X2JGC3_DROME Loading...

Multiplexin, isoform S

AlphaFold DB , UniProt , Accession X2JGC3, Species DROME (Drosophila melanogaster, Fruit fly), Gene Mp, Length 804 aa.

						>X2JGC3_DROME|X2JGC3|Mp
MAMVISTRAKLVITALILFFLLGIVLVTGSTKGWFNPNRYNGERVAARIQATDIFDASGMQPPGQTQYTHERPYRGIKGEKGERGPKGDSIRGPPGPPGPPGPKGETAPYPPFVETTSAGAKYTGECTCNASDILEAIKDNESLRESLRGAPGTPGKDGKPGTPGHTGATGVPGARGARGSEGAQGLKGEPGVDGLPGVMGPPGPPGPPGLPENYDESLMVNSMGAFRGTTQPGAKGVPGEKGDAGQKGERGDPGHKGAHGPSGAKGEPGEPGTPGLPGLPGQVGQPGGLDGLASANGTKGEKGEKGEKGMRGRRGGTGATGPIGPPGKPGPMGDIGHSGRPGMTGPKGEMGPKGPKGDSGGREGLKGDKGDRGQDGRDGLPGPPGLPSTGGGDGDSGGVQYIPMPGPPGPPGPPGLPGLSISGPKGEPGVDSRSSFFGDASYYGRPGARSSLDELKALRELQDLRDRPDGTAEPPRQPGHSHKHEETLGLVDGEEPYFSASSSNMNMKIVPGAVTFQNIDEMTKKSALNPPGTLAYITEEEALLVRVNKGWQYIALGTLVPIATPAPPTTVAPSMRFDLQSKNLLNSPPPLLNTPTLRVAALNEPSTGDLQGIRGADFACYRQGRRAGLLGTFKAFLSSRVQNLDTIVRPADRDLPVVNTRGDVLFNSWKGIFNGQGGFFSQAPRIYSFSGKNVMTDSTWPMKMVWHGSLPNGERSMDTYCDAWHSGDHLKGSFASNLDGHKLLEQKRQSCDSKLIILCVEALSQDRKRKKREIGDGSSHGESESREFKTADEYAAHLENLLL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	65.5	Low	248 Å²	248	128 Å²	128	100%	1.222	69%	0.689	S	S	*	*				0	130.6	0	-58.3	177.6	-173.8	0	0	107.9
2	A	43.3	Very low	67.1	Low	97 Å²	97	124.6 Å²	124.6	80%	0.802	68%	0.675	S	S	*	*			trans	-93.9	105.2	177.5	0	0	0	0	0	109.8	V4	A2-V4 PolarHBondContact O-N 2.91Å
3	M	50.6	Low	68.6	Low	174 Å²	174	121.3 Å²	121.3	86%	0.857	66%	0.655	S	S	*	*			trans	-77.5	112.4	-178.6	-162.8	176.2	-167.8	0	0	110	I5	M3-I5 VanDerWaalsContact C-N 3.33Å; M3-I5 PolarHBondContact O-N 3.02Å
4	V	60	Low	69.8	Low	144 Å²	144	117.9 Å²	117.9	87%	0.873	64%	0.641	S	S	*	*			trans	-76.7	83.7	-177.3	-175.5	0	0	0	0	110	A2 S6	A2-V4 PolarHBondContact O-N 2.91Å; V4-S6 PolarHBondContact O-N 2.96Å
5	I	67.4	Low	71	Confident	81 Å²	81	113.1 Å²	113.1	42%	0.415	62%	0.623	S	S	.	*			trans	-63.3	116.7	175.8	-58.9	177	0	0	0	109.1	M3 A9 K10	M3-I5 VanDerWaalsContact C-N 3.33Å; M3-I5 PolarHBondContact O-N 3.02Å; I5-A9 HydrophobicContact CG2-CB 3.71Å; I5-K10 HydrophobicContact CB-CG 4.45Å; I5-K10 HydrophobicContact CG2-CG 3.9Å; I5-K10 VanDerWaalsContact O-CE 3.29Å; I5-K10 WeakPolarHBondContact O-CE 3.49Å
6	S	74	Confident	72	Confident	68 Å²	68	112.9 Å²	112.9	48%	0.476	62%	0.62	S	S	.	*			trans	-52.3	145.3	178.8	175.6	0	0	0	0	112.5	V4 R8 A9 K10	V4-S6 PolarHBondContact O-N 2.96Å; S6-R8 PolarHBondContact O-N 3.32Å; S6-A9 WeakPolarHBondContact O-CA 3.39Å; S6-A9 WeakPolarHBondContact O-CB 3.46Å; S6-A9 PolarHBondContact O-N 3.37Å; S6-K10 PolarHBondContact O-N 2.8Å
7	T	71.6	Confident	73.1	Confident	107 Å²	107	111.7 Å²	111.7	66%	0.656	61%	0.612	S	S	*	*	H	α-helix	trans	-56.1	-34	178.2	49.9	0	0	0	0	112.7	K10 L11	T7-K10 PolarHBondContact O-N 3.16Å; T7-L11 PolarHBondContact O-N 3.37Å; T7-L11 VanDerWaalsContact O-N 3.09Å
8	R	72.9	Confident	74	Confident	204 Å²	204	112.1 Å²	112.1	77%	0.77	61%	0.612	S	S	*	*	H	α-helix	trans	-65.6	-42.2	173.2	-67.1	-172.7	177.9	-167.8	-0.4	112.3	S6 L11 V12	S6-R8 PolarHBondContact O-N 3.32Å; R8-L11 PolarHBondContact O-N 3.45Å; R8-V12 WeakPolarHBondContact O-CG2 3.16Å; R8-V12 PolarHBondContact O-N 2.9Å
9	A	75.4	Confident	74.9	Confident	40 Å²	40	114.4 Å²	114.4	33%	0.331	62%	0.616	S	S	.	*	H	α-helix	trans	-66.9	-37.9	176.3	0	0	0	0	0	111.6	I5 S6 L11 V12 I13	I5-A9 HydrophobicContact CG2-CB 3.71Å; S6-A9 WeakPolarHBondContact O-CA 3.39Å; S6-A9 WeakPolarHBondContact O-CB 3.46Å; S6-A9 PolarHBondContact O-N 3.37Å; A9-L11 PolarHBondContact O-N 3.13Å; A9-V12 PolarHBondContact O-N 3.11Å; A9-I13 WeakPolarHBondContact O-CB 3.41Å; A9-I13 WeakPolarHBondContact O-CD1 3.48Å; A9-I13 VanDerWaalsContact O-CG1 3.26Å; A9-I13 WeakPolarHBondContact O-CG1 3.32Å; A9-I13 PolarHBondContact O-N 3.11Å
10	K	81.5	Confident	75.6	Confident	124 Å²	124	116.6 Å²	116.6	54%	0.539	62%	0.62	S	S	.	*	H	α-helix	trans	-59	-44.5	172.5	-67	-175.4	178.2	179.6	0	112.1	I5 S6 T7 I13 T14	I5-K10 HydrophobicContact CB-CG 4.45Å; I5-K10 HydrophobicContact CG2-CG 3.9Å; I5-K10 VanDerWaalsContact O-CE 3.29Å; I5-K10 WeakPolarHBondContact O-CE 3.49Å; S6-K10 PolarHBondContact O-N 2.8Å; T7-K10 PolarHBondContact O-N 3.16Å; K10-I13 PolarHBondContact O-N 3.5Å; K10-T14 PolarHBondContact O-N 3.3Å; K10-T14 PolarHBondContact O-OG1 3.03Å
11	L	81.7	Confident	76.2	Confident	121 Å²	121	115.6 Å²	115.6	63%	0.634	61%	0.614	S	S	*	*	H	α-helix	trans	-64.3	-38.9	176.3	-79.9	165.7	0	0	0	113.4	T7 R8 A9 T14 A15	T7-L11 PolarHBondContact O-N 3.37Å; T7-L11 VanDerWaalsContact O-N 3.09Å; R8-L11 PolarHBondContact O-N 3.45Å; A9-L11 PolarHBondContact O-N 3.13Å; L11-T14 PolarHBondContact O-OG1 3.01Å; L11-A15 VanDerWaalsContact O-CB 3.31Å; L11-A15 WeakPolarHBondContact O-CB 3.42Å; L11-A15 PolarHBondContact O-N 3.47Å
12	V	84.9	Confident	78.4	Confident	87 Å²	87	108.8 Å²	108.8	53%	0.527	58%	0.582	S	S	.	*	H	α-helix	trans	-65.8	-42.4	174.8	172.2	0	0	0	0	110.8	R8 A9 A15 L16	R8-V12 WeakPolarHBondContact O-CG2 3.16Å; R8-V12 PolarHBondContact O-N 2.9Å; A9-V12 PolarHBondContact O-N 3.11Å; V12-A15 PolarHBondContact O-N 3.23Å; V12-L16 HydrophobicContact CG1-CD1 3.96Å; V12-L16 HydrophobicContact CG1-CG 4.49Å; V12-L16 WeakPolarHBondContact O-CB 3.45Å; V12-L16 VanDerWaalsContact O-CG 3.31Å; V12-L16 WeakPolarHBondContact O-CG 3.26Å; V12-L16 PolarHBondContact O-N 2.79Å
13	I	87.1	Confident	80.4	Confident	82 Å²	82	105.7 Å²	105.7	42%	0.421	56%	0.56	S	S	.	*	H	α-helix	trans	-65	-44.6	178.2	-68.6	163.4	0	0	0	111.2	A9 K10 L16 I17	A9-I13 WeakPolarHBondContact O-CB 3.41Å; A9-I13 WeakPolarHBondContact O-CD1 3.48Å; A9-I13 VanDerWaalsContact O-CG1 3.26Å; A9-I13 WeakPolarHBondContact O-CG1 3.32Å; A9-I13 PolarHBondContact O-N 3.11Å; K10-I13 PolarHBondContact O-N 3.5Å; I13-L16 PolarHBondContact O-N 2.91Å; I13-I17 HydrophobicContact CG2-CD1 3.82Å; I13-I17 VanDerWaalsContact O-CG1 3.29Å; I13-I17 WeakPolarHBondContact O-CG1 3.49Å; I13-I17 PolarHBondContact O-N 3.09Å
14	T	85.3	Confident	82.1	Confident	74 Å²	74	101.6 Å²	101.6	45%	0.454	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-36.1	177.4	54	0	0	0	0	112.6	K10 L11 I17 L18	K10-T14 PolarHBondContact O-N 3.3Å; K10-T14 PolarHBondContact O-OG1 3.03Å; L11-T14 PolarHBondContact O-OG1 3.01Å; T14-I17 PolarHBondContact O-N 2.74Å; T14-L18 WeakPolarHBondContact O-CB 3.45Å; T14-L18 WeakPolarHBondContact O-CG 3.48Å; T14-L18 PolarHBondContact O-N 2.77Å
15	A	87.1	Confident	83.2	Confident	45 Å²	45	98.3 Å²	98.3	37%	0.372	52%	0.521	S	S	.	.	H	α-helix	trans	-63.1	-45	173.2	0	0	0	0	0	112	L11 V12 I17 L18 F19	L11-A15 VanDerWaalsContact O-CB 3.31Å; L11-A15 WeakPolarHBondContact O-CB 3.42Å; L11-A15 PolarHBondContact O-N 3.47Å; V12-A15 PolarHBondContact O-N 3.23Å; A15-I17 PolarHBondContact O-N 3.3Å; A15-L18 PolarHBondContact O-N 3.32Å; A15-F19 WeakPolarHBondContact O-CD2 3.29Å; A15-F19 PolarHBondContact O-N 3.32Å
16	L	87.2	Confident	83.7	Confident	110 Å²	110	98.6 Å²	98.6	58%	0.576	52%	0.522	S	S	*	.	H	α-helix	trans	-62.5	-41.6	176.6	-73.2	169.3	0	0	0	112.2	V12 I13 F19 F20	V12-L16 HydrophobicContact CG1-CD1 3.96Å; V12-L16 HydrophobicContact CG1-CG 4.49Å; V12-L16 WeakPolarHBondContact O-CB 3.45Å; V12-L16 VanDerWaalsContact O-CG 3.31Å; V12-L16 WeakPolarHBondContact O-CG 3.26Å; V12-L16 PolarHBondContact O-N 2.79Å; I13-L16 PolarHBondContact O-N 2.91Å; L16-F19 PolarHBondContact O-N 2.91Å; L16-F20 PolarHBondContact O-N 3.47Å
17	I	90.9	Very high	84	Confident	93 Å²	93	99.9 Å²	99.9	48%	0.477	53%	0.527	S	S	.	.	H	α-helix	trans	-61.9	-43.9	175	-69	165.1	0	0	0	110.9	I13 T14 A15 F20 L21	I13-I17 HydrophobicContact CG2-CD1 3.82Å; I13-I17 VanDerWaalsContact O-CG1 3.29Å; I13-I17 WeakPolarHBondContact O-CG1 3.49Å; I13-I17 PolarHBondContact O-N 3.09Å; T14-I17 PolarHBondContact O-N 2.74Å; A15-I17 PolarHBondContact O-N 3.3Å; I17-F20 PolarHBondContact O-N 2.95Å; I17-L21 HydrophobicContact CG2-CD1 3.98Å; I17-L21 HydrophobicContact CG2-CG 4.46Å; I17-L21 WeakPolarHBondContact O-CG 3.31Å; I17-L21 PolarHBondContact O-N 3.43Å
18	L	89.9	Confident	84.2	Confident	118 Å²	118	97.8 Å²	97.8	62%	0.618	52%	0.515	S	S	*	.	H	α-helix	trans	-62.3	-42.7	176.5	-79.9	166	0	0	0	112.4	T14 A15 F20 L21 L22	T14-L18 WeakPolarHBondContact O-CB 3.45Å; T14-L18 WeakPolarHBondContact O-CG 3.48Å; T14-L18 PolarHBondContact O-N 2.77Å; A15-L18 PolarHBondContact O-N 3.32Å; L18-F20 VanDerWaalsContact C-N 3.35Å; L18-F20 PolarHBondContact O-N 2.95Å; L18-L21 PolarHBondContact O-N 3.19Å; L18-L22 WeakPolarHBondContact O-CB 3.49Å; L18-L22 PolarHBondContact O-N 3.28Å
19	F	90.3	Very high	84.3	Confident	157 Å²	157	88.1 Å²	88.1	69%	0.689	48%	0.478	S	S	*	.	H	α-helix	trans	-62.3	-40.3	174.1	-92.7	-75.3	0	0	0	112.4	A15 L16 L22 G23	A15-F19 WeakPolarHBondContact O-CD2 3.29Å; A15-F19 PolarHBondContact O-N 3.32Å; L16-F19 PolarHBondContact O-N 2.91Å; F19-L22 PolarHBondContact O-N 3.18Å; F19-G23 PolarHBondContact O-N 3.31Å
20	F	88.6	Confident	84	Confident	158 Å²	158	89.8 Å²	89.8	69%	0.693	49%	0.488	S	S	*	.	H	α-helix	trans	-65.5	-43.5	177.9	-134.1	-88.6	0	0	0	111.9	L16 I17 L18 G23 I24	L16-F20 PolarHBondContact O-N 3.47Å; I17-F20 PolarHBondContact O-N 2.95Å; L18-F20 VanDerWaalsContact C-N 3.35Å; L18-F20 PolarHBondContact O-N 2.95Å; F20-G23 PolarHBondContact O-N 2.95Å; F20-I24 HydrophobicContact CD1-CD1 4.15Å; F20-I24 WeakPolarHBondContact O-CG1 3.44Å; F20-I24 PolarHBondContact O-N 3.02Å
21	L	88	Confident	83.4	Confident	96 Å²	96	89.4 Å²	89.4	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-63.9	-41.4	174.9	-69.9	171.4	0	0	0	112	I17 L18 G23 I24 V25	I17-L21 HydrophobicContact CG2-CD1 3.98Å; I17-L21 HydrophobicContact CG2-CG 4.46Å; I17-L21 WeakPolarHBondContact O-CG 3.31Å; I17-L21 PolarHBondContact O-N 3.43Å; L18-L21 PolarHBondContact O-N 3.19Å; L21-G23 VanDerWaalsContact C-N 3.33Å; L21-G23 PolarHBondContact O-N 3.46Å; L21-I24 PolarHBondContact O-N 3.16Å; L21-V25 WeakPolarHBondContact O-CG2 3.31Å; L21-V25 PolarHBondContact O-N 3.49Å
22	L	87.8	Confident	82.7	Confident	104 Å²	104	91.4 Å²	91.4	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-42	175.4	-160.2	87.6	0	0	0	111.4	L18 F19 V25 L26	L18-L22 WeakPolarHBondContact O-CB 3.49Å; L18-L22 PolarHBondContact O-N 3.28Å; F19-L22 PolarHBondContact O-N 3.18Å; L22-V25 PolarHBondContact O-N 3.46Å; L22-L26 HydrophobicContact CD2-CD1 4.41Å; L22-L26 HydrophobicContact CG-CD1 4.45Å; L22-L26 WeakPolarHBondContact O-CG 3.29Å; L22-L26 PolarHBondContact O-N 3.36Å
23	G	85.4	Confident	81.5	Confident	32 Å²	32	89 Å²	89	33%	0.33	49%	0.492	S	S	.	.	H	α-helix	trans	-59.2	-45.2	174	0	0	0	0	0	112.7	F19 F20 L21 V25 L26 V27	F19-G23 PolarHBondContact O-N 3.31Å; F20-G23 PolarHBondContact O-N 2.95Å; L21-G23 VanDerWaalsContact C-N 3.33Å; L21-G23 PolarHBondContact O-N 3.46Å; G23-V25 PolarHBondContact O-N 3Å; G23-L26 PolarHBondContact O-N 2.97Å; G23-V27 WeakPolarHBondContact O-CG2 3.44Å; G23-V27 PolarHBondContact O-N 2.94Å
24	I	86.5	Confident	80.4	Confident	88 Å²	88	94.6 Å²	94.6	45%	0.451	51%	0.508	S	S	.	.	H	α-helix	trans	-61.7	-42.2	175.5	-67.5	164.1	0	0	0	111.1	F20 L21 T28	F20-I24 HydrophobicContact CD1-CD1 4.15Å; F20-I24 WeakPolarHBondContact O-CG1 3.44Å; F20-I24 PolarHBondContact O-N 3.02Å; L21-I24 PolarHBondContact O-N 3.16Å; I24-T28 HydrophobicContact CG2-CG2 4.34Å; I24-T28 WeakPolarHBondContact O-CB 3.43Å; I24-T28 WeakPolarHBondContact O-CG2 3.37Å; I24-T28 PolarHBondContact O-N 3.06Å; I24-T28 PolarHBondContact O-OG1 3.02Å
25	V	82.7	Confident	79.1	Confident	76 Å²	76	97 Å²	97	46%	0.461	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-40.4	176.8	171.1	0	0	0	0	111.7	L21 L22 G23 T28 G29	L21-V25 WeakPolarHBondContact O-CG2 3.31Å; L21-V25 PolarHBondContact O-N 3.49Å; L22-V25 PolarHBondContact O-N 3.46Å; G23-V25 PolarHBondContact O-N 3Å; V25-T28 PolarHBondContact O-OG1 3.17Å; V25-G29 WeakPolarHBondContact O-CA 3.41Å; V25-G29 PolarHBondContact O-N 3.34Å
26	L	78.5	Confident	77.4	Confident	86 Å²	86	99 Å²	99	45%	0.45	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-43	177.7	-71.7	170.2	0	0	0	112.5	L22 G23 S30 F35	L22-L26 HydrophobicContact CD2-CD1 4.41Å; L22-L26 HydrophobicContact CG-CD1 4.45Å; L22-L26 WeakPolarHBondContact O-CG 3.29Å; L22-L26 PolarHBondContact O-N 3.36Å; G23-L26 PolarHBondContact O-N 2.97Å; L26-S30 VanDerWaalsContact O-CB 3.3Å; L26-S30 WeakPolarHBondContact O-CB 3.36Å; L26-S30 PolarHBondContact O-N 3.22Å; L26-S30 PolarHBondContact O-OG 3.4Å; L26-F35 HydrophobicContact CD2-CE2 4.17Å; L26-F35 HydrophobicContact CD2-CZ 4.16Å
27	V	80.2	Confident	75.8	Confident	96 Å²	96	98.7 Å²	98.7	58%	0.582	52%	0.522	S	S	*	.	H	α-helix	trans	-64.8	-48	176.7	172.3	0	0	0	0	110.7	G23 S30 T31	G23-V27 WeakPolarHBondContact O-CG2 3.44Å; G23-V27 PolarHBondContact O-N 2.94Å; V27-S30 PolarHBondContact O-N 3.35Å; V27-T31 PolarHBondContact O-N 3.42Å; V27-T31 PolarHBondContact O-OG1 3.18Å
28	T	76.5	Confident	73.8	Confident	63 Å²	63	101.5 Å²	101.5	39%	0.387	54%	0.538	S	S	.	.	H	α-helix	trans	-71.4	-32.4	-180	56.2	0	0	0	0	113.6	I24 V25 T31 K32	I24-T28 HydrophobicContact CG2-CG2 4.34Å; I24-T28 WeakPolarHBondContact O-CB 3.43Å; I24-T28 WeakPolarHBondContact O-CG2 3.37Å; I24-T28 PolarHBondContact O-N 3.06Å; I24-T28 PolarHBondContact O-OG1 3.02Å; V25-T28 PolarHBondContact O-OG1 3.17Å; T28-T31 WeakPolarHBondContact CA-OG1 3.44Å; T28-T31 PolarHBondContact O-OG1 3.31Å; T28-K32 VanDerWaalsContact O-CB 3.32Å; T28-K32 WeakPolarHBondContact O-CB 3.5Å; T28-K32 WeakPolarHBondContact O-CG 3.37Å; T28-K32 PolarHBondContact O-N 3.16Å
29	G	74	Confident	71.8	Confident	1 Å²	1	106.2 Å²	106.2	1%	0.01	55%	0.547	C	S	.	.	H	α-helix	trans	-69	-37.2	173.2	0	0	0	0	0	112.5	V25 K32 G33 W34	V25-G29 WeakPolarHBondContact O-CA 3.41Å; V25-G29 PolarHBondContact O-N 3.34Å; G29-K32 CarbonylContact O-C 3.54Å; G29-K32 PolarHBondContact O-N 3.46Å; G29-G33 PolarHBondContact O-N 3.47Å; G29-G33 VanDerWaalsContact O-N 3.08Å; G29-W34 PolarHBondContact O-N 3.09Å
30	S	68.9	Low	69.7	Low	75 Å²	75	109.1 Å²	109.1	52%	0.524	56%	0.555	S	S	.	*	H	α-helix	trans	-66.7	-47.3	175.1	-59.2	0	0	0	0	111.5	L26 V27 K32 G33	L26-S30 VanDerWaalsContact O-CB 3.3Å; L26-S30 WeakPolarHBondContact O-CB 3.36Å; L26-S30 PolarHBondContact O-N 3.22Å; L26-S30 PolarHBondContact O-OG 3.4Å; V27-S30 PolarHBondContact O-N 3.35Å; S30-K32 VanDerWaalsContact C-N 3.28Å; S30-K32 PolarHBondContact O-N 2.97Å; S30-G33 PolarHBondContact O-N 3.45Å; S30-G33 VanDerWaalsContact O-N 3.1Å
31	T	70.4	Confident	67.7	Low	115 Å²	115	109.5 Å²	109.5	71%	0.706	57%	0.565	S	S	*	*	H	α-helix	trans	-68.8	-23	177.4	55.5	0	0	0	0	113.6	V27 T28	V27-T31 PolarHBondContact O-N 3.42Å; V27-T31 PolarHBondContact O-OG1 3.18Å; T28-T31 WeakPolarHBondContact CA-OG1 3.44Å; T28-T31 PolarHBondContact O-OG1 3.31Å
32	K	67.1	Low	65.9	Low	164 Å²	164	108.4 Å²	108.4	71%	0.713	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	5.7	171.9	-68.6	-179.9	177.3	-179.9	0	114	T28 G29 S30 W34	T28-K32 VanDerWaalsContact O-CB 3.32Å; T28-K32 WeakPolarHBondContact O-CB 3.5Å; T28-K32 WeakPolarHBondContact O-CG 3.37Å; T28-K32 PolarHBondContact O-N 3.16Å; G29-K32 CarbonylContact O-C 3.54Å; G29-K32 PolarHBondContact O-N 3.46Å; S30-K32 VanDerWaalsContact C-N 3.28Å; S30-K32 PolarHBondContact O-N 2.97Å; K32-W34 VanDerWaalsContact C-N 3.33Å; K32-W34 PolarHBondContact O-N 3.42Å
33	G	58.2	Low	63.4	Low	37 Å²	37	112 Å²	112	38%	0.381	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	70.6	18.8	173.1	0	0	0	0	0	115.8	G29 S30 F35	G29-G33 PolarHBondContact O-N 3.47Å; G29-G33 VanDerWaalsContact O-N 3.08Å; S30-G33 PolarHBondContact O-N 3.45Å; S30-G33 VanDerWaalsContact O-N 3.1Å; G33-F35 PolarHBondContact O-N 3.19Å
34	W	64.2	Low	61.3	Low	198 Å²	198	122.6 Å²	122.6	75%	0.75	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-25.4	176.8	-81.1	-0.1	0	0	0	113.2	G29 K32	G29-W34 PolarHBondContact O-N 3.09Å; K32-W34 VanDerWaalsContact C-N 3.33Å; K32-W34 PolarHBondContact O-N 3.42Å
35	F	58.7	Low	58.8	Low	124 Å²	124	124.2 Å²	124.2	54%	0.544	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.7	35.9	-177.8	-58.6	-69.8	0	0	0	113.4	L26 G33 P37	L26-F35 HydrophobicContact CD2-CE2 4.17Å; L26-F35 HydrophobicContact CD2-CZ 4.16Å; G33-F35 PolarHBondContact O-N 3.19Å; F35-P37 WeakPolarHBondContact O-CD 3.31Å
36	N	51.4	Low	56.6	Low	87 Å²	87	124.9 Å²	124.9	47%	0.465	65%	0.648	S	S	.	*			trans	-90.6	107.3	175.5	-173.4	-16	0	0	0	111.2	N38 R39	N36-N38 PolarHBondContact O-N 2.77Å; N36-N38 PolarHBondContact OD1-N 3.44Å; N36-R39 PolarHBondContact O-N 2.72Å
37	P	53.3	Low	54.3	Low	105 Å²	105	125.8 Å²	125.8	68%	0.682	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-68.3	-20.6	-173.9	28.2	-35.8	0	0	0	113.8	F35 R39	F35-P37 WeakPolarHBondContact O-CD 3.31Å; P37-R39 PolarHBondContact O-N 3.04Å
38	N	48.8	Very low	51.9	Low	152 Å²	152	132 Å²	132	81%	0.813	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-79.7	5	-178	-72.5	-17	0	0	0	114	N36	N36-N38 PolarHBondContact O-N 2.77Å; N36-N38 PolarHBondContact OD1-N 3.44Å
39	R	47.3	Very low	49.8	Very low	217 Å²	217	136.7 Å²	136.7	82%	0.819	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-87.6	-9.3	178	-126	-177.5	-171.4	-165.5	1.6	114.8	N36 P37 N41	N36-R39 PolarHBondContact O-N 2.72Å; P37-R39 PolarHBondContact O-N 3.04Å; R39-N41 PolarHBondContact O-N 3.27Å
40	Y	47.3	Very low	47.7	Very low	217 Å²	217	144.7 Å²	144.7	85%	0.851	74%	0.739	S	S	*	*			trans	-93.3	70.8	178.3	-86.5	-82.5	0	0	0	112.6
41	N	46.5	Very low	45.8	Very low	167 Å²	167	145.4 Å²	145.4	89%	0.893	75%	0.749	S	S	*	*	S	Bend	trans	-153.2	111	158.8	-109.3	-34.2	0	0	0	110.2	R39	R39-N41 PolarHBondContact O-N 3.27Å
42	G	50.3	Low	44	Very low	72 Å²	72	146 Å²	146	74%	0.742	75%	0.753	S	S	*	*	S	Bend	trans	100.9	57.9	170.6	0	0	0	0	0	117.1
43	E	35.4	Very low	42.2	Very low	180 Å²	180	145.4 Å²	145.4	84%	0.841	76%	0.757	S	S	*	*			trans	-164.7	134.6	133.6	-113.1	170.7	178.6	0	0	112.2
44	R	41.1	Very low	40.9	Very low	254 Å²	254	150 Å²	150	96%	0.958	77%	0.772	S	S	*	*			trans	-101.8	85.5	171.9	-81.1	-175.2	172	-175.9	-2.3	109.2
45	V	34.8	Very low	39.4	Very low	122 Å²	122	150 Å²	150	74%	0.739	78%	0.777	S	S	*	*			trans	-86	116.5	170.1	-176.8	0	0	0	0	109	A47	V45-A47 PolarHBondContact O-N 2.98Å
46	A	34.9	Very low	38	Very low	91 Å²	91	151.1 Å²	151.1	75%	0.752	79%	0.789	S	S	*	*			trans	-76.9	117.5	175.5	0	0	0	0	0	110.2	R48	A46-R48 VanDerWaalsContact C-N 3.33Å; A46-R48 PolarHBondContact O-N 3.33Å
47	A	31.1	Very low	37.1	Very low	104 Å²	104	150.7 Å²	150.7	86%	0.86	80%	0.797	S	S	*	*			trans	-73.9	83.4	175.4	0	0	0	0	0	111	V45	V45-A47 PolarHBondContact O-N 2.98Å
48	R	29.2	Very low	36	Very low	228 Å²	228	151.9 Å²	151.9	86%	0.86	81%	0.808	S	S	*	*			trans	-92.5	101.8	171.4	-167.3	174	-170.2	164.8	2.5	109.3	A46 Q50	A46-R48 VanDerWaalsContact C-N 3.33Å; A46-R48 PolarHBondContact O-N 3.33Å; R48-Q50 PolarHBondContact O-N 3.49Å
49	I	32.9	Very low	35.2	Very low	161 Å²	161	147.9 Å²	147.9	83%	0.826	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-65.3	119.7	174.7	-60.6	172	0	0	0	108.2
50	Q	29.3	Very low	34.4	Very low	169 Å²	169	147.4 Å²	147.4	79%	0.79	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-84.5	132.2	166.9	-72.6	-178.3	-91.3	0	0	109.4	R48	R48-Q50 PolarHBondContact O-N 3.49Å
51	A	30.3	Very low	33.6	Very low	89 Å²	89	146 Å²	146	74%	0.736	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-78	169.7	160.3	0	0	0	0	0	109.9
52	T	32.7	Very low	34	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-79.3	132.4	-173.4	50.1	0	0	0	0	113.7
53	D	28.1	Very low	34	Very low	150 Å²	150	145.4 Å²	145.4	80%	0.802	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-92.4	142.5	165.3	-69.2	-46.8	0	0	0	111.6
54	I	31.5	Very low	33.8	Very low	135 Å²	135	140.2 Å²	140.2	69%	0.692	80%	0.801	S	S	*	*			trans	-146.3	115	177.2	-69.7	-176.7	0	0	0	109.1
55	F	31.9	Very low	33.2	Very low	196 Å²	196	136.3 Å²	136.3	86%	0.86	79%	0.794	S	S	*	*			trans	59.2	159.6	179	-63.7	-68.4	0	0	0	115.7
56	D	30.5	Very low	33.1	Very low	149 Å²	149	135.6 Å²	135.6	80%	0.797	79%	0.79	S	S	*	*			cis	-141.6	-169	1	-150	-18.7	0	0	0	111.8
57	A	31.3	Very low	32.9	Very low	77 Å²	77	137.6 Å²	137.6	64%	0.636	78%	0.783	S	S	*	*			trans	-94.6	179.5	-164.3	0	0	0	0	0	118
58	S	32	Very low	32.8	Very low	130 Å²	130	141.5 Å²	141.5	91%	0.909	78%	0.777	S	S	*	*			trans	76.2	148.5	175.7	78.8	0	0	0	0	117.4
59	G	30.3	Very low	32.8	Very low	69 Å²	69	135.6 Å²	135.6	71%	0.711	77%	0.767	S	S	*	*			cis	170.8	158.2	-9.9	0	0	0	0	0	114.3
60	M	31.9	Very low	32.8	Very low	206 Å²	206	135.3 Å²	135.3	100%	1.015	76%	0.761	S	S	*	*			trans	72.2	170.4	169	-61.5	-171.1	173.9	0	0	119.8
61	Q	29.6	Very low	32.8	Very low	187 Å²	187	135 Å²	135	87%	0.874	76%	0.76	S	S	*	*			trans	-145.5	-161.9	-163	-141.2	-164	-41.8	0	0	112
62	P	55.6	Low	33	Very low	100 Å²	100	138.9 Å²	138.9	65%	0.649	76%	0.756	S	S	*	*			trans	-96.7	-163.6	-141	47.7	-33.5	0	0	0	113.6
63	P	50.8	Low	33.6	Very low	128 Å²	128	139 Å²	139	83%	0.831	76%	0.758	S	S	*	*			cis	-143.3	-175.6	5.3	45.1	-26	0	0	0	118.5
64	G	29.4	Very low	33.9	Very low	71 Å²	71	140.5 Å²	140.5	73%	0.732	75%	0.754	S	S	*	*			trans	107.8	167.8	155.3	0	0	0	0	0	117
65	Q	30	Very low	33.8	Very low	172 Å²	172	146 Å²	146	80%	0.804	77%	0.766	S	S	*	*			cis	-172.8	154.6	-26.7	-134.5	-174.3	3.8	0	0	109.8
66	T	32.2	Very low	34	Very low	107 Å²	107	140.2 Å²	140.2	66%	0.656	76%	0.762	S	S	*	*			trans	64.9	156	155.5	59.2	0	0	0	0	120
67	Q	30.5	Very low	34.9	Very low	132 Å²	132	141.7 Å²	141.7	62%	0.617	77%	0.767	S	S	*	*			cis	-167.2	162.1	-14.7	-115.1	166.6	-6	0	0	113.7
68	Y	29.7	Very low	35.2	Very low	187 Å²	187	147.7 Å²	147.7	73%	0.733	78%	0.779	S	S	*	*			trans	64.7	156.7	147.7	-65.9	-38.8	0	0	0	121.1
69	T	28.8	Very low	36	Very low	104 Å²	104	144.7 Å²	144.7	64%	0.638	77%	0.769	S	S	*	*			cis	-150.1	173.7	-2.9	-0.3	0	0	0	0	112.7
70	H	32.4	Very low	36.9	Very low	154 Å²	154	151.1 Å²	151.1	71%	0.713	78%	0.78	S	S	*	*			trans	80.5	144.7	168.4	-55.7	-72.1	0	0	0	117.5
71	E	28.9	Very low	37.5	Very low	163 Å²	163	151.4 Å²	151.4	76%	0.762	78%	0.776	S	S	*	*			cis	-158.2	-149.6	-33.4	-143.2	174.7	118.3	0	0	111.7
72	R	35.8	Very low	38.6	Very low	171 Å²	171	145.7 Å²	145.7	65%	0.645	77%	0.768	S	S	*	*			trans	-145.2	169.9	176.5	-62	-170.2	179.3	-167.2	2.4	110.9	Y74	R72-Y74 PolarHBondContact NH1-OH 3.26Å
73	P	44.4	Very low	38.7	Very low	130 Å²	130	150.4 Å²	150.4	84%	0.844	78%	0.781	S	S	*	*				-129.7	170.9	91.1	9	12.9	0	0	0	115.2
74	Y	33.7	Very low	38.9	Very low	183 Å²	183	155.7 Å²	155.7	72%	0.718	78%	0.784	S	S	*	*			trans	-71.8	170.1	174.8	-77.8	-92.4	0	0	0	111.6	R72	R72-Y74 PolarHBondContact NH1-OH 3.26Å
75	R	31	Very low	40.1	Very low	251 Å²	251	154.8 Å²	154.8	95%	0.947	78%	0.775	S	S	*	*			cis	-173.1	145.8	49.2	-167.8	-178.9	-166.9	172.5	3.6	112
76	G	34.9	Very low	41.4	Very low	74 Å²	74	152.9 Å²	152.9	76%	0.763	78%	0.777	S	S	*	*			trans	151.3	86.4	167.5	0	0	0	0	0	114.7
77	I	49.9	Very low	42.3	Very low	179 Å²	179	157.4 Å²	157.4	92%	0.918	79%	0.788	S	S	*	*			trans	-77.8	127.2	171.1	-60.6	172.8	0	0	0	108.4
78	K	38	Very low	42.9	Very low	203 Å²	203	154.4 Å²	154.4	88%	0.883	79%	0.792	S	S	*	*			trans	-121.1	133.3	168.2	-168.4	169.6	-175.7	172.4	0	107.9
79	G	47.5	Very low	43.8	Very low	67 Å²	67	153 Å²	153	69%	0.691	80%	0.797	S	S	*	*			trans	-62.2	165.9	-169	0	0	0	0	0	114.8
80	E	49	Very low	44.5	Very low	205 Å²	205	153.4 Å²	153.4	96%	0.958	81%	0.805	S	S	*	*			trans	-57.7	147.2	-177.3	-64.6	-172.6	122.9	0	0	112.8	G82	E80-G82 PolarHBondContact O-N 3.4Å
81	K	45.2	Very low	45.2	Very low	211 Å²	211	153.8 Å²	153.8	92%	0.917	81%	0.811	S	S	*	*			trans	-86.7	104.4	-174.8	-171.1	173	-175.4	174.1	0	109.1
82	G	53.3	Low	46	Very low	68 Å²	68	157.4 Å²	157.4	70%	0.701	82%	0.817	S	S	*	*			trans	-50.7	154.7	176.3	0	0	0	0	0	113.3	E80	E80-G82 PolarHBondContact O-N 3.4Å
83	E	57.9	Low	46.6	Very low	199 Å²	199	151.7 Å²	151.7	93%	0.93	81%	0.812	S	S	*	*			trans	-56.4	148.2	-168.6	-63.7	-164.7	138.2	0	0	113.6	G85	E83-G85 PolarHBondContact O-N 2.97Å; E83-G85 VanDerWaalsContact O-N 3.17Å
84	R	54	Low	47	Very low	239 Å²	239	151.2 Å²	151.2	90%	0.902	81%	0.809	S	S	*	*			trans	-73.5	110.9	-178.4	-169.6	-170.7	-53.6	-160.2	4.8	109.3
85	G	55.3	Low	47.9	Very low	52 Å²	52	148.7 Å²	148.7	54%	0.536	81%	0.814	S	S	.	*	P	Polyproline II helix	trans	-51.2	155.1	170.5	0	0	0	0	0	112.7	E83	E83-G85 PolarHBondContact O-N 2.97Å; E83-G85 VanDerWaalsContact O-N 3.17Å
86	P	57.4	Low	48.8	Very low	131 Å²	131	139.8 Å²	139.8	85%	0.851	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-56.3	148.6	-173.7	23.3	-33.9	0	0	0	112	G88	P86-G88 PolarHBondContact O-N 3.36Å
87	K	50.4	Low	49.7	Very low	202 Å²	202	142.1 Å²	142.1	88%	0.878	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-58.6	121.1	176.3	-73.1	-179.1	177.5	177.1	0	109.4
88	G	43.7	Very low	49.9	Very low	69 Å²	69	139.7 Å²	139.7	71%	0.711	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-67.9	139.5	163.7	0	0	0	0	0	110.4	P86 S90	P86-G88 PolarHBondContact O-N 3.36Å; G88-S90 PolarHBondContact O-N 2.97Å
89	D	48.9	Very low	50.6	Low	157 Å²	157	133 Å²	133	84%	0.84	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.4	119.6	-179.1	-74.1	-56	0	0	0	111.5	I91	D89-I91 PolarHBondContact O-N 2.95Å
90	S	43.3	Very low	51	Low	114 Å²	114	135.7 Å²	135.7	80%	0.797	79%	0.792	S	S	*	*			trans	-83.9	83.9	-176.2	-165.7	0	0	0	0	110.2	G88 R92	G88-S90 PolarHBondContact O-N 2.97Å; S90-R92 VanDerWaalsContact C-N 3.26Å; S90-R92 PolarHBondContact O-N 3.42Å
91	I	47.5	Very low	51.3	Low	162 Å²	162	132.1 Å²	132.1	83%	0.831	79%	0.787	S	S	*	*			trans	-67.3	87.2	172.6	-52.2	177.5	0	0	0	108.6	D89 G93	D89-I91 PolarHBondContact O-N 2.95Å; I91-G93 PolarHBondContact O-N 3.28Å
92	R	43.9	Very low	51.8	Low	238 Å²	238	125 Å²	125	90%	0.898	77%	0.773	S	S	*	*			trans	-74	107.2	178.2	-163.5	-179.2	-163.6	-170.9	4.9	109.2	S90	S90-R92 VanDerWaalsContact C-N 3.26Å; S90-R92 PolarHBondContact O-N 3.42Å
93	G	48.6	Very low	51.9	Low	52 Å²	52	128 Å²	128	54%	0.536	78%	0.781	S	S	.	*	P	Polyproline II helix	trans	-58	158.1	171.6	0	0	0	0	0	112.4	I91	I91-G93 PolarHBondContact O-N 3.28Å
94	P	53.8	Low	51.5	Low	120 Å²	120	128.3 Å²	128.3	78%	0.779	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-61.3	157.2	177.2	27.6	-35.1	0	0	0	111.5	G96	P94-G96 PolarHBondContact O-N 2.99Å
95	P	51.6	Low	50.9	Low	129 Å²	129	120.5 Å²	120.5	84%	0.838	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-57.4	139.4	178.2	-22.8	33.8	0	0	0	112.1
96	G	50.2	Low	50.2	Low	64 Å²	64	127.3 Å²	127.3	66%	0.66	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.3	157	169.1	0	0	0	0	0	111.7	P94	P94-G96 PolarHBondContact O-N 2.99Å
97	P	53.9	Low	49.7	Very low	123 Å²	123	127.8 Å²	127.8	80%	0.799	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.3	156.4	175.9	28.5	-35.3	0	0	0	111.4
98	P	54.3	Low	49.2	Very low	128 Å²	128	122.1 Å²	122.1	83%	0.831	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-56.7	143.3	174.8	-23.6	34.2	0	0	0	112.2
99	G	53.8	Low	49.3	Very low	63 Å²	63	124.7 Å²	124.7	65%	0.649	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.1	158.6	170.3	0	0	0	0	0	112
100	P	55.3	Low	48.7	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-61.8	148	177.5	27.3	-34.9	0	0	0	111.2	G102	P100-G102 PolarHBondContact O-N 3.48Å
101	P	55.5	Low	48.5	Very low	130 Å²	130	127.8 Å²	127.8	84%	0.844	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-57.3	137.6	175	-24.1	34.2	0	0	0	112
102	G	55.7	Low	48.3	Very low	61 Å²	61	125.6 Å²	125.6	63%	0.629	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.6	160.9	171.5	0	0	0	0	0	112.3	P100	P100-G102 PolarHBondContact O-N 3.48Å
103	P	54.8	Low	47.8	Very low	132 Å²	132	123.1 Å²	123.1	86%	0.857	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-59	145.6	176.3	26.4	-34.5	0	0	0	111.1	G105	P103-G105 PolarHBondContact O-N 3.47Å
104	K	49.1	Very low	47.2	Very low	206 Å²	206	125.8 Å²	125.8	90%	0.896	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-63.3	124.4	177.5	-67.7	179.7	177.8	178.6	0	109.5
105	G	41.8	Very low	46.7	Very low	75 Å²	75	128.2 Å²	128.2	77%	0.773	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.2	139.6	171.8	0	0	0	0	0	111.4	P103	P103-G105 PolarHBondContact O-N 3.47Å
106	E	41.4	Very low	45.9	Very low	195 Å²	195	127.7 Å²	127.7	91%	0.911	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-75.4	147.5	177.5	-62.7	-179.3	134.6	0	0	111.3	A108	E106-A108 PolarHBondContact O-N 3.23Å
107	T	45.7	Very low	45.7	Very low	140 Å²	140	131.7 Å²	131.7	86%	0.859	79%	0.79	S	S	*	*			trans	-82.8	94.9	-175.9	51.4	0	0	0	0	111.5
108	A	39.4	Very low	44.9	Very low	83 Å²	83	131 Å²	131	69%	0.686	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.6	135	167.9	0	0	0	0	0	111	E106	E106-A108 PolarHBondContact O-N 3.23Å
109	P	45.9	Very low	44.5	Very low	124 Å²	124	130.4 Å²	130.4	81%	0.805	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-76.3	137.7	177.3	30.6	-33.9	0	0	0	111.6
110	Y	37.3	Very low	44.3	Very low	224 Å²	224	130.8 Å²	130.8	88%	0.878	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.8	138.4	172.4	-80.9	-97	0	0	0	111.3
111	P	39.3	Very low	43.4	Very low	112 Å²	112	129.6 Å²	129.6	73%	0.727	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.5	156.7	164	31.9	-34.2	0	0	0	110.9
112	P	43.6	Very low	43	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.9	153.2	-175	29.3	-35.7	0	0	0	113.3
113	F	33.2	Very low	42.5	Very low	186 Å²	186	140.3 Å²	140.3	82%	0.816	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-66.8	127.8	174.6	-170.9	-98.3	0	0	0	110.7	E115	F113-E115 HydrophobicContact CD1-CG 4.21Å; F113-E115 HydrophobicContact CE1-CG 3.89Å
114	V	36.2	Very low	41.7	Very low	109 Å²	109	140.9 Å²	140.9	66%	0.661	81%	0.811	S	S	*	*			trans	-109.4	117.5	175.3	179	0	0	0	0	108.6	T116	V114-T116 HydrophobicContact CG1-CG2 4.41Å; V114-T116 PolarHBondContact O-N 3.11Å
115	E	43.6	Very low	41.8	Very low	170 Å²	170	135 Å²	135	79%	0.794	81%	0.81	S	S	*	*			trans	-72.9	107.4	170	-70	-173.6	129.6	0	0	110.1	F113	F113-E115 HydrophobicContact CD1-CG 4.21Å; F113-E115 HydrophobicContact CE1-CG 3.89Å
116	T	33	Very low	41.7	Very low	118 Å²	118	139.6 Å²	139.6	72%	0.724	81%	0.811	S	S	*	*			trans	-109.7	93.7	167.4	27.4	0	0	0	0	110.6	V114 S118	V114-T116 HydrophobicContact CG1-CG2 4.41Å; V114-T116 PolarHBondContact O-N 3.11Å; T116-S118 PolarHBondContact O-N 3.16Å; T116-S118 VanDerWaalsContact O-N 3.13Å
117	T	46.5	Very low	41.7	Very low	149 Å²	149	137 Å²	137	91%	0.914	81%	0.813	S	S	*	*			trans	-61.3	111.2	170.3	39.2	0	0	0	0	110.6
118	S	37.1	Very low	42	Very low	107 Å²	107	135.7 Å²	135.7	75%	0.748	81%	0.805	S	S	*	*			trans	-136.7	129.3	171.8	52.4	0	0	0	0	109.6	T116	T116-S118 PolarHBondContact O-N 3.16Å; T116-S118 VanDerWaalsContact O-N 3.13Å
119	A	47	Very low	42.3	Very low	117 Å²	117	137.5 Å²	137.5	97%	0.967	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	123.8	-171.3	0	0	0	0	0	111.3
120	G	50	Low	43	Very low	71 Å²	71	135 Å²	135	73%	0.732	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	164.8	-22.4	172.6	0	0	0	0	0	117.1	K122	G120-K122 PolarHBondContact O-N 3.43Å
121	A	36.2	Very low	44.3	Very low	97 Å²	97	127.6 Å²	127.6	80%	0.802	78%	0.776	S	S	*	*			trans	-78	102.7	-172.3	0	0	0	0	0	113.9	Y123	A121-Y123 PolarHBondContact O-N 3.43Å
122	K	47.1	Very low	45.8	Very low	194 Å²	194	125.7 Å²	125.7	84%	0.843	77%	0.766	S	S	*	*			trans	-85	64.4	171.3	-72.9	-172.4	175.9	-179.1	0	113	G120	G120-K122 PolarHBondContact O-N 3.43Å
123	Y	43.5	Very low	46.7	Very low	223 Å²	223	124.4 Å²	124.4	88%	0.875	75%	0.752	S	S	*	*			trans	-137.6	101.3	170	-72	-70.2	0	0	0	112.6	A121	A121-Y123 PolarHBondContact O-N 3.43Å
124	T	39.4	Very low	48.1	Very low	143 Å²	143	119.7 Å²	119.7	88%	0.877	74%	0.735	S	S	*	*			trans	-74	134.4	161.1	47.1	0	0	0	0	109.2	E126	T124-E126 PolarHBondContact O-N 3.06Å
125	G	50.2	Low	49.5	Very low	84 Å²	84	119.9 Å²	119.9	87%	0.866	73%	0.731	S	S	*	*			trans	-70	115.9	-165	0	0	0	0	0	115.4
126	E	39.6	Very low	50.6	Low	171 Å²	171	117.2 Å²	117.2	80%	0.799	72%	0.719	S	S	*	*			trans	-142.6	103.9	157.8	-170.3	169	-135	0	0	108.9	T124 T128	T124-E126 PolarHBondContact O-N 3.06Å; E126-T128 HydrophobicContact CG-CG2 4.5Å; E126-T128 PolarHBondContact O-N 3.44Å; E126-T128 VanDerWaalsContact O-N 3.1Å
127	C	42.8	Very low	51.9	Low	141 Å²	141	114.5 Å²	114.5	95%	0.953	71%	0.709	S	S	*	*			trans	-80.5	92.2	-175.2	-66.7	0	0	0	0	111.5
128	T	51.1	Low	52.9	Low	112 Å²	112	110.3 Å²	110.3	69%	0.687	68%	0.68	S	S	*	*			trans	-95.5	137.4	168.8	55.2	0	0	0	0	110.7	E126	E126-T128 HydrophobicContact CG-CG2 4.5Å; E126-T128 PolarHBondContact O-N 3.44Å; E126-T128 VanDerWaalsContact O-N 3.1Å
129	C	46.8	Very low	54.1	Low	121 Å²	121	110.9 Å²	110.9	82%	0.818	67%	0.669	S	S	*	*			trans	-110.4	84.3	-175	-161.4	0	0	0	0	110.2
130	N	59.9	Low	54.9	Low	71 Å²	71	112.2 Å²	112.2	38%	0.38	66%	0.66	S	S	.	*			trans	-96.4	131.6	179	174.6	21.1	0	0	0	110.5	S132 D133	N130-S132 VanDerWaalsContact C-N 3.29Å; N130-S132 PolarHBondContact O-N 3.02Å; N130-S132 PolarHBondContact OD1-N 3.38Å; N130-D133 VanDerWaalsContact CB-OD2 3.29Å; N130-D133 WeakPolarHBondContact CB-OD2 3.38Å; N130-D133 PolarHBondContact ND2-OD1 2.81Å; N130-D133 PolarHBondContact ND2-OD2 3.21Å; N130-D133 PolarHBondContact O-N 3.35Å
131	A	65.1	Low	55.7	Low	69 Å²	69	111.8 Å²	111.8	57%	0.57	64%	0.641	S	S	*	*	H	α-helix	trans	-67.9	-26.3	-175.9	0	0	0	0	0	113.5	L135	A131-L135 WeakPolarHBondContact O-CG 3.44Å; A131-L135 PolarHBondContact O-N 2.92Å
132	S	69.3	Low	57.1	Low	72 Å²	72	114.9 Å²	114.9	50%	0.503	64%	0.639	S	S	.	*	H	α-helix	trans	-66.5	-45.8	177.7	-57.5	0	0	0	0	111.9	N130 I134 L135 E136	N130-S132 VanDerWaalsContact C-N 3.29Å; N130-S132 PolarHBondContact O-N 3.02Å; N130-S132 PolarHBondContact OD1-N 3.38Å; S132-I134 VanDerWaalsContact C-N 3.3Å; S132-I134 PolarHBondContact O-N 3.15Å; S132-L135 WeakPolarHBondContact O-CA 3.49Å; S132-L135 WeakPolarHBondContact O-CB 3.36Å; S132-L135 PolarHBondContact O-N 3.38Å; S132-E136 PolarHBondContact O-N 2.92Å
133	D	63.6	Low	57.9	Low	88 Å²	88	109.1 Å²	109.1	47%	0.471	62%	0.623	S	S	.	*	H	α-helix	trans	-72.9	-30.1	-169.8	-46.6	-20.1	0	0	0	110.6	N130 E136 A137	N130-D133 VanDerWaalsContact CB-OD2 3.29Å; N130-D133 WeakPolarHBondContact CB-OD2 3.38Å; N130-D133 PolarHBondContact ND2-OD1 2.81Å; N130-D133 PolarHBondContact ND2-OD2 3.21Å; N130-D133 PolarHBondContact O-N 3.35Å; D133-E136 PolarHBondContact O-N 2.71Å; D133-A137 PolarHBondContact O-N 3.19Å
