A0A087Y7Z9_POEFO Loading...

RAS p21 protein activator 2

AlphaFold DB , UniProt , Accession A0A087Y7Z9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 835 aa.

						>A0A087Y7Z9_POEFO|A0A087Y7Z9
NAPEQRQQHSALTMAEEDDARIRILQSLRGKICEAKNLGPVSGPNRLKDLCTFCTISLDQEEVFRTKVFDKSITPFYGEDFFFEIPRPFQFLSFYVYAKGVFQRDLPVGKVSIRKDDLCKYSGKDDWFNLQPVDPNTEVQGKVHLEMRLNEVITDHGSTGQHLLVKIIECKELPLISGQNCDPYATVSLVGPARSDQKKTKVKKKTSNPYFEETFFFEVTRSSSYSRKSQFPVEEEDIEKLEIRVDLWNNENLAQDAFLGETRVPVKILQSDRVHKAWYLLQPKGTGSKSKSDDLGQLRLKLTYIEDTVLPSTCYTPLCNLLLKSPDVKPISASAAHILGDIFRERYEAVLPMVRLLLYHSRFVPFVSAVAALELDNTQEANTIFRGNSLATRCIDDMMKIVGKSYLAVTLKPVIDEICDSNKTCEIDPIKLKEGDNVEVNKENLQVYVQKVFSSITQSSSNCPPLMCDVFRSLRHLACKRFLGDPHVQYSAVSSFVFLRFFAVAVLSPHSFQLRSHHPDPEIARTLTLISKTIQTLGSWGSLSKKLSSFKESYMYDFYKSFQEEKCIEKVKKFLDEISSNVSKESCRQEDAVVLKEGEVQKRTQGKKNFSKRNFKKRWLRVTNRELSYHKRKGKEALCTISVKNIQAVEKLDESAFNRKNMFQVVLSEKPLYVQAGNCVEASEWLEILGQVSRCNEGRLTTYHSSNYTAGAWQCCKNQSGSAPGCKPCTITMLANLQLDIDCDREAERIFSLLSSNESKLQNMEDACASMAVYQGPQREQEEYSKFTIQEPKETFQTLKQLRNVMEELQRQHNSRNNTTAQYGSLDNPIVGKTS
					

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(Predicted Aligned Error values between residue pairs)

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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	N	39.5	Very low	31.6	Very low	174 Å²	174	123.4 Å²	123.4	93%	0.93	64%	0.642	S	S	*	*				0	-13.5	0	-61.9	7.9	0	0	0	115.5
2	A	34.4	Very low	31.4	Very low	75 Å²	75	121.5 Å²	121.5	62%	0.62	63%	0.632	S	S	*	*			trans	-91	-23.6	174.5	0	0	0	0	0	117.5
3	P	36.2	Very low	31.2	Very low	91 Å²	91	117.3 Å²	117.3	59%	0.591	62%	0.615	S	S	*	*	H	α-helix	trans	-81.8	-28.6	-177.9	27.8	-28.8	0	0	0	114.3	R6 Q7	P3-R6 PolarHBondContact O-N 3.29Å; P3-Q7 PolarHBondContact O-N 2.91Å
4	E	30.3	Very low	31	Very low	136 Å²	136	115.4 Å²	115.4	64%	0.636	60%	0.603	S	S	*	*	H	α-helix	trans	-68.7	-36.4	176.7	-75.6	173	149.3	0	0	112.7	Q7 Q8	E4-Q7 PolarHBondContact O-N 2.94Å; E4-Q8 PolarHBondContact O-N 2.52Å
5	Q	28.4	Very low	31	Very low	138 Å²	138	110.8 Å²	110.8	65%	0.645	59%	0.589	S	S	*	*	H	α-helix	trans	-70.4	-32.3	176.8	-75.3	-177.9	-15.7	0	0	112.7	H9	Q5-H9 WeakPolarHBondContact O-CB 3.41Å; Q5-H9 PolarHBondContact O-N 3.45Å
6	R	28.3	Very low	30.9	Very low	208 Å²	208	111.9 Å²	111.9	79%	0.785	59%	0.589	S	S	*	*	H	α-helix	trans	-72.9	-34.4	175.1	-86.1	-173.6	-175.1	177.7	2.1	113	P3 S10	P3-R6 PolarHBondContact O-N 3.29Å; R6-S10 VanDerWaalsContact O-CB 3.23Å; R6-S10 WeakPolarHBondContact O-CB 3.48Å; R6-S10 PolarHBondContact O-N 3.07Å
7	Q	32	Very low	31.1	Very low	150 Å²	150	113.6 Å²	113.6	70%	0.701	59%	0.593	S	S	*	*	H	α-helix	trans	-70.7	-37.9	173.6	-82	179.3	-20.4	0	0	112	P3 E4 A11	P3-Q7 PolarHBondContact O-N 2.91Å; E4-Q7 PolarHBondContact O-N 2.94Å; Q7-A11 VanDerWaalsContact O-CB 3.25Å; Q7-A11 WeakPolarHBondContact O-CB 3.06Å; Q7-A11 PolarHBondContact O-N 3.32Å
8	Q	30.5	Very low	31.5	Very low	131 Å²	131	110.9 Å²	110.9	61%	0.612	58%	0.58	S	S	*	*	H	α-helix	trans	-65.5	-42.4	171.2	-80.4	179	-14.8	0	0	112.3	E4 A11 L12	E4-Q8 PolarHBondContact O-N 2.52Å; Q8-A11 PolarHBondContact O-N 3.34Å; Q8-L12 WeakPolarHBondContact O-CB 3.49Å; Q8-L12 WeakPolarHBondContact O-CD1 2.91Å; Q8-L12 WeakPolarHBondContact O-CG 3.21Å; Q8-L12 PolarHBondContact O-N 3.48Å
9	H	27.6	Very low	32.2	Very low	133 Å²	133	107.2 Å²	107.2	62%	0.616	56%	0.561	S	S	*	*	H	α-helix	trans	-69.6	-36.4	177.7	-113.1	-19.2	0	0	0	113.4	Q5 L12 T13	Q5-H9 WeakPolarHBondContact O-CB 3.41Å; Q5-H9 PolarHBondContact O-N 3.45Å; H9-L12 PolarHBondContact O-N 3.33Å; H9-T13 WeakPolarHBondContact O-CB 3.44Å; H9-T13 WeakPolarHBondContact O-CG2 3.32Å; H9-T13 PolarHBondContact O-N 3.35Å; H9-T13 PolarHBondContact O-OG1 2.84Å
10	S	29	Very low	33	Very low	59 Å²	59	105 Å²	105	41%	0.413	56%	0.559	S	S	.	*	H	α-helix	trans	-68.6	-34.8	173.6	178.2	0	0	0	0	112.1	R6 T13 M14	R6-S10 VanDerWaalsContact O-CB 3.23Å; R6-S10 WeakPolarHBondContact O-CB 3.48Å; R6-S10 PolarHBondContact O-N 3.07Å; S10-T13 WeakPolarHBondContact CA-OG1 3.26Å; S10-T13 PolarHBondContact O-OG1 3.41Å; S10-M14 VanDerWaalsContact O-CB 3.29Å; S10-M14 WeakPolarHBondContact O-CB 3.34Å; S10-M14 VanDerWaalsContact O-CG 3.26Å; S10-M14 WeakPolarHBondContact O-CG 3.43Å; S10-M14 PolarHBondContact O-N 3.46Å
11	A	31	Very low	34.4	Very low	62 Å²	62	108.1 Å²	108.1	51%	0.512	56%	0.563	S	S	.	*	H	α-helix	trans	-71.6	-34.6	174	0	0	0	0	0	112.4	Q7 Q8 A15	Q7-A11 VanDerWaalsContact O-CB 3.25Å; Q7-A11 WeakPolarHBondContact O-CB 3.06Å; Q7-A11 PolarHBondContact O-N 3.32Å; Q8-A11 PolarHBondContact O-N 3.34Å; A11-A15 WeakPolarHBondContact O-CB 3.36Å; A11-A15 PolarHBondContact O-N 3.2Å
12	L	29.7	Very low	36.1	Very low	101 Å²	101	102.3 Å²	102.3	53%	0.529	53%	0.531	S	S	.	.	H	α-helix	trans	-69.9	-45.1	174.2	-81.4	156.6	0	0	0	112	Q8 H9 A15 E16	Q8-L12 WeakPolarHBondContact O-CB 3.49Å; Q8-L12 WeakPolarHBondContact O-CD1 2.91Å; Q8-L12 WeakPolarHBondContact O-CG 3.21Å; Q8-L12 PolarHBondContact O-N 3.48Å; H9-L12 PolarHBondContact O-N 3.33Å; L12-A15 PolarHBondContact O-N 2.95Å; L12-E16 WeakPolarHBondContact O-CG 3.36Å; L12-E16 PolarHBondContact O-N 2.83Å
13	T	28.3	Very low	38.2	Very low	67 Å²	67	101.9 Å²	101.9	41%	0.411	51%	0.514	S	S	.	.	H	α-helix	trans	-71.4	-32.8	179	43.7	0	0	0	0	113.1	H9 S10 E16 E17	H9-T13 WeakPolarHBondContact O-CB 3.44Å; H9-T13 WeakPolarHBondContact O-CG2 3.32Å; H9-T13 PolarHBondContact O-N 3.35Å; H9-T13 PolarHBondContact O-OG1 2.84Å; S10-T13 WeakPolarHBondContact CA-OG1 3.26Å; S10-T13 PolarHBondContact O-OG1 3.41Å; T13-E16 PolarHBondContact O-N 3.41Å; T13-E17 PolarHBondContact O-N 3.34Å; T13-E17 VanDerWaalsContact O-N 3.13Å
14	M	28.8	Very low	40.3	Very low	90 Å²	90	102.6 Å²	102.6	44%	0.443	51%	0.511	S	S	.	.	H	α-helix	trans	-77.5	-25.8	171.4	-69.9	-169.1	74.6	0	0	113.4	S10 D18	S10-M14 VanDerWaalsContact O-CB 3.29Å; S10-M14 WeakPolarHBondContact O-CB 3.34Å; S10-M14 VanDerWaalsContact O-CG 3.26Å; S10-M14 WeakPolarHBondContact O-CG 3.43Å; S10-M14 PolarHBondContact O-N 3.46Å; M14-D18 PolarHBondContact O-N 3.48Å
15	A	31.3	Very low	42.8	Very low	47 Å²	47	97.8 Å²	97.8	39%	0.388	49%	0.49	S	S	.	.	H	α-helix	trans	-68.2	-37.2	168.3	0	0	0	0	0	111.1	A11 L12 D19	A11-A15 WeakPolarHBondContact O-CB 3.36Å; A11-A15 PolarHBondContact O-N 3.2Å; L12-A15 PolarHBondContact O-N 2.95Å; A15-D19 VanDerWaalsContact O-CB 3.31Å; A15-D19 WeakPolarHBondContact O-CB 3.47Å; A15-D19 PolarHBondContact O-N 2.97Å
16	E	29.6	Very low	45.5	Very low	128 Å²	128	92 Å²	92	60%	0.598	46%	0.463	S	S	*	.	H	α-helix	trans	-67	-33.5	173.9	-74.4	171	168.5	0	0	113	L12 T13	L12-E16 WeakPolarHBondContact O-CG 3.36Å; L12-E16 PolarHBondContact O-N 2.83Å; T13-E16 PolarHBondContact O-N 3.41Å
17	E	34.6	Very low	48.4	Very low	141 Å²	141	82.5 Å²	82.5	66%	0.659	43%	0.428	S	S	*	.	H	α-helix	trans	-73.6	-30.1	178.4	-78.9	-175.5	167.7	0	0	114.1	T13	T13-E17 PolarHBondContact O-N 3.34Å; T13-E17 VanDerWaalsContact O-N 3.13Å
18	D	38.3	Very low	51.1	Low	65 Å²	65	75.4 Å²	75.4	35%	0.348	40%	0.395	S	S	.	.	H	α-helix	trans	-91.2	-19.3	173.6	-102.2	-2.2	0	0	0	113.4	M14 A20 R21	M14-D18 PolarHBondContact O-N 3.48Å; D18-A20 PolarHBondContact O-N 2.89Å; D18-A20 VanDerWaalsContact O-N 3.1Å; D18-R21 PolarHBondContact O-N 3.46Å; D18-R21 VanDerWaalsContact O-N 3.16Å; D18-R21 IonicContact OD1-CZ 3.73Å; D18-R21 VanDerWaalsContact OD1-CZ 3.23Å; D18-R21 IonicContact OD1-NE 3.92Å; D18-R21 PolarHBondContact OD1-NE 2.98Å; D18-R21 IonicContact OD1-NH2 2.79Å; D18-R21 PolarHBondContact OD1-NH2 3.44Å
19	D	43.6	Very low	53.8	Low	41 Å²	41	74 Å²	74	22%	0.219	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-11.3	165.8	-160.3	20.2	0	0	0	111.2	A15 P311 S312	A15-D19 VanDerWaalsContact O-CB 3.31Å; A15-D19 WeakPolarHBondContact O-CB 3.47Å; A15-D19 PolarHBondContact O-N 2.97Å; D19-P311 WeakPolarHBondContact O-CB 3.42Å; D19-P311 WeakPolarHBondContact O-CG 3.3Å; D19-S312 PolarHBondContact OD1-N 2.73Å; D19-S312 VanDerWaalsContact OD1-N 3.15Å; D19-S312 PolarHBondContact OD1-OG 2.83Å
20	A	48.4	Very low	56.6	Low	63 Å²	63	68.3 Å²	68.3	52%	0.521	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-14.2	174.8	0	0	0	0	0	115.1	D18	D18-A20 PolarHBondContact O-N 2.89Å; D18-A20 VanDerWaalsContact O-N 3.1Å
21	R	62.4	Low	59.5	Low	171 Å²	171	68.2 Å²	68.2	65%	0.645	35%	0.353	S	S	*	.	S	Bend	trans	-93	128.5	-172.6	-65.2	-167.5	-137	-143.2	1.6	113.1	D18 R23	D18-R21 PolarHBondContact O-N 3.46Å; D18-R21 VanDerWaalsContact O-N 3.16Å; D18-R21 IonicContact OD1-CZ 3.73Å; D18-R21 VanDerWaalsContact OD1-CZ 3.23Å; D18-R21 IonicContact OD1-NE 3.92Å; D18-R21 PolarHBondContact OD1-NE 2.98Å; D18-R21 IonicContact OD1-NH2 2.79Å; D18-R21 PolarHBondContact OD1-NH2 3.44Å; R21-R23 PolarHBondContact O-N 3.37Å
22	I	74.8	Confident	62.3	Low	52 Å²	52	65.2 Å²	65.2	27%	0.267	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-66	127.4	172.6	-57.9	167.7	0	0	0	109	T308 V309 L310 R816	I22-T308 HydrophobicContact CG2-CG2 3.39Å; I22-V309 WeakPolarHBondContact CA-O 3.28Å; I22-L310 HydrophobicContact CG1-CD2 4.29Å; I22-R816 HydrophobicContact CD1-CB 3.73Å; I22-R816 HydrophobicContact CD1-CG 4.44Å
23	R	80.1	Confident	65	Low	66 Å²	66	61 Å²	61	25%	0.249	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.4	177.6	-55.6	-175	-73.4	143.7	-6.5	109.5	R21 V309 D742 D744	R21-R23 PolarHBondContact O-N 3.37Å; R23-V309 HydrophobicContact CB-CB 4.23Å; R23-V309 PolarHBondContact N-O 2.91Å; R23-V309 PolarHBondContact O-N 3.2Å; R23-D742 IonicContact CZ-OD1 3.75Å; R23-D742 IonicContact CZ-OD2 3.39Å; R23-D742 IonicContact NH1-OD1 3.78Å; R23-D742 IonicContact NH1-OD2 3.72Å; R23-D742 PolarHBondContact NH1-OD2 3.44Å; R23-D742 IonicContact NH2-OD1 3.44Å; R23-D742 PolarHBondContact NH2-OD1 3.12Å; R23-D742 IonicContact NH2-OD2 3.46Å; R23-D742 PolarHBondContact NH2-OD2 3.34Å; R23-D742 VanDerWaalsContact NH2-OD2 3.13Å; R23-D744 IonicContact NH2-OD2 2.67Å
24	I	79.6	Confident	67.9	Low	106 Å²	106	59.6 Å²	59.6	54%	0.544	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	107.4	173.3	-57.9	173.8	0	0	0	107.3	Q26 E306	I24-Q26 HydrophobicContact CG2-CG 4.25Å; I24-E306 HydrophobicContact CG2-CG 3.85Å
25	L	82.4	Confident	70.7	Confident	34 Å²	34	55.3 Å²	55.3	18%	0.178	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.4	179.4	-62.2	-179.1	0	0	0	109.5	D307 V309 R745	L25-D307 PolarHBondContact N-O 3.23Å; L25-D307 PolarHBondContact O-N 3.33Å; L25-V309 HydrophobicContact CD1-CG2 3.96Å; L25-V309 HydrophobicContact CG-CG2 4.33Å; L25-R745 HydrophobicContact CD1-CB 4.12Å; L25-R745 HydrophobicContact CD1-CG 3.87Å
26	Q	85.8	Confident	73.3	Confident	18 Å²	18	56.6 Å²	56.6	8%	0.084	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.2	-178.2	-70.5	170.8	-21.5	0	0	109.4	I24 I85 K115 Y304 I305 E306	I24-Q26 HydrophobicContact CG2-CG 4.25Å; Q26-I85 HydrophobicContact CB-CB 3.79Å; Q26-I85 HydrophobicContact CB-CD1 4.21Å; Q26-I85 HydrophobicContact CB-CG2 4.28Å; Q26-I85 PolarHBondContact O-N 2.98Å; Q26-K115 VanDerWaalsContact NE2-CE 3.33Å; Q26-K115 VanDerWaalsContact NE2-NZ 3.13Å; Q26-Y304 HydrophobicContact CB-CE2 4.32Å; Q26-Y304 VanDerWaalsContact CD-OH 3.23Å; Q26-Y304 HydrophobicContact CG-CE2 4.44Å; Q26-Y304 WeakPolarHBondContact CG-OH 3.26Å; Q26-Y304 PolarHBondContact NE2-OH 3.47Å; Q26-I305 CarbonylContact C-O 3.33Å; Q26-I305 WeakPolarHBondContact CA-O 3.41Å; Q26-E306 HydrophobicContact CG-CB 4.24Å; Q26-E306 HydrophobicContact CG-CG 3.9Å; Q26-E306 PolarHBondContact NE2-OE2 2.59Å
27	S	87.8	Confident	75.7	Confident	7 Å²	7	54.9 Å²	54.9	5%	0.049	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.1	174.9	63.8	0	0	0	0	111	I305	S27-I305 PolarHBondContact N-O 3.11Å; S27-I305 PolarHBondContact O-N 3.35Å
28	L	88.9	Confident	77.7	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.9	175.7	-172.2	75.3	0	0	0	108.7	F81 F82 F83 I85 L92 Y304	L28-F81 HydrophobicContact CD2-CE2 3.74Å; L28-F81 HydrophobicContact CD2-CZ 4.5Å; L28-F81 HydrophobicContact CG-CE2 3.92Å; L28-F82 WeakPolarHBondContact O-CA 3.46Å; L28-F83 HydrophobicContact CB-CE2 4.1Å; L28-F83 HydrophobicContact CB-CZ 4.4Å; L28-F83 HydrophobicContact CD2-CE1 4.42Å; L28-F83 HydrophobicContact CD2-CE2 4.01Å; L28-F83 HydrophobicContact CD2-CZ 3.64Å; L28-F83 PolarHBondContact N-O 3.41Å; L28-F83 PolarHBondContact O-N 3.45Å; L28-I85 HydrophobicContact CB-CD1 3.98Å; L28-I85 HydrophobicContact CB-CG1 4.48Å; L28-L92 HydrophobicContact CD1-CD2 4.02Å; L28-L92 HydrophobicContact CD2-CD1 3.52Å; L28-L92 HydrophobicContact CD2-CD2 3.48Å; L28-L92 VanDerWaalsContact CD2-CD2 3.48Å; L28-L92 HydrophobicContact CD2-CG 4.15Å; L28-L92 HydrophobicContact CG-CD2 4.4Å; L28-Y304 HydrophobicContact CD1-CD2 4.31Å
29	R	88.2	Confident	78.9	Confident	102 Å²	102	46.1 Å²	46.1	39%	0.385	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.6	171.9	72	-174.5	-174.2	-168.7	1.7	109.4	F81 F82 T303	R29-F81 WeakPolarHBondContact CA-O 3.49Å; R29-F82 HydrophobicContact CB-CD2 3.9Å; R29-T303 HydrophobicContact CG-CG2 4.13Å; R29-T303 PolarHBondContact N-O 3.42Å; R29-T303 PolarHBondContact O-N 2.94Å
30	G	87.1	Confident	79.4	Confident	14 Å²	14	48.6 Å²	48.6	14%	0.144	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	-176	178.6	0	0	0	0	0	113.7	D80 F81 K301	G30-D80 CarbonylContact O-C 3.49Å; G30-D80 WeakPolarHBondContact O-CA 3.47Å; G30-F81 VanDerWaalsContact C-CE1 3.41Å; G30-F81 PolarHBondContact N-O 3.1Å; G30-F81 WeakPolarHBondContact O-CD1 3.31Å; G30-F81 PolarHBondContact O-N 3.33Å; G30-K301 CarbonylContact C-O 3.55Å; G30-K301 WeakPolarHBondContact CA-O 3.32Å
31	K	88.2	Confident	79.6	Confident	56 Å²	56	47 Å²	47	24%	0.243	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.7	175.9	-170.1	176.3	-169.5	125.4	0	109.8	C33 G78 E79 D80 K301	K31-C33 PolarHBondContact O-N 2.92Å; K31-G78 VanDerWaalsContact CE-C 3.48Å; K31-G78 WeakPolarHBondContact CE-O 3.26Å; K31-G78 PolarHBondContact NZ-O 3.35Å; K31-E79 WeakPolarHBondContact CA-O 3.44Å; K31-D80 VanDerWaalsContact CD-OD1 3.26Å; K31-D80 WeakPolarHBondContact CD-OD1 3.43Å; K31-D80 WeakPolarHBondContact CG-OD1 3.47Å; K31-D80 IonicContact NZ-OD1 2.75Å; K31-D80 PolarHBondContact NZ-OD1 3.47Å; K31-D80 IonicContact NZ-OD2 3.47Å; K31-K301 HydrophobicContact CB-CB 4.29Å; K31-K301 PolarHBondContact N-O 3.34Å; K31-K301 PolarHBondContact O-N 3.4Å
32	I	89.4	Confident	78.9	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	104.9	165.4	-57	169.8	0	0	0	105.7	C54 I56 F64 T66 Y77 G78 E79 F81 F94 L298 L300	I32-C54 HydrophobicContact CD1-CB 4.08Å; I32-C54 HydrophobicContact CG2-CB 4.08Å; I32-I56 HydrophobicContact CD1-CD1 4.03Å; I32-I56 HydrophobicContact CD1-CG1 3.98Å; I32-F64 HydrophobicContact CD1-CD1 4.44Å; I32-F64 HydrophobicContact CD1-CE1 4.37Å; I32-T66 HydrophobicContact CD1-CG2 3.68Å; I32-Y77 HydrophobicContact CG2-CD2 3.65Å; I32-Y77 HydrophobicContact CG2-CE2 4.41Å; I32-Y77 HydrophobicContact CG2-CG 3.99Å; I32-G78 WeakPolarHBondContact O-CA 3.32Å; I32-G78 PolarHBondContact O-N 2.84Å; I32-E79 PolarHBondContact N-O 3.46Å; I32-E79 PolarHBondContact O-N 2.93Å; I32-F81 HydrophobicContact CD1-CD1 4.45Å; I32-F81 HydrophobicContact CG1-CD1 4.09Å; I32-F81 HydrophobicContact CG1-CE1 3.94Å; I32-F94 HydrophobicContact CD1-CD1 4.48Å; I32-F94 HydrophobicContact CG1-CD1 4.4Å; I32-F94 HydrophobicContact CG1-CE1 4.43Å; I32-L298 HydrophobicContact CG2-CD1 4.19Å; I32-L300 HydrophobicContact CB-CD2 4.43Å; I32-L300 HydrophobicContact CG1-CD2 4.17Å; I32-L300 HydrophobicContact CG2-CD2 4.3Å
33	C	87.3	Confident	77.6	Confident	13 Å²	13	43.3 Å²	43.3	9%	0.088	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-80.5	-170.8	-64.5	0	0	0	0	110.7	K31 Y77 G78 R299	K31-C33 PolarHBondContact O-N 2.92Å; C33-Y77 PolarHBondContact O-N 3.49Å; C33-G78 PolarHBondContact O-N 3.18Å; C33-R299 HydrophobicContact CB-CB 3.98Å; C33-R299 HydrophobicContact CB-CG 3.88Å; C33-R299 WeakPolarHBondContact CB-O 3.44Å; C33-R299 PolarHBondContact N-O 3.45Å
34	E	88.6	Confident	75.8	Confident	37 Å²	37	46 Å²	46	17%	0.173	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155.9	-176.8	49.1	172.7	-164.6	0	0	110.3	K36 P75 F76 W127 R299	E34-K36 WeakPolarHBondContact OE1-CE 3.47Å; E34-K36 IonicContact OE1-NZ 3.85Å; E34-K36 PolarHBondContact OE1-NZ 2.99Å; E34-P75 CarbonylContact C-O 3.56Å; E34-P75 VanDerWaalsContact CA-O 3.27Å; E34-P75 WeakPolarHBondContact CA-O 3.34Å; E34-F76 HydrophobicContact CB-CB 4.48Å; E34-F76 HydrophobicContact CB-CD2 4Å; E34-W127 HydrophobicContact CG-CH2 3.65Å; E34-W127 HydrophobicContact CG-CZ2 4.19Å; E34-W127 VanDerWaalsContact OE1-CH2 3.27Å; E34-W127 WeakPolarHBondContact OE1-CH2 3.3Å; E34-W127 WeakPolarHBondContact OE1-CZ2 3.49Å; E34-R299 HydrophobicContact CG-CB 4.16Å; E34-R299 WeakPolarHBondContact O-CB 3.37Å; E34-R299 PolarHBondContact O-N 2.83Å; E34-R299 IonicContact OE1-NH1 3.17Å
