654-S657 PolarHBondContact O-OG 2.95Å; A654-V658 WeakPolarHBondContact O-CG2 3.07Å; A654-V658 PolarHBondContact O-N 3.07Å; A654-V658 VanDerWaalsContact O-N 3.11Å
655	E	82.8	Confident	78.2	Confident	115 Å²	115	59.3 Å²	59.3	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-60.2	-48.6	174.6	-68.6	-162.4	150	0	0	112.4	E651 E652 S657 V658 D659	E651-E655 PolarHBondContact O-N 2.69Å; E651-E655 VanDerWaalsContact O-N 3.11Å; E652-E655 PolarHBondContact O-N 2.94Å; E652-E655 VanDerWaalsContact O-N 3.12Å; E655-S657 PolarHBondContact O-N 2.9Å; E655-V658 PolarHBondContact O-N 3.27Å; E655-D659 PolarHBondContact O-N 3.24Å; E655-D659 VanDerWaalsContact O-N 3.08Å
656	I	77.3	Confident	77.5	Confident	27 Å²	27	59.6 Å²	59.6	14%	0.138	34%	0.339	C	S	.	.	H	α-helix	trans	-51.8	-43.8	175.7	-71.1	154.6	0	0	0	110.6	E652 R660 V670	E652-I656 HydrophobicContact CB-CD1 4.41Å; E652-I656 WeakPolarHBondContact O-CB 3.46Å; E652-I656 VanDerWaalsContact O-CD1 3.28Å; E652-I656 WeakPolarHBondContact O-CD1 3.44Å; E652-I656 VanDerWaalsContact O-CG1 3.25Å; E652-I656 WeakPolarHBondContact O-CG1 3.2Å; E652-I656 PolarHBondContact O-N 2.78Å; I656-R660 PolarHBondContact O-N 3.23Å; I656-V670 HydrophobicContact CD1-CG1 3.44Å; I656-V670 VanDerWaalsContact CD1-CG1 3.44Å; I656-V670 HydrophobicContact CG1-CG1 4.04Å; I656-V670 HydrophobicContact CG2-CB 4.5Å; I656-V670 HydrophobicContact CG2-CG1 3.89Å; I656-V670 HydrophobicContact CG2-CG2 3.85Å
657	S	73.1	Confident	77	Confident	5 Å²	5	58.7 Å²	58.7	4%	0.035	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-32.4	179.3	82.8	0	0	0	0	113.1	R511 L653 A654 E655	R511-S657 PolarHBondContact NH1-O 2.92Å; R511-S657 PolarHBondContact NH2-O 2.82Å; R511-S657 PolarHBondContact NH2-OG 3.35Å; L653-S657 WeakPolarHBondContact O-CB 3.4Å; L653-S657 PolarHBondContact O-N 2.66Å; A654-S657 PolarHBondContact O-N 2.78Å; A654-S657 PolarHBondContact O-OG 2.95Å; E655-S657 PolarHBondContact O-N 2.9Å
658	V	70.3	Confident	76.4	Confident	70 Å²	70	59.5 Å²	59.5	42%	0.424	34%	0.343	S	S	.	.	H	α-helix	trans	-74.2	-46.2	-178.5	168.5	0	0	0	0	111	L507 A654 E655	L507-V658 HydrophobicContact CD1-CG2 4.29Å; L507-V658 HydrophobicContact CD2-CG2 3.94Å; A654-V658 WeakPolarHBondContact O-CG2 3.07Å; A654-V658 PolarHBondContact O-N 3.07Å; A654-V658 VanDerWaalsContact O-N 3.11Å; E655-V658 PolarHBondContact O-N 3.27Å
659	D	63	Low	75.7	Confident	141 Å²	141	56.6 Å²	56.6	75%	0.754	33%	0.331	S	S	*	.	H	α-helix	trans	-88.6	-27.8	-169.1	-85	-6.7	0	0	0	114.7	E655	E655-D659 PolarHBondContact O-N 3.24Å; E655-D659 VanDerWaalsContact O-N 3.08Å
660	R	61.8	Low	75.2	Confident	139 Å²	139	56.2 Å²	56.2	53%	0.525	33%	0.33	S	S	.	.			trans	-110.1	23.3	-168.6	-56.3	-169.9	-179.6	-133.9	-6	115	I656 G662 G663 V664 D669	I656-R660 PolarHBondContact O-N 3.23Å; R660-G662 PolarHBondContact O-N 3.06Å; R660-G662 VanDerWaalsContact O-N 3.12Å; R660-G663 PolarHBondContact O-N 3.05Å; R660-V664 HydrophobicContact CB-CG2 3.93Å; R660-D669 WeakPolarHBondContact CD-O 3.43Å; R660-D669 PolarHBondContact NH1-O 3.34Å
661	L	53.3	Low	74.8	Confident	103 Å²	103	56.5 Å²	56.5	54%	0.539	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	113.6	-172.8	-156.5	79.9	0	0	0	113.2	T604 G663	T604-L661 WeakPolarHBondContact O-CD1 3.48Å; L661-G663 VanDerWaalsContact C-N 3.32Å; L661-G663 PolarHBondContact O-N 3.17Å
662	G	55	Low	74.4	Confident	89 Å²	89	56.1 Å²	56.1	92%	0.918	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	3.7	178.8	0	0	0	0	0	116.1	R660	R660-G662 PolarHBondContact O-N 3.06Å; R660-G662 VanDerWaalsContact O-N 3.12Å
663	G	58.9	Low	74.2	Confident	52 Å²	52	54.4 Å²	54.4	54%	0.536	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-17.2	-178.8	0	0	0	0	0	115.8	R660 L661 T665	R660-G663 PolarHBondContact O-N 3.05Å; L661-G663 VanDerWaalsContact C-N 3.32Å; L661-G663 PolarHBondContact O-N 3.17Å; G663-T665 PolarHBondContact O-N 3Å
664	V	70.3	Confident	74.2	Confident	26 Å²	26	54.4 Å²	54.4	16%	0.158	33%	0.333	C	S	.	.			trans	-76.5	124.3	-175.1	177.3	0	0	0	0	111.6	R660 D669 V670 F694	R660-V664 HydrophobicContact CB-CG2 3.93Å; V664-D669 HydrophobicContact CB-CB 4.49Å; V664-D669 HydrophobicContact CG1-CB 4.08Å; V664-D669 HydrophobicContact CG2-CB 4.29Å; V664-V670 HydrophobicContact CG1-CG2 3.93Å; V664-V670 HydrophobicContact CG2-CG2 3.93Å; V664-F694 HydrophobicContact CG1-CZ 3.78Å
665	T	71	Confident	74.3	Confident	112 Å²	112	56.4 Å²	56.4	69%	0.687	35%	0.349	S	S	*	.			trans	-124.4	-13.9	179.3	61.5	0	0	0	0	113.4	G663 D669 L693	G663-T665 PolarHBondContact O-N 3Å; T665-D669 PolarHBondContact N-OD2 3.5Å; T665-D669 PolarHBondContact OG1-OD2 3.02Å; T665-L693 WeakPolarHBondContact O-CD2 2.96Å
666	S	77	Confident	74.6	Confident	39 Å²	39	58.3 Å²	58.3	27%	0.273	36%	0.358	S	S	.	.	S	Bend	trans	-143.2	152.7	178.8	179.4	0	0	0	0	110.8	A668 D669	S666-A668 PolarHBondContact O-N 2.75Å; S666-A668 PolarHBondContact OG-N 2.96Å; S666-D669 PolarHBondContact N-OD2 2.83Å; S666-D669 WeakPolarHBondContact O-CB 3.47Å; S666-D669 PolarHBondContact O-N 3.28Å
667	A	82.4	Confident	75.2	Confident	4 Å²	4	58.8 Å²	58.8	3%	0.033	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-59.8	-24.2	169.3	0	0	0	0	0	112.6	D669 V670 L671 M681 V756	A667-D669 PolarHBondContact O-N 3.45Å; A667-V670 PolarHBondContact O-N 2.74Å; A667-V670 VanDerWaalsContact O-N 3.08Å; A667-L671 PolarHBondContact O-N 2.99Å; A667-M681 HydrophobicContact CB-CE 4.35Å; A667-V756 HydrophobicContact CB-CG1 4.46Å; A667-V756 HydrophobicContact CB-CG2 4.01Å
668	A	81.6	Confident	75.9	Confident	31 Å²	31	62.7 Å²	62.7	26%	0.256	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-63.6	-24.3	172.9	0	0	0	0	0	113.4	S666 V670 A675 M681	S666-A668 PolarHBondContact O-N 2.75Å; S666-A668 PolarHBondContact OG-N 2.96Å; A668-V670 PolarHBondContact O-N 3.5Å; A668-A675 HydrophobicContact CB-CB 3.76Å; A668-M681 HydrophobicContact CB-CE 3.96Å; A668-M681 HydrophobicContact CB-SD 4.42Å
669	D	77.9	Confident	76.9	Confident	49 Å²	49	64.8 Å²	64.8	26%	0.262	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-73.1	-4.8	175.4	-54.2	-37.7	0	0	0	112.3	R660 V664 T665 S666 A667	R660-D669 WeakPolarHBondContact CD-O 3.43Å; R660-D669 PolarHBondContact NH1-O 3.34Å; V664-D669 HydrophobicContact CB-CB 4.49Å; V664-D669 HydrophobicContact CG1-CB 4.08Å; V664-D669 HydrophobicContact CG2-CB 4.29Å; T665-D669 PolarHBondContact N-OD2 3.5Å; T665-D669 PolarHBondContact OG1-OD2 3.02Å; S666-D669 PolarHBondContact N-OD2 2.83Å; S666-D669 WeakPolarHBondContact O-CB 3.47Å; S666-D669 PolarHBondContact O-N 3.28Å; A667-D669 PolarHBondContact O-N 3.45Å
670	V	80.8	Confident	78.3	Confident	13 Å²	13	58.1 Å²	58.1	8%	0.079	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-37.3	-173	176.1	0	0	0	0	111.8	I656 V664 A667 A668 P672 F694 F757	I656-V670 HydrophobicContact CD1-CG1 3.44Å; I656-V670 VanDerWaalsContact CD1-CG1 3.44Å; I656-V670 HydrophobicContact CG1-CG1 4.04Å; I656-V670 HydrophobicContact CG2-CB 4.5Å; I656-V670 HydrophobicContact CG2-CG1 3.89Å; I656-V670 HydrophobicContact CG2-CG2 3.85Å; V664-V670 HydrophobicContact CG1-CG2 3.93Å; V664-V670 HydrophobicContact CG2-CG2 3.93Å; A667-V670 PolarHBondContact O-N 2.74Å; A667-V670 VanDerWaalsContact O-N 3.08Å; A668-V670 PolarHBondContact O-N 3.5Å; V670-P672 VanDerWaalsContact O-CD 3.27Å; V670-P672 WeakPolarHBondContact O-CD 3.41Å; V670-F694 HydrophobicContact CB-CE1 4.05Å; V670-F694 HydrophobicContact CG1-CE1 4.19Å; V670-F694 HydrophobicContact CG2-CE1 3.73Å; V670-F694 HydrophobicContact CG2-CZ 3.92Å; V670-F757 HydrophobicContact CG1-CE1 3.85Å; V670-F757 HydrophobicContact CG1-CZ 4.03Å
671	L	85.9	Confident	79.7	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.031	33%	0.333	C	S	.	.			trans	-116.1	80.1	178.9	-64.4	177.2	0	0	0	111.3	A667 S673 L674 A675 V756 F757 H760	A667-L671 PolarHBondContact O-N 2.99Å; L671-S673 VanDerWaalsContact C-N 3.32Å; L671-S673 PolarHBondContact O-N 3.45Å; L671-L674 HydrophobicContact CB-CB 3.93Å; L671-L674 HydrophobicContact CD1-CD2 4.37Å; L671-L674 WeakPolarHBondContact O-CB 3.27Å; L671-L674 PolarHBondContact O-N 3.41Å; L671-L674 VanDerWaalsContact O-N 3.08Å; L671-A675 PolarHBondContact O-N 2.84Å; L671-V756 HydrophobicContact CD1-CB 4.44Å; L671-V756 HydrophobicContact CD1-CG1 3.9Å; L671-V756 HydrophobicContact CD1-CG2 3.94Å; L671-F757 HydrophobicContact CD1-CD1 4.03Å; L671-F757 HydrophobicContact CD1-CE1 4.16Å; L671-F757 HydrophobicContact CD2-CD1 4Å; L671-F757 HydrophobicContact CD2-CE1 4.02Å; L671-F757 HydrophobicContact CG-CD1 4.34Å; L671-F757 HydrophobicContact CG-CE1 4.13Å; L671-H760 HydrophobicContact CD1-CB 3.82Å
672	P	81.6	Confident	81.5	Confident	83 Å²	83	50.7 Å²	50.7	54%	0.539	33%	0.326	S	S	.	.	H	α-helix	trans	-63.1	-35	-177.9	24.9	-33.9	0	0	0	113.1	V670 L674 A675 E676	V670-P672 VanDerWaalsContact O-CD 3.27Å; V670-P672 WeakPolarHBondContact O-CD 3.41Å; P672-L674 PolarHBondContact O-N 2.77Å; P672-A675 CarbonylContact O-C 3.6Å; P672-A675 WeakPolarHBondContact O-CA 3.42Å; P672-A675 VanDerWaalsContact O-CB 3.32Å; P672-A675 WeakPolarHBondContact O-CB 3.41Å; P672-A675 PolarHBondContact O-N 3.27Å; P672-E676 WeakPolarHBondContact O-CG 3.37Å; P672-E676 PolarHBondContact O-N 3.25Å
673	S	84.9	Confident	83.3	Confident	38 Å²	38	46.5 Å²	46.5	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-66.2	-18.5	174.3	49.3	0	0	0	0	114.4	L671 R677 H760	L671-S673 VanDerWaalsContact C-N 3.32Å; L671-S673 PolarHBondContact O-N 3.45Å; S673-R677 PolarHBondContact O-NH1 2.84Å; S673-R677 VanDerWaalsContact O-NH1 3.14Å; S673-H760 PolarHBondContact OG-CE1 3.16Å; S673-H760 PolarHBondContact OG-NE2 3.16Å
674	L	85.7	Confident	84.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-88.6	-37.3	167.3	-168.2	63.1	0	0	0	110.5	L671 P672 E676 R677 L680 M681 V756 F759 H760 I763	L671-L674 HydrophobicContact CB-CB 3.93Å; L671-L674 HydrophobicContact CD1-CD2 4.37Å; L671-L674 WeakPolarHBondContact O-CB 3.27Å; L671-L674 PolarHBondContact O-N 3.41Å; L671-L674 VanDerWaalsContact O-N 3.08Å; P672-L674 PolarHBondContact O-N 2.77Å; L674-E676 PolarHBondContact O-N 3.19Å; L674-R677 CarbonylContact O-C 3.48Å; L674-R677 WeakPolarHBondContact O-CA 3.46Å; L674-R677 PolarHBondContact O-N 2.9Å; L674-L680 HydrophobicContact CD1-CB 4.06Å; L674-M681 HydrophobicContact CB-SD 4.18Å; L674-M681 HydrophobicContact CD2-SD 3.72Å; L674-M681 HydrophobicContact CG-CG 4.03Å; L674-M681 HydrophobicContact CG-SD 3.67Å; L674-M681 VanDerWaalsContact O-CG 3.26Å; L674-M681 WeakPolarHBondContact O-CG 3.47Å; L674-V756 HydrophobicContact CD2-CG2 3.99Å; L674-F759 HydrophobicContact CD1-CE1 4.32Å; L674-F759 HydrophobicContact CD2-CD1 4.21Å; L674-F759 HydrophobicContact CD2-CE1 4.32Å; L674-H760 HydrophobicContact CD2-CB 4.46Å; L674-I763 HydrophobicContact CD1-CD1 3.71Å
675	A	85.3	Confident	85.8	Confident	42 Å²	42	45.9 Å²	45.9	35%	0.347	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-33.2	174.3	0	0	0	0	0	113.3	A668 L671 P672 R677	A668-A675 HydrophobicContact CB-CB 3.76Å; L671-A675 PolarHBondContact O-N 2.84Å; P672-A675 CarbonylContact O-C 3.6Å; P672-A675 WeakPolarHBondContact O-CA 3.42Å; P672-A675 VanDerWaalsContact O-CB 3.32Å; P672-A675 WeakPolarHBondContact O-CB 3.41Å; P672-A675 PolarHBondContact O-N 3.27Å; A675-R677 PolarHBondContact O-N 3.09Å
676	E	88.6	Confident	86.8	Confident	155 Å²	155	43.8 Å²	43.8	72%	0.724	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18	171.3	-72.9	171.5	-179.5	0	0	113.8	P672 L674 P678	P672-E676 WeakPolarHBondContact O-CG 3.37Å; P672-E676 PolarHBondContact O-N 3.25Å; L674-E676 PolarHBondContact O-N 3.19Å; E676-P678 VanDerWaalsContact C-CD 3.5Å; E676-P678 WeakPolarHBondContact O-CD 3.14Å
677	R	89.8	Confident	87.4	Confident	37 Å²	37	42.2 Å²	42.2	14%	0.14	24%	0.242	C	C	.	.			trans	-109.9	75.8	177.7	-63.4	-173.8	175	101.7	-23.7	110.9	S673 L674 A675 Q679 L680 M681 D767 Q769	S673-R677 PolarHBondContact O-NH1 2.84Å; S673-R677 VanDerWaalsContact O-NH1 3.14Å; L674-R677 CarbonylContact O-C 3.48Å; L674-R677 WeakPolarHBondContact O-CA 3.46Å; L674-R677 PolarHBondContact O-N 2.9Å; A675-R677 PolarHBondContact O-N 3.09Å; R677-Q679 VanDerWaalsContact C-N 3.29Å; R677-Q679 PolarHBondContact O-N 3.5Å; R677-Q679 VanDerWaalsContact O-N 3.14Å; R677-L680 HydrophobicContact CB-CB 4.38Å; R677-L680 HydrophobicContact CB-CD1 4.14Å; R677-L680 HydrophobicContact CB-CG 4.49Å; R677-L680 PolarHBondContact O-N 3.49Å; R677-M681 PolarHBondContact O-N 3.11Å; R677-M681 VanDerWaalsContact O-N 3.12Å; R677-D767 IonicContact NH2-OD1 2.68Å; R677-D767 PolarHBondContact NH2-OD1 3.11Å; R677-Q769 VanDerWaalsContact NH2-NE2 3.15Å
678	P	88.9	Confident	87.6	Confident	87 Å²	87	42.3 Å²	42.3	57%	0.565	24%	0.243	S	C	*	.	H	α-helix	trans	-62.7	-28.3	-167	23.4	-35.2	0	0	0	114.8	E676 T682	E676-P678 VanDerWaalsContact C-CD 3.5Å; E676-P678 WeakPolarHBondContact O-CD 3.14Å; P678-T682 WeakPolarHBondContact O-CB 3.29Å; P678-T682 PolarHBondContact O-N 3.17Å; P678-T682 PolarHBondContact O-OG1 3.21Å
679	Q	90.7	Very high	87.7	Confident	114 Å²	114	42.4 Å²	42.4	53%	0.533	25%	0.247	S	C	.	.	H	α-helix	trans	-65.9	-40.3	175.7	-66.3	-178.8	-7.3	0	0	111.8	R677 T682 L683	R677-Q679 VanDerWaalsContact C-N 3.29Å; R677-Q679 PolarHBondContact O-N 3.5Å; R677-Q679 VanDerWaalsContact O-N 3.14Å; Q679-T682 WeakPolarHBondContact O-CB 3.44Å; Q679-T682 PolarHBondContact O-N 2.86Å; Q679-L683 PolarHBondContact O-N 3.01Å
680	L	92.6	Very high	87.4	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-77.4	-34.8	180	-59.1	174.5	0	0	0	111.8	L674 R677 T682 L683 W684 I763 V768 M771	L674-L680 HydrophobicContact CD1-CB 4.06Å; R677-L680 HydrophobicContact CB-CB 4.38Å; R677-L680 HydrophobicContact CB-CD1 4.14Å; R677-L680 HydrophobicContact CB-CG 4.49Å; R677-L680 PolarHBondContact O-N 3.49Å; L680-T682 VanDerWaalsContact C-N 3.29Å; L680-T682 PolarHBondContact O-N 3.05Å; L680-L683 PolarHBondContact O-N 2.95Å; L680-W684 PolarHBondContact O-N 2.84Å; L680-I763 HydrophobicContact CB-CD1 4.02Å; L680-I763 HydrophobicContact CD1-CD1 3.82Å; L680-I763 HydrophobicContact CD1-CG1 4.08Å; L680-I763 HydrophobicContact CD1-CG2 3.85Å; L680-I763 HydrophobicContact CD2-CD1 4.48Å; L680-I763 HydrophobicContact CG-CD1 4.33Å; L680-V768 HydrophobicContact CD1-CG1 4.3Å; L680-V768 WeakPolarHBondContact CD1-O 3.25Å; L680-V768 HydrophobicContact CD2-CG1 4.33Å; L680-M771 HydrophobicContact CD2-CB 3.98Å; L680-M771 HydrophobicContact CD2-CE 4.4Å
681	M	91	Very high	86.4	Confident	18 Å²	18	49.5 Å²	49.5	9%	0.089	31%	0.305	C	S	.	.	H	α-helix	trans	-59.2	-39.6	165.9	-85.7	-60.5	-50.6	0	0	112.7	A667 A668 L674 R677 W684 S685	A667-M681 HydrophobicContact CB-CE 4.35Å; A668-M681 HydrophobicContact CB-CE 3.96Å; A668-M681 HydrophobicContact CB-SD 4.42Å; L674-M681 HydrophobicContact CB-SD 4.18Å; L674-M681 HydrophobicContact CD2-SD 3.72Å; L674-M681 HydrophobicContact CG-CG 4.03Å; L674-M681 HydrophobicContact CG-SD 3.67Å; L674-M681 VanDerWaalsContact O-CG 3.26Å; L674-M681 WeakPolarHBondContact O-CG 3.47Å; R677-M681 PolarHBondContact O-N 3.11Å; R677-M681 VanDerWaalsContact O-N 3.12Å; M681-W684 PolarHBondContact O-N 3.49Å; M681-S685 WeakPolarHBondContact O-CB 3.44Å; M681-S685 PolarHBondContact O-N 2.92Å; M681-S685 PolarHBondContact O-OG 3.48Å
682	T	90.9	Very high	85.6	Confident	67 Å²	67	49.5 Å²	49.5	41%	0.411	31%	0.307	S	S	.	.	H	α-helix	trans	-67.3	-45.1	177.9	-57.1	0	0	0	0	110.3	P678 Q679 L680 W684 S685 E686	P678-T682 WeakPolarHBondContact O-CB 3.29Å; P678-T682 PolarHBondContact O-N 3.17Å; P678-T682 PolarHBondContact O-OG1 3.21Å; Q679-T682 WeakPolarHBondContact O-CB 3.44Å; Q679-T682 PolarHBondContact O-N 2.86Å; L680-T682 VanDerWaalsContact C-N 3.29Å; L680-T682 PolarHBondContact O-N 3.05Å; T682-W684 PolarHBondContact O-N 2.75Å; T682-S685 PolarHBondContact O-N 3.46Å; T682-E686 WeakPolarHBondContact CG2-OE1 3.3Å; T682-E686 WeakPolarHBondContact O-CG 3.45Å; T682-E686 PolarHBondContact O-N 2.84Å
683	L	92.9	Very high	85.6	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-58.4	-45	173.5	179.4	63.2	0	0	0	112.3	Q679 L680 S685 E686 C687 Y709 F759 M771	Q679-L683 PolarHBondContact O-N 3.01Å; L680-L683 PolarHBondContact O-N 2.95Å; L683-S685 PolarHBondContact O-N 3.01Å; L683-E686 PolarHBondContact O-N 3.38Å; L683-C687 WeakPolarHBondContact O-CB 3.43Å; L683-C687 PolarHBondContact O-N 3.09Å; L683-C687 PolarHBondContact O-SG 2.95Å; L683-C687 VanDerWaalsContact O-SG 3.34Å; L683-Y709 HydrophobicContact CD1-CE2 4.03Å; L683-Y709 HydrophobicContact CD2-CE2 4.32Å; L683-F759 HydrophobicContact CD2-CE2 4.31Å; L683-F759 HydrophobicContact CD2-CZ 4.2Å; L683-F759 HydrophobicContact CG-CZ 4.41Å; L683-M771 HydrophobicContact CD2-CB 3.83Å; L683-M771 HydrophobicContact CD2-CE 4.21Å; L683-M771 HydrophobicContact CD2-CG 3.74Å
684	W	92.8	Very high	85.7	Confident	5 Å²	5	46.3 Å²	46.3	2%	0.019	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-47.9	174.1	176.1	-104.6	0	0	0	111.7	L680 M681 T682 E686 C687 S688 L693 T696 L754 V756 F759	L680-W684 PolarHBondContact O-N 2.84Å; M681-W684 PolarHBondContact O-N 3.49Å; T682-W684 PolarHBondContact O-N 2.75Å; W684-E686 VanDerWaalsContact C-N 3.3Å; W684-E686 PolarHBondContact O-N 3.28Å; W684-C687 PolarHBondContact O-N 2.86Å; W684-C687 VanDerWaalsContact O-N 3.15Å; W684-S688 PolarHBondContact O-N 3.24Å; W684-S688 PolarHBondContact O-OG 3.42Å; W684-L693 PolarHBondContact NE1-O 3.29Å; W684-T696 HydrophobicContact CH2-CG2 3.83Å; W684-T696 HydrophobicContact CZ3-CG2 4.02Å; W684-L754 HydrophobicContact CZ3-CD2 4.05Å; W684-L754 HydrophobicContact CZ3-CG 4.17Å; W684-V756 HydrophobicContact CD2-CB 4.05Å; W684-V756 HydrophobicContact CD2-CG2 3.67Å; W684-V756 HydrophobicContact CE3-CB 4.42Å; W684-V756 HydrophobicContact CE3-CG2 4.24Å; W684-V756 HydrophobicContact CG-CG2 3.91Å; W684-V756 HydrophobicContact CH2-CB 3.98Å; W684-V756 HydrophobicContact CZ2-CB 3.56Å; W684-V756 HydrophobicContact CZ2-CG2 4.12Å; W684-V756 HydrophobicContact CZ3-CB 4.38Å; W684-F759 HydrophobicContact CB-CD1 4.2Å; W684-F759 HydrophobicContact CB-CE1 3.78Å; W684-F759 HydrophobicContact CB-CZ 4.36Å; W684-F759 HydrophobicContact CD2-CD1 4.4Å; W684-F759 HydrophobicContact CE3-CB 3.96Å; W684-F759 AromaticContact CE3-CD1 3.86Å; W684-F759 HydrophobicContact CE3-CD1 3.86Å; W684-F759 HydrophobicContact CE3-CD2 4.38Å; W684-F759 HydrophobicContact CE3-CE1 4.44Å; W684-F759 AromaticContact CE3-CG 3.83Å; W684-F759 HydrophobicContact CE3-CG 3.83Å; W684-F759 HydrophobicContact CZ3-CB 4.02Å; W684-F759 HydrophobicContact CZ3-CG 4.35Å
685	S	90.3	Very high	85.9	Confident	60 Å²	60	48 Å²	48	42%	0.42	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-32	-176.7	-55.3	0	0	0	0	112.9	M681 T682 L683 G689	M681-S685 WeakPolarHBondContact O-CB 3.44Å; M681-S685 PolarHBondContact O-N 2.92Å; M681-S685 PolarHBondContact O-OG 3.48Å; T682-S685 PolarHBondContact O-N 3.46Å; L683-S685 PolarHBondContact O-N 3.01Å; S685-G689 WeakPolarHBondContact O-CA 3.39Å; S685-G689 PolarHBondContact O-N 3.37Å
686	E	90.4	Very high	86.2	Confident	67 Å²	67	46.2 Å²	46.2	31%	0.313	27%	0.274	S	S	.	.	H	α-helix	trans	-67.7	-51.5	169.1	-74.1	171.1	-154.6	0	0	111.1	T682 L683 W684 S688 H704 R708	T682-E686 WeakPolarHBondContact CG2-OE1 3.3Å; T682-E686 WeakPolarHBondContact O-CG 3.45Å; T682-E686 PolarHBondContact O-N 2.84Å; L683-E686 PolarHBondContact O-N 3.38Å; W684-E686 VanDerWaalsContact C-N 3.3Å; W684-E686 PolarHBondContact O-N 3.28Å; E686-S688 VanDerWaalsContact C-N 3.32Å; E686-S688 PolarHBondContact O-N 2.98Å; E686-H704 PolarHBondContact O-CD2 2.79Å; E686-H704 VanDerWaalsContact O-CD2 3.28Å; E686-H704 PolarHBondContact O-NE2 2.98Å; E686-H704 IonicContact OE2-ND1 2.78Å; E686-R708 IonicContact OE1-CZ 3.92Å; E686-R708 IonicContact OE1-NH1 2.72Å; E686-R708 PolarHBondContact OE1-NH1 3.35Å; E686-R708 IonicContact OE2-CZ 3.7Å; E686-R708 IonicContact OE2-NH1 3.74Å; E686-R708 PolarHBondContact OE2-NH1 3.04Å
687	C	90.7	Very high	86.2	Confident	6 Å²	6	40.6 Å²	40.6	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-31.4	-179.5	-74.3	0	0	0	0	114.1	L683 W684 T696 R700 V701	L683-C687 WeakPolarHBondContact O-CB 3.43Å; L683-C687 PolarHBondContact O-N 3.09Å; L683-C687 PolarHBondContact O-SG 2.95Å; L683-C687 VanDerWaalsContact O-SG 3.34Å; W684-C687 PolarHBondContact O-N 2.86Å; W684-C687 VanDerWaalsContact O-N 3.15Å; C687-T696 PolarHBondContact O-OG1 3.03Å; C687-R700 WeakPolarHBondContact O-CB 3.43Å; C687-V701 HydrophobicContact CB-CG2 4.44Å
688	S	87.4	Confident	86.1	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-92.1	-37.9	178.9	83.1	0	0	0	0	113.3	W684 E686 G692 R700	W684-S688 PolarHBondContact O-N 3.24Å; W684-S688 PolarHBondContact O-OG 3.42Å; E686-S688 VanDerWaalsContact C-N 3.32Å; E686-S688 PolarHBondContact O-N 2.98Å; S688-G692 WeakPolarHBondContact CB-O 3.3Å; S688-G692 PolarHBondContact OG-O 2.77Å; S688-R700 PolarHBondContact O-NH1 3.26Å
689	G	82.9	Confident	86	Confident	33 Å²	33	35.9 Å²	35.9	34%	0.34	22%	0.224	S	C	.	.			trans	66.5	-175	-176.2	0	0	0	0	0	113.4	S685 A691 G692	S685-G689 WeakPolarHBondContact O-CA 3.39Å; S685-G689 PolarHBondContact O-N 3.37Å; G689-A691 PolarHBondContact O-N 3.34Å; G689-G692 PolarHBondContact O-N 3.04Å
690	S	70.6	Confident	85.9	Confident	139 Å²	139	35.8 Å²	35.8	97%	0.972	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	19.3	-169.6	72.3	0	0	0	0	116.5
691	A	61.4	Low	85.8	Confident	73 Å²	73	35.9 Å²	35.9	60%	0.603	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-138.7	-17.9	-173.8	0	0	0	0	0	114.4	N608 G689	N608-A691 PolarHBondContact OD1-O 2.96Å; G689-A691 PolarHBondContact O-N 3.34Å
692	G	67.6	Low	85.7	Confident	6 Å²	6	36.2 Å²	36.2	6%	0.062	22%	0.22	C	C	.	.			trans	-113.4	104.2	176.4	0	0	0	0	0	110	S688 G689 H695	S688-G692 WeakPolarHBondContact CB-O 3.3Å; S688-G692 PolarHBondContact OG-O 2.77Å; G689-G692 PolarHBondContact O-N 3.04Å; G692-H695 WeakPolarHBondContact CA-O 3.46Å
693	L	81.9	Confident	85.5	Confident	53 Å²	53	37.8 Å²	37.8	28%	0.277	22%	0.221	S	C	.	.	S	Bend	trans	-77.5	-49.7	176.2	-71.1	175	0	0	0	110.8	N608 T665 W684	N608-L693 HydrophobicContact CB-CB 4.35Å; N608-L693 PolarHBondContact OD1-N 3.47Å; T665-L693 WeakPolarHBondContact O-CD2 2.96Å; W684-L693 PolarHBondContact NE1-O 3.29Å
694	F	87.6	Confident	85.5	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	23%	0.234	C	C	.	.	S	Bend	trans	-109.4	-8.3	-173.3	-60.3	-64.4	0	0	0	114.4	N608 L609 A612 V664 V670 T755 V756 F757	N608-F694 HydrophobicContact CB-CD2 3.81Å; L609-F694 HydrophobicContact CB-CD2 3.91Å; L609-F694 HydrophobicContact CB-CE2 3.8Å; L609-F694 HydrophobicContact CD1-CD2 4.04Å; L609-F694 HydrophobicContact CD1-CE1 4.47Å; L609-F694 HydrophobicContact CD1-CE2 3.96Å; L609-F694 HydrophobicContact CD1-CG 4.33Å; L609-F694 HydrophobicContact CD1-CZ 4.16Å; L609-F694 HydrophobicContact CG-CE2 4.36Å; A612-F694 HydrophobicContact CB-CB 3.96Å; V664-F694 HydrophobicContact CG1-CZ 3.78Å; V670-F694 HydrophobicContact CB-CE1 4.05Å; V670-F694 HydrophobicContact CG1-CE1 4.19Å; V670-F694 HydrophobicContact CG2-CE1 3.73Å; V670-F694 HydrophobicContact CG2-CZ 3.92Å; F694-T755 CarbonylContact O-C 3.6Å; F694-T755 VanDerWaalsContact O-CA 3.26Å; F694-T755 WeakPolarHBondContact O-CA 3.48Å; F694-V756 HydrophobicContact CB-CG1 4.41Å; F694-V756 HydrophobicContact CD1-CG1 3.99Å; F694-V756 PolarHBondContact O-N 2.82Å; F694-F757 HydrophobicContact CB-CE2 4.16Å; F694-F757 AromaticContact CD1-CE2 3.93Å; F694-F757 HydrophobicContact CD1-CE2 3.93Å; F694-F757 AromaticContact CD1-CZ 3.75Å; F694-F757 HydrophobicContact CD1-CZ 3.75Å; F694-F757 HydrophobicContact CE1-CZ 4.19Å; F694-F757 HydrophobicContact CG-CE2 4.32Å