134	I	62.5	Low	58.5	Low	87 Å²	87	102.3 Å²	102.3	45%	0.446	60%	0.601	S	S	.	*	H	α-helix	trans	-65.4	-41.1	170	-62.2	169.9	0	0	0	111	S132 E136 A137 I138	S132-I134 VanDerWaalsContact C-N 3.3Å; S132-I134 PolarHBondContact O-N 3.15Å; I134-E136 VanDerWaalsContact C-N 3.26Å; I134-E136 PolarHBondContact O-N 3Å; I134-A137 PolarHBondContact O-N 3.38Å; I134-I138 HydrophobicContact CG2-CD1 3.96Å; I134-I138 WeakPolarHBondContact O-CD1 3.38Å; I134-I138 VanDerWaalsContact O-CG1 3.27Å; I134-I138 WeakPolarHBondContact O-CG1 3.37Å; I134-I138 PolarHBondContact O-N 3.25Å; I134-I138 VanDerWaalsContact O-N 3.1Å
135	L	66.2	Low	59.5	Low	113 Å²	113	100.3 Å²	100.3	59%	0.592	58%	0.577	S	S	*	*	H	α-helix	trans	-69.4	-23.5	176.6	-75.1	166.7	0	0	0	112.7	A131 S132 K139	A131-L135 WeakPolarHBondContact O-CG 3.44Å; A131-L135 PolarHBondContact O-N 2.92Å; S132-L135 WeakPolarHBondContact O-CA 3.49Å; S132-L135 WeakPolarHBondContact O-CB 3.36Å; S132-L135 PolarHBondContact O-N 3.38Å; L135-K139 WeakPolarHBondContact O-CG 3.33Å
136	E	65.5	Low	60	Low	113 Å²	113	101.8 Å²	101.8	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-81.6	-43.9	173.8	-150.9	133.3	-103.1	0	0	111.2	S132 D133 I134 I138 K139 D140	S132-E136 PolarHBondContact O-N 2.92Å; D133-E136 PolarHBondContact O-N 2.71Å; I134-E136 VanDerWaalsContact C-N 3.26Å; I134-E136 PolarHBondContact O-N 3Å; E136-I138 PolarHBondContact O-N 3.08Å; E136-K139 WeakPolarHBondContact O-CA 3.41Å; E136-K139 WeakPolarHBondContact O-CB 3.4Å; E136-K139 PolarHBondContact O-N 2.95Å; E136-D140 PolarHBondContact O-N 3.18Å
137	A	61.5	Low	61	Low	62 Å²	62	98.7 Å²	98.7	51%	0.512	56%	0.559	S	S	.	*	H	α-helix	trans	-59	-32.3	173	0	0	0	0	0	113.6	D133 I134 K139	D133-A137 PolarHBondContact O-N 3.19Å; I134-A137 PolarHBondContact O-N 3.38Å; A137-K139 VanDerWaalsContact C-N 3.33Å
138	I	65.7	Low	61.6	Low	60 Å²	60	98 Å²	98	31%	0.308	55%	0.545	S	S	.	.	H	α-helix	trans	-74.7	-20.1	173.7	-68	167.1	0	0	0	112.3	I134 E136 R145	I134-I138 HydrophobicContact CG2-CD1 3.96Å; I134-I138 WeakPolarHBondContact O-CD1 3.38Å; I134-I138 VanDerWaalsContact O-CG1 3.27Å; I134-I138 WeakPolarHBondContact O-CG1 3.37Å; I134-I138 PolarHBondContact O-N 3.25Å; I134-I138 VanDerWaalsContact O-N 3.1Å; E136-I138 PolarHBondContact O-N 3.08Å; I138-R145 PolarHBondContact O-NH1 3.06Å
139	K	63.4	Low	62	Low	119 Å²	119	100.7 Å²	100.7	52%	0.517	54%	0.543	S	S	.	.	H	α-helix	trans	-79.1	-26.2	174.8	-77.8	172.2	-175.7	169.2	0	113.7	L135 E136 A137 R145	L135-K139 WeakPolarHBondContact O-CG 3.33Å; E136-K139 WeakPolarHBondContact O-CA 3.41Å; E136-K139 WeakPolarHBondContact O-CB 3.4Å; E136-K139 PolarHBondContact O-N 2.95Å; A137-K139 VanDerWaalsContact C-N 3.33Å; K139-R145 VanDerWaalsContact C-NH1 3.27Å; K139-R145 PolarHBondContact O-NH1 3.3Å; K139-R145 PolarHBondContact O-NH2 3.47Å
140	D	63.6	Low	62.5	Low	145 Å²	145	98.1 Å²	98.1	78%	0.775	54%	0.537	S	S	*	.	H	α-helix	trans	-102.7	-2.8	-171.7	-65.7	-6.1	0	0	0	113.8	E136	E136-D140 PolarHBondContact O-N 3.18Å
141	N	66.4	Low	62.2	Low	62 Å²	62	99.1 Å²	99.1	33%	0.332	56%	0.555	S	S	.	*			trans	-117.3	119.3	176.6	-170.7	-16.1	0	0	0	111.4	S143 L144 R145	N141-S143 WeakPolarHBondContact OD1-CB 3.24Å; N141-S143 PolarHBondContact OD1-N 2.99Å; N141-S143 PolarHBondContact OD1-OG 2.71Å; N141-L144 HydrophobicContact CB-CD1 4.27Å; N141-R145 PolarHBondContact O-NH1 2.93Å; N141-R145 VanDerWaalsContact O-NH1 3.08Å
142	E	65.6	Low	62	Low	162 Å²	162	102 Å²	102	76%	0.757	57%	0.568	S	S	*	*	H	α-helix	trans	-72.6	-37.4	174.7	-72.9	-162.2	125.8	0	0	112.8	L144 R145 E146	E142-L144 VanDerWaalsContact C-N 3.28Å; E142-L144 PolarHBondContact O-N 3.39Å; E142-R145 WeakPolarHBondContact O-CB 3.32Å; E142-R145 PolarHBondContact O-N 2.93Å; E142-E146 PolarHBondContact O-N 3.27Å; E142-E146 VanDerWaalsContact O-N 3.15Å
143	S	63.4	Low	61.2	Low	73 Å²	73	102 Å²	102	51%	0.51	58%	0.579	S	S	.	*	H	α-helix	trans	-62.3	-33.5	-174.4	67.9	0	0	0	0	113.4	N141 S147	N141-S143 WeakPolarHBondContact OD1-CB 3.24Å; N141-S143 PolarHBondContact OD1-N 2.99Å; N141-S143 PolarHBondContact OD1-OG 2.71Å; S143-S147 PolarHBondContact O-N 2.96Å; S143-S147 PolarHBondContact O-OG 2.92Å
144	L	57.4	Low	60.6	Low	80 Å²	80	104.1 Å²	104.1	42%	0.419	60%	0.596	S	S	.	*	H	α-helix	trans	-70.8	-30	173	-78.3	172.7	0	0	0	113.2	N141 E142 L148	N141-L144 HydrophobicContact CB-CD1 4.27Å; E142-L144 VanDerWaalsContact C-N 3.28Å; E142-L144 PolarHBondContact O-N 3.39Å; L144-L148 WeakPolarHBondContact O-CD1 3.43Å; L144-L148 WeakPolarHBondContact O-CG 3.37Å; L144-L148 PolarHBondContact O-N 3.44Å
145	R	61	Low	60.6	Low	101 Å²	101	106.1 Å²	106.1	38%	0.381	61%	0.614	S	S	.	*	H	α-helix	trans	-71.7	-39.7	175.8	-66.4	176.8	166.9	98.2	-22.9	112	I138 K139 N141 E142 S147 L148 R149	I138-R145 PolarHBondContact O-NH1 3.06Å; K139-R145 VanDerWaalsContact C-NH1 3.27Å; K139-R145 PolarHBondContact O-NH1 3.3Å; K139-R145 PolarHBondContact O-NH2 3.47Å; N141-R145 PolarHBondContact O-NH1 2.93Å; N141-R145 VanDerWaalsContact O-NH1 3.08Å; E142-R145 WeakPolarHBondContact O-CB 3.32Å; E142-R145 PolarHBondContact O-N 2.93Å; R145-S147 VanDerWaalsContact C-N 3.31Å; R145-S147 PolarHBondContact O-N 3.47Å; R145-L148 PolarHBondContact O-N 3.02Å; R145-R149 PolarHBondContact O-N 3.38Å
146	E	59.4	Low	60	Low	116 Å²	116	104.1 Å²	104.1	54%	0.542	62%	0.621	S	S	.	*	H	α-helix	trans	-63.4	-42	178.4	-136.4	53.8	-130.6	0	0	110.7	E142 L148 R149	E142-E146 PolarHBondContact O-N 3.27Å; E142-E146 VanDerWaalsContact O-N 3.15Å; E146-L148 VanDerWaalsContact C-N 3.27Å; E146-L148 PolarHBondContact O-N 2.6Å; E146-R149 PolarHBondContact O-N 2.93Å; E146-R149 IonicContact OE1-CZ 2.69Å; E146-R149 IonicContact OE1-NE 3.37Å; E146-R149 PolarHBondContact OE1-NE 3.08Å; E146-R149 IonicContact OE1-NH2 3.02Å; E146-R149 PolarHBondContact OE1-NH2 3.24Å; E146-R149 IonicContact OE2-CZ 3.07Å; E146-R149 IonicContact OE2-NH2 3.42Å; E146-R149 PolarHBondContact OE2-NH2 3.01Å
147	S	60.2	Low	59.1	Low	106 Å²	106	108.4 Å²	108.4	74%	0.741	64%	0.638	S	S	*	*	H	α-helix	trans	-69	-19.2	178.9	-55	0	0	0	0	114.5	S143 R145	S143-S147 PolarHBondContact O-N 2.96Å; S143-S147 PolarHBondContact O-OG 2.92Å; R145-S147 VanDerWaalsContact C-N 3.31Å; R145-S147 PolarHBondContact O-N 3.47Å
148	L	57.1	Low	58.9	Low	125 Å²	125	113 Å²	113	65%	0.654	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-2.9	178.4	-71.1	171.7	0	0	0	113.3	L144 R145 E146 G150	L144-L148 WeakPolarHBondContact O-CD1 3.43Å; L144-L148 WeakPolarHBondContact O-CG 3.37Å; L144-L148 PolarHBondContact O-N 3.44Å; R145-L148 PolarHBondContact O-N 3.02Å; E146-L148 VanDerWaalsContact C-N 3.27Å; E146-L148 PolarHBondContact O-N 2.6Å; L148-G150 PolarHBondContact O-N 3.07Å
149	R	58.8	Low	58.1	Low	169 Å²	169	113.7 Å²	113.7	64%	0.638	68%	0.676	S	S	*	*			trans	-86.7	90.6	-177.1	-159.2	-171.2	-49.3	-138.4	10.3	111.1	R145 E146	R145-R149 PolarHBondContact O-N 3.38Å; E146-R149 PolarHBondContact O-N 2.93Å; E146-R149 IonicContact OE1-CZ 2.69Å; E146-R149 IonicContact OE1-NE 3.37Å; E146-R149 PolarHBondContact OE1-NE 3.08Å; E146-R149 IonicContact OE1-NH2 3.02Å; E146-R149 PolarHBondContact OE1-NH2 3.24Å; E146-R149 IonicContact OE2-CZ 3.07Å; E146-R149 IonicContact OE2-NH2 3.42Å; E146-R149 PolarHBondContact OE2-NH2 3.01Å
150	G	58	Low	57.2	Low	68 Å²	68	117.6 Å²	117.6	70%	0.701	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-54.3	145.6	175.3	0	0	0	0	0	113.3	L148	L148-G150 PolarHBondContact O-N 3.07Å
151	A	52.3	Low	57.1	Low	92 Å²	92	116.7 Å²	116.7	76%	0.76	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-59.1	147	-174.2	0	0	0	0	0	113.1	G153	A151-G153 PolarHBondContact O-N 2.73Å
152	P	61.4	Low	56.1	Low	128 Å²	128	117.4 Å²	117.4	83%	0.831	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-56.6	132	179.8	-26	35	0	0	0	113
153	G	52.8	Low	55.2	Low	73 Å²	73	115.3 Å²	115.3	75%	0.753	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-63	140.8	175.5	0	0	0	0	0	111.9	A151	A151-G153 PolarHBondContact O-N 2.73Å
154	T	49.5	Very low	54.8	Low	133 Å²	133	117.4 Å²	117.4	82%	0.816	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-66.3	145.4	-179.9	44.7	0	0	0	0	111.8
155	P	64.3	Low	54.2	Low	128 Å²	128	117.2 Å²	117.2	83%	0.831	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-55.9	140.9	179.2	-27.9	36	0	0	0	113.4	K157	P155-K157 PolarHBondContact O-N 3.22Å
156	G	52.3	Low	53.2	Low	72 Å²	72	120.5 Å²	120.5	74%	0.742	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-66.8	120.4	177	0	0	0	0	0	111.5
157	K	46.7	Very low	52.6	Low	202 Å²	202	122 Å²	122	88%	0.878	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-56.9	133.1	172.9	54.8	-168.5	169.2	-172.1	0	112	P155	P155-K157 PolarHBondContact O-N 3.22Å
158	D	58.7	Low	52.2	Low	159 Å²	159	120.5 Å²	120.5	85%	0.85	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-60.2	149.2	-170	-64.5	-69.3	0	0	0	114.8
159	G	48.3	Very low	51.3	Low	75 Å²	75	119 Å²	119	77%	0.773	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.7	131.6	175.9	0	0	0	0	0	111.9
160	K	43.8	Very low	50.5	Low	201 Å²	201	117.5 Å²	117.5	87%	0.874	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.3	139.3	174.3	-66.1	-172.2	177.3	-174.2	0	110.6
161	P	60.8	Low	49.9	Very low	126 Å²	126	117.9 Å²	117.9	82%	0.818	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-55.6	143.9	173.9	-26.6	35.3	0	0	0	112.9
162	G	46.3	Very low	49.4	Very low	77 Å²	77	120 Å²	120	79%	0.794	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.8	143.7	177.1	0	0	0	0	0	112.6
163	T	45.8	Very low	48.9	Very low	118 Å²	118	119.5 Å²	119.5	72%	0.724	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-74.6	143.9	176.4	44.1	0	0	0	0	111.7
164	P	55.6	Low	48.6	Very low	116 Å²	116	119.9 Å²	119.9	75%	0.753	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-57.3	144.6	174.7	-27.1	36	0	0	0	113.8	H166	P164-H166 PolarHBondContact O-ND1 3.22Å
165	G	46	Very low	48.1	Very low	76 Å²	76	118.2 Å²	118.2	78%	0.784	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.6	149.5	-178.7	0	0	0	0	0	113.5
166	H	38.9	Very low	47.5	Very low	170 Å²	170	123.6 Å²	123.6	79%	0.787	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-98.7	131.2	-171.3	-20.7	-53	0	0	0	110.9	P164 G168	P164-H166 PolarHBondContact O-ND1 3.22Å; H166-G168 PolarHBondContact O-N 2.9Å
167	T	46.3	Very low	47.3	Very low	147 Å²	147	123.4 Å²	123.4	90%	0.902	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-68.8	125.2	171.8	-36.6	0	0	0	0	109.7
168	G	52.5	Low	47.1	Very low	76 Å²	76	118.5 Å²	118.5	78%	0.784	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-79.8	142.3	-175	0	0	0	0	0	114.1	H166	H166-G168 PolarHBondContact O-N 2.9Å
169	A	38.4	Very low	46.8	Very low	92 Å²	92	121.9 Å²	121.9	76%	0.76	81%	0.805	S	S	*	*			trans	-149.1	133	171.2	0	0	0	0	0	112.3
170	T	42.6	Very low	46.8	Very low	139 Å²	139	121.4 Å²	121.4	85%	0.853	80%	0.8	S	S	*	*			trans	55.5	124	156.8	-44.9	0	0	0	0	119.4
171	G	44.1	Very low	46.8	Very low	76 Å²	76	117.3 Å²	117.3	78%	0.784	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-66.6	135.6	175.4	0	0	0	0	0	113.7
172	V	42.3	Very low	46.4	Very low	136 Å²	136	119.9 Å²	119.9	82%	0.824	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-90.5	142.9	-176.9	-130.1	0	0	0	0	111.3
173	P	50.5	Low	46.3	Very low	118 Å²	118	119.3 Å²	119.3	77%	0.766	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-56.7	147.3	169.7	-26.6	36.1	0	0	0	112.7	A175	P173-A175 PolarHBondContact O-N 2.9Å
174	G	46.6	Very low	46.2	Very low	81 Å²	81	118.5 Å²	118.5	84%	0.835	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-51.8	125.8	-173.9	0	0	0	0	0	113.3	R176	G174-R176 PolarHBondContact O-N 3.24Å
175	A	40	Very low	45.8	Very low	97 Å²	97	122 Å²	122	80%	0.802	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-63	127.1	-171.3	0	0	0	0	0	112.1	P173 G177	P173-A175 PolarHBondContact O-N 2.9Å; A175-G177 PolarHBondContact O-N 3.13Å
176	R	51.4	Low	45.9	Very low	242 Å²	242	121.4 Å²	121.4	91%	0.913	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-60.3	120	164.6	-178.3	176.8	-175.8	162.9	2.4	107.7	G174 A178	G174-R176 PolarHBondContact O-N 3.24Å; R176-A178 PolarHBondContact O-N 3.14Å
177	G	47	Very low	46.2	Very low	67 Å²	67	121.6 Å²	121.6	69%	0.691	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-46.2	131.6	-176.3	0	0	0	0	0	112.1	A175 R179	A175-G177 PolarHBondContact O-N 3.13Å; G177-R179 PolarHBondContact O-N 3.35Å
178	A	43.2	Very low	46.6	Very low	99 Å²	99	123.9 Å²	123.9	82%	0.818	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-55.1	134.6	-170	0	0	0	0	0	111.3	R176 G180	R176-A178 PolarHBondContact O-N 3.14Å; A178-G180 PolarHBondContact O-N 3.29Å; A178-G180 VanDerWaalsContact O-N 3.1Å
179	R	52.7	Low	46.3	Very low	230 Å²	230	123.2 Å²	123.2	87%	0.868	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-57.9	119.2	168	177.1	175.8	175.1	170.9	-4.8	107	G177 S181	G177-R179 PolarHBondContact O-N 3.35Å; R179-S181 PolarHBondContact O-N 3.5Å
180	G	47.4	Very low	46.6	Very low	65 Å²	65	127.7 Å²	127.7	67%	0.67	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-49.1	134.8	-179.1	0	0	0	0	0	110.8	A178 E182	A178-G180 PolarHBondContact O-N 3.29Å; A178-G180 VanDerWaalsContact O-N 3.1Å; G180-E182 PolarHBondContact O-N 3.27Å
181	S	44	Very low	47.2	Very low	115 Å²	115	126.7 Å²	126.7	80%	0.804	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-49.3	130.2	-176.9	52	0	0	0	0	110.6	R179 G183	R179-S181 PolarHBondContact O-N 3.5Å; S181-G183 PolarHBondContact O-N 3.15Å
182	E	52.1	Low	47.3	Very low	180 Å²	180	126.4 Å²	126.4	84%	0.841	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-55.4	125.8	175.1	-172	152.9	-141.9	0	0	109	G180 A184	G180-E182 PolarHBondContact O-N 3.27Å; E182-A184 PolarHBondContact O-N 3.1Å
183	G	44.8	Very low	47.5	Very low	65 Å²	65	126.8 Å²	126.8	67%	0.67	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-58.8	130.3	-171.6	0	0	0	0	0	110.1	S181 Q185	S181-G183 PolarHBondContact O-N 3.15Å; G183-Q185 PolarHBondContact O-N 3.08Å; G183-Q185 VanDerWaalsContact O-N 3.16Å
184	A	43.5	Very low	47.6	Very low	101 Å²	101	128.9 Å²	128.9	84%	0.835	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-47.8	123.8	-176.4	0	0	0	0	0	110.4	E182 G186	E182-A184 PolarHBondContact O-N 3.1Å; A184-G186 PolarHBondContact O-N 3.35Å; A184-G186 VanDerWaalsContact O-N 3.11Å
185	Q	48.4	Very low	47.4	Very low	189 Å²	189	128 Å²	128	88%	0.883	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-54.4	121.1	-176.7	-179.1	176.2	-8.3	0	0	109.1	G183 L187	G183-Q185 PolarHBondContact O-N 3.08Å; G183-Q185 VanDerWaalsContact O-N 3.16Å; Q185-L187 PolarHBondContact O-N 3.05Å
186	G	46.4	Very low	47.7	Very low	64 Å²	64	131.3 Å²	131.3	66%	0.66	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-53.5	133.8	-179.5	0	0	0	0	0	110.4	A184 K188	A184-G186 PolarHBondContact O-N 3.35Å; A184-G186 VanDerWaalsContact O-N 3.11Å; G186-K188 PolarHBondContact O-N 2.71Å
187	L	46.3	Very low	47.8	Very low	174 Å²	174	125.5 Å²	125.5	91%	0.911	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-51.9	129.8	-178.6	-64.4	176.3	0	0	0	109.4	Q185 G189	Q185-L187 PolarHBondContact O-N 3.05Å; L187-G189 PolarHBondContact O-N 3.47Å
188	K	54.5	Low	47.8	Very low	195 Å²	195	125.2 Å²	125.2	85%	0.848	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-56.8	124.9	174.8	-176.8	-175.3	176.2	-177	0	107.6	G186 E190	G186-K188 PolarHBondContact O-N 2.71Å; K188-E190 PolarHBondContact O-N 2.97Å
189	G	46.1	Very low	48	Very low	63 Å²	63	127.5 Å²	127.5	65%	0.649	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-53.6	140.1	175.6	0	0	0	0	0	110.8	L187	L187-G189 PolarHBondContact O-N 3.47Å
190	E	45.2	Very low	47.9	Very low	186 Å²	186	125 Å²	125	87%	0.869	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-59.1	142.3	179.3	-61.9	-175.8	147.6	0	0	109.9	K188 G192	K188-E190 PolarHBondContact O-N 2.97Å; E190-G192 PolarHBondContact O-N 2.72Å
191	P	54.4	Low	47.8	Very low	117 Å²	117	124.6 Å²	124.6	76%	0.76	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-55.5	134.3	172.3	-22.8	33.8	0	0	0	110.2	V193	P191-V193 PolarHBondContact O-N 3.06Å
192	G	46.4	Very low	47.8	Very low	71 Å²	71	125 Å²	125	73%	0.732	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-57.9	135.6	173.5	0	0	0	0	0	110.3	E190	E190-G192 PolarHBondContact O-N 2.72Å
193	V	46.6	Very low	48	Very low	144 Å²	144	122.6 Å²	122.6	87%	0.873	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-62.8	134.7	178.4	-72.4	0	0	0	0	110.8	P191	P191-V193 PolarHBondContact O-N 3.06Å
194	D	51.7	Low	48	Very low	161 Å²	161	122.7 Å²	122.7	86%	0.861	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-62.1	137.3	175.7	-73	-53.5	0	0	0	110.8	L196	D194-L196 PolarHBondContact O-N 2.93Å
195	G	44	Very low	47.9	Very low	63 Å²	63	123.8 Å²	123.8	65%	0.649	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-63.5	134	178.9	0	0	0	0	0	111.9
196	L	45.9	Very low	48.4	Very low	167 Å²	167	121 Å²	121	87%	0.874	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-58.2	137.7	179.6	-68.1	173.5	0	0	0	111.3	D194 G198	D194-L196 PolarHBondContact O-N 2.93Å; L196-G198 PolarHBondContact O-N 2.83Å
197	P	54.1	Low	48.4	Very low	120 Å²	120	121 Å²	121	78%	0.779	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.2	136.4	174.9	-25.7	34.9	0	0	0	112.3
198	G	45.3	Very low	48.2	Very low	60 Å²	60	118.7 Å²	118.7	62%	0.619	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-60.7	135.3	177.6	0	0	0	0	0	112.1	L196 M200	L196-G198 PolarHBondContact O-N 2.83Å; G198-M200 PolarHBondContact O-N 3.31Å
199	V	48.2	Very low	48.5	Very low	147 Å²	147	115.4 Å²	115.4	89%	0.891	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67.1	127.6	-179.4	-173.7	0	0	0	0	109.8
200	M	49.8	Very low	48.5	Very low	179 Å²	179	116 Å²	116	88%	0.882	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.8	132.4	179.9	-167	172.1	71.8	0	0	110.8	G198	G198-M200 PolarHBondContact O-N 3.31Å
201	G	45.3	Very low	48.6	Very low	55 Å²	55	115.3 Å²	115.3	57%	0.567	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-64	150.9	-178	0	0	0	0	0	113.6
202	P	44.4	Very low	48.5	Very low	123 Å²	123	115.6 Å²	115.6	80%	0.799	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.9	148.7	178.9	29.1	-35	0	0	0	111.9
203	P	57.3	Low	48.7	Very low	130 Å²	130	121.2 Å²	121.2	84%	0.844	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.4	144.6	175.6	-23.5	34.3	0	0	0	113.2
204	G	43.2	Very low	48.8	Very low	67 Å²	67	121 Å²	121	69%	0.691	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.8	152.3	175.8	0	0	0	0	0	113.4
205	P	43.3	Very low	48.2	Very low	124 Å²	124	122.6 Å²	122.6	81%	0.805	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.2	152.6	-177.6	29.3	-35.5	0	0	0	112.7
206	P	58.8	Low	48.1	Very low	130 Å²	130	126.4 Å²	126.4	84%	0.844	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-62.2	147.3	174.2	-22.1	34	0	0	0	113.4
207	G	44.7	Very low	48.3	Very low	66 Å²	66	127.3 Å²	127.3	68%	0.68	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-71.5	156.7	175.9	0	0	0	0	0	113.8
208	P	43.6	Very low	48.3	Very low	124 Å²	124	126.4 Å²	126.4	81%	0.805	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.8	154.3	-176.8	30.2	-35.8	0	0	0	113.3
209	P	59.8	Low	48.2	Very low	126 Å²	126	131.1 Å²	131.1	82%	0.818	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.3	153.6	172.2	-19.9	33.2	0	0	0	113.5
210	G	45.7	Very low	47.8	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.1	157.3	174.3	0	0	0	0	0	113.7
211	L	48.6	Very low	47.4	Very low	170 Å²	170	130.3 Å²	130.3	89%	0.89	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.4	155	178.7	-78.5	102.1	0	0	0	113.1
212	P	52.3	Low	47	Very low	124 Å²	124	135 Å²	135	81%	0.805	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-78.6	154.3	171.9	-7.1	25.8	0	0	0	112.8
213	E	49.6	Very low	46.7	Very low	189 Å²	189	134.1 Å²	134.1	88%	0.883	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-88	127.7	176.6	-60	176.9	149.9	0	0	111.8
214	N	48.8	Very low	45.8	Very low	138 Å²	138	136.8 Å²	136.8	74%	0.738	80%	0.802	S	S	*	*			trans	-165.9	145.7	149	-104.5	-31.4	0	0	0	112.4
215	Y	39.2	Very low	45.5	Very low	196 Å²	196	137.4 Å²	137.4	77%	0.769	81%	0.808	S	S	*	*			trans	-26.9	145.6	174.1	52.6	-95.2	0	0	0	117.5
216	D	41.4	Very low	45.4	Very low	143 Å²	143	136.4 Å²	136.4	77%	0.765	81%	0.81	S	S	*	*				-138.8	147.4	66.6	-166.7	7.8	0	0	0	114.3
217	E	50.6	Low	44.4	Very low	185 Å²	185	138.7 Å²	138.7	86%	0.864	81%	0.807	S	S	*	*			trans	-127.5	88	-178.7	-171.8	-178.4	152.7	0	0	109.6
218	S	54.6	Low	44	Very low	101 Å²	101	146 Å²	146	71%	0.706	81%	0.814	S	S	*	*			trans	-153.9	84.4	176.3	-85.8	0	0	0	0	112.8
219	L	42.8	Very low	43.7	Very low	159 Å²	159	143.3 Å²	143.3	83%	0.832	81%	0.81	S	S	*	*	S	Bend	trans	-170.7	118.8	137.3	-103.7	165.8	0	0	0	112.1
220	M	40.4	Very low	42.6	Very low	174 Å²	174	144 Å²	144	86%	0.857	81%	0.811	S	S	*	*			trans	73	83.3	161	-59.5	-84.6	165.6	0	0	118.5
221	V	40.7	Very low	42.5	Very low	136 Å²	136	147.1 Å²	147.1	82%	0.824	82%	0.815	S	S	*	*			trans	-57.8	142.6	156.1	169.6	0	0	0	0	111.7
222	N	38.2	Very low	42.2	Very low	153 Å²	153	147.4 Å²	147.4	82%	0.818	81%	0.812	S	S	*	*			trans	-158.8	141.3	144.8	-103.9	-40	0	0	0	113.3
223	S	37.3	Very low	42.1	Very low	104 Å²	104	147.4 Å²	147.4	73%	0.727	81%	0.812	S	S	*	*			trans	56.3	111	169	-68	0	0	0	0	120.7
224	M	38.9	Very low	41.9	Very low	187 Å²	187	142.1 Å²	142.1	92%	0.921	81%	0.808	S	S	*	*			trans	-20.7	140	145.2	-51.9	165.6	-73.5	0	0	115.4
225	G	37.2	Very low	41.6	Very low	80 Å²	80	140.4 Å²	140.4	83%	0.825	81%	0.813	S	S	*	*			cis	135.2	129.7	-6.2	0	0	0	0	0	113.6
226	A	39.5	Very low	42	Very low	103 Å²	103	140.8 Å²	140.8	85%	0.851	82%	0.819	S	S	*	*			trans	-157.8	148.8	166.6	0	0	0	0	0	112.7
227	F	37.6	Very low	42.2	Very low	177 Å²	177	137 Å²	137	78%	0.776	81%	0.814	S	S	*	*			trans	-31.8	125.3	179.4	-91.7	-135.4	0	0	0	116.9
228	R	38	Very low	42	Very low	219 Å²	219	134.7 Å²	134.7	83%	0.826	81%	0.812	S	S	*	*				86.4	120.3	72.3	-86.4	-165.7	177	-168.6	0.2	114.5
229	G	35.8	Very low	41.9	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	82%	0.816	S	S	*	*			trans	103.4	98.3	136.3	0	0	0	0	0	117.8
230	T	37.5	Very low	42.2	Very low	139 Å²	139	131.7 Å²	131.7	85%	0.853	81%	0.813	S	S	*	*				-174.8	147.3	95.5	26.9	0	0	0	0	109.9
231	T	43.3	Very low	42.6	Very low	143 Å²	143	132.6 Å²	132.6	88%	0.877	82%	0.815	S	S	*	*			trans	-85.3	122.8	170.2	38.5	0	0	0	0	109.3
232	Q	42.7	Very low	43	Very low	176 Å²	176	135.9 Å²	135.9	82%	0.822	82%	0.818	S	S	*	*			trans	-123	135	170.5	-104.7	-176.6	1.5	0	0	109.6
233	P	50.3	Low	43.4	Very low	125 Å²	125	131.7 Å²	131.7	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-58.4	140.5	174.4	-24.6	34.8	0	0	0	111.8	A235	P233-A235 PolarHBondContact O-N 2.75Å
234	G	44.6	Very low	43.9	Very low	77 Å²	77	134.5 Å²	134.5	79%	0.794	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-54.2	136.3	178.2	0	0	0	0	0	112.1	K236	G234-K236 PolarHBondContact O-N 3.25Å
235	A	42.8	Very low	44.3	Very low	102 Å²	102	130.3 Å²	130.3	84%	0.843	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-58.5	137.8	-174.1	0	0	0	0	0	111.9	P233 G237	P233-A235 PolarHBondContact O-N 2.75Å; A235-G237 PolarHBondContact O-N 3.29Å
236	K	48.1	Very low	44.7	Very low	204 Å²	204	129.3 Å²	129.3	89%	0.887	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-54.7	123.4	174.2	-179.4	179.8	179	-179.9	0	109.3	G234 V238	G234-K236 PolarHBondContact O-N 3.25Å; K236-V238 PolarHBondContact O-N 2.93Å
237	G	46.1	Very low	45	Very low	64 Å²	64	133.6 Å²	133.6	66%	0.66	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-49.7	133.7	-178.9	0	0	0	0	0	112.1	A235	A235-G237 PolarHBondContact O-N 3.29Å
238	V	45.8	Very low	45.4	Very low	136 Å²	136	135 Å²	135	82%	0.824	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-57.4	139.7	-179.7	-91	0	0	0	0	110.7	K236 G240	K236-V238 PolarHBondContact O-N 2.93Å; V238-G240 PolarHBondContact O-N 3.23Å
239	P	52.4	Low	45.8	Very low	123 Å²	123	127.2 Å²	127.2	80%	0.799	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-54.8	134.5	170	-23	33.7	0	0	0	110.2
240	G	48.3	Very low	46.4	Very low	74 Å²	74	133.2 Å²	133.2	76%	0.763	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-56.3	144.6	177	0	0	0	0	0	111.5	V238	V238-G240 PolarHBondContact O-N 3.23Å
241	E	49.4	Very low	46.8	Very low	194 Å²	194	138.3 Å²	138.3	91%	0.907	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-57.1	143.4	-174.2	-67.1	-170.1	106.2	0	0	112.1	G243	E241-G243 PolarHBondContact O-N 2.79Å
242	K	48.4	Very low	46.8	Very low	205 Å²	205	134.7 Å²	134.7	89%	0.891	80%	0.804	S	S	*	*			trans	-66.7	107.8	177.4	-179.6	-172.8	176.3	-173.8	0	108.3
243	G	48.4	Very low	46.8	Very low	64 Å²	64	133.3 Å²	133.3	66%	0.66	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-49.1	145.2	-179.2	0	0	0	0	0	113.4	E241	E241-G243 PolarHBondContact O-N 2.79Å
244	D	46.3	Very low	46.8	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-51.5	149.5	-168.6	-71.6	-63.2	0	0	0	114.4	G246	D244-G246 PolarHBondContact O-N 3.36Å; D244-G246 VanDerWaalsContact O-N 3.11Å
245	A	47.4	Very low	46.7	Very low	100 Å²	100	132.8 Å²	132.8	83%	0.826	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-60	117.4	171.6	0	0	0	0	0	109.6	Q247	A245-Q247 PolarHBondContact O-N 3.37Å
246	G	46.3	Very low	46.6	Very low	59 Å²	59	136.7 Å²	136.7	61%	0.608	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-50.4	136.9	-178.3	0	0	0	0	0	112	D244 K248	D244-G246 PolarHBondContact O-N 3.36Å; D244-G246 VanDerWaalsContact O-N 3.11Å; G246-K248 PolarHBondContact O-N 2.93Å
247	Q	46	Very low	46.5	Very low	193 Å²	193	136.9 Å²	136.9	90%	0.902	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-54.1	136.2	-171.7	-64.9	-171.8	11.6	0	0	111.4	A245 G249	A245-Q247 PolarHBondContact O-N 3.37Å; Q247-G249 PolarHBondContact O-N 2.62Å; Q247-G249 VanDerWaalsContact O-N 3.11Å
248	K	46.5	Very low	46.4	Very low	205 Å²	205	137.1 Å²	137.1	89%	0.891	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-59.3	117.2	177.1	-179.1	179	-179.7	176.9	0	109	G246	G246-K248 PolarHBondContact O-N 2.93Å
249	G	46.2	Very low	46.2	Very low	57 Å²	57	135.4 Å²	135.4	59%	0.588	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-50.5	143.8	-178.9	0	0	0	0	0	112.7	Q247	Q247-G249 PolarHBondContact O-N 2.62Å; Q247-G249 VanDerWaalsContact O-N 3.11Å
250	E	46.8	Very low	45.9	Very low	195 Å²	195	138.1 Å²	138.1	91%	0.911	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-58.8	148.6	-175.4	-63.7	-170	116.5	0	0	111.7	G252	E250-G252 PolarHBondContact O-N 3.39Å; E250-G252 VanDerWaalsContact O-N 3.1Å
251	R	47.3	Very low	45.6	Very low	245 Å²	245	136.8 Å²	136.8	93%	0.925	79%	0.79	S	S	*	*			trans	-68.9	110.6	175.4	179.2	-171.8	-66	167.4	-0.4	108
252	G	42.8	Very low	45.4	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-50.2	145.2	176.7	0	0	0	0	0	113	E250	E250-G252 PolarHBondContact O-N 3.39Å; E250-G252 VanDerWaalsContact O-N 3.1Å
253	D	42.6	Very low	45.3	Very low	148 Å²	148	129.4 Å²	129.4	79%	0.791	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-56.7	146.5	-169.8	-78.8	-57.8	0	0	0	113.8	G255	D253-G255 PolarHBondContact O-N 3.25Å; D253-G255 VanDerWaalsContact O-N 3.12Å
254	P	49.7	Very low	45.1	Very low	116 Å²	116	129.8 Å²	129.8	75%	0.753	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-56.7	118.1	170.2	-23.2	34	0	0	0	111.2	H256	P254-H256 PolarHBondContact O-N 2.92Å
255	G	42.6	Very low	44.9	Very low	74 Å²	74	126.9 Å²	126.9	76%	0.763	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-51.3	136.4	-176.6	0	0	0	0	0	113.1	D253 K257	D253-G255 PolarHBondContact O-N 3.25Å; D253-G255 VanDerWaalsContact O-N 3.12Å; G255-K257 PolarHBondContact O-N 2.8Å
256	H	41.1	Very low	44.7	Very low	185 Å²	185	131.7 Å²	131.7	86%	0.856	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-56	137.9	-171.4	-54.3	-44.4	0	0	0	112.6	P254 G258	P254-H256 PolarHBondContact O-N 2.92Å; H256-G258 PolarHBondContact O-N 2.85Å; H256-G258 VanDerWaalsContact O-N 3.13Å
257	K	46	Very low	44.6	Very low	208 Å²	208	131.9 Å²	131.9	90%	0.904	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.4	179.4	-163.1	173.9	-169	173.3	0	109.6	G255	G255-K257 PolarHBondContact O-N 2.8Å
258	G	44.5	Very low	44.4	Very low	69 Å²	69	131.4 Å²	131.4	71%	0.711	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-51.7	140.9	-175.6	0	0	0	0	0	112.9	H256	H256-G258 PolarHBondContact O-N 2.85Å; H256-G258 VanDerWaalsContact O-N 3.13Å
259	A	41.9	Very low	44.6	Very low	99 Å²	99	127.7 Å²	127.7	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-55.6	142	-176.5	0	0	0	0	0	111.8	G261	A259-G261 PolarHBondContact O-N 3.2Å
260	H	45.2	Very low	44.4	Very low	181 Å²	181	128.4 Å²	128.4	84%	0.838	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-62.4	128.1	176.1	-166.5	83.4	0	0	0	109.4
261	G	42.5	Very low	44.2	Very low	46 Å²	46	128 Å²	128	47%	0.474	79%	0.789	S	S	.	*	P	Polyproline II helix	trans	-58.7	148.1	179.7	0	0	0	0	0	111.6	A259 S263	A259-G261 PolarHBondContact O-N 3.2Å; G261-S263 PolarHBondContact O-N 3.14Å
262	P	44.2	Very low	44.3	Very low	129 Å²	129	122.3 Å²	122.3	84%	0.838	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-58.6	140.4	176.7	25.9	-34.2	0	0	0	110.1	G264	P262-G264 PolarHBondContact O-N 2.88Å
263	S	46.9	Very low	44.3	Very low	114 Å²	114	122.7 Å²	122.7	80%	0.797	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-56.5	131.2	173.1	-73.8	0	0	0	0	109.9	G261	G261-S263 PolarHBondContact O-N 3.14Å
264	G	43.7	Very low	44.3	Very low	72 Å²	72	121.9 Å²	121.9	74%	0.742	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-56	142.8	-178.5	0	0	0	0	0	111.8	P262 K266	P262-G264 PolarHBondContact O-N 2.88Å; G264-K266 PolarHBondContact O-N 2.98Å
265	A	41.9	Very low	44.3	Very low	102 Å²	102	122.3 Å²	122.3	84%	0.843	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-54.5	133.1	-179.9	0	0	0	0	0	110.8	G267	A265-G267 PolarHBondContact O-N 2.85Å
266	K	45.1	Very low	44.4	Very low	201 Å²	201	122.2 Å²	122.2	87%	0.874	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-59.7	121.1	173.7	-179.2	-177.4	177.7	-176.5	0	108.2	G264	G264-K266 PolarHBondContact O-N 2.98Å
267	G	42.4	Very low	44.5	Very low	64 Å²	64	121.3 Å²	121.3	66%	0.66	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-53.3	139.8	-180	0	0	0	0	0	112.1	A265	A265-G267 PolarHBondContact O-N 2.85Å
268	E	42.9	Very low	44.8	Very low	183 Å²	183	117 Å²	117	86%	0.855	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-62.8	147.4	-177.2	-62.4	-176.7	134.9	0	0	111.2	G270	E268-G270 PolarHBondContact O-N 3.43Å
269	P	49.3	Very low	44.9	Very low	126 Å²	126	117.2 Å²	117.2	82%	0.818	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.2	127.5	171.2	-20	32.5	0	0	0	110.1
270	G	42.5	Very low	45.1	Very low	72 Å²	72	120.4 Å²	120.4	74%	0.742	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-57.8	142	177	0	0	0	0	0	111.9	E268	E268-G270 PolarHBondContact O-N 3.43Å
271	E	43.8	Very low	45.6	Very low	187 Å²	187	117.6 Å²	117.6	87%	0.874	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-55.9	145	-174.4	-64.8	-171.3	127.1	0	0	112.6	G273	E271-G273 PolarHBondContact O-N 3.44Å
272	P	49.2	Very low	45.9	Very low	126 Å²	126	118.8 Å²	118.8	82%	0.818	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-57.2	122.1	171.3	-22.8	33.8	0	0	0	110.8	T274	P272-T274 PolarHBondContact O-N 2.8Å
273	G	42.5	Very low	46.2	Very low	74 Å²	74	122 Å²	122	76%	0.763	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-53.8	136.9	177.8	0	0	0	0	0	111.7	E271	E271-G273 PolarHBondContact O-N 3.44Å
274	T	42.1	Very low	46.5	Very low	131 Å²	131	122.8 Å²	122.8	80%	0.804	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-57.1	144.1	-174.4	44	0	0	0	0	112	P272 G276	P272-T274 PolarHBondContact O-N 2.8Å; T274-G276 PolarHBondContact O-N 3.47Å
275	P	50.1	Low	46.8	Very low	125 Å²	125	122.4 Å²	122.4	81%	0.812	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-55.2	134.1	172	-24.9	34.7	0	0	0	110.8
276	G	43.8	Very low	47.3	Very low	72 Å²	72	126.4 Å²	126.4	74%	0.742	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-58.1	140.4	175.2	0	0	0	0	0	111	T274	T274-G276 PolarHBondContact O-N 3.47Å
277	L	43.8	Very low	47.4	Very low	167 Å²	167	123 Å²	123	87%	0.874	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-53.8	141.6	178.9	-69.9	169.1	0	0	0	110.8	G279	L277-G279 PolarHBondContact O-N 3.06Å
278	P	52.7	Low	47.3	Very low	118 Å²	118	123.5 Å²	123.5	77%	0.766	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-53.2	138.6	170.8	-25.1	34.6	0	0	0	110.9	L280	P278-L280 PolarHBondContact O-N 3.41Å
279	G	45.8	Very low	47.2	Very low	73 Å²	73	118.5 Å²	118.5	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-57.1	138.6	174.4	0	0	0	0	0	110.7	L277	L277-G279 PolarHBondContact O-N 3.06Å
280	L	46.5	Very low	46.6	Very low	166 Å²	166	120 Å²	120	87%	0.869	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-54.7	139.1	179	-69.9	169.8	0	0	0	110.3	P278 G282	P278-L280 PolarHBondContact O-N 3.41Å; L280-G282 PolarHBondContact O-N 3.14Å
281	P	55	Low	46.5	Very low	122 Å²	122	124.4 Å²	124.4	79%	0.792	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-53.3	134.7	173.2	-25.9	34.7	0	0	0	110.9	Q283	P281-Q283 PolarHBondContact O-N 3.15Å
282	G	50.4	Low	46.1	Very low	70 Å²	70	118.5 Å²	118.5	72%	0.722	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-55.6	133.6	176	0	0	0	0	0	110.5	L280 V284	L280-G282 PolarHBondContact O-N 3.14Å; G282-V284 PolarHBondContact O-N 2.81Å
283	Q	49.1	Very low	45.4	Very low	196 Å²	196	120.9 Å²	120.9	92%	0.916	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-58.4	122.7	-174.5	-165.3	172.5	19.8	0	0	109.9	P281 G285	P281-Q283 PolarHBondContact O-N 3.15Å; Q283-G285 PolarHBondContact O-N 3.41Å
284	V	54.5	Low	45.2	Very low	132 Å²	132	121.3 Å²	121.3	80%	0.8	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.2	123.3	179.5	177.9	0	0	0	0	108.4	G282 Q286	G282-V284 PolarHBondContact O-N 2.81Å; V284-Q286 PolarHBondContact O-N 2.76Å
285	G	49.5	Very low	45.1	Very low	63 Å²	63	121.1 Å²	121.1	65%	0.649	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-58.4	133.6	177.1	0	0	0	0	0	110.8	Q283	Q283-G285 PolarHBondContact O-N 3.41Å
286	Q	53.1	Low	44.6	Very low	187 Å²	187	120.3 Å²	120.3	87%	0.874	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.7	179.8	-74.4	179.2	-39.2	0	0	110.6	V284 G288	V284-Q286 PolarHBondContact O-N 2.76Å; Q286-G288 PolarHBondContact O-N 2.73Å
287	P	45.6	Very low	44.6	Very low	128 Å²	128	125.1 Å²	125.1	83%	0.831	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58.2	127.6	167.8	-23.2	34.2	0	0	0	110.2
288	G	40.1	Very low	44.4	Very low	76 Å²	76	120.5 Å²	120.5	78%	0.784	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.2	132.9	175.5	0	0	0	0	0	111.1	Q286	Q286-G288 PolarHBondContact O-N 2.73Å