35	A	87.4	Confident	74.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	154.2	163.5	0	0	0	0	0	110.3	L38 T74 P75 Y77 Q297 L298	A35-L38 HydrophobicContact CB-CD1 4.04Å; A35-L38 HydrophobicContact CB-CD2 3.89Å; A35-L38 HydrophobicContact CB-CG 4.04Å; A35-T74 CarbonylContact O-C 3.57Å; A35-T74 VanDerWaalsContact O-C 3.3Å; A35-T74 WeakPolarHBondContact O-CA 3.31Å; A35-P75 HydrophobicContact CB-CG 4Å; A35-P75 PolarHBondContact N-O 2.74Å; A35-Y77 HydrophobicContact CB-CE2 4.01Å; A35-Q297 CarbonylContact C-O 3.59Å; A35-Q297 WeakPolarHBondContact CA-O 3.35Å; A35-Q297 WeakPolarHBondContact CB-O 3.4Å; A35-L298 HydrophobicContact CB-CD1 4.03Å
36	K	86.6	Confident	72.7	Confident	73 Å²	73	54.2 Å²	54.2	32%	0.317	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149.9	175.6	-77.7	-178.7	-176	153.2	0	111.3	E34 L38 T74 W127 G296 Q297	E34-K36 WeakPolarHBondContact OE1-CE 3.47Å; E34-K36 IonicContact OE1-NZ 3.85Å; E34-K36 PolarHBondContact OE1-NZ 2.99Å; K36-L38 VanDerWaalsContact C-N 3.26Å; K36-L38 PolarHBondContact O-N 2.97Å; K36-T74 HydrophobicContact CB-CG2 4.35Å; K36-T74 HydrophobicContact CG-CG2 4.12Å; K36-W127 HydrophobicContact CB-CH2 4.2Å; K36-W127 HydrophobicContact CB-CZ3 3.98Å; K36-W127 HydrophobicContact CD-CH2 3.35Å; K36-W127 HydrophobicContact CD-CZ2 3.9Å; K36-W127 HydrophobicContact CD-CZ3 3.96Å; K36-W127 VanDerWaalsContact CE-CH2 3.49Å; K36-W127 HydrophobicContact CG-CH2 3.6Å; K36-W127 HydrophobicContact CG-CZ3 3.9Å; K36-W127 VanDerWaalsContact NZ-CZ2 3.26Å; K36-G296 CarbonylContact O-C 3.47Å; K36-G296 WeakPolarHBondContact O-CA 3.34Å; K36-Q297 PolarHBondContact N-O 2.96Å; K36-Q297 PolarHBondContact O-N 2.82Å
37	N	79.3	Confident	70.9	Confident	92 Å²	92	57.4 Å²	57.4	49%	0.492	32%	0.318	S	S	.	.			trans	52.2	41.7	174.8	-58.1	-17.7	0	0	0	113.2	G39 I73 G296	N37-G39 PolarHBondContact O-N 3.48Å; N37-I73 PolarHBondContact N-O 2.9Å; N37-G296 WeakPolarHBondContact O-CA 3.43Å; N37-G296 PolarHBondContact O-N 3.36Å
38	L	77.8	Confident	69	Low	10 Å²	10	65.8 Å²	65.8	5%	0.052	35%	0.353	C	S	.	.			trans	-61.4	114.1	176.2	-65	-178.6	0	0	0	109.4	A35 K36 T52 I73 P75 V96 V108 L130	A35-L38 HydrophobicContact CB-CD1 4.04Å; A35-L38 HydrophobicContact CB-CD2 3.89Å; A35-L38 HydrophobicContact CB-CG 4.04Å; K36-L38 VanDerWaalsContact C-N 3.26Å; K36-L38 PolarHBondContact O-N 2.97Å; L38-T52 HydrophobicContact CD1-CG2 4.09Å; L38-I73 PolarHBondContact N-O 2.77Å; L38-P75 HydrophobicContact CD1-CG 3.71Å; L38-V96 HydrophobicContact CD1-CG1 4.09Å; L38-V96 HydrophobicContact CD2-CG1 4.28Å; L38-V108 HydrophobicContact CB-CG1 4.5Å; L38-V108 HydrophobicContact CD2-CG1 4.26Å; L38-L130 HydrophobicContact CD2-CD1 3.39Å
39	G	63.7	Low	67.3	Low	13 Å²	13	70.7 Å²	70.7	13%	0.134	38%	0.38	C	S	.	.			trans	-68.2	163	-174.4	0	0	0	0	0	113.7	N37 V41	N37-G39 PolarHBondContact O-N 3.48Å; G39-V41 PolarHBondContact O-N 3.47Å
40	P	53	Low	66.2	Low	93 Å²	93	67.2 Å²	67.2	60%	0.604	37%	0.369	S	S	*	.			trans	-70.9	121.1	-175.9	27.7	-31.7	0	0	0	111.1	S42 L47	P40-S42 PolarHBondContact O-N 2.93Å; P40-L47 HydrophobicContact CB-CD1 3.94Å; P40-L47 HydrophobicContact CB-CG 4.43Å
41	V	53	Low	65.7	Low	30 Å²	30	68 Å²	68	18%	0.182	37%	0.372	C	S	.	.	S	Bend	trans	-76.7	82.7	165.8	-150.8	0	0	0	0	108.7	G39 L50 L106 V108	G39-V41 PolarHBondContact O-N 3.47Å; V41-L50 HydrophobicContact CG2-CD2 4.36Å; V41-L106 HydrophobicContact CB-CD2 4.03Å; V41-L106 HydrophobicContact CG1-CD2 3.14Å; V41-L106 HydrophobicContact CG1-CG 3.69Å; V41-V108 HydrophobicContact CG2-CG2 3.96Å
42	S	47.5	Very low	65.5	Low	107 Å²	107	65.4 Å²	65.4	75%	0.748	36%	0.36	S	S	*	.	S	Bend	trans	52.6	92.1	170	-40.3	0	0	0	0	116	P40	P40-S42 PolarHBondContact O-N 2.93Å
43	G	48.2	Very low	65.4	Low	37 Å²	37	65.6 Å²	65.6	38%	0.381	36%	0.361	S	S	.	.	S	Bend	trans	126	143.5	160.1	0	0	0	0	0	115.4	N45	G43-N45 PolarHBondContact O-N 3.41Å; G43-N45 VanDerWaalsContact O-N 3.11Å
44	P	42.2	Very low	65.6	Low	124 Å²	124	65 Å²	65	81%	0.805	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-9.4	-169.5	24.2	-32.3	0	0	0	115.9
45	N	43.5	Very low	65.6	Low	161 Å²	161	63.2 Å²	63.2	86%	0.861	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	8	-173.4	-84.4	-1.5	0	0	0	115.8	G43	G43-N45 PolarHBondContact O-N 3.41Å; G43-N45 VanDerWaalsContact O-N 3.11Å
46	R	52.6	Low	65.8	Low	151 Å²	151	63.2 Å²	63.2	57%	0.57	35%	0.349	S	S	*	.			trans	-107	0.3	-179.5	-70.2	-173.2	-176.5	-169.1	2.5	115.5	K48 L50	R46-K48 VanDerWaalsContact C-N 3.33Å; R46-K48 PolarHBondContact O-N 3.17Å; R46-L50 WeakPolarHBondContact O-CD1 3.49Å
47	L	48.8	Very low	65.8	Low	84 Å²	84	60 Å²	60	44%	0.44	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-19.6	-169.5	-93.4	97	0	0	0	116.4	P40	P40-L47 HydrophobicContact CB-CD1 3.94Å; P40-L47 HydrophobicContact CB-CG 4.43Å
48	K	48.2	Very low	66	Low	183 Å²	183	55.7 Å²	55.7	80%	0.796	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-7.4	-168.6	-71.5	-175.1	177.3	-178.4	0	115.4	R46	R46-K48 VanDerWaalsContact C-N 3.33Å; R46-K48 PolarHBondContact O-N 3.17Å
49	D	52.7	Low	66.1	Low	104 Å²	104	55.9 Å²	55.9	56%	0.556	31%	0.314	S	S	*	.			trans	-131.8	32.9	-177.1	-71	-53.5	0	0	0	112.8	C51 K71	D49-C51 PolarHBondContact O-N 2.91Å; D49-K71 WeakPolarHBondContact OD1-CD 3.49Å; D49-K71 WeakPolarHBondContact OD1-CE 3.39Å; D49-K71 IonicContact OD1-NZ 2.86Å; D49-K71 PolarHBondContact OD1-NZ 2.8Å; D49-K71 VanDerWaalsContact OD1-NZ 3.12Å
50	L	65.2	Low	66.5	Low	29 Å²	29	58.1 Å²	58.1	15%	0.152	32%	0.32	C	S	.	.			trans	-74.6	111.7	174.1	-118.2	92.5	0	0	0	110	V41 R46 T52 K71 A98 V108	V41-L50 HydrophobicContact CG2-CD2 4.36Å; R46-L50 WeakPolarHBondContact O-CD1 3.49Å; L50-T52 HydrophobicContact CB-CG2 4.35Å; L50-T52 HydrophobicContact CD2-CG2 3.91Å; L50-K71 PolarHBondContact O-N 3.34Å; L50-A98 HydrophobicContact CD2-CB 3.6Å; L50-A98 HydrophobicContact CG-CB 4.06Å; L50-V108 HydrophobicContact CD2-CG2 4.44Å
51	C	77.6	Confident	67.7	Low	32 Å²	32	54.9 Å²	54.9	22%	0.216	30%	0.297	C	S	.	.			trans	-86.2	116.6	166.6	-58.3	0	0	0	0	108.2	D49 V68 F69 D70 K99	D49-C51 PolarHBondContact O-N 2.91Å; C51-V68 HydrophobicContact CB-CG1 3.67Å; C51-F69 CarbonylContact C-O 3.56Å; C51-F69 VanDerWaalsContact CA-O 3.22Å; C51-F69 WeakPolarHBondContact CA-O 3.29Å; C51-D70 PolarHBondContact SG-OD1 3.26Å; C51-K99 HydrophobicContact CB-CB 4.12Å; C51-K99 WeakPolarHBondContact O-CB 3.48Å; C51-K99 PolarHBondContact O-N 3.44Å
52	T	83.9	Confident	69.2	Low	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.3	-174.5	55.9	0	0	0	0	112.2	L38 L50 F69 P75 Y77 Y97	L38-T52 HydrophobicContact CD1-CG2 4.09Å; L50-T52 HydrophobicContact CB-CG2 4.35Å; L50-T52 HydrophobicContact CD2-CG2 3.91Å; T52-F69 PolarHBondContact N-O 3.36Å; T52-F69 PolarHBondContact O-N 3.01Å; T52-P75 WeakPolarHBondContact OG1-CB 3.42Å; T52-P75 WeakPolarHBondContact OG1-CG 3.2Å; T52-Y77 PolarHBondContact OG1-OH 3.41Å; T52-Y97 CarbonylContact C-O 3.57Å; T52-Y97 WeakPolarHBondContact CA-O 3.3Å
53	F	87.4	Confident	71.1	Confident	5 Å²	5	52.1 Å²	52.1	2%	0.022	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	155.3	169.3	65.7	-84.8	0	0	0	109.6	T55 R65 K67 V68 Y97 K99 D105	F53-T55 HydrophobicContact CD2-CG2 3.82Å; F53-T55 HydrophobicContact CE2-CG2 3.64Å; F53-R65 HydrophobicContact CD2-CG 4.05Å; F53-R65 HydrophobicContact CE2-CG 4.4Å; F53-K67 WeakPolarHBondContact CB-O 3.35Å; F53-V68 HydrophobicContact CB-CG2 4.22Å; F53-V68 HydrophobicContact CD1-CG2 4.15Å; F53-V68 HydrophobicContact CG-CG2 4.43Å; F53-Y97 HydrophobicContact CD2-CD2 4.34Å; F53-Y97 VanDerWaalsContact CE1-CB 3.46Å; F53-Y97 HydrophobicContact CE1-CG 4.34Å; F53-Y97 AromaticContact CE2-CD2 3.68Å; F53-Y97 HydrophobicContact CE2-CD2 3.68Å; F53-Y97 AromaticContact CE2-CG 3.96Å; F53-Y97 HydrophobicContact CE2-CG 3.96Å; F53-Y97 AromaticContact CZ-CD2 3.97Å; F53-Y97 HydrophobicContact CZ-CD2 3.97Å; F53-Y97 AromaticContact CZ-CG 3.76Å; F53-Y97 HydrophobicContact CZ-CG 3.76Å; F53-Y97 PolarHBondContact N-O 3.33Å; F53-Y97 PolarHBondContact O-N 2.76Å; F53-K99 HydrophobicContact CD1-CB 4.38Å; F53-K99 HydrophobicContact CE1-CB 4.36Å; F53-D105 HydrophobicContact CE1-CB 4.03Å; F53-D105 HydrophobicContact CZ-CB 3.93Å; F53-D105 WeakPolarHBondContact CZ-OD2 3.17Å
54	C	89.7	Confident	72.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	145.5	176.3	-168.1	0	0	0	0	109.9	I32 T66 Y77 Y95	I32-C54 HydrophobicContact CD1-CB 4.08Å; I32-C54 HydrophobicContact CG2-CB 4.08Å; C54-T66 HydrophobicContact CB-CG2 3.92Å; C54-T66 PolarHBondContact N-OG1 3.09Å; C54-T66 PolarHBondContact O-N 3.45Å; C54-T66 PolarHBondContact O-OG1 3.13Å; C54-Y77 HydrophobicContact CB-CD1 4.48Å; C54-Y77 HydrophobicContact CB-CE1 4.27Å; C54-Y77 HydrophobicContact CB-CE2 4.45Å; C54-Y95 CarbonylContact C-O 3.55Å; C54-Y95 VanDerWaalsContact CA-O 3.24Å; C54-Y95 WeakPolarHBondContact CA-O 3.19Å; C54-Y95 PolarHBondContact SG-O 3.38Å
55	T	89.8	Confident	75	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	150	170.6	65	0	0	0	0	110.4	F53 E62 F64 R65 F94 Y95 Y97	F53-T55 HydrophobicContact CD2-CG2 3.82Å; F53-T55 HydrophobicContact CE2-CG2 3.64Å; T55-E62 HydrophobicContact CG2-CG 4.19Å; T55-F64 CarbonylContact C-O 3.5Å; T55-F64 WeakPolarHBondContact CA-O 3.31Å; T55-F64 WeakPolarHBondContact CB-O 3.36Å; T55-R65 HydrophobicContact CG2-CB 4.22Å; T55-R65 HydrophobicContact CG2-CG 4.06Å; T55-F94 CarbonylContact O-C 3.41Å; T55-F94 VanDerWaalsContact O-CA 3.32Å; T55-F94 WeakPolarHBondContact O-CA 3.42Å; T55-Y95 PolarHBondContact N-O 2.61Å; T55-Y95 PolarHBondContact O-N 3.01Å; T55-Y95 WeakPolarHBondContact OG1-CB 3.27Å; T55-Y97 HydrophobicContact CG2-CD2 4.08Å; T55-Y97 HydrophobicContact CG2-CE2 4.11Å; T55-Y97 WeakPolarHBondContact OG1-CE2 3.43Å
56	I	91.4	Very high	77	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.5	172.9	-48.5	177.4	0	0	0	106.9	I32 V63 F64 F81 F83 L92 S93 F94	I32-I56 HydrophobicContact CD1-CD1 4.03Å; I32-I56 HydrophobicContact CD1-CG1 3.98Å; I56-V63 HydrophobicContact CB-CG2 4.17Å; I56-V63 HydrophobicContact CG2-CG2 4.09Å; I56-V63 VanDerWaalsContact O-CG2 3.27Å; I56-V63 WeakPolarHBondContact O-CG2 3.41Å; I56-V63 PolarHBondContact O-N 3.32Å; I56-F64 HydrophobicContact CB-CB 3.96Å; I56-F64 HydrophobicContact CD1-CB 3.93Å; I56-F64 HydrophobicContact CD1-CD1 3.75Å; I56-F64 HydrophobicContact CD1-CG 4.06Å; I56-F64 HydrophobicContact CG1-CB 4.02Å; I56-F64 HydrophobicContact CG1-CD1 4Å; I56-F64 HydrophobicContact CG1-CG 4.42Å; I56-F64 PolarHBondContact N-O 3.28Å; I56-F64 PolarHBondContact O-N 2.96Å; I56-F81 HydrophobicContact CD1-CB 4.1Å; I56-F81 HydrophobicContact CD1-CD1 3.44Å; I56-F81 VanDerWaalsContact CD1-CD1 3.44Å; I56-F81 HydrophobicContact CD1-CD2 3.49Å; I56-F81 VanDerWaalsContact CD1-CD2 3.49Å; I56-F81 HydrophobicContact CD1-CE1 3.58Å; I56-F81 HydrophobicContact CD1-CE2 3.63Å; I56-F81 HydrophobicContact CD1-CG 3.39Å; I56-F81 HydrophobicContact CD1-CZ 3.66Å; I56-F83 HydrophobicContact CD1-CE1 4.27Å; I56-F83 HydrophobicContact CG2-CE1 4.38Å; I56-F83 HydrophobicContact CG2-CZ 4.06Å; I56-L92 HydrophobicContact CG2-CD1 3.55Å; I56-S93 CarbonylContact C-O 3.5Å; I56-S93 WeakPolarHBondContact CA-O 3.28Å; I56-F94 HydrophobicContact CB-CE1 4.48Å; I56-F94 HydrophobicContact CD1-CD1 4.41Å; I56-F94 HydrophobicContact CD1-CE1 3.84Å; I56-F94 HydrophobicContact CG1-CD1 3.83Å; I56-F94 HydrophobicContact CG1-CE1 3.72Å; I56-F94 HydrophobicContact CG2-CD1 4.49Å; I56-F94 HydrophobicContact CG2-CE1 4.12Å; I56-F94 HydrophobicContact CG2-CZ 4.39Å
57	S	86	Confident	78.4	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.042	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.5	176.2	-58.2	0	0	0	0	110.9	E61 S93	S57-E61 CarbonylContact C-O 3.49Å; S57-E61 WeakPolarHBondContact CA-O 3.09Å; S57-E61 WeakPolarHBondContact CB-O 3.41Å; S57-S93 PolarHBondContact N-O 3.33Å; S57-S93 PolarHBondContact O-N 3.29Å
58	L	83.9	Confident	80	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	109.8	164.5	-65.6	179.2	0	0	0	107.5	Q60 E61 V63 F83 I85 R87 F89 L92	L58-Q60 PolarHBondContact O-N 3.19Å; L58-Q60 VanDerWaalsContact O-N 3.14Å; L58-E61 PolarHBondContact N-O 3Å; L58-E61 PolarHBondContact O-N 3.13Å; L58-V63 HydrophobicContact CB-CG1 4.29Å; L58-V63 HydrophobicContact CD1-CG1 3.98Å; L58-V63 HydrophobicContact CG-CG1 3.98Å; L58-V63 HydrophobicContact CG-CG2 4.11Å; L58-F83 HydrophobicContact CD1-CE2 4.16Å; L58-F83 HydrophobicContact CD2-CE2 4.32Å; L58-F83 HydrophobicContact CG-CE2 4.38Å; L58-I85 HydrophobicContact CD1-CG1 4.32Å; L58-I85 HydrophobicContact CD1-CG2 4.38Å; L58-R87 PolarHBondContact O-NH2 3.37Å; L58-F89 HydrophobicContact CB-CB 4.38Å; L58-F89 HydrophobicContact CD2-CD1 4.49Å; L58-F89 HydrophobicContact CD2-CD2 3.97Å; L58-F89 HydrophobicContact CD2-CE2 4.31Å; L58-F89 HydrophobicContact CD2-CG 4.06Å; L58-L92 HydrophobicContact CD2-CD1 3.77Å
59	D	78.9	Confident	81.1	Confident	14 Å²	14	32.9 Å²	32.9	8%	0.075	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	-108.1	-163.3	-45.1	-51.1	0	0	0	110.3	R87 Q90 F91	D59-R87 IonicContact OD2-CZ 3.56Å; D59-R87 IonicContact OD2-NH1 3.41Å; D59-R87 PolarHBondContact OD2-NH1 3.27Å; D59-Q90 PolarHBondContact OD1-N 2.85Å; D59-F91 PolarHBondContact N-O 3.32Å; D59-F91 PolarHBondContact OD1-N 3.28Å; D59-F91 VanDerWaalsContact OD1-N 3.13Å
60	Q	73.4	Confident	81.9	Confident	60 Å²	60	33.2 Å²	33.2	28%	0.28	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	2.1	177.9	-60.8	-175.9	1.5	0	0	113.6	L58 E138	L58-Q60 PolarHBondContact O-N 3.19Å; L58-Q60 VanDerWaalsContact O-N 3.14Å; Q60-E138 PolarHBondContact NE2-O 2.86Å
61	E	77.6	Confident	81.9	Confident	25 Å²	25	38.4 Å²	38.4	12%	0.117	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	114.6	-176.3	-174.3	175.8	-174.3	0	0	110.8	S57 L58 V63 R87 N661 N678 C679	S57-E61 CarbonylContact C-O 3.49Å; S57-E61 WeakPolarHBondContact CA-O 3.09Å; S57-E61 WeakPolarHBondContact CB-O 3.41Å; L58-E61 PolarHBondContact N-O 3Å; L58-E61 PolarHBondContact O-N 3.13Å; E61-V63 PolarHBondContact O-N 3.42Å; E61-R87 IonicContact OE2-CZ 3.71Å; E61-R87 IonicContact OE2-NE 3.92Å; E61-R87 PolarHBondContact OE2-NE 2.91Å; E61-R87 IonicContact OE2-NH2 2.87Å; E61-R87 PolarHBondContact OE2-NH2 3.41Å; E61-N661 PolarHBondContact OE1-ND2 2.85Å; E61-N661 PolarHBondContact OE1-OD1 2.98Å; E61-N678 HydrophobicContact CG-CB 4.41Å; E61-N678 WeakPolarHBondContact OE1-CA 3.44Å; E61-C679 PolarHBondContact OE1-N 3.46Å
62	E	85	Confident	81.5	Confident	67 Å²	67	38.8 Å²	38.8	31%	0.313	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	115.4	175.2	-170.7	-174.9	139.9	0	0	110.8	T55 R65 N678	T55-E62 HydrophobicContact CG2-CG 4.19Å; E62-R65 VanDerWaalsContact CD-NH2 3.32Å; E62-R65 WeakPolarHBondContact OE1-CB 3.24Å; E62-R65 IonicContact OE1-CZ 3.62Å; E62-R65 VanDerWaalsContact OE1-CZ 3.25Å; E62-R65 IonicContact OE1-NE 2.71Å; E62-R65 PolarHBondContact OE1-NE 2.83Å; E62-R65 IonicContact OE1-NH2 3.52Å; E62-R65 PolarHBondContact OE1-NH2 2.86Å; E62-R65 IonicContact OE2-CZ 3.56Å; E62-R65 IonicContact OE2-NE 2.66Å; E62-R65 IonicContact OE2-NH2 2.88Å; E62-R65 PolarHBondContact OE2-NH2 2.95Å; E62-N678 VanDerWaalsContact O-CB 3.23Å; E62-N678 WeakPolarHBondContact O-CB 3.45Å
63	V	86.9	Confident	80.8	Confident	12 Å²	12	42.4 Å²	42.4	7%	0.073	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-23.8	-179.5	-66.8	0	0	0	0	113.2	I56 L58 E61 F83 N678 V680	I56-V63 HydrophobicContact CB-CG2 4.17Å; I56-V63 HydrophobicContact CG2-CG2 4.09Å; I56-V63 VanDerWaalsContact O-CG2 3.27Å; I56-V63 WeakPolarHBondContact O-CG2 3.41Å; I56-V63 PolarHBondContact O-N 3.32Å; L58-V63 HydrophobicContact CB-CG1 4.29Å; L58-V63 HydrophobicContact CD1-CG1 3.98Å; L58-V63 HydrophobicContact CG-CG1 3.98Å; L58-V63 HydrophobicContact CG-CG2 4.11Å; E61-V63 PolarHBondContact O-N 3.42Å; V63-F83 HydrophobicContact CG2-CE1 3.89Å; V63-F83 HydrophobicContact CG2-CE2 4.03Å; V63-F83 HydrophobicContact CG2-CZ 3.55Å; V63-N678 PolarHBondContact O-ND2 3.29Å; V63-V680 HydrophobicContact CB-CG2 3.89Å; V63-V680 HydrophobicContact CG1-CG2 3.76Å
64	F	86.8	Confident	80.4	Confident	46 Å²	46	45 Å²	45	20%	0.202	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	146.7	-179.1	-176.1	-92.4	0	0	0	111.1	I32 T55 I56 T66 F81 F83	I32-F64 HydrophobicContact CD1-CD1 4.44Å; I32-F64 HydrophobicContact CD1-CE1 4.37Å; T55-F64 CarbonylContact C-O 3.5Å; T55-F64 WeakPolarHBondContact CA-O 3.31Å; T55-F64 WeakPolarHBondContact CB-O 3.36Å; I56-F64 HydrophobicContact CB-CB 3.96Å; I56-F64 HydrophobicContact CD1-CB 3.93Å; I56-F64 HydrophobicContact CD1-CD1 3.75Å; I56-F64 HydrophobicContact CD1-CG 4.06Å; I56-F64 HydrophobicContact CG1-CB 4.02Å; I56-F64 HydrophobicContact CG1-CD1 4Å; I56-F64 HydrophobicContact CG1-CG 4.42Å; I56-F64 PolarHBondContact N-O 3.28Å; I56-F64 PolarHBondContact O-N 2.96Å; F64-T66 HydrophobicContact CE1-CG2 3.97Å; F64-F81 HydrophobicContact CD1-CB 4.21Å; F64-F81 HydrophobicContact CD2-CB 3.98Å; F64-F81 HydrophobicContact CE1-CB 4.1Å; F64-F81 HydrophobicContact CE2-CB 3.87Å; F64-F81 HydrophobicContact CG-CB 4.15Å; F64-F81 HydrophobicContact CZ-CB 3.93Å; F64-F83 HydrophobicContact CB-CE1 4.41Å