695	H	90.1	Very high	85.4	Confident	34 Å²	34	40.5 Å²	40.5	16%	0.157	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	156.1	-176.7	67.6	90.2	0	0	0	113	N608 G692 V753 L754	N608-H695 PolarHBondContact O-CD2 3.47Å; G692-H695 WeakPolarHBondContact CA-O 3.46Å; H695-V753 HydrophobicContact CB-CG1 3.65Å; H695-L754 CarbonylContact C-O 3.49Å; H695-L754 VanDerWaalsContact CA-O 3.25Å; H695-L754 WeakPolarHBondContact CA-O 3.16Å
696	T	90.7	Very high	85.4	Confident	5 Å²	5	40 Å²	40	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	155.1	175.7	-170.1	0	0	0	0	111.6	W684 C687 R700 V701 V753 L754	W684-T696 HydrophobicContact CH2-CG2 3.83Å; W684-T696 HydrophobicContact CZ3-CG2 4.02Å; C687-T696 PolarHBondContact O-OG1 3.03Å; T696-R700 WeakPolarHBondContact OG1-CD 3.4Å; T696-V701 HydrophobicContact CG2-CG2 3.57Å; T696-V753 CarbonylContact O-C 3.59Å; T696-V753 WeakPolarHBondContact O-CA 3.35Å; T696-V753 WeakPolarHBondContact O-CG1 3.21Å; T696-L754 PolarHBondContact N-O 3.32Å; T696-L754 PolarHBondContact O-N 3.19Å
697	T	88.4	Confident	85.4	Confident	37 Å²	37	43.7 Å²	43.7	23%	0.227	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	141.8	178.5	52.5	0	0	0	0	111.7	D699 R700 V701 D752	T697-D699 PolarHBondContact O-N 3.36Å; T697-R700 WeakPolarHBondContact O-CB 3.43Å; T697-R700 PolarHBondContact O-N 2.9Å; T697-R700 WeakPolarHBondContact OG1-CG 3.39Å; T697-V701 PolarHBondContact O-N 2.93Å; T697-D752 CarbonylContact C-O 3.5Å; T697-D752 VanDerWaalsContact CA-O 3.25Å; T697-D752 WeakPolarHBondContact CA-O 3.24Å
698	L	87.8	Confident	85.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-55.9	-37.3	179.3	-62.2	-170.5	0	0	0	112.6	R700 V701 F702 V729 V733 L738 L749 D752 L754	L698-R700 PolarHBondContact O-N 3.19Å; L698-R700 VanDerWaalsContact O-N 3.14Å; L698-V701 PolarHBondContact O-N 3.44Å; L698-F702 HydrophobicContact CB-CD2 4.27Å; L698-F702 HydrophobicContact CB-CE2 4.46Å; L698-F702 WeakPolarHBondContact O-CD2 3.25Å; L698-F702 PolarHBondContact O-N 3.38Å; L698-V729 HydrophobicContact CD2-CG1 3.94Å; L698-V733 HydrophobicContact CD1-CG2 4.04Å; L698-V733 HydrophobicContact CD2-CG1 4.24Å; L698-V733 HydrophobicContact CD2-CG2 4.48Å; L698-L738 HydrophobicContact CD1-CD1 3.79Å; L698-L749 HydrophobicContact CB-CB 4.4Å; L698-L749 HydrophobicContact CB-CD2 4.15Å; L698-L749 HydrophobicContact CD1-CD2 4.28Å; L698-L749 PolarHBondContact N-O 2.89Å; L698-D752 HydrophobicContact CB-CB 4.32Å; L698-D752 HydrophobicContact CD1-CB 3.47Å; L698-D752 VanDerWaalsContact CD1-CB 3.47Å; L698-D752 HydrophobicContact CG-CB 3.68Å; L698-D752 PolarHBondContact N-O 3.03Å; L698-L754 HydrophobicContact CD2-CB 3.71Å
699	D	86.6	Confident	85.7	Confident	24 Å²	24	47.7 Å²	47.7	13%	0.128	26%	0.257	C	S	.	.	H	α-helix	trans	-52.3	-32.8	173.6	171.7	86	0	0	0	113.8	T697 K703 L749	T697-D699 PolarHBondContact O-N 3.36Å; D699-K703 WeakPolarHBondContact O-CB 3.46Å; D699-K703 VanDerWaalsContact O-CD 3.26Å; D699-K703 WeakPolarHBondContact O-CD 3.5Å; D699-K703 WeakPolarHBondContact O-CG 3.39Å; D699-K703 PolarHBondContact O-N 3.03Å; D699-K703 WeakPolarHBondContact OD1-CE 3.25Å; D699-K703 IonicContact OD1-NZ 2.77Å; D699-K703 PolarHBondContact OD1-NZ 3.21Å; D699-K703 WeakPolarHBondContact OD2-CE 3.39Å; D699-K703 IonicContact OD2-NZ 3.51Å; D699-K703 PolarHBondContact OD2-NZ 2.96Å; D699-L749 HydrophobicContact CB-CB 4.07Å; D699-L749 WeakPolarHBondContact CB-O 3.26Å; D699-L749 PolarHBondContact N-O 3.12Å
700	R	88.4	Confident	85.9	Confident	112 Å²	112	46.7 Å²	46.7	42%	0.423	25%	0.245	S	C	.	.	H	α-helix	trans	-77	-43.7	174.1	-71.2	177.9	-177.3	-167.9	5.4	112	C687 S688 T696 T697 L698 K703 H704	C687-R700 WeakPolarHBondContact O-CB 3.43Å; S688-R700 PolarHBondContact O-NH1 3.26Å; T696-R700 WeakPolarHBondContact OG1-CD 3.4Å; T697-R700 WeakPolarHBondContact O-CB 3.43Å; T697-R700 PolarHBondContact O-N 2.9Å; T697-R700 WeakPolarHBondContact OG1-CG 3.39Å; L698-R700 PolarHBondContact O-N 3.19Å; L698-R700 VanDerWaalsContact O-N 3.14Å; R700-K703 PolarHBondContact O-N 3.39Å; R700-H704 PolarHBondContact O-N 3.1Å
701	V	91.2	Very high	86.8	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-58.2	-53.2	178.5	-174.3	0	0	0	0	109.9	C687 T696 T697 L698 K703 H704 M705 V729 L754	C687-V701 HydrophobicContact CB-CG2 4.44Å; T696-V701 HydrophobicContact CG2-CG2 3.57Å; T697-V701 PolarHBondContact O-N 2.93Å; L698-V701 PolarHBondContact O-N 3.44Å; V701-K703 VanDerWaalsContact C-N 3.34Å; V701-K703 PolarHBondContact O-N 2.71Å; V701-H704 PolarHBondContact O-N 2.95Å; V701-M705 HydrophobicContact CG1-CG 4.35Å; V701-M705 HydrophobicContact CG1-SD 3.79Å; V701-M705 WeakPolarHBondContact O-CB 3.25Å; V701-M705 WeakPolarHBondContact O-CG 3.18Å; V701-M705 PolarHBondContact O-N 3.48Å; V701-V729 HydrophobicContact CG1-CG2 3.86Å; V701-L754 HydrophobicContact CG1-CD2 4.31Å; V701-L754 HydrophobicContact CG2-CB 4.47Å; V701-L754 HydrophobicContact CG2-CD2 3.89Å
702	F	88.4	Confident	88.1	Confident	26 Å²	26	42 Å²	42	11%	0.114	21%	0.21	C	C	.	.	H	α-helix	trans	-55.3	-45.9	174.9	-87.5	-74.6	0	0	0	112.4	L698 N706 I725 V729 L738 L749	L698-F702 HydrophobicContact CB-CD2 4.27Å; L698-F702 HydrophobicContact CB-CE2 4.46Å; L698-F702 WeakPolarHBondContact O-CD2 3.25Å; L698-F702 PolarHBondContact O-N 3.38Å; F702-N706 VanDerWaalsContact O-CB 3.24Å; F702-N706 WeakPolarHBondContact O-CB 3.36Å; F702-N706 PolarHBondContact O-N 2.89Å; F702-I725 HydrophobicContact CD1-CG2 4.07Å; F702-I725 HydrophobicContact CE1-CG2 4.3Å; F702-V729 HydrophobicContact CD2-CG1 4.15Å; F702-V729 HydrophobicContact CE1-CB 4.44Å; F702-V729 HydrophobicContact CE2-CB 4.04Å; F702-V729 HydrophobicContact CE2-CG1 3.58Å; F702-V729 HydrophobicContact CZ-CB 3.9Å; F702-V729 HydrophobicContact CZ-CG1 3.97Å; F702-V729 HydrophobicContact CZ-CG2 4.44Å; F702-L738 HydrophobicContact CE2-CD1 4.26Å; F702-L738 HydrophobicContact CE2-CD2 4.47Å; F702-L738 HydrophobicContact CZ-CB 4.38Å; F702-L738 HydrophobicContact CZ-CD1 4.44Å; F702-L749 HydrophobicContact CD2-CD1 3.89Å; F702-L749 HydrophobicContact CD2-CD2 4.17Å; F702-L749 HydrophobicContact CE2-CD1 4.1Å; F702-L749 HydrophobicContact CE2-CD2 3.82Å; F702-L749 HydrophobicContact CG-CD1 4.43Å
703	K	88.4	Confident	89.1	Confident	99 Å²	99	41.9 Å²	41.9	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-63.4	-43.2	178.7	-79.3	169.8	-169.4	162.9	0	112.8	D699 R700 V701 Q707	D699-K703 WeakPolarHBondContact O-CB 3.46Å; D699-K703 VanDerWaalsContact O-CD 3.26Å; D699-K703 WeakPolarHBondContact O-CD 3.5Å; D699-K703 WeakPolarHBondContact O-CG 3.39Å; D699-K703 PolarHBondContact O-N 3.03Å; D699-K703 WeakPolarHBondContact OD1-CE 3.25Å; D699-K703 IonicContact OD1-NZ 2.77Å; D699-K703 PolarHBondContact OD1-NZ 3.21Å; D699-K703 WeakPolarHBondContact OD2-CE 3.39Å; D699-K703 IonicContact OD2-NZ 3.51Å; D699-K703 PolarHBondContact OD2-NZ 2.96Å; R700-K703 PolarHBondContact O-N 3.39Å; V701-K703 VanDerWaalsContact C-N 3.34Å; V701-K703 PolarHBondContact O-N 2.71Å; K703-Q707 VanDerWaalsContact O-CB 3.27Å; K703-Q707 WeakPolarHBondContact O-CB 3.24Å; K703-Q707 WeakPolarHBondContact O-CG 3.38Å; K703-Q707 PolarHBondContact O-N 3.16Å; K703-Q707 PolarHBondContact O-NE2 3.02Å
704	H	91.7	Very high	89.3	Confident	61 Å²	61	44.2 Å²	44.2	28%	0.282	22%	0.218	S	C	.	.	H	α-helix	trans	-72.8	-43.1	179.6	-105.1	-66.7	0	0	0	112.3	E686 R700 V701 N706 Q707 R708	E686-H704 PolarHBondContact O-CD2 2.79Å; E686-H704 VanDerWaalsContact O-CD2 3.28Å; E686-H704 PolarHBondContact O-NE2 2.98Å; E686-H704 IonicContact OE2-ND1 2.78Å; R700-H704 PolarHBondContact O-N 3.1Å; V701-H704 PolarHBondContact O-N 2.95Å; H704-N706 PolarHBondContact O-N 3.38Å; H704-Q707 PolarHBondContact O-N 3.25Å; H704-R708 VanDerWaalsContact O-CB 3.24Å; H704-R708 WeakPolarHBondContact O-CB 3.5Å; H704-R708 PolarHBondContact O-N 2.89Å
705	M	91.6	Very high	89.1	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-44	175.8	-69.4	-176.9	73.9	0	0	111.6	V701 R708 Y709 I725 V728 V729 M771 L775	V701-M705 HydrophobicContact CG1-CG 4.35Å; V701-M705 HydrophobicContact CG1-SD 3.79Å; V701-M705 WeakPolarHBondContact O-CB 3.25Å; V701-M705 WeakPolarHBondContact O-CG 3.18Å; V701-M705 PolarHBondContact O-N 3.48Å; M705-R708 PolarHBondContact O-N 3.2Å; M705-Y709 HydrophobicContact CB-CD2 4.37Å; M705-Y709 WeakPolarHBondContact O-CB 3.45Å; M705-Y709 PolarHBondContact O-N 3.4Å; M705-I725 HydrophobicContact CB-CD1 4.25Å; M705-I725 HydrophobicContact CB-CG2 3.73Å; M705-I725 HydrophobicContact CE-CG1 4.48Å; M705-I725 HydrophobicContact CE-CG2 4.22Å; M705-I725 HydrophobicContact SD-CG2 4.24Å; M705-V728 HydrophobicContact CE-CG1 4.14Å; M705-V729 HydrophobicContact SD-CG2 3.68Å; M705-M771 HydrophobicContact CE-CG 4.38Å; M705-M771 HydrophobicContact CE-SD 4.22Å; M705-L775 HydrophobicContact CE-CD1 4.06Å; M705-L775 HydrophobicContact CE-CD2 4.12Å
706	N	89.4	Confident	88.5	Confident	49 Å²	49	58.1 Å²	58.1	26%	0.262	28%	0.275	S	S	.	.	H	α-helix	trans	-66.4	-39.7	176.4	-76.6	12.4	0	0	0	112.4	F702 H704 R708 S710 D722 I725	F702-N706 VanDerWaalsContact O-CB 3.24Å; F702-N706 WeakPolarHBondContact O-CB 3.36Å; F702-N706 PolarHBondContact O-N 2.89Å; H704-N706 PolarHBondContact O-N 3.38Å; N706-R708 VanDerWaalsContact C-N 3.31Å; N706-R708 PolarHBondContact O-N 3.16Å; N706-S710 WeakPolarHBondContact O-CB 3.44Å; N706-S710 PolarHBondContact O-N 2.91Å; N706-D722 PolarHBondContact ND2-OD1 2.98Å; N706-I725 WeakPolarHBondContact OD1-CD1 3.28Å; N706-I725 WeakPolarHBondContact OD1-CG2 3.45Å
707	Q	90.9	Very high	87.9	Confident	145 Å²	145	59.7 Å²	59.7	68%	0.678	28%	0.282	S	S	*	.	H	α-helix	trans	-65.4	-33	176.1	-77.7	168.1	44.7	0	0	113.2	K703 H704	K703-Q707 VanDerWaalsContact O-CB 3.27Å; K703-Q707 WeakPolarHBondContact O-CB 3.24Å; K703-Q707 WeakPolarHBondContact O-CG 3.38Å; K703-Q707 PolarHBondContact O-N 3.16Å; K703-Q707 PolarHBondContact O-NE2 3.02Å; H704-Q707 PolarHBondContact O-N 3.25Å
708	R	91.4	Very high	87	Confident	91 Å²	91	62.1 Å²	62.1	34%	0.343	30%	0.299	S	S	.	.	H	α-helix	trans	-88.7	-43.2	-174.8	-169.5	170.9	177.8	141.6	-1.5	113.1	E686 H704 M705 N706	E686-R708 IonicContact OE1-CZ 3.92Å; E686-R708 IonicContact OE1-NH1 2.72Å; E686-R708 PolarHBondContact OE1-NH1 3.35Å; E686-R708 IonicContact OE2-CZ 3.7Å; E686-R708 IonicContact OE2-NH1 3.74Å; E686-R708 PolarHBondContact OE2-NH1 3.04Å; H704-R708 VanDerWaalsContact O-CB 3.24Å; H704-R708 WeakPolarHBondContact O-CB 3.5Å; H704-R708 PolarHBondContact O-N 2.89Å; M705-R708 PolarHBondContact O-N 3.2Å; N706-R708 VanDerWaalsContact C-N 3.31Å; N706-R708 PolarHBondContact O-N 3.16Å
709	Y	91.6	Very high	86.2	Confident	6 Å²	6	71 Å²	71	2%	0.024	34%	0.34	C	S	.	.	H	α-helix	trans	-113	-21.8	-167.5	-56.7	-61.1	0	0	0	114.9	L683 M705 A711 V712 L713 M771 E772 L775	L683-Y709 HydrophobicContact CD1-CE2 4.03Å; L683-Y709 HydrophobicContact CD2-CE2 4.32Å; M705-Y709 HydrophobicContact CB-CD2 4.37Å; M705-Y709 WeakPolarHBondContact O-CB 3.45Å; M705-Y709 PolarHBondContact O-N 3.4Å; Y709-A711 PolarHBondContact O-N 2.82Å; Y709-A711 VanDerWaalsContact O-N 3.15Å; Y709-V712 PolarHBondContact O-N 3.29Å; Y709-V712 VanDerWaalsContact O-N 3.13Å; Y709-L713 WeakPolarHBondContact O-CG 3.4Å; Y709-L713 PolarHBondContact O-N 3.48Å; Y709-M771 HydrophobicContact CE2-CB 4.38Å; Y709-M771 HydrophobicContact CE2-CG 3.94Å; Y709-E772 HydrophobicContact CD1-CB 3.97Å; Y709-E772 HydrophobicContact CD1-CG 3.89Å; Y709-E772 HydrophobicContact CE1-CB 3.7Å; Y709-E772 HydrophobicContact CE1-CG 4.09Å; Y709-L775 HydrophobicContact CD1-CD1 4.39Å; Y709-L775 HydrophobicContact CD2-CD1 3.51Å; Y709-L775 HydrophobicContact CE2-CD1 4.13Å; Y709-L775 HydrophobicContact CG-CD1 3.66Å
710	S	88.8	Confident	85.6	Confident	11 Å²	11	70.2 Å²	70.2	8%	0.077	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-30.7	-172.9	-163.4	0	0	0	0	112.9	N706 Q714	N706-S710 WeakPolarHBondContact O-CB 3.44Å; N706-S710 PolarHBondContact O-N 2.91Å; S710-Q714 VanDerWaalsContact O-CB 3.23Å; S710-Q714 WeakPolarHBondContact O-CB 3.33Å; S710-Q714 WeakPolarHBondContact O-CG 3.42Å; S710-Q714 PolarHBondContact O-N 2.83Å; S710-Q714 PolarHBondContact OG-NE2 3.07Å
711	A	89.1	Confident	85.1	Confident	72 Å²	72	65.1 Å²	65.1	60%	0.595	32%	0.318	S	S	*	.	H	α-helix	trans	-65.5	-46.7	175.3	0	0	0	0	0	113.1	Y709 Q714 E715	Y709-A711 PolarHBondContact O-N 2.82Å; Y709-A711 VanDerWaalsContact O-N 3.15Å; A711-Q714 PolarHBondContact O-N 3.3Å; A711-E715 PolarHBondContact O-N 2.97Å
712	V	89.1	Confident	84.6	Confident	43 Å²	43	69.7 Å²	69.7	26%	0.261	34%	0.342	S	S	.	.	H	α-helix	trans	-68.3	-40	179.1	-176.2	0	0	0	0	110.5	Y709 E715 R716 E772 L776	Y709-V712 PolarHBondContact O-N 3.29Å; Y709-V712 VanDerWaalsContact O-N 3.13Å; V712-E715 PolarHBondContact O-N 3.17Å; V712-R716 PolarHBondContact O-N 2.81Å; V712-E772 HydrophobicContact CG1-CG 4.47Å; V712-L776 HydrophobicContact CG1-CD1 4.15Å; V712-L776 HydrophobicContact CG1-CD2 4.43Å
713	L	87.1	Confident	84.3	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-42.5	174.4	-68.3	169.6	0	0	0	111.8	Y709 E715 R716 H717 A721 I725 L775 L776 A779	Y709-L713 WeakPolarHBondContact O-CG 3.4Å; Y709-L713 PolarHBondContact O-N 3.48Å; L713-E715 VanDerWaalsContact C-N 3.35Å; L713-E715 PolarHBondContact O-N 2.89Å; L713-R716 PolarHBondContact O-N 2.88Å; L713-H717 CarbonylContact O-C 3.5Å; L713-H717 WeakPolarHBondContact O-CA 3.43Å; L713-H717 PolarHBondContact O-N 2.83Å; L713-A721 HydrophobicContact CB-CB 3.6Å; L713-A721 HydrophobicContact CD1-CB 4.3Å; L713-I725 HydrophobicContact CD1-CD1 3.84Å; L713-I725 HydrophobicContact CD1-CG1 4.08Å; L713-L775 HydrophobicContact CD1-CB 4.28Å; L713-L775 HydrophobicContact CD1-CD1 4.49Å; L713-L775 HydrophobicContact CD2-CB 4Å; L713-L776 HydrophobicContact CD2-CD2 4.06Å; L713-L776 HydrophobicContact CD2-CG 4.29Å; L713-A779 HydrophobicContact CD2-CB 4.03Å
714	Q	86.5	Confident	84.3	Confident	102 Å²	102	64.4 Å²	64.4	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-68	-30	177.5	-75.8	171.7	28	0	0	113.4	S710 A711 R716 P718 A721	S710-Q714 VanDerWaalsContact O-CB 3.23Å; S710-Q714 WeakPolarHBondContact O-CB 3.33Å; S710-Q714 WeakPolarHBondContact O-CG 3.42Å; S710-Q714 PolarHBondContact O-N 2.83Å; S710-Q714 PolarHBondContact OG-NE2 3.07Å; A711-Q714 PolarHBondContact O-N 3.3Å; Q714-R716 VanDerWaalsContact C-N 3.34Å; Q714-P718 WeakPolarHBondContact O-CG 3.36Å; Q714-A721 HydrophobicContact CG-CB 4.03Å
715	E	83.8	Confident	84.2	Confident	155 Å²	155	61.5 Å²	61.5	72%	0.724	31%	0.308	S	S	*	.	H	α-helix	trans	-65.8	-36.8	175.1	-173.7	179.2	169.7	0	0	111.9	A711 V712 L713	A711-E715 PolarHBondContact O-N 2.97Å; V712-E715 PolarHBondContact O-N 3.17Å; L713-E715 VanDerWaalsContact C-N 3.35Å; L713-E715 PolarHBondContact O-N 2.89Å
716	R	77.4	Confident	83.9	Confident	172 Å²	172	61.4 Å²	61.4	65%	0.649	31%	0.308	S	S	*	.	H	α-helix	trans	-92.6	-38.8	-178.9	-60.8	-61	-174.6	157	0.5	113.5	V712 L713 Q714 L776	V712-R716 PolarHBondContact O-N 2.81Å; L713-R716 PolarHBondContact O-N 2.88Å; Q714-R716 VanDerWaalsContact C-N 3.34Å; R716-L776 HydrophobicContact CB-CD2 4.08Å; R716-L776 HydrophobicContact CG-CD2 3.87Å
717	H	79	Confident	83.8	Confident	38 Å²	38	60.2 Å²	60.2	18%	0.176	30%	0.301	C	S	.	.			trans	-141.7	82.5	-171.9	-54.2	-76.1	0	0	0	110.6	L713 H719 S720 A779	L713-H717 CarbonylContact O-C 3.5Å; L713-H717 WeakPolarHBondContact O-CA 3.43Å; L713-H717 PolarHBondContact O-N 2.83Å; H717-H719 PolarHBondContact O-N 2.83Å; H717-S720 WeakPolarHBondContact CB-OG 3.48Å; H717-S720 PolarHBondContact O-N 2.75Å; H717-A779 HydrophobicContact CB-CB 4.24Å; H717-A779 VanDerWaalsContact CD2-CB 3.49Å; H717-A779 WeakPolarHBondContact CD2-CB 3.49Å
718	P	69	Low	83.8	Confident	88 Å²	88	53.3 Å²	53.3	57%	0.571	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-4.4	-168.3	-26	34.3	0	0	0	117.9	Q714	Q714-P718 WeakPolarHBondContact O-CG 3.36Å
719	H	69.6	Low	83.7	Confident	188 Å²	188	49 Å²	49	87%	0.87	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.6	-9.9	-171.5	-63.1	-23.9	0	0	0	114.6	H717	H717-H719 PolarHBondContact O-N 2.83Å
720	S	74.7	Confident	83.5	Confident	7 Å²	7	48.8 Å²	48.8	5%	0.049	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-12.7	-176.7	53.1	0	0	0	0	114.9	H717 D722 A723 V724 E782	H717-S720 WeakPolarHBondContact CB-OG 3.48Å; H717-S720 PolarHBondContact O-N 2.75Å; S720-D722 PolarHBondContact O-N 3.47Å; S720-A723 WeakPolarHBondContact O-CA 3Å; S720-A723 WeakPolarHBondContact O-CB 3.33Å; S720-A723 PolarHBondContact O-N 2.78Å; S720-V724 WeakPolarHBondContact O-CG2 3.31Å; S720-V724 PolarHBondContact O-N 3.44Å; S720-E782 WeakPolarHBondContact CB-OE2 3.5Å
721	A	78.7	Confident	83.4	Confident	5 Å²	5	51.4 Å²	51.4	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-50.2	-48.7	-171	0	0	0	0	0	115	L713 Q714 I725	L713-A721 HydrophobicContact CB-CB 3.6Å; L713-A721 HydrophobicContact CD1-CB 4.3Å; Q714-A721 HydrophobicContact CG-CB 4.03Å; A721-I725 WeakPolarHBondContact O-CG1 3.46Å; A721-I725 PolarHBondContact O-N 2.94Å
722	D	80.6	Confident	83.5	Confident	101 Å²	101	48.5 Å²	48.5	54%	0.54	24%	0.238	S	C	.	.	H	α-helix	trans	-73.8	-30.9	177.6	-71.7	-29.2	0	0	0	112.6	N706 S720 G726	N706-D722 PolarHBondContact ND2-OD1 2.98Å; S720-D722 PolarHBondContact O-N 3.47Å; D722-G726 PolarHBondContact O-N 3.18Å
723	A	82.2	Confident	83.4	Confident	13 Å²	13	46.5 Å²	46.5	11%	0.107	23%	0.226	C	C	.	.	H	α-helix	trans	-70.2	-46.3	178.5	0	0	0	0	0	111.3	S720 I725 G726 M727	S720-A723 WeakPolarHBondContact O-CA 3Å; S720-A723 WeakPolarHBondContact O-CB 3.33Å; S720-A723 PolarHBondContact O-N 2.78Å; A723-I725 PolarHBondContact O-N 2.97Å; A723-G726 CarbonylContact O-C 3.35Å; A723-G726 PolarHBondContact O-N 3.32Å; A723-M727 WeakPolarHBondContact O-CB 3.42Å; A723-M727 PolarHBondContact O-N 2.95Å
724	V	87.8	Confident	83.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-42.2	176.8	176.6	0	0	0	0	111.4	S720 M727 V728 L775 L778 A779 E782	S720-V724 WeakPolarHBondContact O-CG2 3.31Å; S720-V724 PolarHBondContact O-N 3.44Å; V724-M727 WeakPolarHBondContact O-CB 3.42Å; V724-M727 PolarHBondContact O-N 3.36Å; V724-V728 WeakPolarHBondContact O-CG2 3.48Å; V724-V728 PolarHBondContact O-N 2.96Å; V724-L775 HydrophobicContact CG1-CB 4.45Å; V724-L775 HydrophobicContact CG1-CD2 3.78Å; V724-L778 HydrophobicContact CG1-CB 3.7Å; V724-L778 HydrophobicContact CG1-CD1 4.28Å; V724-A779 HydrophobicContact CG2-CB 3.94Å; V724-E782 VanDerWaalsContact CG2-OE2 3.31Å; V724-E782 WeakPolarHBondContact CG2-OE2 3.42Å
725	I	89.2	Confident	82.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-40.9	175.9	-68.2	171.1	0	0	0	110.4	F702 M705 N706 L713 A721 A723 M727 V728 V729 L775	F702-I725 HydrophobicContact CD1-CG2 4.07Å; F702-I725 HydrophobicContact CE1-CG2 4.3Å; M705-I725 HydrophobicContact CB-CD1 4.25Å; M705-I725 HydrophobicContact CB-CG2 3.73Å; M705-I725 HydrophobicContact CE-CG1 4.48Å; M705-I725 HydrophobicContact CE-CG2 4.22Å; M705-I725 HydrophobicContact SD-CG2 4.24Å; N706-I725 WeakPolarHBondContact OD1-CD1 3.28Å; N706-I725 WeakPolarHBondContact OD1-CG2 3.45Å; L713-I725 HydrophobicContact CD1-CD1 3.84Å; L713-I725 HydrophobicContact CD1-CG1 4.08Å; A721-I725 WeakPolarHBondContact O-CG1 3.46Å; A721-I725 PolarHBondContact O-N 2.94Å; A723-I725 PolarHBondContact O-N 2.97Å; I725-M727 VanDerWaalsContact C-N 3.28Å; I725-M727 PolarHBondContact O-N 3.38Å; I725-V728 PolarHBondContact O-N 3.33Å; I725-V729 HydrophobicContact CG2-CG2 4.43Å; I725-V729 WeakPolarHBondContact O-CB 3.49Å; I725-V729 WeakPolarHBondContact O-CG2 3.34Å; I725-V729 PolarHBondContact O-N 3.45Å; I725-L775 HydrophobicContact CG1-CD1 4.44Å; I725-L775 HydrophobicContact CG1-CD2 4.07Å
726	G	87	Confident	81.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-32.2	171.9	0	0	0	0	0	114.3	D722 A723 G730 L738	D722-G726 PolarHBondContact O-N 3.18Å; A723-G726 CarbonylContact O-C 3.35Å; A723-G726 PolarHBondContact O-N 3.32Å; G726-G730 WeakPolarHBondContact O-CA 3.32Å; G726-G730 PolarHBondContact O-N 2.63Å; G726-L738 CarbonylContact C-O 3.42Å; G726-L738 VanDerWaalsContact CA-O 3.24Å; G726-L738 WeakPolarHBondContact CA-O 3.49Å; G726-L738 CarbonylContact O-C 3.6Å; G726-L738 WeakPolarHBondContact O-CB 3.44Å
727	M	86.1	Confident	81.4	Confident	24 Å²	24	36.7 Å²	36.7	12%	0.118	20%	0.2	C	C	.	.	H	α-helix	trans	-72	-46.8	176.8	-170.7	-175.2	-52.8	0	0	111.6	A723 V724 I725 G730 E731 A739 E782 R811	A723-M727 WeakPolarHBondContact O-CB 3.42Å; A723-M727 PolarHBondContact O-N 2.95Å; V724-M727 WeakPolarHBondContact O-CB 3.42Å; V724-M727 PolarHBondContact O-N 3.36Å; I725-M727 VanDerWaalsContact C-N 3.28Å; I725-M727 PolarHBondContact O-N 3.38Å; M727-G730 PolarHBondContact O-N 3.15Å; M727-E731 WeakPolarHBondContact O-CG 3.48Å; M727-E731 PolarHBondContact O-N 3.48Å; M727-A739 HydrophobicContact CB-CB 4.12Å; M727-A739 HydrophobicContact CG-CB 4.47Å; M727-E782 HydrophobicContact CE-CG 4.45Å; M727-E782 VanDerWaalsContact CE-OE1 3.27Å; M727-E782 WeakPolarHBondContact CE-OE1 3.32Å; M727-R811 VanDerWaalsContact CG-NH2 3.29Å; M727-R811 PolarHBondContact SD-NE 3.4Å; M727-R811 PolarHBondContact SD-NH2 3.07Å; M727-R811 VanDerWaalsContact SD-NH2 3.41Å
728	V	90.3	Very high	80.8	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-49.9	175.7	170.6	0	0	0	0	111.6	M705 V724 I725 G730 E731 M732 Y762 M771 L775 L778	M705-V728 HydrophobicContact CE-CG1 4.14Å; V724-V728 WeakPolarHBondContact O-CG2 3.48Å; V724-V728 PolarHBondContact O-N 2.96Å; I725-V728 PolarHBondContact O-N 3.33Å; V728-G730 VanDerWaalsContact C-N 3.25Å; V728-G730 PolarHBondContact O-N 3.39Å; V728-E731 PolarHBondContact O-N 2.72Å; V728-M732 HydrophobicContact CG1-CE 3.68Å; V728-M732 HydrophobicContact CG1-SD 4.34Å; V728-M732 WeakPolarHBondContact O-CG 3.29Å; V728-M732 PolarHBondContact O-N 3.19Å; V728-Y762 HydrophobicContact CG1-CE1 3.83Å; V728-M771 HydrophobicContact CG1-SD 4.37Å; V728-L775 HydrophobicContact CB-CD2 4.34Å; V728-L775 HydrophobicContact CG2-CD2 3.72Å; V728-L778 HydrophobicContact CG2-CD1 3.3Å