289	G	41.5	Very low	43.7	Very low	77 Å²	77	121.6 Å²	121.6	79%	0.794	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-72.5	142.8	175.5	0	0	0	0	0	112.6
290	L	37.6	Very low	43.7	Very low	159 Å²	159	127.8 Å²	127.8	83%	0.832	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-101.8	145.4	152.8	-61.2	168.7	0	0	0	105
291	D	39.5	Very low	43.6	Very low	163 Å²	163	123 Å²	123	87%	0.872	81%	0.809	S	S	*	*			cis	-129.4	146	44.3	-65.4	-53.6	0	0	0	116.9
292	G	35.4	Very low	43.1	Very low	64 Å²	64	126.4 Å²	126.4	66%	0.66	81%	0.814	S	S	*	*			trans	38.5	110	146.4	0	0	0	0	0	122.4
293	L	35	Very low	43	Very low	176 Å²	176	132.9 Å²	132.9	92%	0.921	82%	0.823	S	S	*	*				-174.8	142.6	106.3	-98	161.4	0	0	0	114.1
294	A	38.9	Very low	43	Very low	82 Å²	82	126.8 Å²	126.8	68%	0.678	81%	0.812	S	S	*	*			trans	37.5	108.5	154.1	0	0	0	0	0	122.8
295	S	39.9	Very low	42.7	Very low	127 Å²	127	129.8 Å²	129.8	89%	0.888	82%	0.817	S	S	*	*				57.4	96.5	125.9	-54.4	0	0	0	0	122.3
296	A	39.3	Very low	42.6	Very low	108 Å²	108	136.6 Å²	136.6	89%	0.893	83%	0.829	S	S	*	*			trans	-160.9	165.4	143	0	0	0	0	0	112
297	N	43.3	Very low	42.4	Very low	173 Å²	173	130.8 Å²	130.8	93%	0.925	82%	0.82	S	S	*	*			trans	-96.5	147.8	-179.6	-92.6	-39.2	0	0	0	113.4
298	G	40.1	Very low	42.6	Very low	71 Å²	71	133.5 Å²	133.5	73%	0.732	82%	0.821	S	S	*	*			trans	90.2	150.7	167.3	0	0	0	0	0	114.7
299	T	38.1	Very low	42.9	Very low	140 Å²	140	139.6 Å²	139.6	86%	0.859	83%	0.826	S	S	*	*			cis	-137	161.6	-0.7	50.9	0	0	0	0	111.1	G301	T299-G301 PolarHBondContact O-N 3.29Å; T299-G301 VanDerWaalsContact O-N 3.16Å
300	K	44.9	Very low	43.1	Very low	203 Å²	203	139.3 Å²	139.3	88%	0.883	82%	0.823	S	S	*	*			trans	-67.9	109.6	177.4	178.7	-177.1	178.4	-178.4	0	110.1
301	G	44.7	Very low	43.3	Very low	67 Å²	67	140.1 Å²	140.1	69%	0.691	83%	0.825	S	S	*	*			trans	-57.1	139.2	173.9	0	0	0	0	0	112.2	T299	T299-G301 PolarHBondContact O-N 3.29Å; T299-G301 VanDerWaalsContact O-N 3.16Å
302	E	45.1	Very low	43.6	Very low	193 Å²	193	143.9 Å²	143.9	90%	0.902	83%	0.827	S	S	*	*			trans	-71.8	153.8	-177.1	-65.8	-166.5	112.3	0	0	112.5	G304	E302-G304 PolarHBondContact O-N 3.3Å; E302-G304 VanDerWaalsContact O-N 3.15Å
303	K	48.7	Very low	44.1	Very low	206 Å²	206	144 Å²	144	90%	0.896	83%	0.827	S	S	*	*			trans	-74.2	106.3	177.6	-177.6	-177.2	-177.9	177.9	0	108.6	E305	K303-E305 PolarHBondContact O-N 3.49Å
304	G	48.1	Very low	44.6	Very low	67 Å²	67	147.4 Å²	147.4	69%	0.691	83%	0.828	S	S	*	*			trans	-45.3	137.4	-179.6	0	0	0	0	0	113.2	E302	E302-G304 PolarHBondContact O-N 3.3Å; E302-G304 VanDerWaalsContact O-N 3.15Å
305	E	47.9	Very low	44.8	Very low	195 Å²	195	155 Å²	155	91%	0.911	84%	0.839	S	S	*	*			trans	-59.9	145.7	-168.6	-67.6	-165.7	110	0	0	113	K303 G307	K303-E305 PolarHBondContact O-N 3.49Å; E305-G307 PolarHBondContact O-N 3.43Å
306	K	48.7	Very low	45.1	Very low	206 Å²	206	152 Å²	152	90%	0.896	83%	0.829	S	S	*	*			trans	-73	99.3	175.5	-176.9	-177.6	-178.2	178.6	0	108.6
307	G	48.7	Very low	45.3	Very low	66 Å²	66	150.4 Å²	150.4	68%	0.68	82%	0.822	S	S	*	*			trans	-42.4	137.1	-178.5	0	0	0	0	0	113.6	E305	E305-G307 PolarHBondContact O-N 3.43Å
308	E	49.1	Very low	45.3	Very low	184 Å²	184	149.1 Å²	149.1	86%	0.86	82%	0.821	S	S	*	*			trans	-54.9	140.4	-167.1	-71.3	-161.1	110.9	0	0	113.3	G310	E308-G310 PolarHBondContact O-N 2.91Å
309	K	46.5	Very low	45.6	Very low	205 Å²	205	148.9 Å²	148.9	89%	0.891	82%	0.818	S	S	*	*			trans	-71.9	95.8	175.5	-172.8	-179.8	-175.5	178.3	0	109	M311	K309-M311 PolarHBondContact O-N 2.88Å
310	G	45.9	Very low	45.9	Very low	70 Å²	70	147 Å²	147	72%	0.722	82%	0.817	S	S	*	*			trans	-38.4	125.1	-177.3	0	0	0	0	0	113.3	E308 R312	E308-G310 PolarHBondContact O-N 2.91Å; G310-R312 PolarHBondContact O-N 3.48Å
311	M	42.4	Very low	45.8	Very low	177 Å²	177	144 Å²	144	87%	0.872	82%	0.816	S	S	*	*			trans	-58.8	132.6	-171	-65.2	-168.8	-176.2	0	0	111	K309 G313	K309-M311 PolarHBondContact O-N 2.88Å; M311-G313 PolarHBondContact O-N 3.12Å
312	R	45	Very low	45.7	Very low	242 Å²	242	143.3 Å²	143.3	91%	0.913	81%	0.809	S	S	*	*			trans	-58.5	114.7	170.6	173.9	179.1	-78.1	166	-6.6	108.1	G310 R314	G310-R312 PolarHBondContact O-N 3.48Å; R312-R314 PolarHBondContact O-N 3.37Å
313	G	45.8	Very low	45.5	Very low	65 Å²	65	140.2 Å²	140.2	67%	0.67	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-49.2	135.8	179	0	0	0	0	0	111.4	M311 R315	M311-G313 PolarHBondContact O-N 3.12Å; G313-R315 PolarHBondContact O-N 3.4Å
314	R	45.9	Very low	45.3	Very low	249 Å²	249	138.4 Å²	138.4	94%	0.94	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-55.6	131	177.4	-83	-174.1	169.2	-165.7	-2.6	108.9	R312 G316	R312-R314 PolarHBondContact O-N 3.37Å; R314-G316 PolarHBondContact O-N 2.89Å
315	R	43.4	Very low	44.9	Very low	240 Å²	240	137.7 Å²	137.7	91%	0.906	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-51.9	125.7	166.1	179.2	-176.9	-70	171.1	-2.8	107.4	G313 G317	G313-R315 PolarHBondContact O-N 3.4Å; R315-G317 PolarHBondContact O-N 3.39Å
316	G	45.7	Very low	44.6	Very low	66 Å²	66	133.9 Å²	133.9	68%	0.68	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-52.1	131.4	175.6	0	0	0	0	0	109.9	R314	R314-G316 PolarHBondContact O-N 2.89Å
317	G	43.6	Very low	44.6	Very low	73 Å²	73	130 Å²	130	75%	0.753	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-61.5	144.8	175.1	0	0	0	0	0	109.8	R315 G319	R315-G317 PolarHBondContact O-N 3.39Å; G317-G319 PolarHBondContact O-N 2.74Å; G317-G319 VanDerWaalsContact O-N 3.11Å
318	T	44	Very low	44.2	Very low	147 Å²	147	130.4 Å²	130.4	90%	0.902	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-51.7	121.9	172.2	-49.5	0	0	0	0	108.6	A320	T318-A320 PolarHBondContact O-N 2.86Å
319	G	45.8	Very low	43.7	Very low	65 Å²	65	131 Å²	131	67%	0.67	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-53.4	133.6	179.2	0	0	0	0	0	110.2	G317 T321	G317-G319 PolarHBondContact O-N 2.74Å; G317-G319 VanDerWaalsContact O-N 3.11Å; G319-T321 PolarHBondContact O-N 3.03Å
320	A	43.4	Very low	43.8	Very low	101 Å²	101	127.2 Å²	127.2	84%	0.835	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-54.3	134.4	-178.4	0	0	0	0	0	110	T318 G322	T318-A320 PolarHBondContact O-N 2.86Å; A320-G322 PolarHBondContact O-N 3.18Å; A320-G322 VanDerWaalsContact O-N 3.09Å
321	T	44.4	Very low	43.5	Very low	139 Å²	139	126.8 Å²	126.8	85%	0.853	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-52.3	120.8	175.1	-52.7	0	0	0	0	108.6	G319	G319-T321 PolarHBondContact O-N 3.03Å
322	G	41.8	Very low	43.5	Very low	53 Å²	53	124.5 Å²	124.5	55%	0.546	78%	0.779	S	S	.	*	P	Polyproline II helix	trans	-54.2	140.9	-179.3	0	0	0	0	0	110.3	A320 I324	A320-G322 PolarHBondContact O-N 3.18Å; A320-G322 VanDerWaalsContact O-N 3.09Å; G322-I324 PolarHBondContact O-N 2.85Å
323	P	41.2	Very low	43.3	Very low	128 Å²	128	120.7 Å²	120.7	83%	0.831	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-56.4	135.1	-179.1	24.6	-34	0	0	0	109.4	G325	P323-G325 PolarHBondContact O-N 2.84Å; P323-G325 VanDerWaalsContact O-N 3.14Å
324	I	45.1	Very low	43.2	Very low	169 Å²	169	120.5 Å²	120.5	87%	0.867	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-53.5	124.2	174.2	-62.3	175.7	0	0	0	107.2	G322	G322-I324 PolarHBondContact O-N 2.85Å
325	G	39.6	Very low	42.9	Very low	51 Å²	51	115.8 Å²	115.8	53%	0.526	77%	0.765	S	S	.	*	P	Polyproline II helix	trans	-55.1	137.6	-178.9	0	0	0	0	0	110.1	P323	P323-G325 PolarHBondContact O-N 2.84Å; P323-G325 VanDerWaalsContact O-N 3.14Å
326	P	40	Very low	42.8	Very low	115 Å²	115	111 Å²	111	75%	0.747	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-56	139	179.8	24.8	-34	0	0	0	109.1	G328	P326-G328 PolarHBondContact O-N 3.44Å
327	P	49.3	Very low	42.5	Very low	125 Å²	125	111.2 Å²	111.2	81%	0.812	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-48.4	129.3	176.8	-28.8	35.4	0	0	0	110.3	K329	P327-K329 PolarHBondContact O-N 3.02Å; P327-K329 VanDerWaalsContact O-N 3.14Å
328	G	40.6	Very low	42.3	Very low	74 Å²	74	116 Å²	116	76%	0.763	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-51	124.7	-179	0	0	0	0	0	109.5	P326	P326-G328 PolarHBondContact O-N 3.44Å
329	K	38.4	Very low	42.3	Very low	198 Å²	198	114.2 Å²	114.2	86%	0.861	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-48.3	134.5	-177.9	-69.5	-178.9	178.9	178	0	108.7	P327 G331	P327-K329 PolarHBondContact O-N 3.02Å; P327-K329 VanDerWaalsContact O-N 3.14Å; K329-G331 PolarHBondContact O-N 2.7Å
330	P	48.1	Very low	42	Very low	125 Å²	125	114.6 Å²	114.6	81%	0.812	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-47.8	129.5	168.8	-26.6	34.8	0	0	0	108.8
331	G	40.1	Very low	41.7	Very low	61 Å²	61	121.2 Å²	121.2	63%	0.629	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-54	143.8	176	0	0	0	0	0	109.2	K329 M333	K329-G331 PolarHBondContact O-N 2.7Å; G331-M333 PolarHBondContact O-N 3.11Å
332	P	43.3	Very low	42.1	Very low	129 Å²	129	120.2 Å²	120.2	84%	0.838	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-52.8	135	177.7	24.1	-33.6	0	0	0	108.9	G334	P332-G334 PolarHBondContact O-N 3.46Å; P332-G334 VanDerWaalsContact O-N 3.11Å
333	M	40.8	Very low	41.9	Very low	161 Å²	161	121 Å²	121	79%	0.793	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-53.8	121.4	173	178.4	173.1	175.3	0	0	107.6	G331 D335	G331-M333 PolarHBondContact O-N 3.11Å; M333-D335 PolarHBondContact O-N 3.08Å
334	G	42.6	Very low	41.7	Very low	62 Å²	62	124.1 Å²	124.1	64%	0.639	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-54.9	133.7	-177.5	0	0	0	0	0	110.2	P332 I336	P332-G334 PolarHBondContact O-N 3.46Å; P332-G334 VanDerWaalsContact O-N 3.11Å; G334-I336 PolarHBondContact O-N 3.27Å
335	D	40.6	Very low	42	Very low	150 Å²	150	122.6 Å²	122.6	80%	0.802	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-50.9	131.9	-173.8	-63.4	-63.8	0	0	0	110.8	M333 G337	M333-D335 PolarHBondContact O-N 3.08Å; D335-G337 PolarHBondContact O-N 2.86Å
336	I	41.3	Very low	42	Very low	138 Å²	138	123 Å²	123	71%	0.708	77%	0.774	S	S	*	*			trans	-60.3	109.3	179.3	-65.1	169.8	0	0	0	107.7	G334 H338	G334-I336 PolarHBondContact O-N 3.27Å; I336-H338 PolarHBondContact O-N 2.97Å
337	G	39.6	Very low	42.1	Very low	71 Å²	71	124.4 Å²	124.4	73%	0.732	78%	0.783	S	S	*	*			trans	-49.2	112.9	-174.6	0	0	0	0	0	110.9	D335 S339	D335-G337 PolarHBondContact O-N 2.86Å; G337-S339 PolarHBondContact O-N 2.82Å
338	H	38.2	Very low	42.1	Very low	175 Å²	175	128.4 Å²	128.4	81%	0.81	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-58.4	127.9	-169.6	-59.6	-46.6	0	0	0	110.9	I336 G340	I336-H338 PolarHBondContact O-N 2.97Å; H338-G340 PolarHBondContact O-N 2.95Å
339	S	43.7	Very low	42	Very low	109 Å²	109	128.3 Å²	128.3	76%	0.762	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-53.2	127.7	167.1	52.4	0	0	0	0	109.5	G337 R341	G337-S339 PolarHBondContact O-N 2.82Å; S339-R341 PolarHBondContact O-N 2.94Å
340	G	40	Very low	42.4	Very low	73 Å²	73	128.7 Å²	128.7	75%	0.753	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-49	130.6	-177.5	0	0	0	0	0	111.9	H338 P342	H338-G340 PolarHBondContact O-N 2.95Å; G340-P342 WeakPolarHBondContact O-CD 3.25Å
341	R	36.1	Very low	42.2	Very low	240 Å²	240	131.6 Å²	131.6	91%	0.906	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-60.2	128.4	-172.4	-69.6	-176.8	174.9	-164.7	-1.3	111.1	S339	S339-R341 PolarHBondContact O-N 2.94Å
342	P	52.8	Low	42.2	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-56.8	158.3	157.7	-22.9	34.9	0	0	0	111.3	G340	G340-P342 WeakPolarHBondContact O-CD 3.25Å
343	G	39.1	Very low	42.3	Very low	70 Å²	70	132 Å²	132	72%	0.722	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-56.1	148	-177	0	0	0	0	0	113.9	T345	G343-T345 PolarHBondContact O-N 2.93Å
344	M	36.7	Very low	42.9	Very low	193 Å²	193	134.5 Å²	134.5	95%	0.951	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-60.2	122.8	-175.1	-71.1	168.9	57.8	0	0	112.3
345	T	50.8	Low	43	Very low	138 Å²	138	134.6 Å²	134.6	85%	0.847	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-93.3	145.4	161.3	-55	0	0	0	0	108.9	G343	G343-T345 PolarHBondContact O-N 2.93Å
346	G	39.3	Very low	43.2	Very low	60 Å²	60	134 Å²	134	62%	0.619	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-61.2	156.3	-169.9	0	0	0	0	0	115.2	K348	G346-K348 PolarHBondContact O-N 3.18Å
347	P	43.9	Very low	43.3	Very low	143 Å²	143	135.6 Å²	135.6	93%	0.929	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-66.5	131.5	-174.2	27.8	-35	0	0	0	112
348	K	48.1	Very low	43.4	Very low	209 Å²	209	135.5 Å²	135.5	91%	0.909	81%	0.812	S	S	*	*			trans	-110.5	138.3	167.9	-167.1	168.7	-178.1	175.4	0	108.8	G346	G346-K348 PolarHBondContact O-N 3.18Å
349	G	39	Very low	43.7	Very low	72 Å²	72	133 Å²	133	74%	0.742	81%	0.805	S	S	*	*			trans	-61.6	158.8	-158.9	0	0	0	0	0	116.9
350	E	46.1	Very low	43.4	Very low	207 Å²	207	134 Å²	134	97%	0.967	81%	0.812	S	S	*	*			trans	-61.7	144.4	178.5	-56.9	-178.8	140.9	0	0	112
351	M	44.7	Very low	43.1	Very low	185 Å²	185	134.4 Å²	134.4	91%	0.911	82%	0.815	S	S	*	*			trans	-127.6	132.1	172.1	-173.2	156.5	56	0	0	109.2
352	G	40.5	Very low	43.3	Very low	63 Å²	63	127 Å²	127	65%	0.649	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.4	163.4	-157.6	0	0	0	0	0	116.8	K354	G352-K354 PolarHBondContact O-N 2.96Å
353	P	44.9	Very low	42.6	Very low	137 Å²	137	132.9 Å²	132.9	89%	0.89	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-67.8	129.6	-175.1	28.1	-35.2	0	0	0	112.3
354	K	53.2	Low	42.8	Very low	213 Å²	213	137.7 Å²	137.7	93%	0.926	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.1	135.1	169	-162.7	169.5	-176.4	176.1	0	109.7	G352	G352-K354 PolarHBondContact O-N 2.96Å
355	G	44	Very low	43	Very low	64 Å²	64	132.3 Å²	132.3	66%	0.66	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-66.9	171.6	-162.9	0	0	0	0	0	117.3
356	P	44.2	Very low	43	Very low	138 Å²	138	133.6 Å²	133.6	90%	0.896	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.6	160.4	-170.4	28.5	-35.9	0	0	0	114.8
357	K	43.9	Very low	43.1	Very low	171 Å²	171	140.9 Å²	140.9	74%	0.743	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-65.2	139	-179.9	178	-170.2	171	-120.2	0	112.4	D359	K357-D359 IonicContact NZ-OD1 2.77Å; K357-D359 PolarHBondContact NZ-OD1 3.37Å
358	G	42.7	Very low	43	Very low	68 Å²	68	137.2 Å²	137.2	70%	0.701	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-82.3	141.4	165.7	0	0	0	0	0	112.7
359	D	43	Very low	43.1	Very low	124 Å²	124	135.7 Å²	135.7	66%	0.663	82%	0.824	S	S	*	*			trans	-106.8	179.2	176.5	-80	-37.9	0	0	0	112.5	K357	K357-D359 IonicContact NZ-OD1 2.77Å; K357-D359 PolarHBondContact NZ-OD1 3.37Å
360	S	38.3	Very low	43.7	Very low	130 Å²	130	141.9 Å²	141.9	91%	0.909	83%	0.83	S	S	*	*			trans	73.1	144.3	-172.1	79.1	0	0	0	0	114.9
361	G	34.7	Very low	43.5	Very low	80 Å²	80	135.3 Å²	135.3	83%	0.825	82%	0.818	S	S	*	*			cis	-179.8	161.4	-7	0	0	0	0	0	111
362	G	38.7	Very low	43.7	Very low	84 Å²	84	134.5 Å²	134.5	87%	0.866	82%	0.817	S	S	*	*			trans	176.5	148.8	179.5	0	0	0	0	0	113.2
363	R	39	Very low	44.2	Very low	242 Å²	242	141 Å²	141	91%	0.913	82%	0.822	S	S	*	*			trans	-108.6	173.9	-175.4	-140.4	173.3	-179.6	160.9	-1.1	111.5
364	E	42.4	Very low	44.2	Very low	170 Å²	170	137.3 Å²	137.3	79%	0.794	81%	0.809	S	S	*	*			trans	-58.1	150.1	-171.3	-63.7	155.5	97	0	0	115.4
365	G	40.7	Very low	43.9	Very low	80 Å²	80	136.6 Å²	136.6	83%	0.825	81%	0.809	S	S	*	*			trans	-145	101.1	159.1	0	0	0	0	0	110
366	L	51.2	Low	44.5	Very low	166 Å²	166	139 Å²	139	87%	0.869	81%	0.807	S	S	*	*			trans	-84.1	125.5	173.7	-73.3	170.1	0	0	0	110.2
367	K	42.4	Very low	44.4	Very low	213 Å²	213	135.7 Å²	135.7	93%	0.926	80%	0.798	S	S	*	*			trans	175.4	134.3	136.8	-175.6	167.7	-173.9	177	0	112.1
368	G	41.2	Very low	44.6	Very low	65 Å²	65	139.3 Å²	139.3	67%	0.67	81%	0.807	S	S	*	*			trans	118.9	93.1	155	0	0	0	0	0	115.1	K370	G368-K370 PolarHBondContact O-N 3.41Å
369	D	50.6	Low	45.3	Very low	177 Å²	177	143.8 Å²	143.8	95%	0.947	82%	0.815	S	S	*	*			trans	-64.7	114.7	164.9	-60.5	-60.3	0	0	0	109.4
370	K	50.4	Low	45.2	Very low	203 Å²	203	141.2 Å²	141.2	88%	0.883	82%	0.817	S	S	*	*			trans	-90.8	114.6	176.1	-172.3	173.9	-177.7	177.1	0	108.2	G368	G368-K370 PolarHBondContact O-N 3.41Å
371	G	43.8	Very low	45.7	Very low	68 Å²	68	143 Å²	143	70%	0.701	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-54.6	153.5	-174.4	0	0	0	0	0	114.3	R373	G371-R373 PolarHBondContact O-N 2.81Å
372	D	48.1	Very low	46.7	Very low	168 Å²	168	145 Å²	145	90%	0.898	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-52.4	130.5	-169.9	-64.9	-62.8	0	0	0	113.3	G374	D372-G374 PolarHBondContact O-N 3.4Å
373	R	50.8	Low	47	Very low	199 Å²	199	144 Å²	144	75%	0.751	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.6	119.1	168	175.8	175.7	173.4	161.8	-1.8	108	G371 D376	G371-R373 PolarHBondContact O-N 2.81Å; R373-D376 IonicContact CZ-OD1 3.73Å; R373-D376 IonicContact CZ-OD2 2.93Å; R373-D376 IonicContact NE-OD1 2.72Å; R373-D376 PolarHBondContact NE-OD1 3.4Å; R373-D376 IonicContact NE-OD2 3.37Å; R373-D376 PolarHBondContact NE-OD2 3.38Å; R373-D376 IonicContact NH2-OD1 3.03Å; R373-D376 PolarHBondContact NH2-OD1 3.48Å; R373-D376 IonicContact NH2-OD2 3.21Å; R373-D376 PolarHBondContact NH2-OD2 2.97Å
374	G	44.3	Very low	47.3	Very low	61 Å²	61	138.2 Å²	138.2	63%	0.629	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-53.6	145.3	172	0	0	0	0	0	111.3	D372 D376	D372-G374 PolarHBondContact O-N 3.4Å; G374-D376 PolarHBondContact O-N 2.92Å
375	Q	47.7	Very low	47.8	Very low	198 Å²	198	136.3 Å²	136.3	93%	0.925	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-57.6	127.5	-176.2	-66.5	-180	4.6	0	0	110.6
376	D	56.3	Low	47.7	Very low	113 Å²	113	136.1 Å²	136.1	60%	0.604	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-60.7	141.1	173	-62.5	-54.5	0	0	0	109.6	R373 G374	R373-D376 IonicContact CZ-OD1 3.73Å; R373-D376 IonicContact CZ-OD2 2.93Å; R373-D376 IonicContact NE-OD1 2.72Å; R373-D376 PolarHBondContact NE-OD1 3.4Å; R373-D376 IonicContact NE-OD2 3.37Å; R373-D376 PolarHBondContact NE-OD2 3.38Å; R373-D376 IonicContact NH2-OD1 3.03Å; R373-D376 PolarHBondContact NH2-OD1 3.48Å; R373-D376 IonicContact NH2-OD2 3.21Å; R373-D376 PolarHBondContact NH2-OD2 2.97Å; G374-D376 PolarHBondContact O-N 2.92Å
377	G	42.8	Very low	47.3	Very low	69 Å²	69	136.3 Å²	136.3	71%	0.711	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-62.3	147.3	-175.8	0	0	0	0	0	112.3	D379	G377-D379 PolarHBondContact O-N 3.27Å
378	R	48.7	Very low	47.4	Very low	248 Å²	248	131.9 Å²	131.9	94%	0.936	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-63.7	134.2	175.9	-65.2	-177.3	-179.3	-176	-0	110.3
379	D	57.5	Low	47.3	Very low	161 Å²	161	134.5 Å²	134.5	86%	0.861	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-55.6	142.6	174.1	-63.3	-57.5	0	0	0	111.7	G377	G377-D379 PolarHBondContact O-N 3.27Å
380	G	40.3	Very low	46.7	Very low	70 Å²	70	132.9 Å²	132.9	72%	0.722	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-66.1	144.5	176.4	0	0	0	0	0	111.9
381	L	48.1	Very low	46.5	Very low	168 Å²	168	127.2 Å²	127.2	88%	0.88	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59.9	134.6	174.5	-68.6	172.4	0	0	0	110.3	G383	L381-G383 PolarHBondContact O-N 3.1Å
382	P	55.5	Low	46.1	Very low	122 Å²	122	127.6 Å²	127.6	79%	0.792	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-55.3	138.2	172.3	-26.2	35.1	0	0	0	111.7
383	G	44.7	Very low	45.9	Very low	62 Å²	62	122.7 Å²	122.7	64%	0.639	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.6	152.2	177.1	0	0	0	0	0	112.4	L381	L381-G383 PolarHBondContact O-N 3.1Å
384	P	45.8	Very low	45.5	Very low	122 Å²	122	121.1 Å²	121.1	79%	0.792	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62.7	144	177.7	27.3	-34.7	0	0	0	111.1
385	P	54.1	Low	45.6	Very low	129 Å²	129	121.8 Å²	121.8	84%	0.838	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-56.1	141.8	172.7	-25.4	35	0	0	0	112.3
386	G	38.3	Very low	44.9	Very low	77 Å²	77	119.3 Å²	119.3	79%	0.794	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.3	144.5	177.6	0	0	0	0	0	112.6
387	L	42.3	Very low	44.1	Very low	169 Å²	169	118.7 Å²	118.7	89%	0.885	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-64.3	143	171.9	-76.6	144.5	0	0	0	110.7
388	P	45.1	Very low	43.9	Very low	121 Å²	121	119.2 Å²	119.2	79%	0.786	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.5	135.9	176.3	28.1	-34.2	0	0	0	111.1
389	S	39	Very low	43.6	Very low	120 Å²	120	111.2 Å²	111.2	84%	0.839	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.3	128.3	-177.9	52.7	0	0	0	0	112.6
390	T	37.3	Very low	42.6	Very low	142 Å²	142	110.2 Å²	110.2	87%	0.871	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.1	118.4	170.9	49.4	0	0	0	0	112.4
391	G	46.3	Very low	42.8	Very low	84 Å²	84	115.2 Å²	115.2	87%	0.866	81%	0.805	S	S	*	*			trans	96.1	152.5	150.1	0	0	0	0	0	118.9
392	G	35.5	Very low	42.2	Very low	77 Å²	77	117.3 Å²	117.3	79%	0.794	80%	0.802	S	S	*	*			trans	117.9	126.6	-179.5	0	0	0	0	0	111.9
393	G	43.5	Very low	41.9	Very low	65 Å²	65	117.7 Å²	117.7	67%	0.67	80%	0.796	S	S	*	*			cis	74.2	136.9	4.7	0	0	0	0	0	113.1
394	D	42.8	Very low	41.8	Very low	166 Å²	166	120 Å²	120	89%	0.888	80%	0.801	S	S	*	*			cis	-159	-164	-6.6	-102.9	-58.7	0	0	0	107.5
395	G	45.3	Very low	41.8	Very low	74 Å²	74	121.9 Å²	121.9	76%	0.763	80%	0.801	S	S	*	*			trans	-64	136	149.4	0	0	0	0	0	108.7
396	D	33.9	Very low	41.8	Very low	147 Å²	147	121.7 Å²	121.7	79%	0.786	80%	0.799	S	S	*	*			cis	-157.2	168	48.5	177.8	46.6	0	0	0	113.5
397	S	39.3	Very low	42.3	Very low	99 Å²	99	121 Å²	121	69%	0.692	79%	0.792	S	S	*	*			trans	63.2	134.8	155.9	-80.5	0	0	0	0	122.5
398	G	39.3	Very low	42.5	Very low	81 Å²	81	118.8 Å²	118.8	84%	0.835	79%	0.788	S	S	*	*			trans	82.4	96.3	135.1	0	0	0	0	0	118.8
399	G	41.8	Very low	43	Very low	80 Å²	80	119.1 Å²	119.1	83%	0.825	79%	0.79	S	S	*	*			trans	-86.9	141.1	175.2	0	0	0	0	0	115.1
400	V	35.8	Very low	43.3	Very low	140 Å²	140	116.4 Å²	116.4	85%	0.848	78%	0.781	S	S	*	*			trans	-137.6	137.4	161.6	-179.6	0	0	0	0	108.2
401	Q	44.5	Very low	43.8	Very low	175 Å²	175	115.4 Å²	115.4	82%	0.818	78%	0.777	S	S	*	*			trans	-73.8	137.1	172.6	-75.8	-171.4	-14.2	0	0	111.1
402	Y	36.9	Very low	44.2	Very low	211 Å²	211	117.5 Å²	117.5	83%	0.827	78%	0.775	S	S	*	*			trans	-114.3	122.2	165.7	-148.5	-88.3	0	0	0	110.4
403	I	48.2	Very low	44.7	Very low	130 Å²	130	116.8 Å²	116.8	67%	0.667	77%	0.768	S	S	*	*			trans	-90.6	117.9	176.9	-60.1	170.2	0	0	0	107.5	M405	I403-M405 PolarHBondContact O-N 2.9Å
404	P	42.9	Very low	44.9	Very low	112 Å²	112	119.5 Å²	119.5	73%	0.727	77%	0.774	S	S	*	*			trans	-71.7	103.8	177.2	28.6	-32.9	0	0	0	109.9
405	M	45	Very low	45.5	Very low	161 Å²	161	117.7 Å²	117.7	79%	0.793	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-64.1	136	169.4	-73.2	-167.9	-72.5	0	0	110.1	I403 G407	I403-M405 PolarHBondContact O-N 2.9Å; M405-G407 PolarHBondContact O-N 2.95Å
406	P	54	Low	45.5	Very low	125 Å²	125	117.6 Å²	117.6	81%	0.812	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-56.9	137.6	168.3	-23.7	34.3	0	0	0	111
407	G	48.8	Very low	46.2	Very low	62 Å²	62	118.7 Å²	118.7	64%	0.639	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-60.8	152.1	173.1	0	0	0	0	0	111.7	M405	M405-G407 PolarHBondContact O-N 2.95Å
408	P	48.1	Very low	46.7	Very low	123 Å²	123	119.6 Å²	119.6	80%	0.799	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-59.5	144.2	180	25.6	-34.4	0	0	0	110.9	G410	P408-G410 PolarHBondContact O-N 2.97Å
409	P	55.9	Low	46.7	Very low	128 Å²	128	119 Å²	119	83%	0.831	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-53.7	136.6	177.4	-26.9	35.1	0	0	0	112.1
410	G	45.3	Very low	46.7	Very low	63 Å²	63	123.4 Å²	123.4	65%	0.649	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-58.5	147.9	174.8	0	0	0	0	0	111.5	P408	P408-G410 PolarHBondContact O-N 2.97Å
411	P	46	Very low	47	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.5	145.1	-178.5	25.5	-34.5	0	0	0	110.9	G413	P411-G413 PolarHBondContact O-N 3.32Å
412	P	56.3	Low	46.9	Very low	128 Å²	128	121.2 Å²	121.2	83%	0.831	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-53.2	134.4	178.2	-27.2	35.1	0	0	0	112.1
413	G	44.3	Very low	47.1	Very low	63 Å²	63	116.3 Å²	116.3	65%	0.649	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-59	147.8	175.2	0	0	0	0	0	111.5	P411	P411-G413 PolarHBondContact O-N 3.32Å
414	P	47.8	Very low	47	Very low	122 Å²	122	113.1 Å²	113.1	79%	0.792	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-59.4	144	-179	25.3	-34.3	0	0	0	110.9	G416	P414-G416 PolarHBondContact O-N 3.3Å
415	P	56.5	Low	47.3	Very low	128 Å²	128	114 Å²	114	83%	0.831	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-53.3	135.1	-180	-27.9	35.4	0	0	0	112.6
416	G	44.1	Very low	47.1	Very low	72 Å²	72	115.6 Å²	115.6	74%	0.742	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-59.5	139.3	177	0	0	0	0	0	111.7	P414	P414-G416 PolarHBondContact O-N 3.3Å
417	L	48.9	Very low	46.5	Very low	169 Å²	169	113 Å²	113	89%	0.885	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-56.1	133.2	177.8	-72	167.5	0	0	0	110.6	G419	L417-G419 PolarHBondContact O-N 3.5Å
418	P	49.3	Very low	46.1	Very low	119 Å²	119	118.9 Å²	118.9	77%	0.773	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-55.6	131.2	177.3	-27.1	35.3	0	0	0	112.1	L420	P418-L420 PolarHBondContact O-N 3.18Å
419	G	40.3	Very low	45.7	Very low	69 Å²	69	119 Å²	119	71%	0.711	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-64.6	128.9	178.9	0	0	0	0	0	111.7	L417 S421	L417-G419 PolarHBondContact O-N 3.5Å; G419-S421 PolarHBondContact O-N 3.24Å
420	L	42.3	Very low	44.7	Very low	171 Å²	171	116.6 Å²	116.6	90%	0.895	78%	0.782	S	S	*	*			trans	-71.1	87.5	175.1	-78.4	166.6	0	0	0	110.8	P418 I422	P418-L420 PolarHBondContact O-N 3.18Å; L420-I422 PolarHBondContact O-N 2.91Å
421	S	40.8	Very low	44.3	Very low	108 Å²	108	120.4 Å²	120.4	76%	0.755	79%	0.792	S	S	*	*			trans	-72	91.2	170.3	44.1	0	0	0	0	110.7	G419 S423	G419-S421 PolarHBondContact O-N 3.24Å; S421-S423 VanDerWaalsContact C-N 3.33Å; S421-S423 PolarHBondContact O-N 3.01Å
422	I	42.3	Very low	43.6	Very low	162 Å²	162	122.1 Å²	122.1	83%	0.831	80%	0.795	S	S	*	*			trans	-69.6	95.4	164.5	-58.8	178.9	0	0	0	107.7	L420 G424	L420-I422 PolarHBondContact O-N 2.91Å; I422-G424 PolarHBondContact O-N 2.96Å
423	S	41.3	Very low	42.6	Very low	107 Å²	107	121 Å²	121	75%	0.748	79%	0.791	S	S	*	*			trans	-65.2	115.4	167.8	38.3	0	0	0	0	109.4	S421	S421-S423 VanDerWaalsContact C-N 3.33Å; S421-S423 PolarHBondContact O-N 3.01Å
424	G	47.4	Very low	42.1	Very low	63 Å²	63	129.8 Å²	129.8	65%	0.649	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-61.5	133.5	171.9	0	0	0	0	0	110.2	I422 K426	I422-G424 PolarHBondContact O-N 2.96Å; G424-K426 PolarHBondContact O-N 3.2Å
425	P	49.6	Very low	41.5	Very low	132 Å²	132	128.8 Å²	128.8	86%	0.857	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.2	131.4	179.5	24.5	-32.9	0	0	0	110.7	G427	P425-G427 PolarHBondContact O-N 2.84Å
426	K	40.7	Very low	40.5	Very low	194 Å²	194	127.7 Å²	127.7	84%	0.843	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-61	127.4	175.6	177.8	-175.1	175.9	-172.4	0	109.5	G424	G424-K426 PolarHBondContact O-N 3.2Å
427	G	39.5	Very low	39.9	Very low	70 Å²	70	132.9 Å²	132.9	72%	0.722	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-62.5	137.3	176.9	0	0	0	0	0	112.4	P425	P425-G427 PolarHBondContact O-N 2.84Å
428	E	41.1	Very low	39.3	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.864	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-89.6	144.8	179.6	-61.5	-171.4	137.2	0	0	111.6
429	P	39.9	Very low	38.4	Very low	127 Å²	127	131.8 Å²	131.8	83%	0.825	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.8	137.9	174	-15.7	30.9	0	0	0	112
430	G	34.8	Very low	37.8	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.2	150.5	175.1	0	0	0	0	0	113.7
431	V	36	Very low	37.2	Very low	142 Å²	142	132.1 Å²	132.1	86%	0.861	79%	0.79	S	S	*	*			trans	-143.7	147.8	171.7	-78.8	0	0	0	0	110.1
432	D	33.2	Very low	36.9	Very low	157 Å²	157	132.6 Å²	132.6	84%	0.84	79%	0.794	S	S	*	*			trans	-103.6	137.4	-157.6	-75.2	-63	0	0	0	117.4
433	S	33.5	Very low	36.3	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	79%	0.792	S	S	*	*			trans	42.4	111.2	133	-57.6	0	0	0	0	122.3
434	R	34.3	Very low	35.9	Very low	246 Å²	246	139.7 Å²	139.7	93%	0.928	80%	0.797	S	S	*	*			trans	177.5	144	134.5	-98.6	155.8	178.6	-176.5	-0.1	110.1
435	S	35	Very low	35.1	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	80%	0.795	S	S	*	*			cis	-172.6	165.9	-18.6	42.6	0	0	0	0	110.3
436	S	36.1	Very low	34.3	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	80%	0.796	S	S	*	*			trans	85.7	120.4	179.5	-51	0	0	0	0	115.3
437	F	31.4	Very low	34	Very low	181 Å²	181	141.7 Å²	141.7	79%	0.794	80%	0.798	S	S	*	*				67.9	126.6	54.9	-67.2	-60.9	0	0	0	112.8
438	F	36.7	Very low	33.7	Very low	197 Å²	197	141.9 Å²	141.9	86%	0.864	80%	0.799	S	S	*	*			cis	-155.5	160.1	5.9	-126.1	-67.2	0	0	0	109.3
439	G	30.9	Very low	33.7	Very low	68 Å²	68	138 Å²	138	70%	0.701	80%	0.8	S	S	*	*			trans	122.8	62.8	151.1	0	0	0	0	0	122.5
440	D	27.5	Very low	34	Very low	171 Å²	171	143.6 Å²	143.6	91%	0.914	80%	0.804	S	S	*	*			trans	51.2	162	141.1	-145.5	9.3	0	0	0	124.9
441	A	29.7	Very low	34.8	Very low	76 Å²	76	143.3 Å²	143.3	63%	0.628	79%	0.79	S	S	*	*			trans	78.5	112.6	157.9	0	0	0	0	0	122.7
442	S	34.2	Very low	35.8	Very low	118 Å²	118	140.9 Å²	140.9	83%	0.825	78%	0.779	S	S	*	*			trans	67.1	88	145.2	59.2	0	0	0	0	121.8
443	Y	29.7	Very low	36.7	Very low	204 Å²	204	139.6 Å²	139.6	80%	0.8	77%	0.772	S	S	*	*			trans	-148.2	140.5	149.1	-137.4	-116.7	0	0	0	107.1
444	Y	33	Very low	37.6	Very low	215 Å²	215	140 Å²	140	84%	0.843	77%	0.766	S	S	*	*			cis	-122.8	149	38.7	-81.5	-101.7	0	0	0	115.3
445	G	31.1	Very low	38.6	Very low	59 Å²	59	135.2 Å²	135.2	61%	0.608	75%	0.754	S	S	*	*			trans	-93.6	-168.5	166	0	0	0	0	0	114.5
446	R	32.2	Very low	39.3	Very low	237 Å²	237	136.3 Å²	136.3	89%	0.894	75%	0.751	S	S	*	*			trans	-61.1	158.4	177.1	-69	175	166.1	-173.8	-2.2	113.2
447	P	34.6	Very low	40.6	Very low	135 Å²	135	138.1 Å²	138.1	88%	0.877	75%	0.746	S	S	*	*			trans	-60.2	135.8	152.1	-13.9	28.8	0	0	0	110.4
448	G	33.6	Very low	41.5	Very low	73 Å²	73	132 Å²	132	75%	0.753	73%	0.728	S	S	*	*			trans	-149.5	150	179.5	0	0	0	0	0	112.7
449	A	39.8	Very low	42.3	Very low	105 Å²	105	128.1 Å²	128.1	87%	0.868	72%	0.716	S	S	*	*			trans	43.2	128.7	165.2	0	0	0	0	0	120.2
450	R	46.8	Very low	43.7	Very low	244 Å²	244	134 Å²	134	92%	0.921	72%	0.717	S	S	*	*			trans	-71.4	157.4	155.4	-77.7	176.9	160.7	161.6	-8.2	109.8
451	S	51.4	Low	45.1	Very low	71 Å²	71	132 Å²	132	50%	0.497	70%	0.702	S	S	.	*			trans	-73.9	147.8	178.1	95.3	0	0	0	0	111.8	L453	S451-L453 PolarHBondContact O-N 3.02Å; S451-L453 PolarHBondContact OG-N 2.8Å
452	S	56.6	Low	46.2	Very low	91 Å²	91	134.1 Å²	134.1	64%	0.636	70%	0.703	S	S	*	*	H	α-helix	trans	-74.9	1.8	179.6	52.2	0	0	0	0	114.7
453	L	53.3	Low	47.1	Very low	130 Å²	130	134 Å²	134	68%	0.681	69%	0.689	S	S	*	*	H	α-helix	trans	-84	-32.4	-175	-138.7	162.5	0	0	0	112.1	S451 K457	S451-L453 PolarHBondContact O-N 3.02Å; S451-L453 PolarHBondContact OG-N 2.8Å; L453-K457 PolarHBondContact O-N 3.03Å
454	D	52.4	Low	48.1	Very low	114 Å²	114	130.8 Å²	130.8	61%	0.61	69%	0.686	S	S	*	*	H	α-helix	trans	-72.6	-37.9	178.8	-67.9	-46.1	0	0	0	112.6	L456 K457 A458	D454-L456 VanDerWaalsContact C-N 3.34Å; D454-L456 PolarHBondContact O-N 3.1Å; D454-K457 PolarHBondContact O-N 3.4Å; D454-K457 VanDerWaalsContact O-N 3.16Å; D454-A458 PolarHBondContact O-N 2.88Å; D454-A458 VanDerWaalsContact O-N 3.11Å
455	E	54.9	Low	49	Very low	144 Å²	144	127.8 Å²	127.8	67%	0.673	68%	0.683	S	S	*	*	H	α-helix	trans	-65.2	-37.6	177.3	-70.9	-176.5	129.3	0	0	111.9	K457 A458 L459	E455-K457 PolarHBondContact O-N 3.41Å; E455-A458 PolarHBondContact O-N 2.96Å; E455-L459 WeakPolarHBondContact O-CG 3.32Å; E455-L459 PolarHBondContact O-N 2.86Å
456	L	49	Very low	50	Low	125 Å²	125	134.8 Å²	134.8	65%	0.654	69%	0.691	S	S	*	*	H	α-helix	trans	-65.7	-25.3	174.4	-84.9	166.1	0	0	0	113.4	D454	D454-L456 VanDerWaalsContact C-N 3.34Å; D454-L456 PolarHBondContact O-N 3.1Å
457	K	63.2	Low	50.6	Low	143 Å²	143	128.5 Å²	128.5	62%	0.622	68%	0.676	S	S	*	*	H	α-helix	trans	-79	-46.7	175.9	-162.4	174	-178.5	-177.7	0	111.3	L453 D454 E455 L459 R460 E461	L453-K457 PolarHBondContact O-N 3.03Å; D454-K457 PolarHBondContact O-N 3.4Å; D454-K457 VanDerWaalsContact O-N 3.16Å; E455-K457 PolarHBondContact O-N 3.41Å; K457-L459 VanDerWaalsContact C-N 3.35Å; K457-L459 PolarHBondContact O-N 3.02Å; K457-R460 PolarHBondContact O-N 3.22Å; K457-E461 PolarHBondContact O-N 3.04Å
458	A	50.9	Low	51.3	Low	52 Å²	52	132.9 Å²	132.9	43%	0.43	68%	0.675	S	S	.	*	H	α-helix	trans	-64	-35.2	178.8	0	0	0	0	0	113.5	D454 E455 R460	D454-A458 PolarHBondContact O-N 2.88Å; D454-A458 VanDerWaalsContact O-N 3.11Å; E455-A458 PolarHBondContact O-N 2.96Å; A458-R460 VanDerWaalsContact C-N 3.29Å; A458-R460 PolarHBondContact O-N 3.42Å
459	L	54.5	Low	51.9	Low	115 Å²	115	134.9 Å²	134.9	60%	0.602	67%	0.674	S	S	*	*	H	α-helix	trans	-68.5	-27.2	176.2	-74.7	169.9	0	0	0	113.2	E455 K457 Q463	E455-L459 WeakPolarHBondContact O-CG 3.32Å; E455-L459 PolarHBondContact O-N 2.86Å; K457-L459 VanDerWaalsContact C-N 3.35Å; K457-L459 PolarHBondContact O-N 3.02Å; L459-Q463 PolarHBondContact O-N 3.17Å
460	R	59.9	Low	51.9	Low	191 Å²	191	138 Å²	138	72%	0.721	68%	0.677	S	S	*	*	H	α-helix	trans	-76.3	-40	-178.3	-162.6	167.8	-174.8	147.5	2	112.3	K457 A458 L462 Q463 D464	K457-R460 PolarHBondContact O-N 3.22Å; A458-R460 VanDerWaalsContact C-N 3.29Å; A458-R460 PolarHBondContact O-N 3.42Å; R460-L462 VanDerWaalsContact C-N 3.28Å; R460-L462 PolarHBondContact O-N 3.48Å; R460-Q463 PolarHBondContact O-N 2.9Å; R460-D464 PolarHBondContact O-N 3.49Å
461	E	55.8	Low	51.2	Low	130 Å²	130	129.3 Å²	129.3	61%	0.607	66%	0.663	S	S	*	*	H	α-helix	trans	-64.8	-31	174.8	-66.9	177.6	155.3	0	0	112.4	K457 Q463	K457-E461 PolarHBondContact O-N 3.04Å; E461-Q463 VanDerWaalsContact C-N 3.34Å
462	L	52.5	Low	50.2	Low	121 Å²	121	132.9 Å²	132.9	63%	0.634	68%	0.682	S	S	*	*	H	α-helix	trans	-77.2	-15.6	175.5	-77.6	168.8	0	0	0	114.2	R460	R460-L462 VanDerWaalsContact C-N 3.28Å; R460-L462 PolarHBondContact O-N 3.48Å