65	R	86.5	Confident	79.9	Confident	121 Å²	121	45.2 Å²	45.2	46%	0.457	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	128.7	179	179.7	179.2	-65.3	-149.3	-4.5	110.3	F53 T55 E62	F53-R65 HydrophobicContact CD2-CG 4.05Å; F53-R65 HydrophobicContact CE2-CG 4.4Å; T55-R65 HydrophobicContact CG2-CB 4.22Å; T55-R65 HydrophobicContact CG2-CG 4.06Å; E62-R65 VanDerWaalsContact CD-NH2 3.32Å; E62-R65 WeakPolarHBondContact OE1-CB 3.24Å; E62-R65 IonicContact OE1-CZ 3.62Å; E62-R65 VanDerWaalsContact OE1-CZ 3.25Å; E62-R65 IonicContact OE1-NE 2.71Å; E62-R65 PolarHBondContact OE1-NE 2.83Å; E62-R65 IonicContact OE1-NH2 3.52Å; E62-R65 PolarHBondContact OE1-NH2 2.86Å; E62-R65 IonicContact OE2-CZ 3.56Å; E62-R65 IonicContact OE2-NE 2.66Å; E62-R65 IonicContact OE2-NH2 2.88Å; E62-R65 PolarHBondContact OE2-NH2 2.95Å
66	T	85	Confident	79.6	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.031	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-75.5	165.6	173.8	69.8	0	0	0	0	111.8	I32 C54 F64 E79	I32-T66 HydrophobicContact CD1-CG2 3.68Å; C54-T66 HydrophobicContact CB-CG2 3.92Å; C54-T66 PolarHBondContact N-OG1 3.09Å; C54-T66 PolarHBondContact O-N 3.45Å; C54-T66 PolarHBondContact O-OG1 3.13Å; F64-T66 HydrophobicContact CE1-CG2 3.97Å; T66-E79 WeakPolarHBondContact CA-OE2 3.34Å; T66-E79 HydrophobicContact CG2-CB 4.19Å; T66-E79 HydrophobicContact CG2-CG 4.38Å
67	K	81.8	Confident	79.1	Confident	57 Å²	57	51.3 Å²	51.3	25%	0.248	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-56.3	159.7	160.8	-75.9	174	159.5	-177.2	0	110.9	F53 F69 E79 H517 H518 D520	F53-K67 WeakPolarHBondContact CB-O 3.35Å; K67-F69 HydrophobicContact CB-CD2 4.43Å; K67-F69 HydrophobicContact CB-CE2 3.88Å; K67-F69 HydrophobicContact CB-CZ 4.37Å; K67-F69 VanDerWaalsContact O-CD2 3.25Å; K67-F69 WeakPolarHBondContact O-CD2 3.47Å; K67-E79 WeakPolarHBondContact CB-OE1 3.22Å; K67-E79 PolarHBondContact N-OE1 3.06Å; K67-H517 HydrophobicContact CD-CB 3.86Å; K67-H517 HydrophobicContact CG-CB 4.21Å; K67-H518 PolarHBondContact NZ-O 3.46Å; K67-D520 IonicContact NZ-OD1 3.18Å; K67-D520 PolarHBondContact NZ-OD1 2.62Å
68	V	81.4	Confident	78.8	Confident	50 Å²	50	51.3 Å²	51.3	30%	0.303	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-83.2	123.6	170.5	178.8	0	0	0	0	107.2	C51 F53 K99	C51-V68 HydrophobicContact CB-CG1 3.67Å; F53-V68 HydrophobicContact CB-CG2 4.22Å; F53-V68 HydrophobicContact CD1-CG2 4.15Å; F53-V68 HydrophobicContact CG-CG2 4.43Å; V68-K99 HydrophobicContact CB-CD 4.22Å; V68-K99 HydrophobicContact CG1-CB 4.24Å; V68-K99 HydrophobicContact CG1-CD 3.58Å; V68-K99 HydrophobicContact CG2-CD 3.75Å
69	F	72.6	Confident	78.7	Confident	57 Å²	57	51.6 Å²	51.6	25%	0.25	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-104.7	133.1	177.4	-72.5	-95.3	0	0	0	109.6	C51 T52 K67 F76 Y77	C51-F69 CarbonylContact C-O 3.56Å; C51-F69 VanDerWaalsContact CA-O 3.22Å; C51-F69 WeakPolarHBondContact CA-O 3.29Å; T52-F69 PolarHBondContact N-O 3.36Å; T52-F69 PolarHBondContact O-N 3.01Å; K67-F69 HydrophobicContact CB-CD2 4.43Å; K67-F69 HydrophobicContact CB-CE2 3.88Å; K67-F69 HydrophobicContact CB-CZ 4.37Å; K67-F69 VanDerWaalsContact O-CD2 3.25Å; K67-F69 WeakPolarHBondContact O-CD2 3.47Å; F69-F76 WeakPolarHBondContact CD1-O 3.47Å; F69-F76 WeakPolarHBondContact CE1-O 3.25Å; F69-Y77 AromaticContact CD2-CD1 3.56Å; F69-Y77 HydrophobicContact CD2-CD1 3.56Å; F69-Y77 HydrophobicContact CD2-CE1 4.19Å; F69-Y77 AromaticContact CE2-CD1 3.9Å; F69-Y77 HydrophobicContact CE2-CD1 3.9Å; F69-Y77 HydrophobicContact CG-CD1 4.34Å; F69-Y77 WeakPolarHBondContact CZ-O 3.14Å
70	D	68.8	Low	78.9	Confident	112 Å²	112	53.6 Å²	53.6	60%	0.599	26%	0.261	S	S	*	.			trans	-91.7	141.3	-170.5	-69	-23.3	0	0	0	112.3	C51	C51-D70 PolarHBondContact SG-OD1 3.26Å
71	K	64.5	Low	79.5	Confident	137 Å²	137	51.1 Å²	51.1	60%	0.596	25%	0.249	S	C	*	.	S	Bend	trans	57.6	51.4	156.8	-55	-174.1	-179.4	-155.8	0	116.8	D49 L50	D49-K71 WeakPolarHBondContact OD1-CD 3.49Å; D49-K71 WeakPolarHBondContact OD1-CE 3.39Å; D49-K71 IonicContact OD1-NZ 2.86Å; D49-K71 PolarHBondContact OD1-NZ 2.8Å; D49-K71 VanDerWaalsContact OD1-NZ 3.12Å; L50-K71 PolarHBondContact O-N 3.34Å
72	S	69.6	Low	79.8	Confident	41 Å²	41	56 Å²	56	29%	0.287	27%	0.27	S	S	.	.			trans	-151.4	139	168.9	-173.3	0	0	0	0	113	T74	S72-T74 VanDerWaalsContact OG-C 3.22Å; S72-T74 PolarHBondContact OG-N 2.88Å; S72-T74 PolarHBondContact OG-O 2.9Å; S72-T74 PolarHBondContact OG-OG1 3.25Å
73	I	70.5	Confident	79.7	Confident	76 Å²	76	53 Å²	53	39%	0.39	26%	0.256	S	S	.	.	S	Bend	trans	-77.9	-8.4	166.4	58.2	166.9	0	0	0	112.2	N37 L38 P75	N37-I73 PolarHBondContact N-O 2.9Å; L38-I73 PolarHBondContact N-O 2.77Å; I73-P75 VanDerWaalsContact C-CD 3.47Å
74	T	77.6	Confident	79.6	Confident	60 Å²	60	55 Å²	55	37%	0.368	27%	0.265	S	S	.	.	S	Bend	trans	-127.8	65.2	173.1	64	0	0	0	0	110.5	A35 K36 S72 F76	A35-T74 CarbonylContact O-C 3.57Å; A35-T74 VanDerWaalsContact O-C 3.3Å; A35-T74 WeakPolarHBondContact O-CA 3.31Å; K36-T74 HydrophobicContact CB-CG2 4.35Å; K36-T74 HydrophobicContact CG-CG2 4.12Å; S72-T74 VanDerWaalsContact OG-C 3.22Å; S72-T74 PolarHBondContact OG-N 2.88Å; S72-T74 PolarHBondContact OG-O 2.9Å; S72-T74 PolarHBondContact OG-OG1 3.25Å; T74-F76 PolarHBondContact O-N 3.04Å
75	P	79.9	Confident	79.5	Confident	4 Å²	4	53.4 Å²	53.4	3%	0.026	26%	0.258	C	S	.	.			trans	-69.4	132.9	-176.1	30.3	-36.2	0	0	0	110.8	E34 A35 L38 T52 I73 Y77	E34-P75 CarbonylContact C-O 3.56Å; E34-P75 VanDerWaalsContact CA-O 3.27Å; E34-P75 WeakPolarHBondContact CA-O 3.34Å; A35-P75 HydrophobicContact CB-CG 4Å; A35-P75 PolarHBondContact N-O 2.74Å; L38-P75 HydrophobicContact CD1-CG 3.71Å; T52-P75 WeakPolarHBondContact OG1-CB 3.42Å; T52-P75 WeakPolarHBondContact OG1-CG 3.2Å; I73-P75 VanDerWaalsContact C-CD 3.47Å; P75-Y77 HydrophobicContact CB-CE1 4.34Å; P75-Y77 HydrophobicContact CB-CE2 4.46Å; P75-Y77 HydrophobicContact CG-CE1 4.38Å; P75-Y77 HydrophobicContact CG-CE2 3.96Å
76	F	82.6	Confident	79	Confident	123 Å²	123	49.9 Å²	49.9	54%	0.539	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	106.7	168	-179	-93.4	0	0	0	108.6	E34 F69 T74	E34-F76 HydrophobicContact CB-CB 4.48Å; E34-F76 HydrophobicContact CB-CD2 4Å; F69-F76 WeakPolarHBondContact CD1-O 3.47Å; F69-F76 WeakPolarHBondContact CE1-O 3.25Å; T74-F76 PolarHBondContact O-N 3.04Å
77	Y	82.5	Confident	78.6	Confident	5 Å²	5	52 Å²	52	2%	0.02	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-47.6	178.4	-58.1	-76.1	0	0	0	110.4	I32 C33 A35 T52 C54 F69 P75 E79 L298	I32-Y77 HydrophobicContact CG2-CD2 3.65Å; I32-Y77 HydrophobicContact CG2-CE2 4.41Å; I32-Y77 HydrophobicContact CG2-CG 3.99Å; C33-Y77 PolarHBondContact O-N 3.49Å; A35-Y77 HydrophobicContact CB-CE2 4.01Å; T52-Y77 PolarHBondContact OG1-OH 3.41Å; C54-Y77 HydrophobicContact CB-CD1 4.48Å; C54-Y77 HydrophobicContact CB-CE1 4.27Å; C54-Y77 HydrophobicContact CB-CE2 4.45Å; F69-Y77 AromaticContact CD2-CD1 3.56Å; F69-Y77 HydrophobicContact CD2-CD1 3.56Å; F69-Y77 HydrophobicContact CD2-CE1 4.19Å; F69-Y77 AromaticContact CE2-CD1 3.9Å; F69-Y77 HydrophobicContact CE2-CD1 3.9Å; F69-Y77 HydrophobicContact CG-CD1 4.34Å; F69-Y77 WeakPolarHBondContact CZ-O 3.14Å; P75-Y77 HydrophobicContact CB-CE1 4.34Å; P75-Y77 HydrophobicContact CB-CE2 4.46Å; P75-Y77 HydrophobicContact CG-CE1 4.38Å; P75-Y77 HydrophobicContact CG-CE2 3.96Å; Y77-E79 PolarHBondContact O-N 3.14Å; Y77-E79 VanDerWaalsContact O-N 3.07Å; Y77-L298 HydrophobicContact CD2-CD1 4.47Å; Y77-L298 HydrophobicContact CE2-CD1 4.08Å
78	G	79.3	Confident	78.3	Confident	5 Å²	5	54.3 Å²	54.3	5%	0.052	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	60.2	16.6	178.3	0	0	0	0	0	115.2	K31 I32 C33 H518	K31-G78 VanDerWaalsContact CE-C 3.48Å; K31-G78 WeakPolarHBondContact CE-O 3.26Å; K31-G78 PolarHBondContact NZ-O 3.35Å; I32-G78 WeakPolarHBondContact O-CA 3.32Å; I32-G78 PolarHBondContact O-N 2.84Å; C33-G78 PolarHBondContact O-N 3.18Å; G78-H518 PolarHBondContact O-CD2 3.31Å; G78-H518 VanDerWaalsContact O-CD2 3.28Å; G78-H518 PolarHBondContact O-NE2 2.91Å
79	E	81.1	Confident	78.2	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.028	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	127.8	-174.6	-68	-160.3	-163.2	0	0	112.2	K31 I32 T66 K67 Y77 H517	K31-E79 WeakPolarHBondContact CA-O 3.44Å; I32-E79 PolarHBondContact N-O 3.46Å; I32-E79 PolarHBondContact O-N 2.93Å; T66-E79 WeakPolarHBondContact CA-OE2 3.34Å; T66-E79 HydrophobicContact CG2-CB 4.19Å; T66-E79 HydrophobicContact CG2-CG 4.38Å; K67-E79 WeakPolarHBondContact CB-OE1 3.22Å; K67-E79 PolarHBondContact N-OE1 3.06Å; Y77-E79 PolarHBondContact O-N 3.14Å; Y77-E79 VanDerWaalsContact O-N 3.07Å; E79-H517 IonicContact OE2-ND1 2.79Å
80	D	82.9	Confident	78.3	Confident	56 Å²	56	51.3 Å²	51.3	30%	0.299	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	139.9	173.7	-52.1	-74.4	0	0	0	108.9	G30 K31 H518	G30-D80 CarbonylContact O-C 3.49Å; G30-D80 WeakPolarHBondContact O-CA 3.47Å; K31-D80 VanDerWaalsContact CD-OD1 3.26Å; K31-D80 WeakPolarHBondContact CD-OD1 3.43Å; K31-D80 WeakPolarHBondContact CG-OD1 3.47Å; K31-D80 IonicContact NZ-OD1 2.75Å; K31-D80 PolarHBondContact NZ-OD1 3.47Å; K31-D80 IonicContact NZ-OD2 3.47Å; D80-H518 IonicContact OD2-CE1 3.51Å; D80-H518 PolarHBondContact OD2-CE1 2.77Å; D80-H518 IonicContact OD2-NE2 3.49Å; D80-H518 PolarHBondContact OD2-NE2 3.48Å
81	F	85.9	Confident	78.9	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.035	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.2	177.5	64.4	-90.1	0	0	0	110.5	L28 R29 G30 I32 I56 F64 F83 F94 L302	L28-F81 HydrophobicContact CD2-CE2 3.74Å; L28-F81 HydrophobicContact CD2-CZ 4.5Å; L28-F81 HydrophobicContact CG-CE2 3.92Å; R29-F81 WeakPolarHBondContact CA-O 3.49Å; G30-F81 VanDerWaalsContact C-CE1 3.41Å; G30-F81 PolarHBondContact N-O 3.1Å; G30-F81 WeakPolarHBondContact O-CD1 3.31Å; G30-F81 PolarHBondContact O-N 3.33Å; I32-F81 HydrophobicContact CD1-CD1 4.45Å; I32-F81 HydrophobicContact CG1-CD1 4.09Å; I32-F81 HydrophobicContact CG1-CE1 3.94Å; I56-F81 HydrophobicContact CD1-CB 4.1Å; I56-F81 HydrophobicContact CD1-CD1 3.44Å; I56-F81 VanDerWaalsContact CD1-CD1 3.44Å; I56-F81 HydrophobicContact CD1-CD2 3.49Å; I56-F81 VanDerWaalsContact CD1-CD2 3.49Å; I56-F81 HydrophobicContact CD1-CE1 3.58Å; I56-F81 HydrophobicContact CD1-CE2 3.63Å; I56-F81 HydrophobicContact CD1-CG 3.39Å; I56-F81 HydrophobicContact CD1-CZ 3.66Å; F64-F81 HydrophobicContact CD1-CB 4.21Å; F64-F81 HydrophobicContact CD2-CB 3.98Å; F64-F81 HydrophobicContact CE1-CB 4.1Å; F64-F81 HydrophobicContact CE2-CB 3.87Å; F64-F81 HydrophobicContact CG-CB 4.15Å; F64-F81 HydrophobicContact CZ-CB 3.93Å; F81-F83 HydrophobicContact CD2-CD1 4.2Å; F81-F83 AromaticContact CD2-CE1 3.72Å; F81-F83 HydrophobicContact CD2-CE1 3.72Å; F81-F83 HydrophobicContact CE2-CE1 4.23Å; F81-F94 HydrophobicContact CE1-CE1 4.14Å; F81-F94 AromaticContact CZ-CE1 3.95Å; F81-F94 HydrophobicContact CZ-CE1 3.95Å; F81-F94 HydrophobicContact CZ-CZ 4.13Å; F81-L302 HydrophobicContact CE1-CD2 4.38Å; F81-L302 HydrophobicContact CZ-CD2 3.69Å
82	F	84.4	Confident	80	Confident	127 Å²	127	41.8 Å²	41.8	56%	0.557	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-146.6	130	173.6	171.3	-100.4	0	0	0	108.2	L28 R29 E84	L28-F82 WeakPolarHBondContact O-CA 3.46Å; R29-F82 HydrophobicContact CB-CD2 3.9Å; F82-E84 HydrophobicContact CZ-CG 4.45Å
83	F	83.7	Confident	81	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	153.4	167.7	50	-96.5	0	0	0	111.1	L28 I56 L58 V63 F64 F81 I85 V680	L28-F83 HydrophobicContact CB-CE2 4.1Å; L28-F83 HydrophobicContact CB-CZ 4.4Å; L28-F83 HydrophobicContact CD2-CE1 4.42Å; L28-F83 HydrophobicContact CD2-CE2 4.01Å; L28-F83 HydrophobicContact CD2-CZ 3.64Å; L28-F83 PolarHBondContact N-O 3.41Å; L28-F83 PolarHBondContact O-N 3.45Å; I56-F83 HydrophobicContact CD1-CE1 4.27Å; I56-F83 HydrophobicContact CG2-CE1 4.38Å; I56-F83 HydrophobicContact CG2-CZ 4.06Å; L58-F83 HydrophobicContact CD1-CE2 4.16Å; L58-F83 HydrophobicContact CD2-CE2 4.32Å; L58-F83 HydrophobicContact CG-CE2 4.38Å; V63-F83 HydrophobicContact CG2-CE1 3.89Å; V63-F83 HydrophobicContact CG2-CE2 4.03Å; V63-F83 HydrophobicContact CG2-CZ 3.55Å; F64-F83 HydrophobicContact CB-CE1 4.41Å; F81-F83 HydrophobicContact CD2-CD1 4.2Å; F81-F83 AromaticContact CD2-CE1 3.72Å; F81-F83 HydrophobicContact CD2-CE1 3.72Å; F81-F83 HydrophobicContact CE2-CE1 4.23Å; F83-I85 HydrophobicContact CD2-CG1 4.32Å; F83-I85 HydrophobicContact CE2-CG1 4.22Å; F83-V680 HydrophobicContact CB-CB 4.42Å; F83-V680 HydrophobicContact CB-CG1 3.47Å; F83-V680 VanDerWaalsContact CB-CG1 3.47Å; F83-V680 HydrophobicContact CB-CG2 4.09Å; F83-V680 HydrophobicContact CD2-CG2 3.82Å; F83-V680 HydrophobicContact CG-CG1 4.28Å; F83-V680 HydrophobicContact CG-CG2 4.07Å
84	E	83.4	Confident	82	Confident	52 Å²	52	36.5 Å²	36.5	24%	0.243	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	143.2	168.7	-50.4	-140.8	138.2	0	0	109.3	F82 P86 R745	F82-E84 HydrophobicContact CZ-CG 4.45Å; E84-P86 VanDerWaalsContact O-CD 3.27Å; E84-P86 WeakPolarHBondContact O-CD 3.41Å; E84-R745 IonicContact OE1-CZ 3.4Å; E84-R745 IonicContact OE1-NH1 3.12Å; E84-R745 PolarHBondContact OE1-NH1 2.94Å; E84-R745 IonicContact OE1-NH2 3.55Å; E84-R745 PolarHBondContact OE1-NH2 3.31Å; E84-R745 IonicContact OE2-NH1 3.34Å
85	I	85.6	Confident	82.5	Confident	13 Å²	13	34 Å²	34	7%	0.067	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	108.1	-179.3	-68.4	163.6	0	0	0	107.3	Q26 L28 L58 F83 R87 F89 Y304	Q26-I85 HydrophobicContact CB-CB 3.79Å; Q26-I85 HydrophobicContact CB-CD1 4.21Å; Q26-I85 HydrophobicContact CB-CG2 4.28Å; Q26-I85 PolarHBondContact O-N 2.98Å; L28-I85 HydrophobicContact CB-CD1 3.98Å; L28-I85 HydrophobicContact CB-CG1 4.48Å; L58-I85 HydrophobicContact CD1-CG1 4.32Å; L58-I85 HydrophobicContact CD1-CG2 4.38Å; F83-I85 HydrophobicContact CD2-CG1 4.32Å; F83-I85 HydrophobicContact CE2-CG1 4.22Å; I85-R87 VanDerWaalsContact C-N 3.31Å; I85-R87 WeakPolarHBondContact CG2-O 3.31Å; I85-R87 PolarHBondContact O-N 2.74Å; I85-F89 HydrophobicContact CD1-CD1 4.39Å; I85-F89 HydrophobicContact CD1-CE1 3.67Å; I85-F89 HydrophobicContact CD1-CZ 4.1Å; I85-F89 HydrophobicContact CG2-CD1 3.65Å; I85-F89 HydrophobicContact CG2-CE1 3.91Å; I85-Y304 HydrophobicContact CD1-CD2 4.13Å; I85-Y304 HydrophobicContact CD1-CE2 3.76Å
86	P	76.9	Confident	82.9	Confident	47 Å²	47	33.9 Å²	33.9	31%	0.305	17%	0.169	S	C	.	.			trans	-87.6	-2.8	-169.6	36.8	-37.6	0	0	0	113	E84 C679	E84-P86 VanDerWaalsContact O-CD 3.27Å; E84-P86 WeakPolarHBondContact O-CD 3.41Å; P86-C679 HydrophobicContact CG-CB 3.94Å; P86-C679 WeakPolarHBondContact CG-O 3.17Å
87	R	76.8	Confident	83	Confident	49 Å²	49	30.3 Å²	30.3	19%	0.185	15%	0.152	C	C	.	.	S	Bend	trans	-151.2	153.1	-177.8	64.2	176.8	177.2	94.7	-2.4	111.1	L58 D59 E61 I85 F89	L58-R87 PolarHBondContact O-NH2 3.37Å; D59-R87 IonicContact OD2-CZ 3.56Å; D59-R87 IonicContact OD2-NH1 3.41Å; D59-R87 PolarHBondContact OD2-NH1 3.27Å; E61-R87 IonicContact OE2-CZ 3.71Å; E61-R87 IonicContact OE2-NE 3.92Å; E61-R87 PolarHBondContact OE2-NE 2.91Å; E61-R87 IonicContact OE2-NH2 2.87Å; E61-R87 PolarHBondContact OE2-NH2 3.41Å; I85-R87 VanDerWaalsContact C-N 3.31Å; I85-R87 WeakPolarHBondContact CG2-O 3.31Å; I85-R87 PolarHBondContact O-N 2.74Å; R87-F89 PolarHBondContact O-N 3.46Å
88	P	74.6	Confident	82.9	Confident	107 Å²	107	30.6 Å²	30.6	70%	0.695	16%	0.155	S	C	*	.			trans	-53.1	140.2	165.4	-22.8	33.2	0	0	0	110.8
89	F	79.3	Confident	82.9	Confident	9 Å²	9	35.6 Å²	35.6	4%	0.039	18%	0.176	C	C	.	.			trans	-139.6	161.1	176.7	72.6	-75.1	0	0	0	108.6	L58 I85 R87 L92 K115 L118 Y304	L58-F89 HydrophobicContact CB-CB 4.38Å; L58-F89 HydrophobicContact CD2-CD1 4.49Å; L58-F89 HydrophobicContact CD2-CD2 3.97Å; L58-F89 HydrophobicContact CD2-CE2 4.31Å; L58-F89 HydrophobicContact CD2-CG 4.06Å; I85-F89 HydrophobicContact CD1-CD1 4.39Å; I85-F89 HydrophobicContact CD1-CE1 3.67Å; I85-F89 HydrophobicContact CD1-CZ 4.1Å; I85-F89 HydrophobicContact CG2-CD1 3.65Å; I85-F89 HydrophobicContact CG2-CE1 3.91Å; R87-F89 PolarHBondContact O-N 3.46Å; F89-L92 HydrophobicContact CE2-CB 4.1Å; F89-K115 HydrophobicContact CE1-CD 4.24Å; F89-K115 HydrophobicContact CE1-CG 4.11Å; F89-K115 HydrophobicContact CE2-CB 4.07Å; F89-K115 HydrophobicContact CE2-CG 4.28Å; F89-K115 HydrophobicContact CZ-CB 4.14Å; F89-K115 HydrophobicContact CZ-CD 4.44Å; F89-K115 HydrophobicContact CZ-CG 3.83Å; F89-L118 HydrophobicContact CE2-CD1 3.82Å; F89-L118 HydrophobicContact CZ-CD1 3.51Å; F89-Y304 HydrophobicContact CE1-CE2 4.21Å; F89-Y304 HydrophobicContact CZ-CE2 4.19Å