729	V	90	Very high	80.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.5	-34.5	177.2	179.8	0	0	0	0	110.6	L698 V701 F702 M705 I725 M732 V733 L738	L698-V729 HydrophobicContact CD2-CG1 3.94Å; V701-V729 HydrophobicContact CG1-CG2 3.86Å; F702-V729 HydrophobicContact CD2-CG1 4.15Å; F702-V729 HydrophobicContact CE1-CB 4.44Å; F702-V729 HydrophobicContact CE2-CB 4.04Å; F702-V729 HydrophobicContact CE2-CG1 3.58Å; F702-V729 HydrophobicContact CZ-CB 3.9Å; F702-V729 HydrophobicContact CZ-CG1 3.97Å; F702-V729 HydrophobicContact CZ-CG2 4.44Å; M705-V729 HydrophobicContact SD-CG2 3.68Å; I725-V729 HydrophobicContact CG2-CG2 4.43Å; I725-V729 WeakPolarHBondContact O-CB 3.49Å; I725-V729 WeakPolarHBondContact O-CG2 3.34Å; I725-V729 PolarHBondContact O-N 3.45Å; V729-M732 PolarHBondContact O-N 2.77Å; V729-V733 WeakPolarHBondContact O-CG2 3.35Å; V729-V733 PolarHBondContact O-N 2.76Å; V729-L738 HydrophobicContact CG1-CD1 4.24Å
730	G	87.3	Confident	79.8	Confident	3 Å²	3	26.1 Å²	26.1	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-54.6	-51.5	169.8	0	0	0	0	0	113.1	G726 M727 V728 V733 D734 R735	G726-G730 WeakPolarHBondContact O-CA 3.32Å; G726-G730 PolarHBondContact O-N 2.63Å; M727-G730 PolarHBondContact O-N 3.15Å; V728-G730 VanDerWaalsContact C-N 3.25Å; V728-G730 PolarHBondContact O-N 3.39Å; G730-V733 CarbonylContact O-C 3.42Å; G730-V733 PolarHBondContact O-N 3.46Å; G730-D734 CarbonylContact O-C 3.5Å; G730-D734 WeakPolarHBondContact O-CA 3.46Å; G730-D734 PolarHBondContact O-N 2.79Å; G730-R735 VanDerWaalsContact CA-O 3.23Å; G730-R735 WeakPolarHBondContact CA-O 3.37Å; G730-R735 PolarHBondContact O-N 3.15Å
731	E	87.7	Confident	78.5	Confident	66 Å²	66	30.1 Å²	30.1	31%	0.308	19%	0.193	S	C	.	.	H	α-helix	trans	-67.4	-38.2	179.3	-72.6	-180	147.6	0	0	113	M727 V728 V733 D734 Y762 R811	M727-E731 WeakPolarHBondContact O-CG 3.48Å; M727-E731 PolarHBondContact O-N 3.48Å; V728-E731 PolarHBondContact O-N 2.72Å; E731-V733 PolarHBondContact O-N 3.27Å; E731-V733 VanDerWaalsContact O-N 3.15Å; E731-D734 PolarHBondContact O-N 3.39Å; E731-Y762 HydrophobicContact CB-CD2 4Å; E731-Y762 HydrophobicContact CB-CE2 3.54Å; E731-Y762 PolarHBondContact OE2-OH 3.12Å; E731-R811 VanDerWaalsContact CD-NH1 3.28Å; E731-R811 VanDerWaalsContact CD-NH2 3.27Å; E731-R811 IonicContact OE1-CZ 2.61Å; E731-R811 VanDerWaalsContact OE1-CZ 3.25Å; E731-R811 IonicContact OE1-NH1 2.67Å; E731-R811 PolarHBondContact OE1-NH1 3.4Å; E731-R811 IonicContact OE1-NH2 3.02Å; E731-R811 PolarHBondContact OE1-NH2 3.28Å; E731-R811 IonicContact OE2-CZ 3.89Å; E731-R811 IonicContact OE2-NH1 3.54Å; E731-R811 PolarHBondContact OE2-NH1 3.09Å; E731-R811 IonicContact OE2-NH2 2.95Å
732	M	90.2	Very high	77.3	Confident	10 Å²	10	38.5 Å²	38.5	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-27.7	175	-72	175.7	176.8	0	0	113.5	V728 V729 L754 Q758 F759 Y762 M771	V728-M732 HydrophobicContact CG1-CE 3.68Å; V728-M732 HydrophobicContact CG1-SD 4.34Å; V728-M732 WeakPolarHBondContact O-CG 3.29Å; V728-M732 PolarHBondContact O-N 3.19Å; V729-M732 PolarHBondContact O-N 2.77Å; M732-L754 HydrophobicContact CB-CD1 3.85Å; M732-L754 HydrophobicContact SD-CD2 4.18Å; M732-Q758 WeakPolarHBondContact O-CB 3.27Å; M732-F759 HydrophobicContact CE-CD2 3.67Å; M732-F759 HydrophobicContact CE-CE2 3.99Å; M732-F759 HydrophobicContact SD-CD2 3.96Å; M732-Y762 HydrophobicContact CE-CD1 3.48Å; M732-Y762 VanDerWaalsContact CE-CD1 3.48Å; M732-Y762 HydrophobicContact CE-CE1 4.04Å; M732-Y762 HydrophobicContact CE-CG 3.94Å; M732-Y762 HydrophobicContact CG-CD1 4.11Å; M732-Y762 HydrophobicContact CG-CD2 3.89Å; M732-Y762 HydrophobicContact CG-CG 3.59Å; M732-M771 HydrophobicContact CE-CE 4.02Å
733	V	86.6	Confident	76	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.012	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.3	26.5	176.6	-61.5	0	0	0	0	113.7	W460 L698 V729 G730 E731 R735 L738 L754	W460-V733 HydrophobicContact CH2-CB 4.34Å; W460-V733 HydrophobicContact CZ2-CB 3.88Å; W460-V733 WeakPolarHBondContact CZ2-O 3.43Å; W460-V733 PolarHBondContact NE1-O 2.79Å; L698-V733 HydrophobicContact CD1-CG2 4.04Å; L698-V733 HydrophobicContact CD2-CG1 4.24Å; L698-V733 HydrophobicContact CD2-CG2 4.48Å; V729-V733 WeakPolarHBondContact O-CG2 3.35Å; V729-V733 PolarHBondContact O-N 2.76Å; G730-V733 CarbonylContact O-C 3.42Å; G730-V733 PolarHBondContact O-N 3.46Å; E731-V733 PolarHBondContact O-N 3.27Å; E731-V733 VanDerWaalsContact O-N 3.15Å; V733-R735 HydrophobicContact CG2-CB 4.03Å; V733-R735 HydrophobicContact CG2-CG 3.77Å; V733-R735 WeakPolarHBondContact O-CG 3.24Å; V733-R735 PolarHBondContact O-N 3.34Å; V733-L738 HydrophobicContact CG2-CD1 3.96Å; V733-L754 HydrophobicContact CG1-CB 4.37Å; V733-L754 HydrophobicContact CG1-CD1 3.72Å
734	D	83.8	Confident	74.8	Confident	61 Å²	61	36.8 Å²	36.8	33%	0.326	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	36.4	176.6	-92.7	-33	0	0	0	115.5	Y619 K642 G730 E731	Y619-D734 HydrophobicContact CE2-CB 4.44Å; Y619-D734 PolarHBondContact OH-OD2 2.98Å; K642-D734 WeakPolarHBondContact CE-OD2 3.42Å; K642-D734 IonicContact NZ-OD1 2.66Å; K642-D734 PolarHBondContact NZ-OD1 2.83Å; K642-D734 IonicContact NZ-OD2 2.73Å; K642-D734 PolarHBondContact NZ-OD2 3.41Å; G730-D734 CarbonylContact O-C 3.5Å; G730-D734 WeakPolarHBondContact O-CA 3.46Å; G730-D734 PolarHBondContact O-N 2.79Å; E731-D734 PolarHBondContact O-N 3.39Å
735	R	75.8	Confident	73.5	Confident	13 Å²	13	41.6 Å²	41.6	5%	0.049	26%	0.264	C	S	.	.			trans	-113.4	97.1	-176.9	-76	-88.4	-58.6	-74	8.8	111.1	A461 G730 V733 D737 L738 D752	A461-R735 HydrophobicContact CB-CG 4.35Å; A461-R735 PolarHBondContact O-NH1 3.12Å; G730-R735 VanDerWaalsContact CA-O 3.23Å; G730-R735 WeakPolarHBondContact CA-O 3.37Å; G730-R735 PolarHBondContact O-N 3.15Å; V733-R735 HydrophobicContact CG2-CB 4.03Å; V733-R735 HydrophobicContact CG2-CG 3.77Å; V733-R735 WeakPolarHBondContact O-CG 3.24Å; V733-R735 PolarHBondContact O-N 3.34Å; R735-D737 VanDerWaalsContact C-N 3.26Å; R735-D737 WeakPolarHBondContact CD-OD1 3.44Å; R735-D737 IonicContact CZ-OD1 3.48Å; R735-D737 IonicContact CZ-OD2 2.71Å; R735-D737 VanDerWaalsContact CZ-OD2 3.32Å; R735-D737 VanDerWaalsContact NE-CG 3.31Å; R735-D737 IonicContact NE-OD1 3.25Å; R735-D737 PolarHBondContact NE-OD1 2.96Å; R735-D737 IonicContact NE-OD2 3.95Å; R735-D737 PolarHBondContact NE-OD2 3.37Å; R735-D737 VanDerWaalsContact NE-OD2 3.07Å; R735-D737 IonicContact NH2-OD1 2.7Å; R735-D737 IonicContact NH2-OD2 2.76Å; R735-D737 PolarHBondContact NH2-OD2 3.37Å; R735-D737 PolarHBondContact O-N 2.93Å; R735-L738 HydrophobicContact CB-CB 4.46Å; R735-L738 HydrophobicContact CB-CD1 3.79Å; R735-L738 HydrophobicContact CB-CG 3.71Å; R735-L738 HydrophobicContact CG-CD1 4.36Å; R735-L738 PolarHBondContact O-N 2.97Å; R735-D752 IonicContact CZ-OD2 3.37Å; R735-D752 IonicContact NH1-OD2 3.89Å; R735-D752 PolarHBondContact NH1-OD2 2.93Å; R735-D752 IonicContact NH2-OD2 2.69Å
736	S	67.4	Low	72	Confident	83 Å²	83	44.1 Å²	44.1	58%	0.58	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-68.7	-21.4	178.6	56.8	0	0	0	0	114.2	L738	S736-L738 VanDerWaalsContact C-N 3.31Å; S736-L738 PolarHBondContact O-N 3.47Å
737	D	65.9	Low	70.6	Confident	68 Å²	68	47.5 Å²	47.5	36%	0.364	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-73.9	-17.1	177.3	61.5	-62.5	0	0	0	113.9	R735 A739	R735-D737 VanDerWaalsContact C-N 3.26Å; R735-D737 WeakPolarHBondContact CD-OD1 3.44Å; R735-D737 IonicContact CZ-OD1 3.48Å; R735-D737 IonicContact CZ-OD2 2.71Å; R735-D737 VanDerWaalsContact CZ-OD2 3.32Å; R735-D737 VanDerWaalsContact NE-CG 3.31Å; R735-D737 IonicContact NE-OD1 3.25Å; R735-D737 PolarHBondContact NE-OD1 2.96Å; R735-D737 IonicContact NE-OD2 3.95Å; R735-D737 PolarHBondContact NE-OD2 3.37Å; R735-D737 VanDerWaalsContact NE-OD2 3.07Å; R735-D737 IonicContact NH2-OD1 2.7Å; R735-D737 IonicContact NH2-OD2 2.76Å; R735-D737 PolarHBondContact NH2-OD2 3.37Å; R735-D737 PolarHBondContact O-N 2.93Å; D737-A739 VanDerWaalsContact C-N 3.29Å; D737-A739 PolarHBondContact O-N 3.21Å
738	L	67.7	Low	69.4	Low	2 Å²	2	48.3 Å²	48.3	1%	0.01	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-72.5	-20.1	176.9	-66.3	-172.4	0	0	0	113.5	L698 F702 G726 V729 V733 R735 S736 A740 P744 L749	L698-L738 HydrophobicContact CD1-CD1 3.79Å; F702-L738 HydrophobicContact CE2-CD1 4.26Å; F702-L738 HydrophobicContact CE2-CD2 4.47Å; F702-L738 HydrophobicContact CZ-CB 4.38Å; F702-L738 HydrophobicContact CZ-CD1 4.44Å; G726-L738 CarbonylContact C-O 3.42Å; G726-L738 VanDerWaalsContact CA-O 3.24Å; G726-L738 WeakPolarHBondContact CA-O 3.49Å; G726-L738 CarbonylContact O-C 3.6Å; G726-L738 WeakPolarHBondContact O-CB 3.44Å; V729-L738 HydrophobicContact CG1-CD1 4.24Å; V733-L738 HydrophobicContact CG2-CD1 3.96Å; R735-L738 HydrophobicContact CB-CB 4.46Å; R735-L738 HydrophobicContact CB-CD1 3.79Å; R735-L738 HydrophobicContact CB-CG 3.71Å; R735-L738 HydrophobicContact CG-CD1 4.36Å; R735-L738 PolarHBondContact O-N 2.97Å; S736-L738 VanDerWaalsContact C-N 3.31Å; S736-L738 PolarHBondContact O-N 3.47Å; L738-A740 VanDerWaalsContact C-N 3.29Å; L738-A740 PolarHBondContact O-N 2.7Å; L738-P744 HydrophobicContact CD2-CG 3.53Å; L738-L749 HydrophobicContact CD2-CD2 3.68Å
739	A	59.1	Low	68.2	Low	35 Å²	35	48.9 Å²	48.9	29%	0.289	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-81	-1.9	-179.8	0	0	0	0	0	114.2	M727 D737	M727-A739 HydrophobicContact CB-CB 4.12Å; M727-A739 HydrophobicContact CG-CB 4.47Å; D737-A739 VanDerWaalsContact C-N 3.29Å; D737-A739 PolarHBondContact O-N 3.21Å
740	A	58.2	Low	66.9	Low	54 Å²	54	51.6 Å²	51.6	45%	0.446	35%	0.346	S	S	.	.	S	Bend	trans	-73.9	136.9	-176.9	0	0	0	0	0	112.3	L738 H742 G743	L738-A740 VanDerWaalsContact C-N 3.29Å; L738-A740 PolarHBondContact O-N 2.7Å; A740-H742 CarbonylContact O-C 3.56Å; A740-H742 PolarHBondContact O-N 3.48Å; A740-G743 PolarHBondContact O-N 2.7Å
741	A	47.1	Very low	65.8	Low	92 Å²	92	58.3 Å²	58.3	76%	0.76	37%	0.37	S	S	*	.	S	Bend	trans	-61.2	0.4	179.3	0	0	0	0	0	115.6
742	H	52.5	Low	65.3	Low	180 Å²	180	55.3 Å²	55.3	83%	0.833	36%	0.356	S	S	*	.	S	Bend	trans	-121.1	73.2	165.3	-64.8	-11.6	0	0	0	107.8	A740	A740-H742 CarbonylContact O-C 3.56Å; A740-H742 PolarHBondContact O-N 3.48Å
743	G	53.5	Low	65.1	Low	52 Å²	52	55.3 Å²	55.3	54%	0.536	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-52.8	149	-174.3	0	0	0	0	0	112.8	A740	A740-G743 PolarHBondContact O-N 2.7Å
744	P	58	Low	65.3	Low	27 Å²	27	55.3 Å²	55.3	18%	0.175	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-60.3	149.5	-165.8	-21.5	29.9	0	0	0	113.1	L738 A746 L749	L738-P744 HydrophobicContact CD2-CG 3.53Å; P744-A746 PolarHBondContact O-N 3.32Å; P744-L749 HydrophobicContact CB-CD1 4.47Å; P744-L749 HydrophobicContact CB-CD2 4.33Å; P744-L749 HydrophobicContact CB-CG 4.17Å; P744-L749 HydrophobicContact CG-CD2 4.21Å
745	P	59.4	Low	65.7	Low	100 Å²	100	52.4 Å²	52.4	65%	0.649	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-57.2	130.3	176.8	24.9	-34.2	0	0	0	109.8	A747 A748	P745-A747 PolarHBondContact O-N 3.14Å; P745-A748 WeakPolarHBondContact O-CB 3.43Å; P745-A748 PolarHBondContact O-N 2.75Å
746	A	59.3	Low	66.5	Low	54 Å²	54	51.8 Å²	51.8	45%	0.446	34%	0.339	S	S	.	.	H	α-helix	trans	-53.4	-23.7	-170.8	0	0	0	0	0	115.1	P744 A748 L749 S750	P744-A746 PolarHBondContact O-N 3.32Å; A746-A748 PolarHBondContact O-N 2.84Å; A746-L749 PolarHBondContact O-N 3.27Å; A746-S750 WeakPolarHBondContact O-CB 3.5Å; A746-S750 PolarHBondContact O-N 2.98Å; A746-S750 PolarHBondContact O-OG 3.46Å
747	A	56	Low	67.6	Low	71 Å²	71	48.1 Å²	48.1	59%	0.587	31%	0.312	S	S	*	.	H	α-helix	trans	-67.9	-17	173.9	0	0	0	0	0	114.9	P745 S750	P745-A747 PolarHBondContact O-N 3.14Å; A747-S750 WeakPolarHBondContact CA-OG 3.45Å; A747-S750 PolarHBondContact O-OG 3.42Å
748	A	62.3	Low	68.9	Low	41 Å²	41	45.6 Å²	45.6	34%	0.339	30%	0.298	S	S	.	.	H	α-helix	trans	-82.7	-55	167.1	0	0	0	0	0	110	P745 A746 S750 R751	P745-A748 WeakPolarHBondContact O-CB 3.43Å; P745-A748 PolarHBondContact O-N 2.75Å; A746-A748 PolarHBondContact O-N 2.84Å; A748-S750 PolarHBondContact O-N 3.37Å; A748-R751 WeakPolarHBondContact O-CB 3.49Å; A748-R751 PolarHBondContact O-N 2.81Å
749	L	65.3	Low	70.2	Confident	13 Å²	13	45.8 Å²	45.8	7%	0.068	30%	0.299	C	S	.	.	H	α-helix	trans	-58.1	-21.8	179.1	-63	174.5	0	0	0	114.3	L698 D699 F702 L738 P744 A746 R751	L698-L749 HydrophobicContact CB-CB 4.4Å; L698-L749 HydrophobicContact CB-CD2 4.15Å; L698-L749 HydrophobicContact CD1-CD2 4.28Å; L698-L749 PolarHBondContact N-O 2.89Å; D699-L749 HydrophobicContact CB-CB 4.07Å; D699-L749 WeakPolarHBondContact CB-O 3.26Å; D699-L749 PolarHBondContact N-O 3.12Å; F702-L749 HydrophobicContact CD2-CD1 3.89Å; F702-L749 HydrophobicContact CD2-CD2 4.17Å; F702-L749 HydrophobicContact CE2-CD1 4.1Å; F702-L749 HydrophobicContact CE2-CD2 3.82Å; F702-L749 HydrophobicContact CG-CD1 4.43Å; L738-L749 HydrophobicContact CD2-CD2 3.68Å; P744-L749 HydrophobicContact CB-CD1 4.47Å; P744-L749 HydrophobicContact CB-CD2 4.33Å; P744-L749 HydrophobicContact CB-CG 4.17Å; P744-L749 HydrophobicContact CG-CD2 4.21Å; A746-L749 PolarHBondContact O-N 3.27Å; L749-R751 PolarHBondContact O-N 3.04Å
750	S	60.9	Low	71.7	Confident	57 Å²	57	45 Å²	45	40%	0.399	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.5	174.6	63.8	0	0	0	0	114.5	A746 A747 A748	A746-S750 WeakPolarHBondContact O-CB 3.5Å; A746-S750 PolarHBondContact O-N 2.98Å; A746-S750 PolarHBondContact O-OG 3.46Å; A747-S750 WeakPolarHBondContact CA-OG 3.45Å; A747-S750 PolarHBondContact O-OG 3.42Å; A748-S750 PolarHBondContact O-N 3.37Å
751	R	64.8	Low	73.2	Confident	143 Å²	143	46.8 Å²	46.8	54%	0.54	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-35.7	176.3	-71.3	-177.4	160.6	129.5	-2	112.8	A748 L749	A748-R751 WeakPolarHBondContact O-CB 3.49Å; A748-R751 PolarHBondContact O-N 2.81Å; L749-R751 PolarHBondContact O-N 3.04Å
752	D	77.9	Confident	75.4	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	26%	0.256	C	S	.	.			trans	-68.3	142.1	178	-57.9	-25.6	0	0	0	110.9	A461 S465 T697 L698 R735	A461-D752 HydrophobicContact CB-CB 4.28Å; S465-D752 VanDerWaalsContact CB-OD1 3.23Å; S465-D752 WeakPolarHBondContact CB-OD1 3.46Å; S465-D752 PolarHBondContact OG-OD1 3.14Å; T697-D752 CarbonylContact C-O 3.5Å; T697-D752 VanDerWaalsContact CA-O 3.25Å; T697-D752 WeakPolarHBondContact CA-O 3.24Å; L698-D752 HydrophobicContact CB-CB 4.32Å; L698-D752 HydrophobicContact CD1-CB 3.47Å; L698-D752 VanDerWaalsContact CD1-CB 3.47Å; L698-D752 HydrophobicContact CG-CB 3.68Å; L698-D752 PolarHBondContact N-O 3.03Å; R735-D752 IonicContact CZ-OD2 3.37Å; R735-D752 IonicContact NH1-OD2 3.89Å; R735-D752 PolarHBondContact NH1-OD2 2.93Å; R735-D752 IonicContact NH2-OD2 2.69Å
753	V	85.6	Confident	77.3	Confident	10 Å²	10	34 Å²	34	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.9	-173	-176.5	0	0	0	0	110.5	I615 H695 T696	I615-V753 HydrophobicContact CD1-CB 3.89Å; I615-V753 HydrophobicContact CD1-CG1 3.56Å; H695-V753 HydrophobicContact CB-CG1 3.65Å; T696-V753 CarbonylContact O-C 3.59Å; T696-V753 WeakPolarHBondContact O-CA 3.35Å; T696-V753 WeakPolarHBondContact O-CG1 3.21Å
754	L	90.8	Very high	79	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	133.4	168.7	174.1	68.4	0	0	0	109.1	W684 H695 T696 L698 V701 M732 V733 Q758 F759	W684-L754 HydrophobicContact CZ3-CD2 4.05Å; W684-L754 HydrophobicContact CZ3-CG 4.17Å; H695-L754 CarbonylContact C-O 3.49Å; H695-L754 VanDerWaalsContact CA-O 3.25Å; H695-L754 WeakPolarHBondContact CA-O 3.16Å; T696-L754 PolarHBondContact N-O 3.32Å; T696-L754 PolarHBondContact O-N 3.19Å; L698-L754 HydrophobicContact CD2-CB 3.71Å; V701-L754 HydrophobicContact CG1-CD2 4.31Å; V701-L754 HydrophobicContact CG2-CB 4.47Å; V701-L754 HydrophobicContact CG2-CD2 3.89Å; M732-L754 HydrophobicContact CB-CD1 3.85Å; M732-L754 HydrophobicContact SD-CD2 4.18Å; V733-L754 HydrophobicContact CG1-CB 4.37Å; V733-L754 HydrophobicContact CG1-CD1 3.72Å; L754-Q758 HydrophobicContact CD1-CB 3.51Å; L754-F759 HydrophobicContact CD2-CB 4.34Å
755	T	92.3	Very high	80.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	156.1	169.8	75.9	0	0	0	0	111.6	A612 I615 H616 F694 F757 Q758 F759	A612-T755 HydrophobicContact CB-CG2 4.35Å; I615-T755 HydrophobicContact CB-CG2 4.13Å; I615-T755 HydrophobicContact CD1-CG2 3.97Å; I615-T755 HydrophobicContact CG2-CG2 3.92Å; H616-T755 PolarHBondContact CE1-OG1 2.85Å; H616-T755 PolarHBondContact NE2-OG1 3.41Å; F694-T755 CarbonylContact O-C 3.6Å; F694-T755 VanDerWaalsContact O-CA 3.26Å; F694-T755 WeakPolarHBondContact O-CA 3.48Å; T755-F757 PolarHBondContact O-N 3.46Å; T755-F757 PolarHBondContact OG1-N 3.45Å; T755-Q758 WeakPolarHBondContact O-CB 3.49Å; T755-Q758 PolarHBondContact O-N 3.09Å; T755-Q758 PolarHBondContact OG1-N 3.11Å; T755-Q758 VanDerWaalsContact OG1-N 3.09Å; T755-F759 PolarHBondContact O-N 3.42Å; T755-F759 VanDerWaalsContact O-N 3.09Å
756	V	92.2	Very high	81.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-26.4	174	71.7	0	0	0	0	111.7	A667 L671 L674 W684 F694 F759 H760	A667-V756 HydrophobicContact CB-CG1 4.46Å; A667-V756 HydrophobicContact CB-CG2 4.01Å; L671-V756 HydrophobicContact CD1-CB 4.44Å; L671-V756 HydrophobicContact CD1-CG1 3.9Å; L671-V756 HydrophobicContact CD1-CG2 3.94Å; L674-V756 HydrophobicContact CD2-CG2 3.99Å; W684-V756 HydrophobicContact CD2-CB 4.05Å; W684-V756 HydrophobicContact CD2-CG2 3.67Å; W684-V756 HydrophobicContact CE3-CB 4.42Å; W684-V756 HydrophobicContact CE3-CG2 4.24Å; W684-V756 HydrophobicContact CG-CG2 3.91Å; W684-V756 HydrophobicContact CH2-CB 3.98Å; W684-V756 HydrophobicContact CZ2-CB 3.56Å; W684-V756 HydrophobicContact CZ2-CG2 4.12Å; W684-V756 HydrophobicContact CZ3-CB 4.38Å; F694-V756 HydrophobicContact CB-CG1 4.41Å; F694-V756 HydrophobicContact CD1-CG1 3.99Å; F694-V756 PolarHBondContact O-N 2.82Å; V756-F759 PolarHBondContact O-N 3.03Å; V756-H760 WeakPolarHBondContact O-CB 2.99Å; V756-H760 PolarHBondContact O-N 2.97Å
757	F	91.9	Very high	82.8	Confident	6 Å²	6	39.4 Å²	39.4	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-72.7	-39.3	177.3	-51.1	-77.2	0	0	0	111.6	A612 H616 L649 L653 V670 L671 F694 T755 N761	A612-F757 HydrophobicContact CB-CE2 4.22Å; H616-F757 AromaticContact NE2-CD2 3.99Å; L649-F757 HydrophobicContact CD1-CB 3.82Å; L649-F757 HydrophobicContact CD1-CD1 3.71Å; L649-F757 HydrophobicContact CD1-CG 3.88Å; L649-F757 HydrophobicContact CD2-CB 3.79Å; L649-F757 HydrophobicContact CG-CB 4.45Å; L653-F757 HydrophobicContact CD2-CD1 4.4Å; L653-F757 HydrophobicContact CD2-CD2 4.28Å; L653-F757 HydrophobicContact CD2-CE1 3.82Å; L653-F757 HydrophobicContact CD2-CE2 3.68Å; L653-F757 HydrophobicContact CD2-CZ 3.43Å; L653-F757 VanDerWaalsContact CD2-CZ 3.43Å; V670-F757 HydrophobicContact CG1-CE1 3.85Å; V670-F757 HydrophobicContact CG1-CZ 4.03Å; L671-F757 HydrophobicContact CD1-CD1 4.03Å; L671-F757 HydrophobicContact CD1-CE1 4.16Å; L671-F757 HydrophobicContact CD2-CD1 4Å; L671-F757 HydrophobicContact CD2-CE1 4.02Å; L671-F757 HydrophobicContact CG-CD1 4.34Å; L671-F757 HydrophobicContact CG-CE1 4.13Å; F694-F757 HydrophobicContact CB-CE2 4.16Å; F694-F757 AromaticContact CD1-CE2 3.93Å; F694-F757 HydrophobicContact CD1-CE2 3.93Å; F694-F757 AromaticContact CD1-CZ 3.75Å; F694-F757 HydrophobicContact CD1-CZ 3.75Å; F694-F757 HydrophobicContact CE1-CZ 4.19Å; F694-F757 HydrophobicContact CG-CE2 4.32Å; T755-F757 PolarHBondContact O-N 3.46Å; T755-F757 PolarHBondContact OG1-N 3.45Å; F757-N761 VanDerWaalsContact O-CB 3.24Å; F757-N761 WeakPolarHBondContact O-CB 3.43Å; F757-N761 PolarHBondContact O-N 3.38Å
758	Q	92.5	Very high	84.5	Confident	16 Å²	16	36 Å²	36	8%	0.075	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-46.7	169.4	-78.8	164.8	-25.4	0	0	111.7	M732 L754 T755 H760 N761 Y762	M732-Q758 WeakPolarHBondContact O-CB 3.27Å; L754-Q758 HydrophobicContact CD1-CB 3.51Å; T755-Q758 WeakPolarHBondContact O-CB 3.49Å; T755-Q758 PolarHBondContact O-N 3.09Å; T755-Q758 PolarHBondContact OG1-N 3.11Å; T755-Q758 VanDerWaalsContact OG1-N 3.09Å; Q758-H760 PolarHBondContact O-N 3.48Å; Q758-N761 PolarHBondContact O-N 3.29Å; Q758-Y762 PolarHBondContact O-N 3.38Å
759	F	93.6	Very high	85.7	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-59.6	-45.7	176	177.3	-104.8	0	0	0	112.2	L674 L683 W684 M732 L754 T755 V756 Y762 I763 M771	L674-F759 HydrophobicContact CD1-CE1 4.32Å; L674-F759 HydrophobicContact CD2-CD1 4.21Å; L674-F759 HydrophobicContact CD2-CE1 4.32Å; L683-F759 HydrophobicContact CD2-CE2 4.31Å; L683-F759 HydrophobicContact CD2-CZ 4.2Å; L683-F759 HydrophobicContact CG-CZ 4.41Å; W684-F759 HydrophobicContact CB-CD1 4.2Å; W684-F759 HydrophobicContact CB-CE1 3.78Å; W684-F759 HydrophobicContact CB-CZ 4.36Å; W684-F759 HydrophobicContact CD2-CD1 4.4Å; W684-F759 HydrophobicContact CE3-CB 3.96Å; W684-F759 AromaticContact CE3-CD1 3.86Å; W684-F759 HydrophobicContact CE3-CD1 3.86Å; W684-F759 HydrophobicContact CE3-CD2 4.38Å; W684-F759 HydrophobicContact CE3-CE1 4.44Å; W684-F759 AromaticContact CE3-CG 3.83Å; W684-F759 HydrophobicContact CE3-CG 3.83Å; W684-F759 HydrophobicContact CZ3-CB 4.02Å; W684-F759 HydrophobicContact CZ3-CG 4.35Å; M732-F759 HydrophobicContact CE-CD2 3.67Å; M732-F759 HydrophobicContact CE-CE2 3.99Å; M732-F759 HydrophobicContact SD-CD2 3.96Å; L754-F759 HydrophobicContact CD2-CB 4.34Å; T755-F759 PolarHBondContact O-N 3.42Å; T755-F759 VanDerWaalsContact O-N 3.09Å; V756-F759 PolarHBondContact O-N 3.03Å; F759-Y762 PolarHBondContact O-N 3.13Å; F759-I763 HydrophobicContact CD1-CD1 3.71Å; F759-I763 HydrophobicContact CD2-CD1 4.43Å; F759-I763 HydrophobicContact CE1-CD1 3.36Å; F759-I763 HydrophobicContact CE2-CD1 4.13Å; F759-I763 HydrophobicContact CG-CD1 4.24Å; F759-I763 HydrophobicContact CZ-CD1 3.6Å; F759-I763 WeakPolarHBondContact O-CD1 3.45Å; F759-I763 WeakPolarHBondContact O-CG1 3.5Å; F759-I763 PolarHBondContact O-N 3.45Å; F759-I763 VanDerWaalsContact O-N 3.11Å; F759-M771 HydrophobicContact CE2-CE 4.37Å
760	H	91.9	Very high	86.9	Confident	18 Å²	18	40.3 Å²	40.3	8%	0.083	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-41.2	176.8	177.9	-122.9	0	0	0	112.8	L671 S673 L674 V756 Q758 Y762 I763 L764	L671-H760 HydrophobicContact CD1-CB 3.82Å; S673-H760 PolarHBondContact OG-CE1 3.16Å; S673-H760 PolarHBondContact OG-NE2 3.16Å; L674-H760 HydrophobicContact CD2-CB 4.46Å; V756-H760 WeakPolarHBondContact O-CB 2.99Å; V756-H760 PolarHBondContact O-N 2.97Å; Q758-H760 PolarHBondContact O-N 3.48Å; H760-Y762 VanDerWaalsContact C-N 3.34Å; H760-Y762 PolarHBondContact O-N 3.26Å; H760-I763 WeakPolarHBondContact O-CB 3.48Å; H760-I763 PolarHBondContact O-N 2.89Å; H760-I763 VanDerWaalsContact O-N 3.17Å; H760-L764 VanDerWaalsContact CE1-CD1 3.49Å; H760-L764 WeakPolarHBondContact CE1-CD1 3.38Å; H760-L764 PolarHBondContact O-N 3.17Å
761	N	90.4	Very high	88.5	Confident	91 Å²	91	37.6 Å²	37.6	49%	0.487	18%	0.179	S	C	.	.	H	α-helix	trans	-61.7	-42.2	176.3	-176.9	74.8	0	0	0	111.4	F757 Q758 I763 L764 Q765	F757-N761 VanDerWaalsContact O-CB 3.24Å; F757-N761 WeakPolarHBondContact O-CB 3.43Å; F757-N761 PolarHBondContact O-N 3.38Å; Q758-N761 PolarHBondContact O-N 3.29Å; N761-I763 VanDerWaalsContact C-N 3.34Å; N761-I763 PolarHBondContact O-N 3.1Å; N761-L764 PolarHBondContact O-N 3.48Å; N761-Q765 WeakPolarHBondContact O-CB 3.1Å; N761-Q765 PolarHBondContact O-N 3.46Å