463	Q	53.4	Low	49	Very low	116 Å²	116	133.4 Å²	133.4	54%	0.542	69%	0.691	S	S	.	*	H	α-helix	trans	-88.9	-41.6	177.3	-169.1	166	-7.2	0	0	111.9	L459 R460 E461 L465 R466 D467	L459-Q463 PolarHBondContact O-N 3.17Å; R460-Q463 PolarHBondContact O-N 2.9Å; E461-Q463 VanDerWaalsContact C-N 3.34Å; Q463-L465 PolarHBondContact O-N 3.14Å; Q463-L465 VanDerWaalsContact O-N 3.16Å; Q463-R466 PolarHBondContact O-N 3.3Å; Q463-D467 PolarHBondContact O-N 3.47Å
464	D	50.4	Low	47.7	Very low	136 Å²	136	136.1 Å²	136.1	73%	0.727	70%	0.701	S	S	*	*	H	α-helix	trans	-57.9	-28.6	175	-85.5	1.2	0	0	0	113	R460 R466	R460-D464 PolarHBondContact O-N 3.49Å; D464-R466 VanDerWaalsContact C-N 3.29Å; D464-R466 PolarHBondContact O-N 3.46Å
465	L	51.9	Low	47.9	Very low	151 Å²	151	135.5 Å²	135.5	79%	0.791	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-5.2	177	-75.3	171.3	0	0	0	114.7	Q463	Q463-L465 PolarHBondContact O-N 3.14Å; Q463-L465 VanDerWaalsContact O-N 3.16Å
466	R	52.8	Low	46.9	Very low	206 Å²	206	135 Å²	135	78%	0.777	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-30.8	-173.2	176.5	171	158.2	168.5	-6.3	113.7	Q463 D464 R468	Q463-R466 PolarHBondContact O-N 3.3Å; D464-R466 VanDerWaalsContact C-N 3.29Å; D464-R466 PolarHBondContact O-N 3.46Å; R466-R468 PolarHBondContact O-N 3.2Å
467	D	44.6	Very low	45.9	Very low	106 Å²	106	140.9 Å²	140.9	57%	0.567	73%	0.725	S	S	*	*			trans	-96.5	45.9	-169.8	-64.1	-21.9	0	0	0	113	Q463	Q463-D467 PolarHBondContact O-N 3.47Å
468	R	50.2	Low	44.6	Very low	227 Å²	227	142.9 Å²	142.9	86%	0.857	74%	0.737	S	S	*	*			trans	-104.2	112	173.2	-119.1	-169.6	79.6	147.3	4.2	111.5	R466	R466-R468 PolarHBondContact O-N 3.2Å
469	P	44.7	Very low	43.9	Very low	114 Å²	114	146.6 Å²	146.6	74%	0.74	76%	0.756	S	S	*	*			trans	-79.6	167.9	-176.8	31.7	-35.5	0	0	0	114.5
470	D	41.5	Very low	42.7	Very low	172 Å²	172	144.2 Å²	144.2	92%	0.92	76%	0.76	S	S	*	*			trans	-71.7	164.1	-163.4	-64.2	-77	0	0	0	118.4
471	G	31.6	Very low	41.5	Very low	61 Å²	61	143.6 Å²	143.6	63%	0.629	77%	0.765	S	S	*	*			trans	144	115.8	137.4	0	0	0	0	0	117
472	T	30.7	Very low	40.2	Very low	146 Å²	146	142 Å²	142	90%	0.896	77%	0.768	S	S	*	*				162	154.1	98.4	40.8	0	0	0	0	114.6
473	A	29.8	Very low	39.2	Very low	101 Å²	101	142.7 Å²	142.7	84%	0.835	77%	0.768	S	S	*	*			trans	73.8	125	153.1	0	0	0	0	0	122
474	E	27.1	Very low	38	Very low	188 Å²	188	144.3 Å²	144.3	88%	0.879	77%	0.773	S	S	*	*			trans	-92.6	-177.8	161.9	-114.6	-150.3	110.2	0	0	111
475	P	57	Low	37	Very low	100 Å²	100	143.8 Å²	143.8	65%	0.649	77%	0.766	S	S	*	*			trans	-111.7	175.8	-142.1	43.1	-39.4	0	0	0	116.9
476	P	34	Very low	35.8	Very low	133 Å²	133	143.9 Å²	143.9	86%	0.864	76%	0.762	S	S	*	*			trans	-120.5	173.3	148.8	33.9	-20.5	0	0	0	114.1
477	R	26.7	Very low	34.9	Very low	250 Å²	250	142.5 Å²	142.5	94%	0.943	77%	0.765	S	S	*	*			trans	-93.5	163.9	-161.8	-68.9	175.4	171.3	159.7	-4.4	116.5
478	Q	36.8	Very low	34.1	Very low	185 Å²	185	144 Å²	144	86%	0.864	78%	0.778	S	S	*	*			trans	-67.7	165.5	161.4	-59.7	172.6	-22.3	0	0	113.6
479	P	35	Very low	33.5	Very low	129 Å²	129	141.6 Å²	141.6	84%	0.838	78%	0.781	S	S	*	*			trans	-124.8	121.2	157.5	35.5	-21	0	0	0	114.8
480	G	29.6	Very low	32.6	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	78%	0.784	S	S	*	*			trans	81.7	149	156.8	0	0	0	0	0	118.4
481	H	35.1	Very low	32.2	Very low	178 Å²	178	139.7 Å²	139.7	82%	0.824	78%	0.782	S	S	*	*			cis	-161.3	151.8	-7.1	-127.9	-80.1	0	0	0	112.2
482	S	28.6	Very low	32	Very low	96 Å²	96	142.2 Å²	142.2	67%	0.671	79%	0.785	S	S	*	*			trans	68.4	129.2	157.3	-171	0	0	0	0	119.5
483	H	32.4	Very low	31.9	Very low	135 Å²	135	143 Å²	143	63%	0.625	78%	0.784	S	S	*	*			cis	-170.6	136.7	-15.8	-105.8	-41.1	0	0	0	110.6
484	K	27.4	Very low	31.9	Very low	151 Å²	151	141.5 Å²	141.5	66%	0.657	78%	0.778	S	S	*	*			trans	60.4	164.5	137.3	-67.9	175	166.6	-120.3	0	118.1
485	H	29.4	Very low	32	Very low	125 Å²	125	142.3 Å²	142.3	58%	0.579	78%	0.782	S	S	*	*			cis	-161.3	151.9	-13.7	-99.7	-31.2	0	0	0	104.8
486	E	27.5	Very low	31	Very low	152 Å²	152	144.3 Å²	144.3	71%	0.71	78%	0.783	S	S	*	*			cis	-158	-164.8	-15.5	-151.3	80.9	123.9	0	0	107.1
487	E	32.4	Very low	31.6	Very low	178 Å²	178	143.1 Å²	143.1	83%	0.832	78%	0.775	S	S	*	*			trans	-72.6	160	171.4	-63.7	170.5	85.3	0	0	113.5
488	T	28.2	Very low	31.9	Very low	138 Å²	138	139.7 Å²	139.7	85%	0.847	76%	0.763	S	S	*	*				-179	155.3	125	-70.1	0	0	0	0	111.3
489	L	38.1	Very low	31.8	Very low	176 Å²	176	139.3 Å²	139.3	92%	0.921	76%	0.759	S	S	*	*			trans	-62.4	150.2	174.3	-64.3	151.7	0	0	0	113.3
490	G	26.5	Very low	31.7	Very low	78 Å²	78	138.3 Å²	138.3	80%	0.804	76%	0.755	S	S	*	*			trans	-160	162.9	176.5	0	0	0	0	0	114
491	L	31.4	Very low	32.1	Very low	167 Å²	167	140 Å²	140	87%	0.874	76%	0.763	S	S	*	*			trans	-139	152.2	-170.7	-100.4	165.8	0	0	0	111.6
492	V	28.8	Very low	31.8	Very low	115 Å²	115	137.6 Å²	137.6	70%	0.697	77%	0.766	S	S	*	*			trans	77	134	156.2	169.4	0	0	0	0	119.7
493	D	29	Very low	32.1	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	77%	0.773	S	S	*	*			trans	34.8	154.3	155.8	-60.1	-20.3	0	0	0	124.4
494	G	29.9	Very low	32.3	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	78%	0.778	S	S	*	*			trans	140.8	71.3	141.6	0	0	0	0	0	120.6
495	E	29.1	Very low	32.6	Very low	205 Å²	205	137 Å²	137	96%	0.958	79%	0.785	S	S	*	*			trans	56.5	169	146.3	-58.9	-167.3	118	0	0	122.4
496	E	34.5	Very low	32.9	Very low	141 Å²	141	139.8 Å²	139.8	66%	0.659	80%	0.8	S	S	*	*			trans	-106.8	161.9	-179.8	-152	-157	-95.8	0	0	110	Y498	E496-Y498 PolarHBondContact OE2-N 3.41Å
497	P	47.6	Very low	33	Very low	108 Å²	108	139.7 Å²	139.7	70%	0.701	81%	0.805	S	S	*	*				-157.1	149.2	100.7	37.4	-18.1	0	0	0	118.3
498	Y	32.7	Very low	33	Very low	179 Å²	179	139.9 Å²	139.9	70%	0.702	81%	0.808	S	S	*	*			trans	46	139.6	135.5	-71.1	-108.3	0	0	0	121.1	E496	E496-Y498 PolarHBondContact OE2-N 3.41Å
499	F	35.6	Very low	33.2	Very low	176 Å²	176	142.4 Å²	142.4	77%	0.772	81%	0.807	S	S	*	*			cis	-170.3	154.9	46.9	-120.5	-55.7	0	0	0	114.2
500	S	32	Very low	33.1	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	80%	0.799	S	S	*	*			trans	54.1	115.7	146.8	-72.9	0	0	0	0	124.2
501	A	37.5	Very low	34.1	Very low	103 Å²	103	143.2 Å²	143.2	85%	0.851	80%	0.796	S	S	*	*			trans	-62.9	167.2	166.6	0	0	0	0	0	117.5
502	S	29.3	Very low	35	Very low	127 Å²	127	138 Å²	138	89%	0.888	77%	0.772	S	S	*	*			trans	-142.8	165.6	147.7	58.8	0	0	0	0	109.9
503	S	34.9	Very low	37	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	76%	0.763	S	S	*	*			trans	-134	138.6	-162.1	178.4	0	0	0	0	113.9
504	S	35.9	Very low	39.4	Very low	105 Å²	105	131.5 Å²	131.5	73%	0.734	76%	0.758	S	S	*	*				178.2	156.6	128.5	44	0	0	0	0	113.8
505	N	33.8	Very low	42	Very low	149 Å²	149	130.4 Å²	130.4	80%	0.797	74%	0.737	S	S	*	*	S	Bend	trans	59.7	106.4	163.6	-72.8	-22.4	0	0	0	121.2
506	M	36.3	Very low	44.6	Very low	183 Å²	183	125.7 Å²	125.7	90%	0.901	72%	0.722	S	S	*	*			trans	49.5	78	136.8	-64.9	-61.1	-176.1	0	0	118.2
507	N	30.4	Very low	47.1	Very low	150 Å²	150	119.3 Å²	119.3	80%	0.802	69%	0.693	S	S	*	*			trans	-136.1	108.4	143.8	-156.9	-12.9	0	0	0	108.9	K509	N507-K509 VanDerWaalsContact C-N 3.31Å; N507-K509 PolarHBondContact O-N 3.44Å
508	M	32.5	Very low	48.8	Very low	182 Å²	182	120 Å²	120	90%	0.897	69%	0.686	S	S	*	*			trans	-80.3	77.7	-167.9	-166.1	159.8	69.1	0	0	111.1	I510	M508-I510 PolarHBondContact O-N 3.42Å
509	K	31.2	Very low	51.5	Low	191 Å²	191	113.3 Å²	113.3	83%	0.83	66%	0.663	S	S	*	*			trans	-84.7	95.6	-166.6	-162.6	175.9	-177.4	-176.8	0	113	N507	N507-K509 VanDerWaalsContact C-N 3.31Å; N507-K509 PolarHBondContact O-N 3.44Å
510	I	36.3	Very low	54	Low	149 Å²	149	107.8 Å²	107.8	76%	0.764	64%	0.641	S	S	*	*			trans	-50.4	139.9	157.9	-63.7	159.5	0	0	0	109.2	M508	M508-I510 PolarHBondContact O-N 3.42Å
511	V	47.5	Very low	56.6	Low	121 Å²	121	107.2 Å²	107.2	73%	0.733	63%	0.629	S	S	*	*			cis	-132.8	167.1	3.9	-141.8	0	0	0	0	109.3
512	P	51	Low	58.9	Low	58 Å²	58	104.8 Å²	104.8	38%	0.377	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-97.4	137	142.2	-9.5	28.4	0	0	0	111.5	G533	P512-G533 VanDerWaalsContact CB-C 3.42Å; P512-G533 WeakPolarHBondContact CB-O 3.41Å
513	G	70.5	Confident	61.6	Low	49 Å²	49	98.9 Å²	98.9	51%	0.505	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-78.4	173.7	175	0	0	0	0	0	113.5	L535	G513-L535 PolarHBondContact O-N 3.41Å
514	A	79.3	Confident	64	Low	91 Å²	91	97.3 Å²	97.3	75%	0.752	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	137.9	163.3	0	0	0	0	0	109.6	L535	A514-L535 CarbonylContact C-O 3.52Å; A514-L535 WeakPolarHBondContact CA-O 3.34Å; A514-L535 HydrophobicContact CB-CB 4.48Å
515	V	84.4	Confident	66.4	Low	48 Å²	48	100.1 Å²	100.1	29%	0.291	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.9	-179.4	-174.1	0	0	0	0	109.3	F517 T534 L535 A536 Y537	V515-F517 HydrophobicContact CB-CE2 4.01Å; V515-F517 HydrophobicContact CB-CZ 4.15Å; V515-F517 HydrophobicContact CG1-CD2 4.36Å; V515-F517 HydrophobicContact CG1-CE1 3.94Å; V515-F517 HydrophobicContact CG1-CE2 3.71Å; V515-F517 HydrophobicContact CG1-CZ 3.47Å; V515-F517 VanDerWaalsContact CG1-CZ 3.47Å; V515-T534 HydrophobicContact CG2-CG2 3.9Å; V515-L535 PolarHBondContact N-O 2.82Å; V515-A536 CarbonylContact O-C 3.57Å; V515-A536 VanDerWaalsContact O-CA 3.3Å; V515-A536 WeakPolarHBondContact O-CA 3.47Å; V515-Y537 PolarHBondContact O-N 3.39Å
516	T	84.4	Confident	68.6	Low	105 Å²	105	97.1 Å²	97.1	64%	0.644	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.8	174.4	52.3	0	0	0	0	110.3	Y537	T516-Y537 WeakPolarHBondContact CA-O 3.43Å
517	F	86.6	Confident	70.8	Confident	8 Å²	8	89.2 Å²	89.2	4%	0.035	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	151.7	172.9	-59.2	-78.9	0	0	0	109.4	V515 E522 M523 K526 A536 Y537 I538 T539 W552	V515-F517 HydrophobicContact CB-CE2 4.01Å; V515-F517 HydrophobicContact CB-CZ 4.15Å; V515-F517 HydrophobicContact CG1-CD2 4.36Å; V515-F517 HydrophobicContact CG1-CE1 3.94Å; V515-F517 HydrophobicContact CG1-CE2 3.71Å; V515-F517 HydrophobicContact CG1-CZ 3.47Å; V515-F517 VanDerWaalsContact CG1-CZ 3.47Å; F517-E522 HydrophobicContact CB-CB 4.4Å; F517-E522 HydrophobicContact CD1-CB 4.37Å; F517-M523 HydrophobicContact CB-CB 4.01Å; F517-M523 HydrophobicContact CD1-CB 4.21Å; F517-M523 HydrophobicContact CD2-CB 3.68Å; F517-M523 HydrophobicContact CD2-CG 3.68Å; F517-M523 HydrophobicContact CE2-CB 4.17Å; F517-M523 HydrophobicContact CE2-CG 3.8Å; F517-M523 HydrophobicContact CG-CB 3.69Å; F517-M523 HydrophobicContact CG-CG 4.22Å; F517-M523 HydrophobicContact CZ-CG 4.44Å; F517-K526 HydrophobicContact CD1-CD 4.11Å; F517-K526 HydrophobicContact CE1-CB 3.74Å; F517-K526 HydrophobicContact CE1-CD 3.79Å; F517-K526 HydrophobicContact CE1-CG 4.38Å; F517-K526 HydrophobicContact CZ-CB 4.39Å; F517-A536 HydrophobicContact CD2-CB 3.88Å; F517-A536 HydrophobicContact CE2-CB 3.75Å; F517-Y537 PolarHBondContact N-O 3.32Å; F517-I538 WeakPolarHBondContact O-CA 3.44Å; F517-T539 PolarHBondContact O-N 2.91Å; F517-T539 PolarHBondContact O-OG1 2.98Å; F517-W552 HydrophobicContact CE2-CH2 4.37Å; F517-W552 HydrophobicContact CE2-CZ2 4.47Å
518	Q	83.3	Confident	73	Confident	121 Å²	121	86.2 Å²	86.2	57%	0.565	48%	0.482	S	S	*	.	S	Bend	trans	-69.5	-56.3	176.4	-64.8	-173.9	-11.5	0	0	110.1	E522 I538 T539 E540	Q518-E522 PolarHBondContact N-OE2 2.82Å; Q518-I538 WeakPolarHBondContact O-CG2 3.26Å; Q518-T539 WeakPolarHBondContact CA-OG1 3.24Å; Q518-T539 PolarHBondContact O-N 2.91Å; Q518-T539 PolarHBondContact O-OG1 2.71Å; Q518-E540 VanDerWaalsContact C-OE1 3.25Å; Q518-E540 WeakPolarHBondContact CB-OE1 3.3Å; Q518-E540 VanDerWaalsContact O-CB 3.29Å; Q518-E540 WeakPolarHBondContact O-CB 3.34Å; Q518-E540 VanDerWaalsContact O-CG 3.24Å; Q518-E540 WeakPolarHBondContact O-CG 3.32Å; Q518-E540 PolarHBondContact O-N 2.92Å
519	N	89.6	Confident	75.4	Confident	40 Å²	40	84.4 Å²	84.4	21%	0.214	48%	0.475	C	S	.	.	S	Bend	trans	-129.2	168.6	-178.4	40.4	73.1	0	0	0	112.6	D521 E522 M523 E540	N519-D521 PolarHBondContact O-N 3.47Å; N519-E522 PolarHBondContact O-N 3.17Å; N519-E522 WeakPolarHBondContact OD1-CG 3.37Å; N519-E522 PolarHBondContact OD1-N 3.31Å; N519-M523 PolarHBondContact O-N 3.32Å; N519-E540 WeakPolarHBondContact CB-OE1 3.46Å; N519-E540 PolarHBondContact N-OE1 2.93Å; N519-E540 PolarHBondContact ND2-OE1 2.98Å
520	I	87.4	Confident	77.8	Confident	60 Å²	60	76.5 Å²	76.5	31%	0.308	44%	0.442	S	S	.	.	H	α-helix	trans	-62.1	-26.7	176.9	-154.9	172.4	0	0	0	113.1	M523 T524 I538	I520-M523 HydrophobicContact CD1-CE 4.5Å; I520-M523 HydrophobicContact CG1-CE 3.61Å; I520-T524 VanDerWaalsContact O-CB 3.26Å; I520-T524 WeakPolarHBondContact O-CB 3.32Å; I520-T524 PolarHBondContact O-N 3.34Å; I520-T524 PolarHBondContact O-OG1 3.02Å; I520-I538 HydrophobicContact CB-CD1 4.03Å; I520-I538 HydrophobicContact CG1-CD1 4Å
521	D	86.8	Confident	80.2	Confident	95 Å²	95	72.9 Å²	72.9	51%	0.508	43%	0.428	S	S	.	.	H	α-helix	trans	-71.2	-44.2	176.3	-85.6	-20.2	0	0	0	112.4	N519 T524 K525	N519-D521 PolarHBondContact O-N 3.47Å; D521-T524 PolarHBondContact O-N 2.97Å; D521-K525 WeakPolarHBondContact O-CB 3.31Å; D521-K525 WeakPolarHBondContact O-CD 3.3Å; D521-K525 VanDerWaalsContact O-CG 3.25Å; D521-K525 WeakPolarHBondContact O-CG 3.05Å; D521-K525 PolarHBondContact O-N 3.12Å
522	E	84.6	Confident	82.1	Confident	53 Å²	53	70.6 Å²	70.6	25%	0.248	42%	0.416	C	S	.	.	H	α-helix	trans	-59.2	-46.9	171.1	-82.3	-139.6	109.4	0	0	111.8	F517 Q518 N519 T524 K525 K526	F517-E522 HydrophobicContact CB-CB 4.4Å; F517-E522 HydrophobicContact CD1-CB 4.37Å; Q518-E522 PolarHBondContact N-OE2 2.82Å; N519-E522 PolarHBondContact O-N 3.17Å; N519-E522 WeakPolarHBondContact OD1-CG 3.37Å; N519-E522 PolarHBondContact OD1-N 3.31Å; E522-T524 VanDerWaalsContact C-N 3.27Å; E522-T524 PolarHBondContact O-N 3.49Å; E522-K525 PolarHBondContact O-N 3.15Å; E522-K526 WeakPolarHBondContact O-CB 3.41Å; E522-K526 WeakPolarHBondContact O-CG 3.22Å; E522-K526 PolarHBondContact O-N 2.94Å; E522-K526 IonicContact OE1-NZ 3.87Å; E522-K526 PolarHBondContact OE1-NZ 2.81Å; E522-K526 IonicContact OE2-NZ 3.92Å
523	M	87	Confident	83.6	Confident	3 Å²	3	69.5 Å²	69.5	2%	0.015	41%	0.414	C	S	.	.	H	α-helix	trans	-59.1	-40.6	176.4	-178.2	-166.4	69.3	0	0	111.1	F517 N519 I520 K526 S527 A536 I538 L545 W552	F517-M523 HydrophobicContact CB-CB 4.01Å; F517-M523 HydrophobicContact CD1-CB 4.21Å; F517-M523 HydrophobicContact CD2-CB 3.68Å; F517-M523 HydrophobicContact CD2-CG 3.68Å; F517-M523 HydrophobicContact CE2-CB 4.17Å; F517-M523 HydrophobicContact CE2-CG 3.8Å; F517-M523 HydrophobicContact CG-CB 3.69Å; F517-M523 HydrophobicContact CG-CG 4.22Å; F517-M523 HydrophobicContact CZ-CG 4.44Å; N519-M523 PolarHBondContact O-N 3.32Å; I520-M523 HydrophobicContact CD1-CE 4.5Å; I520-M523 HydrophobicContact CG1-CE 3.61Å; M523-K526 CarbonylContact O-C 3.53Å; M523-S527 WeakPolarHBondContact O-CA 3.43Å; M523-S527 WeakPolarHBondContact O-CB 3.3Å; M523-S527 PolarHBondContact O-N 2.88Å; M523-A536 HydrophobicContact CG-CB 4.4Å; M523-A536 HydrophobicContact SD-CB 4.01Å; M523-I538 HydrophobicContact CE-CD1 4.14Å; M523-I538 HydrophobicContact SD-CD1 3.9Å; M523-I538 HydrophobicContact SD-CG1 4.2Å; M523-L545 HydrophobicContact CE-CD2 4.17Å; M523-L545 HydrophobicContact SD-CD1 4.44Å; M523-L545 HydrophobicContact SD-CD2 4.28Å; M523-W552 HydrophobicContact CE-CB 4Å; M523-W552 HydrophobicContact CE-CD2 4.15Å; M523-W552 HydrophobicContact CE-CG 3.64Å; M523-W552 HydrophobicContact CG-CD2 4.09Å; M523-W552 HydrophobicContact CG-CG 4.47Å; M523-W552 HydrophobicContact CG-CH2 4.47Å; M523-W552 HydrophobicContact CG-CZ2 3.79Å; M523-W552 HydrophobicContact SD-CB 4.38Å; M523-W552 HydrophobicContact SD-CD2 3.62Å; M523-W552 HydrophobicContact SD-CE3 4.07Å; M523-W552 HydrophobicContact SD-CG 3.77Å; M523-W552 HydrophobicContact SD-CZ2 4.35Å
524	T	85.4	Confident	84.5	Confident	83 Å²	83	67.3 Å²	67.3	51%	0.509	39%	0.392	S	S	.	.	H	α-helix	trans	-70	-45.3	179.8	-61.4	0	0	0	0	111.6	I520 D521 E522 K526 S527	I520-T524 VanDerWaalsContact O-CB 3.26Å; I520-T524 WeakPolarHBondContact O-CB 3.32Å; I520-T524 PolarHBondContact O-N 3.34Å; I520-T524 PolarHBondContact O-OG1 3.02Å; D521-T524 PolarHBondContact O-N 2.97Å; E522-T524 VanDerWaalsContact C-N 3.27Å; E522-T524 PolarHBondContact O-N 3.49Å; T524-K526 VanDerWaalsContact C-N 3.29Å; T524-K526 PolarHBondContact O-N 2.95Å; T524-S527 WeakPolarHBondContact O-CB 3.38Å; T524-S527 PolarHBondContact O-N 2.73Å; T524-S527 VanDerWaalsContact O-N 3.12Å
525	K	85.9	Confident	85	Confident	164 Å²	164	66.3 Å²	66.3	71%	0.713	37%	0.373	S	S	*	.	H	α-helix	trans	-60.1	-38	174.6	-71.4	161.4	-173.1	163.2	0	112.1	D521 E522	D521-K525 WeakPolarHBondContact O-CB 3.31Å; D521-K525 WeakPolarHBondContact O-CD 3.3Å; D521-K525 VanDerWaalsContact O-CG 3.25Å; D521-K525 WeakPolarHBondContact O-CG 3.05Å; D521-K525 PolarHBondContact O-N 3.12Å; E522-K525 PolarHBondContact O-N 3.15Å
526	K	81	Confident	85.2	Confident	86 Å²	86	64 Å²	64	37%	0.374	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	4.3	179.1	-64.7	162.9	-179.4	169.9	0	113	F517 E522 M523 T524 A528 L529 N530	F517-K526 HydrophobicContact CD1-CD 4.11Å; F517-K526 HydrophobicContact CE1-CB 3.74Å; F517-K526 HydrophobicContact CE1-CD 3.79Å; F517-K526 HydrophobicContact CE1-CG 4.38Å; F517-K526 HydrophobicContact CZ-CB 4.39Å; E522-K526 WeakPolarHBondContact O-CB 3.41Å; E522-K526 WeakPolarHBondContact O-CG 3.22Å; E522-K526 PolarHBondContact O-N 2.94Å; E522-K526 IonicContact OE1-NZ 3.87Å; E522-K526 PolarHBondContact OE1-NZ 2.81Å; E522-K526 IonicContact OE2-NZ 3.92Å; M523-K526 CarbonylContact O-C 3.53Å; T524-K526 VanDerWaalsContact C-N 3.29Å; T524-K526 PolarHBondContact O-N 2.95Å; K526-A528 VanDerWaalsContact C-N 3.32Å; K526-A528 PolarHBondContact O-N 3.03Å; K526-L529 PolarHBondContact O-N 3.3Å; K526-N530 PolarHBondContact O-ND2 2.95Å
527	S	81.5	Confident	85.5	Confident	17 Å²	17	63 Å²	63	12%	0.119	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-26.2	-173.9	-172.5	0	0	0	0	114.5	M523 T524 R547 W552	M523-S527 WeakPolarHBondContact O-CA 3.43Å; M523-S527 WeakPolarHBondContact O-CB 3.3Å; M523-S527 PolarHBondContact O-N 2.88Å; T524-S527 WeakPolarHBondContact O-CB 3.38Å; T524-S527 PolarHBondContact O-N 2.73Å; T524-S527 VanDerWaalsContact O-N 3.12Å; S527-R547 PolarHBondContact O-NE 2.82Å; S527-R547 PolarHBondContact O-NH2 2.03Å; S527-R547 PolarHBondContact OG-NE 3.39Å; S527-R547 PolarHBondContact OG-NH2 3.16Å; S527-W552 PolarHBondContact OG-NE1 3.46Å
528	A	77.5	Confident	85.7	Confident	86 Å²	86	62.6 Å²	62.6	71%	0.711	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-35.1	177.6	0	0	0	0	0	112.6	K526 N530	K526-A528 VanDerWaalsContact C-N 3.32Å; K526-A528 PolarHBondContact O-N 3.03Å; A528-N530 VanDerWaalsContact C-N 3.28Å; A528-N530 PolarHBondContact O-N 3.22Å
529	L	81.4	Confident	85.8	Confident	144 Å²	144	60.3 Å²	60.3	75%	0.754	34%	0.337	S	S	*	.	S	Bend	trans	-78.3	-10.5	-178.3	-58.9	175.2	0	0	0	113.4	K526	K526-L529 PolarHBondContact O-N 3.3Å
530	N	82.4	Confident	85.7	Confident	25 Å²	25	64.4 Å²	64.4	13%	0.134	36%	0.355	C	S	.	.	S	Bend	trans	-103.5	118.1	-175.2	-78.1	-79.4	0	0	0	110.9	K526 A528 T534 W552	K526-N530 PolarHBondContact O-ND2 2.95Å; A528-N530 VanDerWaalsContact C-N 3.28Å; A528-N530 PolarHBondContact O-N 3.22Å; N530-T534 HydrophobicContact CB-CG2 4.38Å; N530-W552 HydrophobicContact CB-CH2 4.31Å; N530-W552 HydrophobicContact CB-CZ2 4.24Å
531	P	86.8	Confident	85.5	Confident	74 Å²	74	65.7 Å²	65.7	48%	0.481	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-68.5	156.1	-179.6	28.6	-35.4	0	0	0	112.1	G533 T534 R547	P531-G533 PolarHBondContact O-N 3.49Å; P531-T534 WeakPolarHBondContact O-CB 3.46Å; P531-T534 PolarHBondContact O-N 2.82Å; P531-T534 PolarHBondContact O-OG1 2.99Å; P531-R547 WeakPolarHBondContact O-CG 3.35Å
532	P	86.7	Confident	85.4	Confident	73 Å²	73	67.3 Å²	67.3	47%	0.474	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	136.3	170	-25.3	35.2	0	0	0	112	R547 N549	P532-R547 WeakPolarHBondContact CA-O 3.39Å; P532-N549 WeakPolarHBondContact CB-OD1 3.13Å; P532-N549 WeakPolarHBondContact CG-OD1 3.47Å
533	G	82.5	Confident	85.5	Confident	34 Å²	34	65.6 Å²	65.6	35%	0.351	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.4	-14.8	-173.5	0	0	0	0	0	115	P512 P531 L535 R547	P512-G533 VanDerWaalsContact CB-C 3.42Å; P512-G533 WeakPolarHBondContact CB-O 3.41Å; P531-G533 PolarHBondContact O-N 3.49Å; G533-L535 PolarHBondContact O-N 2.87Å; G533-R547 PolarHBondContact N-O 3.24Å
534	T	89.3	Confident	85.6	Confident	4 Å²	4	67.3 Å²	67.3	3%	0.025	37%	0.368	C	S	.	.			trans	-59.8	135.7	173.4	-67.3	0	0	0	0	111.3	V515 N530 P531 V546 R547 W552	V515-T534 HydrophobicContact CG2-CG2 3.9Å; N530-T534 HydrophobicContact CB-CG2 4.38Å; P531-T534 WeakPolarHBondContact O-CB 3.46Å; P531-T534 PolarHBondContact O-N 2.82Å; P531-T534 PolarHBondContact O-OG1 2.99Å; T534-V546 WeakPolarHBondContact O-CA 3.48Å; T534-R547 PolarHBondContact O-N 2.83Å; T534-W552 HydrophobicContact CG2-CH2 4.2Å
535	L	91.1	Very high	85.9	Confident	70 Å²	70	63.5 Å²	63.5	37%	0.366	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	130.4	170.8	-66.9	176.6	0	0	0	110.1	G513 A514 V515 G533 V546 I555	G513-L535 PolarHBondContact O-N 3.41Å; A514-L535 CarbonylContact C-O 3.52Å; A514-L535 WeakPolarHBondContact CA-O 3.34Å; A514-L535 HydrophobicContact CB-CB 4.48Å; V515-L535 PolarHBondContact N-O 2.82Å; G533-L535 PolarHBondContact O-N 2.87Å; L535-V546 HydrophobicContact CD2-CB 3.92Å; L535-V546 HydrophobicContact CD2-CG2 4.06Å; L535-I555 HydrophobicContact CD2-CD1 3.94Å
536	A	88.8	Confident	86.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133.4	174.5	0	0	0	0	0	110.4	V515 F517 M523 L544 L545 W552	V515-A536 CarbonylContact O-C 3.57Å; V515-A536 VanDerWaalsContact O-CA 3.3Å; V515-A536 WeakPolarHBondContact O-CA 3.47Å; F517-A536 HydrophobicContact CD2-CB 3.88Å; F517-A536 HydrophobicContact CE2-CB 3.75Å; M523-A536 HydrophobicContact CG-CB 4.4Å; M523-A536 HydrophobicContact SD-CB 4.01Å; A536-L544 WeakPolarHBondContact O-CA 3.25Å; A536-L545 PolarHBondContact N-O 2.87Å; A536-L545 PolarHBondContact O-N 3.3Å; A536-W552 HydrophobicContact CB-CE3 3.85Å; A536-W552 HydrophobicContact CB-CH2 3.64Å; A536-W552 HydrophobicContact CB-CZ2 4.46Å; A536-W552 HydrophobicContact CB-CZ3 3.28Å
537	Y	90.3	Very high	86.7	Confident	82 Å²	82	55.1 Å²	55.1	32%	0.322	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.7	165.7	-174.2	-107.1	0	0	0	109.3	V515 T516 F517 T539 E542 A543 L544 L557	V515-Y537 PolarHBondContact O-N 3.39Å; T516-Y537 WeakPolarHBondContact CA-O 3.43Å; F517-Y537 PolarHBondContact N-O 3.32Å; Y537-T539 HydrophobicContact CD1-CG2 4.12Å; Y537-T539 HydrophobicContact CE1-CG2 4.2Å; Y537-E542 VanDerWaalsContact CE2-O 3.22Å; Y537-E542 WeakPolarHBondContact CE2-O 3.23Å; Y537-E542 WeakPolarHBondContact OH-CA 3.31Å; Y537-A543 WeakPolarHBondContact CA-O 3.39Å; Y537-A543 WeakPolarHBondContact CD2-O 3.34Å; Y537-L544 HydrophobicContact CD2-CB 4.45Å; Y537-L544 HydrophobicContact CD2-CD1 4.43Å; Y537-L557 HydrophobicContact CE2-CD1 4.18Å
538	I	89.8	Confident	87.1	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	118	176.9	-57.6	178.3	0	0	0	107.8	F517 Q518 I520 M523 E541 E542 A543 L545	F517-I538 WeakPolarHBondContact O-CA 3.44Å; Q518-I538 WeakPolarHBondContact O-CG2 3.26Å; I520-I538 HydrophobicContact CB-CD1 4.03Å; I520-I538 HydrophobicContact CG1-CD1 4Å; M523-I538 HydrophobicContact CE-CD1 4.14Å; M523-I538 HydrophobicContact SD-CD1 3.9Å; M523-I538 HydrophobicContact SD-CG1 4.2Å; I538-E541 HydrophobicContact CB-CB 4.32Å; I538-E541 HydrophobicContact CG2-CB 3.97Å; I538-E541 HydrophobicContact CG2-CG 4Å; I538-E542 WeakPolarHBondContact O-CA 3.44Å; I538-E542 PolarHBondContact O-N 2.93Å; I538-E542 VanDerWaalsContact O-N 3.1Å; I538-A543 PolarHBondContact N-O 2.65Å; I538-A543 PolarHBondContact O-N 3.33Å; I538-L545 HydrophobicContact CD1-CD1 3.53Å; I538-L545 HydrophobicContact CG1-CD1 3.83Å
539	T	85.4	Confident	87.4	Confident	73 Å²	73	59.9 Å²	59.9	45%	0.448	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-28.3	-174.3	57	0	0	0	0	113.8	F517 Q518 Y537	F517-T539 PolarHBondContact O-N 2.91Å; F517-T539 PolarHBondContact O-OG1 2.98Å; Q518-T539 WeakPolarHBondContact CA-OG1 3.24Å; Q518-T539 PolarHBondContact O-N 2.91Å; Q518-T539 PolarHBondContact O-OG1 2.71Å; Y537-T539 HydrophobicContact CD1-CG2 4.12Å; Y537-T539 HydrophobicContact CE1-CG2 4.2Å
540	E	87.8	Confident	87.4	Confident	127 Å²	127	63.2 Å²	63.2	59%	0.593	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-26	177.1	-72	171.5	-130.1	0	0	113.2	Q518 N519	Q518-E540 VanDerWaalsContact C-OE1 3.25Å; Q518-E540 WeakPolarHBondContact CB-OE1 3.3Å; Q518-E540 VanDerWaalsContact O-CB 3.29Å; Q518-E540 WeakPolarHBondContact O-CB 3.34Å; Q518-E540 VanDerWaalsContact O-CG 3.24Å; Q518-E540 WeakPolarHBondContact O-CG 3.32Å; Q518-E540 PolarHBondContact O-N 2.92Å; N519-E540 WeakPolarHBondContact CB-OE1 3.46Å; N519-E540 PolarHBondContact N-OE1 2.93Å; N519-E540 PolarHBondContact ND2-OE1 2.98Å
541	E	83.5	Confident	87.6	Confident	86 Å²	86	63.1 Å²	63.1	40%	0.402	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-1.5	-177.8	-63.6	176.9	-171	0	0	113	I538 A543	I538-E541 HydrophobicContact CB-CB 4.32Å; I538-E541 HydrophobicContact CG2-CB 3.97Å; I538-E541 HydrophobicContact CG2-CG 4Å; E541-A543 HydrophobicContact CB-CB 3.99Å; E541-A543 PolarHBondContact O-N 2.88Å
542	E	85.8	Confident	87.8	Confident	129 Å²	129	61.5 Å²	61.5	60%	0.603	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	20.8	-167.2	-59.9	-165	144.8	0	0	114.7	Y537 I538 L557	Y537-E542 VanDerWaalsContact CE2-O 3.22Å; Y537-E542 WeakPolarHBondContact CE2-O 3.23Å; Y537-E542 WeakPolarHBondContact OH-CA 3.31Å; I538-E542 WeakPolarHBondContact O-CA 3.44Å; I538-E542 PolarHBondContact O-N 2.93Å; I538-E542 VanDerWaalsContact O-N 3.1Å; E542-L557 WeakPolarHBondContact O-CD1 3.22Å
543	A	85.4	Confident	88	Confident	17 Å²	17	63.2 Å²	63.2	14%	0.14	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	139.8	-167.2	0	0	0	0	0	113.1	Y537 I538 E541 L545 Y554	Y537-A543 WeakPolarHBondContact CA-O 3.39Å; Y537-A543 WeakPolarHBondContact CD2-O 3.34Å; I538-A543 PolarHBondContact N-O 2.65Å; I538-A543 PolarHBondContact O-N 3.33Å; E541-A543 HydrophobicContact CB-CB 3.99Å; E541-A543 PolarHBondContact O-N 2.88Å; A543-L545 HydrophobicContact CB-CD1 3.97Å; A543-Y554 HydrophobicContact CB-CD1 4.24Å; A543-Y554 HydrophobicContact CB-CE1 3.97Å
544	L	90.3	Very high	88.3	Confident	40 Å²	40	67.3 Å²	67.3	21%	0.209	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130	169.4	-172.5	75.1	0	0	0	110.2	A536 Y537 I555 L557	A536-L544 WeakPolarHBondContact O-CA 3.25Å; Y537-L544 HydrophobicContact CD2-CB 4.45Å; Y537-L544 HydrophobicContact CD2-CD1 4.43Å; L544-I555 HydrophobicContact CB-CB 4.46Å; L544-I555 HydrophobicContact CD2-CB 4.2Å; L544-I555 HydrophobicContact CD2-CD1 4.07Å; L544-I555 HydrophobicContact CD2-CG2 4.14Å; L544-I555 HydrophobicContact CG-CB 4.41Å; L544-I555 HydrophobicContact CG-CD1 4.32Å; L544-I555 PolarHBondContact O-N 3.26Å; L544-L557 HydrophobicContact CB-CD1 4.21Å; L544-L557 HydrophobicContact CB-CD2 3.78Å; L544-L557 HydrophobicContact CB-CG 4.09Å; L544-L557 HydrophobicContact CD2-CD2 3.93Å; L544-L557 HydrophobicContact CG-CD2 4.49Å
545	L	91.6	Very high	88.3	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.01	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	157	177.5	-60	89.7	0	0	0	110.9	M523 A536 I538 A543 W552 Q553 Y554	M523-L545 HydrophobicContact CE-CD2 4.17Å; M523-L545 HydrophobicContact SD-CD1 4.44Å; M523-L545 HydrophobicContact SD-CD2 4.28Å; A536-L545 PolarHBondContact N-O 2.87Å; A536-L545 PolarHBondContact O-N 3.3Å; I538-L545 HydrophobicContact CD1-CD1 3.53Å; I538-L545 HydrophobicContact CG1-CD1 3.83Å; A543-L545 HydrophobicContact CB-CD1 3.97Å; L545-W552 HydrophobicContact CB-CB 4.4Å; L545-W552 HydrophobicContact CB-CE3 4.11Å; L545-W552 HydrophobicContact CD2-CB 3.84Å; L545-Q553 CarbonylContact C-O 3.55Å; L545-Q553 VanDerWaalsContact CA-O 3.24Å; L545-Q553 WeakPolarHBondContact CA-O 3.45Å; L545-Y554 HydrophobicContact CD1-CD1 4.14Å; L545-Y554 HydrophobicContact CD1-CE1 4.02Å; L545-Y554 HydrophobicContact CD2-CD1 3.95Å; L545-Y554 HydrophobicContact CD2-CD2 4.17Å; L545-Y554 HydrophobicContact CD2-CE1 3.84Å; L545-Y554 HydrophobicContact CD2-CE2 4.07Å; L545-Y554 HydrophobicContact CD2-CG 4.12Å; L545-Y554 HydrophobicContact CG-CD1 3.8Å; L545-Y554 HydrophobicContact CG-CE1 4.01Å; L545-Y554 HydrophobicContact CG-CG 4.2Å
546	V	92.8	Very high	87.9	Confident	32 Å²	32	71.8 Å²	71.8	19%	0.194	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137.6	171.7	60.7	0	0	0	0	111.1	T534 L535 V548 Q553 I555	T534-V546 WeakPolarHBondContact O-CA 3.48Å; L535-V546 HydrophobicContact CD2-CB 3.92Å; L535-V546 HydrophobicContact CD2-CG2 4.06Å; V546-V548 HydrophobicContact CG1-CG1 4.27Å; V546-V548 PolarHBondContact O-N 3.27Å; V546-Q553 HydrophobicContact CG1-CB 4.07Å; V546-Q553 PolarHBondContact N-O 3Å; V546-Q553 PolarHBondContact O-N 2.96Å; V546-I555 HydrophobicContact CB-CD1 4Å; V546-I555 HydrophobicContact CG1-CD1 4.06Å; V546-I555 HydrophobicContact CG1-CG1 4.25Å
547	R	90.6	Very high	87.2	Confident	42 Å²	42	76.3 Å²	76.3	16%	0.158	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	119	175.7	-169.8	69.8	171.2	95.2	-2.2	109.4	S527 P531 P532 G533 T534 G551 W552	S527-R547 PolarHBondContact O-NE 2.82Å; S527-R547 PolarHBondContact O-NH2 2.03Å; S527-R547 PolarHBondContact OG-NE 3.39Å; S527-R547 PolarHBondContact OG-NH2 3.16Å; P531-R547 WeakPolarHBondContact O-CG 3.35Å; P532-R547 WeakPolarHBondContact CA-O 3.39Å; G533-R547 PolarHBondContact N-O 3.24Å; T534-R547 PolarHBondContact O-N 2.83Å; R547-G551 PolarHBondContact NH1-O 2.88Å; R547-W552 HydrophobicContact CB-CD2 4.42Å; R547-W552 HydrophobicContact CB-CE3 3.96Å; R547-W552 HydrophobicContact CB-CH2 3.89Å; R547-W552 HydrophobicContact CB-CZ2 4.38Å; R547-W552 HydrophobicContact CB-CZ3 3.65Å; R547-W552 VanDerWaalsContact CD-CE2 3.47Å; R547-W552 HydrophobicContact CG-CH2 4.44Å; R547-W552 HydrophobicContact CG-CZ2 4.48Å; R547-W552 VanDerWaalsContact N-CE3 3.34Å
548	V	89.6	Confident	86.5	Confident	56 Å²	56	75.5 Å²	75.5	34%	0.339	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	161.5	174.8	-64.2	0	0	0	0	110.2	V546 K550 G551 Q553	V546-V548 HydrophobicContact CG1-CG1 4.27Å; V546-V548 PolarHBondContact O-N 3.27Å; V548-K550 PolarHBondContact O-N 3.22Å; V548-G551 PolarHBondContact N-O 3.31Å; V548-G551 PolarHBondContact O-N 3.36Å; V548-Q553 HydrophobicContact CG1-CB 4.04Å; V548-Q553 HydrophobicContact CG2-CB 4.14Å
549	N	84.4	Confident	85.5	Confident	147 Å²	147	82.5 Å²	82.5	79%	0.786	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-20.1	-174.6	-62.9	-1	0	0	0	114.6	P532	P532-N549 WeakPolarHBondContact CB-OD1 3.13Å; P532-N549 WeakPolarHBondContact CG-OD1 3.47Å
550	K	81.4	Confident	84.1	Confident	215 Å²	215	86.2 Å²	86.2	94%	0.935	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-1.5	179.1	-64.3	-171.5	177.3	-175.5	0	115.3	V548	V548-K550 PolarHBondContact O-N 3.22Å
551	G	85.1	Confident	82.1	Confident	23 Å²	23	86.2 Å²	86.2	24%	0.237	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.5	-144.4	-176	0	0	0	0	0	113.8	R547 V548	R547-G551 PolarHBondContact NH1-O 2.88Å; V548-G551 PolarHBondContact N-O 3.31Å; V548-G551 PolarHBondContact O-N 3.36Å
552	W	91.1	Very high	80.4	Confident	40 Å²	40	88 Å²	88	15%	0.152	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142	168.8	-69	94.9	0	0	0	109.5	F517 M523 S527 N530 T534 A536 L545 R547	F517-W552 HydrophobicContact CE2-CH2 4.37Å; F517-W552 HydrophobicContact CE2-CZ2 4.47Å; M523-W552 HydrophobicContact CE-CB 4Å; M523-W552 HydrophobicContact CE-CD2 4.15Å; M523-W552 HydrophobicContact CE-CG 3.64Å; M523-W552 HydrophobicContact CG-CD2 4.09Å; M523-W552 HydrophobicContact CG-CG 4.47Å; M523-W552 HydrophobicContact CG-CH2 4.47Å; M523-W552 HydrophobicContact CG-CZ2 3.79Å; M523-W552 HydrophobicContact SD-CB 4.38Å; M523-W552 HydrophobicContact SD-CD2 3.62Å; M523-W552 HydrophobicContact SD-CE3 4.07Å; M523-W552 HydrophobicContact SD-CG 3.77Å; M523-W552 HydrophobicContact SD-CZ2 4.35Å; S527-W552 PolarHBondContact OG-NE1 3.46Å; N530-W552 HydrophobicContact CB-CH2 4.31Å; N530-W552 HydrophobicContact CB-CZ2 4.24Å; T534-W552 HydrophobicContact CG2-CH2 4.2Å; A536-W552 HydrophobicContact CB-CE3 3.85Å; A536-W552 HydrophobicContact CB-CH2 3.64Å; A536-W552 HydrophobicContact CB-CZ2 4.46Å; A536-W552 HydrophobicContact CB-CZ3 3.28Å; L545-W552 HydrophobicContact CB-CB 4.4Å; L545-W552 HydrophobicContact CB-CE3 4.11Å; L545-W552 HydrophobicContact CD2-CB 3.84Å; R547-W552 HydrophobicContact CB-CD2 4.42Å; R547-W552 HydrophobicContact CB-CE3 3.96Å; R547-W552 HydrophobicContact CB-CH2 3.89Å; R547-W552 HydrophobicContact CB-CZ2 4.38Å; R547-W552 HydrophobicContact CB-CZ3 3.65Å; R547-W552 VanDerWaalsContact CD-CE2 3.47Å; R547-W552 HydrophobicContact CG-CH2 4.44Å; R547-W552 HydrophobicContact CG-CZ2 4.48Å; R547-W552 VanDerWaalsContact N-CE3 3.34Å
553	Q	90.7	Very high	78.2	Confident	108 Å²	108	89 Å²	89	51%	0.505	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.6	-178.3	176.2	58.8	59.5	0	0	109.8	L545 V546 V548	L545-Q553 CarbonylContact C-O 3.55Å; L545-Q553 VanDerWaalsContact CA-O 3.24Å; L545-Q553 WeakPolarHBondContact CA-O 3.45Å; V546-Q553 HydrophobicContact CG1-CB 4.07Å; V546-Q553 PolarHBondContact N-O 3Å; V546-Q553 PolarHBondContact O-N 2.96Å; V548-Q553 HydrophobicContact CG1-CB 4.04Å; V548-Q553 HydrophobicContact CG2-CB 4.14Å
554	Y	90.4	Very high	75.9	Confident	121 Å²	121	93 Å²	93	48%	0.475	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	140.9	176	-72.7	-86.5	0	0	0	112.3	A543 L545	A543-Y554 HydrophobicContact CB-CD1 4.24Å; A543-Y554 HydrophobicContact CB-CE1 3.97Å; L545-Y554 HydrophobicContact CD1-CD1 4.14Å; L545-Y554 HydrophobicContact CD1-CE1 4.02Å; L545-Y554 HydrophobicContact CD2-CD1 3.95Å; L545-Y554 HydrophobicContact CD2-CD2 4.17Å; L545-Y554 HydrophobicContact CD2-CE1 3.84Å; L545-Y554 HydrophobicContact CD2-CE2 4.07Å; L545-Y554 HydrophobicContact CD2-CG 4.12Å; L545-Y554 HydrophobicContact CG-CD1 3.8Å; L545-Y554 HydrophobicContact CG-CE1 4.01Å; L545-Y554 HydrophobicContact CG-CG 4.2Å