90	Q	74.6	Confident	82.2	Confident	34 Å²	34	36.5 Å²	36.5	16%	0.159	19%	0.186	C	C	.	.	S	Bend	trans	-108	-42.7	-178	-60.9	175.6	16.1	0	0	111	D59 R114 K115 L280	D59-Q90 PolarHBondContact OD1-N 2.85Å; Q90-R114 WeakPolarHBondContact O-CA 3.46Å; Q90-K115 PolarHBondContact O-N 2.82Å; Q90-L280 VanDerWaalsContact CD-CD2 3.45Å; Q90-L280 HydrophobicContact CG-CD2 4.42Å
91	F	80.8	Confident	81.1	Confident	50 Å²	50	39.7 Å²	39.7	22%	0.219	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.9	-177.1	-67.2	-91.7	0	0	0	111.1	D59 I113 R114	D59-F91 PolarHBondContact N-O 3.32Å; D59-F91 PolarHBondContact OD1-N 3.28Å; D59-F91 VanDerWaalsContact OD1-N 3.13Å; F91-I113 WeakPolarHBondContact CA-O 3.25Å; F91-R114 HydrophobicContact CD1-CG 3.75Å; F91-R114 HydrophobicContact CE1-CB 4.39Å; F91-R114 HydrophobicContact CE1-CG 3.2Å; F91-R114 HydrophobicContact CZ-CG 3.77Å
92	L	89.1	Confident	79.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	115.1	163.6	178.2	69.1	0	0	0	107.7	L28 I56 L58 F89 F94 I113 L118 L302	L28-L92 HydrophobicContact CD1-CD2 4.02Å; L28-L92 HydrophobicContact CD2-CD1 3.52Å; L28-L92 HydrophobicContact CD2-CD2 3.48Å; L28-L92 VanDerWaalsContact CD2-CD2 3.48Å; L28-L92 HydrophobicContact CD2-CG 4.15Å; L28-L92 HydrophobicContact CG-CD2 4.4Å; I56-L92 HydrophobicContact CG2-CD1 3.55Å; L58-L92 HydrophobicContact CD2-CD1 3.77Å; F89-L92 HydrophobicContact CE2-CB 4.1Å; L92-F94 HydrophobicContact CD2-CE2 3.66Å; L92-F94 HydrophobicContact CD2-CZ 3.77Å; L92-F94 HydrophobicContact CG-CE2 3.71Å; L92-F94 HydrophobicContact CG-CZ 4.04Å; L92-I113 PolarHBondContact N-O 2.95Å; L92-I113 PolarHBondContact O-N 3.46Å; L92-L118 HydrophobicContact CB-CD2 4.2Å; L92-L118 HydrophobicContact CD2-CD2 3.62Å; L92-L302 HydrophobicContact CD2-CD1 4.39Å
93	S	89.1	Confident	78.5	Confident	5 Å²	5	49.3 Å²	49.3	4%	0.035	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.3	-174.8	-64.9	0	0	0	0	111.9	I56 S57 Y95 V111 S112	I56-S93 CarbonylContact C-O 3.5Å; I56-S93 WeakPolarHBondContact CA-O 3.28Å; S57-S93 PolarHBondContact N-O 3.33Å; S57-S93 PolarHBondContact O-N 3.29Å; S93-Y95 VanDerWaalsContact CB-CE2 3.49Å; S93-V111 CarbonylContact C-O 3.55Å; S93-V111 VanDerWaalsContact CA-O 3.23Å; S93-V111 WeakPolarHBondContact CA-O 3.39Å; S93-S112 WeakPolarHBondContact OG-CB 3.09Å; S93-S112 PolarHBondContact OG-OG 2.67Å
94	F	91.3	Very high	77.7	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.4	175	-61.3	-95.7	0	0	0	108.6	I32 T55 I56 F81 L92 K110 V111 L298 L300 L302	I32-F94 HydrophobicContact CD1-CD1 4.48Å; I32-F94 HydrophobicContact CG1-CD1 4.4Å; I32-F94 HydrophobicContact CG1-CE1 4.43Å; T55-F94 CarbonylContact O-C 3.41Å; T55-F94 VanDerWaalsContact O-CA 3.32Å; T55-F94 WeakPolarHBondContact O-CA 3.42Å; I56-F94 HydrophobicContact CB-CE1 4.48Å; I56-F94 HydrophobicContact CD1-CD1 4.41Å; I56-F94 HydrophobicContact CD1-CE1 3.84Å; I56-F94 HydrophobicContact CG1-CD1 3.83Å; I56-F94 HydrophobicContact CG1-CE1 3.72Å; I56-F94 HydrophobicContact CG2-CD1 4.49Å; I56-F94 HydrophobicContact CG2-CE1 4.12Å; I56-F94 HydrophobicContact CG2-CZ 4.39Å; F81-F94 HydrophobicContact CE1-CE1 4.14Å; F81-F94 AromaticContact CZ-CE1 3.95Å; F81-F94 HydrophobicContact CZ-CE1 3.95Å; F81-F94 HydrophobicContact CZ-CZ 4.13Å; L92-F94 HydrophobicContact CD2-CE2 3.66Å; L92-F94 HydrophobicContact CD2-CZ 3.77Å; L92-F94 HydrophobicContact CG-CE2 3.71Å; L92-F94 HydrophobicContact CG-CZ 4.04Å; F94-K110 CarbonylContact O-C 3.5Å; F94-K110 WeakPolarHBondContact O-CA 3.4Å; F94-V111 HydrophobicContact CB-CB 4.34Å; F94-V111 PolarHBondContact N-O 3.39Å; F94-V111 PolarHBondContact O-N 2.73Å; F94-L298 HydrophobicContact CB-CD2 3.78Å; F94-L298 HydrophobicContact CG-CD2 4.48Å; F94-L300 HydrophobicContact CB-CD1 4.39Å; F94-L300 HydrophobicContact CD1-CD1 4.08Å; F94-L300 HydrophobicContact CD1-CD2 3.88Å; F94-L300 HydrophobicContact CD2-CD1 3.5Å; F94-L300 VanDerWaalsContact CD2-CD1 3.5Å; F94-L300 HydrophobicContact CE1-CD1 4.25Å; F94-L300 HydrophobicContact CE1-CD2 4.05Å; F94-L300 HydrophobicContact CE2-CD1 3.7Å; F94-L300 HydrophobicContact CG-CD1 3.72Å; F94-L300 HydrophobicContact CG-CD2 4.27Å; F94-L300 HydrophobicContact CZ-CD1 4.09Å; F94-L302 HydrophobicContact CE1-CD2 4.21Å; F94-L302 HydrophobicContact CE2-CD1 4.05Å; F94-L302 HydrophobicContact CE2-CD2 4.22Å; F94-L302 HydrophobicContact CZ-CD1 4.16Å; F94-L302 HydrophobicContact CZ-CD2 3.49Å; F94-L302 VanDerWaalsContact CZ-CD2 3.49Å; F94-L302 HydrophobicContact CZ-CG 4.48Å
95	Y	88.3	Confident	77.5	Confident	9 Å²	9	60.4 Å²	60.4	4%	0.035	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.7	-179.6	-65	-102.3	0	0	0	110.4	C54 T55 S93 Y97 K110 V133 E138	C54-Y95 CarbonylContact C-O 3.55Å; C54-Y95 VanDerWaalsContact CA-O 3.24Å; C54-Y95 WeakPolarHBondContact CA-O 3.19Å; C54-Y95 PolarHBondContact SG-O 3.38Å; T55-Y95 PolarHBondContact N-O 2.61Å; T55-Y95 PolarHBondContact O-N 3.01Å; T55-Y95 WeakPolarHBondContact OG1-CB 3.27Å; S93-Y95 VanDerWaalsContact CB-CE2 3.49Å; Y95-Y97 VanDerWaalsContact CB-CE2 3.44Å; Y95-Y97 HydrophobicContact CG-CE2 4.21Å; Y95-K110 HydrophobicContact CD1-CB 3.79Å; Y95-K110 HydrophobicContact CD1-CD 4.44Å; Y95-K110 HydrophobicContact CE1-CB 3.98Å; Y95-K110 HydrophobicContact CE1-CD 3.79Å; Y95-K110 HydrophobicContact CG-CB 4.25Å; Y95-V133 HydrophobicContact CD1-CG2 4.17Å; Y95-V133 HydrophobicContact CE1-CG1 4.15Å; Y95-V133 HydrophobicContact CE1-CG2 4.37Å; Y95-E138 WeakPolarHBondContact CE1-OE1 3.42Å; Y95-E138 VanDerWaalsContact CZ-OE1 3.3Å; Y95-E138 PolarHBondContact OH-OE1 2.75Å
96	V	88	Confident	77	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.2	170.5	-179.4	0	0	0	0	108.3	L38 V108 G109 L130 L298	L38-V96 HydrophobicContact CD1-CG1 4.09Å; L38-V96 HydrophobicContact CD2-CG1 4.28Å; V96-V108 HydrophobicContact CB-CB 4.32Å; V96-V108 HydrophobicContact CG1-CB 4.08Å; V96-V108 HydrophobicContact CG1-CG2 4.26Å; V96-V108 WeakPolarHBondContact O-CB 3.33Å; V96-V108 PolarHBondContact O-N 2.75Å; V96-G109 PolarHBondContact N-O 3.01Å; V96-G109 PolarHBondContact O-N 2.86Å; V96-L130 HydrophobicContact CG2-CD1 4.34Å; V96-L130 HydrophobicContact CG2-CD2 3.94Å; V96-L298 HydrophobicContact CG2-CD1 4.38Å; V96-L298 HydrophobicContact CG2-CD2 4.36Å
97	Y	85.1	Confident	77.1	Confident	49 Å²	49	63.5 Å²	63.5	19%	0.192	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142.7	178.1	-73	-81.1	0	0	0	111.1	T52 F53 T55 Y95 D105 L106 P107	T52-Y97 CarbonylContact C-O 3.57Å; T52-Y97 WeakPolarHBondContact CA-O 3.3Å; F53-Y97 HydrophobicContact CD2-CD2 4.34Å; F53-Y97 VanDerWaalsContact CE1-CB 3.46Å; F53-Y97 HydrophobicContact CE1-CG 4.34Å; F53-Y97 AromaticContact CE2-CD2 3.68Å; F53-Y97 HydrophobicContact CE2-CD2 3.68Å; F53-Y97 AromaticContact CE2-CG 3.96Å; F53-Y97 HydrophobicContact CE2-CG 3.96Å; F53-Y97 AromaticContact CZ-CD2 3.97Å; F53-Y97 HydrophobicContact CZ-CD2 3.97Å; F53-Y97 AromaticContact CZ-CG 3.76Å; F53-Y97 HydrophobicContact CZ-CG 3.76Å; F53-Y97 PolarHBondContact N-O 3.33Å; F53-Y97 PolarHBondContact O-N 2.76Å; T55-Y97 HydrophobicContact CG2-CD2 4.08Å; T55-Y97 HydrophobicContact CG2-CE2 4.11Å; T55-Y97 WeakPolarHBondContact OG1-CE2 3.43Å; Y95-Y97 VanDerWaalsContact CB-CE2 3.44Å; Y95-Y97 HydrophobicContact CG-CE2 4.21Å; Y97-D105 HydrophobicContact CD1-CB 4.18Å; Y97-L106 WeakPolarHBondContact CA-O 3.27Å; Y97-P107 HydrophobicContact CD1-CB 4.14Å; Y97-P107 HydrophobicContact CE1-CB 3.82Å; Y97-P107 HydrophobicContact CE1-CG 4.44Å
98	A	80.9	Confident	77.3	Confident	10 Å²	10	61.6 Å²	61.6	8%	0.083	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	121.7	163.5	0	0	0	0	0	108.7	L50 G100 L106 V108	L50-A98 HydrophobicContact CD2-CB 3.6Å; L50-A98 HydrophobicContact CG-CB 4.06Å; A98-G100 PolarHBondContact O-N 3.24Å; A98-L106 PolarHBondContact N-O 3.38Å; A98-L106 PolarHBondContact O-N 2.83Å; A98-V108 HydrophobicContact CB-CG2 3.86Å
99	K	78.4	Confident	77.7	Confident	111 Å²	111	56.5 Å²	56.5	48%	0.483	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-69.9	123	-179.2	-174.1	177.6	-173.6	176.4	0	110.6	C51 F53 V68 D105	C51-K99 HydrophobicContact CB-CB 4.12Å; C51-K99 WeakPolarHBondContact O-CB 3.48Å; C51-K99 PolarHBondContact O-N 3.44Å; F53-K99 HydrophobicContact CD1-CB 4.38Å; F53-K99 HydrophobicContact CE1-CB 4.36Å; V68-K99 HydrophobicContact CB-CD 4.22Å; V68-K99 HydrophobicContact CG1-CB 4.24Å; V68-K99 HydrophobicContact CG1-CD 3.58Å; V68-K99 HydrophobicContact CG2-CD 3.75Å; K99-D105 WeakPolarHBondContact CA-OD1 3.3Å
100	G	67.4	Low	78.1	Confident	25 Å²	25	56.6 Å²	56.6	26%	0.258	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-84.9	125.8	173.4	0	0	0	0	0	110.9	A98 F102 D105	A98-G100 PolarHBondContact O-N 3.24Å; G100-F102 VanDerWaalsContact C-N 3.31Å; G100-F102 PolarHBondContact O-N 3.24Å; G100-D105 PolarHBondContact N-OD1 3.2Å
101	V	58.8	Low	78.8	Confident	123 Å²	123	55.3 Å²	55.3	75%	0.745	27%	0.267	S	S	*	.	S	Bend	trans	-68.2	-33.9	175.7	-174.4	0	0	0	0	111.4
102	F	54.6	Low	79.1	Confident	198 Å²	198	54.8 Å²	54.8	87%	0.868	27%	0.27	S	S	*	.	S	Bend	trans	-134.9	4.2	-177.2	-59.6	-73.7	0	0	0	113.9	G100	G100-F102 VanDerWaalsContact C-N 3.31Å; G100-F102 PolarHBondContact O-N 3.24Å
103	Q	61.7	Low	79	Confident	139 Å²	139	55.1 Å²	55.1	65%	0.65	27%	0.272	S	S	*	.	S	Bend	trans	-128.8	166.2	-178.5	-69.5	-177.1	-15.8	0	0	109.6
104	R	67.8	Low	78.7	Confident	231 Å²	231	59.4 Å²	59.4	87%	0.872	29%	0.287	S	S	*	.			trans	-58.7	146.6	172.5	-69.3	-174.6	-178.3	-179.4	1.6	109.9	L106	R104-L106 PolarHBondContact O-N 2.98Å
105	D	78.6	Confident	78.3	Confident	60 Å²	60	62 Å²	62	32%	0.321	30%	0.298	S	S	.	.			trans	-58.4	133.8	175.6	-59.7	-37.4	0	0	0	109.8	F53 Y97 K99 G100	F53-D105 HydrophobicContact CE1-CB 4.03Å; F53-D105 HydrophobicContact CZ-CB 3.93Å; F53-D105 WeakPolarHBondContact CZ-OD2 3.17Å; Y97-D105 HydrophobicContact CD1-CB 4.18Å; K99-D105 WeakPolarHBondContact CA-OD1 3.3Å; G100-D105 PolarHBondContact N-OD1 3.2Å
106	L	75.9	Confident	77.9	Confident	78 Å²	78	67.8 Å²	67.8	41%	0.408	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.8	-169.6	-169.3	62.3	0	0	0	109	V41 Y97 A98 R104 V108	V41-L106 HydrophobicContact CB-CD2 4.03Å; V41-L106 HydrophobicContact CG1-CD2 3.14Å; V41-L106 HydrophobicContact CG1-CG 3.69Å; Y97-L106 WeakPolarHBondContact CA-O 3.27Å; A98-L106 PolarHBondContact N-O 3.38Å; A98-L106 PolarHBondContact O-N 2.83Å; R104-L106 PolarHBondContact O-N 2.98Å; L106-V108 PolarHBondContact O-N 3.27Å
107	P	77.9	Confident	77.8	Confident	47 Å²	47	70 Å²	70	31%	0.305	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	124.6	178.4	25.9	-32.8	0	0	0	110.1	Y97 V133	Y97-P107 HydrophobicContact CD1-CB 4.14Å; Y97-P107 HydrophobicContact CE1-CB 3.82Å; Y97-P107 HydrophobicContact CE1-CG 4.44Å; P107-V133 HydrophobicContact CB-CB 3.83Å; P107-V133 HydrophobicContact CB-CG1 4.09Å; P107-V133 HydrophobicContact CB-CG2 3.76Å; P107-V133 HydrophobicContact CG-CB 4.09Å; P107-V133 HydrophobicContact CG-CG1 4.2Å
108	V	80.6	Confident	77.8	Confident	8 Å²	8	67.8 Å²	67.8	5%	0.048	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-42.3	174.3	-177.2	0	0	0	0	109.7	L38 V41 L50 V96 A98 L106	L38-V108 HydrophobicContact CB-CG1 4.5Å; L38-V108 HydrophobicContact CD2-CG1 4.26Å; V41-V108 HydrophobicContact CG2-CG2 3.96Å; L50-V108 HydrophobicContact CD2-CG2 4.44Å; V96-V108 HydrophobicContact CB-CB 4.32Å; V96-V108 HydrophobicContact CG1-CB 4.08Å; V96-V108 HydrophobicContact CG1-CG2 4.26Å; V96-V108 WeakPolarHBondContact O-CB 3.33Å; V96-V108 PolarHBondContact O-N 2.75Å; A98-V108 HydrophobicContact CB-CG2 3.86Å; L106-V108 PolarHBondContact O-N 3.27Å
109	G	83.3	Confident	77.9	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.8	170.3	179.3	0	0	0	0	0	112.1	V96 Q131	V96-G109 PolarHBondContact N-O 3.01Å; V96-G109 PolarHBondContact O-N 2.86Å; G109-Q131 CarbonylContact C-O 3.54Å; G109-Q131 VanDerWaalsContact CA-O 3.24Å; G109-Q131 WeakPolarHBondContact CA-O 3.47Å
110	K	87.2	Confident	78.2	Confident	11 Å²	11	72.2 Å²	72.2	5%	0.048	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.3	176.8	70	-179.7	176.3	-176.3	0	113.1	F94 Y95 Q131 V133 T137	F94-K110 CarbonylContact O-C 3.5Å; F94-K110 WeakPolarHBondContact O-CA 3.4Å; Y95-K110 HydrophobicContact CD1-CB 3.79Å; Y95-K110 HydrophobicContact CD1-CD 4.44Å; Y95-K110 HydrophobicContact CE1-CB 3.98Å; Y95-K110 HydrophobicContact CE1-CD 3.79Å; Y95-K110 HydrophobicContact CG-CB 4.25Å; K110-Q131 HydrophobicContact CG-CB 4.5Å; K110-Q131 PolarHBondContact N-O 3.33Å; K110-Q131 PolarHBondContact O-N 3.31Å; K110-V133 HydrophobicContact CB-CG2 3.94Å; K110-V133 HydrophobicContact CD-CG2 4.19Å; K110-V133 HydrophobicContact CG-CG2 4Å; K110-T137 PolarHBondContact NZ-OG1 3.49Å
111	V	89.8	Confident	79	Confident	7 Å²	7	74.8 Å²	74.8	4%	0.042	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.3	162.7	180	0	0	0	0	106.6	S93 F94 I113 F128 L130 L298 L300	S93-V111 CarbonylContact C-O 3.55Å; S93-V111 VanDerWaalsContact CA-O 3.23Å; S93-V111 WeakPolarHBondContact CA-O 3.39Å; F94-V111 HydrophobicContact CB-CB 4.34Å; F94-V111 PolarHBondContact N-O 3.39Å; F94-V111 PolarHBondContact O-N 2.73Å; V111-I113 HydrophobicContact CG1-CG1 4.21Å; V111-F128 HydrophobicContact CB-CB 4.27Å; V111-F128 HydrophobicContact CG1-CB 3.58Å; V111-F128 HydrophobicContact CG1-CD1 3.79Å; V111-F128 HydrophobicContact CG1-CG 3.8Å; V111-F128 HydrophobicContact CG2-CB 3.66Å; V111-L130 HydrophobicContact CG2-CD2 3.96Å; V111-L298 HydrophobicContact CG2-CB 4.13Å; V111-L298 HydrophobicContact CG2-CD2 4.21Å; V111-L300 HydrophobicContact CG1-CD1 4.47Å
112	S	86.8	Confident	80.1	Confident	40 Å²	40	70.9 Å²	70.9	28%	0.28	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.7	176.6	-60	0	0	0	0	109.8	S93	S93-S112 WeakPolarHBondContact OG-CB 3.09Å; S93-S112 PolarHBondContact OG-OG 2.67Å
113	I	86.6	Confident	81.1	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.036	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.4	-178.9	-53.4	174.7	0	0	0	107.9	F91 L92 V111 D117 L118 Y121 F128 L302	F91-I113 WeakPolarHBondContact CA-O 3.25Å; L92-I113 PolarHBondContact N-O 2.95Å; L92-I113 PolarHBondContact O-N 3.46Å; V111-I113 HydrophobicContact CG1-CG1 4.21Å; I113-D117 HydrophobicContact CG2-CB 4.18Å; I113-L118 HydrophobicContact CB-CD2 4.14Å; I113-L118 HydrophobicContact CG2-CD2 3.73Å; I113-L118 HydrophobicContact CG2-CG 4.22Å; I113-Y121 HydrophobicContact CD1-CD2 4.5Å; I113-Y121 HydrophobicContact CG2-CD2 3.98Å; I113-Y121 HydrophobicContact CG2-CE2 4.02Å; I113-F128 HydrophobicContact CD1-CD1 4.33Å; I113-F128 HydrophobicContact CD1-CE1 3.72Å; I113-F128 HydrophobicContact CD1-CZ 3.99Å; I113-F128 HydrophobicContact CG1-CE1 4.35Å; I113-L302 HydrophobicContact CD1-CD1 3.55Å
114	R	83.1	Confident	82.1	Confident	94 Å²	94	62.3 Å²	62.3	36%	0.355	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	145.7	174.4	-74.3	179.5	174.8	-170	-2.6	110.1	Q90 F91 D116 D117 L118	Q90-R114 WeakPolarHBondContact O-CA 3.46Å; F91-R114 HydrophobicContact CD1-CG 3.75Å; F91-R114 HydrophobicContact CE1-CB 4.39Å; F91-R114 HydrophobicContact CE1-CG 3.2Å; F91-R114 HydrophobicContact CZ-CG 3.77Å; R114-D116 PolarHBondContact O-N 3.38Å; R114-D117 HydrophobicContact CB-CB 4.4Å; R114-D117 PolarHBondContact O-N 3.46Å; R114-L118 PolarHBondContact O-N 3.02Å
115	K	83.6	Confident	83.1	Confident	54 Å²	54	54.4 Å²	54.4	24%	0.235	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-48.8	-48.1	176	-177.1	-170.9	173.6	-155.9	0	111.5	Q26 F89 Q90 D117 L118 Y304 E306	Q26-K115 VanDerWaalsContact NE2-CE 3.33Å; Q26-K115 VanDerWaalsContact NE2-NZ 3.13Å; F89-K115 HydrophobicContact CE1-CD 4.24Å; F89-K115 HydrophobicContact CE1-CG 4.11Å; F89-K115 HydrophobicContact CE2-CB 4.07Å; F89-K115 HydrophobicContact CE2-CG 4.28Å; F89-K115 HydrophobicContact CZ-CB 4.14Å; F89-K115 HydrophobicContact CZ-CD 4.44Å; F89-K115 HydrophobicContact CZ-CG 3.83Å; Q90-K115 PolarHBondContact O-N 2.82Å; K115-D117 PolarHBondContact O-N 3.32Å; K115-L118 WeakPolarHBondContact O-CB 3.35Å; K115-L118 PolarHBondContact O-N 2.92Å; K115-L118 VanDerWaalsContact O-N 3.1Å; K115-Y304 VanDerWaalsContact CE-OH 3.22Å; K115-Y304 WeakPolarHBondContact CE-OH 3.28Å; K115-E306 WeakPolarHBondContact CE-OE2 3.46Å; K115-E306 IonicContact NZ-OE2 3.19Å; K115-E306 PolarHBondContact NZ-OE2 3.06Å
116	D	80.8	Confident	83.7	Confident	132 Å²	132	54 Å²	54	71%	0.706	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-64.8	-22.1	-177.6	-54.5	-29	0	0	0	113.4	R114	R114-D116 PolarHBondContact O-N 3.38Å