762	Y	91.6	Very high	89.8	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-59.4	-45	172.9	-175.5	-90.6	0	0	0	111.9	V728 E731 M732 Q758 F759 H760 L764 Q765 H766 V768 H774	V728-Y762 HydrophobicContact CG1-CE1 3.83Å; E731-Y762 HydrophobicContact CB-CD2 4Å; E731-Y762 HydrophobicContact CB-CE2 3.54Å; E731-Y762 PolarHBondContact OE2-OH 3.12Å; M732-Y762 HydrophobicContact CE-CD1 3.48Å; M732-Y762 VanDerWaalsContact CE-CD1 3.48Å; M732-Y762 HydrophobicContact CE-CE1 4.04Å; M732-Y762 HydrophobicContact CE-CG 3.94Å; M732-Y762 HydrophobicContact CG-CD1 4.11Å; M732-Y762 HydrophobicContact CG-CD2 3.89Å; M732-Y762 HydrophobicContact CG-CG 3.59Å; Q758-Y762 PolarHBondContact O-N 3.38Å; F759-Y762 PolarHBondContact O-N 3.13Å; H760-Y762 VanDerWaalsContact C-N 3.34Å; H760-Y762 PolarHBondContact O-N 3.26Å; Y762-L764 VanDerWaalsContact C-N 3.34Å; Y762-L764 PolarHBondContact O-N 3.48Å; Y762-Q765 PolarHBondContact O-N 2.95Å; Y762-H766 AromaticContact CD2-CD2 3.57Å; Y762-H766 AromaticContact CD2-NE2 3.86Å; Y762-H766 AromaticContact CE2-CD2 3.31Å; Y762-H766 WeakPolarHBondContact CE2-CD2 3.4Å; Y762-H766 AromaticContact CE2-NE2 3.38Å; Y762-H766 WeakPolarHBondContact CE2-NE2 3.36Å; Y762-H766 AromaticContact CZ-CD2 3.6Å; Y762-H766 AromaticContact CZ-NE2 3.95Å; Y762-H766 WeakPolarHBondContact O-CB 3.41Å; Y762-H766 PolarHBondContact O-CD2 3.4Å; Y762-H766 PolarHBondContact O-N 2.9Å; Y762-V768 HydrophobicContact CE1-CG2 4.34Å; Y762-H774 AromaticContact CE1-NE2 3.48Å; Y762-H774 WeakPolarHBondContact CE1-NE2 3.35Å; Y762-H774 AromaticContact CZ-NE2 3.63Å; Y762-H774 PolarHBondContact OH-NE2 2.6Å
763	I	92.3	Very high	90.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-41.1	176.8	-74.7	163.9	0	0	0	112.1	L674 L680 F759 H760 N761 D767 V768	L674-I763 HydrophobicContact CD1-CD1 3.71Å; L680-I763 HydrophobicContact CB-CD1 4.02Å; L680-I763 HydrophobicContact CD1-CD1 3.82Å; L680-I763 HydrophobicContact CD1-CG1 4.08Å; L680-I763 HydrophobicContact CD1-CG2 3.85Å; L680-I763 HydrophobicContact CD2-CD1 4.48Å; L680-I763 HydrophobicContact CG-CD1 4.33Å; F759-I763 HydrophobicContact CD1-CD1 3.71Å; F759-I763 HydrophobicContact CD2-CD1 4.43Å; F759-I763 HydrophobicContact CE1-CD1 3.36Å; F759-I763 HydrophobicContact CE2-CD1 4.13Å; F759-I763 HydrophobicContact CG-CD1 4.24Å; F759-I763 HydrophobicContact CZ-CD1 3.6Å; F759-I763 WeakPolarHBondContact O-CD1 3.45Å; F759-I763 WeakPolarHBondContact O-CG1 3.5Å; F759-I763 PolarHBondContact O-N 3.45Å; F759-I763 VanDerWaalsContact O-N 3.11Å; H760-I763 WeakPolarHBondContact O-CB 3.48Å; H760-I763 PolarHBondContact O-N 2.89Å; H760-I763 VanDerWaalsContact O-N 3.17Å; N761-I763 VanDerWaalsContact C-N 3.34Å; N761-I763 PolarHBondContact O-N 3.1Å; I763-D767 CarbonylContact O-C 3.58Å; I763-D767 VanDerWaalsContact O-CA 3.28Å; I763-D767 WeakPolarHBondContact O-CA 3.26Å; I763-D767 PolarHBondContact O-N 3.43Å; I763-V768 HydrophobicContact CB-CB 4.43Å; I763-V768 HydrophobicContact CG1-CB 4.21Å; I763-V768 HydrophobicContact CG2-CB 4.34Å; I763-V768 PolarHBondContact O-N 2.94Å
764	L	89.1	Confident	90.6	Very high	81 Å²	81	37.4 Å²	37.4	42%	0.424	19%	0.188	S	C	.	.	H	α-helix	trans	-73.8	-43.1	177.3	-66.6	-174.6	0	0	0	112.6	H760 N761 Y762 H766 D767	H760-L764 VanDerWaalsContact CE1-CD1 3.49Å; H760-L764 WeakPolarHBondContact CE1-CD1 3.38Å; H760-L764 PolarHBondContact O-N 3.17Å; N761-L764 PolarHBondContact O-N 3.48Å; Y762-L764 VanDerWaalsContact C-N 3.34Å; Y762-L764 PolarHBondContact O-N 3.48Å; L764-H766 PolarHBondContact O-N 2.89Å; L764-D767 PolarHBondContact O-N 3.18Å
765	Q	84.9	Confident	90.7	Very high	129 Å²	129	37.4 Å²	37.4	60%	0.603	19%	0.188	S	C	*	.	H	α-helix	trans	-62.5	-30.5	-179.6	-179.6	174.3	-9.7	0	0	112.5	N761 Y762	N761-Q765 WeakPolarHBondContact O-CB 3.1Å; N761-Q765 PolarHBondContact O-N 3.46Å; Y762-Q765 PolarHBondContact O-N 2.95Å
766	H	85.5	Confident	90.5	Very high	44 Å²	44	39.3 Å²	39.3	20%	0.204	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	17.7	178.4	-64.7	-84.9	0	0	0	113.1	Y762 L764 V768 W809	Y762-H766 AromaticContact CD2-CD2 3.57Å; Y762-H766 AromaticContact CD2-NE2 3.86Å; Y762-H766 AromaticContact CE2-CD2 3.31Å; Y762-H766 WeakPolarHBondContact CE2-CD2 3.4Å; Y762-H766 AromaticContact CE2-NE2 3.38Å; Y762-H766 WeakPolarHBondContact CE2-NE2 3.36Å; Y762-H766 AromaticContact CZ-CD2 3.6Å; Y762-H766 AromaticContact CZ-NE2 3.95Å; Y762-H766 WeakPolarHBondContact O-CB 3.41Å; Y762-H766 PolarHBondContact O-CD2 3.4Å; Y762-H766 PolarHBondContact O-N 2.9Å; L764-H766 PolarHBondContact O-N 2.89Å; H766-V768 HydrophobicContact CB-CG2 3.79Å; H766-V768 PolarHBondContact O-N 3.3Å; H766-W809 HydrophobicContact CB-CZ3 4.24Å; H766-W809 WeakPolarHBondContact O-CH2 3.36Å; H766-W809 WeakPolarHBondContact O-CZ3 3.42Å
767	D	87.1	Confident	90.3	Very high	92 Å²	92	43 Å²	43	49%	0.492	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	34.4	45.8	-175.1	-165.6	26.9	0	0	0	115.4	R677 I763 L764 Q769	R677-D767 IonicContact NH2-OD1 2.68Å; R677-D767 PolarHBondContact NH2-OD1 3.11Å; I763-D767 CarbonylContact O-C 3.58Å; I763-D767 VanDerWaalsContact O-CA 3.28Å; I763-D767 WeakPolarHBondContact O-CA 3.26Å; I763-D767 PolarHBondContact O-N 3.43Å; L764-D767 PolarHBondContact O-N 3.18Å; D767-Q769 PolarHBondContact O-N 3.23Å; D767-Q769 PolarHBondContact OD1-NE2 3.23Å
768	V	90.9	Very high	90.2	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	22%	0.215	C	C	.	.			trans	-72.3	116.4	-173.7	-178	0	0	0	0	108.8	L680 Y762 I763 H766 D770 M771 H774	L680-V768 HydrophobicContact CD1-CG1 4.3Å; L680-V768 WeakPolarHBondContact CD1-O 3.25Å; L680-V768 HydrophobicContact CD2-CG1 4.33Å; Y762-V768 HydrophobicContact CE1-CG2 4.34Å; I763-V768 HydrophobicContact CB-CB 4.43Å; I763-V768 HydrophobicContact CG1-CB 4.21Å; I763-V768 HydrophobicContact CG2-CB 4.34Å; I763-V768 PolarHBondContact O-N 2.94Å; H766-V768 HydrophobicContact CB-CG2 3.79Å; H766-V768 PolarHBondContact O-N 3.3Å; V768-D770 WeakPolarHBondContact CG1-O 3.22Å; V768-M771 HydrophobicContact CG1-CE 4.24Å; V768-H774 HydrophobicContact CG1-CB 4.08Å
769	Q	88.9	Confident	90	Very high	106 Å²	106	42.1 Å²	42.1	50%	0.495	21%	0.212	S	C	.	.	S	Bend	trans	-97.2	-37.4	176.1	-58.3	-62	-18.7	0	0	111.7	R677 D767	R677-Q769 VanDerWaalsContact NH2-NE2 3.15Å; D767-Q769 PolarHBondContact O-N 3.23Å; D767-Q769 PolarHBondContact OD1-NE2 3.23Å
770	D	91	Very high	89.6	Confident	37 Å²	37	45.8 Å²	45.8	20%	0.198	23%	0.225	C	C	.	.			trans	-135.8	144.7	167.5	158.6	55.4	0	0	0	109.8	V768 E772 T773 H774	V768-D770 WeakPolarHBondContact CG1-O 3.22Å; D770-E772 PolarHBondContact OD1-N 2.94Å; D770-E772 WeakPolarHBondContact OD2-CB 3.33Å; D770-E772 PolarHBondContact OD2-N 3.12Å; D770-T773 PolarHBondContact O-OG1 2.94Å; D770-T773 WeakPolarHBondContact OD2-CB 3.49Å; D770-T773 WeakPolarHBondContact OD2-CG2 3.5Å; D770-T773 PolarHBondContact OD2-N 2.93Å; D770-T773 PolarHBondContact OD2-OG1 3.31Å; D770-H774 WeakPolarHBondContact O-CB 3.48Å; D770-H774 PolarHBondContact O-N 3.49Å
771	M	93.3	Very high	89.4	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-83.1	-28.4	-178.1	-172.6	63.8	63.9	0	0	112.6	L680 L683 M705 Y709 V728 M732 F759 V768 L775	L680-M771 HydrophobicContact CD2-CB 3.98Å; L680-M771 HydrophobicContact CD2-CE 4.4Å; L683-M771 HydrophobicContact CD2-CB 3.83Å; L683-M771 HydrophobicContact CD2-CE 4.21Å; L683-M771 HydrophobicContact CD2-CG 3.74Å; M705-M771 HydrophobicContact CE-CG 4.38Å; M705-M771 HydrophobicContact CE-SD 4.22Å; Y709-M771 HydrophobicContact CE2-CB 4.38Å; Y709-M771 HydrophobicContact CE2-CG 3.94Å; V728-M771 HydrophobicContact CG1-SD 4.37Å; M732-M771 HydrophobicContact CE-CE 4.02Å; F759-M771 HydrophobicContact CE2-CE 4.37Å; V768-M771 HydrophobicContact CG1-CE 4.24Å; M771-L775 HydrophobicContact CG-CD1 3.87Å; M771-L775 HydrophobicContact CG-CG 4.21Å; M771-L775 WeakPolarHBondContact O-CB 3.34Å; M771-L775 WeakPolarHBondContact O-CD1 3.31Å; M771-L775 WeakPolarHBondContact O-CG 3.49Å; M771-L775 PolarHBondContact O-N 3.11Å; M771-L775 HydrophobicContact SD-CD1 4.42Å; M771-L775 HydrophobicContact SD-CG 4.2Å
772	E	92.3	Very high	89.2	Confident	73 Å²	73	43.3 Å²	43.3	34%	0.341	21%	0.211	S	C	.	.	H	α-helix	trans	-68.2	-49.4	-179.3	-166	168.1	127.6	0	0	111.1	Y709 V712 D770 L775 L776	Y709-E772 HydrophobicContact CD1-CB 3.97Å; Y709-E772 HydrophobicContact CD1-CG 3.89Å; Y709-E772 HydrophobicContact CE1-CB 3.7Å; Y709-E772 HydrophobicContact CE1-CG 4.09Å; V712-E772 HydrophobicContact CG1-CG 4.47Å; D770-E772 PolarHBondContact OD1-N 2.94Å; D770-E772 WeakPolarHBondContact OD2-CB 3.33Å; D770-E772 PolarHBondContact OD2-N 3.12Å; E772-L775 PolarHBondContact O-N 3.32Å; E772-L776 HydrophobicContact CG-CD1 4.35Å; E772-L776 WeakPolarHBondContact O-CB 3.5Å; E772-L776 WeakPolarHBondContact O-CG 3.42Å; E772-L776 PolarHBondContact O-N 2.95Å
773	T	90.2	Very high	89	Confident	71 Å²	71	45.1 Å²	45.1	44%	0.436	22%	0.222	S	C	.	.	H	α-helix	trans	-62.8	-39.9	173.7	47.7	0	0	0	0	112.2	D770 L776 H777	D770-T773 PolarHBondContact O-OG1 2.94Å; D770-T773 WeakPolarHBondContact OD2-CB 3.49Å; D770-T773 WeakPolarHBondContact OD2-CG2 3.5Å; D770-T773 PolarHBondContact OD2-N 2.93Å; D770-T773 PolarHBondContact OD2-OG1 3.31Å; T773-L776 PolarHBondContact O-N 3.43Å; T773-H777 PolarHBondContact O-N 3.36Å; T773-H777 PolarHBondContact O-ND1 2.71Å
774	H	90.9	Very high	88.8	Confident	9 Å²	9	45.1 Å²	45.1	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-59.6	-51.2	174.1	-176.6	56	0	0	0	112.1	Y762 V768 D770 L776 H777 L778 W809	Y762-H774 AromaticContact CE1-NE2 3.48Å; Y762-H774 WeakPolarHBondContact CE1-NE2 3.35Å; Y762-H774 AromaticContact CZ-NE2 3.63Å; Y762-H774 PolarHBondContact OH-NE2 2.6Å; V768-H774 HydrophobicContact CG1-CB 4.08Å; D770-H774 WeakPolarHBondContact O-CB 3.48Å; D770-H774 PolarHBondContact O-N 3.49Å; H774-L776 VanDerWaalsContact C-N 3.28Å; H774-L776 PolarHBondContact O-N 3.08Å; H774-H777 PolarHBondContact O-N 2.95Å; H774-L778 WeakPolarHBondContact O-CG 3.2Å; H774-L778 PolarHBondContact O-N 3.25Å; H774-W809 AromaticContact CE1-CE3 3.79Å; H774-W809 AromaticContact CE1-CZ3 3.64Å; H774-W809 AromaticContact ND1-CE3 3.67Å; H774-W809 AromaticContact ND1-CZ3 3.36Å; H774-W809 WeakPolarHBondContact ND1-CZ3 3.31Å
775	L	91.4	Very high	88.8	Confident	1 Å²	1	42 Å²	42	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-35.6	177	-69.2	167.2	0	0	0	112.2	M705 Y709 L713 V724 I725 V728 M771 E772 A779	M705-L775 HydrophobicContact CE-CD1 4.06Å; M705-L775 HydrophobicContact CE-CD2 4.12Å; Y709-L775 HydrophobicContact CD1-CD1 4.39Å; Y709-L775 HydrophobicContact CD2-CD1 3.51Å; Y709-L775 HydrophobicContact CE2-CD1 4.13Å; Y709-L775 HydrophobicContact CG-CD1 3.66Å; L713-L775 HydrophobicContact CD1-CB 4.28Å; L713-L775 HydrophobicContact CD1-CD1 4.49Å; L713-L775 HydrophobicContact CD2-CB 4Å; V724-L775 HydrophobicContact CG1-CB 4.45Å; V724-L775 HydrophobicContact CG1-CD2 3.78Å; I725-L775 HydrophobicContact CG1-CD1 4.44Å; I725-L775 HydrophobicContact CG1-CD2 4.07Å; V728-L775 HydrophobicContact CB-CD2 4.34Å; V728-L775 HydrophobicContact CG2-CD2 3.72Å; M771-L775 HydrophobicContact CG-CD1 3.87Å; M771-L775 HydrophobicContact CG-CG 4.21Å; M771-L775 WeakPolarHBondContact O-CB 3.34Å; M771-L775 WeakPolarHBondContact O-CD1 3.31Å; M771-L775 WeakPolarHBondContact O-CG 3.49Å; M771-L775 PolarHBondContact O-N 3.11Å; M771-L775 HydrophobicContact SD-CD1 4.42Å; M771-L775 HydrophobicContact SD-CG 4.2Å; E772-L775 PolarHBondContact O-N 3.32Å; L775-A779 VanDerWaalsContact O-CB 3.3Å; L775-A779 WeakPolarHBondContact O-CB 3.32Å; L775-A779 PolarHBondContact O-N 2.84Å
776	L	89.1	Confident	89	Confident	40 Å²	40	42.1 Å²	42.1	21%	0.209	21%	0.209	C	C	.	.	H	α-helix	trans	-69.2	-39	176.1	-77.5	166	0	0	0	113.3	V712 L713 R716 E772 T773 H774 A779 R780	V712-L776 HydrophobicContact CG1-CD1 4.15Å; V712-L776 HydrophobicContact CG1-CD2 4.43Å; L713-L776 HydrophobicContact CD2-CD2 4.06Å; L713-L776 HydrophobicContact CD2-CG 4.29Å; R716-L776 HydrophobicContact CB-CD2 4.08Å; R716-L776 HydrophobicContact CG-CD2 3.87Å; E772-L776 HydrophobicContact CG-CD1 4.35Å; E772-L776 WeakPolarHBondContact O-CB 3.5Å; E772-L776 WeakPolarHBondContact O-CG 3.42Å; E772-L776 PolarHBondContact O-N 2.95Å; T773-L776 PolarHBondContact O-N 3.43Å; H774-L776 VanDerWaalsContact C-N 3.28Å; H774-L776 PolarHBondContact O-N 3.08Å; L776-A779 PolarHBondContact O-N 3.07Å; L776-R780 PolarHBondContact O-N 2.88Å
777	H	87.7	Confident	89.1	Confident	77 Å²	77	40.4 Å²	40.4	36%	0.356	20%	0.201	S	C	.	.	H	α-helix	trans	-65.4	-44.4	173.7	-74.4	86.8	0	0	0	111	T773 H774 A779 R780 E781	T773-H777 PolarHBondContact O-N 3.36Å; T773-H777 PolarHBondContact O-ND1 2.71Å; H774-H777 PolarHBondContact O-N 2.95Å; H777-A779 VanDerWaalsContact C-N 3.34Å; H777-A779 PolarHBondContact O-N 3.34Å; H777-R780 PolarHBondContact O-N 2.88Å; H777-E781 WeakPolarHBondContact O-CB 3.29Å; H777-E781 PolarHBondContact O-N 2.69Å
778	L	88.8	Confident	89.3	Confident	4 Å²	4	36 Å²	36	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-41.3	174.7	-67.9	172.1	0	0	0	112.5	V724 V728 H774 E781 E782 R811	V724-L778 HydrophobicContact CG1-CB 3.7Å; V724-L778 HydrophobicContact CG1-CD1 4.28Å; V728-L778 HydrophobicContact CG2-CD1 3.3Å; H774-L778 WeakPolarHBondContact O-CG 3.2Å; H774-L778 PolarHBondContact O-N 3.25Å; L778-E781 PolarHBondContact O-N 2.81Å; L778-E782 PolarHBondContact O-N 2.75Å; L778-R811 HydrophobicContact CD2-CG 4.45Å
779	A	88.4	Confident	89.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.5	-37.6	177.3	0	0	0	0	0	113	L713 H717 V724 L775 L776 H777 V783	L713-A779 HydrophobicContact CD2-CB 4.03Å; H717-A779 HydrophobicContact CB-CB 4.24Å; H717-A779 VanDerWaalsContact CD2-CB 3.49Å; H717-A779 WeakPolarHBondContact CD2-CB 3.49Å; V724-A779 HydrophobicContact CG2-CB 3.94Å; L775-A779 VanDerWaalsContact O-CB 3.3Å; L775-A779 WeakPolarHBondContact O-CB 3.32Å; L775-A779 PolarHBondContact O-N 2.84Å; L776-A779 PolarHBondContact O-N 3.07Å; H777-A779 VanDerWaalsContact C-N 3.34Å; H777-A779 PolarHBondContact O-N 3.34Å; A779-V783 WeakPolarHBondContact O-CG2 3.48Å; A779-V783 PolarHBondContact O-N 3.4Å
780	R	86.9	Confident	88.9	Confident	84 Å²	84	36.3 Å²	36.3	32%	0.317	20%	0.196	S	C	.	.	H	α-helix	trans	-65	-42.7	171.9	-174.5	-177.5	-177.6	-154.2	-0.9	111.2	L776 H777 V783 F784 T807	L776-R780 PolarHBondContact O-N 2.88Å; H777-R780 PolarHBondContact O-N 2.88Å; R780-V783 PolarHBondContact O-N 3.46Å; R780-F784 WeakPolarHBondContact O-CB 3.44Å; R780-F784 PolarHBondContact O-N 3.14Å; R780-T807 VanDerWaalsContact NH1-CB 3.31Å; R780-T807 PolarHBondContact NH1-OG1 2.8Å
781	E	87.8	Confident	88.4	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-69.9	-36.5	-178.6	-175.3	167.9	151.9	0	0	113	H777 L778 F784 A785 L808 W809 P810 R811 T814	H777-E781 WeakPolarHBondContact O-CB 3.29Å; H777-E781 PolarHBondContact O-N 2.69Å; L778-E781 PolarHBondContact O-N 2.81Å; E781-F784 PolarHBondContact O-N 3.28Å; E781-A785 WeakPolarHBondContact O-CB 3.32Å; E781-A785 PolarHBondContact O-N 2.89Å; E781-L808 HydrophobicContact CB-CD2 4.36Å; E781-L808 HydrophobicContact CG-CD2 4.16Å; E781-W809 VanDerWaalsContact OE2-C 3.29Å; E781-W809 WeakPolarHBondContact OE2-CA 3.27Å; E781-W809 PolarHBondContact OE2-N 2.78Å; E781-P810 WeakPolarHBondContact OE1-CA 3.45Å; E781-R811 WeakPolarHBondContact OE1-CB 3.3Å; E781-R811 WeakPolarHBondContact OE1-CG 3.35Å; E781-R811 PolarHBondContact OE1-N 2.66Å; E781-T814 VanDerWaalsContact CD-OG1 3.32Å; E781-T814 HydrophobicContact CG-CG2 3.93Å; E781-T814 WeakPolarHBondContact CG-OG1 3.35Å; E781-T814 VanDerWaalsContact OE1-CB 3.22Å; E781-T814 WeakPolarHBondContact OE1-CB 3.49Å; E781-T814 PolarHBondContact OE1-OG1 3.27Å
782	E	86.1	Confident	88.2	Confident	55 Å²	55	45.7 Å²	45.7	26%	0.257	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-45.2	172.8	-174.9	171.5	-138.2	0	0	111.5	S720 V724 M727 L778 F784 A785 E786	S720-E782 WeakPolarHBondContact CB-OE2 3.5Å; V724-E782 VanDerWaalsContact CG2-OE2 3.31Å; V724-E782 WeakPolarHBondContact CG2-OE2 3.42Å; M727-E782 HydrophobicContact CE-CG 4.45Å; M727-E782 VanDerWaalsContact CE-OE1 3.27Å; M727-E782 WeakPolarHBondContact CE-OE1 3.32Å; L778-E782 PolarHBondContact O-N 2.75Å; E782-F784 VanDerWaalsContact C-N 3.34Å; E782-F784 PolarHBondContact O-N 2.84Å; E782-A785 PolarHBondContact O-N 3.46Å; E782-E786 WeakPolarHBondContact O-CB 3.36Å; E782-E786 PolarHBondContact O-N 2.99Å
783	V	86.4	Confident	87.8	Confident	42 Å²	42	47.3 Å²	47.3	26%	0.255	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-35.2	176.5	171.5	0	0	0	0	112.2	A779 R780 T787	A779-V783 WeakPolarHBondContact O-CG2 3.48Å; A779-V783 PolarHBondContact O-N 3.4Å; R780-V783 PolarHBondContact O-N 3.46Å; V783-T787 VanDerWaalsContact O-CB 3.27Å; V783-T787 WeakPolarHBondContact O-CB 3.48Å; V783-T787 PolarHBondContact O-N 3.18Å; V783-T787 PolarHBondContact O-OG1 3.08Å
784	F	89.1	Confident	87.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-51.6	172.8	174.6	-108.4	0	0	0	110.7	R780 E781 E782 E786 T787 L788 Q799 L800 V803 L808 T814 L818 Y836	R780-F784 WeakPolarHBondContact O-CB 3.44Å; R780-F784 PolarHBondContact O-N 3.14Å; E781-F784 PolarHBondContact O-N 3.28Å; E782-F784 VanDerWaalsContact C-N 3.34Å; E782-F784 PolarHBondContact O-N 2.84Å; F784-E786 PolarHBondContact O-N 3.45Å; F784-T787 PolarHBondContact O-N 3.33Å; F784-T787 VanDerWaalsContact O-N 3.14Å; F784-L788 HydrophobicContact CD1-CD1 4.23Å; F784-L788 HydrophobicContact CE1-CD1 3.68Å; F784-L788 HydrophobicContact CE1-CG 4.43Å; F784-L788 HydrophobicContact CE2-CD1 4.25Å; F784-L788 HydrophobicContact CE2-CD2 4.29Å; F784-L788 HydrophobicContact CE2-CG 4.33Å; F784-L788 HydrophobicContact CZ-CD1 3.71Å; F784-L788 HydrophobicContact CZ-CD2 4.48Å; F784-L788 HydrophobicContact CZ-CG 4.28Å; F784-L788 WeakPolarHBondContact O-CG 3.42Å; F784-L788 PolarHBondContact O-N 2.97Å; F784-Q799 HydrophobicContact CD2-CB 4.04Å; F784-Q799 HydrophobicContact CE2-CB 4.13Å; F784-Q799 WeakPolarHBondContact CE2-O 3.47Å; F784-L800 HydrophobicContact CZ-CD2 4.21Å; F784-V803 HydrophobicContact CD2-CB 3.92Å; F784-V803 HydrophobicContact CD2-CG1 4.08Å; F784-V803 HydrophobicContact CD2-CG2 3.77Å; F784-V803 HydrophobicContact CE2-CB 3.81Å; F784-V803 HydrophobicContact CE2-CG1 4.16Å; F784-V803 HydrophobicContact CE2-CG2 4.11Å; F784-V803 HydrophobicContact CG-CG1 4.46Å; F784-L808 HydrophobicContact CD1-CD1 4.07Å; F784-L808 HydrophobicContact CD1-CD2 4.04Å; F784-L808 HydrophobicContact CE1-CD1 3.51Å; F784-L808 HydrophobicContact CE1-CD2 4.31Å; F784-L808 HydrophobicContact CZ-CD1 4.07Å; F784-T814 HydrophobicContact CD1-CG2 3.74Å; F784-T814 HydrophobicContact CE1-CG2 3.82Å; F784-L818 HydrophobicContact CZ-CD2 4.42Å; F784-Y836 HydrophobicContact CZ-CE1 4.08Å; F784-Y836 AromaticContact CZ-CZ 3.97Å
785	A	89.1	Confident	87.6	Confident	14 Å²	14	54.3 Å²	54.3	12%	0.116	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-41.8	178.2	0	0	0	0	0	112.9	E781 E782 T787 L788 C789	E781-A785 WeakPolarHBondContact O-CB 3.32Å; E781-A785 PolarHBondContact O-N 2.89Å; E782-A785 PolarHBondContact O-N 3.46Å; A785-T787 VanDerWaalsContact C-N 3.33Å; A785-T787 PolarHBondContact O-N 3.36Å; A785-L788 PolarHBondContact O-N 2.94Å; A785-C789 PolarHBondContact O-N 3.11Å; A785-C789 VanDerWaalsContact O-N 3.11Å; A785-C789 PolarHBondContact O-SG 3.07Å
786	E	87.4	Confident	87.5	Confident	133 Å²	133	55.6 Å²	55.6	62%	0.621	29%	0.289	S	S	*	.	H	α-helix	trans	-59.2	-45	172.7	-174.3	-172.5	-159.2	0	0	111	E782 F784 C789 G790	E782-E786 WeakPolarHBondContact O-CB 3.36Å; E782-E786 PolarHBondContact O-N 2.99Å; F784-E786 PolarHBondContact O-N 3.45Å; E786-C789 PolarHBondContact O-N 3.44Å; E786-G790 PolarHBondContact O-N 3.19Å
787	T	89.1	Confident	87.5	Confident	8 Å²	8	56 Å²	56	5%	0.049	29%	0.292	C	S	.	.	H	α-helix	trans	-68.4	-35.2	-179.2	-58.5	0	0	0	0	112.5	V783 F784 A785 C789 R795 Q799	V783-T787 VanDerWaalsContact O-CB 3.27Å; V783-T787 WeakPolarHBondContact O-CB 3.48Å; V783-T787 PolarHBondContact O-N 3.18Å; V783-T787 PolarHBondContact O-OG1 3.08Å; F784-T787 PolarHBondContact O-N 3.33Å; F784-T787 VanDerWaalsContact O-N 3.14Å; A785-T787 VanDerWaalsContact C-N 3.33Å; A785-T787 PolarHBondContact O-N 3.36Å; T787-C789 VanDerWaalsContact C-N 3.31Å; T787-R795 HydrophobicContact CG2-CB 4.4Å; T787-R795 HydrophobicContact CG2-CG 3.59Å; T787-R795 VanDerWaalsContact CG2-NE 3.3Å; T787-R795 PolarHBondContact OG1-NH2 3.03Å; T787-Q799 HydrophobicContact CG2-CB 4.5Å; T787-Q799 HydrophobicContact CG2-CG 3.69Å
788	L	89.7	Confident	87.7	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.3	-32.1	172.3	-67.6	-171.1	0	0	0	112.5	F784 A785 R796 L800 A817 L818 L821	F784-L788 HydrophobicContact CD1-CD1 4.23Å; F784-L788 HydrophobicContact CE1-CD1 3.68Å; F784-L788 HydrophobicContact CE1-CG 4.43Å; F784-L788 HydrophobicContact CE2-CD1 4.25Å; F784-L788 HydrophobicContact CE2-CD2 4.29Å; F784-L788 HydrophobicContact CE2-CG 4.33Å; F784-L788 HydrophobicContact CZ-CD1 3.71Å; F784-L788 HydrophobicContact CZ-CD2 4.48Å; F784-L788 HydrophobicContact CZ-CG 4.28Å; F784-L788 WeakPolarHBondContact O-CG 3.42Å; F784-L788 PolarHBondContact O-N 2.97Å; A785-L788 PolarHBondContact O-N 2.94Å; L788-R796 WeakPolarHBondContact O-CD 3.4Å; L788-R796 PolarHBondContact O-NE 3.5Å; L788-R796 VanDerWaalsContact O-NE 3.1Å; L788-L800 HydrophobicContact CD1-CD2 4.34Å; L788-L800 HydrophobicContact CD2-CD2 3.9Å; L788-L800 HydrophobicContact CD2-CG 3.97Å; L788-A817 HydrophobicContact CB-CB 4Å; L788-A817 HydrophobicContact CD1-CB 4.33Å; L788-L818 HydrophobicContact CD1-CD2 3.58Å; L788-L818 HydrophobicContact CD1-CG 3.9Å; L788-L821 HydrophobicContact CB-CD1 4.27Å; L788-L821 HydrophobicContact CD1-CD1 4.4Å; L788-L821 HydrophobicContact CD2-CD1 3.98Å; L788-L821 HydrophobicContact CG-CD1 4.44Å
789	C	86.6	Confident	87.8	Confident	78 Å²	78	55.5 Å²	55.5	53%	0.527	30%	0.295	S	S	.	.	H	α-helix	trans	-78.6	-35.6	177	-74.2	0	0	0	0	113.8	A785 E786 T787 R796	A785-C789 PolarHBondContact O-N 3.11Å; A785-C789 VanDerWaalsContact O-N 3.11Å; A785-C789 PolarHBondContact O-SG 3.07Å; E786-C789 PolarHBondContact O-N 3.44Å; T787-C789 VanDerWaalsContact C-N 3.31Å; C789-R796 PolarHBondContact O-NH2 2.82Å
790	G	85.2	Confident	87.9	Confident	34 Å²	34	56.2 Å²	56.2	35%	0.351	30%	0.299	S	S	.	.	S	Bend	trans	-64.1	153.1	-177.5	0	0	0	0	0	114.4	E786 D792 R796	E786-G790 PolarHBondContact O-N 3.19Å; G790-D792 PolarHBondContact O-N 3.07Å; G790-R796 PolarHBondContact O-NE 3.09Å; G790-R796 PolarHBondContact O-NH2 3.22Å
791	D	81.7	Confident	88	Confident	148 Å²	148	60.5 Å²	60.5	79%	0.791	32%	0.322	S	S	*	.	S	Bend	trans	-69.6	0.1	-166.6	-60.7	-46.2	0	0	0	116.9	F793	D791-F793 PolarHBondContact O-N 3.14Å