555	I	89.4	Confident	73.6	Confident	66 Å²	66	97.1 Å²	97.1	34%	0.338	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	122.4	169.6	-61.8	172.6	0	0	0	107.4	L535 L544 V546 L557	L535-I555 HydrophobicContact CD2-CD1 3.94Å; L544-I555 HydrophobicContact CB-CB 4.46Å; L544-I555 HydrophobicContact CD2-CB 4.2Å; L544-I555 HydrophobicContact CD2-CD1 4.07Å; L544-I555 HydrophobicContact CD2-CG2 4.14Å; L544-I555 HydrophobicContact CG-CB 4.41Å; L544-I555 HydrophobicContact CG-CD1 4.32Å; L544-I555 PolarHBondContact O-N 3.26Å; V546-I555 HydrophobicContact CB-CD1 4Å; V546-I555 HydrophobicContact CG1-CD1 4.06Å; V546-I555 HydrophobicContact CG1-CG1 4.25Å; I555-L557 PolarHBondContact O-N 2.87Å
556	A	81.6	Confident	71.2	Confident	102 Å²	102	103.1 Å²	103.1	84%	0.843	60%	0.601	S	S	*	*			trans	-67.4	117.5	177	0	0	0	0	0	110.7
557	L	75.2	Confident	68.4	Low	94 Å²	94	106.1 Å²	106.1	49%	0.492	63%	0.629	S	S	.	*			trans	-77.8	137.8	170.8	-63.6	-179.9	0	0	0	109.8	Y537 E542 L544 I555	Y537-L557 HydrophobicContact CE2-CD1 4.18Å; E542-L557 WeakPolarHBondContact O-CD1 3.22Å; L544-L557 HydrophobicContact CB-CD1 4.21Å; L544-L557 HydrophobicContact CB-CD2 3.78Å; L544-L557 HydrophobicContact CB-CG 4.09Å; L544-L557 HydrophobicContact CD2-CD2 3.93Å; L544-L557 HydrophobicContact CG-CD2 4.49Å; I555-L557 PolarHBondContact O-N 2.87Å
558	G	75.1	Confident	66.1	Low	66 Å²	66	110 Å²	110	68%	0.68	66%	0.659	S	S	*	*			trans	-78.5	-169.2	-177.8	0	0	0	0	0	113.7	L560	G558-L560 PolarHBondContact O-N 3.11Å
559	T	68.8	Low	64.4	Low	147 Å²	147	112.5 Å²	112.5	90%	0.902	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-62.9	128.2	177.4	39.5	0	0	0	0	112.2
560	L	56.3	Low	62.5	Low	150 Å²	150	111.9 Å²	111.9	79%	0.785	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-66.5	142.9	-177.2	-63	173.4	0	0	0	112.4	G558	G558-L560 PolarHBondContact O-N 3.11Å
561	V	46	Very low	60.8	Low	127 Å²	127	107.5 Å²	107.5	77%	0.77	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-95.3	119.1	169	179.9	0	0	0	0	108.3	I563	V561-I563 PolarHBondContact O-N 3.23Å
562	P	47	Very low	58.4	Low	125 Å²	125	113.1 Å²	113.1	81%	0.812	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-70.9	120.6	-174.3	27	-34	0	0	0	111.9
563	I	39.6	Very low	55.6	Low	149 Å²	149	115.2 Å²	115.2	76%	0.764	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-92.5	117	172.2	-58.5	176.3	0	0	0	108.1	V561 T565	V561-I563 PolarHBondContact O-N 3.23Å; I563-T565 PolarHBondContact O-N 3.38Å; I563-T565 VanDerWaalsContact O-N 3.15Å
564	A	37.7	Very low	53.6	Low	102 Å²	102	115.9 Å²	115.9	84%	0.843	74%	0.739	S	S	*	*			trans	-81	93.8	-176.7	0	0	0	0	0	112
565	T	41.3	Very low	50.9	Low	126 Å²	126	115.1 Å²	115.1	77%	0.773	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-81.3	129.7	168.2	40.2	0	0	0	0	111	I563	I563-T565 PolarHBondContact O-N 3.38Å; I563-T565 VanDerWaalsContact O-N 3.15Å
566	P	41	Very low	48.3	Very low	128 Å²	128	120.9 Å²	120.9	83%	0.831	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-81.1	131.8	177.8	31.3	-33.1	0	0	0	111.6
567	A	35.1	Very low	46.3	Very low	95 Å²	95	126.8 Å²	126.8	79%	0.785	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-84.1	148.2	177.2	0	0	0	0	0	112.8
568	P	42.1	Very low	44.4	Very low	123 Å²	123	129 Å²	129	80%	0.799	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75	167.9	176.9	32	-35.7	0	0	0	113.3
569	P	53.9	Low	42.3	Very low	108 Å²	108	133.3 Å²	133.3	70%	0.701	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-101.5	156.9	-160.2	39.2	-37.2	0	0	0	116.4
570	T	43.8	Very low	40.7	Very low	135 Å²	135	129.5 Å²	129.5	83%	0.828	77%	0.767	S	S	*	*			trans	67.8	152	166.6	66.5	0	0	0	0	116.2
571	T	46.5	Very low	39.7	Very low	122 Å²	122	131.7 Å²	131.7	75%	0.748	77%	0.773	S	S	*	*			cis	-147.3	173.2	12.6	-36.1	0	0	0	0	111.5
572	V	33.6	Very low	39.3	Very low	141 Å²	141	131 Å²	131	86%	0.855	77%	0.774	S	S	*	*			trans	86.7	143.1	167	-167.1	0	0	0	0	117
573	A	32.5	Very low	38.8	Very low	85 Å²	85	132.7 Å²	132.7	70%	0.702	77%	0.768	S	S	*	*			trans	-157.7	178.2	-178.7	0	0	0	0	0	108.2
574	P	48.9	Very low	38.5	Very low	121 Å²	121	133.6 Å²	133.6	79%	0.786	78%	0.775	S	S	*	*			cis	-105.7	-162.9	-6.2	32.7	-12.9	0	0	0	110.8
575	S	33	Very low	38.6	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	77%	0.767	S	S	*	*			cis	-150.7	178.9	18.6	-48.8	0	0	0	0	109.8
576	M	35.8	Very low	38.4	Very low	187 Å²	187	136.5 Å²	136.5	92%	0.921	77%	0.77	S	S	*	*			cis	-123.6	174.6	5.4	-81.8	-165.9	-86.8	0	0	112.3
577	R	38.8	Very low	38.2	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	77%	0.768	S	S	*	*			trans	-103.9	171.4	-179.3	-63.9	175.4	178.5	171.3	-0.4	110
578	F	36	Very low	38.1	Very low	142 Å²	142	135.5 Å²	135.5	62%	0.623	75%	0.748	S	S	*	*			cis	-156.2	161	-27.4	-103.4	-47.5	0	0	0	104.1	L580	F578-L580 HydrophobicContact CD1-CB 4.14Å; F578-L580 HydrophobicContact CD1-CD1 3.97Å; F578-L580 HydrophobicContact CD2-CD1 4.33Å; F578-L580 HydrophobicContact CE1-CD1 3.93Å; F578-L580 HydrophobicContact CE2-CD1 4.31Å; F578-L580 HydrophobicContact CG-CD1 4.21Å; F578-L580 HydrophobicContact CZ-CD1 4.13Å
579	D	30.6	Very low	37.9	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	74%	0.744	S	S	*	*				-155.8	149.2	71.7	-73.8	-39.6	0	0	0	110.1
580	L	34.3	Very low	37.3	Very low	67 Å²	67	134.9 Å²	134.9	35%	0.351	75%	0.745	S	S	.	*			cis	88.8	77	15.9	-148.9	165	0	0	0	116.4	F578 K583	F578-L580 HydrophobicContact CD1-CB 4.14Å; F578-L580 HydrophobicContact CD1-CD1 3.97Å; F578-L580 HydrophobicContact CD2-CD1 4.33Å; F578-L580 HydrophobicContact CE1-CD1 3.93Å; F578-L580 HydrophobicContact CE2-CD1 4.31Å; F578-L580 HydrophobicContact CG-CD1 4.21Å; F578-L580 HydrophobicContact CZ-CD1 4.13Å; L580-K583 HydrophobicContact CD1-CD 4.49Å; L580-K583 HydrophobicContact CD2-CB 4.4Å; L580-K583 HydrophobicContact CD2-CD 4.04Å; L580-K583 HydrophobicContact CD2-CG 4.03Å
581	Q	36.7	Very low	37.3	Very low	197 Å²	197	130.8 Å²	130.8	92%	0.921	72%	0.72	S	S	*	*			trans	-127.1	59.6	145.7	-74.6	-156.6	-6.3	0	0	112
582	S	37.8	Very low	37.2	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	72%	0.718	S	S	*	*			trans	-133.1	49.7	175.2	-58.2	0	0	0	0	112.1
583	K	35.3	Very low	38	Very low	159 Å²	159	132.5 Å²	132.5	69%	0.691	72%	0.718	S	S	*	*			trans	-133.7	83.4	177.2	-77.1	-169	-179.5	171.6	0	113	L580	L580-K583 HydrophobicContact CD1-CD 4.49Å; L580-K583 HydrophobicContact CD2-CB 4.4Å; L580-K583 HydrophobicContact CD2-CD 4.04Å; L580-K583 HydrophobicContact CD2-CG 4.03Å
584	N	33.2	Very low	39.2	Very low	169 Å²	169	135 Å²	135	90%	0.904	72%	0.72	S	S	*	*			trans	-151.7	33.1	148.8	-100.6	-35	0	0	0	112.1	L586	N584-L586 PolarHBondContact O-N 3Å
585	L	40.8	Very low	40.2	Very low	128 Å²	128	132.1 Å²	132.1	67%	0.67	70%	0.7	S	S	*	*			trans	-96.2	69.1	168.7	-85.8	167	0	0	0	110
586	L	35.6	Very low	42.8	Very low	161 Å²	161	129.6 Å²	129.6	84%	0.843	68%	0.681	S	S	*	*	S	Bend	trans	-137.7	42.5	176.7	-106.4	172.5	0	0	0	112	N584	N584-L586 PolarHBondContact O-N 3Å
587	N	37	Very low	45.4	Very low	147 Å²	147	121.9 Å²	121.9	79%	0.786	65%	0.645	S	S	*	*	S	Bend	trans	-165	31	158.7	-109.7	-8.5	0	0	0	114.6	N668	N587-N668 PolarHBondContact O-ND2 3.31Å
588	S	34.8	Very low	48	Very low	54 Å²	54	111.2 Å²	111.2	38%	0.378	61%	0.605	S	S	.	*			trans	-135.2	90.8	172.5	-61.7	0	0	0	0	109	N668	S588-N668 VanDerWaalsContact OG-CG 3.3Å; S588-N668 PolarHBondContact OG-ND2 2.79Å; S588-N668 PolarHBondContact OG-OD1 2.89Å
589	P	37.7	Very low	50.8	Low	110 Å²	110	108 Å²	108	71%	0.714	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-60.5	144.3	165.8	27.7	-33.6	0	0	0	108.9
590	P	40.7	Very low	53.9	Low	109 Å²	109	101.1 Å²	101.1	71%	0.708	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-59	139.5	170.4	26.9	-33.7	0	0	0	108.7	L592	P590-L592 PolarHBondContact O-N 3.23Å; P590-L592 VanDerWaalsContact O-N 3.08Å
591	P	44.1	Very low	56.9	Low	49 Å²	49	97.9 Å²	97.9	32%	0.318	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-59.7	119.7	178.5	24.5	-32.5	0	0	0	108.6	T597 V665	P591-T597 HydrophobicContact CB-CG2 4.43Å; P591-V665 HydrophobicContact CG-CG2 3.96Å
592	L	44.3	Very low	59.8	Low	133 Å²	133	88.5 Å²	88.5	70%	0.696	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-56.2	145.3	177.5	-61.4	170.2	0	0	0	108.5	P590 N594 T595	P590-L592 PolarHBondContact O-N 3.23Å; P590-L592 VanDerWaalsContact O-N 3.08Å; L592-N594 PolarHBondContact O-N 2.93Å; L592-T595 HydrophobicContact CB-CG2 4.17Å; L592-T595 PolarHBondContact O-N 3.02Å; L592-T595 PolarHBondContact O-OG1 2.93Å
593	L	49.8	Very low	62.7	Low	165 Å²	165	83.5 Å²	83.5	86%	0.864	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-3.9	-170.1	-119.5	72.7	0	0	0	116.2
594	N	57	Low	65.7	Low	139 Å²	139	78 Å²	78	74%	0.743	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	1.7	178.2	-73.1	-45.6	0	0	0	115.1	L592	L592-N594 PolarHBondContact O-N 2.93Å
595	T	70.8	Confident	68.7	Low	60 Å²	60	76.2 Å²	76.2	37%	0.368	42%	0.42	S	S	.	.	S	Bend	trans	-72	134.3	174.8	46.5	0	0	0	0	111	L592	L592-T595 HydrophobicContact CB-CG2 4.17Å; L592-T595 PolarHBondContact O-N 3.02Å; L592-T595 PolarHBondContact O-OG1 2.93Å
596	P	87.1	Confident	71.4	Confident	53 Å²	53	71.4 Å²	71.4	34%	0.344	40%	0.396	S	S	.	.			trans	-62.8	143.9	169.4	26	-31.2	0	0	0	110.3	L656	P596-L656 HydrophobicContact CB-CD1 4.01Å; P596-L656 HydrophobicContact CB-CD2 4.48Å; P596-L656 HydrophobicContact CG-CD1 4.19Å; P596-L656 HydrophobicContact CG-CD2 3.85Å
597	T	91.4	Very high	74.3	Confident	25 Å²	25	65.3 Å²	65.3	15%	0.153	37%	0.367	C	S	.	.			trans	-138	155.5	-174.9	54	0	0	0	0	109.7	P591 P657 V659	P591-T597 HydrophobicContact CB-CG2 4.43Å; T597-P657 HydrophobicContact CG2-CG 4.09Å; T597-V659 HydrophobicContact CG2-CG1 4.15Å
598	L	93.6	Very high	77.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.7	177.4	-64	170.8	0	0	0	109.8	V649 D653 L656 P657 V658 V659 W670	L598-V649 HydrophobicContact CD1-CG1 3.73Å; L598-V649 HydrophobicContact CD1-CG2 4.25Å; L598-V649 HydrophobicContact CD2-CG1 4.32Å; L598-D653 WeakPolarHBondContact CD1-O 3.04Å; L598-D653 HydrophobicContact CD2-CB 4.24Å; L598-L656 HydrophobicContact CD1-CB 4.2Å; L598-L656 HydrophobicContact CG-CB 4.14Å; L598-L656 HydrophobicContact CG-CD1 4.47Å; L598-P657 PolarHBondContact N-O 3.26Å; L598-V658 HydrophobicContact CB-CG2 4.44Å; L598-V658 CarbonylContact O-C 3.57Å; L598-V658 WeakPolarHBondContact O-CA 3.42Å; L598-V659 PolarHBondContact O-N 2.89Å; L598-W670 HydrophobicContact CD1-CB 3.9Å; L598-W670 HydrophobicContact CD1-CG 4.49Å
599	R	94.1	Very high	80	Confident	75 Å²	75	57.6 Å²	57.6	28%	0.283	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.3	-177.4	-67.4	175.4	-177.8	-93.9	-10.2	111.8	F634 V659 T661 E762	R599-F634 HydrophobicContact CB-CE1 4.02Å; R599-F634 HydrophobicContact CB-CZ 4.1Å; R599-V659 CarbonylContact C-O 3.55Å; R599-V659 WeakPolarHBondContact CA-O 3.42Å; R599-V659 HydrophobicContact CG-CG2 3.92Å; R599-T661 PolarHBondContact NH1-O 3.47Å; R599-E762 HydrophobicContact CB-CB 4.35Å; R599-E762 PolarHBondContact O-N 3.2Å
600	V	95.9	Very high	82.8	Confident	10 Å²	10	56 Å²	56	6%	0.061	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.5	167.9	173.2	0	0	0	0	109.7	V658 V659 N660 T661 L666 L759 C760 V761	V600-V658 HydrophobicContact CB-CG1 4.37Å; V600-V658 HydrophobicContact CG2-CG1 3.48Å; V600-V658 VanDerWaalsContact CG2-CG1 3.48Å; V600-V659 PolarHBondContact N-O 2.9Å; V600-N660 WeakPolarHBondContact O-CA 3.48Å; V600-T661 PolarHBondContact O-N 2.92Å; V600-L666 HydrophobicContact CB-CD1 4.39Å; V600-L759 HydrophobicContact CG1-CB 4.35Å; V600-L759 HydrophobicContact CG1-CD1 4.2Å; V600-C760 WeakPolarHBondContact CA-O 3.27Å; V600-V761 HydrophobicContact CG2-CB 4.2Å; V600-V761 HydrophobicContact CG2-CG2 4.28Å
601	A	97.3	Very high	85.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	158.5	176.5	0	0	0	0	0	109.6	T661 Y688 F690 L759 C760	A601-T661 HydrophobicContact CB-CG2 3.45Å; A601-T661 VanDerWaalsContact CB-CG2 3.45Å; A601-Y688 CarbonylContact C-O 3.45Å; A601-Y688 WeakPolarHBondContact CA-O 3.29Å; A601-F690 HydrophobicContact CB-CD1 3.62Å; A601-F690 HydrophobicContact CB-CD2 4.28Å; A601-F690 HydrophobicContact CB-CE1 3.42Å; A601-F690 VanDerWaalsContact CB-CE1 3.42Å; A601-F690 HydrophobicContact CB-CE2 4.13Å; A601-F690 HydrophobicContact CB-CG 4.07Å; A601-F690 HydrophobicContact CB-CZ 3.72Å; A601-L759 CarbonylContact O-C 3.55Å; A601-L759 WeakPolarHBondContact O-CA 3.45Å; A601-C760 PolarHBondContact N-O 3.35Å; A601-C760 PolarHBondContact O-N 3.31Å
602	A	98.3	Very high	87.9	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	153.9	164.4	0	0	0	0	0	111.9	I687 Y688 S689 F690 V695 I757 I758 L759	A602-I687 HydrophobicContact CB-CG2 4.42Å; A602-Y688 PolarHBondContact N-O 2.74Å; A602-S689 CarbonylContact O-C 3.59Å; A602-S689 VanDerWaalsContact O-CA 3.31Å; A602-S689 WeakPolarHBondContact O-CA 3.19Å; A602-F690 VanDerWaalsContact O-CD2 3.28Å; A602-F690 WeakPolarHBondContact O-CD2 3.48Å; A602-F690 PolarHBondContact O-N 3.3Å; A602-V695 HydrophobicContact CB-CG2 3.59Å; A602-I757 HydrophobicContact CB-CG2 3.97Å; A602-I758 WeakPolarHBondContact CA-O 3.36Å; A602-L759 HydrophobicContact CB-CD2 3.9Å
603	L	98.3	Very high	90.3	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.037	27%	0.268	C	S	.	.			trans	-59.7	148.9	157.7	-66.1	-174.1	0	0	0	109.8	E605 A620 Q624 F690 W701 I758 C760	L603-E605 PolarHBondContact O-N 3.43Å; L603-E605 VanDerWaalsContact O-N 3.15Å; L603-A620 HydrophobicContact CD1-CB 3.92Å; L603-A620 HydrophobicContact CD2-CB 4.01Å; L603-Q624 HydrophobicContact CD2-CG 4.37Å; L603-F690 HydrophobicContact CD2-CD2 4.48Å; L603-F690 HydrophobicContact CD2-CE2 4.24Å; L603-W701 VanDerWaalsContact O-CZ2 3.29Å; L603-W701 WeakPolarHBondContact O-CZ2 3.41Å; L603-I758 HydrophobicContact CB-CB 4.34Å; L603-I758 HydrophobicContact CD1-CB 3.71Å; L603-I758 HydrophobicContact CD1-CG1 4.07Å; L603-I758 HydrophobicContact CD1-CG2 3.77Å; L603-I758 HydrophobicContact CG-CB 3.93Å; L603-I758 HydrophobicContact CG-CG2 4Å; L603-I758 PolarHBondContact N-O 3.14Å; L603-C760 WeakPolarHBondContact CD2-SG 3.18Å
604	N	97.9	Very high	92.5	Very high	44 Å²	44	44.6 Å²	44.6	24%	0.235	24%	0.235	C	C	.	.	S	Bend	trans	-67.6	-10.4	-172.9	-68.9	-11.9	0	0	0	115.8	Q624 F690 S691 W701	N604-Q624 VanDerWaalsContact CG-OE1 3.3Å; N604-F690 WeakPolarHBondContact OD1-CB 3.29Å; N604-F690 PolarHBondContact OD1-N 3.42Å; N604-S691 PolarHBondContact OD1-N 3.04Å; N604-S691 PolarHBondContact OD1-OG 3.03Å; N604-W701 VanDerWaalsContact C-CZ2 3.4Å; N604-W701 VanDerWaalsContact O-CZ2 3.25Å; N604-W701 WeakPolarHBondContact O-CZ2 3.37Å
605	E	96.9	Very high	94.4	Very high	132 Å²	132	48.4 Å²	48.4	62%	0.617	24%	0.239	S	C	*	.	S	Bend	trans	-143.3	150.1	-178.1	-71.1	166.9	-161.8	0	0	108.9	L603	L603-E605 PolarHBondContact O-N 3.43Å; L603-E605 VanDerWaalsContact O-N 3.15Å
606	P	97.1	Very high	95.6	Very high	27 Å²	27	46.3 Å²	46.3	18%	0.175	23%	0.23	C	C	.	.			trans	-70.1	149.3	172.7	30.9	-36.2	0	0	0	111.4	T700 K755 L756	P606-T700 VanDerWaalsContact CD-O 3.26Å; P606-T700 WeakPolarHBondContact CD-O 3.42Å; P606-T700 WeakPolarHBondContact CG-O 3.3Å; P606-K755 HydrophobicContact CB-CB 4.06Å; P606-K755 HydrophobicContact CG-CB 4.32Å; P606-L756 CarbonylContact C-O 3.58Å; P606-L756 WeakPolarHBondContact CA-O 3.49Å; P606-L756 WeakPolarHBondContact CB-O 3.45Å
607	S	96.9	Very high	96.1	Very high	33 Å²	33	43.9 Å²	43.9	23%	0.231	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-131.6	153.4	-177.2	-57.9	0	0	0	0	112.2	L611 W707 K755 L756	S607-L611 VanDerWaalsContact CB-CD2 3.49Å; S607-W707 PolarHBondContact O-NE1 3.43Å; S607-K755 WeakPolarHBondContact O-CA 3.42Å; S607-L756 PolarHBondContact N-O 3.3Å; S607-L756 PolarHBondContact O-N 2.64Å
608	T	97.2	Very high	96.4	Very high	39 Å²	39	44.1 Å²	44.1	24%	0.239	22%	0.215	C	C	.	.			trans	-79.3	-178.2	174.4	61.2	0	0	0	0	111	D610 L611 D753 K755	T608-D610 PolarHBondContact O-N 3.3Å; T608-L611 VanDerWaalsContact O-CD2 3.31Å; T608-L611 WeakPolarHBondContact O-CD2 3.25Å; T608-D753 VanDerWaalsContact CG2-O 3.27Å; T608-D753 WeakPolarHBondContact CG2-O 3.3Å; T608-K755 HydrophobicContact CG2-CG 3.76Å
609	G	94.3	Very high	96.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-70.3	-8.8	173.5	0	0	0	0	0	115.3	C722 W725 S727 C752	G609-C722 WeakPolarHBondContact O-CB 3.36Å; G609-W725 CarbonylContact O-C 3.48Å; G609-W725 WeakPolarHBondContact O-CA 3.35Å; G609-S727 CarbonylContact C-O 3.54Å; G609-C752 PolarHBondContact N-O 3.42Å
610	D	96.3	Very high	96.7	Very high	77 Å²	77	47 Å²	47	41%	0.412	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-94.6	108.3	165.9	-176.2	14.8	0	0	0	110.2	T608 Q612	T608-D610 PolarHBondContact O-N 3.3Å; D610-Q612 PolarHBondContact OD1-N 3.38Å
611	L	95.9	Very high	96.8	Very high	19 Å²	19	46.5 Å²	46.5	10%	0.099	23%	0.229	C	C	.	.	S	Bend	trans	-114.4	16.4	178.3	-56.3	174.9	0	0	0	111.2	S607 T608 G613 G616 A617 L638 W725 I758	S607-L611 VanDerWaalsContact CB-CD2 3.49Å; T608-L611 VanDerWaalsContact O-CD2 3.31Å; T608-L611 WeakPolarHBondContact O-CD2 3.25Å; L611-G613 PolarHBondContact O-N 2.98Å; L611-G616 CarbonylContact O-C 3.45Å; L611-G616 VanDerWaalsContact O-CA 3.24Å; L611-G616 WeakPolarHBondContact O-CA 3.44Å; L611-A617 HydrophobicContact CB-CB 4.08Å; L611-A617 HydrophobicContact CD1-CB 3.89Å; L611-A617 PolarHBondContact O-N 3.01Å; L611-L638 HydrophobicContact CD1-CD1 3.36Å; L611-W725 HydrophobicContact CB-CB 4.12Å; L611-W725 HydrophobicContact CD1-CB 4.08Å; L611-W725 HydrophobicContact CD1-CD2 4.32Å; L611-W725 HydrophobicContact CD1-CE3 4.23Å; L611-W725 HydrophobicContact CD1-CG 4.26Å; L611-W725 HydrophobicContact CG-CB 4.24Å; L611-W725 PolarHBondContact N-O 3.42Å; L611-I758 HydrophobicContact CD1-CD1 3.68Å; L611-I758 HydrophobicContact CD1-CG1 4.45Å; L611-I758 HydrophobicContact CD2-CD1 4.08Å; L611-I758 HydrophobicContact CD2-CG1 4.23Å
612	Q	95.8	Very high	96.7	Very high	161 Å²	161	51.6 Å²	51.6	75%	0.752	25%	0.249	S	C	*	.	S	Bend	trans	57.4	38.2	-165.6	-54.2	177.7	-13.9	0	0	111.6	D610	D610-Q612 PolarHBondContact OD1-N 3.38Å
613	G	95.3	Very high	96.6	Very high	2 Å²	2	56.9 Å²	56.9	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	72.1	175.8	-172.7	0	0	0	0	0	113.9	L611 R615 G616 A617 A724 W725 H726	L611-G613 PolarHBondContact O-N 2.98Å; G613-R615 PolarHBondContact O-N 3.47Å; G613-G616 PolarHBondContact O-N 3.43Å; G613-A617 PolarHBondContact O-N 3Å; G613-A724 WeakPolarHBondContact CA-O 3.27Å; G613-W725 VanDerWaalsContact CA-O 3.24Å; G613-W725 WeakPolarHBondContact CA-O 3.49Å; G613-W725 PolarHBondContact N-O 2.88Å; G613-H726 WeakPolarHBondContact CA-NE2 3.4Å
614	I	95.6	Very high	96.5	Very high	34 Å²	34	58 Å²	58	17%	0.174	27%	0.274	C	S	.	.	H	α-helix	trans	-52.4	-28.8	176.8	-170.1	65	0	0	0	113.5	A617 D618 A636 L638	I614-A617 PolarHBondContact O-N 2.98Å; I614-D618 WeakPolarHBondContact O-CB 3.36Å; I614-D618 PolarHBondContact O-N 2.86Å; I614-A636 HydrophobicContact CD1-CB 4.32Å; I614-L638 HydrophobicContact CD1-CB 3.76Å; I614-L638 HydrophobicContact CD1-CD1 4.35Å
615	R	95.9	Very high	96.4	Very high	218 Å²	218	55.9 Å²	55.9	82%	0.823	26%	0.263	S	S	*	.	H	α-helix	trans	-69.9	-38.4	178.4	-68.6	-176.7	179.9	173.2	0.5	112.7	G613 F619	G613-R615 PolarHBondContact O-N 3.47Å; R615-F619 VanDerWaalsContact O-CB 3.28Å; R615-F619 WeakPolarHBondContact O-CB 3.21Å; R615-F619 PolarHBondContact O-N 3.25Å
616	G	96.9	Very high	96.3	Very high	17 Å²	17	54.2 Å²	54.2	18%	0.175	25%	0.251	C	S	.	.	H	α-helix	trans	-69	-38.4	174.4	0	0	0	0	0	111.6	L611 G613 F619 A620	L611-G616 CarbonylContact O-C 3.45Å; L611-G616 VanDerWaalsContact O-CA 3.24Å; L611-G616 WeakPolarHBondContact O-CA 3.44Å; G613-G616 PolarHBondContact O-N 3.43Å; G616-F619 PolarHBondContact O-N 2.96Å; G616-A620 WeakPolarHBondContact O-CB 3.45Å; G616-A620 PolarHBondContact O-N 3.22Å
617	A	97.1	Very high	96.2	Very high	2 Å²	2	62.5 Å²	62.5	2%	0.017	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-51.2	172.3	0	0	0	0	0	112.6	L611 G613 I614 F619 A620 C621 A636 L638	L611-A617 HydrophobicContact CB-CB 4.08Å; L611-A617 HydrophobicContact CD1-CB 3.89Å; L611-A617 PolarHBondContact O-N 3.01Å; G613-A617 PolarHBondContact O-N 3Å; I614-A617 PolarHBondContact O-N 2.98Å; A617-F619 VanDerWaalsContact C-N 3.31Å; A617-F619 PolarHBondContact O-N 2.86Å; A617-A620 PolarHBondContact O-N 2.82Å; A617-C621 PolarHBondContact O-N 3.43Å; A617-C621 PolarHBondContact O-SG 3.2Å; A617-A636 HydrophobicContact CB-CB 3.54Å; A617-L638 HydrophobicContact CB-CD1 3.81Å
618	D	96.9	Very high	96	Very high	30 Å²	30	62.9 Å²	62.9	16%	0.16	28%	0.284	C	S	.	.	H	α-helix	trans	-56.6	-43.6	174.5	-90.2	-4.2	0	0	0	111.3	I614 C621 Y622 K635 A636	I614-D618 WeakPolarHBondContact O-CB 3.36Å; I614-D618 PolarHBondContact O-N 2.86Å; D618-C621 PolarHBondContact O-N 3.38Å; D618-Y622 WeakPolarHBondContact O-CB 3.22Å; D618-Y622 PolarHBondContact O-N 3.39Å; D618-K635 VanDerWaalsContact OD1-CA 3.24Å; D618-K635 WeakPolarHBondContact OD1-CA 3.13Å; D618-K635 VanDerWaalsContact OD1-CB 3.26Å; D618-K635 WeakPolarHBondContact OD1-CB 3.2Å; D618-K635 WeakPolarHBondContact OD1-CG 3.5Å; D618-K635 WeakPolarHBondContact OD2-CE 3.46Å; D618-K635 IonicContact OD2-NZ 3.96Å; D618-K635 PolarHBondContact OD2-NZ 2.89Å; D618-A636 PolarHBondContact OD1-N 3.44Å
619	F	96.8	Very high	95.7	Very high	121 Å²	121	63.7 Å²	63.7	53%	0.531	30%	0.3	S	S	.	.	H	α-helix	trans	-66.6	-38.1	177.8	-178.4	-108.4	0	0	0	112.8	R615 G616 A617 R623	R615-F619 VanDerWaalsContact O-CB 3.28Å; R615-F619 WeakPolarHBondContact O-CB 3.21Å; R615-F619 PolarHBondContact O-N 3.25Å; G616-F619 PolarHBondContact O-N 2.96Å; A617-F619 VanDerWaalsContact C-N 3.31Å; A617-F619 PolarHBondContact O-N 2.86Å; F619-R623 WeakPolarHBondContact O-CB 3.49Å; F619-R623 PolarHBondContact O-N 2.94Å
620	A	97.6	Very high	95.5	Very high	14 Å²	14	65.3 Å²	65.3	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-62.6	-46.3	174.1	0	0	0	0	0	111.2	L603 G616 A617 R623 Q624	L603-A620 HydrophobicContact CD1-CB 3.92Å; L603-A620 HydrophobicContact CD2-CB 4.01Å; G616-A620 WeakPolarHBondContact O-CB 3.45Å; G616-A620 PolarHBondContact O-N 3.22Å; A617-A620 PolarHBondContact O-N 2.82Å; A620-R623 PolarHBondContact O-N 3.15Å; A620-Q624 WeakPolarHBondContact O-CB 3.43Å; A620-Q624 WeakPolarHBondContact O-CG 3.29Å; A620-Q624 PolarHBondContact O-N 3.26Å
621	C	97.6	Very high	94.9	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-50.7	175.3	-71.5	0	0	0	0	112	A617 D618 R623 Q624 G625 F634 A636 C760	A617-C621 PolarHBondContact O-N 3.43Å; A617-C621 PolarHBondContact O-SG 3.2Å; D618-C621 PolarHBondContact O-N 3.38Å; C621-R623 PolarHBondContact O-N 2.73Å; C621-Q624 PolarHBondContact O-N 3.31Å; C621-G625 PolarHBondContact O-N 3.17Å; C621-F634 HydrophobicContact CB-CB 4.08Å; C621-A636 WeakPolarHBondContact SG-CA 3.31Å; C621-C760 WeakPolarHBondContact CA-SG 3.41Å; C621-C760 HydrophobicContact CB-CB 3.63Å; C621-C760 WeakPolarHBondContact CB-SG 3.41Å; C621-C760 WeakPolarHBondContact SG-CB 3.45Å; C621-C760 CovalentContact SG-SG 2.03Å; C621-C760 PolarHBondContact SG-SG 3.38Å
622	Y	95.9	Very high	94.4	Very high	106 Å²	106	66.7 Å²	66.7	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-57.8	-48.9	176.9	174.5	-98.5	0	0	0	112.3	D618 Q624 R626	D618-Y622 WeakPolarHBondContact O-CB 3.22Å; D618-Y622 PolarHBondContact O-N 3.39Å; Y622-Q624 PolarHBondContact O-N 3.03Å; Y622-R626 HydrophobicContact CD2-CG 4.42Å; Y622-R626 HydrophobicContact CE1-CG 4.25Å; Y622-R626 HydrophobicContact CE2-CG 4.05Å; Y622-R626 WeakPolarHBondContact O-CB 3.35Å; Y622-R626 VanDerWaalsContact O-CG 3.3Å; Y622-R626 WeakPolarHBondContact O-CG 3.24Å; Y622-R626 PolarHBondContact O-N 3.15Å
623	R	96.3	Very high	94.2	Very high	112 Å²	112	61.6 Å²	61.6	42%	0.423	30%	0.295	S	S	.	.	H	α-helix	trans	-64.5	-40	-177.7	-177.7	179	64.9	171.4	-1.1	112.4	F619 A620 C621 R627	F619-R623 WeakPolarHBondContact O-CB 3.49Å; F619-R623 PolarHBondContact O-N 2.94Å; A620-R623 PolarHBondContact O-N 3.15Å; C621-R623 PolarHBondContact O-N 2.73Å; R623-R627 WeakPolarHBondContact O-CG 3.41Å; R623-R627 PolarHBondContact O-N 2.87Å
624	Q	97.2	Very high	94.2	Very high	29 Å²	29	61.8 Å²	61.8	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-76.8	-40.3	178.9	-67.7	-170.4	15.1	0	0	112.1	L603 N604 A620 C621 Y622 R626 R627 A628 F690	L603-Q624 HydrophobicContact CD2-CG 4.37Å; N604-Q624 VanDerWaalsContact CG-OE1 3.3Å; A620-Q624 WeakPolarHBondContact O-CB 3.43Å; A620-Q624 WeakPolarHBondContact O-CG 3.29Å; A620-Q624 PolarHBondContact O-N 3.26Å; C621-Q624 PolarHBondContact O-N 3.31Å; Y622-Q624 PolarHBondContact O-N 3.03Å; Q624-R626 PolarHBondContact O-N 2.81Å; Q624-R627 PolarHBondContact O-N 3.22Å; Q624-R627 VanDerWaalsContact O-N 3.14Å; Q624-A628 PolarHBondContact O-N 3.31Å; Q624-F690 HydrophobicContact CB-CB 4.09Å; Q624-F690 HydrophobicContact CB-CD2 3.38Å; Q624-F690 HydrophobicContact CB-CE2 3.94Å; Q624-F690 HydrophobicContact CB-CG 3.92Å
625	G	95.4	Very high	94.3	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.6	-44.5	173.6	0	0	0	0	0	113.2	C621 R627 A628 G629 L630 F690	C621-G625 PolarHBondContact O-N 3.17Å; G625-R627 PolarHBondContact O-N 3.26Å; G625-A628 CarbonylContact O-C 3.58Å; G625-A628 PolarHBondContact O-N 3.01Å; G625-A628 VanDerWaalsContact O-N 3.17Å; G625-G629 PolarHBondContact O-N 3.5Å; G625-L630 PolarHBondContact O-N 2.85Å; G625-F690 VanDerWaalsContact CA-CD1 3.5Å
626	R	94	Very high	94.3	Very high	98 Å²	98	52.6 Å²	52.6	37%	0.37	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-39.8	174.2	-71.9	-72.9	174.6	-156	-17.7	113	Y622 Q624 A628 G629 L631	Y622-R626 HydrophobicContact CD2-CG 4.42Å; Y622-R626 HydrophobicContact CE1-CG 4.25Å; Y622-R626 HydrophobicContact CE2-CG 4.05Å; Y622-R626 WeakPolarHBondContact O-CB 3.35Å; Y622-R626 VanDerWaalsContact O-CG 3.3Å; Y622-R626 WeakPolarHBondContact O-CG 3.24Å; Y622-R626 PolarHBondContact O-N 3.15Å; Q624-R626 PolarHBondContact O-N 2.81Å; R626-A628 VanDerWaalsContact C-N 3.29Å; R626-A628 PolarHBondContact O-N 3.32Å; R626-G629 PolarHBondContact O-N 2.9Å; R626-L631 VanDerWaalsContact CZ-O 3.29Å; R626-L631 PolarHBondContact NH1-O 3.06Å; R626-L631 PolarHBondContact NH2-O 2.93Å
627	R	94.9	Very high	94.4	Very high	200 Å²	200	51.9 Å²	51.9	76%	0.755	25%	0.253	S	S	*	.	H	α-helix	trans	-67.8	-27.7	175.5	-75.6	175.7	175.7	-172.4	-3.1	112.9	R623 Q624 G625 G629	R623-R627 WeakPolarHBondContact O-CG 3.41Å; R623-R627 PolarHBondContact O-N 2.87Å; Q624-R627 PolarHBondContact O-N 3.22Å; Q624-R627 VanDerWaalsContact O-N 3.14Å; G625-R627 PolarHBondContact O-N 3.26Å; R627-G629 PolarHBondContact O-N 3.23Å
628	A	93.8	Very high	94.4	Very high	41 Å²	41	52 Å²	52	34%	0.339	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	10.1	173.4	0	0	0	0	0	113.9	Q624 G625 R626 L630 F690	Q624-A628 PolarHBondContact O-N 3.31Å; G625-A628 CarbonylContact O-C 3.58Å; G625-A628 PolarHBondContact O-N 3.01Å; G625-A628 VanDerWaalsContact O-N 3.17Å; R626-A628 VanDerWaalsContact C-N 3.29Å; R626-A628 PolarHBondContact O-N 3.32Å; A628-L630 HydrophobicContact CB-CG 4.32Å; A628-L630 PolarHBondContact O-N 2.7Å; A628-F690 HydrophobicContact CB-CB 4Å; A628-F690 HydrophobicContact CB-CD1 4.2Å; A628-F690 VanDerWaalsContact CB-O 3.26Å; A628-F690 WeakPolarHBondContact CB-O 3.36Å
629	G	91.4	Very high	94.3	Very high	56 Å²	56	50.5 Å²	50.5	58%	0.577	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.6	3.1	-178.3	0	0	0	0	0	114.8	G625 R626 R627 L631	G625-G629 PolarHBondContact O-N 3.5Å; R626-G629 PolarHBondContact O-N 2.9Å; R627-G629 PolarHBondContact O-N 3.23Å; G629-L631 PolarHBondContact O-N 3.22Å
630	L	89.6	Confident	94	Very high	35 Å²	35	45 Å²	45	18%	0.183	22%	0.221	C	C	.	.			trans	-78.5	118.5	180	-57.6	177.2	0	0	0	109.5	G625 A628 G632 F634 T661 F690	G625-L630 PolarHBondContact O-N 2.85Å; A628-L630 HydrophobicContact CB-CG 4.32Å; A628-L630 PolarHBondContact O-N 2.7Å; L630-G632 PolarHBondContact O-N 2.93Å; L630-F634 HydrophobicContact CB-CE2 3.6Å; L630-F634 HydrophobicContact CB-CZ 4.01Å; L630-F634 HydrophobicContact CD1-CE2 4.1Å; L630-F634 HydrophobicContact CD1-CZ 3.77Å; L630-T661 HydrophobicContact CD1-CG2 4.18Å; L630-F690 HydrophobicContact CD1-CD1 3.94Å; L630-F690 HydrophobicContact CD1-CE1 3.97Å
631	L	84.1	Confident	93.7	Very high	122 Å²	122	51 Å²	51	64%	0.639	24%	0.241	S	C	*	.			trans	-76.5	-8.3	-175.3	-60.1	-178.6	0	0	0	114.2	R626 G629	R626-L631 VanDerWaalsContact CZ-O 3.29Å; R626-L631 PolarHBondContact NH1-O 3.06Å; R626-L631 PolarHBondContact NH2-O 2.93Å; G629-L631 PolarHBondContact O-N 3.22Å
632	G	84.7	Confident	93.4	Very high	2 Å²	2	56.9 Å²	56.9	2%	0.021	28%	0.277	C	S	.	.	S	Bend	trans	-64.5	158.8	-177.8	0	0	0	0	0	115.9	L630 F634 E762	L630-G632 PolarHBondContact O-N 2.93Å; G632-F634 PolarHBondContact O-N 3.16Å; G632-E762 WeakPolarHBondContact CA-OE1 3.39Å
633	T	90.9	Very high	93.2	Very high	54 Å²	54	54.3 Å²	54.3	33%	0.331	27%	0.268	S	S	.	.			trans	-91.3	87.2	170.4	51.2	0	0	0	0	109.5	A763 L764	T633-A763 PolarHBondContact O-N 3.1Å; T633-L764 HydrophobicContact CG2-CD1 4.26Å; T633-L764 WeakPolarHBondContact OG1-CD1 3.39Å; T633-L764 VanDerWaalsContact OG1-CG 3.32Å; T633-L764 WeakPolarHBondContact OG1-CG 3.42Å
634	F	95.9	Very high	93.2	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	134.1	177.4	-67.5	-87.8	0	0	0	111.8	R599 C621 L630 G632 F690 C760 V761 E762	R599-F634 HydrophobicContact CB-CE1 4.02Å; R599-F634 HydrophobicContact CB-CZ 4.1Å; C621-F634 HydrophobicContact CB-CB 4.08Å; L630-F634 HydrophobicContact CB-CE2 3.6Å; L630-F634 HydrophobicContact CB-CZ 4.01Å; L630-F634 HydrophobicContact CD1-CE2 4.1Å; L630-F634 HydrophobicContact CD1-CZ 3.77Å; G632-F634 PolarHBondContact O-N 3.16Å; F634-F690 HydrophobicContact CB-CZ 4.19Å; F634-F690 HydrophobicContact CD1-CE1 4Å; F634-F690 AromaticContact CD1-CZ 3.86Å; F634-F690 HydrophobicContact CD1-CZ 3.86Å; F634-F690 HydrophobicContact CD2-CE1 4.21Å; F634-F690 HydrophobicContact CD2-CZ 4.36Å; F634-F690 HydrophobicContact CE1-CE1 4.1Å; F634-F690 HydrophobicContact CE1-CZ 4.41Å; F634-F690 HydrophobicContact CE2-CE1 4.32Å; F634-F690 HydrophobicContact CG-CE1 4.07Å; F634-F690 AromaticContact CG-CZ 3.85Å; F634-F690 HydrophobicContact CG-CZ 3.85Å; F634-F690 HydrophobicContact CZ-CE1 4.28Å; F634-C760 HydrophobicContact CB-CB 4.45Å; F634-C760 HydrophobicContact CD1-CB 4.43Å; F634-V761 CarbonylContact C-O 3.59Å; F634-V761 WeakPolarHBondContact CA-O 3.33Å; F634-E762 HydrophobicContact CD1-CB 4.24Å; F634-E762 HydrophobicContact CE1-CB 3.86Å; F634-E762 HydrophobicContact CE1-CG 4.25Å; F634-E762 HydrophobicContact CE2-CG 4.36Å; F634-E762 HydrophobicContact CZ-CB 4.17Å; F634-E762 HydrophobicContact CZ-CG 4.08Å
635	K	96.6	Very high	93.1	Very high	58 Å²	58	49.2 Å²	49.2	25%	0.252	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	157.9	169.3	-81.8	-170.9	149.6	-103	0	110.2	D618 I648 C760 V761 A763	D618-K635 VanDerWaalsContact OD1-CA 3.24Å; D618-K635 WeakPolarHBondContact OD1-CA 3.13Å; D618-K635 VanDerWaalsContact OD1-CB 3.26Å; D618-K635 WeakPolarHBondContact OD1-CB 3.2Å; D618-K635 WeakPolarHBondContact OD1-CG 3.5Å; D618-K635 WeakPolarHBondContact OD2-CE 3.46Å; D618-K635 IonicContact OD2-NZ 3.96Å; D618-K635 PolarHBondContact OD2-NZ 2.89Å; K635-I648 HydrophobicContact CB-CG2 3.87Å; K635-I648 HydrophobicContact CD-CG2 3.91Å; K635-C760 CarbonylContact O-C 3.55Å; K635-C760 WeakPolarHBondContact O-CA 3.4Å; K635-V761 PolarHBondContact N-O 2.88Å; K635-V761 PolarHBondContact O-N 3.26Å; K635-A763 HydrophobicContact CB-CB 4.44Å; K635-A763 HydrophobicContact CD-CB 4.02Å; K635-A763 HydrophobicContact CG-CB 4.14Å
636	A	97.8	Very high	93.1	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	136.1	173.9	0	0	0	0	0	111	I614 A617 D618 C621 L638 I648	I614-A636 HydrophobicContact CD1-CB 4.32Å; A617-A636 HydrophobicContact CB-CB 3.54Å; D618-A636 PolarHBondContact OD1-N 3.44Å; C621-A636 WeakPolarHBondContact SG-CA 3.31Å; A636-L638 HydrophobicContact CB-CB 4.45Å; A636-L638 HydrophobicContact CB-CD1 3.87Å; A636-L638 HydrophobicContact CB-CG 4.01Å; A636-L638 PolarHBondContact O-N 2.97Å; A636-I648 VanDerWaalsContact O-CD1 3.29Å; A636-I648 WeakPolarHBondContact O-CD1 3.36Å
637	F	97.6	Very high	93.2	Very high	3 Å²	3	48.4 Å²	48.4	1%	0.013	26%	0.256	C	S	.	.	S	Bend	trans	-77.2	61.7	175.1	-173.1	-99.3	0	0	0	110.1	L645 W670 F674 H708 L744 L745 L759 V761	F637-L645 HydrophobicContact CD1-CD1 4.16Å; F637-L645 HydrophobicContact CD1-CD2 4.41Å; F637-L645 HydrophobicContact CD2-CD1 3.98Å; F637-L645 HydrophobicContact CE1-CD1 4.33Å; F637-L645 HydrophobicContact CE1-CD2 3.85Å; F637-L645 HydrophobicContact CE1-CG 4.48Å; F637-L645 HydrophobicContact CE2-CD1 4.16Å; F637-L645 HydrophobicContact CE2-CD2 4.33Å; F637-L645 HydrophobicContact CE2-CG 4.21Å; F637-L645 HydrophobicContact CG-CD1 3.97Å; F637-L645 HydrophobicContact CZ-CD1 4.32Å; F637-L645 HydrophobicContact CZ-CD2 3.8Å; F637-L645 HydrophobicContact CZ-CG 4.18Å; F637-W670 AromaticContact CD2-CH2 3.7Å; F637-W670 HydrophobicContact CD2-CH2 3.7Å; F637-W670 AromaticContact CD2-CZ3 3.9Å; F637-W670 HydrophobicContact CD2-CZ3 3.9Å; F637-W670 AromaticContact CE2-CH2 3.57Å; F637-W670 HydrophobicContact CE2-CH2 3.57Å; F637-W670 AromaticContact CE2-CZ3 3.64Å; F637-W670 HydrophobicContact CE2-CZ3 3.64Å; F637-F674 HydrophobicContact CE2-CZ 4.11Å; F637-F674 HydrophobicContact CZ-CZ 4.34Å; F637-H708 HydrophobicContact CD1-CB 4.39Å; F637-H708 HydrophobicContact CE1-CB 4.25Å; F637-L744 HydrophobicContact CD1-CD1 4.42Å; F637-L744 HydrophobicContact CE1-CD1 3.79Å; F637-L744 HydrophobicContact CE1-CD2 3.89Å; F637-L744 HydrophobicContact CE1-CG 3.67Å; F637-L744 HydrophobicContact CE2-CD2 4.3Å; F637-L744 HydrophobicContact CZ-CD1 4.35Å; F637-L744 HydrophobicContact CZ-CD2 3.57Å; F637-L744 HydrophobicContact CZ-CG 3.8Å; F637-L745 HydrophobicContact CE1-CD2 3.84Å; F637-L745 HydrophobicContact CZ-CD2 3.95Å; F637-L759 HydrophobicContact CB-CB 3.82Å; F637-L759 WeakPolarHBondContact CB-O 3.34Å; F637-L759 HydrophobicContact CD1-CB 4.49Å; F637-L759 HydrophobicContact CG-CB 4.37Å; F637-L759 PolarHBondContact N-O 3.33Å; F637-V761 HydrophobicContact CD2-CG1 4.38Å