117	D	85	Confident	84.4	Confident	46 Å²	46	54.5 Å²	54.5	25%	0.246	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-91.8	-12.3	178.9	-68.3	-42	0	0	0	112.8	I113 R114 K115 C119 K120 Y121	I113-D117 HydrophobicContact CG2-CB 4.18Å; R114-D117 HydrophobicContact CB-CB 4.4Å; R114-D117 PolarHBondContact O-N 3.46Å; K115-D117 PolarHBondContact O-N 3.32Å; D117-C119 VanDerWaalsContact C-N 3.26Å; D117-C119 PolarHBondContact O-N 3.35Å; D117-K120 HydrophobicContact CB-CD 4.41Å; D117-K120 VanDerWaalsContact O-CB 3.3Å; D117-K120 WeakPolarHBondContact O-CB 3.23Å; D117-K120 PolarHBondContact O-N 2.89Å; D117-K120 WeakPolarHBondContact OD1-CE 3.2Å; D117-K120 IonicContact OD1-NZ 3.23Å; D117-K120 PolarHBondContact OD1-NZ 3.36Å; D117-Y121 HydrophobicContact CB-CE2 4.27Å; D117-Y121 VanDerWaalsContact O-CD2 3.24Å; D117-Y121 WeakPolarHBondContact O-CD2 3.44Å
118	L	85.6	Confident	85	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-36.9	-176.6	-73.9	172.4	0	0	0	112.8	F89 L92 I113 R114 K115 K120 Y121 S122 Y304	F89-L118 HydrophobicContact CE2-CD1 3.82Å; F89-L118 HydrophobicContact CZ-CD1 3.51Å; L92-L118 HydrophobicContact CB-CD2 4.2Å; L92-L118 HydrophobicContact CD2-CD2 3.62Å; I113-L118 HydrophobicContact CB-CD2 4.14Å; I113-L118 HydrophobicContact CG2-CD2 3.73Å; I113-L118 HydrophobicContact CG2-CG 4.22Å; R114-L118 PolarHBondContact O-N 3.02Å; K115-L118 WeakPolarHBondContact O-CB 3.35Å; K115-L118 PolarHBondContact O-N 2.92Å; K115-L118 VanDerWaalsContact O-N 3.1Å; L118-K120 PolarHBondContact O-N 2.98Å; L118-Y121 PolarHBondContact O-N 3Å; L118-Y121 VanDerWaalsContact O-N 3.16Å; L118-S122 PolarHBondContact O-N 2.91Å; L118-S122 VanDerWaalsContact O-N 3.16Å; L118-Y304 HydrophobicContact CB-CD1 4.15Å; L118-Y304 HydrophobicContact CB-CG 4.06Å; L118-Y304 HydrophobicContact CD1-CD1 4.5Å; L118-Y304 HydrophobicContact CD1-CD2 3.94Å; L118-Y304 HydrophobicContact CD1-CE2 4.31Å; L118-Y304 HydrophobicContact CD1-CG 4.02Å
119	C	81.8	Confident	85.5	Confident	87 Å²	87	58.2 Å²	58.2	59%	0.588	30%	0.299	S	S	*	.	H	α-helix	trans	-61.3	-28.4	178.5	-64.4	0	0	0	0	112.5	D117 Y121 S122	D117-C119 VanDerWaalsContact C-N 3.26Å; D117-C119 PolarHBondContact O-N 3.35Å; C119-Y121 VanDerWaalsContact C-N 3.28Å; C119-Y121 PolarHBondContact O-N 3.37Å; C119-S122 PolarHBondContact O-N 3.41Å
120	K	84.8	Confident	85.6	Confident	127 Å²	127	58.8 Å²	58.8	55%	0.552	30%	0.303	S	S	*	.	H	α-helix	trans	-67.9	-29.3	179.3	-60.2	173.9	179.9	167.5	0	112.7	D117 L118 K124	D117-K120 HydrophobicContact CB-CD 4.41Å; D117-K120 VanDerWaalsContact O-CB 3.3Å; D117-K120 WeakPolarHBondContact O-CB 3.23Å; D117-K120 PolarHBondContact O-N 2.89Å; D117-K120 WeakPolarHBondContact OD1-CE 3.2Å; D117-K120 IonicContact OD1-NZ 3.23Å; D117-K120 PolarHBondContact OD1-NZ 3.36Å; L118-K120 PolarHBondContact O-N 2.98Å; K120-K124 PolarHBondContact O-NZ 3.16Å
121	Y	84.7	Confident	85.5	Confident	80 Å²	80	63.6 Å²	63.6	31%	0.314	33%	0.325	S	S	.	.	H	α-helix	trans	-102.5	-3.3	-177.6	-54.4	-73.1	0	0	0	113	I113 D117 L118 C119 G123 K124 F128	I113-Y121 HydrophobicContact CD1-CD2 4.5Å; I113-Y121 HydrophobicContact CG2-CD2 3.98Å; I113-Y121 HydrophobicContact CG2-CE2 4.02Å; D117-Y121 HydrophobicContact CB-CE2 4.27Å; D117-Y121 VanDerWaalsContact O-CD2 3.24Å; D117-Y121 WeakPolarHBondContact O-CD2 3.44Å; L118-Y121 PolarHBondContact O-N 3Å; L118-Y121 VanDerWaalsContact O-N 3.16Å; C119-Y121 VanDerWaalsContact C-N 3.28Å; C119-Y121 PolarHBondContact O-N 3.37Å; Y121-G123 PolarHBondContact O-N 2.84Å; Y121-K124 PolarHBondContact O-N 3.32Å; Y121-F128 AromaticContact CD1-CE1 3.88Å; Y121-F128 HydrophobicContact CD1-CE1 3.88Å; Y121-F128 AromaticContact CD1-CZ 3.7Å; Y121-F128 HydrophobicContact CD1-CZ 3.7Å; Y121-F128 AromaticContact CE1-CE1 3.8Å; Y121-F128 HydrophobicContact CE1-CE1 3.8Å; Y121-F128 HydrophobicContact CE1-CZ 4.09Å; Y121-F128 HydrophobicContact CE2-CE1 4.46Å; Y121-F128 HydrophobicContact CG-CE1 4.25Å; Y121-F128 HydrophobicContact CG-CZ 4.01Å
122	S	82.8	Confident	84.9	Confident	40 Å²	40	67.1 Å²	67.1	28%	0.28	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-65.5	126.7	-177.4	-161.7	0	0	0	0	111.6	L118 C119 K124 L302 T303 Y304	L118-S122 PolarHBondContact O-N 2.91Å; L118-S122 VanDerWaalsContact O-N 3.16Å; C119-S122 PolarHBondContact O-N 3.41Å; S122-K124 VanDerWaalsContact C-N 3.27Å; S122-K124 PolarHBondContact O-N 3.26Å; S122-L302 CarbonylContact C-O 3.53Å; S122-L302 WeakPolarHBondContact CA-O 3.46Å; S122-T303 WeakPolarHBondContact OG-CA 3.44Å; S122-Y304 PolarHBondContact OG-N 3.46Å; S122-Y304 PolarHBondContact OG-O 3.31Å
123	G	75.6	Confident	84.3	Confident	44 Å²	44	67 Å²	67	45%	0.454	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	0.9	-179.6	0	0	0	0	0	115.1	Y121 L302	Y121-G123 PolarHBondContact O-N 2.84Å; G123-L302 PolarHBondContact N-O 2.97Å
124	K	82.9	Confident	83.3	Confident	113 Å²	113	69.9 Å²	69.9	49%	0.491	36%	0.361	S	S	.	.			trans	-101.7	159.7	179.6	-62.8	178.1	-175	164.9	0	111.7	K120 Y121 S122 D126 K301	K120-K124 PolarHBondContact O-NZ 3.16Å; Y121-K124 PolarHBondContact O-N 3.32Å; S122-K124 VanDerWaalsContact C-N 3.27Å; S122-K124 PolarHBondContact O-N 3.26Å; K124-D126 WeakPolarHBondContact CB-OD2 3.43Å; K124-K301 WeakPolarHBondContact O-CA 3.34Å
125	D	88.6	Confident	82.2	Confident	66 Å²	66	70.3 Å²	70.3	35%	0.353	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	98.1	177.1	-178.1	1.7	0	0	0	107.7	R299	D125-R299 VanDerWaalsContact CG-NE 3.32Å; D125-R299 VanDerWaalsContact OD1-CG 3.25Å; D125-R299 WeakPolarHBondContact OD1-CG 3.44Å; D125-R299 IonicContact OD1-CZ 2.7Å; D125-R299 IonicContact OD1-NE 2.69Å; D125-R299 PolarHBondContact OD1-NE 2.92Å; D125-R299 IonicContact OD1-NH2 3.93Å; D125-R299 IonicContact OD2-CZ 3.76Å; D125-R299 VanDerWaalsContact OD2-CZ 3.3Å; D125-R299 IonicContact OD2-NE 3.36Å; D125-R299 PolarHBondContact OD2-NE 2.93Å; D125-R299 IonicContact OD2-NH2 2.91Å; D125-R299 PolarHBondContact OD2-NH2 3.5Å
126	D	90.1	Very high	81	Confident	52 Å²	52	70.9 Å²	70.9	28%	0.278	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	151.5	-165.5	-69.9	-52	0	0	0	111.7	K124 F128 R299 L300	K124-D126 WeakPolarHBondContact CB-OD2 3.43Å; D126-F128 HydrophobicContact CB-CD2 4.44Å; D126-F128 HydrophobicContact CB-CE2 3.66Å; D126-F128 HydrophobicContact CB-CZ 3.93Å; D126-F128 WeakPolarHBondContact O-CD2 3.45Å; D126-R299 WeakPolarHBondContact O-CA 3.32Å; D126-L300 PolarHBondContact N-O 3.39Å; D126-L300 VanDerWaalsContact N-O 3.08Å; D126-L300 PolarHBondContact O-N 2.93Å
127	W	91.7	Very high	80	Confident	88 Å²	88	67 Å²	67	33%	0.333	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130	171.4	-73.6	93.9	0	0	0	110.8	E34 K36 Q297 R299	E34-W127 HydrophobicContact CG-CH2 3.65Å; E34-W127 HydrophobicContact CG-CZ2 4.19Å; E34-W127 VanDerWaalsContact OE1-CH2 3.27Å; E34-W127 WeakPolarHBondContact OE1-CH2 3.3Å; E34-W127 WeakPolarHBondContact OE1-CZ2 3.49Å; K36-W127 HydrophobicContact CB-CH2 4.2Å; K36-W127 HydrophobicContact CB-CZ3 3.98Å; K36-W127 HydrophobicContact CD-CH2 3.35Å; K36-W127 HydrophobicContact CD-CZ2 3.9Å; K36-W127 HydrophobicContact CD-CZ3 3.96Å; K36-W127 VanDerWaalsContact CE-CH2 3.49Å; K36-W127 HydrophobicContact CG-CH2 3.6Å; K36-W127 HydrophobicContact CG-CZ3 3.9Å; K36-W127 VanDerWaalsContact NZ-CZ2 3.26Å; W127-Q297 HydrophobicContact CE3-CB 3.68Å; W127-Q297 HydrophobicContact CZ3-CB 4.21Å; W127-R299 HydrophobicContact CD2-CB 3.84Å; W127-R299 HydrophobicContact CD2-CG 4.24Å; W127-R299 HydrophobicContact CE3-CB 3.73Å; W127-R299 HydrophobicContact CH2-CB 3.75Å; W127-R299 HydrophobicContact CZ2-CB 3.85Å; W127-R299 HydrophobicContact CZ2-CG 4.15Å; W127-R299 HydrophobicContact CZ3-CB 3.71Å
128	F	90.9	Very high	78.9	Confident	22 Å²	22	67.5 Å²	67.5	10%	0.096	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.9	179.2	-63	-93.8	0	0	0	110.2	V111 I113 Y121 D126 Q297 L298 L300	V111-F128 HydrophobicContact CB-CB 4.27Å; V111-F128 HydrophobicContact CG1-CB 3.58Å; V111-F128 HydrophobicContact CG1-CD1 3.79Å; V111-F128 HydrophobicContact CG1-CG 3.8Å; V111-F128 HydrophobicContact CG2-CB 3.66Å; I113-F128 HydrophobicContact CD1-CD1 4.33Å; I113-F128 HydrophobicContact CD1-CE1 3.72Å; I113-F128 HydrophobicContact CD1-CZ 3.99Å; I113-F128 HydrophobicContact CG1-CE1 4.35Å; Y121-F128 AromaticContact CD1-CE1 3.88Å; Y121-F128 HydrophobicContact CD1-CE1 3.88Å; Y121-F128 AromaticContact CD1-CZ 3.7Å; Y121-F128 HydrophobicContact CD1-CZ 3.7Å; Y121-F128 AromaticContact CE1-CE1 3.8Å; Y121-F128 HydrophobicContact CE1-CE1 3.8Å; Y121-F128 HydrophobicContact CE1-CZ 4.09Å; Y121-F128 HydrophobicContact CE2-CE1 4.46Å; Y121-F128 HydrophobicContact CG-CE1 4.25Å; Y121-F128 HydrophobicContact CG-CZ 4.01Å; D126-F128 HydrophobicContact CB-CD2 4.44Å; D126-F128 HydrophobicContact CB-CE2 3.66Å; D126-F128 HydrophobicContact CB-CZ 3.93Å; D126-F128 WeakPolarHBondContact O-CD2 3.45Å; F128-Q297 CarbonylContact O-C 3.16Å; F128-Q297 VanDerWaalsContact O-CA 3.24Å; F128-Q297 WeakPolarHBondContact O-CA 3.45Å; F128-L298 PolarHBondContact N-O 2.85Å; F128-L298 PolarHBondContact O-N 3.36Å; F128-L300 HydrophobicContact CD2-CB 3.96Å; F128-L300 HydrophobicContact CD2-CD1 3.89Å; F128-L300 HydrophobicContact CD2-CG 4.05Å; F128-L300 HydrophobicContact CE2-CB 3.79Å; F128-L300 HydrophobicContact CE2-CD1 4.19Å; F128-L300 HydrophobicContact CE2-CG 4.35Å; F128-L300 HydrophobicContact CG-CD1 4.44Å
129	N	89.2	Confident	78.1	Confident	110 Å²	110	68.3 Å²	68.3	59%	0.588	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	135.2	176.1	-64.6	-24.6	0	0	0	110.4	Q297	N129-Q297 WeakPolarHBondContact OD1-CG 3.39Å; N129-Q297 PolarHBondContact OD1-NE2 2.82Å
130	L	86.9	Confident	77.7	Confident	13 Å²	13	64.6 Å²	64.6	7%	0.068	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-73.9	133.8	175.8	-70.9	169.2	0	0	0	110.6	L38 V96 V111 L295 G296 L298	L38-L130 HydrophobicContact CD2-CD1 3.39Å; V96-L130 HydrophobicContact CG2-CD1 4.34Å; V96-L130 HydrophobicContact CG2-CD2 3.94Å; V111-L130 HydrophobicContact CG2-CD2 3.96Å; L130-L295 HydrophobicContact CB-CB 3.87Å; L130-L295 VanDerWaalsContact CD1-O 3.29Å; L130-L295 WeakPolarHBondContact CD1-O 3.43Å; L130-G296 WeakPolarHBondContact CB-O 3.39Å; L130-G296 PolarHBondContact N-O 3.07Å; L130-L298 HydrophobicContact CD2-CB 4.31Å
131	Q	83.8	Confident	77.4	Confident	112 Å²	112	58.5 Å²	58.5	52%	0.523	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-102.8	149.2	174.1	-64.1	-173.7	-22	0	0	110.4	G109 K110	G109-Q131 CarbonylContact C-O 3.54Å; G109-Q131 VanDerWaalsContact CA-O 3.24Å; G109-Q131 WeakPolarHBondContact CA-O 3.47Å; K110-Q131 HydrophobicContact CG-CB 4.5Å; K110-Q131 PolarHBondContact N-O 3.33Å; K110-Q131 PolarHBondContact O-N 3.31Å
132	P	77.8	Confident	77.5	Confident	80 Å²	80	55.7 Å²	55.7	52%	0.519	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-62	145.3	175.9	25.1	-33.2	0	0	0	111.2	L295	P132-L295 HydrophobicContact CB-CD1 4Å
133	V	73.4	Confident	77.9	Confident	39 Å²	39	53.8 Å²	53.8	24%	0.236	29%	0.292	C	S	.	.			trans	-95.5	100.7	175.7	-174.2	0	0	0	0	108.4	Y95 P107 K110	Y95-V133 HydrophobicContact CD1-CG2 4.17Å; Y95-V133 HydrophobicContact CE1-CG1 4.15Å; Y95-V133 HydrophobicContact CE1-CG2 4.37Å; P107-V133 HydrophobicContact CB-CB 3.83Å; P107-V133 HydrophobicContact CB-CG1 4.09Å; P107-V133 HydrophobicContact CB-CG2 3.76Å; P107-V133 HydrophobicContact CG-CB 4.09Å; P107-V133 HydrophobicContact CG-CG1 4.2Å; K110-V133 HydrophobicContact CB-CG2 3.94Å; K110-V133 HydrophobicContact CD-CG2 4.19Å; K110-V133 HydrophobicContact CG-CG2 4Å
134	D	67.6	Low	78.7	Confident	67 Å²	67	52.8 Å²	52.8	36%	0.358	28%	0.275	S	S	.	.			trans	-110.1	131.5	173.5	176.9	-12	0	0	0	109.3	N136 T137	D134-N136 PolarHBondContact O-N 3.33Å; D134-N136 VanDerWaalsContact O-N 3.07Å; D134-N136 WeakPolarHBondContact OD1-CB 3.32Å; D134-N136 PolarHBondContact OD1-N 2.92Å; D134-N136 PolarHBondContact OD1-ND2 2.95Å; D134-T137 HydrophobicContact CB-CG2 3.88Å; D134-T137 WeakPolarHBondContact O-CA 3.24Å; D134-T137 WeakPolarHBondContact O-CB 3.11Å; D134-T137 PolarHBondContact O-N 3.06Å; D134-T137 PolarHBondContact O-OG1 3.12Å
135	P	59.7	Low	79.2	Confident	102 Å²	102	47.4 Å²	47.4	66%	0.662	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-47.6	-31.8	172.5	-28.6	34.4	0	0	0	114.7	T137 E138	P135-T137 PolarHBondContact O-N 3.38Å; P135-E138 PolarHBondContact O-N 3.36Å
136	N	58.6	Low	79.4	Confident	67 Å²	67	45 Å²	45	36%	0.358	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-75.7	-9.6	177.8	-58.4	-61.7	0	0	0	113.9	D134	D134-N136 PolarHBondContact O-N 3.33Å; D134-N136 VanDerWaalsContact O-N 3.07Å; D134-N136 WeakPolarHBondContact OD1-CB 3.32Å; D134-N136 PolarHBondContact OD1-N 2.92Å; D134-N136 PolarHBondContact OD1-ND2 2.95Å
137	T	58.1	Low	79.4	Confident	51 Å²	51	42.6 Å²	42.6	31%	0.313	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-97	-7.3	176.8	68.9	0	0	0	0	113.2	K110 D134 P135 V139	K110-T137 PolarHBondContact NZ-OG1 3.49Å; D134-T137 HydrophobicContact CB-CG2 3.88Å; D134-T137 WeakPolarHBondContact O-CA 3.24Å; D134-T137 WeakPolarHBondContact O-CB 3.11Å; D134-T137 PolarHBondContact O-N 3.06Å; D134-T137 PolarHBondContact O-OG1 3.12Å; P135-T137 PolarHBondContact O-N 3.38Å; T137-V139 PolarHBondContact O-N 2.98Å
138	E	63.4	Low	79.2	Confident	56 Å²	56	43.1 Å²	43.1	26%	0.262	23%	0.228	S	C	.	.			trans	-98.1	75.2	177.8	-61.3	-162.5	152.7	0	0	110	Q60 Y95 P135	Q60-E138 PolarHBondContact NE2-O 2.86Å; Y95-E138 WeakPolarHBondContact CE1-OE1 3.42Å; Y95-E138 VanDerWaalsContact CZ-OE1 3.3Å; Y95-E138 PolarHBondContact OH-OE1 2.75Å; P135-E138 PolarHBondContact O-N 3.36Å
139	V	68.8	Low	78.9	Confident	18 Å²	18	44.4 Å²	44.4	11%	0.109	24%	0.235	C	C	.	.			trans	-98.8	133.2	179.4	169.5	0	0	0	0	109.9	T137 F258 L259 L281 P283	T137-V139 PolarHBondContact O-N 2.98Å; V139-F258 HydrophobicContact CG2-CD1 4.19Å; V139-F258 HydrophobicContact CG2-CE1 3.74Å; V139-L259 WeakPolarHBondContact CG1-O 3.41Å; V139-L281 VanDerWaalsContact CG1-C 3.46Å; V139-L281 HydrophobicContact CG1-CB 3.4Å; V139-P283 HydrophobicContact CB-CG 4.45Å; V139-P283 HydrophobicContact CG2-CG 4.46Å
140	Q	72.9	Confident	78.5	Confident	9 Å²	9	42.5 Å²	42.5	4%	0.042	23%	0.225	C	C	.	.			trans	-138.7	146.6	175.7	-171.9	-179.6	-8.1	0	0	109.9	E172 P174 L281	Q140-E172 WeakPolarHBondContact CG-O 3.47Å; Q140-P174 HydrophobicContact CB-CB 4.38Å; Q140-P174 WeakPolarHBondContact O-CD 2.99Å; Q140-L281 WeakPolarHBondContact O-CD1 3.49Å
141	G	78	Confident	77.8	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.			trans	115.9	176.9	169.6	0	0	0	0	0	113.3	K171 E172 L281	G141-K171 VanDerWaalsContact CA-O 3.25Å; G141-K171 WeakPolarHBondContact CA-O 3.5Å; G141-E172 WeakPolarHBondContact CA-O 3.5Å; G141-L281 WeakPolarHBondContact O-CG 3.49Å; G141-L281 PolarHBondContact O-N 2.94Å
142	K	86.8	Confident	77	Confident	21 Å²	21	46.2 Å²	46.2	9%	0.091	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	146.8	-175.3	-56.8	169.7	-173	-179.7	0	109.3	C170 K171 W278 Y279 L280 L826 P829	K142-C170 CarbonylContact O-C 3.46Å; K142-C170 WeakPolarHBondContact O-CA 3.38Å; K142-C170 WeakPolarHBondContact O-CB 3.27Å; K142-K171 PolarHBondContact N-O 2.81Å; K142-K171 PolarHBondContact O-N 3.19Å; K142-W278 HydrophobicContact CB-CE3 3.81Å; K142-W278 HydrophobicContact CB-CZ3 4.21Å; K142-Y279 CarbonylContact C-O 3.53Å; K142-Y279 VanDerWaalsContact CA-O 3.27Å; K142-Y279 WeakPolarHBondContact CA-O 3.25Å; K142-L280 HydrophobicContact CD-CD2 4.49Å; K142-L280 HydrophobicContact CG-CD2 3.81Å; K142-L826 HydrophobicContact CD-CD1 4.26Å; K142-L826 PolarHBondContact NZ-O 3.33Å; K142-P829 HydrophobicContact CD-CB 4.29Å; K142-P829 HydrophobicContact CD-CG 3.94Å; K142-P829 HydrophobicContact CG-CG 4.38Å
143	V	90.8	Very high	76.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134	173.7	61.2	0	0	0	0	110.2	L145 I167 T262 W278 Y279 L281	V143-L145 HydrophobicContact CG1-CD1 4.28Å; V143-L145 HydrophobicContact CG1-CG 4.2Å; V143-L145 HydrophobicContact CG2-CD2 3.64Å; V143-L145 HydrophobicContact CG2-CG 4.06Å; V143-I167 HydrophobicContact CG2-CG2 4.32Å; V143-T262 HydrophobicContact CG1-CG2 3.6Å; V143-W278 WeakPolarHBondContact O-CA 3.3Å; V143-Y279 PolarHBondContact N-O 3.21Å; V143-Y279 PolarHBondContact O-N 3.23Å; V143-L281 HydrophobicContact CB-CD2 4.37Å; V143-L281 HydrophobicContact CG1-CD2 4.06Å