792	D	87.3	Confident	88	Confident	87 Å²	87	66.3 Å²	66.3	47%	0.465	35%	0.349	S	S	.	.			trans	-89.6	94.5	-175.4	-173.4	-23.7	0	0	0	111.9	G790 S794 R795 R796	G790-D792 PolarHBondContact O-N 3.07Å; D792-S794 VanDerWaalsContact C-N 3.27Å; D792-S794 PolarHBondContact O-N 3.27Å; D792-S794 PolarHBondContact OD1-N 3.48Å; D792-S794 VanDerWaalsContact OD1-N 3.07Å; D792-R795 HydrophobicContact CB-CB 3.85Å; D792-R795 PolarHBondContact O-N 3.4Å; D792-R795 VanDerWaalsContact O-N 3.11Å; D792-R795 PolarHBondContact OD1-N 2.89Å; D792-R796 WeakPolarHBondContact O-CG 3.46Å; D792-R796 PolarHBondContact O-N 3Å
793	F	85.5	Confident	88.2	Confident	106 Å²	106	63.8 Å²	63.8	47%	0.465	34%	0.338	S	S	.	.	H	α-helix	trans	-53.1	-39.2	178.9	-53.7	-79.7	0	0	0	113.9	D791 R796 L797 D826 V829	D791-F793 PolarHBondContact O-N 3.14Å; F793-R796 PolarHBondContact O-N 3.36Å; F793-L797 WeakPolarHBondContact O-CG 2.98Å; F793-L797 PolarHBondContact O-N 3.08Å; F793-L797 VanDerWaalsContact O-N 3.12Å; F793-D826 HydrophobicContact CD1-CB 4.12Å; F793-D826 HydrophobicContact CE1-CB 4.14Å; F793-V829 HydrophobicContact CB-CG2 4.17Å; F793-V829 HydrophobicContact CD1-CG2 4.13Å
794	S	87.9	Confident	88.2	Confident	93 Å²	93	65 Å²	65	65%	0.65	35%	0.346	S	S	*	.	H	α-helix	trans	-69.5	-38	-179.8	-63.9	0	0	0	0	111.3	D792 L797 A798	D792-S794 VanDerWaalsContact C-N 3.27Å; D792-S794 PolarHBondContact O-N 3.27Å; D792-S794 PolarHBondContact OD1-N 3.48Å; D792-S794 VanDerWaalsContact OD1-N 3.07Å; S794-L797 PolarHBondContact O-N 3.29Å; S794-A798 PolarHBondContact O-N 3.37Å; S794-A798 VanDerWaalsContact O-N 3.12Å
795	R	88	Confident	88	Confident	135 Å²	135	65.6 Å²	65.6	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-71.1	-32.8	175.6	-163.9	-177.2	160.3	-175.5	-14.4	112.7	T787 D792 Q799	T787-R795 HydrophobicContact CG2-CB 4.4Å; T787-R795 HydrophobicContact CG2-CG 3.59Å; T787-R795 VanDerWaalsContact CG2-NE 3.3Å; T787-R795 PolarHBondContact OG1-NH2 3.03Å; D792-R795 HydrophobicContact CB-CB 3.85Å; D792-R795 PolarHBondContact O-N 3.4Å; D792-R795 VanDerWaalsContact O-N 3.11Å; D792-R795 PolarHBondContact OD1-N 2.89Å; R795-Q799 PolarHBondContact O-N 2.76Å
796	R	89.7	Confident	87.7	Confident	28 Å²	28	69.1 Å²	69.1	11%	0.106	37%	0.374	C	S	.	.	H	α-helix	trans	-61.3	-49.3	171	-66.1	-179.6	-172.1	-174.5	-1.1	111.6	L788 C789 G790 D792 F793 Q799 L800	L788-R796 WeakPolarHBondContact O-CD 3.4Å; L788-R796 PolarHBondContact O-NE 3.5Å; L788-R796 VanDerWaalsContact O-NE 3.1Å; C789-R796 PolarHBondContact O-NH2 2.82Å; G790-R796 PolarHBondContact O-NE 3.09Å; G790-R796 PolarHBondContact O-NH2 3.22Å; D792-R796 WeakPolarHBondContact O-CG 3.46Å; D792-R796 PolarHBondContact O-N 3Å; F793-R796 PolarHBondContact O-N 3.36Å; R796-Q799 PolarHBondContact O-N 2.68Å; R796-L800 WeakPolarHBondContact O-CG 3.14Å; R796-L800 PolarHBondContact O-N 2.96Å
797	L	89.9	Confident	87.4	Confident	49 Å²	49	64.7 Å²	64.7	26%	0.257	36%	0.356	S	S	.	.	H	α-helix	trans	-60.2	-48.7	179.4	-71.1	173	0	0	0	111.6	F793 S794 Q799 L800 E801 V829 A832	F793-L797 WeakPolarHBondContact O-CG 2.98Å; F793-L797 PolarHBondContact O-N 3.08Å; F793-L797 VanDerWaalsContact O-N 3.12Å; S794-L797 PolarHBondContact O-N 3.29Å; L797-Q799 VanDerWaalsContact C-N 3.3Å; L797-Q799 PolarHBondContact O-N 2.94Å; L797-L800 PolarHBondContact O-N 2.92Å; L797-E801 PolarHBondContact O-N 2.92Å; L797-V829 HydrophobicContact CD1-CG2 4.45Å; L797-V829 HydrophobicContact CD2-CG2 4.04Å; L797-V829 HydrophobicContact CG-CG2 4.01Å; L797-A832 HydrophobicContact CD2-CB 3.49Å; L797-A832 VanDerWaalsContact CD2-CB 3.49Å
798	A	90.3	Very high	87.1	Confident	35 Å²	35	64.5 Å²	64.5	29%	0.289	35%	0.354	S	S	.	.	H	α-helix	trans	-56.5	-42.1	178	0	0	0	0	0	112.3	S794 L800 E801 E802	S794-A798 PolarHBondContact O-N 3.37Å; S794-A798 VanDerWaalsContact O-N 3.12Å; A798-L800 PolarHBondContact O-N 3.34Å; A798-E801 PolarHBondContact O-N 3.06Å; A798-E801 VanDerWaalsContact O-N 3.16Å; A798-E802 WeakPolarHBondContact O-CB 3.42Å; A798-E802 VanDerWaalsContact O-CG 3.24Å; A798-E802 WeakPolarHBondContact O-CG 3.29Å; A798-E802 PolarHBondContact O-N 3.45Å
799	Q	91.2	Very high	86.7	Confident	34 Å²	34	68.7 Å²	68.7	16%	0.159	37%	0.37	C	S	.	.	H	α-helix	trans	-68.9	-33.8	178.8	-76.7	-71.3	-80.7	0	0	114.1	F784 T787 R795 R796 L797 E801 E802 V803	F784-Q799 HydrophobicContact CD2-CB 4.04Å; F784-Q799 HydrophobicContact CE2-CB 4.13Å; F784-Q799 WeakPolarHBondContact CE2-O 3.47Å; T787-Q799 HydrophobicContact CG2-CB 4.5Å; T787-Q799 HydrophobicContact CG2-CG 3.69Å; R795-Q799 PolarHBondContact O-N 2.76Å; R796-Q799 PolarHBondContact O-N 2.68Å; L797-Q799 VanDerWaalsContact C-N 3.3Å; L797-Q799 PolarHBondContact O-N 2.94Å; Q799-E801 PolarHBondContact O-N 2.85Å; Q799-E802 PolarHBondContact NE2-OE2 2.85Å; Q799-V803 WeakPolarHBondContact O-CB 3.34Å; Q799-V803 WeakPolarHBondContact O-CG2 3.37Å; Q799-V803 PolarHBondContact O-N 2.61Å; Q799-V803 VanDerWaalsContact O-N 3.12Å
800	L	90.8	Very high	86.5	Confident	15 Å²	15	65.1 Å²	65.1	8%	0.079	35%	0.346	C	S	.	.	H	α-helix	trans	-67.2	-22.4	172.8	-66.5	172.3	0	0	0	112.4	F784 L788 R796 L797 A798 L818 L821 A832 A833 Y836	F784-L800 HydrophobicContact CZ-CD2 4.21Å; L788-L800 HydrophobicContact CD1-CD2 4.34Å; L788-L800 HydrophobicContact CD2-CD2 3.9Å; L788-L800 HydrophobicContact CD2-CG 3.97Å; R796-L800 WeakPolarHBondContact O-CG 3.14Å; R796-L800 PolarHBondContact O-N 2.96Å; L797-L800 PolarHBondContact O-N 2.92Å; A798-L800 PolarHBondContact O-N 3.34Å; L800-L818 HydrophobicContact CD2-CD2 3.74Å; L800-L821 HydrophobicContact CD1-CD1 4.36Å; L800-A832 HydrophobicContact CD1-CB 3.95Å; L800-A833 HydrophobicContact CD1-CB 4.36Å; L800-Y836 HydrophobicContact CB-CD2 4.31Å; L800-Y836 HydrophobicContact CD2-CD1 3.85Å; L800-Y836 HydrophobicContact CD2-CD2 4.23Å; L800-Y836 HydrophobicContact CD2-CE1 4.09Å; L800-Y836 HydrophobicContact CD2-CE2 4.47Å; L800-Y836 HydrophobicContact CD2-CG 3.91Å; L800-Y836 WeakPolarHBondContact O-CD2 3.47Å; L800-Y836 WeakPolarHBondContact O-CE2 3.33Å
801	E	89.6	Confident	86.5	Confident	174 Å²	174	65.6 Å²	65.6	81%	0.813	34%	0.337	S	S	*	.	H	α-helix	trans	-89.9	-39.5	175.6	-168.1	171.4	-168.5	0	0	112.3	L797 A798 Q799	L797-E801 PolarHBondContact O-N 2.92Å; A798-E801 PolarHBondContact O-N 3.06Å; A798-E801 VanDerWaalsContact O-N 3.16Å; Q799-E801 PolarHBondContact O-N 2.85Å
802	E	88.5	Confident	86.7	Confident	124 Å²	124	61.3 Å²	61.3	58%	0.579	31%	0.314	S	S	*	.	H	α-helix	trans	-79.6	-20.9	-176.5	-71.9	173.6	152.8	0	0	114.9	A798 Q799 P804	A798-E802 WeakPolarHBondContact O-CB 3.42Å; A798-E802 VanDerWaalsContact O-CG 3.24Å; A798-E802 WeakPolarHBondContact O-CG 3.29Å; A798-E802 PolarHBondContact O-N 3.45Å; Q799-E802 PolarHBondContact NE2-OE2 2.85Å; E802-P804 WeakPolarHBondContact O-CD 3.4Å
803	V	88.9	Confident	86.7	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.018	31%	0.31	C	S	.	.	S	Bend	trans	-112.9	97.8	-172.5	-175.7	0	0	0	0	110.9	F784 Q799 L808 Y836	F784-V803 HydrophobicContact CD2-CB 3.92Å; F784-V803 HydrophobicContact CD2-CG1 4.08Å; F784-V803 HydrophobicContact CD2-CG2 3.77Å; F784-V803 HydrophobicContact CE2-CB 3.81Å; F784-V803 HydrophobicContact CE2-CG1 4.16Å; F784-V803 HydrophobicContact CE2-CG2 4.11Å; F784-V803 HydrophobicContact CG-CG1 4.46Å; Q799-V803 WeakPolarHBondContact O-CB 3.34Å; Q799-V803 WeakPolarHBondContact O-CG2 3.37Å; Q799-V803 PolarHBondContact O-N 2.61Å; Q799-V803 VanDerWaalsContact O-N 3.12Å; V803-L808 HydrophobicContact CG1-CD2 3.76Å; V803-L808 HydrophobicContact CG1-CG 4.17Å; V803-Y836 VanDerWaalsContact O-CE2 3.29Å; V803-Y836 WeakPolarHBondContact O-CE2 3.45Å; V803-Y836 PolarHBondContact O-OH 3.12Å
804	P	86.9	Confident	87	Confident	66 Å²	66	54 Å²	54	43%	0.429	29%	0.288	S	S	.	.			trans	-71	138.6	179.2	27.9	-33.6	0	0	0	111.6	E802 S806 T807	E802-P804 WeakPolarHBondContact O-CD 3.4Å; P804-S806 PolarHBondContact O-N 2.99Å; P804-S806 VanDerWaalsContact O-N 3.17Å; P804-T807 HydrophobicContact CG-CG2 4.09Å; P804-T807 PolarHBondContact O-N 3.12Å; P804-T807 PolarHBondContact O-OG1 3.4Å
805	L	85.4	Confident	87.2	Confident	13 Å²	13	49.5 Å²	49.5	7%	0.068	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-53.8	-35.2	-177.5	-75.7	177.1	0	0	0	114.6	T807 L808 Y836 S839 G840 F846	L805-T807 PolarHBondContact O-N 3.45Å; L805-L808 HydrophobicContact CD2-CD1 4.19Å; L805-L808 PolarHBondContact O-N 2.97Å; L805-Y836 WeakPolarHBondContact CD1-O 3.3Å; L805-Y836 HydrophobicContact CD2-CD1 3.91Å; L805-Y836 HydrophobicContact CD2-CE1 3.23Å; L805-Y836 HydrophobicContact CD2-CE2 4.35Å; L805-Y836 VanDerWaalsContact CD2-CZ 3.49Å; L805-Y836 HydrophobicContact CG-CD1 4.43Å; L805-Y836 HydrophobicContact CG-CE1 3.94Å; L805-Y836 HydrophobicContact CG-CE2 4.2Å; L805-S839 WeakPolarHBondContact CD1-OG 3.4Å; L805-G840 VanDerWaalsContact CD1-N 3.26Å; L805-F846 HydrophobicContact CD1-CD1 4.4Å; L805-F846 HydrophobicContact CD1-CE1 4.46Å; L805-F846 HydrophobicContact CD2-CD1 4.28Å; L805-F846 HydrophobicContact CD2-CD2 3.79Å; L805-F846 HydrophobicContact CD2-CE1 4.02Å; L805-F846 HydrophobicContact CD2-CE2 3.51Å; L805-F846 HydrophobicContact CD2-CG 4.19Å; L805-F846 HydrophobicContact CD2-CZ 3.64Å
806	S	81.7	Confident	87.4	Confident	89 Å²	89	49.3 Å²	49.3	62%	0.622	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-63.7	-7	176.6	54.2	0	0	0	0	114	P804	P804-S806 PolarHBondContact O-N 2.99Å; P804-S806 VanDerWaalsContact O-N 3.17Å
807	T	81.6	Confident	87.5	Confident	39 Å²	39	48 Å²	48	24%	0.239	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-109.3	6.8	173	64.2	0	0	0	0	114	R780 P804 L805	R780-T807 VanDerWaalsContact NH1-CB 3.31Å; R780-T807 PolarHBondContact NH1-OG1 2.8Å; P804-T807 HydrophobicContact CG-CG2 4.09Å; P804-T807 PolarHBondContact O-N 3.12Å; P804-T807 PolarHBondContact O-OG1 3.4Å; L805-T807 PolarHBondContact O-N 3.45Å
808	L	83	Confident	87.7	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	24%	0.24	C	C	.	.			trans	-103.1	143.5	172.8	-64.3	-175	0	0	0	111.4	E781 F784 V803 L805 P810 T814 Y836	E781-L808 HydrophobicContact CB-CD2 4.36Å; E781-L808 HydrophobicContact CG-CD2 4.16Å; F784-L808 HydrophobicContact CD1-CD1 4.07Å; F784-L808 HydrophobicContact CD1-CD2 4.04Å; F784-L808 HydrophobicContact CE1-CD1 3.51Å; F784-L808 HydrophobicContact CE1-CD2 4.31Å; F784-L808 HydrophobicContact CZ-CD1 4.07Å; V803-L808 HydrophobicContact CG1-CD2 3.76Å; V803-L808 HydrophobicContact CG1-CG 4.17Å; L805-L808 HydrophobicContact CD2-CD1 4.19Å; L805-L808 PolarHBondContact O-N 2.97Å; L808-P810 WeakPolarHBondContact O-CD 3.49Å; L808-T814 HydrophobicContact CD1-CG2 4.45Å; L808-Y836 WeakPolarHBondContact CD1-OH 3.36Å
809	W	81.6	Confident	87.8	Confident	88 Å²	88	44.3 Å²	44.3	33%	0.333	23%	0.229	S	C	.	.			trans	-117.8	71	177.4	-88.2	30.3	0	0	0	108.7	H766 H774 E781 R811 H845	H766-W809 HydrophobicContact CB-CZ3 4.24Å; H766-W809 WeakPolarHBondContact O-CH2 3.36Å; H766-W809 WeakPolarHBondContact O-CZ3 3.42Å; H774-W809 AromaticContact CE1-CE3 3.79Å; H774-W809 AromaticContact CE1-CZ3 3.64Å; H774-W809 AromaticContact ND1-CE3 3.67Å; H774-W809 AromaticContact ND1-CZ3 3.36Å; H774-W809 WeakPolarHBondContact ND1-CZ3 3.31Å; E781-W809 VanDerWaalsContact OE2-C 3.29Å; E781-W809 WeakPolarHBondContact OE2-CA 3.27Å; E781-W809 PolarHBondContact OE2-N 2.78Å; W809-R811 PolarHBondContact O-N 2.9Å; W809-H845 AromaticContact CD1-CE1 3.99Å
810	P	81.6	Confident	87.9	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.019	24%	0.238	C	C	.	.			trans	-58.4	106.6	-146.8	21.7	-36.5	0	0	0	114.4	E781 L808 L815 F846 R849	E781-P810 WeakPolarHBondContact OE1-CA 3.45Å; L808-P810 WeakPolarHBondContact O-CD 3.49Å; P810-L815 HydrophobicContact CB-CD1 4.06Å; P810-L815 HydrophobicContact CB-CD2 3.82Å; P810-L815 HydrophobicContact CB-CG 3.87Å; P810-F846 HydrophobicContact CB-CD2 3.84Å; P810-F846 HydrophobicContact CB-CE2 3.78Å; P810-F846 HydrophobicContact CG-CD2 3.57Å; P810-F846 HydrophobicContact CG-CE2 4.03Å; P810-F846 HydrophobicContact CG-CG 4.31Å; P810-R849 HydrophobicContact CG-CB 4.03Å; P810-R849 HydrophobicContact CG-CG 4.05Å; P810-R849 WeakPolarHBondContact O-CG 3.22Å
811	R	85.4	Confident	87.9	Confident	44 Å²	44	44.4 Å²	44.4	17%	0.166	23%	0.234	C	C	.	.			trans	-78.4	155.7	174.6	-58.2	-176.9	65	67.3	11.8	111.2	M727 E731 L778 E781 W809 G813 T814 L815	M727-R811 VanDerWaalsContact CG-NH2 3.29Å; M727-R811 PolarHBondContact SD-NE 3.4Å; M727-R811 PolarHBondContact SD-NH2 3.07Å; M727-R811 VanDerWaalsContact SD-NH2 3.41Å; E731-R811 VanDerWaalsContact CD-NH1 3.28Å; E731-R811 VanDerWaalsContact CD-NH2 3.27Å; E731-R811 IonicContact OE1-CZ 2.61Å; E731-R811 VanDerWaalsContact OE1-CZ 3.25Å; E731-R811 IonicContact OE1-NH1 2.67Å; E731-R811 PolarHBondContact OE1-NH1 3.4Å; E731-R811 IonicContact OE1-NH2 3.02Å; E731-R811 PolarHBondContact OE1-NH2 3.28Å; E731-R811 IonicContact OE2-CZ 3.89Å; E731-R811 IonicContact OE2-NH1 3.54Å; E731-R811 PolarHBondContact OE2-NH1 3.09Å; E731-R811 IonicContact OE2-NH2 2.95Å; L778-R811 HydrophobicContact CD2-CG 4.45Å; E781-R811 WeakPolarHBondContact OE1-CB 3.3Å; E781-R811 WeakPolarHBondContact OE1-CG 3.35Å; E781-R811 PolarHBondContact OE1-N 2.66Å; W809-R811 PolarHBondContact O-N 2.9Å; R811-G813 PolarHBondContact O-N 2.87Å; R811-G813 VanDerWaalsContact O-N 3.08Å; R811-T814 WeakPolarHBondContact O-CB 3.44Å; R811-T814 PolarHBondContact O-N 3.09Å; R811-L815 PolarHBondContact O-N 3.14Å
812	N	87	Confident	88	Confident	58 Å²	58	36.7 Å²	36.7	31%	0.31	20%	0.199	S	C	.	.	H	α-helix	trans	-56.8	-27.3	177.7	-60.5	33.1	0	0	0	112.9	R816 R849 Y853	N812-R816 VanDerWaalsContact O-CB 3.28Å; N812-R816 WeakPolarHBondContact O-CB 3.46Å; N812-R816 PolarHBondContact O-N 2.98Å; N812-R849 PolarHBondContact OD1-NH2 2.93Å; N812-R849 VanDerWaalsContact OD1-NH2 3.16Å; N812-Y853 HydrophobicContact CB-CD2 3.91Å; N812-Y853 HydrophobicContact CB-CE2 3.56Å; N812-Y853 PolarHBondContact O-OH 3.42Å
813	G	86.6	Confident	88	Confident	36 Å²	36	32.9 Å²	32.9	37%	0.371	18%	0.184	S	C	.	.	H	α-helix	trans	-69	-51.4	173	0	0	0	0	0	112.5	R811 R816 A817	R811-G813 PolarHBondContact O-N 2.87Å; R811-G813 VanDerWaalsContact O-N 3.08Å; G813-R816 WeakPolarHBondContact O-CB 3.12Å; G813-R816 PolarHBondContact O-N 3.12Å; G813-A817 PolarHBondContact O-N 2.72Å
814	T	90.7	Very high	87.8	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.018	19%	0.193	C	C	.	.	H	α-helix	trans	-59.6	-46.4	178.5	-41.4	0	0	0	0	112.2	E781 F784 L808 R811 A817 L818	E781-T814 VanDerWaalsContact CD-OG1 3.32Å; E781-T814 HydrophobicContact CG-CG2 3.93Å; E781-T814 WeakPolarHBondContact CG-OG1 3.35Å; E781-T814 VanDerWaalsContact OE1-CB 3.22Å; E781-T814 WeakPolarHBondContact OE1-CB 3.49Å; E781-T814 PolarHBondContact OE1-OG1 3.27Å; F784-T814 HydrophobicContact CD1-CG2 3.74Å; F784-T814 HydrophobicContact CE1-CG2 3.82Å; L808-T814 HydrophobicContact CD1-CG2 4.45Å; R811-T814 WeakPolarHBondContact O-CB 3.44Å; R811-T814 PolarHBondContact O-N 3.09Å; T814-A817 WeakPolarHBondContact O-CB 3.1Å; T814-A817 PolarHBondContact O-N 3.04Å; T814-L818 HydrophobicContact CG2-CD1 4.42Å; T814-L818 WeakPolarHBondContact O-CG 3.45Å; T814-L818 PolarHBondContact O-N 2.79Å
815	L	93.1	Very high	87.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-40.1	176.3	-66.6	170	0	0	0	111.5	P810 R811 A817 L818 A819 F846 A850 Y853 Y854	P810-L815 HydrophobicContact CB-CD1 4.06Å; P810-L815 HydrophobicContact CB-CD2 3.82Å; P810-L815 HydrophobicContact CB-CG 3.87Å; R811-L815 PolarHBondContact O-N 3.14Å; L815-A817 VanDerWaalsContact C-N 3.34Å; L815-A817 PolarHBondContact O-N 3.46Å; L815-L818 PolarHBondContact O-N 3.46Å; L815-A819 WeakPolarHBondContact O-CB 3.41Å; L815-A819 PolarHBondContact O-N 3.3Å; L815-F846 HydrophobicContact CD2-CE2 4.25Å; L815-F846 HydrophobicContact CD2-CZ 4.09Å; L815-A850 HydrophobicContact CD2-CB 3.7Å; L815-Y853 HydrophobicContact CB-CD1 3.41Å; L815-Y853 VanDerWaalsContact CB-CD1 3.41Å; L815-Y853 HydrophobicContact CB-CE1 3.64Å; L815-Y853 HydrophobicContact CB-CG 4.2Å; L815-Y853 HydrophobicContact CD1-CD1 3.8Å; L815-Y853 HydrophobicContact CD1-CG 3.8Å; L815-Y853 HydrophobicContact CG-CD1 4.24Å; L815-Y854 HydrophobicContact CB-CE1 3.92Å; L815-Y854 HydrophobicContact CD2-CE2 4.19Å; L815-Y854 WeakPolarHBondContact CD2-OH 3.41Å; L815-Y854 WeakPolarHBondContact O-CE1 3.39Å; L815-Y854 PolarHBondContact O-OH 3.26Å; L815-Y854 VanDerWaalsContact O-OH 3.05Å
816	R	91.8	Very high	87.7	Confident	130 Å²	130	42.2 Å²	42.2	49%	0.491	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-41.2	172.7	-166.5	-179	-58.9	111.3	4.4	112.2	N812 G813 S820 Y853	N812-R816 VanDerWaalsContact O-CB 3.28Å; N812-R816 WeakPolarHBondContact O-CB 3.46Å; N812-R816 PolarHBondContact O-N 2.98Å; G813-R816 WeakPolarHBondContact O-CB 3.12Å; G813-R816 PolarHBondContact O-N 3.12Å; R816-S820 WeakPolarHBondContact O-CB 3.44Å; R816-S820 PolarHBondContact O-N 3.29Å; R816-Y853 PolarHBondContact NE-OH 3.19Å; R816-Y853 PolarHBondContact NH2-OH 2.99Å
817	A	91.9	Very high	88	Confident	2 Å²	2	42.6 Å²	42.6	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-53.1	176.6	0	0	0	0	0	110.7	L788 G813 T814 L815 A819 S820 L821	L788-A817 HydrophobicContact CB-CB 4Å; L788-A817 HydrophobicContact CD1-CB 4.33Å; G813-A817 PolarHBondContact O-N 2.72Å; T814-A817 WeakPolarHBondContact O-CB 3.1Å; T814-A817 PolarHBondContact O-N 3.04Å; L815-A817 VanDerWaalsContact C-N 3.34Å; L815-A817 PolarHBondContact O-N 3.46Å; A817-A819 PolarHBondContact O-N 3.43Å; A817-S820 WeakPolarHBondContact O-CB 3.5Å; A817-S820 PolarHBondContact O-N 3.32Å; A817-S820 VanDerWaalsContact O-N 3.14Å; A817-S820 PolarHBondContact O-OG 3.1Å; A817-L821 PolarHBondContact O-N 3.13Å
818	L	93.8	Very high	88.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-55.2	-50.3	177.7	-73.4	168.7	0	0	0	112.6	F784 L788 L800 T814 L815 S820 L821 Y836 L837 F846	F784-L818 HydrophobicContact CZ-CD2 4.42Å; L788-L818 HydrophobicContact CD1-CD2 3.58Å; L788-L818 HydrophobicContact CD1-CG 3.9Å; L800-L818 HydrophobicContact CD2-CD2 3.74Å; T814-L818 HydrophobicContact CG2-CD1 4.42Å; T814-L818 WeakPolarHBondContact O-CG 3.45Å; T814-L818 PolarHBondContact O-N 2.79Å; L815-L818 PolarHBondContact O-N 3.46Å; L818-S820 VanDerWaalsContact C-N 3.32Å; L818-S820 PolarHBondContact O-N 2.94Å; L818-L821 WeakPolarHBondContact O-CB 3.37Å; L818-L821 PolarHBondContact O-N 2.88Å; L818-Y836 HydrophobicContact CD1-CE1 4.26Å; L818-Y836 HydrophobicContact CD2-CD1 3.74Å; L818-Y836 HydrophobicContact CD2-CE1 3.81Å; L818-L837 HydrophobicContact CB-CD1 4.31Å; L818-L837 HydrophobicContact CB-CD2 4.37Å; L818-L837 HydrophobicContact CD1-CD2 4.19Å; L818-F846 HydrophobicContact CD1-CE2 4.45Å; L818-F846 HydrophobicContact CD1-CZ 4.15Å
819	A	93.6	Very high	88.9	Confident	6 Å²	6	46.9 Å²	46.9	5%	0.05	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-34.7	178.3	0	0	0	0	0	112.8	L815 A817 L821 L822 Y854 A868 A872	L815-A819 WeakPolarHBondContact O-CB 3.41Å; L815-A819 PolarHBondContact O-N 3.3Å; A817-A819 PolarHBondContact O-N 3.43Å; A819-L821 PolarHBondContact O-N 3.08Å; A819-L822 WeakPolarHBondContact O-CB 3.27Å; A819-L822 PolarHBondContact O-N 2.87Å; A819-Y854 HydrophobicContact CB-CD1 4.26Å; A819-Y854 HydrophobicContact CB-CE1 3.55Å; A819-A868 HydrophobicContact CB-CB 4.1Å; A819-A868 WeakPolarHBondContact O-CB 3.4Å; A819-A872 HydrophobicContact CB-CB 4.18Å
820	S	91.9	Very high	89.4	Confident	50 Å²	50	45 Å²	45	35%	0.35	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-34.7	177.1	77.3	0	0	0	0	112.5	R816 A817 L818 L822 T823 A824	R816-S820 WeakPolarHBondContact O-CB 3.44Å; R816-S820 PolarHBondContact O-N 3.29Å; A817-S820 WeakPolarHBondContact O-CB 3.5Å; A817-S820 PolarHBondContact O-N 3.32Å; A817-S820 VanDerWaalsContact O-N 3.14Å; A817-S820 PolarHBondContact O-OG 3.1Å; L818-S820 VanDerWaalsContact C-N 3.32Å; L818-S820 PolarHBondContact O-N 2.94Å; S820-L822 VanDerWaalsContact C-N 3.32Å; S820-L822 PolarHBondContact O-N 3.32Å; S820-T823 CarbonylContact O-C 3.51Å; S820-T823 PolarHBondContact O-N 2.95Å; S820-T823 PolarHBondContact O-OG1 3Å; S820-A824 PolarHBondContact O-N 3.08Å
821	L	92.4	Very high	89.9	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-29.3	178.4	-61	-176.3	0	0	0	113	L788 L800 A817 L818 A819 T823 A824 V829 N830 A833	L788-L821 HydrophobicContact CB-CD1 4.27Å; L788-L821 HydrophobicContact CD1-CD1 4.4Å; L788-L821 HydrophobicContact CD2-CD1 3.98Å; L788-L821 HydrophobicContact CG-CD1 4.44Å; L800-L821 HydrophobicContact CD1-CD1 4.36Å; A817-L821 PolarHBondContact O-N 3.13Å; L818-L821 WeakPolarHBondContact O-CB 3.37Å; L818-L821 PolarHBondContact O-N 2.88Å; A819-L821 PolarHBondContact O-N 3.08Å; L821-T823 PolarHBondContact O-N 3.32Å; L821-T823 VanDerWaalsContact O-N 3.08Å; L821-A824 VanDerWaalsContact O-CB 3.31Å; L821-A824 WeakPolarHBondContact O-CB 3.36Å; L821-A824 PolarHBondContact O-N 3.28Å; L821-V829 HydrophobicContact CB-CG1 4.27Å; L821-V829 HydrophobicContact CD1-CG1 4.15Å; L821-V829 HydrophobicContact CD2-CG1 3.87Å; L821-V829 HydrophobicContact CG-CG1 4.32Å; L821-N830 WeakPolarHBondContact O-CA 3.5Å; L821-A833 HydrophobicContact CB-CB 3.58Å; L821-A833 HydrophobicContact CD1-CB 4.34Å
822	L	91.6	Very high	90.4	Very high	12 Å²	12	49.7 Å²	49.7	6%	0.063	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-10.2	170.5	-55.6	-179.6	0	0	0	113.4	A819 S820 N830 A833 A834 L837 A872	A819-L822 WeakPolarHBondContact O-CB 3.27Å; A819-L822 PolarHBondContact O-N 2.87Å; S820-L822 VanDerWaalsContact C-N 3.32Å; S820-L822 PolarHBondContact O-N 3.32Å; L822-N830 VanDerWaalsContact C-ND2 3.26Å; L822-N830 PolarHBondContact O-ND2 2.93Å; L822-A833 HydrophobicContact CD2-CB 3.94Å; L822-A834 HydrophobicContact CD2-CB 3.78Å; L822-L837 HydrophobicContact CD1-CD1 3.73Å; L822-L837 HydrophobicContact CD2-CD1 4.23Å; L822-L837 HydrophobicContact CG-CD1 4.14Å; L822-A872 VanDerWaalsContact CD1-CA 3.44Å; L822-A872 HydrophobicContact CD1-CB 3.68Å; L822-A872 VanDerWaalsContact CD1-N 3.29Å
823	T	87.6	Confident	90.7	Very high	43 Å²	43	47 Å²	47	26%	0.264	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	12.3	175.3	70.3	0	0	0	0	113.3	S820 L821 Q864 A868	S820-T823 CarbonylContact O-C 3.51Å; S820-T823 PolarHBondContact O-N 2.95Å; S820-T823 PolarHBondContact O-OG1 3Å; L821-T823 PolarHBondContact O-N 3.32Å; L821-T823 VanDerWaalsContact O-N 3.08Å; T823-Q864 PolarHBondContact OG1-NE2 3.03Å; T823-A868 HydrophobicContact CG2-CB 3.78Å
824	A	84.5	Confident	91.1	Very high	25 Å²	25	46.2 Å²	46.2	21%	0.207	24%	0.243	C	C	.	.			trans	-69.5	148.6	176.8	0	0	0	0	0	112.1	S820 L821 D826	S820-A824 PolarHBondContact O-N 3.08Å; L821-A824 VanDerWaalsContact O-CB 3.31Å; L821-A824 WeakPolarHBondContact O-CB 3.36Å; L821-A824 PolarHBondContact O-N 3.28Å; A824-D826 PolarHBondContact O-N 3.37Å
825	E	82.1	Confident	91.3	Very high	205 Å²	205	50.1 Å²	50.1	96%	0.958	26%	0.263	S	S	*	.	S	Bend	trans	-66.3	-23.7	176.2	-61.6	-173.6	171.5	0	0	113.2