638	L	97	Very high	93.2	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	22%	0.222	C	C	.	.			trans	-134.8	142.2	-174.9	-59	174.4	0	0	0	110.1	L611 I614 A617 A636 W707 W725 I758	L611-L638 HydrophobicContact CD1-CD1 3.36Å; I614-L638 HydrophobicContact CD1-CB 3.76Å; I614-L638 HydrophobicContact CD1-CD1 4.35Å; A617-L638 HydrophobicContact CB-CD1 3.81Å; A636-L638 HydrophobicContact CB-CB 4.45Å; A636-L638 HydrophobicContact CB-CD1 3.87Å; A636-L638 HydrophobicContact CB-CG 4.01Å; A636-L638 PolarHBondContact O-N 2.97Å; L638-W707 HydrophobicContact CD2-CB 3.76Å; L638-W707 VanDerWaalsContact CD2-O 3.31Å; L638-W707 WeakPolarHBondContact CD2-O 3.49Å; L638-W725 HydrophobicContact CB-CZ2 4.07Å; L638-W725 HydrophobicContact CD1-CD2 4.17Å; L638-W725 HydrophobicContact CD1-CG 4.31Å; L638-W725 HydrophobicContact CD2-CH2 3.89Å; L638-W725 HydrophobicContact CD2-CZ2 3.74Å; L638-W725 HydrophobicContact CD2-CZ3 4.4Å; L638-W725 HydrophobicContact CG-CZ2 4.34Å; L638-I758 HydrophobicContact CD1-CD1 4.48Å; L638-I758 HydrophobicContact CD2-CD1 4.42Å
639	S	95.1	Very high	93.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.			trans	-64.7	160.4	166	83.4	0	0	0	0	110.8	H708 G709 W725	S639-H708 PolarHBondContact N-O 3.26Å; S639-G709 WeakPolarHBondContact CB-O 3.46Å; S639-G709 PolarHBondContact OG-O 3.47Å; S639-W725 PolarHBondContact O-NE1 2.83Å
640	S	91.2	Very high	93.3	Very high	4 Å²	4	42.2 Å²	42.2	3%	0.028	21%	0.207	C	C	.	.			trans	-146	167.5	172.3	71.2	0	0	0	0	111.5	V642 Q643 R716	S640-V642 PolarHBondContact O-N 2.91Å; S640-Q643 PolarHBondContact N-O 3.38Å; S640-Q643 PolarHBondContact O-N 3.22Å; S640-Q643 WeakPolarHBondContact OG-CB 3.37Å; S640-Q643 PolarHBondContact OG-N 3.45Å; S640-Q643 PolarHBondContact OG-O 3.44Å; S640-R716 WeakPolarHBondContact O-CD 3.41Å
641	R	90.7	Very high	93.3	Very high	141 Å²	141	45.3 Å²	45.3	53%	0.532	23%	0.229	S	C	.	.	S	Bend	trans	-50.7	-24.4	177.5	-174.5	173.2	-67.8	152.7	2	114.7	M718 A724	R641-M718 HydrophobicContact CG-CE 4.33Å; R641-A724 HydrophobicContact CB-CB 4.31Å
642	V	91.1	Very high	93.6	Very high	123 Å²	123	44.1 Å²	44.1	75%	0.745	24%	0.237	S	C	*	.	S	Bend	trans	-122.8	-20.8	-175.9	-62.2	0	0	0	0	115	S640	S640-V642 PolarHBondContact O-N 2.91Å
643	Q	92.9	Very high	94	Very high	52 Å²	52	44.9 Å²	44.9	24%	0.243	24%	0.24	C	C	.	.			trans	-124.5	128.6	-175.2	-169.4	169.9	21.6	0	0	110	S640 T647	S640-Q643 PolarHBondContact N-O 3.38Å; S640-Q643 PolarHBondContact O-N 3.22Å; S640-Q643 WeakPolarHBondContact OG-CB 3.37Å; S640-Q643 PolarHBondContact OG-N 3.45Å; S640-Q643 PolarHBondContact OG-O 3.44Å; Q643-T647 VanDerWaalsContact CG-OG1 3.22Å; Q643-T647 WeakPolarHBondContact CG-OG1 3.3Å; Q643-T647 PolarHBondContact NE2-O 2.94Å
644	N	95.7	Very high	94.1	Very high	34 Å²	34	45 Å²	45	18%	0.182	24%	0.235	C	C	.	.			trans	-79.1	156.1	173.2	-69.3	5.7	0	0	0	110.2	D646 T647 R716	N644-D646 VanDerWaalsContact CB-OD1 3.22Å; N644-D646 WeakPolarHBondContact CB-OD1 3.43Å; N644-D646 PolarHBondContact O-N 2.91Å; N644-T647 HydrophobicContact CB-CG2 4.14Å; N644-T647 PolarHBondContact N-OG1 3.44Å; N644-T647 VanDerWaalsContact N-OG1 3.11Å; N644-T647 PolarHBondContact O-N 3.36Å; N644-T647 VanDerWaalsContact O-N 3.08Å; N644-T647 PolarHBondContact O-OG1 2.93Å; N644-R716 WeakPolarHBondContact OD1-CG 3.32Å; N644-R716 PolarHBondContact OD1-NH1 2.84Å
645	L	95.4	Very high	94	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	-64.4	-41.6	-175.4	-171.9	65.6	0	0	0	111.4	F637 T647 I648 W670 F674 H708 S710 G714 L745	F637-L645 HydrophobicContact CD1-CD1 4.16Å; F637-L645 HydrophobicContact CD1-CD2 4.41Å; F637-L645 HydrophobicContact CD2-CD1 3.98Å; F637-L645 HydrophobicContact CE1-CD1 4.33Å; F637-L645 HydrophobicContact CE1-CD2 3.85Å; F637-L645 HydrophobicContact CE1-CG 4.48Å; F637-L645 HydrophobicContact CE2-CD1 4.16Å; F637-L645 HydrophobicContact CE2-CD2 4.33Å; F637-L645 HydrophobicContact CE2-CG 4.21Å; F637-L645 HydrophobicContact CG-CD1 3.97Å; F637-L645 HydrophobicContact CZ-CD1 4.32Å; F637-L645 HydrophobicContact CZ-CD2 3.8Å; F637-L645 HydrophobicContact CZ-CG 4.18Å; L645-T647 PolarHBondContact O-N 3.46Å; L645-I648 HydrophobicContact CD1-CD1 3.76Å; L645-I648 WeakPolarHBondContact O-CG1 3.47Å; L645-I648 PolarHBondContact O-N 3.28Å; L645-W670 VanDerWaalsContact O-CZ2 3.3Å; L645-W670 WeakPolarHBondContact O-CZ2 3.34Å; L645-F674 HydrophobicContact CB-CE1 4.25Å; L645-F674 HydrophobicContact CD2-CE1 3.93Å; L645-F674 HydrophobicContact CG-CE1 3.86Å; L645-F674 HydrophobicContact CG-CZ 4.14Å; L645-H708 HydrophobicContact CD2-CB 4.01Å; L645-S710 WeakPolarHBondContact CD2-OG 3.19Å; L645-G714 WeakPolarHBondContact CA-O 3.4Å; L645-G714 VanDerWaalsContact CB-O 3.27Å; L645-G714 WeakPolarHBondContact CB-O 3.3Å; L645-G714 PolarHBondContact N-O 3.31Å; L645-L745 HydrophobicContact CD2-CD2 3.43Å; L645-L745 VanDerWaalsContact CD2-CD2 3.43Å
646	D	95.4	Very high	93.8	Very high	33 Å²	33	48.4 Å²	48.4	18%	0.176	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-59.5	-32	174.4	80.5	-70.4	0	0	0	112.7	N644 I648 R654 W670 F674	N644-D646 VanDerWaalsContact CB-OD1 3.22Å; N644-D646 WeakPolarHBondContact CB-OD1 3.43Å; N644-D646 PolarHBondContact O-N 2.91Å; D646-I648 VanDerWaalsContact C-N 3.3Å; D646-I648 PolarHBondContact O-N 3.44Å; D646-R654 IonicContact OD2-CZ 2.77Å; D646-R654 IonicContact OD2-NH1 3.65Å; D646-R654 PolarHBondContact OD2-NH1 3.46Å; D646-R654 IonicContact OD2-NH2 2.73Å; D646-W670 PolarHBondContact O-NE1 3.36Å; D646-F674 HydrophobicContact CB-CB 4.47Å; D646-F674 HydrophobicContact CB-CD1 4.25Å; D646-F674 HydrophobicContact CB-CD2 3.96Å; D646-F674 HydrophobicContact CB-CE2 4.29Å; D646-F674 HydrophobicContact CB-CG 3.93Å
647	T	95.4	Very high	93.6	Very high	49 Å²	49	49.6 Å²	49.6	30%	0.301	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-82.7	5	-175.1	65.7	0	0	0	0	115.5	Q643 N644 L645	Q643-T647 VanDerWaalsContact CG-OG1 3.22Å; Q643-T647 WeakPolarHBondContact CG-OG1 3.3Å; Q643-T647 PolarHBondContact NE2-O 2.94Å; N644-T647 HydrophobicContact CB-CG2 4.14Å; N644-T647 PolarHBondContact N-OG1 3.44Å; N644-T647 VanDerWaalsContact N-OG1 3.11Å; N644-T647 PolarHBondContact O-N 3.36Å; N644-T647 VanDerWaalsContact O-N 3.08Å; N644-T647 PolarHBondContact O-OG1 2.93Å; L645-T647 PolarHBondContact O-N 3.46Å
648	I	95.3	Very high	93.5	Very high	11 Å²	11	49.5 Å²	49.5	6%	0.056	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-66.9	-40.6	177.5	-66.7	174.2	0	0	0	111.6	K635 A636 L645 D646 W670 V761 A763	K635-I648 HydrophobicContact CB-CG2 3.87Å; K635-I648 HydrophobicContact CD-CG2 3.91Å; A636-I648 VanDerWaalsContact O-CD1 3.29Å; A636-I648 WeakPolarHBondContact O-CD1 3.36Å; L645-I648 HydrophobicContact CD1-CD1 3.76Å; L645-I648 WeakPolarHBondContact O-CG1 3.47Å; L645-I648 PolarHBondContact O-N 3.28Å; D646-I648 VanDerWaalsContact C-N 3.3Å; D646-I648 PolarHBondContact O-N 3.44Å; I648-W670 HydrophobicContact CB-CZ2 4.16Å; I648-V761 HydrophobicContact CG2-CG1 3.64Å; I648-A763 HydrophobicContact CG2-CB 4.29Å
649	V	94.6	Very high	93.3	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.012	26%	0.263	C	S	.	.	S	Bend	trans	-90.1	138.1	179.9	174.1	0	0	0	0	110.6	L598 D653 R654 W670 V761	L598-V649 HydrophobicContact CD1-CG1 3.73Å; L598-V649 HydrophobicContact CD1-CG2 4.25Å; L598-V649 HydrophobicContact CD2-CG1 4.32Å; V649-D653 HydrophobicContact CG1-CB 3.49Å; V649-D653 VanDerWaalsContact CG1-CB 3.49Å; V649-R654 HydrophobicContact CG1-CG 4.2Å; V649-R654 PolarHBondContact O-NE 2.82Å; V649-R654 VanDerWaalsContact O-NE 3.07Å; V649-W670 HydrophobicContact CB-CD2 4.08Å; V649-W670 HydrophobicContact CB-CG 4.12Å; V649-W670 HydrophobicContact CB-CZ2 4.27Å; V649-W670 HydrophobicContact CG1-CG 4.39Å; V649-W670 HydrophobicContact CG2-CD2 3.61Å; V649-W670 VanDerWaalsContact CG2-CE2 3.47Å; V649-W670 HydrophobicContact CG2-CE3 3.98Å; V649-W670 HydrophobicContact CG2-CG 4.09Å; V649-W670 HydrophobicContact CG2-CH2 4.11Å; V649-W670 HydrophobicContact CG2-CZ2 3.72Å; V649-W670 HydrophobicContact CG2-CZ3 4.24Å; V649-V761 HydrophobicContact CG2-CG2 3.97Å
650	R	91.4	Very high	93.3	Very high	153 Å²	153	49.4 Å²	49.4	58%	0.577	26%	0.263	S	S	*	.			trans	-55.2	142.3	177.3	-79	-174.4	174.4	162.8	5	111.5	A652 D653 R654 L764	R650-A652 VanDerWaalsContact C-N 3.29Å; R650-A652 PolarHBondContact O-N 2.96Å; R650-A652 VanDerWaalsContact O-N 3.15Å; R650-D653 HydrophobicContact CB-CB 4.44Å; R650-D653 PolarHBondContact O-N 3.24Å; R650-R654 WeakPolarHBondContact O-CG 3.42Å; R650-R654 PolarHBondContact O-N 3.14Å; R650-L764 HydrophobicContact CG-CD2 3.74Å
651	P	91.5	Very high	93.3	Very high	101 Å²	101	50.5 Å²	50.5	66%	0.656	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-47.7	-44.7	180	-31.2	36.8	0	0	0	115	D653 R654	P651-D653 VanDerWaalsContact C-N 3.3Å; P651-D653 PolarHBondContact O-N 3.35Å; P651-R654 PolarHBondContact O-N 3.28Å
652	A	90.5	Very high	93.4	Very high	96 Å²	96	51.4 Å²	51.4	79%	0.793	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-66.7	-26.1	179.3	0	0	0	0	0	114.4	R650	R650-A652 VanDerWaalsContact C-N 3.29Å; R650-A652 PolarHBondContact O-N 2.96Å; R650-A652 VanDerWaalsContact O-N 3.15Å
653	D	92.1	Very high	93.3	Very high	18 Å²	18	47 Å²	47	10%	0.096	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-86	-10.4	178.4	-72.5	-57.1	0	0	0	112.2	L598 V649 R650 P651 D655 L656 S765	L598-D653 WeakPolarHBondContact CD1-O 3.04Å; L598-D653 HydrophobicContact CD2-CB 4.24Å; V649-D653 HydrophobicContact CG1-CB 3.49Å; V649-D653 VanDerWaalsContact CG1-CB 3.49Å; R650-D653 HydrophobicContact CB-CB 4.44Å; R650-D653 PolarHBondContact O-N 3.24Å; P651-D653 VanDerWaalsContact C-N 3.3Å; P651-D653 PolarHBondContact O-N 3.35Å; D653-D655 VanDerWaalsContact C-N 3.3Å; D653-D655 PolarHBondContact O-N 2.88Å; D653-L656 HydrophobicContact CB-CD1 4.11Å; D653-L656 VanDerWaalsContact O-CB 3.25Å; D653-L656 WeakPolarHBondContact O-CB 3.49Å; D653-L656 VanDerWaalsContact O-CG 3.31Å; D653-L656 WeakPolarHBondContact O-CG 3.45Å; D653-L656 PolarHBondContact O-N 3.24Å; D653-L656 VanDerWaalsContact O-N 3.08Å; D653-L656 WeakPolarHBondContact OD1-CD1 2.98Å; D653-S765 VanDerWaalsContact OD1-CB 3.24Å; D653-S765 WeakPolarHBondContact OD1-CB 3.49Å; D653-S765 PolarHBondContact OD1-OG 3.37Å
654	R	93.5	Very high	93.2	Very high	56 Å²	56	46.6 Å²	46.6	21%	0.211	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-19.6	-167.6	-63.7	-165.8	-173	-176.6	9.9	115.6	D646 V649 R650 P651 L656 W670 K671	D646-R654 IonicContact OD2-CZ 2.77Å; D646-R654 IonicContact OD2-NH1 3.65Å; D646-R654 PolarHBondContact OD2-NH1 3.46Å; D646-R654 IonicContact OD2-NH2 2.73Å; V649-R654 HydrophobicContact CG1-CG 4.2Å; V649-R654 PolarHBondContact O-NE 2.82Å; V649-R654 VanDerWaalsContact O-NE 3.07Å; R650-R654 WeakPolarHBondContact O-CG 3.42Å; R650-R654 PolarHBondContact O-N 3.14Å; P651-R654 PolarHBondContact O-N 3.28Å; R654-L656 VanDerWaalsContact C-N 3.35Å; R654-W670 WeakPolarHBondContact O-CB 3.26Å; R654-W670 PolarHBondContact O-N 2.92Å; R654-K671 HydrophobicContact CB-CB 4.48Å; R654-K671 PolarHBondContact O-N 2.83Å
655	D	93.3	Very high	93	Very high	104 Å²	104	47.5 Å²	47.5	56%	0.556	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-1.1	176	-64.7	-51.9	0	0	0	112.3	D653 S669 K671	D653-D655 VanDerWaalsContact C-N 3.3Å; D653-D655 PolarHBondContact O-N 2.88Å; D655-S669 WeakPolarHBondContact O-CB 3.41Å; D655-K671 WeakPolarHBondContact OD1-CD 3.49Å
656	L	92.7	Very high	92.9	Very high	32 Å²	32	48.3 Å²	48.3	17%	0.168	26%	0.262	C	S	.	.	S	Bend	trans	-74.6	144.9	176	-59	-178.2	0	0	0	112.5	P596 L598 D653 R654 S669 W670	P596-L656 HydrophobicContact CB-CD1 4.01Å; P596-L656 HydrophobicContact CB-CD2 4.48Å; P596-L656 HydrophobicContact CG-CD1 4.19Å; P596-L656 HydrophobicContact CG-CD2 3.85Å; L598-L656 HydrophobicContact CD1-CB 4.2Å; L598-L656 HydrophobicContact CG-CB 4.14Å; L598-L656 HydrophobicContact CG-CD1 4.47Å; D653-L656 HydrophobicContact CB-CD1 4.11Å; D653-L656 VanDerWaalsContact O-CB 3.25Å; D653-L656 WeakPolarHBondContact O-CB 3.49Å; D653-L656 VanDerWaalsContact O-CG 3.31Å; D653-L656 WeakPolarHBondContact O-CG 3.45Å; D653-L656 PolarHBondContact O-N 3.24Å; D653-L656 VanDerWaalsContact O-N 3.08Å; D653-L656 WeakPolarHBondContact OD1-CD1 2.98Å; R654-L656 VanDerWaalsContact C-N 3.35Å; L656-S669 WeakPolarHBondContact O-CA 3.37Å; L656-W670 PolarHBondContact O-N 3.22Å
657	P	94	Very high	92.9	Very high	27 Å²	27	47.6 Å²	47.6	18%	0.175	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-67.6	140.3	178.2	28.5	-35	0	0	0	111.8	T597 L598 N668	T597-P657 HydrophobicContact CG2-CG 4.09Å; L598-P657 PolarHBondContact N-O 3.26Å; P657-N668 WeakPolarHBondContact CA-O 3.18Å
658	V	94.4	Very high	92.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.7	-179.3	-176.7	0	0	0	0	108.4	L598 V600 L666 F667 W670 I673	L598-V658 HydrophobicContact CB-CG2 4.44Å; L598-V658 CarbonylContact O-C 3.57Å; L598-V658 WeakPolarHBondContact O-CA 3.42Å; V600-V658 HydrophobicContact CB-CG1 4.37Å; V600-V658 HydrophobicContact CG2-CG1 3.48Å; V600-V658 VanDerWaalsContact CG2-CG1 3.48Å; V658-L666 PolarHBondContact O-N 2.98Å; V658-F667 HydrophobicContact CB-CB 4.19Å; V658-F667 HydrophobicContact CB-CD2 4.19Å; V658-F667 HydrophobicContact CG1-CD2 4.25Å; V658-F667 PolarHBondContact N-O 2.95Å; V658-F667 PolarHBondContact O-N 3.21Å; V658-F667 VanDerWaalsContact O-N 3.15Å; V658-W670 HydrophobicContact CG2-CB 3.89Å; V658-W670 HydrophobicContact CG2-CE3 4.21Å; V658-I673 HydrophobicContact CG2-CD1 4.19Å
659	V	93.9	Very high	92.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	156.6	-174.6	-59.7	0	0	0	0	111.4	T597 L598 R599 V600 D664 V665	T597-V659 HydrophobicContact CG2-CG1 4.15Å; L598-V659 PolarHBondContact O-N 2.89Å; R599-V659 CarbonylContact C-O 3.55Å; R599-V659 WeakPolarHBondContact CA-O 3.42Å; R599-V659 HydrophobicContact CG-CG2 3.92Å; V600-V659 PolarHBondContact N-O 2.9Å; V659-D664 CarbonylContact C-O 3.58Å; V659-D664 WeakPolarHBondContact CA-O 3.5Å; V659-D664 WeakPolarHBondContact CB-O 3.05Å; V659-V665 HydrophobicContact CG1-CG2 4.16Å
660	N	95	Very high	92.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	178.8	168.4	72.1	14.9	0	0	0	111.6	V600 R662 G663 D664 L666 R686 Y688	V600-N660 WeakPolarHBondContact O-CA 3.48Å; N660-R662 PolarHBondContact O-N 2.99Å; N660-R662 WeakPolarHBondContact OD1-CA 3.35Å; N660-R662 WeakPolarHBondContact OD1-CB 3.42Å; N660-R662 PolarHBondContact OD1-N 2.92Å; N660-G663 PolarHBondContact O-N 3.4Å; N660-G663 VanDerWaalsContact O-N 3.14Å; N660-G663 PolarHBondContact OD1-N 3.43Å; N660-D664 PolarHBondContact N-O 3.35Å; N660-D664 WeakPolarHBondContact ND2-CB 3.4Å; N660-D664 PolarHBondContact ND2-OD2 2.96Å; N660-D664 PolarHBondContact OD1-N 3.37Å; N660-D664 PolarHBondContact OD1-OD2 2.94Å; N660-L666 HydrophobicContact CB-CD1 4.1Å; N660-L666 HydrophobicContact CB-CD2 4.45Å; N660-L666 HydrophobicContact CB-CG 4.29Å; N660-R686 WeakPolarHBondContact CB-O 3.28Å; N660-R686 PolarHBondContact ND2-O 2.88Å; N660-Y688 HydrophobicContact CB-CD2 4.25Å; N660-Y688 WeakPolarHBondContact ND2-CD2 3.25Å; N660-Y688 VanDerWaalsContact ND2-CE2 3.31Å; N660-Y688 WeakPolarHBondContact ND2-CE2 3.45Å
661	T	91.6	Very high	92.8	Very high	26 Å²	26	49.2 Å²	49.2	16%	0.16	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.8	177.8	55.4	0	0	0	0	114.2	R599 V600 A601 L630 Y688	R599-T661 PolarHBondContact NH1-O 3.47Å; V600-T661 PolarHBondContact O-N 2.92Å; A601-T661 HydrophobicContact CB-CG2 3.45Å; A601-T661 VanDerWaalsContact CB-CG2 3.45Å; L630-T661 HydrophobicContact CD1-CG2 4.18Å; T661-Y688 WeakPolarHBondContact OG1-CB 3.31Å
662	R	90.9	Very high	92.9	Very high	160 Å²	160	46 Å²	46	60%	0.604	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-17.5	178.6	-56.1	-170	-177.2	-154.3	-2.2	113.4	N660 Y688 G692	N660-R662 PolarHBondContact O-N 2.99Å; N660-R662 WeakPolarHBondContact OD1-CA 3.35Å; N660-R662 WeakPolarHBondContact OD1-CB 3.42Å; N660-R662 PolarHBondContact OD1-N 2.92Å; R662-Y688 HydrophobicContact CG-CD2 3.93Å; R662-Y688 HydrophobicContact CG-CE2 4Å; R662-Y688 HydrophobicContact CG-CG 4.41Å; R662-Y688 VanDerWaalsContact NE-CZ 3.29Å; R662-Y688 VanDerWaalsContact NH2-CE1 3.3Å; R662-G692 PolarHBondContact NH2-O 2.9Å
663	G	89.3	Confident	93.1	Very high	30 Å²	30	41.5 Å²	41.5	31%	0.309	22%	0.22	S	C	.	.	S	Bend	trans	104.1	2.4	179.8	0	0	0	0	0	115.4	N660	N660-G663 PolarHBondContact O-N 3.4Å; N660-G663 VanDerWaalsContact O-N 3.14Å; N660-G663 PolarHBondContact OD1-N 3.43Å
664	D	91.1	Very high	93.3	Very high	44 Å²	44	41.8 Å²	41.8	24%	0.235	22%	0.22	C	C	.	.			trans	-67.5	135.5	172	-55	-82.3	0	0	0	110.4	V659 N660 L666 R686	V659-D664 CarbonylContact C-O 3.58Å; V659-D664 WeakPolarHBondContact CA-O 3.5Å; V659-D664 WeakPolarHBondContact CB-O 3.05Å; N660-D664 PolarHBondContact N-O 3.35Å; N660-D664 WeakPolarHBondContact ND2-CB 3.4Å; N660-D664 PolarHBondContact ND2-OD2 2.96Å; N660-D664 PolarHBondContact OD1-N 3.37Å; N660-D664 PolarHBondContact OD1-OD2 2.94Å; D664-L666 PolarHBondContact O-N 3.34Å; D664-R686 VanDerWaalsContact CG-CZ 3.46Å; D664-R686 VanDerWaalsContact CG-NH2 3.28Å; D664-R686 IonicContact OD1-CZ 2.72Å; D664-R686 IonicContact OD1-NH1 3.24Å; D664-R686 PolarHBondContact OD1-NH1 2.03Å; D664-R686 IonicContact OD1-NH2 2.62Å; D664-R686 PolarHBondContact OD1-NH2 3.11Å; D664-R686 IonicContact OD2-CZ 3.16Å; D664-R686 IonicContact OD2-NH1 2.73Å; D664-R686 PolarHBondContact OD2-NH1 3.44Å; D664-R686 IonicContact OD2-NH2 2.76Å
665	V	92.4	Very high	93.2	Very high	54 Å²	54	43.2 Å²	43.2	33%	0.327	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	125.8	173.7	-177.8	0	0	0	0	110.1	P591 V659 F667	P591-V665 HydrophobicContact CG-CG2 3.96Å; V659-V665 HydrophobicContact CG1-CG2 4.16Å; V665-F667 WeakPolarHBondContact CG1-O 3.46Å
666	L	93.6	Very high	93	Very high	16 Å²	16	40.4 Å²	40.4	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-39.7	170.2	-61.6	177.3	0	0	0	110.9	V600 V658 N660 D664 F681 I687	V600-L666 HydrophobicContact CB-CD1 4.39Å; V658-L666 PolarHBondContact O-N 2.98Å; N660-L666 HydrophobicContact CB-CD1 4.1Å; N660-L666 HydrophobicContact CB-CD2 4.45Å; N660-L666 HydrophobicContact CB-CG 4.29Å; D664-L666 PolarHBondContact O-N 3.34Å; L666-F681 HydrophobicContact CB-CE1 4.38Å; L666-I687 HydrophobicContact CD1-CG1 4.26Å
667	F	94.2	Very high	92.9	Very high	18 Å²	18	45.4 Å²	45.4	8%	0.079	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.4	176.5	-53.9	-82.8	0	0	0	111.4	V658 V665 S669 I673 F681 L744	V658-F667 HydrophobicContact CB-CB 4.19Å; V658-F667 HydrophobicContact CB-CD2 4.19Å; V658-F667 HydrophobicContact CG1-CD2 4.25Å; V658-F667 PolarHBondContact N-O 2.95Å; V658-F667 PolarHBondContact O-N 3.21Å; V658-F667 VanDerWaalsContact O-N 3.15Å; V665-F667 WeakPolarHBondContact CG1-O 3.46Å; F667-S669 PolarHBondContact O-N 2.85Å; F667-I673 HydrophobicContact CB-CG1 4.05Å; F667-I673 HydrophobicContact CD1-CG1 3.9Å; F667-I673 HydrophobicContact CD2-CD1 3.58Å; F667-I673 HydrophobicContact CD2-CG1 3.64Å; F667-I673 HydrophobicContact CE1-CG1 4.22Å; F667-I673 HydrophobicContact CE2-CD1 3.88Å; F667-I673 HydrophobicContact CE2-CG1 3.98Å; F667-I673 HydrophobicContact CG-CD1 4.04Å; F667-I673 HydrophobicContact CG-CG1 3.58Å; F667-I673 HydrophobicContact CZ-CG1 4.25Å; F667-F681 AromaticContact CE1-CD1 3.92Å; F667-F681 HydrophobicContact CE1-CD1 3.92Å; F667-F681 HydrophobicContact CE1-CE1 4.06Å; F667-F681 HydrophobicContact CE1-CG 4.42Å; F667-F681 HydrophobicContact CE2-CD1 4.11Å; F667-F681 AromaticContact CE2-CE1 3.5Å; F667-F681 HydrophobicContact CE2-CE1 3.5Å; F667-F681 HydrophobicContact CE2-CZ 4.1Å; F667-F681 AromaticContact CZ-CD1 3.54Å; F667-F681 HydrophobicContact CZ-CD1 3.54Å; F667-F681 AromaticContact CZ-CE1 3.2Å; F667-F681 HydrophobicContact CZ-CE1 3.2Å; F667-F681 HydrophobicContact CZ-CE2 4.31Å; F667-F681 HydrophobicContact CZ-CG 4.25Å; F667-F681 AromaticContact CZ-CZ 3.64Å; F667-F681 HydrophobicContact CZ-CZ 3.64Å; F667-L744 HydrophobicContact CE2-CD2 3.56Å; F667-L744 HydrophobicContact CZ-CB 4.03Å; F667-L744 HydrophobicContact CZ-CD2 3.61Å; F667-L744 HydrophobicContact CZ-CG 4.48Å
668	N	92.3	Very high	92.6	Very high	90 Å²	90	44.2 Å²	44.2	48%	0.481	24%	0.243	S	C	.	.	S	Bend	trans	-62.7	-28.3	179.8	-74.8	1.7	0	0	0	113.6	N587 S588 P657	N587-N668 PolarHBondContact O-ND2 3.31Å; S588-N668 VanDerWaalsContact OG-CG 3.3Å; S588-N668 PolarHBondContact OG-ND2 2.79Å; S588-N668 PolarHBondContact OG-OD1 2.89Å; P657-N668 WeakPolarHBondContact CA-O 3.18Å
669	S	94.3	Very high	92.5	Very high	26 Å²	26	44.3 Å²	44.3	18%	0.182	24%	0.243	C	C	.	.			trans	-153.7	156.8	167.8	68.5	0	0	0	0	111.9	D655 L656 F667 K671 G672	D655-S669 WeakPolarHBondContact O-CB 3.41Å; L656-S669 WeakPolarHBondContact O-CA 3.37Å; F667-S669 PolarHBondContact O-N 2.85Å; S669-K671 VanDerWaalsContact C-N 3.34Å; S669-K671 PolarHBondContact O-N 2.85Å; S669-G672 PolarHBondContact O-N 2.72Å; S669-G672 VanDerWaalsContact O-N 3.14Å; S669-G672 PolarHBondContact OG-N 3.07Å; S669-G672 VanDerWaalsContact OG-N 3.13Å
670	W	95.3	Very high	92.4	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-43.8	173.5	171.3	-95.7	0	0	0	111.9	L598 F637 L645 D646 I648 V649 R654 L656 V658 G672 I673 F674 V761	L598-W670 HydrophobicContact CD1-CB 3.9Å; L598-W670 HydrophobicContact CD1-CG 4.49Å; F637-W670 AromaticContact CD2-CH2 3.7Å; F637-W670 HydrophobicContact CD2-CH2 3.7Å; F637-W670 AromaticContact CD2-CZ3 3.9Å; F637-W670 HydrophobicContact CD2-CZ3 3.9Å; F637-W670 AromaticContact CE2-CH2 3.57Å; F637-W670 HydrophobicContact CE2-CH2 3.57Å; F637-W670 AromaticContact CE2-CZ3 3.64Å; F637-W670 HydrophobicContact CE2-CZ3 3.64Å; L645-W670 VanDerWaalsContact O-CZ2 3.3Å; L645-W670 WeakPolarHBondContact O-CZ2 3.34Å; D646-W670 PolarHBondContact O-NE1 3.36Å; I648-W670 HydrophobicContact CB-CZ2 4.16Å; V649-W670 HydrophobicContact CB-CD2 4.08Å; V649-W670 HydrophobicContact CB-CG 4.12Å; V649-W670 HydrophobicContact CB-CZ2 4.27Å; V649-W670 HydrophobicContact CG1-CG 4.39Å; V649-W670 HydrophobicContact CG2-CD2 3.61Å; V649-W670 VanDerWaalsContact CG2-CE2 3.47Å; V649-W670 HydrophobicContact CG2-CE3 3.98Å; V649-W670 HydrophobicContact CG2-CG 4.09Å; V649-W670 HydrophobicContact CG2-CH2 4.11Å; V649-W670 HydrophobicContact CG2-CZ2 3.72Å; V649-W670 HydrophobicContact CG2-CZ3 4.24Å; R654-W670 WeakPolarHBondContact O-CB 3.26Å; R654-W670 PolarHBondContact O-N 2.92Å; L656-W670 PolarHBondContact O-N 3.22Å; V658-W670 HydrophobicContact CG2-CB 3.89Å; V658-W670 HydrophobicContact CG2-CE3 4.21Å; W670-G672 PolarHBondContact O-N 2.91Å; W670-I673 HydrophobicContact CE3-CD1 3.83Å; W670-I673 HydrophobicContact CZ3-CD1 4.24Å; W670-I673 WeakPolarHBondContact O-CB 3.01Å; W670-I673 PolarHBondContact O-N 2.91Å; W670-I673 VanDerWaalsContact O-N 3.14Å; W670-F674 AromaticContact CD2-CE2 3.81Å; W670-F674 HydrophobicContact CD2-CE2 3.81Å; W670-F674 AromaticContact CE2-CE2 3.44Å; W670-F674 VanDerWaalsContact CE2-CE2 3.44Å; W670-F674 HydrophobicContact CE3-CE2 4.31Å; W670-F674 HydrophobicContact CG-CE2 4.24Å; W670-F674 HydrophobicContact CH2-CE2 4.22Å; W670-F674 AromaticContact CH2-CZ 4Å; W670-F674 HydrophobicContact CH2-CZ 4Å; W670-F674 AromaticContact CZ2-CE2 3.71Å; W670-F674 HydrophobicContact CZ2-CE2 3.71Å; W670-F674 AromaticContact CZ2-CZ 3.76Å; W670-F674 HydrophobicContact CZ2-CZ 3.76Å; W670-F674 HydrophobicContact CZ3-CE2 4.48Å; W670-F674 HydrophobicContact CZ3-CZ 4.46Å; W670-F674 AromaticContact NE1-CE2 3.6Å; W670-F674 VanDerWaalsContact O-CD2 3.25Å; W670-F674 WeakPolarHBondContact O-CD2 3.36Å; W670-F674 WeakPolarHBondContact O-CE2 3.21Å; W670-V761 HydrophobicContact CE3-CG2 4.16Å; W670-V761 HydrophobicContact CH2-CB 4.34Å; W670-V761 HydrophobicContact CH2-CG1 4.01Å; W670-V761 HydrophobicContact CH2-CG2 4.03Å; W670-V761 HydrophobicContact CZ3-CB 4.12Å; W670-V761 HydrophobicContact CZ3-CG1 4.3Å; W670-V761 HydrophobicContact CZ3-CG2 3.59Å
671	K	94.1	Very high	92.2	Very high	133 Å²	133	50 Å²	50	58%	0.578	27%	0.268	S	S	*	.	H	α-helix	trans	-57	-33.1	174	-172.9	179.4	-179.7	-179.2	0	112.9	R654 D655 S669 I673 F674	R654-K671 HydrophobicContact CB-CB 4.48Å; R654-K671 PolarHBondContact O-N 2.83Å; D655-K671 WeakPolarHBondContact OD1-CD 3.49Å; S669-K671 VanDerWaalsContact C-N 3.34Å; S669-K671 PolarHBondContact O-N 2.85Å; K671-I673 VanDerWaalsContact C-N 3.27Å; K671-I673 PolarHBondContact O-N 2.54Å; K671-F674 PolarHBondContact O-N 2.88Å
672	G	92.9	Very high	91.9	Very high	33 Å²	33	53.4 Å²	53.4	34%	0.34	29%	0.293	S	S	.	.	H	α-helix	trans	-63.6	-26.6	177.9	0	0	0	0	0	114.6	S669 W670 F674	S669-G672 PolarHBondContact O-N 2.72Å; S669-G672 VanDerWaalsContact O-N 3.14Å; S669-G672 PolarHBondContact OG-N 3.07Å; S669-G672 VanDerWaalsContact OG-N 3.13Å; W670-G672 PolarHBondContact O-N 2.91Å; G672-F674 VanDerWaalsContact C-N 3.28Å; G672-F674 PolarHBondContact O-N 2.76Å
673	I	95.1	Very high	91.6	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-37.2	177.5	-58.8	172.8	0	0	0	111	V658 F667 W670 K671 N675 G679 L744 L745	V658-I673 HydrophobicContact CG2-CD1 4.19Å; F667-I673 HydrophobicContact CB-CG1 4.05Å; F667-I673 HydrophobicContact CD1-CG1 3.9Å; F667-I673 HydrophobicContact CD2-CD1 3.58Å; F667-I673 HydrophobicContact CD2-CG1 3.64Å; F667-I673 HydrophobicContact CE1-CG1 4.22Å; F667-I673 HydrophobicContact CE2-CD1 3.88Å; F667-I673 HydrophobicContact CE2-CG1 3.98Å; F667-I673 HydrophobicContact CG-CD1 4.04Å; F667-I673 HydrophobicContact CG-CG1 3.58Å; F667-I673 HydrophobicContact CZ-CG1 4.25Å; W670-I673 HydrophobicContact CE3-CD1 3.83Å; W670-I673 HydrophobicContact CZ3-CD1 4.24Å; W670-I673 WeakPolarHBondContact O-CB 3.01Å; W670-I673 PolarHBondContact O-N 2.91Å; W670-I673 VanDerWaalsContact O-N 3.14Å; K671-I673 VanDerWaalsContact C-N 3.27Å; K671-I673 PolarHBondContact O-N 2.54Å; I673-N675 PolarHBondContact O-N 3.17Å; I673-G679 VanDerWaalsContact O-CA 3.31Å; I673-G679 WeakPolarHBondContact O-CA 3.32Å; I673-G679 PolarHBondContact O-N 3.48Å; I673-G679 VanDerWaalsContact O-N 3.12Å; I673-L744 HydrophobicContact CD1-CD2 4.49Å; I673-L744 HydrophobicContact CG2-CD2 4.12Å; I673-L745 HydrophobicContact CG2-CD1 4.02Å; I673-L745 HydrophobicContact CG2-CG 4.47Å
674	F	95.8	Very high	91.5	Very high	23 Å²	23	52.4 Å²	52.4	10%	0.101	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	22.5	-168.9	-54.2	-71	0	0	0	113.4	F637 L645 D646 W670 K671 G672 G676 L745	F637-F674 HydrophobicContact CE2-CZ 4.11Å; F637-F674 HydrophobicContact CZ-CZ 4.34Å; L645-F674 HydrophobicContact CB-CE1 4.25Å; L645-F674 HydrophobicContact CD2-CE1 3.93Å; L645-F674 HydrophobicContact CG-CE1 3.86Å; L645-F674 HydrophobicContact CG-CZ 4.14Å; D646-F674 HydrophobicContact CB-CB 4.47Å; D646-F674 HydrophobicContact CB-CD1 4.25Å; D646-F674 HydrophobicContact CB-CD2 3.96Å; D646-F674 HydrophobicContact CB-CE2 4.29Å; D646-F674 HydrophobicContact CB-CG 3.93Å; W670-F674 AromaticContact CD2-CE2 3.81Å; W670-F674 HydrophobicContact CD2-CE2 3.81Å; W670-F674 AromaticContact CE2-CE2 3.44Å; W670-F674 VanDerWaalsContact CE2-CE2 3.44Å; W670-F674 HydrophobicContact CE3-CE2 4.31Å; W670-F674 HydrophobicContact CG-CE2 4.24Å; W670-F674 HydrophobicContact CH2-CE2 4.22Å; W670-F674 AromaticContact CH2-CZ 4Å; W670-F674 HydrophobicContact CH2-CZ 4Å; W670-F674 AromaticContact CZ2-CE2 3.71Å; W670-F674 HydrophobicContact CZ2-CE2 3.71Å; W670-F674 AromaticContact CZ2-CZ 3.76Å; W670-F674 HydrophobicContact CZ2-CZ 3.76Å; W670-F674 HydrophobicContact CZ3-CE2 4.48Å; W670-F674 HydrophobicContact CZ3-CZ 4.46Å; W670-F674 AromaticContact NE1-CE2 3.6Å; W670-F674 VanDerWaalsContact O-CD2 3.25Å; W670-F674 WeakPolarHBondContact O-CD2 3.36Å; W670-F674 WeakPolarHBondContact O-CE2 3.21Å; K671-F674 PolarHBondContact O-N 2.88Å; G672-F674 VanDerWaalsContact C-N 3.28Å; G672-F674 PolarHBondContact O-N 2.76Å; F674-G676 PolarHBondContact O-N 2.91Å; F674-L745 HydrophobicContact CD1-CD1 3.63Å; F674-L745 HydrophobicContact CE1-CD1 3.7Å
675	N	91.8	Very high	91.3	Very high	87 Å²	87	50.6 Å²	50.6	47%	0.465	29%	0.289	S	S	.	.	S	Bend	trans	-72.3	8.9	-179.7	75.2	-9.5	0	0	0	114.7	I673 Q677	I673-N675 PolarHBondContact O-N 3.17Å; N675-Q677 VanDerWaalsContact C-N 3.3Å; N675-Q677 PolarHBondContact ND2-OE1 3.26Å; N675-Q677 PolarHBondContact O-N 3.18Å; N675-Q677 VanDerWaalsContact OD1-CB 3.23Å; N675-Q677 WeakPolarHBondContact OD1-CB 3.35Å; N675-Q677 PolarHBondContact OD1-N 3.35Å
676	G	89.1	Confident	91.3	Very high	44 Å²	44	52.5 Å²	52.5	45%	0.454	29%	0.291	S	S	.	.	S	Bend	trans	84.3	-12.8	-176.2	0	0	0	0	0	115.3	F674 G678 P712	F674-G676 PolarHBondContact O-N 2.91Å; G676-G678 VanDerWaalsContact C-N 3.26Å; G676-G678 PolarHBondContact O-N 3.06Å; G676-P712 PolarHBondContact N-O 2.93Å; G676-P712 WeakPolarHBondContact O-CB 3.09Å
677	Q	89.5	Confident	91.4	Very high	137 Å²	137	51.8 Å²	51.8	64%	0.64	29%	0.287	S	S	*	.	S	Bend	trans	-82.5	-2	178.9	-57.3	178.5	-34.1	0	0	113.4	N675	N675-Q677 VanDerWaalsContact C-N 3.3Å; N675-Q677 PolarHBondContact ND2-OE1 3.26Å; N675-Q677 PolarHBondContact O-N 3.18Å; N675-Q677 VanDerWaalsContact OD1-CB 3.23Å; N675-Q677 WeakPolarHBondContact OD1-CB 3.35Å; N675-Q677 PolarHBondContact OD1-N 3.35Å
678	G	88.2	Confident	91.5	Very high	3 Å²	3	52 Å²	52	3%	0.031	29%	0.287	C	S	.	.			trans	86.8	27.2	175.9	0	0	0	0	0	114.9	G676 L744 L745	G676-G678 VanDerWaalsContact C-N 3.26Å; G676-G678 PolarHBondContact O-N 3.06Å; G678-L744 PolarHBondContact O-N 3.41Å; G678-L744 VanDerWaalsContact O-N 3.1Å; G678-L745 PolarHBondContact O-N 2.69Å
679	G	91.8	Very high	91.8	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.01	27%	0.265	C	S	.	.			trans	59.5	63.8	179	0	0	0	0	0	112.9	I673 L744	I673-G679 VanDerWaalsContact O-CA 3.31Å; I673-G679 WeakPolarHBondContact O-CA 3.32Å; I673-G679 PolarHBondContact O-N 3.48Å; I673-G679 VanDerWaalsContact O-N 3.12Å; G679-L744 WeakPolarHBondContact O-CB 3.04Å; G679-L744 PolarHBondContact O-N 2.94Å
680	F	93.1	Very high	91.9	Very high	117 Å²	117	47.3 Å²	47.3	51%	0.513	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-71.9	131.6	-178.4	-178.2	-102.5	0	0	0	112.2	H742 K743	F680-H742 CarbonylContact C-O 3.57Å; F680-H742 WeakPolarHBondContact CA-O 3.33Å; F680-H742 HydrophobicContact CD2-CB 4.21Å; F680-H742 WeakPolarHBondContact CD2-O 3.04Å; F680-H742 HydrophobicContact CE2-CB 3.71Å; F680-H742 HydrophobicContact CZ-CB 4.35Å; F680-K743 HydrophobicContact CD2-CG 4.35Å
681	F	90.7	Very high	92	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.018	28%	0.281	C	S	.	.			trans	-87.3	126.1	173.3	-63.2	-79.4	0	0	0	110.4	L666 F667 Q683 P685 I687 L739 H742 L744	L666-F681 HydrophobicContact CB-CE1 4.38Å; F667-F681 AromaticContact CE1-CD1 3.92Å; F667-F681 HydrophobicContact CE1-CD1 3.92Å; F667-F681 HydrophobicContact CE1-CE1 4.06Å; F667-F681 HydrophobicContact CE1-CG 4.42Å; F667-F681 HydrophobicContact CE2-CD1 4.11Å; F667-F681 AromaticContact CE2-CE1 3.5Å; F667-F681 HydrophobicContact CE2-CE1 3.5Å; F667-F681 HydrophobicContact CE2-CZ 4.1Å; F667-F681 AromaticContact CZ-CD1 3.54Å; F667-F681 HydrophobicContact CZ-CD1 3.54Å; F667-F681 AromaticContact CZ-CE1 3.2Å; F667-F681 HydrophobicContact CZ-CE1 3.2Å; F667-F681 HydrophobicContact CZ-CE2 4.31Å; F667-F681 HydrophobicContact CZ-CG 4.25Å; F667-F681 AromaticContact CZ-CZ 3.64Å; F667-F681 HydrophobicContact CZ-CZ 3.64Å; F681-Q683 WeakPolarHBondContact CB-O 3.39Å; F681-Q683 PolarHBondContact O-N 3Å; F681-P685 HydrophobicContact CD1-CB 3.87Å; F681-P685 HydrophobicContact CD2-CB 3.83Å; F681-P685 HydrophobicContact CD2-CG 4.09Å; F681-P685 HydrophobicContact CE1-CB 3.84Å; F681-P685 HydrophobicContact CE2-CB 3.83Å; F681-P685 HydrophobicContact CE2-CG 4.2Å; F681-P685 HydrophobicContact CG-CB 3.85Å; F681-P685 HydrophobicContact CG-CG 4.45Å; F681-P685 HydrophobicContact CZ-CB 3.82Å; F681-I687 HydrophobicContact CZ-CD1 4.07Å; F681-L739 HydrophobicContact CE2-CD2 3.76Å; F681-L739 HydrophobicContact CZ-CD2 4.17Å; F681-H742 PolarHBondContact N-O 3.21Å; F681-L744 HydrophobicContact CE2-CB 3.91Å; F681-L744 HydrophobicContact CZ-CB 3.95Å; F681-L744 HydrophobicContact CZ-CD1 4.3Å; F681-L744 HydrophobicContact CZ-CD2 4.35Å; F681-L744 HydrophobicContact CZ-CG 4.43Å
682	S	84.6	Confident	92	Very high	99 Å²	99	45.3 Å²	45.3	69%	0.692	27%	0.267	S	S	*	.	S	Bend	trans	-69.2	-9.6	178.8	56.6	0	0	0	0	114.8
683	Q	85.4	Confident	92.2	Very high	102 Å²	102	47.5 Å²	47.5	48%	0.477	27%	0.267	S	S	.	.	S	Bend	trans	-145.9	-178.3	178.7	-62.3	-175.1	0.2	0	0	109.1	F681 H742	F681-Q683 WeakPolarHBondContact CB-O 3.39Å; F681-Q683 PolarHBondContact O-N 3Å; Q683-H742 PolarHBondContact O-ND1 3.28Å
684	A	85.7	Confident	92.2	Very high	67 Å²	67	49 Å²	49	55%	0.554	28%	0.275	S	S	*	.	S	Bend	trans	-62.1	128.6	168.7	0	0	0	0	0	110.4	R686	A684-R686 PolarHBondContact O-N 3.39Å
685	P	87.8	Confident	92.2	Very high	5 Å²	5	48 Å²	48	3%	0.032	27%	0.27	C	S	.	.			trans	-70.5	102	-171.6	25.4	-33.4	0	0	0	112.4	F681 I687 M696 L739	F681-P685 HydrophobicContact CD1-CB 3.87Å; F681-P685 HydrophobicContact CD2-CB 3.83Å; F681-P685 HydrophobicContact CD2-CG 4.09Å; F681-P685 HydrophobicContact CE1-CB 3.84Å; F681-P685 HydrophobicContact CE2-CB 3.83Å; F681-P685 HydrophobicContact CE2-CG 4.2Å; F681-P685 HydrophobicContact CG-CB 3.85Å; F681-P685 HydrophobicContact CG-CG 4.45Å; F681-P685 HydrophobicContact CZ-CB 3.82Å; P685-I687 HydrophobicContact CB-CD1 4.12Å; P685-I687 HydrophobicContact CB-CG1 4.2Å; P685-I687 PolarHBondContact O-N 2.88Å; P685-M696 HydrophobicContact CG-CE 4.4Å; P685-M696 HydrophobicContact CG-CG 4.44Å; P685-M696 HydrophobicContact CG-SD 4.21Å; P685-M696 WeakPolarHBondContact O-CG 3.26Å; P685-L739 HydrophobicContact CG-CB 4Å; P685-L739 HydrophobicContact CG-CD2 4.38Å
686	R	91.7	Very high	92.4	Very high	95 Å²	95	45.6 Å²	45.6	36%	0.358	26%	0.257	S	S	.	.			trans	-77.8	66.9	177.1	-64.9	-172.5	-70.3	125.7	1.4	111.5	N660 D664 A684 Y688	N660-R686 WeakPolarHBondContact CB-O 3.28Å; N660-R686 PolarHBondContact ND2-O 2.88Å; D664-R686 VanDerWaalsContact CG-CZ 3.46Å; D664-R686 VanDerWaalsContact CG-NH2 3.28Å; D664-R686 IonicContact OD1-CZ 2.72Å; D664-R686 IonicContact OD1-NH1 3.24Å; D664-R686 PolarHBondContact OD1-NH1 2.03Å; D664-R686 IonicContact OD1-NH2 2.62Å; D664-R686 PolarHBondContact OD1-NH2 3.11Å; D664-R686 IonicContact OD2-CZ 3.16Å; D664-R686 IonicContact OD2-NH1 2.73Å; D664-R686 PolarHBondContact OD2-NH1 3.44Å; D664-R686 IonicContact OD2-NH2 2.76Å; A684-R686 PolarHBondContact O-N 3.39Å; R686-Y688 HydrophobicContact CB-CE2 4.24Å; R686-Y688 WeakPolarHBondContact O-CD2 3.1Å; R686-Y688 WeakPolarHBondContact O-CE2 3.1Å