144	H	93.3	Very high	75.9	Confident	22 Å²	22	48.5 Å²	48.5	10%	0.102	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	113.9	175.9	-171.8	-172	0	0	0	109.2	I168 E169 K276 W278	H144-I168 HydrophobicContact CB-CB 4.25Å; H144-I168 PolarHBondContact O-N 3.12Å; H144-I168 VanDerWaalsContact O-N 3.08Å; H144-E169 HydrophobicContact CB-CG 3.88Å; H144-E169 PolarHBondContact N-O 3.3Å; H144-E169 IonicContact ND1-OE1 2.65Å; H144-K276 VanDerWaalsContact CE1-CE 3.41Å; H144-K276 WeakPolarHBondContact CE1-CE 3.46Å; H144-K276 WeakPolarHBondContact NE2-CE 3.28Å; H144-K276 WeakPolarHBondContact NE2-CG 3.42Å; H144-W278 HydrophobicContact CB-CD2 3.81Å; H144-W278 HydrophobicContact CB-CE3 3.77Å; H144-W278 HydrophobicContact CB-CH2 3.75Å; H144-W278 HydrophobicContact CB-CZ2 3.74Å; H144-W278 HydrophobicContact CB-CZ3 3.76Å; H144-W278 AromaticContact CG-CE2 3.7Å; H144-W278 AromaticContact CG-CZ2 3.85Å; H144-W278 AromaticContact CG-NE1 3.94Å; H144-W278 AromaticContact ND1-CE2 3.84Å; H144-W278 AromaticContact ND1-CZ2 3.69Å; H144-W278 AromaticContact ND1-NE1 3.98Å
145	L	92.1	Very high	75.3	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.3	-176.9	-60.3	178.5	0	0	0	110.3	V143 I167 V245 T262 V264 K276 A277 Y279	V143-L145 HydrophobicContact CG1-CD1 4.28Å; V143-L145 HydrophobicContact CG1-CG 4.2Å; V143-L145 HydrophobicContact CG2-CD2 3.64Å; V143-L145 HydrophobicContact CG2-CG 4.06Å; L145-I167 HydrophobicContact CD2-CG1 3.85Å; L145-V245 HydrophobicContact CD1-CG2 4Å; L145-V245 HydrophobicContact CD2-CG2 4.16Å; L145-T262 HydrophobicContact CD1-CG2 4.09Å; L145-V264 HydrophobicContact CD1-CG2 4.08Å; L145-K276 WeakPolarHBondContact O-CA 3.37Å; L145-A277 PolarHBondContact N-O 3.34Å; L145-A277 PolarHBondContact O-N 2.71Å; L145-Y279 HydrophobicContact CB-CD2 4.12Å; L145-Y279 HydrophobicContact CB-CE2 4.24Å; L145-Y279 HydrophobicContact CD1-CD2 3.83Å; L145-Y279 HydrophobicContact CD1-CE2 4.26Å; L145-Y279 HydrophobicContact CD1-CG 4.4Å; L145-Y279 HydrophobicContact CG-CD2 4.14Å
146	E	92.8	Very high	75.3	Confident	17 Å²	17	55.7 Å²	55.7	8%	0.079	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.6	167.3	177.6	178	163.4	0	0	108.9	R148 K166 I168 V274 H275 K276	E146-R148 IonicContact OE1-CZ 2.99Å; E146-R148 IonicContact OE1-NE 3.96Å; E146-R148 PolarHBondContact OE1-NE 3.06Å; E146-R148 IonicContact OE1-NH2 3.13Å; E146-R148 PolarHBondContact OE1-NH2 3.5Å; E146-K166 HydrophobicContact CB-CB 4.23Å; E146-K166 PolarHBondContact N-O 3.29Å; E146-K166 PolarHBondContact O-N 2.87Å; E146-I168 HydrophobicContact CB-CD1 4.01Å; E146-V274 HydrophobicContact CG-CG1 4.26Å; E146-H275 CarbonylContact C-O 3.57Å; E146-H275 WeakPolarHBondContact CA-O 3.23Å; E146-K276 HydrophobicContact CB-CB 4.42Å; E146-K276 HydrophobicContact CB-CG 4.23Å; E146-K276 HydrophobicContact CG-CB 4.34Å; E146-K276 HydrophobicContact CG-CD 4.49Å; E146-K276 HydrophobicContact CG-CG 4.5Å; E146-K276 IonicContact OE2-NZ 2.77Å
147	M	90.3	Very high	75.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.7	-175.7	-62.9	175.7	59.6	0	0	109.6	L163 L164 V165 I243 V264 L269 H275	M147-L163 HydrophobicContact CE-CD1 4.31Å; M147-L164 CarbonylContact C-O 3.3Å; M147-L164 VanDerWaalsContact CA-O 3.27Å; M147-L164 WeakPolarHBondContact CA-O 3.46Å; M147-V165 HydrophobicContact CG-CG1 4.37Å; M147-V165 HydrophobicContact CG-CG2 4.49Å; M147-I243 HydrophobicContact CE-CB 4.19Å; M147-I243 HydrophobicContact CE-CG1 3.64Å; M147-V264 HydrophobicContact CE-CG1 4.18Å; M147-V264 HydrophobicContact SD-CB 4.06Å; M147-V264 HydrophobicContact SD-CG1 3.63Å; M147-L269 HydrophobicContact CB-CD1 4.1Å; M147-L269 HydrophobicContact CB-CD2 3.94Å; M147-L269 HydrophobicContact CB-CG 4.45Å; M147-L269 HydrophobicContact CE-CD1 4.15Å; M147-L269 WeakPolarHBondContact O-CD2 3.45Å; M147-H275 PolarHBondContact N-O 3.18Å; M147-H275 PolarHBondContact O-N 2.75Å
148	R	88.4	Confident	75.3	Confident	99 Å²	99	55.1 Å²	55.1	37%	0.374	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	137.1	177.7	-54.6	-172.9	-179.2	-165.1	-3.3	110.3	E146 L164 V274	E146-R148 IonicContact OE1-CZ 2.99Å; E146-R148 IonicContact OE1-NE 3.96Å; E146-R148 PolarHBondContact OE1-NE 3.06Å; E146-R148 IonicContact OE1-NH2 3.13Å; E146-R148 PolarHBondContact OE1-NH2 3.5Å; R148-L164 HydrophobicContact CB-CB 4.25Å; R148-L164 PolarHBondContact N-O 2.96Å; R148-L164 PolarHBondContact O-N 3.15Å; R148-V274 HydrophobicContact CG-CB 4.17Å; R148-V274 HydrophobicContact CG-CG1 3.87Å; R148-V274 HydrophobicContact CG-CG2 3.83Å
149	L	84.4	Confident	75.1	Confident	49 Å²	49	57.1 Å²	57.1	26%	0.257	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	119.2	171.7	-165.8	71.6	0	0	0	108.6	Q161 L163 V219 L269	L149-Q161 HydrophobicContact CD1-CB 4.2Å; L149-L163 HydrophobicContact CD1-CB 4.39Å; L149-V219 HydrophobicContact CD1-CG2 3.97Å; L149-L269 HydrophobicContact CB-CD1 4.35Å
150	N	80.4	Confident	75	Confident	70 Å²	70	56.3 Å²	56.3	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.7	178.1	-67.2	-9.2	0	0	0	109.8	Q161 H162	N150-Q161 WeakPolarHBondContact O-CA 3.02Å; N150-H162 PolarHBondContact N-O 2.88Å; N150-H162 PolarHBondContact O-N 2.93Å
151	E	72.3	Confident	75.1	Confident	149 Å²	149	57.9 Å²	57.9	70%	0.696	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	129.5	167.1	-66.8	177.5	177.7	0	0	109	T159	E151-T159 HydrophobicContact CB-CG2 4.13Å; E151-T159 HydrophobicContact CG-CG2 4.36Å
152	V	67.7	Low	75.3	Confident	54 Å²	54	60.4 Å²	60.4	33%	0.327	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130.5	-179.4	-174.1	0	0	0	0	108	T154 G160 H162	V152-T154 PolarHBondContact O-N 3.3Å; V152-G160 PolarHBondContact N-O 3.22Å; V152-G160 WeakPolarHBondContact O-CA 3.29Å; V152-G160 PolarHBondContact O-N 2.8Å; V152-G160 VanDerWaalsContact O-O 3.12Å; V152-H162 HydrophobicContact CG2-CB 4.15Å
153	I	65	Low	75.3	Confident	134 Å²	134	59.4 Å²	59.4	69%	0.687	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	117.7	173.4	-57.2	171.5	0	0	0	106.8
154	T	62	Low	75.2	Confident	34 Å²	34	60.6 Å²	60.6	21%	0.209	33%	0.326	C	S	.	.			trans	-70.2	161.3	176.8	70.8	0	0	0	0	110.5	V152 H156 G157 S158	V152-T154 PolarHBondContact O-N 3.3Å; T154-H156 PolarHBondContact O-N 3.09Å; T154-H156 PolarHBondContact OG1-N 3.01Å; T154-G157 PolarHBondContact O-N 2.97Å; T154-S158 PolarHBondContact N-O 3.15Å; T154-S158 PolarHBondContact OG1-N 3.44Å; T154-S158 PolarHBondContact OG1-O 2.89Å; T154-S158 PolarHBondContact OG1-OG 3.09Å
155	D	56.6	Low	75.2	Confident	166 Å²	166	59.6 Å²	59.6	89%	0.888	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-13	177.2	-60.4	-23.5	0	0	0	113.6
156	H	58.5	Low	75.3	Confident	154 Å²	154	61.5 Å²	61.5	71%	0.713	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	6.2	177.7	-56.7	-47.8	0	0	0	113.8	T154 S158	T154-H156 PolarHBondContact O-N 3.09Å; T154-H156 PolarHBondContact OG1-N 3.01Å; H156-S158 VanDerWaalsContact C-N 3.32Å; H156-S158 PolarHBondContact O-N 3.11Å
157	G	56.9	Low	75.3	Confident	61 Å²	61	60.7 Å²	60.7	63%	0.629	33%	0.325	S	S	*	.	S	Bend	trans	77.3	10.8	178.9	0	0	0	0	0	114.8	T154	T154-G157 PolarHBondContact O-N 2.97Å
158	S	60	Low	75.4	Confident	44 Å²	44	61.2 Å²	61.2	31%	0.308	33%	0.328	S	S	.	.			trans	-90.8	145.7	172.1	61.6	0	0	0	0	111.3	T154 H156 G160 S222	T154-S158 PolarHBondContact N-O 3.15Å; T154-S158 PolarHBondContact OG1-N 3.44Å; T154-S158 PolarHBondContact OG1-O 2.89Å; T154-S158 PolarHBondContact OG1-OG 3.09Å; H156-S158 VanDerWaalsContact C-N 3.32Å; H156-S158 PolarHBondContact O-N 3.11Å; S158-G160 PolarHBondContact O-N 2.79Å; S158-S222 PolarHBondContact OG-OG 3.3Å
159	T	60.3	Low	75.6	Confident	98 Å²	98	58.5 Å²	58.5	60%	0.601	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	110.3	172.9	-46.6	0	0	0	0	109.2	E151	E151-T159 HydrophobicContact CB-CG2 4.13Å; E151-T159 HydrophobicContact CG-CG2 4.36Å
160	G	65.8	Low	75.8	Confident	2 Å²	2	56.1 Å²	56.1	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	152.9	171.2	0	0	0	0	0	111.5	V152 S158 T220	V152-G160 PolarHBondContact N-O 3.22Å; V152-G160 WeakPolarHBondContact O-CA 3.29Å; V152-G160 PolarHBondContact O-N 2.8Å; V152-G160 VanDerWaalsContact O-O 3.12Å; S158-G160 PolarHBondContact O-N 2.79Å; G160-T220 WeakPolarHBondContact CA-OG1 3.16Å
161	Q	74.7	Confident	76	Confident	41 Å²	41	55.6 Å²	55.6	19%	0.192	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.6	174.2	-70.1	-178.4	-10.9	0	0	110.7	L149 N150 V219 T220	L149-Q161 HydrophobicContact CD1-CB 4.2Å; N150-Q161 WeakPolarHBondContact O-CA 3.02Å; Q161-V219 HydrophobicContact CB-CB 4.07Å; Q161-V219 WeakPolarHBondContact O-CB 3.49Å; Q161-V219 PolarHBondContact O-N 3.15Å; Q161-T220 PolarHBondContact N-OG1 2.84Å
162	H	82.1	Confident	76.1	Confident	53 Å²	53	52.7 Å²	52.7	25%	0.245	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.3	173.8	-71	-178.2	0	0	0	109.9	N150 V152 F217	N150-H162 PolarHBondContact N-O 2.88Å; N150-H162 PolarHBondContact O-N 2.93Å; V152-H162 HydrophobicContact CG2-CB 4.15Å; H162-F217 CarbonylContact C-O 3.58Å; H162-F217 WeakPolarHBondContact CA-O 3.25Å
163	L	86.3	Confident	76.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.5	172.9	177.3	59.7	0	0	0	109.3	M147 L149 V165 L189 F217 V219 I243 V266 L269	M147-L163 HydrophobicContact CE-CD1 4.31Å; L149-L163 HydrophobicContact CD1-CB 4.39Å; L163-V165 HydrophobicContact CD1-CG2 4.44Å; L163-V165 HydrophobicContact CD2-CG2 4.24Å; L163-V165 HydrophobicContact CG-CG2 3.91Å; L163-L189 HydrophobicContact CD2-CD1 4.13Å; L163-F217 PolarHBondContact N-O 3.23Å; L163-F217 PolarHBondContact O-N 3.14Å; L163-V219 HydrophobicContact CB-CG2 3.54Å; L163-I243 HydrophobicContact CD2-CD1 3.6Å; L163-I243 HydrophobicContact CD2-CG1 3.76Å; L163-V266 HydrophobicContact CD2-CG1 4.19Å; L163-V266 HydrophobicContact CD2-CG2 3.79Å; L163-L269 HydrophobicContact CD1-CD1 3.35Å
164	L	90.6	Very high	77	Confident	26 Å²	26	44.1 Å²	44.1	14%	0.136	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.5	170.2	-176.3	158.5	0	0	0	108.5	M147 R148 K166 T214 F215 F216	M147-L164 CarbonylContact C-O 3.3Å; M147-L164 VanDerWaalsContact CA-O 3.27Å; M147-L164 WeakPolarHBondContact CA-O 3.46Å; R148-L164 HydrophobicContact CB-CB 4.25Å; R148-L164 PolarHBondContact N-O 2.96Å; R148-L164 PolarHBondContact O-N 3.15Å; L164-K166 HydrophobicContact CD2-CB 4.17Å; L164-T214 HydrophobicContact CD1-CG2 3.84Å; L164-T214 HydrophobicContact CD2-CG2 3.72Å; L164-T214 HydrophobicContact CG-CG2 3.5Å; L164-F215 WeakPolarHBondContact CA-O 3.38Å; L164-F216 HydrophobicContact CD1-CE1 3.84Å; L164-F216 HydrophobicContact CD1-CZ 4.34Å; L164-F216 HydrophobicContact CG-CE1 4.23Å
165	V	92.3	Very high	77.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	112.7	172.4	-174	0	0	0	0	108.5	M147 L163 V187 F215 F217 I243	M147-V165 HydrophobicContact CG-CG1 4.37Å; M147-V165 HydrophobicContact CG-CG2 4.49Å; L163-V165 HydrophobicContact CD1-CG2 4.44Å; L163-V165 HydrophobicContact CD2-CG2 4.24Å; L163-V165 HydrophobicContact CG-CG2 3.91Å; V165-V187 HydrophobicContact CB-CG1 4.26Å; V165-V187 HydrophobicContact CG1-CG1 3.94Å; V165-F215 PolarHBondContact N-O 3.36Å; V165-F215 PolarHBondContact O-N 3.34Å; V165-F217 HydrophobicContact CB-CE2 4.39Å; V165-F217 HydrophobicContact CG2-CD2 4.16Å; V165-F217 HydrophobicContact CG2-CE2 4.2Å; V165-I243 HydrophobicContact CG1-CG2 4.28Å; V165-I243 HydrophobicContact CG2-CD1 3.73Å; V165-I243 HydrophobicContact CG2-CG1 3.92Å
166	K	93.6	Very high	77.6	Confident	41 Å²	41	38.8 Å²	38.8	18%	0.178	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.3	174.4	-177.1	178.4	-177.6	-177.7	0	109.4	E146 L164 I168 E212 E213	E146-K166 HydrophobicContact CB-CB 4.23Å; E146-K166 PolarHBondContact N-O 3.29Å; E146-K166 PolarHBondContact O-N 2.87Å; L164-K166 HydrophobicContact CD2-CB 4.17Å; K166-I168 HydrophobicContact CD-CG1 4.21Å; K166-I168 HydrophobicContact CG-CG1 4.11Å; K166-E212 IonicContact NZ-OE1 3.4Å; K166-E212 PolarHBondContact NZ-OE1 2.99Å; K166-E213 WeakPolarHBondContact CA-O 3.48Å
167	I	94.1	Very high	77.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	112.3	165.3	-61.7	-172.6	0	0	0	107.2	V143 L145 A185 V187 T200 F211 E212 E213 F215 V245	V143-I167 HydrophobicContact CG2-CG2 4.32Å; L145-I167 HydrophobicContact CD2-CG1 3.85Å; I167-A185 HydrophobicContact CD1-CB 3.38Å; I167-V187 HydrophobicContact CD1-CG2 3.18Å; I167-V187 HydrophobicContact CG1-CG2 3.82Å; I167-T200 HydrophobicContact CD1-CG2 4.13Å; I167-F211 HydrophobicContact CG2-CB 4.12Å; I167-F211 HydrophobicContact CG2-CD2 3.66Å; I167-F211 HydrophobicContact CG2-CE2 4.44Å; I167-F211 HydrophobicContact CG2-CG 4.16Å; I167-E212 WeakPolarHBondContact O-CA 3.35Å; I167-E212 PolarHBondContact O-N 2.9Å; I167-E212 VanDerWaalsContact O-N 3.14Å; I167-E213 PolarHBondContact N-O 3.42Å; I167-E213 PolarHBondContact O-N 2.86Å; I167-F215 HydrophobicContact CD1-CE2 4.32Å; I167-F215 HydrophobicContact CG1-CE2 4.39Å; I167-V245 HydrophobicContact CD1-CG1 3.87Å
168	I	91.9	Very high	77.5	Confident	10 Å²	10	37.1 Å²	37.1	5%	0.051	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-64.1	-178.7	-58.6	170.6	0	0	0	108.8	H144 E146 K166 Y210 F211 E212 K276	H144-I168 HydrophobicContact CB-CB 4.25Å; H144-I168 PolarHBondContact O-N 3.12Å; H144-I168 VanDerWaalsContact O-N 3.08Å; E146-I168 HydrophobicContact CB-CD1 4.01Å; K166-I168 HydrophobicContact CD-CG1 4.21Å; K166-I168 HydrophobicContact CG-CG1 4.11Å; I168-Y210 HydrophobicContact CG2-CE2 4.06Å; I168-F211 PolarHBondContact O-N 2.86Å; I168-E212 PolarHBondContact O-N 2.72Å; I168-K276 HydrophobicContact CD1-CD 4.46Å
169	E	91.8	Very high	77.6	Confident	42 Å²	42	41.9 Å²	41.9	20%	0.196	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	162.8	-174.1	61.5	179.3	149.9	0	0	111.5	H144 K171 P209 Y210 W278	H144-E169 HydrophobicContact CB-CG 3.88Å; H144-E169 PolarHBondContact N-O 3.3Å; H144-E169 IonicContact ND1-OE1 2.65Å; E169-K171 WeakPolarHBondContact OE2-CE 3.34Å; E169-P209 CarbonylContact C-O 3.58Å; E169-P209 VanDerWaalsContact CA-O 3.29Å; E169-P209 WeakPolarHBondContact CA-O 3.49Å; E169-Y210 HydrophobicContact CB-CD2 3.72Å; E169-Y210 HydrophobicContact CB-CE2 4.28Å; E169-W278 HydrophobicContact CG-CH2 3.55Å; E169-W278 HydrophobicContact CG-CZ2 4.08Å; E169-W278 HydrophobicContact CG-CZ3 4.37Å; E169-W278 WeakPolarHBondContact OE1-CZ2 3.42Å
170	C	89.6	Confident	78	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	152.4	165.3	-51.6	0	0	0	0	110	K142 L173 N208 P209 L247	K142-C170 CarbonylContact O-C 3.46Å; K142-C170 WeakPolarHBondContact O-CA 3.38Å; K142-C170 WeakPolarHBondContact O-CB 3.27Å; C170-L173 HydrophobicContact CB-CD1 4.04Å; C170-L173 HydrophobicContact CB-CD2 4.11Å; C170-L173 HydrophobicContact CB-CG 4.12Å; C170-N208 CarbonylContact O-C 3.55Å; C170-N208 WeakPolarHBondContact O-CA 3.2Å; C170-P209 HydrophobicContact CB-CG 3.76Å; C170-P209 PolarHBondContact N-O 2.86Å; C170-P209 WeakPolarHBondContact O-CD 3.4Å; C170-L247 HydrophobicContact CB-CD1 4.31Å
171	K	83.2	Confident	78.5	Confident	58 Å²	58	39.1 Å²	39.1	25%	0.252	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	149.5	175.6	-71.6	-174.1	178.1	176.5	0	111.3	G141 K142 E169 L173 N208 W278 L826	G141-K171 VanDerWaalsContact CA-O 3.25Å; G141-K171 WeakPolarHBondContact CA-O 3.5Å; K142-K171 PolarHBondContact N-O 2.81Å; K142-K171 PolarHBondContact O-N 3.19Å; E169-K171 WeakPolarHBondContact OE2-CE 3.34Å; K171-L173 VanDerWaalsContact C-N 3.33Å; K171-L173 PolarHBondContact O-N 3.48Å; K171-N208 VanDerWaalsContact CA-OD1 3.23Å; K171-N208 WeakPolarHBondContact CA-OD1 3.35Å; K171-W278 HydrophobicContact CB-CH2 4.42Å; K171-W278 HydrophobicContact CB-CZ3 4.19Å; K171-W278 HydrophobicContact CD-CH2 3.67Å; K171-W278 HydrophobicContact CD-CZ2 4.41Å; K171-W278 HydrophobicContact CD-CZ3 4.24Å; K171-W278 HydrophobicContact CG-CH2 3.81Å; K171-W278 HydrophobicContact CG-CZ3 4.07Å; K171-L826 HydrophobicContact CD-CD1 3.88Å; K171-L826 HydrophobicContact CD-CD2 4.15Å
172	E	75.3	Confident	79.1	Confident	88 Å²	88	38.4 Å²	38.4	41%	0.411	21%	0.213	S	C	.	.	S	Bend	trans	60.1	35.5	172.5	-58.7	168.8	-174	0	0	114.3	Q140 G141 S207 N208	Q140-E172 WeakPolarHBondContact CG-O 3.47Å; G141-E172 WeakPolarHBondContact CA-O 3.5Å; E172-S207 PolarHBondContact N-O 2.82Å; E172-N208 PolarHBondContact N-OD1 3.18Å
173	L	79.8	Confident	79.5	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-64.4	150.1	173.2	-60.3	-177.7	0	0	0	111.2	C170 K171 P183 S207 P209 L247 L259 L281	C170-L173 HydrophobicContact CB-CD1 4.04Å; C170-L173 HydrophobicContact CB-CD2 4.11Å; C170-L173 HydrophobicContact CB-CG 4.12Å; K171-L173 VanDerWaalsContact C-N 3.33Å; K171-L173 PolarHBondContact O-N 3.48Å; L173-P183 HydrophobicContact CD1-CB 3.69Å; L173-P183 HydrophobicContact CD1-CG 4.02Å; L173-S207 WeakPolarHBondContact CB-O 3.27Å; L173-S207 WeakPolarHBondContact CG-O 3.27Å; L173-S207 PolarHBondContact N-O 2.62Å; L173-S207 WeakPolarHBondContact O-CB 3.42Å; L173-P209 HydrophobicContact CD1-CG 3.69Å; L173-L247 HydrophobicContact CD1-CD1 4.38Å; L173-L247 HydrophobicContact CD2-CD1 3.61Å; L173-L259 HydrophobicContact CD1-CD1 4.3Å; L173-L281 HydrophobicContact CD2-CD1 3.54Å