826	D	87.9	Confident	91.3	Very high	48 Å²	48	51 Å²	51	26%	0.257	27%	0.267	S	S	.	.			trans	-84.5	119.9	178.1	-175.7	-83.9	0	0	0	111.5	F793 A824 Q828 V829 N830	F793-D826 HydrophobicContact CD1-CB 4.12Å; F793-D826 HydrophobicContact CE1-CB 4.14Å; A824-D826 PolarHBondContact O-N 3.37Å; D826-Q828 VanDerWaalsContact C-N 3.33Å; D826-Q828 PolarHBondContact O-N 3.12Å; D826-Q828 WeakPolarHBondContact OD1-CA 3.43Å; D826-Q828 WeakPolarHBondContact OD1-CB 3.14Å; D826-Q828 PolarHBondContact OD1-N 2.99Å; D826-V829 HydrophobicContact CB-CB 4.36Å; D826-V829 HydrophobicContact CB-CG2 4.38Å; D826-V829 PolarHBondContact OD1-N 3.34Å; D826-N830 VanDerWaalsContact O-CB 3.25Å; D826-N830 WeakPolarHBondContact O-CB 3.26Å; D826-N830 PolarHBondContact O-N 3.48Å
827	P	89.2	Confident	91.4	Very high	98 Å²	98	44.8 Å²	44.8	64%	0.636	24%	0.243	S	C	*	.	H	α-helix	trans	-75.3	-16.9	-175	31.1	-36.2	0	0	0	114	K831	P827-K831 WeakPolarHBondContact O-CB 3.32Å; P827-K831 PolarHBondContact O-N 3.49Å; P827-K831 VanDerWaalsContact O-N 3.14Å
828	Q	91.1	Very high	91.5	Very high	132 Å²	132	47.3 Å²	47.3	62%	0.617	26%	0.261	S	S	*	.	H	α-helix	trans	-78.6	-46	175.9	-60.5	-170.4	-20.3	0	0	110.3	D826 N830 K831 A832	D826-Q828 VanDerWaalsContact C-N 3.33Å; D826-Q828 PolarHBondContact O-N 3.12Å; D826-Q828 WeakPolarHBondContact OD1-CA 3.43Å; D826-Q828 WeakPolarHBondContact OD1-CB 3.14Å; D826-Q828 PolarHBondContact OD1-N 2.99Å; Q828-N830 VanDerWaalsContact C-N 3.34Å; Q828-K831 PolarHBondContact O-N 2.91Å; Q828-A832 WeakPolarHBondContact O-CB 3.35Å; Q828-A832 PolarHBondContact O-N 2.87Å
829	V	90.8	Very high	91.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-40	174.7	178.6	0	0	0	0	111.1	F793 L797 L821 D826 A832 A833	F793-V829 HydrophobicContact CB-CG2 4.17Å; F793-V829 HydrophobicContact CD1-CG2 4.13Å; L797-V829 HydrophobicContact CD1-CG2 4.45Å; L797-V829 HydrophobicContact CD2-CG2 4.04Å; L797-V829 HydrophobicContact CG-CG2 4.01Å; L821-V829 HydrophobicContact CB-CG1 4.27Å; L821-V829 HydrophobicContact CD1-CG1 4.15Å; L821-V829 HydrophobicContact CD2-CG1 3.87Å; L821-V829 HydrophobicContact CG-CG1 4.32Å; D826-V829 HydrophobicContact CB-CB 4.36Å; D826-V829 HydrophobicContact CB-CG2 4.38Å; D826-V829 PolarHBondContact OD1-N 3.34Å; V829-A832 PolarHBondContact O-N 2.79Å; V829-A833 WeakPolarHBondContact O-CB 3.34Å; V829-A833 PolarHBondContact O-N 2.82Å
830	N	92.4	Very high	91.1	Very high	50 Å²	50	50.1 Å²	50.1	27%	0.267	28%	0.28	S	S	.	.	H	α-helix	trans	-57.9	-53.1	174	-170.4	-59.6	0	0	0	111.4	L821 L822 D826 Q828 A832 A833 A834	L821-N830 WeakPolarHBondContact O-CA 3.5Å; L822-N830 VanDerWaalsContact C-ND2 3.26Å; L822-N830 PolarHBondContact O-ND2 2.93Å; D826-N830 VanDerWaalsContact O-CB 3.25Å; D826-N830 WeakPolarHBondContact O-CB 3.26Å; D826-N830 PolarHBondContact O-N 3.48Å; Q828-N830 VanDerWaalsContact C-N 3.34Å; N830-A832 PolarHBondContact O-N 3.12Å; N830-A833 PolarHBondContact O-N 2.97Å; N830-A834 PolarHBondContact O-N 3.21Å
831	K	93.4	Very high	90.9	Very high	121 Å²	121	49.2 Å²	49.2	53%	0.526	28%	0.276	S	S	.	.	H	α-helix	trans	-62.3	-43.9	177.9	-171.3	-177.4	-174.3	-70.3	0	112.2	P827 Q828 A833 A834 D835	P827-K831 WeakPolarHBondContact O-CB 3.32Å; P827-K831 PolarHBondContact O-N 3.49Å; P827-K831 VanDerWaalsContact O-N 3.14Å; Q828-K831 PolarHBondContact O-N 2.91Å; K831-A833 VanDerWaalsContact C-N 3.32Å; K831-A833 PolarHBondContact O-N 3.46Å; K831-A834 PolarHBondContact O-N 2.72Å; K831-A834 VanDerWaalsContact O-N 3.12Å; K831-D835 IonicContact NZ-OD1 3.98Å; K831-D835 PolarHBondContact NZ-OD1 3.47Å; K831-D835 IonicContact NZ-OD2 3.88Å; K831-D835 PolarHBondContact NZ-OD2 3.44Å; K831-D835 WeakPolarHBondContact O-CB 3.46Å; K831-D835 VanDerWaalsContact O-CG 3.29Å; K831-D835 PolarHBondContact O-N 3.4Å
832	A	94.2	Very high	90.7	Very high	24 Å²	24	54.5 Å²	54.5	20%	0.198	31%	0.313	C	S	.	.	H	α-helix	trans	-60.4	-41.8	179.2	0	0	0	0	0	111.9	L797 L800 Q828 V829 N830 Y836	L797-A832 HydrophobicContact CD2-CB 3.49Å; L797-A832 VanDerWaalsContact CD2-CB 3.49Å; L800-A832 HydrophobicContact CD1-CB 3.95Å; Q828-A832 WeakPolarHBondContact O-CB 3.35Å; Q828-A832 PolarHBondContact O-N 2.87Å; V829-A832 PolarHBondContact O-N 2.79Å; N830-A832 PolarHBondContact O-N 3.12Å; A832-Y836 WeakPolarHBondContact O-CB 3.12Å; A832-Y836 PolarHBondContact O-N 3.09Å
833	A	94.4	Very high	90.6	Very high	0 Å²	0	56 Å²	56	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-35.2	174.8	0	0	0	0	0	112.8	L800 L821 L822 V829 N830 K831 L837	L800-A833 HydrophobicContact CD1-CB 4.36Å; L821-A833 HydrophobicContact CB-CB 3.58Å; L821-A833 HydrophobicContact CD1-CB 4.34Å; L822-A833 HydrophobicContact CD2-CB 3.94Å; V829-A833 WeakPolarHBondContact O-CB 3.34Å; V829-A833 PolarHBondContact O-N 2.82Å; N830-A833 PolarHBondContact O-N 2.97Å; K831-A833 VanDerWaalsContact C-N 3.32Å; K831-A833 PolarHBondContact O-N 3.46Å; A833-L837 WeakPolarHBondContact O-CB 3.47Å; A833-L837 WeakPolarHBondContact O-CG 3.25Å; A833-L837 PolarHBondContact O-N 3.39Å
834	A	94.3	Very high	90.6	Very high	21 Å²	21	64.5 Å²	64.5	17%	0.174	35%	0.348	C	S	.	.	H	α-helix	trans	-70.1	-46.4	175.9	0	0	0	0	0	112.4	L822 N830 K831 Y836 S838	L822-A834 HydrophobicContact CD2-CB 3.78Å; N830-A834 PolarHBondContact O-N 3.21Å; K831-A834 PolarHBondContact O-N 2.72Å; K831-A834 VanDerWaalsContact O-N 3.12Å; A834-Y836 VanDerWaalsContact C-N 3.32Å; A834-Y836 PolarHBondContact O-N 3.45Å; A834-S838 VanDerWaalsContact O-CB 3.25Å; A834-S838 WeakPolarHBondContact O-CB 3.37Å; A834-S838 PolarHBondContact O-N 2.94Å; A834-S838 PolarHBondContact O-OG 3.18Å
835	D	94.3	Very high	90.7	Very high	85 Å²	85	68.3 Å²	68.3	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-59.9	-44.3	174.6	-66.8	-24.5	0	0	0	110.1	K831 S838 S839	K831-D835 IonicContact NZ-OD1 3.98Å; K831-D835 PolarHBondContact NZ-OD1 3.47Å; K831-D835 IonicContact NZ-OD2 3.88Å; K831-D835 PolarHBondContact NZ-OD2 3.44Å; K831-D835 WeakPolarHBondContact O-CB 3.46Å; K831-D835 VanDerWaalsContact O-CG 3.29Å; K831-D835 PolarHBondContact O-N 3.4Å; D835-S838 PolarHBondContact O-N 3.45Å; D835-S839 PolarHBondContact O-N 3.13Å
836	Y	93.8	Very high	91.1	Very high	18 Å²	18	58.6 Å²	58.6	7%	0.071	32%	0.316	C	S	.	.	H	α-helix	trans	-59.8	-55.9	177	-170.9	-101.9	0	0	0	111.6	F784 L800 V803 L805 L808 L818 A832 A834 S838 S839 G840	F784-Y836 HydrophobicContact CZ-CE1 4.08Å; F784-Y836 AromaticContact CZ-CZ 3.97Å; L800-Y836 HydrophobicContact CB-CD2 4.31Å; L800-Y836 HydrophobicContact CD2-CD1 3.85Å; L800-Y836 HydrophobicContact CD2-CD2 4.23Å; L800-Y836 HydrophobicContact CD2-CE1 4.09Å; L800-Y836 HydrophobicContact CD2-CE2 4.47Å; L800-Y836 HydrophobicContact CD2-CG 3.91Å; L800-Y836 WeakPolarHBondContact O-CD2 3.47Å; L800-Y836 WeakPolarHBondContact O-CE2 3.33Å; V803-Y836 VanDerWaalsContact O-CE2 3.29Å; V803-Y836 WeakPolarHBondContact O-CE2 3.45Å; V803-Y836 PolarHBondContact O-OH 3.12Å; L805-Y836 WeakPolarHBondContact CD1-O 3.3Å; L805-Y836 HydrophobicContact CD2-CD1 3.91Å; L805-Y836 HydrophobicContact CD2-CE1 3.23Å; L805-Y836 HydrophobicContact CD2-CE2 4.35Å; L805-Y836 VanDerWaalsContact CD2-CZ 3.49Å; L805-Y836 HydrophobicContact CG-CD1 4.43Å; L805-Y836 HydrophobicContact CG-CE1 3.94Å; L805-Y836 HydrophobicContact CG-CE2 4.2Å; L808-Y836 WeakPolarHBondContact CD1-OH 3.36Å; L818-Y836 HydrophobicContact CD1-CE1 4.26Å; L818-Y836 HydrophobicContact CD2-CD1 3.74Å; L818-Y836 HydrophobicContact CD2-CE1 3.81Å; A832-Y836 WeakPolarHBondContact O-CB 3.12Å; A832-Y836 PolarHBondContact O-N 3.09Å; A834-Y836 VanDerWaalsContact C-N 3.32Å; A834-Y836 PolarHBondContact O-N 3.45Å; Y836-S838 VanDerWaalsContact C-N 3.27Å; Y836-S838 PolarHBondContact O-N 2.72Å; Y836-S839 PolarHBondContact O-N 2.83Å; Y836-S839 PolarHBondContact O-OG 3.18Å; Y836-G840 PolarHBondContact O-N 3.12Å
837	L	94.2	Very high	91.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-33.5	177.9	-77.5	170.2	0	0	0	112.9	L818 L822 A833 G840 A841 F846 Y854 A872 C875 L876	L818-L837 HydrophobicContact CB-CD1 4.31Å; L818-L837 HydrophobicContact CB-CD2 4.37Å; L818-L837 HydrophobicContact CD1-CD2 4.19Å; L822-L837 HydrophobicContact CD1-CD1 3.73Å; L822-L837 HydrophobicContact CD2-CD1 4.23Å; L822-L837 HydrophobicContact CG-CD1 4.14Å; A833-L837 WeakPolarHBondContact O-CB 3.47Å; A833-L837 WeakPolarHBondContact O-CG 3.25Å; A833-L837 PolarHBondContact O-N 3.39Å; L837-G840 WeakPolarHBondContact O-CA 3.36Å; L837-G840 PolarHBondContact O-N 3.09Å; L837-G840 VanDerWaalsContact O-N 3.13Å; L837-A841 PolarHBondContact O-N 3.13Å; L837-F846 HydrophobicContact CD2-CE1 3.83Å; L837-F846 HydrophobicContact CD2-CZ 3.74Å; L837-Y854 HydrophobicContact CD2-CE2 4.49Å; L837-A872 HydrophobicContact CD1-CB 4.14Å; L837-C875 HydrophobicContact CB-CB 3.9Å; L837-L876 WeakPolarHBondContact O-CD2 3.46Å
838	S	93.9	Very high	91.3	Very high	54 Å²	54	56.7 Å²	56.7	38%	0.378	31%	0.306	S	S	.	.	H	α-helix	trans	-69.6	-35.8	177.2	-55.4	0	0	0	0	112.3	A834 D835 Y836 G840 A841 C875	A834-S838 VanDerWaalsContact O-CB 3.25Å; A834-S838 WeakPolarHBondContact O-CB 3.37Å; A834-S838 PolarHBondContact O-N 2.94Å; A834-S838 PolarHBondContact O-OG 3.18Å; D835-S838 PolarHBondContact O-N 3.45Å; Y836-S838 VanDerWaalsContact C-N 3.27Å; Y836-S838 PolarHBondContact O-N 2.72Å; S838-G840 PolarHBondContact O-N 3.5Å; S838-A841 VanDerWaalsContact O-CB 3.26Å; S838-A841 WeakPolarHBondContact O-CB 3.34Å; S838-A841 PolarHBondContact O-N 2.87Å; S838-A841 VanDerWaalsContact O-N 3.11Å; S838-C875 WeakPolarHBondContact OG-CB 3.4Å
839	S	91.8	Very high	91.2	Very high	65 Å²	65	54.4 Å²	54.4	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-34.3	169.3	78.9	0	0	0	0	111.6	L805 D835 Y836 A841 S842	L805-S839 WeakPolarHBondContact CD1-OG 3.4Å; D835-S839 PolarHBondContact O-N 3.13Å; Y836-S839 PolarHBondContact O-N 2.83Å; Y836-S839 PolarHBondContact O-OG 3.18Å; S839-A841 PolarHBondContact O-N 2.91Å; S839-S842 PolarHBondContact O-N 3.07Å; S839-S842 PolarHBondContact O-OG 3.27Å
840	G	87.9	Confident	91.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.9	174.9	0	0	0	0	0	115.6	L805 Y836 L837 S838 S842 D843	L805-G840 VanDerWaalsContact CD1-N 3.26Å; Y836-G840 PolarHBondContact O-N 3.12Å; L837-G840 WeakPolarHBondContact O-CA 3.36Å; L837-G840 PolarHBondContact O-N 3.09Å; L837-G840 VanDerWaalsContact O-N 3.13Å; S838-G840 PolarHBondContact O-N 3.5Å; G840-S842 PolarHBondContact O-N 3.36Å; G840-D843 PolarHBondContact O-N 3.32Å
841	A	87.8	Confident	91.4	Very high	32 Å²	32	52.6 Å²	52.6	26%	0.264	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.4	170.1	0	0	0	0	0	112.4	L837 S838 S839 R847	L837-A841 PolarHBondContact O-N 3.13Å; S838-A841 VanDerWaalsContact O-CB 3.26Å; S838-A841 WeakPolarHBondContact O-CB 3.34Å; S838-A841 PolarHBondContact O-N 2.87Å; S838-A841 VanDerWaalsContact O-N 3.11Å; S839-A841 PolarHBondContact O-N 2.91Å; A841-R847 WeakPolarHBondContact O-CD 3.35Å
842	S	87.8	Confident	91.2	Very high	111 Å²	111	52 Å²	52	78%	0.776	28%	0.281	S	S	*	.	S	Bend	trans	-85.1	-25.7	177.1	69.8	0	0	0	0	114.4	S839 G840 R844	S839-S842 PolarHBondContact O-N 3.07Å; S839-S842 PolarHBondContact O-OG 3.27Å; G840-S842 PolarHBondContact O-N 3.36Å; S842-R844 PolarHBondContact O-N 3.09Å
843	D	89.9	Confident	91.1	Very high	44 Å²	44	51.2 Å²	51.2	24%	0.235	27%	0.273	C	S	.	.			trans	-83.7	115	179.6	-174.5	-59.5	0	0	0	110.4	G840 H845 F846 R847	G840-D843 PolarHBondContact O-N 3.32Å; D843-H845 VanDerWaalsContact C-N 3.32Å; D843-H845 PolarHBondContact O-N 2.91Å; D843-H845 WeakPolarHBondContact OD1-CA 3.39Å; D843-H845 WeakPolarHBondContact OD1-CB 3.41Å; D843-H845 PolarHBondContact OD1-N 2.87Å; D843-F846 HydrophobicContact CB-CB 4Å; D843-F846 PolarHBondContact OD1-N 3.17Å; D843-R847 WeakPolarHBondContact O-CB 3.42Å; D843-R847 PolarHBondContact O-N 3.15Å
844	R	87.6	Confident	91.1	Very high	222 Å²	222	51.3 Å²	51.3	84%	0.838	27%	0.273	S	S	*	.	H	α-helix	trans	-64.3	-33.1	-175.8	-173.6	178.2	-179.9	-80.3	-4.1	113.3	S842 A848	S842-R844 PolarHBondContact O-N 3.09Å; R844-A848 VanDerWaalsContact O-CB 3.27Å; R844-A848 WeakPolarHBondContact O-CB 3.49Å; R844-A848 PolarHBondContact O-N 3.19Å
845	H	85.9	Confident	90.9	Very high	104 Å²	104	50.9 Å²	50.9	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-78.1	-50.6	-178.5	178	-113.5	0	0	0	110.3	W809 D843 A848 R849	W809-H845 AromaticContact CD1-CE1 3.99Å; D843-H845 VanDerWaalsContact C-N 3.32Å; D843-H845 PolarHBondContact O-N 2.91Å; D843-H845 WeakPolarHBondContact OD1-CA 3.39Å; D843-H845 WeakPolarHBondContact OD1-CB 3.41Å; D843-H845 PolarHBondContact OD1-N 2.87Å; H845-A848 PolarHBondContact O-N 3.41Å; H845-R849 PolarHBondContact O-N 2.94Å
846	F	90.3	Very high	90.6	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-60.9	-50.5	177.9	-178.2	-89.7	0	0	0	111.5	L805 P810 L815 L818 L837 D843 A848 R849 A850 L876	L805-F846 HydrophobicContact CD1-CD1 4.4Å; L805-F846 HydrophobicContact CD1-CE1 4.46Å; L805-F846 HydrophobicContact CD2-CD1 4.28Å; L805-F846 HydrophobicContact CD2-CD2 3.79Å; L805-F846 HydrophobicContact CD2-CE1 4.02Å; L805-F846 HydrophobicContact CD2-CE2 3.51Å; L805-F846 HydrophobicContact CD2-CG 4.19Å; L805-F846 HydrophobicContact CD2-CZ 3.64Å; P810-F846 HydrophobicContact CB-CD2 3.84Å; P810-F846 HydrophobicContact CB-CE2 3.78Å; P810-F846 HydrophobicContact CG-CD2 3.57Å; P810-F846 HydrophobicContact CG-CE2 4.03Å; P810-F846 HydrophobicContact CG-CG 4.31Å; L815-F846 HydrophobicContact CD2-CE2 4.25Å; L815-F846 HydrophobicContact CD2-CZ 4.09Å; L818-F846 HydrophobicContact CD1-CE2 4.45Å; L818-F846 HydrophobicContact CD1-CZ 4.15Å; L837-F846 HydrophobicContact CD2-CE1 3.83Å; L837-F846 HydrophobicContact CD2-CZ 3.74Å; D843-F846 HydrophobicContact CB-CB 4Å; D843-F846 PolarHBondContact OD1-N 3.17Å; F846-A848 PolarHBondContact O-N 3.02Å; F846-R849 PolarHBondContact O-N 2.91Å; F846-A850 HydrophobicContact CD1-CB 4.36Å; F846-A850 HydrophobicContact CE1-CB 4.08Å; F846-A850 HydrophobicContact CZ-CB 4.43Å; F846-A850 WeakPolarHBondContact O-CB 3.45Å; F846-A850 PolarHBondContact O-N 3.33Å; F846-L876 HydrophobicContact CE1-CD2 4.3Å
847	R	92.6	Very high	90.4	Very high	46 Å²	46	48.9 Å²	48.9	17%	0.174	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-47.1	-179.9	-174.9	177	178.1	-79.6	2	111.8	A841 D843 R849 A850 V851 L876 Q877 E880	A841-R847 WeakPolarHBondContact O-CD 3.35Å; D843-R847 WeakPolarHBondContact O-CB 3.42Å; D843-R847 PolarHBondContact O-N 3.15Å; R847-R849 PolarHBondContact O-N 3.42Å; R847-A850 PolarHBondContact O-N 3.48Å; R847-V851 HydrophobicContact CG-CG2 3.93Å; R847-V851 WeakPolarHBondContact O-CB 3.38Å; R847-V851 VanDerWaalsContact O-CG2 3.25Å; R847-V851 WeakPolarHBondContact O-CG2 3.34Å; R847-V851 PolarHBondContact O-N 2.9Å; R847-L876 HydrophobicContact CG-CD2 4.34Å; R847-L876 PolarHBondContact NE-O 3.08Å; R847-Q877 PolarHBondContact NH2-O 2.93Å; R847-E880 IonicContact CZ-OE1 2.69Å; R847-E880 IonicContact CZ-OE2 2.69Å; R847-E880 IonicContact NH1-OE1 3.25Å; R847-E880 PolarHBondContact NH1-OE1 3.44Å; R847-E880 IonicContact NH1-OE2 3.32Å; R847-E880 IonicContact NH2-OE1 3.45Å; R847-E880 PolarHBondContact NH2-OE1 3.24Å; R847-E880 IonicContact NH2-OE2 3.62Å; R847-E880 PolarHBondContact NH2-OE2 2.8Å
848	A	89.6	Confident	90.2	Very high	61 Å²	61	49.2 Å²	49.2	50%	0.504	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-47.9	-177.6	0	0	0	0	0	111.8	R844 H845 F846 E852	R844-A848 VanDerWaalsContact O-CB 3.27Å; R844-A848 WeakPolarHBondContact O-CB 3.49Å; R844-A848 PolarHBondContact O-N 3.19Å; H845-A848 PolarHBondContact O-N 3.41Å; F846-A848 PolarHBondContact O-N 3.02Å; A848-E852 WeakPolarHBondContact O-CB 3.41Å; A848-E852 PolarHBondContact O-N 2.89Å; A848-E852 VanDerWaalsContact O-N 3.16Å
849	R	88.5	Confident	89.6	Confident	83 Å²	83	49.7 Å²	49.7	31%	0.313	26%	0.262	S	S	.	.	H	α-helix	trans	-72.3	-36.3	-179.8	-176.2	55.4	177.2	-178.1	0.1	113	P810 N812 H845 F846 R847 E852 Y853	P810-R849 HydrophobicContact CG-CB 4.03Å; P810-R849 HydrophobicContact CG-CG 4.05Å; P810-R849 WeakPolarHBondContact O-CG 3.22Å; N812-R849 PolarHBondContact OD1-NH2 2.93Å; N812-R849 VanDerWaalsContact OD1-NH2 3.16Å; H845-R849 PolarHBondContact O-N 2.94Å; F846-R849 PolarHBondContact O-N 2.91Å; R847-R849 PolarHBondContact O-N 3.42Å; R849-E852 VanDerWaalsContact CD-OE2 3.31Å; R849-E852 WeakPolarHBondContact CD-OE2 3.25Å; R849-E852 IonicContact CZ-OE2 2.78Å; R849-E852 IonicContact NE-OE2 3.68Å; R849-E852 IonicContact NH1-OE1 2.83Å; R849-E852 IonicContact NH1-OE2 2.75Å; R849-E852 PolarHBondContact NH1-OE2 3.12Å; R849-Y853 WeakPolarHBondContact O-CB 3.29Å; R849-Y853 PolarHBondContact O-N 3.09Å; R849-Y853 VanDerWaalsContact O-N 3.12Å
850	A	93.1	Very high	89.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-44.7	177	0	0	0	0	0	112	L815 F846 R847 Y853 Y854 L876	L815-A850 HydrophobicContact CD2-CB 3.7Å; F846-A850 HydrophobicContact CD1-CB 4.36Å; F846-A850 HydrophobicContact CE1-CB 4.08Å; F846-A850 HydrophobicContact CZ-CB 4.43Å; F846-A850 WeakPolarHBondContact O-CB 3.45Å; F846-A850 PolarHBondContact O-N 3.33Å; R847-A850 PolarHBondContact O-N 3.48Å; A850-Y853 PolarHBondContact O-N 3.45Å; A850-Y854 HydrophobicContact CB-CD2 4.24Å; A850-Y854 HydrophobicContact CB-CE2 3.9Å; A850-Y854 WeakPolarHBondContact O-CB 3.19Å; A850-Y854 WeakPolarHBondContact O-CD2 3.43Å; A850-Y854 PolarHBondContact O-N 3.1Å; A850-L876 HydrophobicContact CB-CD1 3.58Å
851	V	93.8	Very high	88	Confident	12 Å²	12	55.4 Å²	55.4	7%	0.073	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-44	176.9	170.1	0	0	0	0	111.4	R847 T855 L873 L876 A878	R847-V851 HydrophobicContact CG-CG2 3.93Å; R847-V851 WeakPolarHBondContact O-CB 3.38Å; R847-V851 VanDerWaalsContact O-CG2 3.25Å; R847-V851 WeakPolarHBondContact O-CG2 3.34Å; R847-V851 PolarHBondContact O-N 2.9Å; V851-T855 WeakPolarHBondContact O-CB 3.48Å; V851-T855 PolarHBondContact O-N 2.97Å; V851-T855 PolarHBondContact O-OG1 2.8Å; V851-L873 HydrophobicContact CB-CD2 4.49Å; V851-L873 HydrophobicContact CG1-CD2 4.34Å; V851-L873 HydrophobicContact CG2-CD2 4.44Å; V851-L876 HydrophobicContact CG2-CB 4.21Å; V851-L876 HydrophobicContact CG2-CD1 4.15Å; V851-A878 HydrophobicContact CB-CB 4.44Å; V851-A878 HydrophobicContact CG1-CB 4.02Å; V851-A878 HydrophobicContact CG2-CB 3.62Å
852	E	89.6	Confident	87.8	Confident	108 Å²	108	55.2 Å²	55.2	51%	0.505	30%	0.304	S	S	.	.	H	α-helix	trans	-54.6	-53.9	173.8	-178.3	-169.6	-163.8	0	0	111.4	A848 R849 T855 Q856	A848-E852 WeakPolarHBondContact O-CB 3.41Å; A848-E852 PolarHBondContact O-N 2.89Å; A848-E852 VanDerWaalsContact O-N 3.16Å; R849-E852 VanDerWaalsContact CD-OE2 3.31Å; R849-E852 WeakPolarHBondContact CD-OE2 3.25Å; R849-E852 IonicContact CZ-OE2 2.78Å; R849-E852 IonicContact NE-OE2 3.68Å; R849-E852 IonicContact NH1-OE1 2.83Å; R849-E852 IonicContact NH1-OE2 2.75Å; R849-E852 PolarHBondContact NH1-OE2 3.12Å; E852-T855 PolarHBondContact O-N 2.82Å; E852-Q856 PolarHBondContact O-N 3.03Å; E852-Q856 VanDerWaalsContact O-N 3.09Å
853	Y	91.1	Very high	87.7	Confident	9 Å²	9	52.4 Å²	52.4	4%	0.035	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-46.3	-177.3	175	-101.1	0	0	0	113.1	N812 L815 R816 R849 A850 Q856 A857	N812-Y853 HydrophobicContact CB-CD2 3.91Å; N812-Y853 HydrophobicContact CB-CE2 3.56Å; N812-Y853 PolarHBondContact O-OH 3.42Å; L815-Y853 HydrophobicContact CB-CD1 3.41Å; L815-Y853 VanDerWaalsContact CB-CD1 3.41Å; L815-Y853 HydrophobicContact CB-CE1 3.64Å; L815-Y853 HydrophobicContact CB-CG 4.2Å; L815-Y853 HydrophobicContact CD1-CD1 3.8Å; L815-Y853 HydrophobicContact CD1-CG 3.8Å; L815-Y853 HydrophobicContact CG-CD1 4.24Å; R816-Y853 PolarHBondContact NE-OH 3.19Å; R816-Y853 PolarHBondContact NH2-OH 2.99Å; R849-Y853 WeakPolarHBondContact O-CB 3.29Å; R849-Y853 PolarHBondContact O-N 3.09Å; R849-Y853 VanDerWaalsContact O-N 3.12Å; A850-Y853 PolarHBondContact O-N 3.45Å; Y853-Q856 WeakPolarHBondContact O-CB 3.32Å; Y853-Q856 PolarHBondContact O-N 3.4Å; Y853-A857 PolarHBondContact O-N 3.1Å
854	Y	94.4	Very high	87.6	Confident	1 Å²	1	54.6 Å²	54.6	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-70.5	-33.2	-179.5	-60.7	-46.4	0	0	0	112	L815 A819 L837 A850 A857 L858 A872 L876	L815-Y854 HydrophobicContact CB-CE1 3.92Å; L815-Y854 HydrophobicContact CD2-CE2 4.19Å; L815-Y854 WeakPolarHBondContact CD2-OH 3.41Å; L815-Y854 WeakPolarHBondContact O-CE1 3.39Å; L815-Y854 PolarHBondContact O-OH 3.26Å; L815-Y854 VanDerWaalsContact O-OH 3.05Å; A819-Y854 HydrophobicContact CB-CD1 4.26Å; A819-Y854 HydrophobicContact CB-CE1 3.55Å; L837-Y854 HydrophobicContact CD2-CE2 4.49Å; A850-Y854 HydrophobicContact CB-CD2 4.24Å; A850-Y854 HydrophobicContact CB-CE2 3.9Å; A850-Y854 WeakPolarHBondContact O-CB 3.19Å; A850-Y854 WeakPolarHBondContact O-CD2 3.43Å; A850-Y854 PolarHBondContact O-N 3.1Å; Y854-A857 PolarHBondContact O-N 2.7Å; Y854-L858 WeakPolarHBondContact O-CG 3.4Å; Y854-L858 PolarHBondContact O-N 3.34Å; Y854-L858 VanDerWaalsContact O-N 3.16Å; Y854-A872 HydrophobicContact CD1-CB 4.09Å; Y854-A872 HydrophobicContact CD2-CB 3.55Å; Y854-A872 HydrophobicContact CE1-CB 4.02Å; Y854-A872 HydrophobicContact CE2-CB 3.45Å; Y854-A872 VanDerWaalsContact CE2-CB 3.45Å; Y854-A872 HydrophobicContact CG-CB 3.89Å; Y854-L876 HydrophobicContact CD2-CD1 3.82Å; Y854-L876 HydrophobicContact CE2-CD1 3.82Å
855	T	92.2	Very high	87.7	Confident	13 Å²	13	46.1 Å²	46.1	8%	0.08	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-42.6	172.3	-57.4	0	0	0	0	111.3	W634 V851 E852 L858 S881 A884	W634-T855 HydrophobicContact CH2-CG2 3.7Å; W634-T855 HydrophobicContact CZ2-CG2 4.01Å; W634-T855 HydrophobicContact CZ3-CG2 4.22Å; V851-T855 WeakPolarHBondContact O-CB 3.48Å; V851-T855 PolarHBondContact O-N 2.97Å; V851-T855 PolarHBondContact O-OG1 2.8Å; E852-T855 PolarHBondContact O-N 2.82Å; T855-L858 WeakPolarHBondContact O-CB 3.44Å; T855-L858 PolarHBondContact O-N 3.07Å; T855-S881 PolarHBondContact OG1-OG 2.84Å; T855-A884 HydrophobicContact CG2-CB 4.05Å
856	Q	87.8	Confident	88	Confident	59 Å²	59	42.6 Å²	42.6	28%	0.276	25%	0.249	S	C	.	.	H	α-helix	trans	-59.5	-46.5	171.2	176.5	-175	-45.1	0	0	111.2	W634 E852 Y853 L858 S859 E860	W634-Q856 HydrophobicContact CB-CG 4Å; E852-Q856 PolarHBondContact O-N 3.03Å; E852-Q856 VanDerWaalsContact O-N 3.09Å; Y853-Q856 WeakPolarHBondContact O-CB 3.32Å; Y853-Q856 PolarHBondContact O-N 3.4Å; Q856-L858 PolarHBondContact O-N 3.36Å; Q856-S859 WeakPolarHBondContact O-CB 3.32Å; Q856-S859 PolarHBondContact O-N 2.76Å; Q856-S859 PolarHBondContact O-OG 3.47Å; Q856-E860 PolarHBondContact NE2-OE1 2.84Å
857	A	89.3	Confident	88.1	Confident	2 Å²	2	45 Å²	45	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-61.9	-23.9	-176.5	0	0	0	0	0	114	Y853 Y854 S859 E860 A869	Y853-A857 PolarHBondContact O-N 3.1Å; Y854-A857 PolarHBondContact O-N 2.7Å; A857-S859 PolarHBondContact O-N 2.84Å; A857-E860 PolarHBondContact O-N 2.76Å; A857-E860 VanDerWaalsContact O-N 3.16Å; A857-A869 HydrophobicContact CB-CB 3.84Å