687	I	96	Very high	92.6	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.268	C	S	.	.			trans	-87.8	131.3	179.3	-64.1	174.1	0	0	0	110	A602 L666 F681 P685 N694 V695 L739 L759	A602-I687 HydrophobicContact CB-CG2 4.42Å; L666-I687 HydrophobicContact CD1-CG1 4.26Å; F681-I687 HydrophobicContact CZ-CD1 4.07Å; P685-I687 HydrophobicContact CB-CD1 4.12Å; P685-I687 HydrophobicContact CB-CG1 4.2Å; P685-I687 PolarHBondContact O-N 2.88Å; I687-N694 PolarHBondContact O-OD1 3.11Å; I687-V695 HydrophobicContact CG2-CB 4.42Å; I687-V695 HydrophobicContact CG2-CG2 4.11Å; I687-V695 PolarHBondContact O-N 2.56Å; I687-L739 HydrophobicContact CD1-CD1 4.01Å; I687-L739 HydrophobicContact CD1-CD2 4.03Å; I687-L759 HydrophobicContact CD1-CD1 4.15Å; I687-L759 HydrophobicContact CD1-CD2 4.45Å; I687-L759 HydrophobicContact CG2-CD2 3.7Å
688	Y	97.3	Very high	93	Very high	23 Å²	23	43.8 Å²	43.8	9%	0.09	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-117.2	146.5	179.5	-64.9	-82.3	0	0	0	111.5	A601 A602 N660 T661 R662 R686 G692 K693 N694	A601-Y688 CarbonylContact C-O 3.45Å; A601-Y688 WeakPolarHBondContact CA-O 3.29Å; A602-Y688 PolarHBondContact N-O 2.74Å; N660-Y688 HydrophobicContact CB-CD2 4.25Å; N660-Y688 WeakPolarHBondContact ND2-CD2 3.25Å; N660-Y688 VanDerWaalsContact ND2-CE2 3.31Å; N660-Y688 WeakPolarHBondContact ND2-CE2 3.45Å; T661-Y688 WeakPolarHBondContact OG1-CB 3.31Å; R662-Y688 HydrophobicContact CG-CD2 3.93Å; R662-Y688 HydrophobicContact CG-CE2 4Å; R662-Y688 HydrophobicContact CG-CG 4.41Å; R662-Y688 VanDerWaalsContact NE-CZ 3.29Å; R662-Y688 VanDerWaalsContact NH2-CE1 3.3Å; R686-Y688 HydrophobicContact CB-CE2 4.24Å; R686-Y688 WeakPolarHBondContact O-CD2 3.1Å; R686-Y688 WeakPolarHBondContact O-CE2 3.1Å; Y688-G692 WeakPolarHBondContact CD1-O 3.47Å; Y688-K693 CarbonylContact C-O 3.51Å; Y688-K693 WeakPolarHBondContact CA-O 3.29Å; Y688-N694 HydrophobicContact CD1-CB 3.96Å; Y688-N694 HydrophobicContact CE1-CB 3.64Å
689	S	98	Very high	93.4	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.007	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-70.4	168.4	169.1	66.9	0	0	0	0	112.1	A602 S691 G692 K693	A602-S689 CarbonylContact O-C 3.59Å; A602-S689 VanDerWaalsContact O-CA 3.31Å; A602-S689 WeakPolarHBondContact O-CA 3.19Å; S689-S691 PolarHBondContact O-N 3.16Å; S689-S691 PolarHBondContact OG-N 3.4Å; S689-S691 PolarHBondContact OG-OG 3.5Å; S689-G692 PolarHBondContact O-N 3.15Å; S689-G692 PolarHBondContact OG-N 3.1Å; S689-K693 PolarHBondContact N-O 3.39Å; S689-K693 WeakPolarHBondContact OG-CB 3.38Å; S689-K693 PolarHBondContact OG-N 3.38Å; S689-K693 VanDerWaalsContact OG-N 3.15Å
690	F	97.3	Very high	93.6	Very high	16 Å²	16	50.9 Å²	50.9	7%	0.07	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-26	166.7	-70.3	-63.5	0	0	0	113.1	A601 A602 L603 N604 Q624 G625 A628 L630 F634 G692 C760	A601-F690 HydrophobicContact CB-CD1 3.62Å; A601-F690 HydrophobicContact CB-CD2 4.28Å; A601-F690 HydrophobicContact CB-CE1 3.42Å; A601-F690 VanDerWaalsContact CB-CE1 3.42Å; A601-F690 HydrophobicContact CB-CE2 4.13Å; A601-F690 HydrophobicContact CB-CG 4.07Å; A601-F690 HydrophobicContact CB-CZ 3.72Å; A602-F690 VanDerWaalsContact O-CD2 3.28Å; A602-F690 WeakPolarHBondContact O-CD2 3.48Å; A602-F690 PolarHBondContact O-N 3.3Å; L603-F690 HydrophobicContact CD2-CD2 4.48Å; L603-F690 HydrophobicContact CD2-CE2 4.24Å; N604-F690 WeakPolarHBondContact OD1-CB 3.29Å; N604-F690 PolarHBondContact OD1-N 3.42Å; Q624-F690 HydrophobicContact CB-CB 4.09Å; Q624-F690 HydrophobicContact CB-CD2 3.38Å; Q624-F690 HydrophobicContact CB-CE2 3.94Å; Q624-F690 HydrophobicContact CB-CG 3.92Å; G625-F690 VanDerWaalsContact CA-CD1 3.5Å; A628-F690 HydrophobicContact CB-CB 4Å; A628-F690 HydrophobicContact CB-CD1 4.2Å; A628-F690 VanDerWaalsContact CB-O 3.26Å; A628-F690 WeakPolarHBondContact CB-O 3.36Å; L630-F690 HydrophobicContact CD1-CD1 3.94Å; L630-F690 HydrophobicContact CD1-CE1 3.97Å; F634-F690 HydrophobicContact CB-CZ 4.19Å; F634-F690 HydrophobicContact CD1-CE1 4Å; F634-F690 AromaticContact CD1-CZ 3.86Å; F634-F690 HydrophobicContact CD1-CZ 3.86Å; F634-F690 HydrophobicContact CD2-CE1 4.21Å; F634-F690 HydrophobicContact CD2-CZ 4.36Å; F634-F690 HydrophobicContact CE1-CE1 4.1Å; F634-F690 HydrophobicContact CE1-CZ 4.41Å; F634-F690 HydrophobicContact CE2-CE1 4.32Å; F634-F690 HydrophobicContact CG-CE1 4.07Å; F634-F690 AromaticContact CG-CZ 3.85Å; F634-F690 HydrophobicContact CG-CZ 3.85Å; F634-F690 HydrophobicContact CZ-CE1 4.28Å; F690-G692 VanDerWaalsContact C-N 3.28Å; F690-G692 PolarHBondContact O-N 3.31Å; F690-C760 HydrophobicContact CE2-CB 3.76Å; F690-C760 HydrophobicContact CZ-CB 3.68Å
691	S	95.4	Very high	93.8	Very high	64 Å²	64	45.3 Å²	45.3	45%	0.448	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	4.3	170.2	55.5	0	0	0	0	114.6	N604 S689 K693	N604-S691 PolarHBondContact OD1-N 3.04Å; N604-S691 PolarHBondContact OD1-OG 3.03Å; S689-S691 PolarHBondContact O-N 3.16Å; S689-S691 PolarHBondContact OG-N 3.4Å; S689-S691 PolarHBondContact OG-OG 3.5Å; S691-K693 VanDerWaalsContact C-N 3.28Å; S691-K693 PolarHBondContact O-N 3.29Å
692	G	95.3	Very high	94	Very high	28 Å²	28	50 Å²	50	29%	0.289	30%	0.299	S	S	.	.			trans	79.1	-0.8	174.8	0	0	0	0	0	116.1	R662 Y688 S689 F690	R662-G692 PolarHBondContact NH2-O 2.9Å; Y688-G692 WeakPolarHBondContact CD1-O 3.47Å; S689-G692 PolarHBondContact O-N 3.15Å; S689-G692 PolarHBondContact OG-N 3.1Å; F690-G692 VanDerWaalsContact C-N 3.28Å; F690-G692 PolarHBondContact O-N 3.31Å
693	K	96.4	Very high	94.5	Very high	78 Å²	78	48.7 Å²	48.7	34%	0.339	28%	0.283	S	S	.	.			trans	-65.6	140.2	173.3	-68.3	171.1	156	-107.7	0	110.3	Y688 S689 S691 V695 D698 T700 W701	Y688-K693 CarbonylContact C-O 3.51Å; Y688-K693 WeakPolarHBondContact CA-O 3.29Å; S689-K693 PolarHBondContact N-O 3.39Å; S689-K693 WeakPolarHBondContact OG-CB 3.38Å; S689-K693 PolarHBondContact OG-N 3.38Å; S689-K693 VanDerWaalsContact OG-N 3.15Å; S691-K693 VanDerWaalsContact C-N 3.28Å; S691-K693 PolarHBondContact O-N 3.29Å; K693-V695 PolarHBondContact O-N 2.85Å; K693-D698 HydrophobicContact CB-CB 4.36Å; K693-D698 VanDerWaalsContact CD-OD2 3.22Å; K693-D698 WeakPolarHBondContact CD-OD2 3.28Å; K693-D698 WeakPolarHBondContact CE-OD2 3.24Å; K693-D698 VanDerWaalsContact CG-OD2 3.26Å; K693-D698 WeakPolarHBondContact CG-OD2 3.44Å; K693-D698 VanDerWaalsContact NZ-CG 3.27Å; K693-D698 IonicContact NZ-OD1 3.53Å; K693-D698 PolarHBondContact NZ-OD1 3.2Å; K693-D698 VanDerWaalsContact NZ-OD1 3.07Å; K693-D698 IonicContact NZ-OD2 3.91Å; K693-D698 PolarHBondContact NZ-OD2 3.32Å; K693-T700 PolarHBondContact NZ-OG1 3.35Å; K693-W701 HydrophobicContact CB-CH2 3.98Å; K693-W701 HydrophobicContact CB-CZ3 3.89Å; K693-W701 HydrophobicContact CD-CH2 3.93Å; K693-W701 HydrophobicContact CD-CZ3 4.03Å
694	N	95.9	Very high	95	Very high	35 Å²	35	45.4 Å²	45.4	19%	0.187	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-80.6	116.5	172.3	178	5.4	0	0	0	109.5	I687 Y688 M696 T697 D698	I687-N694 PolarHBondContact O-OD1 3.11Å; Y688-N694 HydrophobicContact CD1-CB 3.96Å; Y688-N694 HydrophobicContact CE1-CB 3.64Å; N694-M696 PolarHBondContact O-N 3.01Å; N694-M696 PolarHBondContact OD1-N 3.28Å; N694-M696 VanDerWaalsContact OD1-N 3.11Å; N694-T697 WeakPolarHBondContact CB-OG1 3.28Å; N694-T697 PolarHBondContact ND2-OG1 3.1Å; N694-T697 PolarHBondContact O-N 2.92Å; N694-D698 WeakPolarHBondContact O-CB 3.16Å; N694-D698 PolarHBondContact O-N 3.03Å
695	V	96.2	Very high	95.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-30	-174.5	-179.2	0	0	0	0	112	A602 I687 K693 W701 K704 I757	A602-V695 HydrophobicContact CB-CG2 3.59Å; I687-V695 HydrophobicContact CG2-CB 4.42Å; I687-V695 HydrophobicContact CG2-CG2 4.11Å; I687-V695 PolarHBondContact O-N 2.56Å; K693-V695 PolarHBondContact O-N 2.85Å; V695-W701 HydrophobicContact CB-CD2 4.46Å; V695-W701 HydrophobicContact CB-CE3 4.36Å; V695-W701 HydrophobicContact CG1-CB 4.19Å; V695-W701 HydrophobicContact CG1-CD2 3.88Å; V695-W701 HydrophobicContact CG1-CE3 4.2Å; V695-W701 HydrophobicContact CG1-CG 3.85Å; V695-W701 HydrophobicContact CG2-CD2 4.4Å; V695-W701 HydrophobicContact CG2-CE3 4.36Å; V695-W701 HydrophobicContact CG2-CH2 4.36Å; V695-W701 HydrophobicContact CG2-CZ2 4.35Å; V695-W701 HydrophobicContact CG2-CZ3 4.35Å; V695-K704 PolarHBondContact O-NZ 3.38Å; V695-I757 HydrophobicContact CG1-CB 4.49Å; V695-I757 HydrophobicContact CG1-CD1 3.33Å; V695-I757 HydrophobicContact CG1-CG1 3.59Å; V695-I757 HydrophobicContact CG1-CG2 4.04Å
696	M	94.3	Very high	96	Very high	38 Å²	38	42.3 Å²	42.3	19%	0.187	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-31.9	179	-62.5	-52.9	-68	0	0	113.2	P685 N694 K704 L739 D740	P685-M696 HydrophobicContact CG-CE 4.4Å; P685-M696 HydrophobicContact CG-CG 4.44Å; P685-M696 HydrophobicContact CG-SD 4.21Å; P685-M696 WeakPolarHBondContact O-CG 3.26Å; N694-M696 PolarHBondContact O-N 3.01Å; N694-M696 PolarHBondContact OD1-N 3.28Å; N694-M696 VanDerWaalsContact OD1-N 3.11Å; M696-K704 HydrophobicContact CE-CB 4.2Å; M696-K704 HydrophobicContact CE-CG 4.45Å; M696-K704 WeakPolarHBondContact O-CE 3.42Å; M696-K704 PolarHBondContact O-NZ 3.23Å; M696-K704 VanDerWaalsContact O-NZ 3.17Å; M696-L739 HydrophobicContact CE-CB 3.7Å; M696-L739 HydrophobicContact SD-CB 3.52Å; M696-L739 VanDerWaalsContact SD-CB 3.52Å; M696-L739 HydrophobicContact SD-CD1 3.53Å; M696-L739 VanDerWaalsContact SD-CD1 3.53Å; M696-L739 HydrophobicContact SD-CG 4.19Å; M696-D740 WeakPolarHBondContact CE-OD1 3.25Å
697	T	95.2	Very high	96.3	Very high	111 Å²	111	37.8 Å²	37.8	68%	0.681	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-22	-174.1	58.4	0	0	0	0	113.9	N694	N694-T697 WeakPolarHBondContact CB-OG1 3.28Å; N694-T697 PolarHBondContact ND2-OG1 3.1Å; N694-T697 PolarHBondContact O-N 2.92Å
698	D	96.5	Very high	96.3	Very high	32 Å²	32	37.8 Å²	37.8	17%	0.171	22%	0.224	C	C	.	.			trans	-78.5	137.9	-178.9	-168.3	-60.7	0	0	0	111.5	K693 N694 T700 W701 K704	K693-D698 HydrophobicContact CB-CB 4.36Å; K693-D698 VanDerWaalsContact CD-OD2 3.22Å; K693-D698 WeakPolarHBondContact CD-OD2 3.28Å; K693-D698 WeakPolarHBondContact CE-OD2 3.24Å; K693-D698 VanDerWaalsContact CG-OD2 3.26Å; K693-D698 WeakPolarHBondContact CG-OD2 3.44Å; K693-D698 VanDerWaalsContact NZ-CG 3.27Å; K693-D698 IonicContact NZ-OD1 3.53Å; K693-D698 PolarHBondContact NZ-OD1 3.2Å; K693-D698 VanDerWaalsContact NZ-OD1 3.07Å; K693-D698 IonicContact NZ-OD2 3.91Å; K693-D698 PolarHBondContact NZ-OD2 3.32Å; N694-D698 WeakPolarHBondContact O-CB 3.16Å; N694-D698 PolarHBondContact O-N 3.03Å; D698-T700 VanDerWaalsContact C-N 3.26Å; D698-T700 PolarHBondContact O-N 3.11Å; D698-T700 WeakPolarHBondContact OD1-CB 3.39Å; D698-T700 PolarHBondContact OD1-N 3.34Å; D698-T700 PolarHBondContact OD1-OG1 3.35Å; D698-W701 HydrophobicContact CB-CE3 4.04Å; D698-W701 HydrophobicContact CB-CZ3 3.83Å; D698-K704 PolarHBondContact O-NZ 3.2Å
699	S	96.1	Very high	96.2	Very high	108 Å²	108	36.7 Å²	36.7	76%	0.755	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.7	-177.7	52.4	0	0	0	0	114.4	W701	S699-W701 PolarHBondContact O-N 3.38Å
700	T	96.9	Very high	96.1	Very high	44 Å²	44	36.6 Å²	36.6	27%	0.27	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.6	175.8	-46.9	0	0	0	0	111.9	P606 K693 D698 P702	P606-T700 VanDerWaalsContact CD-O 3.26Å; P606-T700 WeakPolarHBondContact CD-O 3.42Å; P606-T700 WeakPolarHBondContact CG-O 3.3Å; K693-T700 PolarHBondContact NZ-OG1 3.35Å; D698-T700 VanDerWaalsContact C-N 3.26Å; D698-T700 PolarHBondContact O-N 3.11Å; D698-T700 WeakPolarHBondContact OD1-CB 3.39Å; D698-T700 PolarHBondContact OD1-N 3.34Å; D698-T700 PolarHBondContact OD1-OG1 3.35Å; T700-P702 WeakPolarHBondContact O-CD 3.42Å
701	W	96.8	Very high	96	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.23	C	C	.	.			trans	-112.8	89.4	172.5	-56.3	-94.5	0	0	0	109.5	L603 N604 K693 V695 D698 S699 M703 K704 I757	L603-W701 VanDerWaalsContact O-CZ2 3.29Å; L603-W701 WeakPolarHBondContact O-CZ2 3.41Å; N604-W701 VanDerWaalsContact C-CZ2 3.4Å; N604-W701 VanDerWaalsContact O-CZ2 3.25Å; N604-W701 WeakPolarHBondContact O-CZ2 3.37Å; K693-W701 HydrophobicContact CB-CH2 3.98Å; K693-W701 HydrophobicContact CB-CZ3 3.89Å; K693-W701 HydrophobicContact CD-CH2 3.93Å; K693-W701 HydrophobicContact CD-CZ3 4.03Å; V695-W701 HydrophobicContact CB-CD2 4.46Å; V695-W701 HydrophobicContact CB-CE3 4.36Å; V695-W701 HydrophobicContact CG1-CB 4.19Å; V695-W701 HydrophobicContact CG1-CD2 3.88Å; V695-W701 HydrophobicContact CG1-CE3 4.2Å; V695-W701 HydrophobicContact CG1-CG 3.85Å; V695-W701 HydrophobicContact CG2-CD2 4.4Å; V695-W701 HydrophobicContact CG2-CE3 4.36Å; V695-W701 HydrophobicContact CG2-CH2 4.36Å; V695-W701 HydrophobicContact CG2-CZ2 4.35Å; V695-W701 HydrophobicContact CG2-CZ3 4.35Å; D698-W701 HydrophobicContact CB-CE3 4.04Å; D698-W701 HydrophobicContact CB-CZ3 3.83Å; S699-W701 PolarHBondContact O-N 3.38Å; W701-M703 VanDerWaalsContact C-N 3.3Å; W701-M703 PolarHBondContact O-N 3.45Å; W701-K704 WeakPolarHBondContact O-CD 3.46Å; W701-K704 VanDerWaalsContact O-CE 3.28Å; W701-K704 WeakPolarHBondContact O-CE 3.47Å; W701-K704 PolarHBondContact O-NZ 3.21Å; W701-I757 HydrophobicContact CB-CG1 4.23Å; W701-I757 HydrophobicContact CG-CG1 4.07Å
702	P	94.3	Very high	96	Very high	104 Å²	104	37.3 Å²	37.3	68%	0.675	22%	0.22	S	C	*	.	S	Bend	trans	-68	-31.2	178.4	26.3	-33.9	0	0	0	112.2	T700	T700-P702 WeakPolarHBondContact O-CD 3.42Å
703	M	95.3	Very high	96	Very high	71 Å²	71	39.3 Å²	39.3	35%	0.35	22%	0.224	S	C	.	.	S	Bend	trans	-97.5	115.4	174.5	-56.6	-176.7	89.3	0	0	109.7	W701 M705 L756	W701-M703 VanDerWaalsContact C-N 3.3Å; W701-M703 PolarHBondContact O-N 3.45Å; M703-M705 HydrophobicContact CE-CE 3.77Å; M703-M705 PolarHBondContact O-N 3.42Å; M703-L756 HydrophobicContact CB-CD2 3.93Å; M703-L756 HydrophobicContact CE-CD2 4.19Å; M703-L756 HydrophobicContact CG-CD2 4.44Å; M703-L756 HydrophobicContact SD-CD2 3.65Å
704	K	95.8	Very high	95.9	Very high	33 Å²	33	35.6 Å²	35.6	14%	0.143	21%	0.208	C	C	.	.			trans	-80.9	37.5	-178.4	-53.2	-51.2	-176.2	-178.7	0	113.4	V695 M696 D698 W701 N738 L739	V695-K704 PolarHBondContact O-NZ 3.38Å; M696-K704 HydrophobicContact CE-CB 4.2Å; M696-K704 HydrophobicContact CE-CG 4.45Å; M696-K704 WeakPolarHBondContact O-CE 3.42Å; M696-K704 PolarHBondContact O-NZ 3.23Å; M696-K704 VanDerWaalsContact O-NZ 3.17Å; D698-K704 PolarHBondContact O-NZ 3.2Å; W701-K704 WeakPolarHBondContact O-CD 3.46Å; W701-K704 VanDerWaalsContact O-CE 3.28Å; W701-K704 WeakPolarHBondContact O-CE 3.47Å; W701-K704 PolarHBondContact O-NZ 3.21Å; K704-N738 PolarHBondContact O-OD1 3.25Å; K704-L739 VanDerWaalsContact O-CB 3.28Å; K704-L739 WeakPolarHBondContact O-CB 3.4Å; K704-L739 WeakPolarHBondContact O-CG 3.31Å; K704-L739 PolarHBondContact O-N 3.34Å
705	M	96.8	Very high	95.8	Very high	7 Å²	7	38.4 Å²	38.4	3%	0.034	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	145.1	-177.1	-52	-169.7	-52.8	0	0	111.4	M703 S737 N738 K748 Q750 L756 I757	M703-M705 HydrophobicContact CE-CE 3.77Å; M703-M705 PolarHBondContact O-N 3.42Å; M705-S737 CarbonylContact C-O 3.18Å; M705-S737 VanDerWaalsContact CA-O 3.23Å; M705-S737 WeakPolarHBondContact CA-O 3.48Å; M705-N738 HydrophobicContact CG-CB 4.21Å; M705-K748 HydrophobicContact SD-CD 3.92Å; M705-K748 PolarHBondContact SD-NZ 3.26Å; M705-Q750 HydrophobicContact CE-CB 4.31Å; M705-Q750 HydrophobicContact CE-CG 3.78Å; M705-L756 HydrophobicContact CB-CD1 4.19Å; M705-L756 HydrophobicContact CB-CD2 4.32Å; M705-L756 HydrophobicContact CE-CD1 4.1Å; M705-L756 HydrophobicContact CE-CD2 3.67Å; M705-L756 WeakPolarHBondContact O-CB 3.47Å; M705-I757 VanDerWaalsContact O-CB 3.3Å; M705-I757 WeakPolarHBondContact O-CB 3.43Å; M705-I757 WeakPolarHBondContact O-CD1 3.29Å; M705-I757 WeakPolarHBondContact O-CG1 3.35Å; M705-I757 PolarHBondContact O-N 3.11Å
706	V	97.8	Very high	95.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.1	-178.9	167.1	0	0	0	0	110.2	A736 S737 L739 L744 I757 L759	V706-A736 CarbonylContact O-C 3.58Å; V706-A736 WeakPolarHBondContact O-CA 3.24Å; V706-A736 WeakPolarHBondContact O-CB 3.49Å; V706-S737 PolarHBondContact N-O 3.32Å; V706-S737 PolarHBondContact O-N 3.28Å; V706-L739 HydrophobicContact CG2-CD1 3.77Å; V706-L739 HydrophobicContact CG2-CD2 3.91Å; V706-L739 HydrophobicContact CG2-CG 3.9Å; V706-L744 HydrophobicContact CG1-CD1 4.19Å; V706-I757 WeakPolarHBondContact CA-O 3.28Å; V706-I757 HydrophobicContact CG2-CB 3.86Å; V706-I757 HydrophobicContact CG2-CD1 4.09Å; V706-I757 HydrophobicContact CG2-CG2 3.96Å; V706-L759 HydrophobicContact CG1-CD1 3.9Å; V706-L759 HydrophobicContact CG1-CG 3.8Å; V706-L759 HydrophobicContact CG2-CD1 4.01Å; V706-L759 HydrophobicContact CG2-CD2 4.32Å; V706-L759 HydrophobicContact CG2-CG 3.95Å
707	W	97.9	Very high	95.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	137.5	167.1	-75.6	126.8	0	0	0	110.7	S607 L638 W725 S734 A736 Q750 S751 L756 I757 I758	S607-W707 PolarHBondContact O-NE1 3.43Å; L638-W707 HydrophobicContact CD2-CB 3.76Å; L638-W707 VanDerWaalsContact CD2-O 3.31Å; L638-W707 WeakPolarHBondContact CD2-O 3.49Å; W707-W725 HydrophobicContact CB-CH2 3.94Å; W707-W725 HydrophobicContact CB-CZ3 3.92Å; W707-W725 HydrophobicContact CD2-CH2 4.4Å; W707-W725 AromaticContact CD2-CZ3 3.86Å; W707-W725 HydrophobicContact CD2-CZ3 3.86Å; W707-W725 HydrophobicContact CE3-CH2 4.24Å; W707-W725 AromaticContact CE3-CZ3 3.98Å; W707-W725 HydrophobicContact CE3-CZ3 3.98Å; W707-W725 HydrophobicContact CG-CH2 4.34Å; W707-W725 AromaticContact CG-CZ3 3.87Å; W707-W725 HydrophobicContact CG-CZ3 3.87Å; W707-S734 VanDerWaalsContact CZ3-CB 3.41Å; W707-A736 HydrophobicContact CE3-CB 3.77Å; W707-A736 HydrophobicContact CZ3-CB 3.96Å; W707-Q750 HydrophobicContact CH2-CB 3.84Å; W707-Q750 HydrophobicContact CH2-CG 4.06Å; W707-Q750 HydrophobicContact CZ3-CB 3.94Å; W707-S751 VanDerWaalsContact CH2-O 3.3Å; W707-S751 WeakPolarHBondContact CH2-O 3.24Å; W707-S751 WeakPolarHBondContact CZ2-O 2.89Å; W707-L756 HydrophobicContact CD2-CB 4.33Å; W707-L756 HydrophobicContact CD2-CD1 3.59Å; W707-L756 HydrophobicContact CD2-CG 4.19Å; W707-L756 VanDerWaalsContact CE2-CD1 3.47Å; W707-L756 HydrophobicContact CE3-CD1 3.83Å; W707-L756 HydrophobicContact CG-CB 4.15Å; W707-L756 HydrophobicContact CG-CD1 4.17Å; W707-L756 HydrophobicContact CH2-CD1 3.86Å; W707-L756 HydrophobicContact CZ2-CD1 3.64Å; W707-L756 HydrophobicContact CZ2-CG 3.87Å; W707-L756 HydrophobicContact CZ3-CD1 3.93Å; W707-I757 PolarHBondContact N-O 3.35Å; W707-I758 HydrophobicContact CB-CD1 3.98Å; W707-I758 HydrophobicContact CG-CD1 4.18Å
708	H	96.6	Very high	95.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.			trans	-145	-31.4	170.6	61.6	100.1	0	0	0	113.7	F637 S639 L645 S710 F735 L745 E746	F637-H708 HydrophobicContact CD1-CB 4.39Å; F637-H708 HydrophobicContact CE1-CB 4.25Å; S639-H708 PolarHBondContact N-O 3.26Å; L645-H708 HydrophobicContact CD2-CB 4.01Å; H708-S710 VanDerWaalsContact C-N 3.29Å; H708-S710 PolarHBondContact CE1-O 3.09Å; H708-S710 PolarHBondContact ND1-N 3.45Å; H708-S710 PolarHBondContact ND1-O 3.36Å; H708-S710 PolarHBondContact ND1-OG 3.43Å; H708-S710 PolarHBondContact O-N 3.24Å; H708-F735 PolarHBondContact CD2-O 3.21Å; H708-F735 PolarHBondContact N-O 3.17Å; H708-F735 VanDerWaalsContact N-O 3.16Å; H708-L745 HydrophobicContact CB-CD2 4.02Å; H708-E746 PolarHBondContact NE2-O 3.38Å
709	G	95.3	Very high	94.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.249	C	C	.	.			trans	62.5	30.3	175.3	0	0	0	0	0	114.6	S639 S717 T720 F735	S639-G709 WeakPolarHBondContact CB-O 3.46Å; S639-G709 PolarHBondContact OG-O 3.47Å; G709-S717 PolarHBondContact O-N 3.28Å; G709-T720 VanDerWaalsContact CA-O 3.32Å; G709-T720 WeakPolarHBondContact CA-O 3.48Å; G709-F735 PolarHBondContact N-O 3.37Å
710	S	95.8	Very high	94.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-131.9	159.5	-172.7	79.2	0	0	0	0	112.4	L645 H708 E715 Q747	L645-S710 WeakPolarHBondContact CD2-OG 3.19Å; H708-S710 VanDerWaalsContact C-N 3.29Å; H708-S710 PolarHBondContact CE1-O 3.09Å; H708-S710 PolarHBondContact ND1-N 3.45Å; H708-S710 PolarHBondContact ND1-O 3.36Å; H708-S710 PolarHBondContact ND1-OG 3.43Å; H708-S710 PolarHBondContact O-N 3.24Å; S710-E715 CarbonylContact C-O 3.46Å; S710-E715 VanDerWaalsContact CA-O 3.25Å; S710-E715 WeakPolarHBondContact CA-O 3.26Å; S710-E715 VanDerWaalsContact CB-O 3.29Å; S710-E715 WeakPolarHBondContact CB-O 3.19Å; S710-Q747 PolarHBondContact O-NE2 3.14Å; S710-Q747 PolarHBondContact O-OE1 3.33Å
711	L	95.6	Very high	94	Very high	59 Å²	59	39.8 Å²	39.8	31%	0.309	21%	0.207	S	C	.	.			trans	-72.7	167.5	165.9	-62.2	-179.6	0	0	0	111.2	N713 G714 E715 F735	L711-N713 WeakPolarHBondContact CB-OD1 3.31Å; L711-N713 PolarHBondContact O-N 3.19Å; L711-G714 PolarHBondContact O-N 3.35Å; L711-E715 HydrophobicContact CB-CB 4.43Å; L711-E715 HydrophobicContact CD1-CB 4.42Å; L711-E715 PolarHBondContact N-O 3.46Å; L711-F735 HydrophobicContact CD2-CE2 4.14Å
712	P	95.4	Very high	93.8	Very high	36 Å²	36	39.9 Å²	39.9	23%	0.234	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-12.8	-177	-22.5	36.2	0	0	0	115.2	G676 G714 Q747	G676-P712 PolarHBondContact N-O 2.93Å; G676-P712 WeakPolarHBondContact O-CB 3.09Å; P712-G714 VanDerWaalsContact C-N 3.34Å; P712-Q747 HydrophobicContact CG-CG 3.74Å
713	N	94.5	Very high	93.8	Very high	70 Å²	70	38.6 Å²	38.6	37%	0.374	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	2.1	170.8	66.5	-14.2	0	0	0	112.8	L711 E715	L711-N713 WeakPolarHBondContact CB-OD1 3.31Å; L711-N713 PolarHBondContact O-N 3.19Å; N713-E715 VanDerWaalsContact C-N 3.29Å; N713-E715 PolarHBondContact ND2-OE2 3.04Å; N713-E715 PolarHBondContact O-N 3.3Å; N713-E715 WeakPolarHBondContact OD1-CB 3.22Å; N713-E715 PolarHBondContact OD1-N 3.18Å
714	G	94.3	Very high	93.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	81.4	0.3	-176.3	0	0	0	0	0	114.9	L645 L711 P712	L645-G714 WeakPolarHBondContact CA-O 3.4Å; L645-G714 VanDerWaalsContact CB-O 3.27Å; L645-G714 WeakPolarHBondContact CB-O 3.3Å; L645-G714 PolarHBondContact N-O 3.31Å; L711-G714 PolarHBondContact O-N 3.35Å; P712-G714 VanDerWaalsContact C-N 3.34Å
715	E	94.9	Very high	93.7	Very high	94 Å²	94	33.9 Å²	33.9	44%	0.439	17%	0.173	S	C	.	.			trans	-68.6	144.6	176.9	-171.4	168.6	-167.1	0	0	111.5	S710 L711 N713	S710-E715 CarbonylContact C-O 3.46Å; S710-E715 VanDerWaalsContact CA-O 3.25Å; S710-E715 WeakPolarHBondContact CA-O 3.26Å; S710-E715 VanDerWaalsContact CB-O 3.29Å; S710-E715 WeakPolarHBondContact CB-O 3.19Å; L711-E715 HydrophobicContact CB-CB 4.43Å; L711-E715 HydrophobicContact CD1-CB 4.42Å; L711-E715 PolarHBondContact N-O 3.46Å; N713-E715 VanDerWaalsContact C-N 3.29Å; N713-E715 PolarHBondContact ND2-OE2 3.04Å; N713-E715 PolarHBondContact O-N 3.3Å; N713-E715 WeakPolarHBondContact OD1-CB 3.22Å; N713-E715 PolarHBondContact OD1-N 3.18Å
716	R	93.7	Very high	93.7	Very high	87 Å²	87	38.5 Å²	38.5	33%	0.328	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-70.9	132.2	-179.7	66.1	-176	178.4	-106.5	10.2	110.9	S640 N644 M718	S640-R716 WeakPolarHBondContact O-CD 3.41Å; N644-R716 WeakPolarHBondContact OD1-CG 3.32Å; N644-R716 PolarHBondContact OD1-NH1 2.84Å; R716-M718 HydrophobicContact CG-SD 4Å
717	S	91.8	Very high	93.6	Very high	18 Å²	18	39.4 Å²	39.4	13%	0.126	20%	0.201	C	C	.	.			trans	-98.8	106.3	170.6	179.9	0	0	0	0	109.2	G709 D719 T720	G709-S717 PolarHBondContact O-N 3.28Å; S717-D719 PolarHBondContact O-N 3.04Å; S717-T720 WeakPolarHBondContact CB-OG1 3.05Å; S717-T720 PolarHBondContact O-N 3.05Å; S717-T720 PolarHBondContact OG-OG1 3.43Å
718	M	85.8	Confident	93.4	Very high	83 Å²	83	41 Å²	41	41%	0.409	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-18.1	-169.5	-63.4	-71.2	-72.1	0	0	113.9	R641 R716 Y721	R641-M718 HydrophobicContact CG-CE 4.33Å; R716-M718 HydrophobicContact CG-SD 4Å; M718-Y721 WeakPolarHBondContact CE-OH 3.4Å; M718-Y721 WeakPolarHBondContact O-CE1 3.43Å; M718-Y721 HydrophobicContact SD-CE2 4.05Å
719	D	86	Confident	93.3	Very high	146 Å²	146	43.5 Å²	43.5	78%	0.781	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-4.3	-178.4	-53.1	-48.5	0	0	0	112.9	S717	S717-D719 PolarHBondContact O-N 3.04Å
720	T	89.2	Confident	93.3	Very high	14 Å²	14	49.4 Å²	49.4	9%	0.086	26%	0.258	C	S	.	.	S	Bend	trans	-137.7	55	-172.6	68.2	0	0	0	0	112.1	G709 S717 G733 S734 F735	G709-T720 VanDerWaalsContact CA-O 3.32Å; G709-T720 WeakPolarHBondContact CA-O 3.48Å; S717-T720 WeakPolarHBondContact CB-OG1 3.05Å; S717-T720 PolarHBondContact O-N 3.05Å; S717-T720 PolarHBondContact OG-OG1 3.43Å; T720-G733 WeakPolarHBondContact CA-O 3.32Å; T720-S734 VanDerWaalsContact O-CA 3.3Å; T720-S734 WeakPolarHBondContact O-CA 3.3Å; T720-S734 WeakPolarHBondContact O-CB 3.37Å; T720-S734 PolarHBondContact O-OG 3.5Å; T720-S734 VanDerWaalsContact O-OG 3.06Å; T720-F735 HydrophobicContact CG2-CE2 4.13Å; T720-F735 HydrophobicContact CG2-CZ 4.21Å; T720-F735 PolarHBondContact O-N 3.17Å; T720-F735 WeakPolarHBondContact OG1-CD2 3.09Å; T720-F735 WeakPolarHBondContact OG1-CE2 3.45Å
721	Y	89.6	Confident	93.1	Very high	14 Å²	14	56 Å²	56	6%	0.055	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-144.7	31.5	178.3	66.8	-2.7	0	0	0	113.8	M718 D723 A724 W725	M718-Y721 WeakPolarHBondContact CE-OH 3.4Å; M718-Y721 WeakPolarHBondContact O-CE1 3.43Å; M718-Y721 HydrophobicContact SD-CE2 4.05Å; Y721-D723 PolarHBondContact O-N 3.33Å; Y721-A724 HydrophobicContact CD1-CB 4.5Å; Y721-A724 HydrophobicContact CD2-CB 4.32Å; Y721-A724 HydrophobicContact CE1-CB 4.16Å; Y721-A724 VanDerWaalsContact CE1-N 3.31Å; Y721-A724 HydrophobicContact CE2-CB 3.97Å; Y721-A724 CarbonylContact O-C 3.54Å; Y721-A724 WeakPolarHBondContact O-CA 3.42Å; Y721-A724 PolarHBondContact O-N 3.48Å; Y721-W725 PolarHBondContact O-N 3.1Å
722	C	93.9	Very high	93.1	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.014	29%	0.29	C	S	.	.	H	α-helix	trans	49.7	52.1	176.8	-57.3	0	0	0	0	114.2	G609 A724 W725 H726 S727 S734 C752	G609-C722 WeakPolarHBondContact O-CB 3.36Å; C722-A724 VanDerWaalsContact C-N 3.34Å; C722-A724 PolarHBondContact O-N 2.94Å; C722-W725 HydrophobicContact CB-CE3 4.11Å; C722-W725 CarbonylContact O-C 3.32Å; C722-W725 VanDerWaalsContact O-CA 3.28Å; C722-W725 WeakPolarHBondContact O-CA 3.22Å; C722-W725 PolarHBondContact O-N 3.13Å; C722-H726 PolarHBondContact O-N 3.02Å; C722-S727 PolarHBondContact O-N 3.39Å; C722-S734 WeakPolarHBondContact SG-CB 3.35Å; C722-C752 WeakPolarHBondContact CA-SG 3.19Å; C722-C752 HydrophobicContact CB-CB 3.89Å; C722-C752 WeakPolarHBondContact CB-SG 3.43Å; C722-C752 WeakPolarHBondContact SG-CB 3.23Å; C722-C752 CovalentContact SG-SG 2.03Å; C722-C752 PolarHBondContact SG-SG 3.3Å
723	D	93.4	Very high	92.9	Very high	77 Å²	77	54.7 Å²	54.7	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	54	42.6	-173.8	-62.9	-3.8	0	0	0	114.1	Y721 W725 H726 K732	Y721-D723 PolarHBondContact O-N 3.33Å; D723-W725 VanDerWaalsContact C-N 3.3Å; D723-H726 PolarHBondContact O-ND1 3.37Å; D723-K732 WeakPolarHBondContact OD2-CE 3.16Å; D723-K732 IonicContact OD2-NZ 2.74Å; D723-K732 PolarHBondContact OD2-NZ 3.13Å
724	A	93.8	Very high	93	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	59.3	39.6	-169.7	0	0	0	0	0	113.2	G613 R641 Y721 C722 H726	G613-A724 WeakPolarHBondContact CA-O 3.27Å; R641-A724 HydrophobicContact CB-CB 4.31Å; Y721-A724 HydrophobicContact CD1-CB 4.5Å; Y721-A724 HydrophobicContact CD2-CB 4.32Å; Y721-A724 HydrophobicContact CE1-CB 4.16Å; Y721-A724 VanDerWaalsContact CE1-N 3.31Å; Y721-A724 HydrophobicContact CE2-CB 3.97Å; Y721-A724 CarbonylContact O-C 3.54Å; Y721-A724 WeakPolarHBondContact O-CA 3.42Å; Y721-A724 PolarHBondContact O-N 3.48Å; C722-A724 VanDerWaalsContact C-N 3.34Å; C722-A724 PolarHBondContact O-N 2.94Å; A724-H726 PolarHBondContact O-CE1 3.24Å; A724-H726 VanDerWaalsContact O-CE1 3.24Å; A724-H726 PolarHBondContact O-ND1 2.72Å; A724-H726 VanDerWaalsContact O-ND1 3.14Å
725	W	96.5	Very high	93.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	70.6	37.9	177.3	-40.9	99.2	0	0	0	116.4	G609 L611 G613 L638 S639 W707 Y721 C722 D723 S734	G609-W725 CarbonylContact O-C 3.48Å; G609-W725 WeakPolarHBondContact O-CA 3.35Å; L611-W725 HydrophobicContact CB-CB 4.12Å; L611-W725 HydrophobicContact CD1-CB 4.08Å; L611-W725 HydrophobicContact CD1-CD2 4.32Å; L611-W725 HydrophobicContact CD1-CE3 4.23Å; L611-W725 HydrophobicContact CD1-CG 4.26Å; L611-W725 HydrophobicContact CG-CB 4.24Å; L611-W725 PolarHBondContact N-O 3.42Å; G613-W725 VanDerWaalsContact CA-O 3.24Å; G613-W725 WeakPolarHBondContact CA-O 3.49Å; G613-W725 PolarHBondContact N-O 2.88Å; L638-W725 HydrophobicContact CB-CZ2 4.07Å; L638-W725 HydrophobicContact CD1-CD2 4.17Å; L638-W725 HydrophobicContact CD1-CG 4.31Å; L638-W725 HydrophobicContact CD2-CH2 3.89Å; L638-W725 HydrophobicContact CD2-CZ2 3.74Å; L638-W725 HydrophobicContact CD2-CZ3 4.4Å; L638-W725 HydrophobicContact CG-CZ2 4.34Å; S639-W725 PolarHBondContact O-NE1 2.83Å; W707-W725 HydrophobicContact CB-CH2 3.94Å; W707-W725 HydrophobicContact CB-CZ3 3.92Å; W707-W725 HydrophobicContact CD2-CH2 4.4Å; W707-W725 AromaticContact CD2-CZ3 3.86Å; W707-W725 HydrophobicContact CD2-CZ3 3.86Å; W707-W725 HydrophobicContact CE3-CH2 4.24Å; W707-W725 AromaticContact CE3-CZ3 3.98Å; W707-W725 HydrophobicContact CE3-CZ3 3.98Å; W707-W725 HydrophobicContact CG-CH2 4.34Å; W707-W725 AromaticContact CG-CZ3 3.87Å; W707-W725 HydrophobicContact CG-CZ3 3.87Å; Y721-W725 PolarHBondContact O-N 3.1Å; C722-W725 HydrophobicContact CB-CE3 4.11Å; C722-W725 CarbonylContact O-C 3.32Å; C722-W725 VanDerWaalsContact O-CA 3.28Å; C722-W725 WeakPolarHBondContact O-CA 3.22Å; C722-W725 PolarHBondContact O-N 3.13Å; D723-W725 VanDerWaalsContact C-N 3.3Å; W725-S734 WeakPolarHBondContact CH2-OG 3.14Å; W725-S734 WeakPolarHBondContact CZ3-OG 3.05Å
726	H	95.8	Very high	93.2	Very high	105 Å²	105	48.4 Å²	48.4	49%	0.486	25%	0.25	S	S	.	.	B	Isolated β-bridge	trans	-116.8	15.5	177.9	-53.3	87.7	0	0	0	113.2	G613 C722 D723 A724	G613-H726 WeakPolarHBondContact CA-NE2 3.4Å; C722-H726 PolarHBondContact O-N 3.02Å; D723-H726 PolarHBondContact O-ND1 3.37Å; A724-H726 PolarHBondContact O-CE1 3.24Å; A724-H726 VanDerWaalsContact O-CE1 3.24Å; A724-H726 PolarHBondContact O-ND1 2.72Å; A724-H726 VanDerWaalsContact O-ND1 3.14Å
727	S	94.9	Very high	93.3	Very high	19 Å²	19	44.2 Å²	44.2	13%	0.133	24%	0.235	C	C	.	.			trans	-151	118.7	-173.1	-157.2	0	0	0	0	112.3	G609 C722 D729 K732 C752	G609-S727 CarbonylContact C-O 3.54Å; C722-S727 PolarHBondContact O-N 3.39Å; S727-D729 VanDerWaalsContact C-N 3.29Å; S727-K732 PolarHBondContact OG-NZ 3.47Å; S727-C752 VanDerWaalsContact O-CB 3.28Å; S727-C752 WeakPolarHBondContact O-CB 3.21Å
728	G	94.8	Very high	93.4	Very high	33 Å²	33	45 Å²	45	34%	0.34	24%	0.237	S	C	.	.			trans	-93.1	28.1	171	0	0	0	0	0	113.2	C752 D753	G728-C752 WeakPolarHBondContact CA-O 3.36Å; G728-D753 WeakPolarHBondContact O-CA 3.5Å
729	D	94.6	Very high	93.8	Very high	52 Å²	52	41 Å²	41	28%	0.278	22%	0.217	S	C	.	.			trans	-80.5	128.5	-174.8	177.2	11.2	0	0	0	111.7	S727 L731 K732	S727-D729 VanDerWaalsContact C-N 3.29Å; D729-L731 PolarHBondContact O-N 3.47Å; D729-L731 PolarHBondContact OD1-N 3.21Å; D729-L731 VanDerWaalsContact OD1-N 3.1Å; D729-K732 HydrophobicContact CB-CD 4.15Å; D729-K732 HydrophobicContact CB-CG 4.3Å; D729-K732 PolarHBondContact O-N 3.14Å; D729-K732 WeakPolarHBondContact OD2-CE 3.33Å
730	H	94.5	Very high	94.1	Very high	125 Å²	125	38.5 Å²	38.5	58%	0.579	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.8	177.9	71.4	-44.4	0	0	0	115.5	K732 S751 D753	H730-K732 PolarHBondContact O-N 3.48Å; H730-S751 WeakPolarHBondContact CA-OG 3.37Å; H730-S751 PolarHBondContact O-OG 3.37Å; H730-D753 HydrophobicContact CB-CB 4.44Å
731	L	93.2	Very high	94.1	Very high	137 Å²	137	39.3 Å²	39.3	72%	0.717	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-13.6	176.5	-63.4	179.3	0	0	0	112.8	D729	D729-L731 PolarHBondContact O-N 3.47Å; D729-L731 PolarHBondContact OD1-N 3.21Å; D729-L731 VanDerWaalsContact OD1-N 3.1Å
732	K	93.7	Very high	94.2	Very high	62 Å²	62	41.9 Å²	41.9	27%	0.27	23%	0.228	S	C	.	.			trans	-102.9	145.1	-178.5	-59.9	177.8	-164.4	171	0	109.5	D723 S727 D729 H730 C752	D723-K732 WeakPolarHBondContact OD2-CE 3.16Å; D723-K732 IonicContact OD2-NZ 2.74Å; D723-K732 PolarHBondContact OD2-NZ 3.13Å; S727-K732 PolarHBondContact OG-NZ 3.47Å; D729-K732 HydrophobicContact CB-CD 4.15Å; D729-K732 HydrophobicContact CB-CG 4.3Å; D729-K732 PolarHBondContact O-N 3.14Å; D729-K732 WeakPolarHBondContact OD2-CE 3.33Å; H730-K732 PolarHBondContact O-N 3.48Å; K732-C752 VanDerWaalsContact C-SG 3.51Å; K732-C752 HydrophobicContact CB-CB 4.31Å; K732-C752 PolarHBondContact O-N 3.31Å; K732-C752 PolarHBondContact O-SG 2.93Å; K732-C752 VanDerWaalsContact O-SG 3.34Å
733	G	92.9	Very high	94.2	Very high	7 Å²	7	45.6 Å²	45.6	7%	0.072	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	157	178.4	0	0	0	0	0	111.9	T720 Q750	T720-G733 WeakPolarHBondContact CA-O 3.32Å; G733-Q750 CarbonylContact C-O 3.44Å; G733-Q750 WeakPolarHBondContact CA-O 3.26Å
734	S	94.9	Very high	94.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	160.8	173.6	171.3	0	0	0	0	110.4	W707 T720 C722 W725 R749 Q750	W707-S734 VanDerWaalsContact CZ3-CB 3.41Å; T720-S734 VanDerWaalsContact O-CA 3.3Å; T720-S734 WeakPolarHBondContact O-CA 3.3Å; T720-S734 WeakPolarHBondContact O-CB 3.37Å; T720-S734 PolarHBondContact O-OG 3.5Å; T720-S734 VanDerWaalsContact O-OG 3.06Å; C722-S734 WeakPolarHBondContact SG-CB 3.35Å; W725-S734 WeakPolarHBondContact CH2-OG 3.14Å; W725-S734 WeakPolarHBondContact CZ3-OG 3.05Å; S734-R749 WeakPolarHBondContact O-CA 3.36Å; S734-Q750 PolarHBondContact N-O 3.22Å; S734-Q750 PolarHBondContact O-N 3.2Å
735	F	96.6	Very high	94.4	Very high	31 Å²	31	42.1 Å²	42.1	14%	0.136	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.1	172.4	-70.4	-50.1	0	0	0	110.5	H708 G709 L711 T720 Q747	H708-F735 PolarHBondContact CD2-O 3.21Å; H708-F735 PolarHBondContact N-O 3.17Å; H708-F735 VanDerWaalsContact N-O 3.16Å; G709-F735 PolarHBondContact N-O 3.37Å; L711-F735 HydrophobicContact CD2-CE2 4.14Å; T720-F735 HydrophobicContact CG2-CE2 4.13Å; T720-F735 HydrophobicContact CG2-CZ 4.21Å; T720-F735 PolarHBondContact O-N 3.17Å; T720-F735 WeakPolarHBondContact OG1-CD2 3.09Å; T720-F735 WeakPolarHBondContact OG1-CE2 3.45Å; F735-Q747 HydrophobicContact CD1-CB 4.23Å; F735-Q747 HydrophobicContact CE1-CB 4.06Å; F735-Q747 WeakPolarHBondContact CE1-O 3.2Å