174	P	72.1	Confident	79.8	Confident	7 Å²	7	37.5 Å²	37.5	5%	0.045	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-67.6	153.5	-173.7	28.9	-35.6	0	0	0	111.7	Q140 L259	Q140-P174 HydrophobicContact CB-CB 4.38Å; Q140-P174 WeakPolarHBondContact O-CD 2.99Å; P174-L259 HydrophobicContact CG-CD2 3.68Å
175	L	65.9	Low	79.9	Confident	43 Å²	43	36.2 Å²	36.2	23%	0.225	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-85.3	133.6	172.8	-63.5	-178.6	0	0	0	109.1	Q179 K660	L175-Q179 CarbonylContact C-O 3.58Å; L175-Q179 WeakPolarHBondContact CA-O 3.45Å; L175-K660 HydrophobicContact CD1-CD 3.69Å; L175-K660 VanDerWaalsContact CD1-CE 3.42Å; L175-K660 HydrophobicContact CD1-CG 4.04Å
176	I	64.9	Low	79.9	Confident	45 Å²	45	36.7 Å²	36.7	23%	0.231	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-97.8	117.9	175.5	-68.2	171.6	0	0	0	108.2	G178 Q179 C181 N249 A257 L259	I176-G178 PolarHBondContact O-N 3.08Å; I176-Q179 PolarHBondContact N-O 2.83Å; I176-Q179 PolarHBondContact O-N 3.44Å; I176-C181 HydrophobicContact CD1-CB 4.32Å; I176-N249 HydrophobicContact CD1-CB 3.27Å; I176-N249 WeakPolarHBondContact CD1-ND2 3.23Å; I176-A257 HydrophobicContact CD1-CB 3.91Å; I176-L259 HydrophobicContact CD1-CD2 3.94Å
177	S	57.8	Low	79.9	Confident	119 Å²	119	34.7 Å²	34.7	83%	0.832	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	35.5	-175.7	-62.2	0	0	0	0	114	Q179	S177-Q179 VanDerWaalsContact C-N 3.29Å; S177-Q179 PolarHBondContact O-N 2.85Å
178	G	54.5	Low	79.7	Confident	60 Å²	60	34.9 Å²	34.9	62%	0.619	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	16	180	0	0	0	0	0	114.7	I176	I176-G178 PolarHBondContact O-N 3.08Å
179	Q	63	Low	79.6	Confident	144 Å²	144	34.4 Å²	34.4	67%	0.673	19%	0.194	S	C	*	.	B	Isolated β-bridge	trans	-121.6	156.4	173.7	-61.6	-173	9.9	0	0	110.9	L175 I176 S177	L175-Q179 CarbonylContact C-O 3.58Å; L175-Q179 WeakPolarHBondContact CA-O 3.45Å; I176-Q179 PolarHBondContact N-O 2.83Å; I176-Q179 PolarHBondContact O-N 3.44Å; S177-Q179 VanDerWaalsContact C-N 3.29Å; S177-Q179 PolarHBondContact O-N 2.85Å
180	N	68.2	Low	79.4	Confident	40 Å²	40	34 Å²	34	21%	0.214	19%	0.194	C	C	.	.			trans	-62.2	142.1	174.8	-63.5	24.6	0	0	0	110.2	K205	N180-K205 HydrophobicContact CB-CB 4.43Å; N180-K205 WeakPolarHBondContact CB-O 3.49Å; N180-K205 PolarHBondContact ND2-O 3.36Å
181	C	77.1	Confident	79	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.014	20%	0.201	C	C	.	.			trans	-76.8	165.4	177.3	51.2	0	0	0	0	112.6	I176 P183 K205 T206 N249	I176-C181 HydrophobicContact CD1-CB 4.32Å; C181-P183 WeakPolarHBondContact O-CD 3.33Å; C181-K205 CarbonylContact O-C 3.52Å; C181-K205 VanDerWaalsContact O-CA 3.28Å; C181-K205 WeakPolarHBondContact O-CA 3.31Å; C181-K205 PolarHBondContact O-N 3.11Å; C181-K205 VanDerWaalsContact O-N 3.1Å; C181-T206 PolarHBondContact O-N 2.84Å; C181-T206 PolarHBondContact SG-O 3.46Å; C181-T206 VanDerWaalsContact SG-O 3.34Å; C181-N249 WeakPolarHBondContact CA-OD1 3.14Å; C181-N249 HydrophobicContact CB-CB 4.26Å; C181-N249 VanDerWaalsContact CB-OD1 3.22Å; C181-N249 WeakPolarHBondContact CB-OD1 3.34Å
182	D	87.3	Confident	78.6	Confident	26 Å²	26	36.4 Å²	36.4	14%	0.139	22%	0.219	C	C	.	.			trans	-105	71.1	167.5	-70.9	-16.2	0	0	0	109.2	V202 K203 K204 K205 N249 N250	D182-V202 HydrophobicContact CB-CG1 4.01Å; D182-K203 CarbonylContact C-O 3.59Å; D182-K203 WeakPolarHBondContact CA-O 3.35Å; D182-K204 WeakPolarHBondContact OD1-CA 3.17Å; D182-K205 PolarHBondContact OD1-N 2.81Å; D182-N249 PolarHBondContact N-OD1 2.88Å; D182-N250 HydrophobicContact CB-CB 4.4Å; D182-N250 PolarHBondContact O-N 3.33Å
183	P	89.4	Confident	78.2	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	146.6	-168.3	30.5	-39.4	0	0	0	114.3	L173 C181 K203 T206 P209 W248 L259	L173-P183 HydrophobicContact CD1-CB 3.69Å; L173-P183 HydrophobicContact CD1-CG 4.02Å; C181-P183 WeakPolarHBondContact O-CD 3.33Å; P183-K203 WeakPolarHBondContact CD-O 3.34Å; P183-K203 HydrophobicContact CG-CB 4.47Å; P183-K203 VanDerWaalsContact N-O 3.16Å; P183-K203 PolarHBondContact O-N 3.13Å; P183-T206 VanDerWaalsContact CD-O 3.31Å; P183-T206 WeakPolarHBondContact CD-O 3.44Å; P183-T206 HydrophobicContact CG-CG2 4.28Å; P183-T206 WeakPolarHBondContact CG-O 3.42Å; P183-P209 HydrophobicContact CB-CG 4.13Å; P183-P209 HydrophobicContact CG-CB 3.66Å; P183-P209 HydrophobicContact CG-CG 3.55Å; P183-W248 CarbonylContact C-O 3.54Å; P183-W248 VanDerWaalsContact CA-O 3.23Å; P183-W248 WeakPolarHBondContact CA-O 3.35Å; P183-L259 HydrophobicContact CB-CD1 3.99Å
184	Y	92.8	Very high	77.9	Confident	34 Å²	34	37.6 Å²	37.6	13%	0.133	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152.1	161.6	72.5	-85.7	0	0	0	110.7	T186 V202 W248 N250 D256	Y184-T186 HydrophobicContact CD2-CG2 4.24Å; Y184-T186 HydrophobicContact CE2-CG2 3.81Å; Y184-V202 HydrophobicContact CD1-CG2 4.15Å; Y184-V202 HydrophobicContact CG-CG2 4.33Å; Y184-W248 HydrophobicContact CD1-CB 3.92Å; Y184-W248 HydrophobicContact CD2-CB 4.36Å; Y184-W248 HydrophobicContact CE1-CB 3.41Å; Y184-W248 VanDerWaalsContact CE1-CB 3.41Å; Y184-W248 HydrophobicContact CE1-CG 4.35Å; Y184-W248 HydrophobicContact CE2-CB 3.89Å; Y184-W248 AromaticContact CE2-CD1 3.89Å; Y184-W248 HydrophobicContact CE2-CG 4.07Å; Y184-W248 HydrophobicContact CG-CB 4.38Å; Y184-W248 AromaticContact CZ-CG 3.84Å; Y184-W248 PolarHBondContact N-O 3.21Å; Y184-W248 PolarHBondContact O-N 2.63Å; Y184-N250 HydrophobicContact CD1-CB 4.03Å; Y184-N250 HydrophobicContact CE1-CB 4.13Å; Y184-D256 HydrophobicContact CE1-CB 4.5Å; Y184-D256 VanDerWaalsContact CE1-OD2 3.27Å; Y184-D256 WeakPolarHBondContact CE1-OD2 3.48Å; Y184-D256 VanDerWaalsContact CZ-OD2 3.31Å; Y184-D256 PolarHBondContact OH-OD2 2.87Å
185	A	93	Very high	78.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	141.4	174.4	0	0	0	0	0	112.2	I167 K199 T200 V245 D246 L247	I167-A185 HydrophobicContact CD1-CB 3.38Å; A185-K199 WeakPolarHBondContact O-CA 3.4Å; A185-T200 HydrophobicContact CB-CG2 3.96Å; A185-T200 PolarHBondContact N-OG1 3.31Å; A185-T200 PolarHBondContact O-N 3.45Å; A185-T200 PolarHBondContact O-OG1 3.31Å; A185-V245 HydrophobicContact CB-CG1 4.34Å; A185-D246 CarbonylContact C-O 3.55Å; A185-D246 WeakPolarHBondContact CA-O 3.17Å; A185-L247 HydrophobicContact CB-CD2 3.46Å; A185-L247 VanDerWaalsContact CB-CD2 3.46Å
186	T	92.9	Very high	79.1	Confident	9 Å²	9	42 Å²	42	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.9	163	57.4	0	0	0	0	109.8	Y184 K198 K199 V245 D246 W248	Y184-T186 HydrophobicContact CD2-CG2 4.24Å; Y184-T186 HydrophobicContact CE2-CG2 3.81Å; T186-K198 CarbonylContact C-O 3.56Å; T186-K198 VanDerWaalsContact CA-O 3.26Å; T186-K198 WeakPolarHBondContact CA-O 3.15Å; T186-K199 HydrophobicContact CG2-CB 4.12Å; T186-V245 WeakPolarHBondContact O-CA 3.45Å; T186-D246 PolarHBondContact N-O 3.04Å; T186-D246 PolarHBondContact O-N 2.8Å; T186-D246 WeakPolarHBondContact OG1-CB 3.13Å; T186-D246 PolarHBondContact OG1-O 3.01Å; T186-W248 PolarHBondContact OG1-NE1 2.98Å
187	V	93.1	Very high	80.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122	176.8	-173.5	0	0	0	0	108.5	V165 I167 Q197 K198 F215 F217 I243 V245	V165-V187 HydrophobicContact CB-CG1 4.26Å; V165-V187 HydrophobicContact CG1-CG1 3.94Å; I167-V187 HydrophobicContact CD1-CG2 3.18Å; I167-V187 HydrophobicContact CG1-CG2 3.82Å; V187-Q197 CarbonylContact O-C 3.53Å; V187-Q197 WeakPolarHBondContact O-CA 3.3Å; V187-K198 PolarHBondContact N-O 3.39Å; V187-K198 PolarHBondContact O-N 2.86Å; V187-F215 HydrophobicContact CB-CD2 4.1Å; V187-F215 HydrophobicContact CB-CE2 4.46Å; V187-F215 HydrophobicContact CG2-CD2 3.64Å; V187-F215 HydrophobicContact CG2-CE2 3.7Å; V187-F217 HydrophobicContact CB-CE2 4.44Å; V187-F217 HydrophobicContact CB-CZ 4.15Å; V187-F217 HydrophobicContact CG1-CE2 3.67Å; V187-F217 HydrophobicContact CG1-CZ 3.76Å; V187-F217 WeakPolarHBondContact O-CZ 3.45Å; V187-I243 HydrophobicContact CG1-CG2 4.17Å; V187-V245 HydrophobicContact CG1-CG2 4.44Å; V187-V245 HydrophobicContact CG2-CG2 4.37Å
188	S	91.2	Very high	81.9	Confident	4 Å²	4	44.1 Å²	44.1	3%	0.028	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.5	179.3	-54.7	0	0	0	0	110.9	D196 Q197 I243 R244	S188-D196 CarbonylContact C-O 3.6Å; S188-D196 WeakPolarHBondContact CA-O 3.33Å; S188-Q197 WeakPolarHBondContact OG-CG 3.29Å; S188-Q197 PolarHBondContact OG-NE2 3.49Å; S188-I243 WeakPolarHBondContact O-CA 3.46Å; S188-R244 PolarHBondContact N-O 3.5Å; S188-R244 PolarHBondContact O-N 3.06Å
189	L	89	Confident	83.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	111.9	164.5	180	56.2	0	0	0	108.5	L163 S195 D196 F217 L241 I243 V266	L163-L189 HydrophobicContact CD2-CD1 4.13Å; L189-S195 WeakPolarHBondContact O-CA 3.4Å; L189-D196 PolarHBondContact N-O 3.46Å; L189-D196 PolarHBondContact O-N 3.45Å; L189-F217 HydrophobicContact CB-CB 4.22Å; L189-F217 HydrophobicContact CB-CD1 3.77Å; L189-F217 HydrophobicContact CB-CE1 4.26Å; L189-F217 HydrophobicContact CB-CG 3.94Å; L189-F217 HydrophobicContact CD2-CB 3.45Å; L189-F217 VanDerWaalsContact CD2-CB 3.45Å; L189-F217 HydrophobicContact CD2-CD1 4.49Å; L189-F217 HydrophobicContact CD2-CG 4.11Å; L189-F217 HydrophobicContact CG-CB 4.49Å; L189-L241 HydrophobicContact CD1-CB 4.29Å; L189-I243 HydrophobicContact CB-CD1 3.98Å; L189-I243 HydrophobicContact CD1-CD1 3.68Å; L189-I243 HydrophobicContact CD1-CG1 4.47Å; L189-I243 HydrophobicContact CG-CD1 4.36Å; L189-V266 HydrophobicContact CD1-CG2 4.07Å
190	V	86.6	Confident	85.2	Confident	32 Å²	32	42.3 Å²	42.3	19%	0.194	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.2	-174.3	-173.9	0	0	0	0	109.2	E242 R244	V190-E242 PolarHBondContact N-O 3.15Å; V190-E242 PolarHBondContact O-N 2.98Å; V190-R244 HydrophobicContact CG2-CB 4.02Å
191	G	82.4	Confident	86.2	Confident	14 Å²	14	47.8 Å²	47.8	14%	0.144	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	178.3	172.9	0	0	0	0	0	110.8	A193 R194	G191-A193 PolarHBondContact O-N 3.19Å; G191-R194 PolarHBondContact N-O 3.21Å; G191-R194 PolarHBondContact O-N 3.07Å
192	P	73.7	Confident	86.9	Confident	96 Å²	96	50.2 Å²	50.2	62%	0.623	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-35	-177.2	-25.4	34.4	0	0	0	114.3	K240	P192-K240 HydrophobicContact CG-CB 4.11Å; P192-K240 HydrophobicContact CG-CD 4.2Å
193	A	67.5	Low	86.9	Confident	89 Å²	89	52.1 Å²	52.1	74%	0.736	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	11	-178.9	0	0	0	0	0	113.7	G191 E236	G191-A193 PolarHBondContact O-N 3.19Å; A193-E236 WeakPolarHBondContact CB-OE1 3.17Å; A193-E236 PolarHBondContact N-OE1 3.01Å
194	R	72.8	Confident	86.6	Confident	25 Å²	25	59.5 Å²	59.5	9%	0.094	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.7	-174.5	71.8	176.7	-169.4	-149.1	23.3	115.2	G191 V219 E236 L241	G191-R194 PolarHBondContact N-O 3.21Å; G191-R194 PolarHBondContact O-N 3.07Å; R194-V219 PolarHBondContact NH1-O 2.96Å; R194-E236 WeakPolarHBondContact CD-OE2 3.38Å; R194-E236 IonicContact CZ-OE2 3.95Å; R194-E236 IonicContact NE-OE2 3.9Å; R194-E236 PolarHBondContact NE-OE2 3.48Å; R194-E236 IonicContact NH1-OE2 3.88Å; R194-E236 PolarHBondContact NH1-OE2 2.89Å; R194-L241 VanDerWaalsContact NH2-CD2 3.25Å
195	S	79.8	Confident	86	Confident	85 Å²	85	65.4 Å²	65.4	59%	0.594	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.4	83.1	172.5	175.2	0	0	0	0	109.7	L189	L189-S195 WeakPolarHBondContact O-CA 3.4Å
196	D	83.6	Confident	85.3	Confident	59 Å²	59	67.1 Å²	67.1	32%	0.316	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.6	176.8	-65.6	-40.8	0	0	0	109.5	S188 L189 F217	S188-D196 CarbonylContact C-O 3.6Å; S188-D196 WeakPolarHBondContact CA-O 3.33Å; L189-D196 PolarHBondContact N-O 3.46Å; L189-D196 PolarHBondContact O-N 3.45Å; D196-F217 HydrophobicContact CB-CD1 4.02Å; D196-F217 HydrophobicContact CB-CE1 4.21Å; D196-F217 VanDerWaalsContact O-CE1 3.31Å; D196-F217 WeakPolarHBondContact O-CE1 3.45Å
197	Q	90.7	Very high	84.6	Confident	121 Å²	121	67 Å²	67	57%	0.565	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.8	-176.5	-176	176.9	67	0	0	112	V187 S188	V187-Q197 CarbonylContact O-C 3.53Å; V187-Q197 WeakPolarHBondContact O-CA 3.3Å; S188-Q197 WeakPolarHBondContact OG-CG 3.29Å; S188-Q197 PolarHBondContact OG-NE2 3.49Å
198	K	91.8	Very high	84.1	Confident	87 Å²	87	70.5 Å²	70.5	38%	0.378	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156.3	172	-62.2	-174.7	177.5	-172.3	0	109.6	T186 V187 F215 F216 F217	T186-K198 CarbonylContact C-O 3.56Å; T186-K198 VanDerWaalsContact CA-O 3.26Å; T186-K198 WeakPolarHBondContact CA-O 3.15Å; V187-K198 PolarHBondContact N-O 3.39Å; V187-K198 PolarHBondContact O-N 2.86Å; K198-F215 HydrophobicContact CB-CD1 3.49Å; K198-F215 VanDerWaalsContact CB-CD1 3.49Å; K198-F215 HydrophobicContact CB-CE1 3.82Å; K198-F215 HydrophobicContact CB-CG 4.19Å; K198-F215 HydrophobicContact CD-CB 4.15Å; K198-F215 HydrophobicContact CD-CD1 3.82Å; K198-F215 HydrophobicContact CD-CG 4.39Å; K198-F215 HydrophobicContact CG-CD1 4.26Å; K198-F216 WeakPolarHBondContact CE-O 3.34Å; K198-F216 PolarHBondContact NZ-O 3.49Å; K198-F217 HydrophobicContact CB-CZ 4.32Å; K198-F217 HydrophobicContact CD-CE1 4.08Å; K198-F217 HydrophobicContact CD-CZ 4.09Å; K198-F217 HydrophobicContact CG-CE1 4.03Å; K198-F217 HydrophobicContact CG-CZ 4.12Å
199	K	92.3	Very high	83.9	Confident	156 Å²	156	70.3 Å²	70.3	68%	0.678	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.4	-178.7	69.3	-178.8	-178.5	-179.8	0	112.3	A185 T186	A185-K199 WeakPolarHBondContact O-CA 3.4Å; T186-K199 HydrophobicContact CG2-CB 4.12Å
200	T	93.4	Very high	83.9	Confident	9 Å²	9	75.8 Å²	75.8	6%	0.055	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-80.2	171.7	173.5	55	0	0	0	0	111.9	I167 A185 F211 E213 F215	I167-T200 HydrophobicContact CD1-CG2 4.13Å; A185-T200 HydrophobicContact CB-CG2 3.96Å; A185-T200 PolarHBondContact N-OG1 3.31Å; A185-T200 PolarHBondContact O-N 3.45Å; A185-T200 PolarHBondContact O-OG1 3.31Å; T200-F211 HydrophobicContact CG2-CD1 4.06Å; T200-F211 HydrophobicContact CG2-CG 4.33Å; T200-E213 WeakPolarHBondContact CA-OE2 3.49Å; T200-E213 HydrophobicContact CG2-CB 4.25Å; T200-F215 HydrophobicContact CG2-CE2 3.71Å; T200-F215 HydrophobicContact CG2-CZ 3.55Å
201	K	90.9	Very high	84.1	Confident	155 Å²	155	74.7 Å²	74.7	67%	0.674	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-76	140.3	168.1	-64.4	176.9	-177.2	173.7	0	110.9	K203 F211 E213	K201-K203 PolarHBondContact O-N 2.88Å; K201-F211 WeakPolarHBondContact O-CE1 3.4Å; K201-E213 PolarHBondContact N-OE1 3.48Å; K201-E213 PolarHBondContact N-OE2 3.36Å
202	V	90.8	Very high	84.5	Confident	54 Å²	54	78.6 Å²	78.6	33%	0.327	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-63.5	125.9	174.5	-177.1	0	0	0	0	110.3	D182 Y184 N250	D182-V202 HydrophobicContact CB-CG1 4.01Å; Y184-V202 HydrophobicContact CD1-CG2 4.15Å; Y184-V202 HydrophobicContact CG-CG2 4.33Å; V202-N250 HydrophobicContact CG1-CB 3.85Å; V202-N250 HydrophobicContact CG2-CB 4.05Å
203	K	87.8	Confident	85.4	Confident	65 Å²	65	75.9 Å²	75.9	28%	0.283	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-97.5	133.4	170.4	-59.2	-68.5	168.3	150	0	108	D182 P183 K201 T206 P209 Y210 F211	D182-K203 CarbonylContact C-O 3.59Å; D182-K203 WeakPolarHBondContact CA-O 3.35Å; P183-K203 WeakPolarHBondContact CD-O 3.34Å; P183-K203 HydrophobicContact CG-CB 4.47Å; P183-K203 VanDerWaalsContact N-O 3.16Å; P183-K203 PolarHBondContact O-N 3.13Å; K201-K203 PolarHBondContact O-N 2.88Å; K203-T206 HydrophobicContact CB-CG2 3.91Å; K203-P209 HydrophobicContact CB-CB 3.91Å; K203-P209 HydrophobicContact CG-CB 3.93Å; K203-Y210 WeakPolarHBondContact CE-O 3.41Å; K203-Y210 PolarHBondContact NZ-O 3.24Å; K203-F211 HydrophobicContact CG-CD1 3.93Å; K203-F211 HydrophobicContact CG-CE1 3.71Å; K203-F211 HydrophobicContact CG-CZ 4.41Å
204	K	83	Confident	86.5	Confident	155 Å²	155	74.3 Å²	74.3	67%	0.674	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-96.9	139.8	-172.8	-65	-173.9	177.6	-177	0	112.5	D182 T206	D182-K204 WeakPolarHBondContact OD1-CA 3.17Å; K204-T206 PolarHBondContact O-N 2.81Å
205	K	79.7	Confident	87.4	Confident	159 Å²	159	74 Å²	74	69%	0.691	35%	0.354	S	S	*	.	S	Bend	trans	53.1	44.9	170.5	-59	-179.7	179.6	176.6	0	114	N180 C181 D182	N180-K205 HydrophobicContact CB-CB 4.43Å; N180-K205 WeakPolarHBondContact CB-O 3.49Å; N180-K205 PolarHBondContact ND2-O 3.36Å; C181-K205 CarbonylContact O-C 3.52Å; C181-K205 VanDerWaalsContact O-CA 3.28Å; C181-K205 WeakPolarHBondContact O-CA 3.31Å; C181-K205 PolarHBondContact O-N 3.11Å; C181-K205 VanDerWaalsContact O-N 3.1Å; D182-K205 PolarHBondContact OD1-N 2.81Å