858	L	89	Confident	88.2	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.037	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.5	170.6	-61.9	-172	0	0	0	113.3	Y854 T855 Q856 Q866 A869 C870 L873 A884 V885 L888	Y854-L858 WeakPolarHBondContact O-CG 3.4Å; Y854-L858 PolarHBondContact O-N 3.34Å; Y854-L858 VanDerWaalsContact O-N 3.16Å; T855-L858 WeakPolarHBondContact O-CB 3.44Å; T855-L858 PolarHBondContact O-N 3.07Å; Q856-L858 PolarHBondContact O-N 3.36Å; L858-Q866 PolarHBondContact O-NE2 3.37Å; L858-A869 HydrophobicContact CD2-CB 3.78Å; L858-C870 HydrophobicContact CD2-CB 4.47Å; L858-C870 VanDerWaalsContact CD2-SG 3.52Å; L858-L873 HydrophobicContact CD1-CD1 3.7Å; L858-L873 HydrophobicContact CD2-CD1 4.11Å; L858-L873 HydrophobicContact CG-CD1 3.98Å; L858-A884 HydrophobicContact CD1-CB 3.81Å; L858-V885 HydrophobicContact CD1-CG2 3.72Å; L858-L888 HydrophobicContact CB-CD1 4Å; L858-L888 HydrophobicContact CD1-CD1 4.32Å; L858-L888 HydrophobicContact CD2-CD1 3.82Å; L858-L888 HydrophobicContact CG-CD1 4.26Å
859	S	82.4	Confident	88.4	Confident	63 Å²	63	40.3 Å²	40.3	44%	0.441	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.6	179.3	76	0	0	0	0	114.4	Q856 A857	Q856-S859 WeakPolarHBondContact O-CB 3.32Å; Q856-S859 PolarHBondContact O-N 2.76Å; Q856-S859 PolarHBondContact O-OG 3.47Å; A857-S859 PolarHBondContact O-N 2.84Å
860	E	79.7	Confident	88.7	Confident	68 Å²	68	36.4 Å²	36.4	32%	0.318	21%	0.214	S	C	.	.	S	Bend	trans	-80.9	148.9	-177.3	-65	-175.4	179.1	0	0	111.3	Q856 A857 G862	Q856-E860 PolarHBondContact NE2-OE1 2.84Å; A857-E860 PolarHBondContact O-N 2.76Å; A857-E860 VanDerWaalsContact O-N 3.16Å; E860-G862 PolarHBondContact O-N 3.22Å
861	A	66.4	Low	88.8	Confident	117 Å²	117	37.9 Å²	37.9	97%	0.967	23%	0.225	S	C	*	.	S	Bend	trans	-75.5	94	-172.9	0	0	0	0	0	112.1
862	G	82.3	Confident	89	Confident	29 Å²	29	37.3 Å²	37.3	30%	0.299	22%	0.221	S	C	.	.			trans	166.2	114.9	167.8	0	0	0	0	0	113.9	E860 Q864 S865 Q866	E860-G862 PolarHBondContact O-N 3.22Å; G862-Q864 PolarHBondContact O-N 3.22Å; G862-S865 WeakPolarHBondContact O-CA 3.38Å; G862-S865 WeakPolarHBondContact O-CB 3.47Å; G862-S865 PolarHBondContact O-N 2.99Å; G862-Q866 WeakPolarHBondContact O-CG 2.77Å; G862-Q866 PolarHBondContact O-N 3.19Å
863	V	86.8	Confident	89.3	Confident	51 Å²	51	32.2 Å²	32.2	31%	0.309	20%	0.197	S	C	.	.	H	α-helix	trans	-49.3	-38.7	-178.6	-176.1	0	0	0	0	112.7	R867 D893 L896	V863-R867 WeakPolarHBondContact O-CB 3.33Å; V863-R867 VanDerWaalsContact O-CG 3.31Å; V863-R867 WeakPolarHBondContact O-CG 3.27Å; V863-R867 PolarHBondContact O-N 3.22Å; V863-D893 HydrophobicContact CG1-CB 4.4Å; V863-L896 HydrophobicContact CG1-CB 3.93Å; V863-L896 HydrophobicContact CG1-CD2 4.34Å
864	Q	87.8	Confident	89.5	Confident	91 Å²	91	32.9 Å²	32.9	43%	0.425	20%	0.203	S	C	.	.	H	α-helix	trans	-66.3	-43.2	176.7	-165.1	67.2	11.5	0	0	113	T823 G862 R867 A868	T823-Q864 PolarHBondContact OG1-NE2 3.03Å; G862-Q864 PolarHBondContact O-N 3.22Å; Q864-R867 PolarHBondContact O-N 2.7Å; Q864-A868 WeakPolarHBondContact O-CB 3.32Å; Q864-A868 PolarHBondContact O-N 2.67Å
865	S	88.4	Confident	89.5	Confident	44 Å²	44	33.8 Å²	33.8	31%	0.308	21%	0.209	S	C	.	.	H	α-helix	trans	-66.4	-43.1	178.3	-162.2	0	0	0	0	110.7	G862 A868 A869	G862-S865 WeakPolarHBondContact O-CA 3.38Å; G862-S865 WeakPolarHBondContact O-CB 3.47Å; G862-S865 PolarHBondContact O-N 2.99Å; S865-A868 PolarHBondContact O-N 2.8Å; S865-A869 VanDerWaalsContact O-CB 3.3Å; S865-A869 WeakPolarHBondContact O-CB 3.26Å; S865-A869 PolarHBondContact O-N 3.25Å
866	Q	92	Very high	89.6	Confident	30 Å²	30	33.1 Å²	33.1	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-42.1	178	-63.1	174.4	-68.7	0	0	111.6	L858 G862 A869 C870 L896	L858-Q866 PolarHBondContact O-NE2 3.37Å; G862-Q866 WeakPolarHBondContact O-CG 2.77Å; G862-Q866 PolarHBondContact O-N 3.19Å; Q866-A869 PolarHBondContact O-N 3.03Å; Q866-C870 WeakPolarHBondContact O-CB 3.33Å; Q866-C870 PolarHBondContact O-N 3.11Å; Q866-C870 PolarHBondContact O-SG 2.58Å; Q866-L896 HydrophobicContact CB-CD1 3.74Å; Q866-L896 HydrophobicContact CB-CD2 4.03Å
867	R	93.2	Very high	89.9	Confident	52 Å²	52	36.3 Å²	36.3	20%	0.196	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-49.3	173.2	-75.8	-171.4	-64.2	-170.1	-4.7	112.3	V863 Q864 A869 C870 S871 E895 L896 V899	V863-R867 WeakPolarHBondContact O-CB 3.33Å; V863-R867 VanDerWaalsContact O-CG 3.31Å; V863-R867 WeakPolarHBondContact O-CG 3.27Å; V863-R867 PolarHBondContact O-N 3.22Å; Q864-R867 PolarHBondContact O-N 2.7Å; R867-A869 VanDerWaalsContact C-N 3.29Å; R867-A869 PolarHBondContact O-N 2.6Å; R867-C870 WeakPolarHBondContact O-CB 3.43Å; R867-C870 PolarHBondContact O-N 3.29Å; R867-S871 PolarHBondContact O-N 2.77Å; R867-S871 PolarHBondContact O-OG 2.88Å; R867-E895 IonicContact CZ-OE2 3.91Å; R867-E895 VanDerWaalsContact NH1-CB 3.28Å; R867-E895 IonicContact NH1-OE2 2.74Å; R867-E895 PolarHBondContact NH1-OE2 3.02Å; R867-E895 IonicContact NH2-OE2 3.67Å; R867-L896 HydrophobicContact CG-CB 4.03Å; R867-L896 HydrophobicContact CG-CD1 3.7Å; R867-L896 HydrophobicContact CG-CG 4.48Å; R867-V899 HydrophobicContact CG-CB 4.43Å; R867-V899 HydrophobicContact CG-CG2 4.43Å
868	A	93.8	Very high	90.1	Very high	6 Å²	6	36.2 Å²	36.2	5%	0.05	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-42.3	177.6	0	0	0	0	0	112.2	A819 T823 Q864 S865 A872	A819-A868 HydrophobicContact CB-CB 4.1Å; A819-A868 WeakPolarHBondContact O-CB 3.4Å; T823-A868 HydrophobicContact CG2-CB 3.78Å; Q864-A868 WeakPolarHBondContact O-CB 3.32Å; Q864-A868 PolarHBondContact O-N 2.67Å; S865-A868 PolarHBondContact O-N 2.8Å; A868-A872 WeakPolarHBondContact O-CB 3.46Å; A868-A872 PolarHBondContact O-N 3.12Å
869	A	95.1	Very high	90.2	Very high	2 Å²	2	38.5 Å²	38.5	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-68.4	-42.3	175.9	0	0	0	0	0	112.7	A857 L858 S865 Q866 R867 A872 L873	A857-A869 HydrophobicContact CB-CB 3.84Å; L858-A869 HydrophobicContact CD2-CB 3.78Å; S865-A869 VanDerWaalsContact O-CB 3.3Å; S865-A869 WeakPolarHBondContact O-CB 3.26Å; S865-A869 PolarHBondContact O-N 3.25Å; Q866-A869 PolarHBondContact O-N 3.03Å; R867-A869 VanDerWaalsContact C-N 3.29Å; R867-A869 PolarHBondContact O-N 2.6Å; A869-A872 PolarHBondContact O-N 3.09Å; A869-L873 WeakPolarHBondContact O-CB 3.39Å; A869-L873 VanDerWaalsContact O-CG 3.27Å; A869-L873 WeakPolarHBondContact O-CG 3.4Å; A869-L873 PolarHBondContact O-N 3.22Å
870	C	95.3	Very high	90.6	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-56.5	-51.2	171.7	-81.7	0	0	0	0	111.7	L858 Q866 R867 A872 L873 S874 V899 T903	L858-C870 HydrophobicContact CD2-CB 4.47Å; L858-C870 VanDerWaalsContact CD2-SG 3.52Å; Q866-C870 WeakPolarHBondContact O-CB 3.33Å; Q866-C870 PolarHBondContact O-N 3.11Å; Q866-C870 PolarHBondContact O-SG 2.58Å; R867-C870 WeakPolarHBondContact O-CB 3.43Å; R867-C870 PolarHBondContact O-N 3.29Å; C870-A872 VanDerWaalsContact C-N 3.29Å; C870-A872 PolarHBondContact O-N 3.3Å; C870-L873 PolarHBondContact O-N 2.93Å; C870-S874 WeakPolarHBondContact O-CB 3.25Å; C870-S874 PolarHBondContact O-N 3.39Å; C870-V899 HydrophobicContact CB-CG1 3.72Å; C870-T903 WeakPolarHBondContact CB-OG1 3.28Å; C870-T903 WeakPolarHBondContact O-CG2 3.47Å; C870-T903 PolarHBondContact O-OG1 3.31Å
871	S	94.8	Very high	91.2	Very high	32 Å²	32	37.9 Å²	37.9	22%	0.224	22%	0.224	C	C	.	.	H	α-helix	trans	-58.1	-39.8	176.5	-59.8	0	0	0	0	112.3	R867 S874 C875	R867-S871 PolarHBondContact O-N 2.77Å; R867-S871 PolarHBondContact O-OG 2.88Å; S871-S874 WeakPolarHBondContact O-CB 3.42Å; S871-S874 PolarHBondContact O-N 3.33Å; S871-C875 PolarHBondContact O-N 2.74Å; S871-C875 PolarHBondContact O-SG 2.87Å; S871-C875 VanDerWaalsContact O-SG 3.37Å
872	A	96.5	Very high	92.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69.3	-38.6	178.1	0	0	0	0	0	113.1	A819 L822 L837 Y854 A868 A869 C870 S874 C875 L876	A819-A872 HydrophobicContact CB-CB 4.18Å; L822-A872 VanDerWaalsContact CD1-CA 3.44Å; L822-A872 HydrophobicContact CD1-CB 3.68Å; L822-A872 VanDerWaalsContact CD1-N 3.29Å; L837-A872 HydrophobicContact CD1-CB 4.14Å; Y854-A872 HydrophobicContact CD1-CB 4.09Å; Y854-A872 HydrophobicContact CD2-CB 3.55Å; Y854-A872 HydrophobicContact CE1-CB 4.02Å; Y854-A872 HydrophobicContact CE2-CB 3.45Å; Y854-A872 VanDerWaalsContact CE2-CB 3.45Å; Y854-A872 HydrophobicContact CG-CB 3.89Å; A868-A872 WeakPolarHBondContact O-CB 3.46Å; A868-A872 PolarHBondContact O-N 3.12Å; A869-A872 PolarHBondContact O-N 3.09Å; C870-A872 VanDerWaalsContact C-N 3.29Å; C870-A872 PolarHBondContact O-N 3.3Å; A872-S874 VanDerWaalsContact C-N 3.29Å; A872-S874 PolarHBondContact O-N 3.49Å; A872-C875 PolarHBondContact O-N 3.32Å; A872-L876 WeakPolarHBondContact O-CG 3.28Å; A872-L876 PolarHBondContact O-N 3.45Å; A872-L876 VanDerWaalsContact O-N 3.1Å
873	L	96.4	Very high	92.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-32.9	173	-70	172.1	0	0	0	111.9	V851 L858 A869 C870 L876 Q877 A878 S881 V885 T903 F907	V851-L873 HydrophobicContact CB-CD2 4.49Å; V851-L873 HydrophobicContact CG1-CD2 4.34Å; V851-L873 HydrophobicContact CG2-CD2 4.44Å; L858-L873 HydrophobicContact CD1-CD1 3.7Å; L858-L873 HydrophobicContact CD2-CD1 4.11Å; L858-L873 HydrophobicContact CG-CD1 3.98Å; A869-L873 WeakPolarHBondContact O-CB 3.39Å; A869-L873 VanDerWaalsContact O-CG 3.27Å; A869-L873 WeakPolarHBondContact O-CG 3.4Å; A869-L873 PolarHBondContact O-N 3.22Å; C870-L873 PolarHBondContact O-N 2.93Å; L873-L876 PolarHBondContact O-N 3.43Å; L873-Q877 PolarHBondContact O-N 3.48Å; L873-Q877 VanDerWaalsContact O-N 3.11Å; L873-A878 HydrophobicContact CB-CB 4Å; L873-A878 HydrophobicContact CD2-CB 3.55Å; L873-A878 HydrophobicContact CG-CB 4.37Å; L873-A878 WeakPolarHBondContact O-CB 3.36Å; L873-A878 PolarHBondContact O-N 3.12Å; L873-S881 WeakPolarHBondContact CD2-OG 3.36Å; L873-V885 HydrophobicContact CD1-CG2 4.33Å; L873-T903 HydrophobicContact CB-CG2 4.42Å; L873-F907 HydrophobicContact CB-CZ 4.33Å
874	S	95.3	Very high	92.8	Very high	24 Å²	24	38.4 Å²	38.4	17%	0.168	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-49.9	173.7	-175.1	0	0	0	0	111.6	C870 S871 A872 L876 Q877 T906	C870-S874 WeakPolarHBondContact O-CB 3.25Å; C870-S874 PolarHBondContact O-N 3.39Å; S871-S874 WeakPolarHBondContact O-CB 3.42Å; S871-S874 PolarHBondContact O-N 3.33Å; A872-S874 VanDerWaalsContact C-N 3.29Å; A872-S874 PolarHBondContact O-N 3.49Å; S874-L876 VanDerWaalsContact C-N 3.26Å; S874-L876 PolarHBondContact O-N 3.11Å; S874-Q877 PolarHBondContact O-N 3.2Å; S874-Q877 VanDerWaalsContact O-N 3.13Å; S874-T906 WeakPolarHBondContact CA-OG1 3.21Å; S874-T906 WeakPolarHBondContact CB-OG1 3.06Å; S874-T906 WeakPolarHBondContact OG-CB 3.37Å; S874-T906 WeakPolarHBondContact OG-CG2 3.47Å; S874-T906 PolarHBondContact OG-OG1 3.24Å
875	C	95.3	Very high	93	Very high	19 Å²	19	34 Å²	34	13%	0.128	18%	0.177	C	C	.	.	H	α-helix	trans	-56.1	-38.9	172.7	-66.2	0	0	0	0	112.8	L837 S838 S871 A872 Q877	L837-C875 HydrophobicContact CB-CB 3.9Å; S838-C875 WeakPolarHBondContact OG-CB 3.4Å; S871-C875 PolarHBondContact O-N 2.74Å; S871-C875 PolarHBondContact O-SG 2.87Å; S871-C875 VanDerWaalsContact O-SG 3.37Å; A872-C875 PolarHBondContact O-N 3.32Å; C875-Q877 VanDerWaalsContact C-N 3.31Å; C875-Q877 PolarHBondContact O-N 3.02Å
876	L	94.5	Very high	93.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-2.4	-179	-68.7	168	0	0	0	114.7	L837 F846 R847 A850 V851 Y854 A872 L873 S874 A878	L837-L876 WeakPolarHBondContact O-CD2 3.46Å; F846-L876 HydrophobicContact CE1-CD2 4.3Å; R847-L876 HydrophobicContact CG-CD2 4.34Å; R847-L876 PolarHBondContact NE-O 3.08Å; A850-L876 HydrophobicContact CB-CD1 3.58Å; V851-L876 HydrophobicContact CG2-CB 4.21Å; V851-L876 HydrophobicContact CG2-CD1 4.15Å; Y854-L876 HydrophobicContact CD2-CD1 3.82Å; Y854-L876 HydrophobicContact CE2-CD1 3.82Å; A872-L876 WeakPolarHBondContact O-CG 3.28Å; A872-L876 PolarHBondContact O-N 3.45Å; A872-L876 VanDerWaalsContact O-N 3.1Å; L873-L876 PolarHBondContact O-N 3.43Å; S874-L876 VanDerWaalsContact C-N 3.26Å; S874-L876 PolarHBondContact O-N 3.11Å; L876-A878 VanDerWaalsContact C-N 3.29Å; L876-A878 HydrophobicContact CB-CB 4.42Å; L876-A878 PolarHBondContact O-N 3.23Å
877	Q	93	Very high	92.9	Very high	125 Å²	125	35.7 Å²	35.7	58%	0.584	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.1	53.2	-174	-60	-179.8	16.6	0	0	111.5	R847 L873 S874 C875 V879	R847-Q877 PolarHBondContact NH2-O 2.93Å; L873-Q877 PolarHBondContact O-N 3.48Å; L873-Q877 VanDerWaalsContact O-N 3.11Å; S874-Q877 PolarHBondContact O-N 3.2Å; S874-Q877 VanDerWaalsContact O-N 3.13Å; C875-Q877 VanDerWaalsContact C-N 3.31Å; C875-Q877 PolarHBondContact O-N 3.02Å; Q877-V879 VanDerWaalsContact C-N 3.33Å; Q877-V879 PolarHBondContact O-N 2.99Å
878	A	93.4	Very high	92.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.19	C	C	.	.			trans	-84.4	63.5	-166.3	0	0	0	0	0	113.7	V851 L873 L876 E880 S881 F907	V851-A878 HydrophobicContact CB-CB 4.44Å; V851-A878 HydrophobicContact CG1-CB 4.02Å; V851-A878 HydrophobicContact CG2-CB 3.62Å; L873-A878 HydrophobicContact CB-CB 4Å; L873-A878 HydrophobicContact CD2-CB 3.55Å; L873-A878 HydrophobicContact CG-CB 4.37Å; L873-A878 WeakPolarHBondContact O-CB 3.36Å; L873-A878 PolarHBondContact O-N 3.12Å; L876-A878 VanDerWaalsContact C-N 3.29Å; L876-A878 HydrophobicContact CB-CB 4.42Å; L876-A878 PolarHBondContact O-N 3.23Å; A878-E880 PolarHBondContact O-N 3.14Å; A878-S881 VanDerWaalsContact CB-OG 3.3Å; A878-S881 WeakPolarHBondContact CB-OG 3.47Å; A878-S881 VanDerWaalsContact O-CB 3.25Å; A878-S881 WeakPolarHBondContact O-CB 3.45Å; A878-S881 PolarHBondContact O-N 3.04Å; A878-S881 PolarHBondContact O-OG 3.11Å; A878-F907 HydrophobicContact CB-CE1 4.27Å; A878-F907 HydrophobicContact CB-CZ 4.3Å; A878-F907 WeakPolarHBondContact O-CE2 3.49Å; A878-F907 VanDerWaalsContact O-CZ 3.24Å; A878-F907 WeakPolarHBondContact O-CZ 3.29Å
879	V	91.4	Very high	92.4	Very high	55 Å²	55	34.3 Å²	34.3	33%	0.333	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-51.4	-30	-179.5	-59.4	0	0	0	0	113.6	Q877 S881 L882 F907	Q877-V879 VanDerWaalsContact C-N 3.33Å; Q877-V879 PolarHBondContact O-N 2.99Å; V879-S881 PolarHBondContact O-N 2.88Å; V879-S881 VanDerWaalsContact O-N 3.1Å; V879-L882 VanDerWaalsContact O-CB 3.23Å; V879-L882 WeakPolarHBondContact O-CB 3.4Å; V879-L882 PolarHBondContact O-N 3.44Å; V879-L882 VanDerWaalsContact O-N 3.09Å; V879-F907 HydrophobicContact CG1-CB 4.08Å; V879-F907 HydrophobicContact CG1-CG 4.44Å
880	E	91.4	Very high	91.9	Very high	117 Å²	117	40.2 Å²	40.2	55%	0.547	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-59.4	-22.9	175.9	-56.3	95.8	138.3	0	0	113	R847 A878	R847-E880 IonicContact CZ-OE1 2.69Å; R847-E880 IonicContact CZ-OE2 2.69Å; R847-E880 IonicContact NH1-OE1 3.25Å; R847-E880 PolarHBondContact NH1-OE1 3.44Å; R847-E880 IonicContact NH1-OE2 3.32Å; R847-E880 IonicContact NH2-OE1 3.45Å; R847-E880 PolarHBondContact NH2-OE1 3.24Å; R847-E880 IonicContact NH2-OE2 3.62Å; R847-E880 PolarHBondContact NH2-OE2 2.8Å; A878-E880 PolarHBondContact O-N 3.14Å
881	S	92.5	Very high	91.5	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.007	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-87.4	-1.6	-178.3	-25.4	0	0	0	0	113.3	T855 L873 A878 V879 K883 A884 V885	T855-S881 PolarHBondContact OG1-OG 2.84Å; L873-S881 WeakPolarHBondContact CD2-OG 3.36Å; A878-S881 VanDerWaalsContact CB-OG 3.3Å; A878-S881 WeakPolarHBondContact CB-OG 3.47Å; A878-S881 VanDerWaalsContact O-CB 3.25Å; A878-S881 WeakPolarHBondContact O-CB 3.45Å; A878-S881 PolarHBondContact O-N 3.04Å; A878-S881 PolarHBondContact O-OG 3.11Å; V879-S881 PolarHBondContact O-N 2.88Å; V879-S881 VanDerWaalsContact O-N 3.1Å; S881-K883 VanDerWaalsContact C-N 3.31Å; S881-K883 PolarHBondContact O-N 3.36Å; S881-K883 VanDerWaalsContact O-N 3.15Å; S881-A884 PolarHBondContact O-N 2.88Å; S881-V885 PolarHBondContact O-N 3.18Å; S881-V885 VanDerWaalsContact O-N 3.1Å
882	L	91	Very high	91.1	Very high	38 Å²	38	45.2 Å²	45.2	20%	0.199	26%	0.263	C	S	.	.	H	α-helix	trans	-45.8	-49.9	-170.7	-174.5	72.4	0	0	0	113.2	V879 A884 V885 V886 L904 F907 A914	V879-L882 VanDerWaalsContact O-CB 3.23Å; V879-L882 WeakPolarHBondContact O-CB 3.4Å; V879-L882 PolarHBondContact O-N 3.44Å; V879-L882 VanDerWaalsContact O-N 3.09Å; L882-A884 VanDerWaalsContact C-N 3.3Å; L882-A884 PolarHBondContact O-N 2.91Å; L882-V885 PolarHBondContact O-N 3.06Å; L882-V886 WeakPolarHBondContact O-CB 3.32Å; L882-V886 VanDerWaalsContact O-CG2 3.27Å; L882-V886 WeakPolarHBondContact O-CG2 3.37Å; L882-V886 PolarHBondContact O-N 3.2Å; L882-L904 HydrophobicContact CD1-CD2 3.79Å; L882-F907 HydrophobicContact CD1-CD2 3.97Å; L882-A914 HydrophobicContact CD1-CB 3.81Å; L882-A914 HydrophobicContact CD2-CB 4.22Å; L882-A914 HydrophobicContact CG-CB 4.18Å
883	K	88.7	Confident	90.8	Very high	151 Å²	151	47.9 Å²	47.9	66%	0.657	28%	0.277	S	S	*	.	H	α-helix	trans	-58.6	-38.9	-179.6	-60.8	-175.5	-173.9	-175.4	0	112.6	D370 S881 A887	D370-K883 IonicContact OD2-NZ 3.92Å; D370-K883 PolarHBondContact OD2-NZ 3.07Å; S881-K883 VanDerWaalsContact C-N 3.31Å; S881-K883 PolarHBondContact O-N 3.36Å; S881-K883 VanDerWaalsContact O-N 3.15Å; K883-A887 PolarHBondContact O-N 3.36Å
884	A	88.9	Confident	90.5	Very high	19 Å²	19	54.6 Å²	54.6	16%	0.157	31%	0.309	C	S	.	.	H	α-helix	trans	-77.6	-36.5	-177.8	0	0	0	0	0	112.4	T855 L858 S881 L882 A887	T855-A884 HydrophobicContact CG2-CB 4.05Å; L858-A884 HydrophobicContact CD1-CB 3.81Å; S881-A884 PolarHBondContact O-N 2.88Å; L882-A884 VanDerWaalsContact C-N 3.3Å; L882-A884 PolarHBondContact O-N 2.91Å; A884-A887 PolarHBondContact O-N 3.04Å
885	V	91.9	Very high	90.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-71.2	-38.8	175.2	-175.9	0	0	0	0	111.2	L858 L873 S881 L882 A887 L888 C889 A900 T903 L904 F907	L858-V885 HydrophobicContact CD1-CG2 3.72Å; L873-V885 HydrophobicContact CD1-CG2 4.33Å; S881-V885 PolarHBondContact O-N 3.18Å; S881-V885 VanDerWaalsContact O-N 3.1Å; L882-V885 PolarHBondContact O-N 3.06Å; V885-A887 VanDerWaalsContact C-N 3.28Å; V885-A887 PolarHBondContact O-N 3.36Å; V885-L888 PolarHBondContact O-N 3.04Å; V885-C889 PolarHBondContact O-N 3.17Å; V885-C889 PolarHBondContact O-SG 2.89Å; V885-A900 HydrophobicContact CG1-CB 4.24Å; V885-A900 WeakPolarHBondContact CG1-O 3.34Å; V885-T903 HydrophobicContact CG1-CG2 3.92Å; V885-T903 HydrophobicContact CG2-CG2 4.13Å; V885-L904 HydrophobicContact CB-CD2 3.81Å; V885-L904 HydrophobicContact CB-CG 4.49Å; V885-L904 HydrophobicContact CG1-CD2 3.67Å; V885-L904 HydrophobicContact CG1-CG 3.83Å; V885-F907 HydrophobicContact CB-CE2 4.35Å; V885-F907 HydrophobicContact CG2-CE2 3.9Å; V885-F907 HydrophobicContact CG2-CZ 4.05Å
886	V	90.5	Very high	90	Very high	38 Å²	38	58.3 Å²	58.3	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-54.8	-42.9	173.3	162.8	0	0	0	0	111.4	L882 L888 C889 L904 A914 L918	L882-V886 WeakPolarHBondContact O-CB 3.32Å; L882-V886 VanDerWaalsContact O-CG2 3.27Å; L882-V886 WeakPolarHBondContact O-CG2 3.37Å; L882-V886 PolarHBondContact O-N 3.2Å; V886-L888 PolarHBondContact O-N 2.66Å; V886-C889 WeakPolarHBondContact O-CB 3.11Å; V886-C889 PolarHBondContact O-N 3.25Å; V886-L904 HydrophobicContact CG2-CD1 3.98Å; V886-L904 HydrophobicContact CG2-CD2 3.93Å; V886-A914 HydrophobicContact CG2-CB 3.89Å; V886-L918 HydrophobicContact CG1-CD1 4.21Å; V886-L918 HydrophobicContact CG1-CD2 4.39Å; V886-L918 HydrophobicContact CG1-CG 4.41Å
887	A	88.2	Confident	89.9	Confident	70 Å²	70	62.2 Å²	62.2	58%	0.579	34%	0.336	S	S	*	.	H	α-helix	trans	-63.2	-21.2	179	0	0	0	0	0	114.2	K883 A884 V885	K883-A887 PolarHBondContact O-N 3.36Å; A884-A887 PolarHBondContact O-N 3.04Å; V885-A887 VanDerWaalsContact C-N 3.28Å; V885-A887 PolarHBondContact O-N 3.36Å
888	L	89.4	Confident	89.8	Confident	20 Å²	20	62.1 Å²	62.1	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-88	-11.3	175.3	-63.2	178.4	0	0	0	113.4	L858 V885 V886 D890 S891 L896 A900	L858-L888 HydrophobicContact CB-CD1 4Å; L858-L888 HydrophobicContact CD1-CD1 4.32Å; L858-L888 HydrophobicContact CD2-CD1 3.82Å; L858-L888 HydrophobicContact CG-CD1 4.26Å; V885-L888 PolarHBondContact O-N 3.04Å; V886-L888 PolarHBondContact O-N 2.66Å; L888-D890 VanDerWaalsContact C-N 3.25Å; L888-D890 PolarHBondContact O-N 3.05Å; L888-S891 WeakPolarHBondContact O-CB 3.27Å; L888-S891 PolarHBondContact O-N 2.72Å; L888-S891 VanDerWaalsContact O-N 3.1Å; L888-L896 HydrophobicContact CD1-CD1 4.4Å; L888-L896 HydrophobicContact CD2-CD2 4.47Å; L888-A900 HydrophobicContact CB-CB 3.84Å
889	C	87.5	Confident	89.9	Confident	9 Å²	9	63.5 Å²	63.5	6%	0.061	34%	0.344	C	S	.	.	H	α-helix	trans	-71.7	-20.3	176.2	-63.7	0	0	0	0	112.9	V885 V886 S891 R897 I901 L904 L918	V885-C889 PolarHBondContact O-N 3.17Å; V885-C889 PolarHBondContact O-SG 2.89Å; V886-C889 WeakPolarHBondContact O-CB 3.11Å; V886-C889 PolarHBondContact O-N 3.25Å; C889-S891 VanDerWaalsContact C-N 3.29Å; C889-R897 WeakPolarHBondContact O-CD 3.44Å; C889-R897 VanDerWaalsContact O-CG 3.25Å; C889-R897 WeakPolarHBondContact O-CG 3.48Å; C889-I901 HydrophobicContact CB-CG1 4.27Å; C889-L904 WeakPolarHBondContact SG-CD1 3.45Å; C889-L918 HydrophobicContact CB-CD1 3.75Å
890	D	84.6	Confident	89.9	Confident	127 Å²	127	60.9 Å²	60.9	68%	0.679	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	10.8	170.2	-74.2	-34.2	0	0	0	113	L888	L888-D890 VanDerWaalsContact C-N 3.25Å; L888-D890 PolarHBondContact O-N 3.05Å
891	S	86.8	Confident	89.9	Confident	29 Å²	29	56.7 Å²	56.7	20%	0.203	31%	0.309	C	S	.	.			trans	-62.2	138.8	179.7	-178.4	0	0	0	0	112.8	L888 C889 D893 R897	L888-S891 WeakPolarHBondContact O-CB 3.27Å; L888-S891 PolarHBondContact O-N 2.72Å; L888-S891 VanDerWaalsContact O-N 3.1Å; C889-S891 VanDerWaalsContact C-N 3.29Å; S891-D893 PolarHBondContact O-N 3.48Å; S891-D893 PolarHBondContact OG-N 2.76Å; S891-D893 VanDerWaalsContact OG-N 3.14Å; S891-R897 PolarHBondContact O-NE 3.29Å
892	A	86.2	Confident	90	Very high	108 Å²	108	62 Å²	62	89%	0.893	33%	0.334	S	S	*	.	S	Bend	trans	-71.8	-15.6	172.2	0	0	0	0	0	113.3
893	D	89.5	Confident	90.1	Very high	55 Å²	55	60.2 Å²	60.2	29%	0.294	33%	0.325	S	S	.	.			trans	-85.9	119.6	172.3	-175.3	-79.6	0	0	0	110	V863 S891 E895 L896 R897	V863-D893 HydrophobicContact CG1-CB 4.4Å; S891-D893 PolarHBondContact O-N 3.48Å; S891-D893 PolarHBondContact OG-N 2.76Å; S891-D893 VanDerWaalsContact OG-N 3.14Å; D893-E895 PolarHBondContact O-N 3.44Å; D893-E895 PolarHBondContact OD1-N 2.93Å; D893-E895 VanDerWaalsContact OD1-N 3.1Å; D893-L896 HydrophobicContact CB-CB 4.17Å; D893-L896 WeakPolarHBondContact OD1-CB 3.31Å; D893-L896 PolarHBondContact OD1-N 2.87Å; D893-R897 WeakPolarHBondContact O-CB 3.33Å; D893-R897 PolarHBondContact O-N 3.47Å
894	E	89.9	Confident	90.3	Very high	141 Å²	141	53 Å²	53	66%	0.659	29%	0.294	S	S	*	.	H	α-helix	trans	-69.9	-31.3	-173.1	-54	-151.1	106.7	0	0	113.2	R897 H898	E894-R897 IonicContact OE1-NH2 2.75Å; E894-R897 PolarHBondContact OE1-NH2 3.03Å; E894-H898 WeakPolarHBondContact O-CB 3.35Å; E894-H898 PolarHBondContact O-N 3.07Å