736	A	96.6	Very high	94.3	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.8	170.2	0	0	0	0	0	109.5	V706 W707 E746 K748 Q750 L756	V706-A736 CarbonylContact O-C 3.58Å; V706-A736 WeakPolarHBondContact O-CA 3.24Å; V706-A736 WeakPolarHBondContact O-CB 3.49Å; W707-A736 HydrophobicContact CE3-CB 3.77Å; W707-A736 HydrophobicContact CZ3-CB 3.96Å; A736-E746 VanDerWaalsContact O-O 3.13Å; A736-K748 PolarHBondContact N-O 2.87Å; A736-K748 WeakPolarHBondContact O-CB 3.47Å; A736-K748 PolarHBondContact O-N 3.48Å; A736-Q750 HydrophobicContact CB-CB 4.13Å; A736-L756 HydrophobicContact CB-CD1 3.42Å; A736-L756 VanDerWaalsContact CB-CD1 3.42Å
737	S	96.5	Very high	94.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.5	-179.6	-171.7	0	0	0	0	111.1	M705 V706 K743 L744 L745 E746	M705-S737 CarbonylContact C-O 3.18Å; M705-S737 VanDerWaalsContact CA-O 3.23Å; M705-S737 WeakPolarHBondContact CA-O 3.48Å; V706-S737 PolarHBondContact N-O 3.32Å; V706-S737 PolarHBondContact O-N 3.28Å; S737-K743 PolarHBondContact OG-O 3.33Å; S737-L744 WeakPolarHBondContact CB-O 3.34Å; S737-L744 WeakPolarHBondContact OG-CA 3.44Å; S737-L744 PolarHBondContact OG-N 3.18Å; S737-L744 PolarHBondContact OG-O 3.28Å; S737-L745 PolarHBondContact OG-N 3.21Å; S737-E746 VanDerWaalsContact OG-CB 3.29Å; S737-E746 WeakPolarHBondContact OG-CB 3.45Å; S737-E746 PolarHBondContact OG-N 3.16Å
738	N	94.4	Very high	94.4	Very high	33 Å²	33	46.1 Å²	46.1	18%	0.176	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	119.6	174.9	-166.5	26.9	0	0	0	111.6	K704 M705 D740 G741 E746	K704-N738 PolarHBondContact O-OD1 3.25Å; M705-N738 HydrophobicContact CG-CB 4.21Å; N738-D740 VanDerWaalsContact C-N 3.3Å; N738-D740 PolarHBondContact O-N 3.37Å; N738-D740 PolarHBondContact OD1-OD2 3.48Å; N738-G741 WeakPolarHBondContact O-CA 3.17Å; N738-G741 PolarHBondContact O-N 3.22Å; N738-E746 VanDerWaalsContact CB-OE2 3.22Å; N738-E746 WeakPolarHBondContact CB-OE2 3.28Å; N738-E746 PolarHBondContact N-OE2 3.2Å
739	L	93.9	Very high	94.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-70.1	-28.2	-178.6	-65.6	178.5	0	0	0	112.5	F681 P685 I687 M696 K704 V706 G741 H742 I757	F681-L739 HydrophobicContact CE2-CD2 3.76Å; F681-L739 HydrophobicContact CZ-CD2 4.17Å; P685-L739 HydrophobicContact CG-CB 4Å; P685-L739 HydrophobicContact CG-CD2 4.38Å; I687-L739 HydrophobicContact CD1-CD1 4.01Å; I687-L739 HydrophobicContact CD1-CD2 4.03Å; M696-L739 HydrophobicContact CE-CB 3.7Å; M696-L739 HydrophobicContact SD-CB 3.52Å; M696-L739 VanDerWaalsContact SD-CB 3.52Å; M696-L739 HydrophobicContact SD-CD1 3.53Å; M696-L739 VanDerWaalsContact SD-CD1 3.53Å; M696-L739 HydrophobicContact SD-CG 4.19Å; K704-L739 VanDerWaalsContact O-CB 3.28Å; K704-L739 WeakPolarHBondContact O-CB 3.4Å; K704-L739 WeakPolarHBondContact O-CG 3.31Å; K704-L739 PolarHBondContact O-N 3.34Å; V706-L739 HydrophobicContact CG2-CD1 3.77Å; V706-L739 HydrophobicContact CG2-CD2 3.91Å; V706-L739 HydrophobicContact CG2-CG 3.9Å; L739-G741 PolarHBondContact O-N 3.19Å; L739-H742 PolarHBondContact O-N 3.35Å; L739-I757 HydrophobicContact CD1-CD1 3.68Å
740	D	92.4	Very high	94.5	Very high	93 Å²	93	51.8 Å²	51.8	50%	0.497	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-65.1	-22.2	171.5	-50.5	-43.8	0	0	0	111.8	M696 N738 H742	M696-D740 WeakPolarHBondContact CE-OD1 3.25Å; N738-D740 VanDerWaalsContact C-N 3.3Å; N738-D740 PolarHBondContact O-N 3.37Å; N738-D740 PolarHBondContact OD1-OD2 3.48Å; D740-H742 PolarHBondContact O-CD2 3.4Å; D740-H742 PolarHBondContact O-N 3.37Å
741	G	89.9	Confident	94.6	Very high	32 Å²	32	47.3 Å²	47.3	33%	0.33	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-80.4	7.1	172.3	0	0	0	0	0	114.3	N738 L739 K743	N738-G741 WeakPolarHBondContact O-CA 3.17Å; N738-G741 PolarHBondContact O-N 3.22Å; L739-G741 PolarHBondContact O-N 3.19Å; G741-K743 PolarHBondContact O-N 3.1Å; G741-K743 VanDerWaalsContact O-N 3.14Å
742	H	91.1	Very high	94.8	Very high	67 Å²	67	40.8 Å²	40.8	31%	0.31	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	29.6	-177.3	-66.3	-97	0	0	0	114.5	F680 F681 Q683 L739 D740	F680-H742 CarbonylContact C-O 3.57Å; F680-H742 WeakPolarHBondContact CA-O 3.33Å; F680-H742 HydrophobicContact CD2-CB 4.21Å; F680-H742 WeakPolarHBondContact CD2-O 3.04Å; F680-H742 HydrophobicContact CE2-CB 3.71Å; F680-H742 HydrophobicContact CZ-CB 4.35Å; F681-H742 PolarHBondContact N-O 3.21Å; Q683-H742 PolarHBondContact O-ND1 3.28Å; L739-H742 PolarHBondContact O-N 3.35Å; D740-H742 PolarHBondContact O-CD2 3.4Å; D740-H742 PolarHBondContact O-N 3.37Å
743	K	93.6	Very high	94.9	Very high	81 Å²	81	41.5 Å²	41.5	35%	0.352	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-127.1	150.7	176.9	-71.9	173	-175.2	170.2	0	111.1	F680 S737 G741 E746	F680-K743 HydrophobicContact CD2-CG 4.35Å; S737-K743 PolarHBondContact OG-O 3.33Å; G741-K743 PolarHBondContact O-N 3.1Å; G741-K743 VanDerWaalsContact O-N 3.14Å; K743-E746 HydrophobicContact CB-CB 4.11Å; K743-E746 HydrophobicContact CD-CB 4.38Å
744	L	95.8	Very high	95.1	Very high	6 Å²	6	42 Å²	42	3%	0.031	21%	0.206	C	C	.	.	S	Bend	trans	-102	-20.9	176.4	-177.4	54.8	0	0	0	113.4	F637 F667 I673 G678 G679 F681 V706 S737 L759	F637-L744 HydrophobicContact CD1-CD1 4.42Å; F637-L744 HydrophobicContact CE1-CD1 3.79Å; F637-L744 HydrophobicContact CE1-CD2 3.89Å; F637-L744 HydrophobicContact CE1-CG 3.67Å; F637-L744 HydrophobicContact CE2-CD2 4.3Å; F637-L744 HydrophobicContact CZ-CD1 4.35Å; F637-L744 HydrophobicContact CZ-CD2 3.57Å; F637-L744 HydrophobicContact CZ-CG 3.8Å; F667-L744 HydrophobicContact CE2-CD2 3.56Å; F667-L744 HydrophobicContact CZ-CB 4.03Å; F667-L744 HydrophobicContact CZ-CD2 3.61Å; F667-L744 HydrophobicContact CZ-CG 4.48Å; I673-L744 HydrophobicContact CD1-CD2 4.49Å; I673-L744 HydrophobicContact CG2-CD2 4.12Å; G678-L744 PolarHBondContact O-N 3.41Å; G678-L744 VanDerWaalsContact O-N 3.1Å; G679-L744 WeakPolarHBondContact O-CB 3.04Å; G679-L744 PolarHBondContact O-N 2.94Å; F681-L744 HydrophobicContact CE2-CB 3.91Å; F681-L744 HydrophobicContact CZ-CB 3.95Å; F681-L744 HydrophobicContact CZ-CD1 4.3Å; F681-L744 HydrophobicContact CZ-CD2 4.35Å; F681-L744 HydrophobicContact CZ-CG 4.43Å; V706-L744 HydrophobicContact CG1-CD1 4.19Å; S737-L744 WeakPolarHBondContact CB-O 3.34Å; S737-L744 WeakPolarHBondContact OG-CA 3.44Å; S737-L744 PolarHBondContact OG-N 3.18Å; S737-L744 PolarHBondContact OG-O 3.28Å; L744-L759 HydrophobicContact CD1-CD1 3.69Å
745	L	95.8	Very high	95.2	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.235	C	C	.	.	S	Bend	trans	-131.5	35.8	-178.6	-50	173.4	0	0	0	112.4	F637 L645 I673 F674 G678 H708 S737 Q747	F637-L745 HydrophobicContact CE1-CD2 3.84Å; F637-L745 HydrophobicContact CZ-CD2 3.95Å; L645-L745 HydrophobicContact CD2-CD2 3.43Å; L645-L745 VanDerWaalsContact CD2-CD2 3.43Å; I673-L745 HydrophobicContact CG2-CD1 4.02Å; I673-L745 HydrophobicContact CG2-CG 4.47Å; F674-L745 HydrophobicContact CD1-CD1 3.63Å; F674-L745 HydrophobicContact CE1-CD1 3.7Å; G678-L745 PolarHBondContact O-N 2.69Å; H708-L745 HydrophobicContact CB-CD2 4.02Å; S737-L745 PolarHBondContact OG-N 3.21Å; L745-Q747 PolarHBondContact O-NE2 3.12Å
746	E	95.3	Very high	95.3	Very high	60 Å²	60	47 Å²	47	28%	0.28	23%	0.228	S	C	.	.			trans	-56.6	138	167.6	175.3	-172.9	-125.8	0	0	110.2	H708 A736 S737 N738 K743 K748	H708-E746 PolarHBondContact NE2-O 3.38Å; A736-E746 VanDerWaalsContact O-O 3.13Å; S737-E746 VanDerWaalsContact OG-CB 3.29Å; S737-E746 WeakPolarHBondContact OG-CB 3.45Å; S737-E746 PolarHBondContact OG-N 3.16Å; N738-E746 VanDerWaalsContact CB-OE2 3.22Å; N738-E746 WeakPolarHBondContact CB-OE2 3.28Å; N738-E746 PolarHBondContact N-OE2 3.2Å; K743-E746 HydrophobicContact CB-CB 4.11Å; K743-E746 HydrophobicContact CD-CB 4.38Å; E746-K748 HydrophobicContact CG-CB 4.17Å; E746-K748 PolarHBondContact O-N 3.11Å
747	Q	95.5	Very high	95.4	Very high	62 Å²	62	47 Å²	47	29%	0.29	23%	0.228	S	C	.	.			trans	-86.2	42.6	-173.6	-58.8	-63.8	-76.6	0	0	112.4	S710 P712 F735 L745 R749	S710-Q747 PolarHBondContact O-NE2 3.14Å; S710-Q747 PolarHBondContact O-OE1 3.33Å; P712-Q747 HydrophobicContact CG-CG 3.74Å; F735-Q747 HydrophobicContact CD1-CB 4.23Å; F735-Q747 HydrophobicContact CE1-CB 4.06Å; F735-Q747 WeakPolarHBondContact CE1-O 3.2Å; L745-Q747 PolarHBondContact O-NE2 3.12Å; Q747-R749 PolarHBondContact O-N 3.46Å
748	K	95.7	Very high	95.4	Very high	86 Å²	86	47 Å²	47	37%	0.374	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	115.1	-179.6	-176.7	-178.4	179.8	-176.1	0	109.1	M705 A736 E746 Q750	M705-K748 HydrophobicContact SD-CD 3.92Å; M705-K748 PolarHBondContact SD-NZ 3.26Å; A736-K748 PolarHBondContact N-O 2.87Å; A736-K748 WeakPolarHBondContact O-CB 3.47Å; A736-K748 PolarHBondContact O-N 3.48Å; E746-K748 HydrophobicContact CG-CB 4.17Å; E746-K748 PolarHBondContact O-N 3.11Å; K748-Q750 PolarHBondContact O-N 3.33Å
749	R	95.6	Very high	95.6	Very high	164 Å²	164	45.5 Å²	45.5	62%	0.619	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	117.1	178.1	-167.4	-179.2	-171.8	-148.1	2.1	109.4	S734 Q747	S734-R749 WeakPolarHBondContact O-CA 3.36Å; Q747-R749 PolarHBondContact O-N 3.46Å
750	Q	96.4	Very high	95.8	Very high	40 Å²	40	45.5 Å²	45.5	19%	0.187	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	148.2	175.1	-172.1	59.7	37.1	0	0	110.4	M705 W707 G733 S734 A736 K748 S754 L756	M705-Q750 HydrophobicContact CE-CB 4.31Å; M705-Q750 HydrophobicContact CE-CG 3.78Å; W707-Q750 HydrophobicContact CH2-CB 3.84Å; W707-Q750 HydrophobicContact CH2-CG 4.06Å; W707-Q750 HydrophobicContact CZ3-CB 3.94Å; G733-Q750 CarbonylContact C-O 3.44Å; G733-Q750 WeakPolarHBondContact CA-O 3.26Å; S734-Q750 PolarHBondContact N-O 3.22Å; S734-Q750 PolarHBondContact O-N 3.2Å; A736-Q750 HydrophobicContact CB-CB 4.13Å; K748-Q750 PolarHBondContact O-N 3.33Å; Q750-S754 PolarHBondContact NE2-OG 3.23Å; Q750-L756 HydrophobicContact CB-CD1 4.16Å; Q750-L756 HydrophobicContact CG-CD1 3.89Å; Q750-L756 HydrophobicContact CG-CD2 4.33Å
751	S	97.1	Very high	96	Very high	31 Å²	31	41.1 Å²	41.1	22%	0.217	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	139.8	175.8	170.2	0	0	0	0	112	W707 H730 D753 S754	W707-S751 VanDerWaalsContact CH2-O 3.3Å; W707-S751 WeakPolarHBondContact CH2-O 3.24Å; W707-S751 WeakPolarHBondContact CZ2-O 2.89Å; H730-S751 WeakPolarHBondContact CA-OG 3.37Å; H730-S751 PolarHBondContact O-OG 3.37Å; S751-D753 WeakPolarHBondContact CB-OD1 3.28Å; S751-D753 PolarHBondContact O-N 2.68Å; S751-D753 VanDerWaalsContact OG-CG 3.26Å; S751-D753 PolarHBondContact OG-OD1 2.76Å; S751-S754 WeakPolarHBondContact O-CB 3.36Å; S751-S754 PolarHBondContact O-N 3.08Å; S751-S754 VanDerWaalsContact O-N 3.11Å; S751-S754 PolarHBondContact O-OG 2.97Å; S751-S754 VanDerWaalsContact O-OG 3.11Å
752	C	96.6	Very high	96.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-13.7	-173.8	-67.2	0	0	0	0	114.3	G609 C722 S727 G728 K732 S754	G609-C752 PolarHBondContact N-O 3.42Å; C722-C752 WeakPolarHBondContact CA-SG 3.19Å; C722-C752 HydrophobicContact CB-CB 3.89Å; C722-C752 WeakPolarHBondContact CB-SG 3.43Å; C722-C752 WeakPolarHBondContact SG-CB 3.23Å; C722-C752 CovalentContact SG-SG 2.03Å; C722-C752 PolarHBondContact SG-SG 3.3Å; S727-C752 VanDerWaalsContact O-CB 3.28Å; S727-C752 WeakPolarHBondContact O-CB 3.21Å; G728-C752 WeakPolarHBondContact CA-O 3.36Å; K732-C752 VanDerWaalsContact C-SG 3.51Å; K732-C752 HydrophobicContact CB-CB 4.31Å; K732-C752 PolarHBondContact O-N 3.31Å; K732-C752 PolarHBondContact O-SG 2.93Å; K732-C752 VanDerWaalsContact O-SG 3.34Å; C752-S754 PolarHBondContact O-N 3.3Å
753	D	96.9	Very high	96.2	Very high	78 Å²	78	37 Å²	37	42%	0.417	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.2	169.1	72.6	-22.7	0	0	0	113.5	T608 G728 H730 S751	T608-D753 VanDerWaalsContact CG2-O 3.27Å; T608-D753 WeakPolarHBondContact CG2-O 3.3Å; G728-D753 WeakPolarHBondContact O-CA 3.5Å; H730-D753 HydrophobicContact CB-CB 4.44Å; S751-D753 WeakPolarHBondContact CB-OD1 3.28Å; S751-D753 PolarHBondContact O-N 2.68Å; S751-D753 VanDerWaalsContact OG-CG 3.26Å; S751-D753 PolarHBondContact OG-OD1 2.76Å
754	S	97	Very high	95.7	Very high	16 Å²	16	35.4 Å²	35.4	11%	0.112	17%	0.166	C	C	.	.	S	Bend	trans	-79.9	129.7	-166.3	-60	0	0	0	0	111.5	Q750 S751 C752 L756	Q750-S754 PolarHBondContact NE2-OG 3.23Å; S751-S754 WeakPolarHBondContact O-CB 3.36Å; S751-S754 PolarHBondContact O-N 3.08Å; S751-S754 VanDerWaalsContact O-N 3.11Å; S751-S754 PolarHBondContact O-OG 2.97Å; S751-S754 VanDerWaalsContact O-OG 3.11Å; C752-S754 PolarHBondContact O-N 3.3Å; S754-L756 PolarHBondContact O-N 3.05Å
755	K	96.9	Very high	94.7	Very high	137 Å²	137	36.1 Å²	36.1	60%	0.596	17%	0.172	S	C	*	.			trans	-81.2	97.1	-179.3	-65.6	-176.9	-178.6	-178.9	0	110.6	P606 S607 T608	P606-K755 HydrophobicContact CB-CB 4.06Å; P606-K755 HydrophobicContact CG-CB 4.32Å; S607-K755 WeakPolarHBondContact O-CA 3.42Å; T608-K755 HydrophobicContact CG2-CG 3.76Å
756	L	97.9	Very high	93.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-112.4	174.8	-177.3	-47.9	-170.6	0	0	0	112.3	P606 S607 M703 M705 W707 A736 Q750 S754	P606-L756 CarbonylContact C-O 3.58Å; P606-L756 WeakPolarHBondContact CA-O 3.49Å; P606-L756 WeakPolarHBondContact CB-O 3.45Å; S607-L756 PolarHBondContact N-O 3.3Å; S607-L756 PolarHBondContact O-N 2.64Å; M703-L756 HydrophobicContact CB-CD2 3.93Å; M703-L756 HydrophobicContact CE-CD2 4.19Å; M703-L756 HydrophobicContact CG-CD2 4.44Å; M703-L756 HydrophobicContact SD-CD2 3.65Å; M705-L756 HydrophobicContact CB-CD1 4.19Å; M705-L756 HydrophobicContact CB-CD2 4.32Å; M705-L756 HydrophobicContact CE-CD1 4.1Å; M705-L756 HydrophobicContact CE-CD2 3.67Å; M705-L756 WeakPolarHBondContact O-CB 3.47Å; W707-L756 HydrophobicContact CD2-CB 4.33Å; W707-L756 HydrophobicContact CD2-CD1 3.59Å; W707-L756 HydrophobicContact CD2-CG 4.19Å; W707-L756 VanDerWaalsContact CE2-CD1 3.47Å; W707-L756 HydrophobicContact CE3-CD1 3.83Å; W707-L756 HydrophobicContact CG-CB 4.15Å; W707-L756 HydrophobicContact CG-CD1 4.17Å; W707-L756 HydrophobicContact CH2-CD1 3.86Å; W707-L756 HydrophobicContact CZ2-CD1 3.64Å; W707-L756 HydrophobicContact CZ2-CG 3.87Å; W707-L756 HydrophobicContact CZ3-CD1 3.93Å; A736-L756 HydrophobicContact CB-CD1 3.42Å; A736-L756 VanDerWaalsContact CB-CD1 3.42Å; Q750-L756 HydrophobicContact CB-CD1 4.16Å; Q750-L756 HydrophobicContact CG-CD1 3.89Å; Q750-L756 HydrophobicContact CG-CD2 4.33Å; S754-L756 PolarHBondContact O-N 3.05Å
757	I	98.3	Very high	91.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-73.5	131.2	177.9	-54.3	155.7	0	0	0	109.6	A602 V695 W701 M705 V706 W707 L739 L759	A602-I757 HydrophobicContact CB-CG2 3.97Å; V695-I757 HydrophobicContact CG1-CB 4.49Å; V695-I757 HydrophobicContact CG1-CD1 3.33Å; V695-I757 HydrophobicContact CG1-CG1 3.59Å; V695-I757 HydrophobicContact CG1-CG2 4.04Å; W701-I757 HydrophobicContact CB-CG1 4.23Å; W701-I757 HydrophobicContact CG-CG1 4.07Å; M705-I757 VanDerWaalsContact O-CB 3.3Å; M705-I757 WeakPolarHBondContact O-CB 3.43Å; M705-I757 WeakPolarHBondContact O-CD1 3.29Å; M705-I757 WeakPolarHBondContact O-CG1 3.35Å; M705-I757 PolarHBondContact O-N 3.11Å; V706-I757 WeakPolarHBondContact CA-O 3.28Å; V706-I757 HydrophobicContact CG2-CB 3.86Å; V706-I757 HydrophobicContact CG2-CD1 4.09Å; V706-I757 HydrophobicContact CG2-CG2 3.96Å; W707-I757 PolarHBondContact N-O 3.35Å; L739-I757 HydrophobicContact CD1-CD1 3.68Å; I757-L759 HydrophobicContact CG2-CD2 3.71Å; I757-L759 HydrophobicContact CG2-CG 4.38Å
758	I	98.2	Very high	89.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-99.8	122.9	163	-55.1	-60.9	0	0	0	108	A602 L603 L611 L638 W707	A602-I758 WeakPolarHBondContact CA-O 3.36Å; L603-I758 HydrophobicContact CB-CB 4.34Å; L603-I758 HydrophobicContact CD1-CB 3.71Å; L603-I758 HydrophobicContact CD1-CG1 4.07Å; L603-I758 HydrophobicContact CD1-CG2 3.77Å; L603-I758 HydrophobicContact CG-CB 3.93Å; L603-I758 HydrophobicContact CG-CG2 4Å; L603-I758 PolarHBondContact N-O 3.14Å; L611-I758 HydrophobicContact CD1-CD1 3.68Å; L611-I758 HydrophobicContact CD1-CG1 4.45Å; L611-I758 HydrophobicContact CD2-CD1 4.08Å; L611-I758 HydrophobicContact CD2-CG1 4.23Å; L638-I758 HydrophobicContact CD1-CD1 4.48Å; L638-I758 HydrophobicContact CD2-CD1 4.42Å; W707-I758 HydrophobicContact CB-CD1 3.98Å; W707-I758 HydrophobicContact CG-CD1 4.18Å
759	L	98.3	Very high	86.5	Confident	2 Å²	2	54 Å²	54	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	153.4	168.5	-58.9	-174.4	0	0	0	111.1	V600 A601 A602 F637 I687 V706 L744 I757	V600-L759 HydrophobicContact CG1-CB 4.35Å; V600-L759 HydrophobicContact CG1-CD1 4.2Å; A601-L759 CarbonylContact O-C 3.55Å; A601-L759 WeakPolarHBondContact O-CA 3.45Å; A602-L759 HydrophobicContact CB-CD2 3.9Å; F637-L759 HydrophobicContact CB-CB 3.82Å; F637-L759 WeakPolarHBondContact CB-O 3.34Å; F637-L759 HydrophobicContact CD1-CB 4.49Å; F637-L759 HydrophobicContact CG-CB 4.37Å; F637-L759 PolarHBondContact N-O 3.33Å; I687-L759 HydrophobicContact CD1-CD1 4.15Å; I687-L759 HydrophobicContact CD1-CD2 4.45Å; I687-L759 HydrophobicContact CG2-CD2 3.7Å; V706-L759 HydrophobicContact CG1-CD1 3.9Å; V706-L759 HydrophobicContact CG1-CG 3.8Å; V706-L759 HydrophobicContact CG2-CD1 4.01Å; V706-L759 HydrophobicContact CG2-CD2 4.32Å; V706-L759 HydrophobicContact CG2-CG 3.95Å; L744-L759 HydrophobicContact CD1-CD1 3.69Å; I757-L759 HydrophobicContact CG2-CD2 3.71Å; I757-L759 HydrophobicContact CG2-CG 4.38Å
760	C	98.2	Very high	84	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.7	-179.9	-61.3	0	0	0	0	108.5	V600 A601 L603 C621 F634 K635 F690	V600-C760 WeakPolarHBondContact CA-O 3.27Å; A601-C760 PolarHBondContact N-O 3.35Å; A601-C760 PolarHBondContact O-N 3.31Å; L603-C760 WeakPolarHBondContact CD2-SG 3.18Å; C621-C760 WeakPolarHBondContact CA-SG 3.41Å; C621-C760 HydrophobicContact CB-CB 3.63Å; C621-C760 WeakPolarHBondContact CB-SG 3.41Å; C621-C760 WeakPolarHBondContact SG-CB 3.45Å; C621-C760 CovalentContact SG-SG 2.03Å; C621-C760 PolarHBondContact SG-SG 3.38Å; F634-C760 HydrophobicContact CB-CB 4.45Å; F634-C760 HydrophobicContact CD1-CB 4.43Å; K635-C760 CarbonylContact O-C 3.55Å; K635-C760 WeakPolarHBondContact O-CA 3.4Å; F690-C760 HydrophobicContact CE2-CB 3.76Å; F690-C760 HydrophobicContact CZ-CB 3.68Å
761	V	96.9	Very high	81.1	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.7	-179.7	52.7	0	0	0	0	110.3	V600 F634 K635 F637 I648 V649 W670 A763	V600-V761 HydrophobicContact CG2-CB 4.2Å; V600-V761 HydrophobicContact CG2-CG2 4.28Å; F634-V761 CarbonylContact C-O 3.59Å; F634-V761 WeakPolarHBondContact CA-O 3.33Å; K635-V761 PolarHBondContact N-O 2.88Å; K635-V761 PolarHBondContact O-N 3.26Å; F637-V761 HydrophobicContact CD2-CG1 4.38Å; I648-V761 HydrophobicContact CG2-CG1 3.64Å; V649-V761 HydrophobicContact CG2-CG2 3.97Å; W670-V761 HydrophobicContact CE3-CG2 4.16Å; W670-V761 HydrophobicContact CH2-CB 4.34Å; W670-V761 HydrophobicContact CH2-CG1 4.01Å; W670-V761 HydrophobicContact CH2-CG2 4.03Å; W670-V761 HydrophobicContact CZ3-CB 4.12Å; W670-V761 HydrophobicContact CZ3-CG1 4.3Å; W670-V761 HydrophobicContact CZ3-CG2 3.59Å; V761-A763 PolarHBondContact O-N 3.49Å
762	E	94.4	Very high	78.1	Confident	3 Å²	3	69.1 Å²	69.1	1%	0.014	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	110.1	168.8	-150.8	-177.7	166.1	0	0	109.8	R599 G632 F634 L764 Q766	R599-E762 HydrophobicContact CB-CB 4.35Å; R599-E762 PolarHBondContact O-N 3.2Å; G632-E762 WeakPolarHBondContact CA-OE1 3.39Å; F634-E762 HydrophobicContact CD1-CB 4.24Å; F634-E762 HydrophobicContact CE1-CB 3.86Å; F634-E762 HydrophobicContact CE1-CG 4.25Å; F634-E762 HydrophobicContact CE2-CG 4.36Å; F634-E762 HydrophobicContact CZ-CB 4.17Å; F634-E762 HydrophobicContact CZ-CG 4.08Å; E762-L764 VanDerWaalsContact CG-O 3.31Å; E762-L764 WeakPolarHBondContact CG-O 3.29Å; E762-L764 PolarHBondContact O-N 3.42Å; E762-Q766 VanDerWaalsContact OE1-CG 3.3Å; E762-Q766 WeakPolarHBondContact OE1-CG 3.18Å; E762-Q766 PolarHBondContact OE1-NE2 3.11Å
763	A	89.4	Confident	75.3	Confident	10 Å²	10	80.5 Å²	80.5	8%	0.083	35%	0.35	C	S	.	.	S	Bend	trans	-75.3	-10.2	-172.7	0	0	0	0	0	114.3	T633 K635 I648 V761	T633-A763 PolarHBondContact O-N 3.1Å; K635-A763 HydrophobicContact CB-CB 4.44Å; K635-A763 HydrophobicContact CD-CB 4.02Å; K635-A763 HydrophobicContact CG-CB 4.14Å; I648-A763 HydrophobicContact CG2-CB 4.29Å; V761-A763 PolarHBondContact O-N 3.49Å
764	L	82.9	Confident	72.3	Confident	47 Å²	47	81.8 Å²	81.8	25%	0.246	35%	0.354	C	S	.	.	S	Bend	trans	-138.9	134.3	-178.1	-56.5	-179.4	0	0	0	107.3	T633 R650 E762	T633-L764 HydrophobicContact CG2-CD1 4.26Å; T633-L764 WeakPolarHBondContact OG1-CD1 3.39Å; T633-L764 VanDerWaalsContact OG1-CG 3.32Å; T633-L764 WeakPolarHBondContact OG1-CG 3.42Å; R650-L764 HydrophobicContact CG-CD2 3.74Å; E762-L764 VanDerWaalsContact CG-O 3.31Å; E762-L764 WeakPolarHBondContact CG-O 3.29Å; E762-L764 PolarHBondContact O-N 3.42Å
765	S	74.9	Confident	69.7	Low	22 Å²	22	89.2 Å²	89.2	15%	0.154	39%	0.39	C	S	.	.			trans	-69.9	145.5	171.8	62.8	0	0	0	0	111.6	D653 D767	D653-S765 VanDerWaalsContact OD1-CB 3.24Å; D653-S765 WeakPolarHBondContact OD1-CB 3.49Å; D653-S765 PolarHBondContact OD1-OG 3.37Å; S765-D767 PolarHBondContact O-N 3.31Å
766	Q	63.8	Low	66.6	Low	87 Å²	87	85.7 Å²	85.7	41%	0.407	39%	0.393	S	S	.	.			trans	-73.8	93.1	167.6	-72.3	-41.5	-79.1	0	0	110	E762 R768	E762-Q766 VanDerWaalsContact OE1-CG 3.3Å; E762-Q766 WeakPolarHBondContact OE1-CG 3.18Å; E762-Q766 PolarHBondContact OE1-NE2 3.11Å; Q766-R768 PolarHBondContact O-N 3.35Å
767	D	54.8	Low	63.8	Low	118 Å²	118	94.1 Å²	94.1	63%	0.631	44%	0.438	S	S	*	.			trans	-61.6	105.1	163.5	-145.5	-24.2	0	0	0	109	S765 K769 R770	S765-D767 PolarHBondContact O-N 3.31Å; D767-K769 PolarHBondContact O-N 3.28Å; D767-R770 PolarHBondContact O-N 3.19Å
768	R	50.6	Low	60.6	Low	211 Å²	211	97.5 Å²	97.5	80%	0.796	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-8.6	178.9	-82.2	-172	167.6	-165.9	-4	112.6	Q766	Q766-R768 PolarHBondContact O-N 3.35Å
769	K	40.7	Very low	57.7	Low	167 Å²	167	102.9 Å²	102.9	73%	0.726	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	67.7	172	-68.2	178.3	-177.9	172.7	0	111.8	D767 K771	D767-K769 PolarHBondContact O-N 3.28Å; K769-K771 HydrophobicContact CB-CB 4.4Å; K769-K771 PolarHBondContact O-N 2.93Å
770	R	42.8	Very low	54.6	Low	247 Å²	247	108.4 Å²	108.4	93%	0.932	55%	0.549	S	S	*	.			trans	-68.5	59.7	138.8	-161.8	179.6	-168	-173.3	3.5	109	D767 K772	D767-R770 PolarHBondContact O-N 3.19Å; R770-K772 PolarHBondContact O-N 3.21Å
771	K	36.9	Very low	51.7	Low	154 Å²	154	117.5 Å²	117.5	67%	0.67	59%	0.592	S	S	*	*			trans	-58.5	124.9	-179.4	-158.8	-170	-178.5	-162.4	0	106.3	K769 R773	K769-K771 HydrophobicContact CB-CB 4.4Å; K769-K771 PolarHBondContact O-N 2.93Å; K771-R773 PolarHBondContact O-N 3.37Å
772	K	33.9	Very low	48.5	Very low	152 Å²	152	120.8 Å²	120.8	66%	0.661	63%	0.625	S	S	*	*			trans	-46.3	138.4	167.5	179.4	-179.4	158.5	-143	0	107.7	R770 E774	R770-K772 PolarHBondContact O-N 3.21Å; K772-E774 HydrophobicContact CD-CG 4.24Å; K772-E774 WeakPolarHBondContact CD-OE1 3.41Å; K772-E774 WeakPolarHBondContact CE-OE1 3.47Å; K772-E774 HydrophobicContact CG-CG 4.18Å; K772-E774 IonicContact NZ-OE1 3.4Å; K772-E774 PolarHBondContact NZ-OE1 3.32Å; K772-E774 PolarHBondContact O-N 3.5Å
773	R	37.3	Very low	45.6	Very low	239 Å²	239	130 Å²	130	90%	0.902	67%	0.668	S	S	*	*			trans	-74.4	63.7	-177	-164.3	-175	-169.8	-170.5	3.2	110.4	K771 I775	K771-R773 PolarHBondContact O-N 3.37Å; R773-I775 PolarHBondContact O-N 3.15Å; R773-I775 VanDerWaalsContact O-N 3.16Å
774	E	33.3	Very low	42.9	Very low	106 Å²	106	135.1 Å²	135.1	50%	0.495	70%	0.703	S	S	.	*			trans	-70.4	104.4	169.6	-76.4	165.5	173.2	0	0	107	K772 G776	K772-E774 HydrophobicContact CD-CG 4.24Å; K772-E774 WeakPolarHBondContact CD-OE1 3.41Å; K772-E774 WeakPolarHBondContact CE-OE1 3.47Å; K772-E774 HydrophobicContact CG-CG 4.18Å; K772-E774 IonicContact NZ-OE1 3.4Å; K772-E774 PolarHBondContact NZ-OE1 3.32Å; K772-E774 PolarHBondContact O-N 3.5Å; E774-G776 PolarHBondContact O-N 2.98Å
775	I	42.5	Very low	40.7	Very low	171 Å²	171	139.6 Å²	139.6	88%	0.877	72%	0.723	S	S	*	*			trans	-64.3	97.4	157.8	-61.8	170.2	0	0	0	104.5	R773	R773-I775 PolarHBondContact O-N 3.15Å; R773-I775 VanDerWaalsContact O-N 3.16Å
776	G	31.6	Very low	38.8	Very low	63 Å²	63	144 Å²	144	65%	0.649	75%	0.754	S	S	*	*			trans	-151.1	116.9	-174.8	0	0	0	0	0	107.4	E774	E774-G776 PolarHBondContact O-N 2.98Å
777	D	40.5	Very low	38	Very low	178 Å²	178	148 Å²	148	95%	0.952	77%	0.765	S	S	*	*			trans	-69.6	158.9	-168.2	-156.2	-6	0	0	0	112.6
778	G	30.9	Very low	37.6	Very low	71 Å²	71	150.5 Å²	150.5	73%	0.732	77%	0.773	S	S	*	*			trans	134.5	105.6	179.3	0	0	0	0	0	113.7
779	S	36.5	Very low	38.5	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	75%	0.752	S	S	*	*			trans	-87.4	149	-177.5	58.9	0	0	0	0	114.5
780	S	32.7	Very low	39.4	Very low	118 Å²	118	145 Å²	145	83%	0.825	76%	0.755	S	S	*	*			trans	-152.1	145.7	142.5	57.4	0	0	0	0	110.9
781	H	38.5	Very low	40.8	Very low	192 Å²	192	136.7 Å²	136.7	89%	0.889	73%	0.732	S	S	*	*			trans	-75.9	160.1	-169.3	-64.9	-63.3	0	0	0	113.9
782	G	29.8	Very low	41.7	Very low	68 Å²	68	133 Å²	133	70%	0.701	73%	0.73	S	S	*	*			cis	-173.3	176.6	0.8	0	0	0	0	0	114.1
783	E	33.6	Very low	43.5	Very low	196 Å²	196	132 Å²	132	92%	0.916	73%	0.732	S	S	*	*			trans	-121.4	157	-170.7	-63.7	175.2	116.7	0	0	111.8
784	S	32.2	Very low	45.2	Very low	118 Å²	118	125.1 Å²	125.1	83%	0.825	71%	0.71	S	S	*	*			trans	-78	129.1	163.7	55.7	0	0	0	0	110
785	E	36	Very low	47.1	Very low	142 Å²	142	126.1 Å²	126.1	66%	0.664	71%	0.71	S	S	*	*			trans	-67	129	-160.3	-56.5	-178.8	101.9	0	0	115.6	R787	E785-R787 HydrophobicContact CB-CG 4.33Å; E785-R787 IonicContact OE1-CZ 3.19Å; E785-R787 IonicContact OE1-NE 2.74Å; E785-R787 PolarHBondContact OE1-NE 3.02Å; E785-R787 IonicContact OE1-NH2 2.77Å; E785-R787 PolarHBondContact OE1-NH2 2.91Å; E785-R787 IonicContact OE2-CZ 3.89Å; E785-R787 IonicContact OE2-NE 3.75Å; E785-R787 IonicContact OE2-NH2 3.3Å; E785-R787 PolarHBondContact OE2-NH2 3.01Å
786	S	35.8	Very low	48.4	Very low	115 Å²	115	120.2 Å²	120.2	80%	0.804	69%	0.687	S	S	*	*			trans	-114.4	98.4	146.1	58	0	0	0	0	107.9	E788	S786-E788 PolarHBondContact O-N 3.28Å
787	R	46.9	Very low	50.3	Low	169 Å²	169	119.3 Å²	119.3	64%	0.638	67%	0.673	S	S	*	*			trans	-73	116.5	-177.6	-69.6	-170.8	180	173.6	5	111	E785	E785-R787 HydrophobicContact CB-CG 4.33Å; E785-R787 IonicContact OE1-CZ 3.19Å; E785-R787 IonicContact OE1-NE 2.74Å; E785-R787 PolarHBondContact OE1-NE 3.02Å; E785-R787 IonicContact OE1-NH2 2.77Å; E785-R787 PolarHBondContact OE1-NH2 2.91Å; E785-R787 IonicContact OE2-CZ 3.89Å; E785-R787 IonicContact OE2-NE 3.75Å; E785-R787 IonicContact OE2-NH2 3.3Å; E785-R787 PolarHBondContact OE2-NH2 3.01Å
788	E	46.3	Very low	52	Low	172 Å²	172	114.3 Å²	114.3	80%	0.804	64%	0.644	S	S	*	*			trans	-109.7	107.6	176.2	-168.4	171.9	-121.9	0	0	108.5	S786	S786-E788 PolarHBondContact O-N 3.28Å
789	F	70.4	Confident	53.7	Low	79 Å²	79	114.6 Å²	114.6	35%	0.346	63%	0.629	S	S	.	*			trans	-71.3	137.3	-179	-58.7	-85.5	0	0	0	110.3	E794 Y795 H798	F789-E794 HydrophobicContact CD1-CB 4.24Å; F789-Y795 AromaticContact CD2-CD2 3.83Å; F789-Y795 HydrophobicContact CD2-CD2 3.83Å; F789-Y795 HydrophobicContact CE2-CD2 4.08Å; F789-Y795 HydrophobicContact CG-CD2 4.29Å; F789-H798 HydrophobicContact CE1-CB 3.97Å; F789-H798 AromaticContact CE1-CD2 3.67Å; F789-H798 AromaticContact CE1-CG 3.85Å; F789-H798 HydrophobicContact CZ-CB 4.18Å; F789-H798 AromaticContact CZ-CD2 3.48Å; F789-H798 VanDerWaalsContact CZ-CD2 3.48Å; F789-H798 WeakPolarHBondContact CZ-CD2 3.27Å; F789-H798 AromaticContact CZ-CG 3.64Å; F789-H798 AromaticContact CZ-ND1 3.99Å; F789-H798 AromaticContact CZ-NE2 3.75Å
790	K	58.8	Low	55.4	Low	184 Å²	184	116.1 Å²	116.1	80%	0.8	62%	0.623	S	S	*	*			trans	-101.4	-14.3	-169.9	-69.2	178.3	-178.4	172	0	113.6	E794	K790-E794 PolarHBondContact N-OE2 3.42Å; K790-E794 VanDerWaalsContact N-OE2 3.09Å
791	T	71.6	Confident	57	Low	71 Å²	71	116.3 Å²	116.3	44%	0.436	62%	0.615	S	S	.	*	S	Bend	trans	-133.1	155.8	176.3	60.4	0	0	0	0	111.1	D793 E794 Y795	T791-D793 VanDerWaalsContact C-N 3.26Å; T791-D793 PolarHBondContact O-N 3.44Å; T791-E794 PolarHBondContact N-OE2 3.39Å; T791-E794 WeakPolarHBondContact OG1-CB 3.34Å; T791-E794 VanDerWaalsContact OG1-CD 3.3Å; T791-E794 WeakPolarHBondContact OG1-CG 3.46Å; T791-E794 PolarHBondContact OG1-N 3.46Å; T791-E794 PolarHBondContact OG1-OE2 2.77Å; T791-Y795 PolarHBondContact O-N 3.44Å
792	A	57.4	Low	58.1	Low	77 Å²	77	112.7 Å²	112.7	64%	0.636	60%	0.602	S	S	*	*	H	α-helix	trans	-65.4	-33.7	175.5	0	0	0	0	0	111.6	Y795 A796	A792-Y795 PolarHBondContact O-N 3.39Å; A792-A796 PolarHBondContact O-N 3.33Å
793	D	71.9	Confident	59	Low	130 Å²	130	116.8 Å²	116.8	70%	0.695	61%	0.607	S	S	*	*	H	α-helix	trans	-71.6	-36.6	-177	-49.7	-53.2	0	0	0	112.2	T791 Y795 A796 A797	T791-D793 VanDerWaalsContact C-N 3.26Å; T791-D793 PolarHBondContact O-N 3.44Å; D793-Y795 VanDerWaalsContact C-N 3.3Å; D793-Y795 PolarHBondContact O-N 3.11Å; D793-A796 PolarHBondContact O-N 3.49Å; D793-A797 WeakPolarHBondContact O-CB 3.37Å; D793-A797 PolarHBondContact O-N 3.39Å
794	E	72.6	Confident	59.4	Low	96 Å²	96	117.7 Å²	117.7	45%	0.449	62%	0.617	S	S	.	*	H	α-helix	trans	-59.6	-40.5	169.3	-77.9	169	127.5	0	0	111.9	F789 K790 T791 H798	F789-E794 HydrophobicContact CD1-CB 4.24Å; K790-E794 PolarHBondContact N-OE2 3.42Å; K790-E794 VanDerWaalsContact N-OE2 3.09Å; T791-E794 PolarHBondContact N-OE2 3.39Å; T791-E794 WeakPolarHBondContact OG1-CB 3.34Å; T791-E794 VanDerWaalsContact OG1-CD 3.3Å; T791-E794 WeakPolarHBondContact OG1-CG 3.46Å; T791-E794 PolarHBondContact OG1-N 3.46Å; T791-E794 PolarHBondContact OG1-OE2 2.77Å; E794-H798 VanDerWaalsContact O-CB 3.32Å; E794-H798 WeakPolarHBondContact O-CB 3.5Å; E794-H798 PolarHBondContact O-N 3.31Å
795	Y	71.8	Confident	60.8	Low	126 Å²	126	117.7 Å²	117.7	49%	0.494	61%	0.606	S	S	.	*	H	α-helix	trans	-72.1	-37.8	178.9	-174	-113.2	0	0	0	111.9	F789 T791 A792 D793 H798 L799	F789-Y795 AromaticContact CD2-CD2 3.83Å; F789-Y795 HydrophobicContact CD2-CD2 3.83Å; F789-Y795 HydrophobicContact CE2-CD2 4.08Å; F789-Y795 HydrophobicContact CG-CD2 4.29Å; T791-Y795 PolarHBondContact O-N 3.44Å; A792-Y795 PolarHBondContact O-N 3.39Å; D793-Y795 VanDerWaalsContact C-N 3.3Å; D793-Y795 PolarHBondContact O-N 3.11Å; Y795-H798 PolarHBondContact O-N 3.4Å; Y795-L799 HydrophobicContact CD1-CD1 3.99Å; Y795-L799 HydrophobicContact CE1-CD1 3.61Å; Y795-L799 HydrophobicContact CE1-CG 4.37Å; Y795-L799 WeakPolarHBondContact O-CG 3.44Å; Y795-L799 PolarHBondContact O-N 3.2Å
796	A	71.2	Confident	62.1	Low	47 Å²	47	116.4 Å²	116.4	39%	0.388	60%	0.603	S	S	.	*	H	α-helix	trans	-62.7	-49.1	173	0	0	0	0	0	111.7	A792 D793 H798 L799 E800	A792-A796 PolarHBondContact O-N 3.33Å; D793-A796 PolarHBondContact O-N 3.49Å; A796-H798 VanDerWaalsContact C-N 3.27Å; A796-H798 PolarHBondContact O-N 3.27Å; A796-L799 WeakPolarHBondContact O-CB 3.34Å; A796-L799 PolarHBondContact O-N 3.34Å; A796-E800 PolarHBondContact O-N 3.03Å
797	A	71.8	Confident	63.5	Low	44 Å²	44	116.4 Å²	116.4	36%	0.364	59%	0.592	S	S	.	*	H	α-helix	trans	-62.1	-33.5	176.4	0	0	0	0	0	112.5	D793 N801	D793-A797 WeakPolarHBondContact O-CB 3.37Å; D793-A797 PolarHBondContact O-N 3.39Å; A797-N801 PolarHBondContact O-N 3.47Å; A797-N801 VanDerWaalsContact O-N 3.16Å; A797-N801 PolarHBondContact O-ND2 3.47Å
798	H	75.4	Confident	64.5	Low	74 Å²	74	113.4 Å²	113.4	34%	0.343	59%	0.589	S	S	.	*	H	α-helix	trans	-69.1	-31	173	-173.6	-81.7	0	0	0	112.9	F789 E794 Y795 A796 L802	F789-H798 HydrophobicContact CE1-CB 3.97Å; F789-H798 AromaticContact CE1-CD2 3.67Å; F789-H798 AromaticContact CE1-CG 3.85Å; F789-H798 HydrophobicContact CZ-CB 4.18Å; F789-H798 AromaticContact CZ-CD2 3.48Å; F789-H798 VanDerWaalsContact CZ-CD2 3.48Å; F789-H798 WeakPolarHBondContact CZ-CD2 3.27Å; F789-H798 AromaticContact CZ-CG 3.64Å; F789-H798 AromaticContact CZ-ND1 3.99Å; F789-H798 AromaticContact CZ-NE2 3.75Å; E794-H798 VanDerWaalsContact O-CB 3.32Å; E794-H798 WeakPolarHBondContact O-CB 3.5Å; E794-H798 PolarHBondContact O-N 3.31Å; Y795-H798 PolarHBondContact O-N 3.4Å; A796-H798 VanDerWaalsContact C-N 3.27Å; A796-H798 PolarHBondContact O-N 3.27Å; H798-L802 WeakPolarHBondContact O-CG 3.5Å
799	L	66.6	Low	65.6	Low	77 Å²	77	109.7 Å²	109.7	40%	0.403	58%	0.576	S	S	.	*	H	α-helix	trans	-76	-37.5	174.3	-73.5	171.3	0	0	0	112.6	Y795 A796 N801 L802	Y795-L799 HydrophobicContact CD1-CD1 3.99Å; Y795-L799 HydrophobicContact CE1-CD1 3.61Å; Y795-L799 HydrophobicContact CE1-CG 4.37Å; Y795-L799 WeakPolarHBondContact O-CG 3.44Å; Y795-L799 PolarHBondContact O-N 3.2Å; A796-L799 WeakPolarHBondContact O-CB 3.34Å; A796-L799 PolarHBondContact O-N 3.34Å; L799-N801 VanDerWaalsContact C-N 3.35Å; L799-L802 PolarHBondContact O-N 3.28Å; L799-L802 VanDerWaalsContact O-N 3.11Å
800	E	72	Confident	65.3	Low	144 Å²	144	111.7 Å²	111.7	67%	0.673	59%	0.591	S	S	*	*	H	α-helix	trans	-63.6	-40.3	173.8	-69.7	-170.9	147.1	0	0	111.8	A796 L802 L803	A796-E800 PolarHBondContact O-N 3.03Å; E800-L802 PolarHBondContact O-N 3.47Å; E800-L802 VanDerWaalsContact O-N 3.11Å; E800-L803 PolarHBondContact O-N 3.46Å; E800-L803 VanDerWaalsContact O-N 3.13Å
801	N	65.5	Low	65.8	Low	121 Å²	121	106.6 Å²	106.6	65%	0.647	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	1	173.6	-77.6	-81.4	0	0	0	114.4	A797 L799	A797-N801 PolarHBondContact O-N 3.47Å; A797-N801 VanDerWaalsContact O-N 3.16Å; A797-N801 PolarHBondContact O-ND2 3.47Å; L799-N801 VanDerWaalsContact C-N 3.35Å
802	L	62.6	Low	65.3	Low	116 Å²	116	109.3 Å²	109.3	61%	0.607	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	4.7	172.3	-77.7	169.3	0	0	0	113.2	H798 L799 E800	H798-L802 WeakPolarHBondContact O-CG 3.5Å; L799-L802 PolarHBondContact O-N 3.28Å; L799-L802 VanDerWaalsContact O-N 3.11Å; E800-L802 PolarHBondContact O-N 3.47Å; E800-L802 VanDerWaalsContact O-N 3.11Å
803	L	49	Very low	66	Low	155 Å²	155	112 Å²	112	81%	0.812	58%	0.583	S	S	*	*			trans	-118.9	13.6	178.9	-70.1	169.8	0	0	0	113.1	E800	E800-L803 PolarHBondContact O-N 3.46Å; E800-L803 VanDerWaalsContact O-N 3.13Å
804	L	41.5	Very low	65.5	Low	214 Å²	214	110.4 Å²	110.4	100%	1.12	57%	0.573	S	S	*	*			trans	-113.7	0	169.6	-78.2	166.4	0	0	0	110.4

Retrieved 804 of 804 residues in 259.8 ms (Link to these results)

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