895	E	89.2	Confident	90.4	Very high	120 Å²	120	56.2 Å²	56.2	56%	0.561	31%	0.307	S	S	*	.	H	α-helix	trans	-77.2	-43.5	-177.6	-59.6	-174.7	160.6	0	0	110.4	R867 D893 H898 V899	R867-E895 IonicContact CZ-OE2 3.91Å; R867-E895 VanDerWaalsContact NH1-CB 3.28Å; R867-E895 IonicContact NH1-OE2 2.74Å; R867-E895 PolarHBondContact NH1-OE2 3.02Å; R867-E895 IonicContact NH2-OE2 3.67Å; D893-E895 PolarHBondContact O-N 3.44Å; D893-E895 PolarHBondContact OD1-N 2.93Å; D893-E895 VanDerWaalsContact OD1-N 3.1Å; E895-H898 PolarHBondContact O-N 3.12Å; E895-V899 WeakPolarHBondContact O-CG2 3.48Å; E895-V899 PolarHBondContact O-N 3.25Å
896	L	90.9	Very high	90.4	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-42.1	172	174.8	60.8	0	0	0	112	V863 Q866 R867 L888 D893 H898 V899 A900	V863-L896 HydrophobicContact CG1-CB 3.93Å; V863-L896 HydrophobicContact CG1-CD2 4.34Å; Q866-L896 HydrophobicContact CB-CD1 3.74Å; Q866-L896 HydrophobicContact CB-CD2 4.03Å; R867-L896 HydrophobicContact CG-CB 4.03Å; R867-L896 HydrophobicContact CG-CD1 3.7Å; R867-L896 HydrophobicContact CG-CG 4.48Å; L888-L896 HydrophobicContact CD1-CD1 4.4Å; L888-L896 HydrophobicContact CD2-CD2 4.47Å; D893-L896 HydrophobicContact CB-CB 4.17Å; D893-L896 WeakPolarHBondContact OD1-CB 3.31Å; D893-L896 PolarHBondContact OD1-N 2.87Å; L896-H898 VanDerWaalsContact C-N 3.3Å; L896-H898 PolarHBondContact O-N 3.46Å; L896-V899 PolarHBondContact O-N 2.76Å; L896-A900 WeakPolarHBondContact O-CB 3.44Å; L896-A900 PolarHBondContact O-N 3.26Å
897	R	92.1	Very high	90.5	Very high	81 Å²	81	57.3 Å²	57.3	31%	0.306	31%	0.314	S	S	.	.	H	α-helix	trans	-60.3	-40.7	174.5	176.6	165.5	53.9	74.8	1.6	111.7	C889 S891 D893 E894 I901	C889-R897 WeakPolarHBondContact O-CD 3.44Å; C889-R897 VanDerWaalsContact O-CG 3.25Å; C889-R897 WeakPolarHBondContact O-CG 3.48Å; S891-R897 PolarHBondContact O-NE 3.29Å; D893-R897 WeakPolarHBondContact O-CB 3.33Å; D893-R897 PolarHBondContact O-N 3.47Å; E894-R897 IonicContact OE1-NH2 2.75Å; E894-R897 PolarHBondContact OE1-NH2 3.03Å; R897-I901 HydrophobicContact CG-CD1 3.94Å; R897-I901 WeakPolarHBondContact O-CD1 3.47Å; R897-I901 VanDerWaalsContact O-CG1 3.25Å; R897-I901 WeakPolarHBondContact O-CG1 3.37Å; R897-I901 PolarHBondContact O-N 3.21Å; R897-I901 VanDerWaalsContact O-N 3.08Å
898	H	92.6	Very high	90.6	Very high	124 Å²	124	55.3 Å²	55.3	57%	0.574	30%	0.3	S	S	*	.	H	α-helix	trans	-63.9	-47.5	176.4	-174	6.2	0	0	0	112.1	E894 E895 L896 A900 I901 E902	E894-H898 WeakPolarHBondContact O-CB 3.35Å; E894-H898 PolarHBondContact O-N 3.07Å; E895-H898 PolarHBondContact O-N 3.12Å; L896-H898 VanDerWaalsContact C-N 3.3Å; L896-H898 PolarHBondContact O-N 3.46Å; H898-A900 PolarHBondContact O-N 3.24Å; H898-I901 PolarHBondContact O-N 3.18Å; H898-E902 PolarHBondContact O-N 3.03Å
899	V	93.9	Very high	90.6	Very high	28 Å²	28	60.7 Å²	60.7	17%	0.17	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-36.7	179	173.2	0	0	0	0	111.7	R867 C870 E895 L896 E902 T903	R867-V899 HydrophobicContact CG-CB 4.43Å; R867-V899 HydrophobicContact CG-CG2 4.43Å; C870-V899 HydrophobicContact CB-CG1 3.72Å; E895-V899 WeakPolarHBondContact O-CG2 3.48Å; E895-V899 PolarHBondContact O-N 3.25Å; L896-V899 PolarHBondContact O-N 2.76Å; V899-E902 PolarHBondContact O-N 2.83Å; V899-T903 WeakPolarHBondContact O-CB 3.47Å; V899-T903 PolarHBondContact O-N 3.08Å; V899-T903 PolarHBondContact O-OG1 2.97Å
900	A	92.8	Very high	90.6	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-64.1	-43.2	174.3	0	0	0	0	0	112	V885 L888 L896 H898 T903 L904	V885-A900 HydrophobicContact CG1-CB 4.24Å; V885-A900 WeakPolarHBondContact CG1-O 3.34Å; L888-A900 HydrophobicContact CB-CB 3.84Å; L896-A900 WeakPolarHBondContact O-CB 3.44Å; L896-A900 PolarHBondContact O-N 3.26Å; H898-A900 PolarHBondContact O-N 3.24Å; A900-T903 WeakPolarHBondContact O-CB 3.17Å; A900-T903 PolarHBondContact O-N 2.95Å; A900-L904 PolarHBondContact O-N 2.87Å
901	I	91.5	Very high	90.9	Very high	29 Å²	29	59.7 Å²	59.7	15%	0.149	32%	0.315	C	S	.	.	H	α-helix	trans	-64.8	-43.5	175.9	-68	165.3	0	0	0	111.1	C889 R897 H898 T903 L904 L905 Y915	C889-I901 HydrophobicContact CB-CG1 4.27Å; R897-I901 HydrophobicContact CG-CD1 3.94Å; R897-I901 WeakPolarHBondContact O-CD1 3.47Å; R897-I901 VanDerWaalsContact O-CG1 3.25Å; R897-I901 WeakPolarHBondContact O-CG1 3.37Å; R897-I901 PolarHBondContact O-N 3.21Å; R897-I901 VanDerWaalsContact O-N 3.08Å; H898-I901 PolarHBondContact O-N 3.18Å; I901-T903 VanDerWaalsContact C-N 3.32Å; I901-T903 PolarHBondContact O-N 3.3Å; I901-L904 PolarHBondContact O-N 2.92Å; I901-L905 HydrophobicContact CG2-CD1 4.38Å; I901-L905 WeakPolarHBondContact O-CG 3.42Å; I901-L905 PolarHBondContact O-N 3.32Å; I901-Y915 HydrophobicContact CB-CE2 4.29Å; I901-Y915 HydrophobicContact CD1-CE2 3.9Å; I901-Y915 HydrophobicContact CG1-CD2 4.18Å; I901-Y915 HydrophobicContact CG1-CE2 3.77Å; I901-Y915 HydrophobicContact CG2-CD2 3.91Å; I901-Y915 HydrophobicContact CG2-CE2 3.54Å
902	E	93.1	Very high	90.9	Very high	112 Å²	112	63.9 Å²	63.9	52%	0.523	33%	0.327	S	S	.	.	H	α-helix	trans	-60.4	-43.3	174.9	-175.7	168.8	-149.6	0	0	111.4	H898 V899 L904 L905 T906	H898-E902 PolarHBondContact O-N 3.03Å; V899-E902 PolarHBondContact O-N 2.83Å; E902-L904 PolarHBondContact O-N 3.48Å; E902-L905 PolarHBondContact O-N 3.46Å; E902-L905 VanDerWaalsContact O-N 3.1Å; E902-T906 PolarHBondContact O-N 3.05Å; E902-T906 VanDerWaalsContact O-N 3.12Å
903	T	94.4	Very high	91	Very high	2 Å²	2	62.6 Å²	62.6	1%	0.012	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-46.2	174.6	-57.6	0	0	0	0	111.5	C870 L873 V885 V899 A900 I901 L905 T906 F907	C870-T903 WeakPolarHBondContact CB-OG1 3.28Å; C870-T903 WeakPolarHBondContact O-CG2 3.47Å; C870-T903 PolarHBondContact O-OG1 3.31Å; L873-T903 HydrophobicContact CB-CG2 4.42Å; V885-T903 HydrophobicContact CG1-CG2 3.92Å; V885-T903 HydrophobicContact CG2-CG2 4.13Å; V899-T903 WeakPolarHBondContact O-CB 3.47Å; V899-T903 PolarHBondContact O-N 3.08Å; V899-T903 PolarHBondContact O-OG1 2.97Å; A900-T903 WeakPolarHBondContact O-CB 3.17Å; A900-T903 PolarHBondContact O-N 2.95Å; I901-T903 VanDerWaalsContact C-N 3.32Å; I901-T903 PolarHBondContact O-N 3.3Å; T903-L905 VanDerWaalsContact C-N 3.32Å; T903-L905 PolarHBondContact O-N 3.01Å; T903-T906 PolarHBondContact O-N 3.14Å; T903-T906 VanDerWaalsContact O-N 3.15Å; T903-T906 PolarHBondContact O-OG1 2.93Å; T903-F907 HydrophobicContact CG2-CE1 3.89Å; T903-F907 HydrophobicContact CG2-CE2 4.41Å; T903-F907 HydrophobicContact CG2-CZ 3.69Å; T903-F907 WeakPolarHBondContact O-CD1 3.47Å; T903-F907 PolarHBondContact O-N 3.21Å
904	L	92.5	Very high	90.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.1	-43.1	173.8	-70.1	-175.3	0	0	0	112	L882 V885 V886 C889 A900 I901 E902 T906 F907 G911 L918	L882-L904 HydrophobicContact CD1-CD2 3.79Å; V885-L904 HydrophobicContact CB-CD2 3.81Å; V885-L904 HydrophobicContact CB-CG 4.49Å; V885-L904 HydrophobicContact CG1-CD2 3.67Å; V885-L904 HydrophobicContact CG1-CG 3.83Å; V886-L904 HydrophobicContact CG2-CD1 3.98Å; V886-L904 HydrophobicContact CG2-CD2 3.93Å; C889-L904 WeakPolarHBondContact SG-CD1 3.45Å; A900-L904 PolarHBondContact O-N 2.87Å; I901-L904 PolarHBondContact O-N 2.92Å; E902-L904 PolarHBondContact O-N 3.48Å; L904-T906 PolarHBondContact O-N 3.37Å; L904-F907 HydrophobicContact CD2-CD2 4.32Å; L904-F907 WeakPolarHBondContact O-CB 3.28Å; L904-F907 PolarHBondContact O-N 3.13Å; L904-G911 VanDerWaalsContact O-CA 3.23Å; L904-G911 WeakPolarHBondContact O-CA 3.49Å; L904-L918 HydrophobicContact CD1-CD1 4.29Å
905	L	90.6	Very high	90.7	Very high	85 Å²	85	58.3 Å²	58.3	45%	0.445	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-25.6	-179.7	-65.4	174.1	0	0	0	112.8	I901 E902 T903 F907 R912	I901-L905 HydrophobicContact CG2-CD1 4.38Å; I901-L905 WeakPolarHBondContact O-CG 3.42Å; I901-L905 PolarHBondContact O-N 3.32Å; E902-L905 PolarHBondContact O-N 3.46Å; E902-L905 VanDerWaalsContact O-N 3.1Å; T903-L905 VanDerWaalsContact C-N 3.32Å; T903-L905 PolarHBondContact O-N 3.01Å; L905-F907 VanDerWaalsContact C-N 3.33Å; L905-R912 HydrophobicContact CD2-CG 3.9Å
906	T	93.1	Very high	90.4	Very high	55 Å²	55	58.2 Å²	58.2	34%	0.337	28%	0.281	S	S	.	.	H	α-helix	trans	-76.2	-13.4	171.1	63.6	0	0	0	0	114.7	S874 E902 T903 L904 G908	S874-T906 WeakPolarHBondContact CA-OG1 3.21Å; S874-T906 WeakPolarHBondContact CB-OG1 3.06Å; S874-T906 WeakPolarHBondContact OG-CB 3.37Å; S874-T906 WeakPolarHBondContact OG-CG2 3.47Å; S874-T906 PolarHBondContact OG-OG1 3.24Å; E902-T906 PolarHBondContact O-N 3.05Å; E902-T906 VanDerWaalsContact O-N 3.12Å; T903-T906 PolarHBondContact O-N 3.14Å; T903-T906 VanDerWaalsContact O-N 3.15Å; T903-T906 PolarHBondContact O-OG1 2.93Å; L904-T906 PolarHBondContact O-N 3.37Å; T906-G908 PolarHBondContact O-N 3.24Å; T906-G908 VanDerWaalsContact O-N 3.16Å
907	F	92.9	Very high	89.9	Confident	6 Å²	6	64 Å²	64	3%	0.026	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	23.7	172.8	-62.5	-6.6	0	0	0	112.8	L873 A878 V879 L882 V885 T903 L904 L905 G911	L873-F907 HydrophobicContact CB-CZ 4.33Å; A878-F907 HydrophobicContact CB-CE1 4.27Å; A878-F907 HydrophobicContact CB-CZ 4.3Å; A878-F907 WeakPolarHBondContact O-CE2 3.49Å; A878-F907 VanDerWaalsContact O-CZ 3.24Å; A878-F907 WeakPolarHBondContact O-CZ 3.29Å; V879-F907 HydrophobicContact CG1-CB 4.08Å; V879-F907 HydrophobicContact CG1-CG 4.44Å; L882-F907 HydrophobicContact CD1-CD2 3.97Å; V885-F907 HydrophobicContact CB-CE2 4.35Å; V885-F907 HydrophobicContact CG2-CE2 3.9Å; V885-F907 HydrophobicContact CG2-CZ 4.05Å; T903-F907 HydrophobicContact CG2-CE1 3.89Å; T903-F907 HydrophobicContact CG2-CE2 4.41Å; T903-F907 HydrophobicContact CG2-CZ 3.69Å; T903-F907 WeakPolarHBondContact O-CD1 3.47Å; T903-F907 PolarHBondContact O-N 3.21Å; L904-F907 HydrophobicContact CD2-CD2 4.32Å; L904-F907 WeakPolarHBondContact O-CB 3.28Å; L904-F907 PolarHBondContact O-N 3.13Å; L905-F907 VanDerWaalsContact C-N 3.33Å; F907-G911 PolarHBondContact O-N 2.98Å
908	G	90	Very high	89.1	Confident	29 Å²	29	61.8 Å²	61.8	30%	0.299	30%	0.302	S	S	.	.	H	α-helix	trans	66.7	-133.1	171.4	0	0	0	0	0	114.1	T906 R912	T906-G908 PolarHBondContact O-N 3.24Å; T906-G908 VanDerWaalsContact O-N 3.16Å; G908-R912 WeakPolarHBondContact O-CG 3.35Å; G908-R912 PolarHBondContact O-N 2.86Å; G908-R912 PolarHBondContact O-NH1 3.47Å
909	E	89	Confident	87.5	Confident	132 Å²	132	61.4 Å²	61.4	62%	0.617	30%	0.304	S	S	*	.	H	α-helix	trans	-76.2	-41.9	-176.6	-168.6	170.3	161.4	0	0	112.7	G911 R912 L913	E909-G911 VanDerWaalsContact C-N 3.31Å; E909-G911 PolarHBondContact O-N 3.22Å; E909-R912 PolarHBondContact O-N 3.17Å; E909-L913 HydrophobicContact CG-CD1 4.08Å; E909-L913 HydrophobicContact CG-CG 4.42Å; E909-L913 WeakPolarHBondContact O-CG 3.47Å; E909-L913 PolarHBondContact O-N 3.14Å
910	E	87.9	Confident	85.8	Confident	116 Å²	116	64.4 Å²	64.4	54%	0.542	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-41.9	177.7	-60.2	-173.2	169	0	0	111.5	L913 A914	E910-L913 PolarHBondContact O-N 2.67Å; E910-A914 WeakPolarHBondContact O-CB 3.41Å; E910-A914 PolarHBondContact O-N 3.24Å
911	G	89.7	Confident	83.9	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-43	174.2	0	0	0	0	0	114.1	L904 F907 E909 A914 Y915	L904-G911 VanDerWaalsContact O-CA 3.23Å; L904-G911 WeakPolarHBondContact O-CA 3.49Å; F907-G911 PolarHBondContact O-N 2.98Å; E909-G911 VanDerWaalsContact C-N 3.31Å; E909-G911 PolarHBondContact O-N 3.22Å; G911-A914 PolarHBondContact O-N 2.8Å; G911-Y915 PolarHBondContact O-N 3.45Å
912	R	88.1	Confident	81.9	Confident	117 Å²	117	71.6 Å²	71.6	44%	0.442	37%	0.367	S	S	.	.	H	α-helix	trans	-63.5	-46	173.4	-73.9	-174.1	-60.8	-96	5.3	111.8	L905 G908 E909 A914 Y915 E916	L905-R912 HydrophobicContact CD2-CG 3.9Å; G908-R912 WeakPolarHBondContact O-CG 3.35Å; G908-R912 PolarHBondContact O-N 2.86Å; G908-R912 PolarHBondContact O-NH1 3.47Å; E909-R912 PolarHBondContact O-N 3.17Å; R912-A914 VanDerWaalsContact C-N 3.3Å; R912-A914 PolarHBondContact O-N 3Å; R912-Y915 PolarHBondContact O-N 3Å; R912-Y915 VanDerWaalsContact O-N 3.17Å; R912-E916 WeakPolarHBondContact O-CG 3.36Å; R912-E916 PolarHBondContact O-N 3.22Å
913	L	88.3	Confident	79.4	Confident	81 Å²	81	67.6 Å²	67.6	42%	0.424	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-34.4	179	-71.2	171	0	0	0	112.4	E909 E910 Q917	E909-L913 HydrophobicContact CG-CD1 4.08Å; E909-L913 HydrophobicContact CG-CG 4.42Å; E909-L913 WeakPolarHBondContact O-CG 3.47Å; E909-L913 PolarHBondContact O-N 3.14Å; E910-L913 PolarHBondContact O-N 2.67Å; L913-Q917 VanDerWaalsContact O-CG 3.31Å; L913-Q917 WeakPolarHBondContact O-CG 3.45Å; L913-Q917 PolarHBondContact O-N 3.3Å; L913-Q917 PolarHBondContact O-NE2 3.49Å
914	A	85.9	Confident	76.8	Confident	13 Å²	13	71.6 Å²	71.6	11%	0.107	38%	0.378	C	S	.	.	H	α-helix	trans	-69.5	-40.9	173.1	0	0	0	0	0	112.3	L882 V886 E910 G911 R912 Q917 L918	L882-A914 HydrophobicContact CD1-CB 3.81Å; L882-A914 HydrophobicContact CD2-CB 4.22Å; L882-A914 HydrophobicContact CG-CB 4.18Å; V886-A914 HydrophobicContact CG2-CB 3.89Å; E910-A914 WeakPolarHBondContact O-CB 3.41Å; E910-A914 PolarHBondContact O-N 3.24Å; G911-A914 PolarHBondContact O-N 2.8Å; R912-A914 VanDerWaalsContact C-N 3.3Å; R912-A914 PolarHBondContact O-N 3Å; A914-Q917 PolarHBondContact O-N 2.94Å; A914-L918 PolarHBondContact O-N 3.01Å
915	Y	85.8	Confident	74.4	Confident	92 Å²	92	78.7 Å²	78.7	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-66.1	-40.2	175.8	-178.8	-101.4	0	0	0	112.9	I901 G911 R912 Q917 L918 D919	I901-Y915 HydrophobicContact CB-CE2 4.29Å; I901-Y915 HydrophobicContact CD1-CE2 3.9Å; I901-Y915 HydrophobicContact CG1-CD2 4.18Å; I901-Y915 HydrophobicContact CG1-CE2 3.77Å; I901-Y915 HydrophobicContact CG2-CD2 3.91Å; I901-Y915 HydrophobicContact CG2-CE2 3.54Å; G911-Y915 PolarHBondContact O-N 3.45Å; R912-Y915 PolarHBondContact O-N 3Å; R912-Y915 VanDerWaalsContact O-N 3.17Å; Y915-Q917 VanDerWaalsContact C-N 3.29Å; Y915-Q917 PolarHBondContact O-N 3.18Å; Y915-L918 WeakPolarHBondContact O-CB 3.47Å; Y915-L918 PolarHBondContact O-N 3.45Å; Y915-D919 PolarHBondContact O-N 2.88Å
916	E	84.2	Confident	72.4	Confident	119 Å²	119	79.9 Å²	79.9	56%	0.556	42%	0.418	S	S	*	.	H	α-helix	trans	-62.5	-36.6	173.1	-73	178.3	-169.2	0	0	111.9	R912 D919 T920	R912-E916 WeakPolarHBondContact O-CG 3.36Å; R912-E916 PolarHBondContact O-N 3.22Å; E916-D919 PolarHBondContact O-N 3.08Å; E916-T920 WeakPolarHBondContact O-CG2 3.41Å; E916-T920 PolarHBondContact O-N 3.14Å
917	Q	80	Confident	69.9	Low	124 Å²	124	84.9 Å²	84.9	58%	0.579	43%	0.431	S	S	*	.	H	α-helix	trans	-64.3	-40	176.4	-78.5	167.9	77	0	0	112.7	L913 A914 Y915 D919 T920 V921	L913-Q917 VanDerWaalsContact O-CG 3.31Å; L913-Q917 WeakPolarHBondContact O-CG 3.45Å; L913-Q917 PolarHBondContact O-N 3.3Å; L913-Q917 PolarHBondContact O-NE2 3.49Å; A914-Q917 PolarHBondContact O-N 2.94Å; Y915-Q917 VanDerWaalsContact C-N 3.29Å; Y915-Q917 PolarHBondContact O-N 3.18Å; Q917-D919 PolarHBondContact O-N 3.37Å; Q917-T920 PolarHBondContact O-N 2.89Å; Q917-T920 PolarHBondContact O-OG1 3.11Å; Q917-V921 WeakPolarHBondContact O-CG2 3.47Å; Q917-V921 PolarHBondContact O-N 3.36Å
918	L	74.3	Confident	67.4	Low	33 Å²	33	90.6 Å²	90.6	17%	0.173	46%	0.461	C	S	.	.	H	α-helix	trans	-53.7	-49.5	173.6	-81.7	153.8	0	0	0	111.9	V886 C889 L904 A914 Y915 T920 V921 V922	V886-L918 HydrophobicContact CG1-CD1 4.21Å; V886-L918 HydrophobicContact CG1-CD2 4.39Å; V886-L918 HydrophobicContact CG1-CG 4.41Å; C889-L918 HydrophobicContact CB-CD1 3.75Å; L904-L918 HydrophobicContact CD1-CD1 4.29Å; A914-L918 PolarHBondContact O-N 3.01Å; Y915-L918 WeakPolarHBondContact O-CB 3.47Å; Y915-L918 PolarHBondContact O-N 3.45Å; L918-T920 PolarHBondContact O-N 3.03Å; L918-V921 PolarHBondContact O-N 2.9Å; L918-V922 PolarHBondContact O-N 3.43Å
919	D	59.8	Low	65.1	Low	117 Å²	117	91.9 Å²	91.9	63%	0.626	47%	0.474	S	S	*	.	H	α-helix	trans	-65.5	-36.1	-179.6	-168	44.2	0	0	0	112.2	Y915 E916 Q917 V921 V922 G923	Y915-D919 PolarHBondContact O-N 2.88Å; E916-D919 PolarHBondContact O-N 3.08Å; Q917-D919 PolarHBondContact O-N 3.37Å; D919-V921 PolarHBondContact O-N 3.15Å; D919-V922 PolarHBondContact O-N 2.98Å; D919-G923 PolarHBondContact O-N 2.86Å
920	T	58.7	Low	62.8	Low	90 Å²	90	90 Å²	90	55%	0.552	47%	0.472	S	S	*	.	H	α-helix	trans	-64.3	-36.6	176.4	64	0	0	0	0	113.6	E916 Q917 L918 G923 D924	E916-T920 WeakPolarHBondContact O-CG2 3.41Å; E916-T920 PolarHBondContact O-N 3.14Å; Q917-T920 PolarHBondContact O-N 2.89Å; Q917-T920 PolarHBondContact O-OG1 3.11Å; L918-T920 PolarHBondContact O-N 3.03Å; T920-G923 PolarHBondContact O-N 3.02Å; T920-D924 PolarHBondContact O-N 3Å
921	V	52.6	Low	60.6	Low	106 Å²	106	94.8 Å²	94.8	64%	0.642	49%	0.485	S	S	*	.	H	α-helix	trans	-66.3	-42.5	179.1	172.8	0	0	0	0	110.9	Q917 L918 D919 M925	Q917-V921 WeakPolarHBondContact O-CG2 3.47Å; Q917-V921 PolarHBondContact O-N 3.36Å; L918-V921 PolarHBondContact O-N 2.9Å; D919-V921 PolarHBondContact O-N 3.15Å; V921-M925 PolarHBondContact O-N 3.08Å
922	V	48.8	Very low	58.4	Low	74 Å²	74	106 Å²	106	45%	0.448	53%	0.527	S	S	.	.	H	α-helix	trans	-64.4	-45.3	174	179.7	0	0	0	0	110.7	L918 D919 D924 M925 I926	L918-V922 PolarHBondContact O-N 3.43Å; D919-V922 PolarHBondContact O-N 2.98Å; V922-D924 PolarHBondContact O-N 2.84Å; V922-M925 PolarHBondContact O-N 3.05Å; V922-I926 HydrophobicContact CG1-CD1 4.2Å; V922-I926 WeakPolarHBondContact O-CG1 3.39Å; V922-I926 PolarHBondContact O-N 2.9Å
923	G	41.2	Very low	56	Low	29 Å²	29	103.3 Å²	103.3	30%	0.299	54%	0.535	S	S	.	.	H	α-helix	trans	-60.3	-43.2	-179.5	0	0	0	0	0	114.2	D919 T920 I926 R927	D919-G923 PolarHBondContact O-N 2.86Å; T920-G923 PolarHBondContact O-N 3.02Å; G923-I926 PolarHBondContact O-N 2.76Å; G923-R927 WeakPolarHBondContact O-CG 3.21Å; G923-R927 PolarHBondContact O-N 3.16Å; G923-R927 VanDerWaalsContact O-N 3.12Å
924	D	40.4	Very low	53.6	Low	86 Å²	86	107 Å²	107	46%	0.46	56%	0.556	S	S	.	*	H	α-helix	trans	-76.5	-28.4	-179.1	-99.2	6.8	0	0	0	113.2	T920 V922 I926 R927 L928	T920-D924 PolarHBondContact O-N 3Å; V922-D924 PolarHBondContact O-N 2.84Å; D924-I926 VanDerWaalsContact C-N 3.31Å; D924-I926 PolarHBondContact O-N 2.71Å; D924-R927 PolarHBondContact O-N 3.05Å; D924-R927 VanDerWaalsContact O-N 3.15Å; D924-R927 WeakPolarHBondContact OD1-CD 3.33Å; D924-R927 IonicContact OD1-NH1 3.21Å; D924-R927 PolarHBondContact OD1-NH1 2.93Å; D924-L928 VanDerWaalsContact O-CD1 3.25Å; D924-L928 WeakPolarHBondContact O-CD1 3.28Å; D924-L928 PolarHBondContact O-N 3.45Å
925	M	42.1	Very low	51.4	Low	149 Å²	149	110.3 Å²	110.3	73%	0.734	58%	0.583	S	S	*	*	H	α-helix	trans	-63.2	-38.2	171.5	-163.5	167.4	69.1	0	0	111.7	V921 V922 L928 G929	V921-M925 PolarHBondContact O-N 3.08Å; V922-M925 PolarHBondContact O-N 3.05Å; M925-L928 PolarHBondContact O-N 3.23Å; M925-G929 PolarHBondContact O-N 2.94Å
926	I	46.8	Very low	49.3	Very low	109 Å²	109	112.5 Å²	112.5	56%	0.559	61%	0.606	S	S	*	*	H	α-helix	trans	-68.3	-35.1	173.5	-64	169.2	0	0	0	111.6	V922 G923 D924 G929 T930	V922-I926 HydrophobicContact CG1-CD1 4.2Å; V922-I926 WeakPolarHBondContact O-CG1 3.39Å; V922-I926 PolarHBondContact O-N 2.9Å; G923-I926 PolarHBondContact O-N 2.76Å; D924-I926 VanDerWaalsContact C-N 3.31Å; D924-I926 PolarHBondContact O-N 2.71Å; I926-G929 PolarHBondContact O-N 3.38Å; I926-T930 PolarHBondContact O-N 3.14Å; I926-T930 VanDerWaalsContact O-N 3.12Å; I926-T930 PolarHBondContact O-OG1 3.14Å
927	R	41	Very low	47.2	Very low	161 Å²	161	113.4 Å²	113.4	61%	0.608	62%	0.619	S	S	*	*	H	α-helix	trans	-70.9	-34.1	175.8	-74.7	169.1	162.2	-176.3	1.4	113.7	G923 D924 T930 R931	G923-R927 WeakPolarHBondContact O-CG 3.21Å; G923-R927 PolarHBondContact O-N 3.16Å; G923-R927 VanDerWaalsContact O-N 3.12Å; D924-R927 PolarHBondContact O-N 3.05Å; D924-R927 VanDerWaalsContact O-N 3.15Å; D924-R927 WeakPolarHBondContact OD1-CD 3.33Å; D924-R927 IonicContact OD1-NH1 3.21Å; D924-R927 PolarHBondContact OD1-NH1 2.93Å; R927-T930 WeakPolarHBondContact CA-OG1 3.23Å; R927-T930 PolarHBondContact O-OG1 2.94Å; R927-R931 WeakPolarHBondContact O-CB 3.42Å; R927-R931 PolarHBondContact O-N 3.42Å
928	L	41.2	Very low	45	Very low	126 Å²	126	114.3 Å²	114.3	66%	0.66	63%	0.633	S	S	*	*	H	α-helix	trans	-66.3	-41.5	171.6	-93.9	81	0	0	0	111.7	D924 M925 R931	D924-L928 VanDerWaalsContact O-CD1 3.25Å; D924-L928 WeakPolarHBondContact O-CD1 3.28Å; D924-L928 PolarHBondContact O-N 3.45Å; M925-L928 PolarHBondContact O-N 3.23Å; L928-R931 PolarHBondContact O-N 3.46Å
929	G	40.7	Very low	43.2	Very low	55 Å²	55	116.9 Å²	116.9	57%	0.567	66%	0.66	S	S	*	*	H	α-helix	trans	-58.2	-49	175.5	0	0	0	0	0	112.5	M925 I926 R931 R932	M925-G929 PolarHBondContact O-N 2.94Å; I926-G929 PolarHBondContact O-N 3.38Å; G929-R931 PolarHBondContact O-N 3.2Å; G929-R932 PolarHBondContact O-N 2.91Å
930	T	41.8	Very low	41.9	Very low	92 Å²	92	124.6 Å²	124.6	56%	0.564	69%	0.688	S	S	*	*	H	α-helix	trans	-69.6	-29.9	179.7	45.8	0	0	0	0	113.8	I926 R927 R932 G933	I926-T930 PolarHBondContact O-N 3.14Å; I926-T930 VanDerWaalsContact O-N 3.12Å; I926-T930 PolarHBondContact O-OG1 3.14Å; R927-T930 WeakPolarHBondContact CA-OG1 3.23Å; R927-T930 PolarHBondContact O-OG1 2.94Å; T930-R932 VanDerWaalsContact C-N 3.29Å; T930-R932 PolarHBondContact O-N 3.49Å; T930-G933 PolarHBondContact O-N 3.26Å
931	R	42.3	Very low	41.1	Very low	218 Å²	218	126.4 Å²	126.4	82%	0.823	70%	0.695	S	S	*	*	H	α-helix	trans	-66.5	-21.7	175.5	-90.4	-171.6	169.1	-168.8	-0.7	114.9	R927 L928 G929	R927-R931 WeakPolarHBondContact O-CB 3.42Å; R927-R931 PolarHBondContact O-N 3.42Å; L928-R931 PolarHBondContact O-N 3.46Å; G929-R931 PolarHBondContact O-N 3.2Å
932	R	41.7	Very low	40.5	Very low	236 Å²	236	127.4 Å²	127.4	89%	0.891	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-13.9	175.5	-90.8	-170.2	172.6	-161.4	-0.2	114.7	G929 T930	G929-R932 PolarHBondContact O-N 2.91Å; T930-R932 VanDerWaalsContact C-N 3.29Å; T930-R932 PolarHBondContact O-N 3.49Å
933	G	37.5	Very low	40	Very low	59 Å²	59	130.4 Å²	130.4	61%	0.608	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-29.8	-174.1	0	0	0	0	0	116.1	T930	T930-G933 PolarHBondContact O-N 3.26Å
934	N	38.5	Very low	39.9	Very low	160 Å²	160	136.4 Å²	136.4	86%	0.856	74%	0.736	S	S	*	*	S	Bend	trans	-110.8	26.8	-160	-70.7	-10.6	0	0	0	115.2
935	A	40.8	Very low	39.9	Very low	81 Å²	81	139.5 Å²	139.5	67%	0.669	75%	0.753	S	S	*	*			trans	-127.6	19.8	-163.6	0	0	0	0	0	117.2
936	V	41.3	Very low	39.8	Very low	139 Å²	139	138.9 Å²	138.9	84%	0.842	75%	0.754	S	S	*	*			trans	-140.9	73	173.7	-165.7	0	0	0	0	113.2
937	T	40.3	Very low	39.3	Very low	137 Å²	137	141 Å²	141	84%	0.84	77%	0.768	S	S	*	*			trans	-157.6	87.8	156	39.4	0	0	0	0	112.2
938	T	34.1	Very low	39.1	Very low	143 Å²	143	139.5 Å²	139.5	88%	0.877	78%	0.781	S	S	*	*			trans	-173.8	134.4	142	36	0	0	0	0	110.2
939	A	35.2	Very low	39	Very low	88 Å²	88	140.6 Å²	140.6	73%	0.727	79%	0.791	S	S	*	*			trans	8.4	145.6	158.2	0	0	0	0	0	120.9
940	F	33.3	Very low	38.8	Very low	279 Å²	279	148.4 Å²	148.4	100%	1.224	81%	0.811	S	S	*	*			cis	-139.9	0	26.5	-116.8	-75.2	0	0	0	112.9

Retrieved 940 of 940 residues in 765.8 ms (Link to these results)

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