206	T	78.1	Confident	87.8	Confident	36 Å²	36	75.2 Å²	75.2	22%	0.221	35%	0.349	C	S	.	.			trans	-140.3	131.7	178.8	-175.7	0	0	0	0	112.1	C181 P183 K203 K204 N208 P209	C181-T206 PolarHBondContact O-N 2.84Å; C181-T206 PolarHBondContact SG-O 3.46Å; C181-T206 VanDerWaalsContact SG-O 3.34Å; P183-T206 VanDerWaalsContact CD-O 3.31Å; P183-T206 WeakPolarHBondContact CD-O 3.44Å; P183-T206 HydrophobicContact CG-CG2 4.28Å; P183-T206 WeakPolarHBondContact CG-O 3.42Å; K203-T206 HydrophobicContact CB-CG2 3.91Å; K204-T206 PolarHBondContact O-N 2.81Å; T206-N208 VanDerWaalsContact C-N 3.29Å; T206-N208 VanDerWaalsContact OG1-C 3.3Å; T206-N208 PolarHBondContact OG1-N 3.28Å; T206-N208 PolarHBondContact OG1-O 2.94Å; T206-P209 HydrophobicContact CG2-CB 3.94Å
207	S	78	Confident	88	Confident	7 Å²	7	72.7 Å²	72.7	5%	0.049	34%	0.335	C	S	.	.	S	Bend	trans	-84.5	-4.6	167	49.3	0	0	0	0	112.9	E172 L173	E172-S207 PolarHBondContact N-O 2.82Å; L173-S207 WeakPolarHBondContact CB-O 3.27Å; L173-S207 WeakPolarHBondContact CG-O 3.27Å; L173-S207 PolarHBondContact N-O 2.62Å; L173-S207 WeakPolarHBondContact O-CB 3.42Å
208	N	82.6	Confident	87.4	Confident	72 Å²	72	72.5 Å²	72.5	39%	0.385	34%	0.335	S	S	.	.	S	Bend	trans	-130.9	68.7	-179.9	-58.3	-80	0	0	0	109.7	C170 K171 E172 T206	C170-N208 CarbonylContact O-C 3.55Å; C170-N208 WeakPolarHBondContact O-CA 3.2Å; K171-N208 VanDerWaalsContact CA-OD1 3.23Å; K171-N208 WeakPolarHBondContact CA-OD1 3.35Å; E172-N208 PolarHBondContact N-OD1 3.18Å; T206-N208 VanDerWaalsContact C-N 3.29Å; T206-N208 VanDerWaalsContact OG1-C 3.3Å; T206-N208 PolarHBondContact OG1-N 3.28Å; T206-N208 PolarHBondContact OG1-O 2.94Å
209	P	87.1	Confident	86.5	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	32%	0.318	C	S	.	.			trans	-70.8	133.2	-177.2	29.7	-36.5	0	0	0	112	E169 C170 L173 P183 K203 T206 F211	E169-P209 CarbonylContact C-O 3.58Å; E169-P209 VanDerWaalsContact CA-O 3.29Å; E169-P209 WeakPolarHBondContact CA-O 3.49Å; C170-P209 HydrophobicContact CB-CG 3.76Å; C170-P209 PolarHBondContact N-O 2.86Å; C170-P209 WeakPolarHBondContact O-CD 3.4Å; L173-P209 HydrophobicContact CD1-CG 3.69Å; P183-P209 HydrophobicContact CB-CG 4.13Å; P183-P209 HydrophobicContact CG-CB 3.66Å; P183-P209 HydrophobicContact CG-CG 3.55Å; K203-P209 HydrophobicContact CB-CB 3.91Å; K203-P209 HydrophobicContact CG-CB 3.93Å; T206-P209 HydrophobicContact CG2-CB 3.94Å; P209-F211 HydrophobicContact CB-CD2 4.26Å; P209-F211 HydrophobicContact CB-CE1 4.3Å; P209-F211 HydrophobicContact CB-CE2 3.63Å; P209-F211 HydrophobicContact CB-CZ 3.65Å; P209-F211 HydrophobicContact CG-CD2 4.37Å; P209-F211 HydrophobicContact CG-CE2 3.48Å; P209-F211 VanDerWaalsContact CG-CE2 3.48Å; P209-F211 HydrophobicContact CG-CZ 3.75Å
210	Y	89.2	Confident	85.3	Confident	114 Å²	114	63.9 Å²	63.9	45%	0.447	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	110.1	168.2	-165.6	-99.3	0	0	0	108.9	I168 E169 K203 E212	I168-Y210 HydrophobicContact CG2-CE2 4.06Å; E169-Y210 HydrophobicContact CB-CD2 3.72Å; E169-Y210 HydrophobicContact CB-CE2 4.28Å; K203-Y210 WeakPolarHBondContact CE-O 3.41Å; K203-Y210 PolarHBondContact NZ-O 3.24Å; Y210-E212 HydrophobicContact CD1-CB 4.29Å; Y210-E212 HydrophobicContact CE1-CB 3.71Å; Y210-E212 HydrophobicContact CE1-CG 4.31Å; Y210-E212 VanDerWaalsContact CE1-OE2 3.22Å; Y210-E212 WeakPolarHBondContact CE1-OE2 3.4Å; Y210-E212 VanDerWaalsContact OH-CD 3.29Å; Y210-E212 PolarHBondContact OH-OE2 3.39Å
211	F	90.7	Very high	83.4	Confident	10 Å²	10	72.2 Å²	72.2	4%	0.044	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-58.9	-176.1	-66.6	-75.8	0	0	0	110.8	I167 I168 T200 K201 K203 P209 E213	I167-F211 HydrophobicContact CG2-CB 4.12Å; I167-F211 HydrophobicContact CG2-CD2 3.66Å; I167-F211 HydrophobicContact CG2-CE2 4.44Å; I167-F211 HydrophobicContact CG2-CG 4.16Å; I168-F211 PolarHBondContact O-N 2.86Å; T200-F211 HydrophobicContact CG2-CD1 4.06Å; T200-F211 HydrophobicContact CG2-CG 4.33Å; K201-F211 WeakPolarHBondContact O-CE1 3.4Å; K203-F211 HydrophobicContact CG-CD1 3.93Å; K203-F211 HydrophobicContact CG-CE1 3.71Å; K203-F211 HydrophobicContact CG-CZ 4.41Å; P209-F211 HydrophobicContact CB-CD2 4.26Å; P209-F211 HydrophobicContact CB-CE1 4.3Å; P209-F211 HydrophobicContact CB-CE2 3.63Å; P209-F211 HydrophobicContact CB-CZ 3.65Å; P209-F211 HydrophobicContact CG-CD2 4.37Å; P209-F211 HydrophobicContact CG-CE2 3.48Å; P209-F211 VanDerWaalsContact CG-CE2 3.48Å; P209-F211 HydrophobicContact CG-CZ 3.75Å; F211-E213 VanDerWaalsContact C-N 3.32Å; F211-E213 HydrophobicContact CB-CG 4.39Å
212	E	91.3	Very high	81.3	Confident	96 Å²	96	67 Å²	67	45%	0.449	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.4	45.2	-171.4	-150	171.7	-173	0	0	113.8	K166 I167 I168 Y210	K166-E212 IonicContact NZ-OE1 3.4Å; K166-E212 PolarHBondContact NZ-OE1 2.99Å; I167-E212 WeakPolarHBondContact O-CA 3.35Å; I167-E212 PolarHBondContact O-N 2.9Å; I167-E212 VanDerWaalsContact O-N 3.14Å; I168-E212 PolarHBondContact O-N 2.72Å; Y210-E212 HydrophobicContact CD1-CB 4.29Å; Y210-E212 HydrophobicContact CE1-CB 3.71Å; Y210-E212 HydrophobicContact CE1-CG 4.31Å; Y210-E212 VanDerWaalsContact CE1-OE2 3.22Å; Y210-E212 WeakPolarHBondContact CE1-OE2 3.4Å; Y210-E212 VanDerWaalsContact OH-CD 3.29Å; Y210-E212 PolarHBondContact OH-OE2 3.39Å
213	E	92.2	Very high	79.2	Confident	38 Å²	38	70.4 Å²	70.4	18%	0.178	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.1	-177.1	-65.2	-176	-130.8	0	0	111	K166 I167 T200 K201 F211 F215	K166-E213 WeakPolarHBondContact CA-O 3.48Å; I167-E213 PolarHBondContact N-O 3.42Å; I167-E213 PolarHBondContact O-N 2.86Å; T200-E213 WeakPolarHBondContact CA-OE2 3.49Å; T200-E213 HydrophobicContact CG2-CB 4.25Å; K201-E213 PolarHBondContact N-OE1 3.48Å; K201-E213 PolarHBondContact N-OE2 3.36Å; F211-E213 VanDerWaalsContact C-N 3.32Å; F211-E213 HydrophobicContact CB-CG 4.39Å; E213-F215 HydrophobicContact CB-CE2 4.28Å; E213-F215 HydrophobicContact CB-CZ 4.2Å
214	T	91.7	Very high	77.1	Confident	56 Å²	56	71.4 Å²	71.4	34%	0.344	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.5	-177.1	-56.5	0	0	0	0	110.8	L164 F216	L164-T214 HydrophobicContact CD1-CG2 3.84Å; L164-T214 HydrophobicContact CD2-CG2 3.72Å; L164-T214 HydrophobicContact CG-CG2 3.5Å; T214-F216 HydrophobicContact CG2-CE1 4.5Å; T214-F216 HydrophobicContact CG2-CE2 4.08Å; T214-F216 HydrophobicContact CG2-CZ 3.96Å
215	F	91.7	Very high	75.3	Confident	19 Å²	19	75 Å²	75	8%	0.083	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	142.6	177.7	-57.5	-73.4	0	0	0	110.5	L164 V165 I167 V187 K198 T200 E213 F217	L164-F215 WeakPolarHBondContact CA-O 3.38Å; V165-F215 PolarHBondContact N-O 3.36Å; V165-F215 PolarHBondContact O-N 3.34Å; I167-F215 HydrophobicContact CD1-CE2 4.32Å; I167-F215 HydrophobicContact CG1-CE2 4.39Å; V187-F215 HydrophobicContact CB-CD2 4.1Å; V187-F215 HydrophobicContact CB-CE2 4.46Å; V187-F215 HydrophobicContact CG2-CD2 3.64Å; V187-F215 HydrophobicContact CG2-CE2 3.7Å; K198-F215 HydrophobicContact CB-CD1 3.49Å; K198-F215 VanDerWaalsContact CB-CD1 3.49Å; K198-F215 HydrophobicContact CB-CE1 3.82Å; K198-F215 HydrophobicContact CB-CG 4.19Å; K198-F215 HydrophobicContact CD-CB 4.15Å; K198-F215 HydrophobicContact CD-CD1 3.82Å; K198-F215 HydrophobicContact CD-CG 4.39Å; K198-F215 HydrophobicContact CG-CD1 4.26Å; T200-F215 HydrophobicContact CG2-CE2 3.71Å; T200-F215 HydrophobicContact CG2-CZ 3.55Å; E213-F215 HydrophobicContact CB-CE2 4.28Å; E213-F215 HydrophobicContact CB-CZ 4.2Å; F215-F217 HydrophobicContact CB-CD2 4.47Å; F215-F217 HydrophobicContact CB-CE2 3.68Å; F215-F217 HydrophobicContact CB-CZ 4.14Å
216	F	88	Confident	73.5	Confident	110 Å²	110	70.5 Å²	70.5	48%	0.482	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.1	177.9	-60	-88.8	0	0	0	109.5	L164 K198 T214	L164-F216 HydrophobicContact CD1-CE1 3.84Å; L164-F216 HydrophobicContact CD1-CZ 4.34Å; L164-F216 HydrophobicContact CG-CE1 4.23Å; K198-F216 WeakPolarHBondContact CE-O 3.34Å; K198-F216 PolarHBondContact NZ-O 3.49Å; T214-F216 HydrophobicContact CG2-CE1 4.5Å; T214-F216 HydrophobicContact CG2-CE2 4.08Å; T214-F216 HydrophobicContact CG2-CZ 3.96Å
217	F	86.7	Confident	72	Confident	6 Å²	6	81.3 Å²	81.3	3%	0.026	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.8	175.3	-60.5	-87.4	0	0	0	110	H162 L163 V165 V187 L189 D196 K198 F215	H162-F217 CarbonylContact C-O 3.58Å; H162-F217 WeakPolarHBondContact CA-O 3.25Å; L163-F217 PolarHBondContact N-O 3.23Å; L163-F217 PolarHBondContact O-N 3.14Å; V165-F217 HydrophobicContact CB-CE2 4.39Å; V165-F217 HydrophobicContact CG2-CD2 4.16Å; V165-F217 HydrophobicContact CG2-CE2 4.2Å; V187-F217 HydrophobicContact CB-CE2 4.44Å; V187-F217 HydrophobicContact CB-CZ 4.15Å; V187-F217 HydrophobicContact CG1-CE2 3.67Å; V187-F217 HydrophobicContact CG1-CZ 3.76Å; V187-F217 WeakPolarHBondContact O-CZ 3.45Å; L189-F217 HydrophobicContact CB-CB 4.22Å; L189-F217 HydrophobicContact CB-CD1 3.77Å; L189-F217 HydrophobicContact CB-CE1 4.26Å; L189-F217 HydrophobicContact CB-CG 3.94Å; L189-F217 HydrophobicContact CD2-CB 3.45Å; L189-F217 VanDerWaalsContact CD2-CB 3.45Å; L189-F217 HydrophobicContact CD2-CD1 4.49Å; L189-F217 HydrophobicContact CD2-CG 4.11Å; L189-F217 HydrophobicContact CG-CB 4.49Å; D196-F217 HydrophobicContact CB-CD1 4.02Å; D196-F217 HydrophobicContact CB-CE1 4.21Å; D196-F217 VanDerWaalsContact O-CE1 3.31Å; D196-F217 WeakPolarHBondContact O-CE1 3.45Å; K198-F217 HydrophobicContact CB-CZ 4.32Å; K198-F217 HydrophobicContact CD-CE1 4.08Å; K198-F217 HydrophobicContact CD-CZ 4.09Å; K198-F217 HydrophobicContact CG-CE1 4.03Å; K198-F217 HydrophobicContact CG-CZ 4.12Å; F215-F217 HydrophobicContact CB-CD2 4.47Å; F215-F217 HydrophobicContact CB-CE2 3.68Å; F215-F217 HydrophobicContact CB-CZ 4.14Å
218	E	78.4	Confident	70.4	Confident	118 Å²	118	91 Å²	91	55%	0.551	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.9	174.4	-65	-179.5	-176.4	0	0	109
219	V	74	Confident	68.5	Low	5 Å²	5	90.2 Å²	90.2	3%	0.03	44%	0.435	C	S	.	.	S	Bend	trans	-89.2	-40.8	-177.6	-179.6	0	0	0	0	110.7	L149 Q161 L163 R194 I238 L241	L149-V219 HydrophobicContact CD1-CG2 3.97Å; Q161-V219 HydrophobicContact CB-CB 4.07Å; Q161-V219 WeakPolarHBondContact O-CB 3.49Å; Q161-V219 PolarHBondContact O-N 3.15Å; L163-V219 HydrophobicContact CB-CG2 3.54Å; R194-V219 PolarHBondContact NH1-O 2.96Å; V219-I238 HydrophobicContact CG1-CG1 4.05Å; V219-L241 HydrophobicContact CG1-CD1 3.66Å
220	T	65.4	Low	66.3	Low	57 Å²	57	99.4 Å²	99.4	35%	0.35	48%	0.477	S	S	.	.	S	Bend	trans	-108.5	115.2	178	45.4	0	0	0	0	110.2	G160 Q161 S222	G160-T220 WeakPolarHBondContact CA-OG1 3.16Å; Q161-T220 PolarHBondContact N-OG1 2.84Å; T220-S222 PolarHBondContact O-N 3.45Å
221	R	55	Low	64	Low	183 Å²	183	101.8 Å²	101.8	69%	0.691	49%	0.491	S	S	*	.			trans	-79.4	117.1	168.1	-76.4	-174.3	174.8	168.3	1.8	109.1	S223	R221-S223 PolarHBondContact O-N 3.34Å
222	S	46.6	Very low	61.7	Low	47 Å²	47	107 Å²	107	33%	0.329	53%	0.525	S	S	.	.			trans	-64.8	121.7	164.8	-74.5	0	0	0	0	108.7	S158 T220 S224	S158-S222 PolarHBondContact OG-OG 3.3Å; T220-S222 PolarHBondContact O-N 3.45Å; S222-S224 VanDerWaalsContact C-N 3.28Å; S222-S224 PolarHBondContact O-N 2.81Å; S222-S224 PolarHBondContact O-OG 3.44Å
223	S	46.1	Very low	59.4	Low	124 Å²	124	108.4 Å²	108.4	87%	0.867	54%	0.54	S	S	*	.			trans	-63.5	75.9	-177.3	49.6	0	0	0	0	112.7	R221	R221-S223 PolarHBondContact O-N 3.34Å
224	S	43.6	Very low	57.4	Low	86 Å²	86	114.6 Å²	114.6	60%	0.601	57%	0.569	S	S	*	*			trans	-97	0.2	-177.2	30.9	0	0	0	0	114.5	S222	S222-S224 VanDerWaalsContact C-N 3.28Å; S222-S224 PolarHBondContact O-N 2.81Å; S222-S224 PolarHBondContact O-OG 3.44Å
225	Y	45.9	Very low	55.5	Low	232 Å²	232	120.5 Å²	120.5	91%	0.91	59%	0.593	S	S	*	*	S	Bend	trans	-136.7	66.5	176.5	-90.3	-89.2	0	0	0	113.9
226	S	41	Very low	53.9	Low	64 Å²	64	122.3 Å²	122.3	45%	0.448	60%	0.601	S	S	.	*			trans	-172.6	86.4	135.9	67	0	0	0	0	112.1	K228 S229	S226-K228 PolarHBondContact O-N 3.45Å; S226-K228 VanDerWaalsContact O-N 3.09Å; S226-S229 VanDerWaalsContact OG-CB 3.29Å; S226-S229 WeakPolarHBondContact OG-CB 3.15Å
227	R	46	Very low	52.8	Low	263 Å²	263	121 Å²	121	99%	0.992	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	10.7	160.1	-77.1	-168.5	-161.1	163.3	6.4	113.4
228	K	46.3	Very low	51.9	Low	210 Å²	210	122.8 Å²	122.8	91%	0.913	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.2	12.9	-177.7	-74.8	-168	177.3	-177.8	0	115.4	S226	S226-K228 PolarHBondContact O-N 3.45Å; S226-K228 VanDerWaalsContact O-N 3.09Å
229	S	42.7	Very low	51.5	Low	55 Å²	55	123.6 Å²	123.6	39%	0.385	61%	0.613	S	S	.	*			trans	-100.8	124.5	170.9	-178	0	0	0	0	109.2	S226 F231	S226-S229 VanDerWaalsContact OG-CB 3.29Å; S226-S229 WeakPolarHBondContact OG-CB 3.15Å; S229-F231 PolarHBondContact O-N 2.84Å; S229-F231 PolarHBondContact OG-N 3.12Å
230	Q	39.9	Very low	51.5	Low	194 Å²	194	128.8 Å²	128.8	91%	0.907	64%	0.635	S	S	*	*			trans	-78.3	6.7	172.2	-83.9	176.9	-15	0	0	113
231	F	41.8	Very low	52.4	Low	165 Å²	165	126 Å²	126	72%	0.724	62%	0.618	S	S	*	*	S	Bend	trans	-100.4	121.6	177.2	-62	-78.7	0	0	0	110.1	S229 V233	S229-F231 PolarHBondContact O-N 2.84Å; S229-F231 PolarHBondContact OG-N 3.12Å; F231-V233 PolarHBondContact O-N 2.83Å
232	P	40.7	Very low	54	Low	119 Å²	119	120 Å²	120	77%	0.773	60%	0.597	S	S	*	*			trans	-62.8	123.3	170.1	25.1	-29.5	0	0	0	108.7	E234	P232-E234 PolarHBondContact O-N 2.81Å
233	V	44.3	Very low	56.1	Low	125 Å²	125	117.7 Å²	117.7	76%	0.758	58%	0.582	S	S	*	*			trans	-79.2	111.3	166.9	179.5	0	0	0	0	105.7	F231 E235	F231-V233 PolarHBondContact O-N 2.83Å; V233-E235 PolarHBondContact O-N 3.09Å
234	E	49.1	Very low	58.2	Low	169 Å²	169	115 Å²	115	79%	0.79	55%	0.553	S	S	*	*			trans	-58.1	129.1	175.6	-68.1	-177.7	164.5	0	0	109.6	P232 E236	P232-E234 PolarHBondContact O-N 2.81Å; E234-E236 PolarHBondContact O-N 3.32Å
235	E	53.4	Low	60.5	Low	180 Å²	180	111 Å²	111	84%	0.841	52%	0.524	S	S	*	.			trans	-60.3	122.1	166.3	-72.8	-178	161.6	0	0	107.7	V233 D237	V233-E235 PolarHBondContact O-N 3.09Å; E235-D237 PolarHBondContact O-N 3.04Å; E235-D237 VanDerWaalsContact O-N 3.1Å
236	E	56.6	Low	62.7	Low	56 Å²	56	100.6 Å²	100.6	26%	0.262	49%	0.485	S	S	.	.			trans	-64.5	115.1	179.2	-76.9	-174.1	147.5	0	0	109.7	A193 R194 E234 I238	A193-E236 WeakPolarHBondContact CB-OE1 3.17Å; A193-E236 PolarHBondContact N-OE1 3.01Å; R194-E236 WeakPolarHBondContact CD-OE2 3.38Å; R194-E236 IonicContact CZ-OE2 3.95Å; R194-E236 IonicContact NE-OE2 3.9Å; R194-E236 PolarHBondContact NE-OE2 3.48Å; R194-E236 IonicContact NH1-OE2 3.88Å; R194-E236 PolarHBondContact NH1-OE2 2.89Å; E234-E236 PolarHBondContact O-N 3.32Å; E236-I238 PolarHBondContact O-N 2.83Å
237	D	65.8	Low	65.1	Low	84 Å²	84	97.6 Å²	97.6	45%	0.449	46%	0.463	S	S	.	.			trans	-53.9	127.1	175.4	-62.6	-50.3	0	0	0	110.8	E235 E239 K240	E235-D237 PolarHBondContact O-N 3.04Å; E235-D237 VanDerWaalsContact O-N 3.1Å; D237-E239 PolarHBondContact O-N 3.11Å; D237-K240 HydrophobicContact CB-CD 4.13Å; D237-K240 HydrophobicContact CB-CG 4.26Å; D237-K240 WeakPolarHBondContact O-CB 3.31Å; D237-K240 PolarHBondContact O-N 3.37Å; D237-K240 WeakPolarHBondContact OD2-CE 3.31Å; D237-K240 IonicContact OD2-NZ 3.98Å; D237-K240 PolarHBondContact OD2-NZ 3.5Å
238	I	67.4	Low	67.1	Low	42 Å²	42	87.2 Å²	87.2	22%	0.215	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-55.5	-26.7	177.5	-63.4	170.1	0	0	0	111.8	V219 E236 K240 L241 V266	V219-I238 HydrophobicContact CG1-CG1 4.05Å; E236-I238 PolarHBondContact O-N 2.83Å; I238-K240 PolarHBondContact O-N 3.14Å; I238-L241 PolarHBondContact O-N 3.34Å; I238-V266 HydrophobicContact CG2-CB 4.42Å; I238-V266 HydrophobicContact CG2-CG1 3.87Å
239	E	68.9	Low	69.1	Low	136 Å²	136	77.8 Å²	77.8	64%	0.636	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-64.1	-24.3	176.6	-59.4	-170.4	169.4	0	0	114.2	D237	D237-E239 PolarHBondContact O-N 3.11Å
240	K	74.9	Confident	71.2	Confident	113 Å²	113	77 Å²	77	49%	0.491	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-92.9	-2	-179.3	-65.1	171.2	-178.5	153.3	0	112.9	P192 D237 I238	P192-K240 HydrophobicContact CG-CB 4.11Å; P192-K240 HydrophobicContact CG-CD 4.2Å; D237-K240 HydrophobicContact CB-CD 4.13Å; D237-K240 HydrophobicContact CB-CG 4.26Å; D237-K240 WeakPolarHBondContact O-CB 3.31Å; D237-K240 PolarHBondContact O-N 3.37Å; D237-K240 WeakPolarHBondContact OD2-CE 3.31Å; D237-K240 IonicContact OD2-NZ 3.98Å; D237-K240 PolarHBondContact OD2-NZ 3.5Å; I238-K240 PolarHBondContact O-N 3.14Å
241	L	83.9	Confident	73.1	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	35%	0.346	C	S	.	.			trans	-93.1	137	-177	-60.1	176.9	0	0	0	112	L189 R194 V219 I238 V266	L189-L241 HydrophobicContact CD1-CB 4.29Å; R194-L241 VanDerWaalsContact NH2-CD2 3.25Å; V219-L241 HydrophobicContact CG1-CD1 3.66Å; I238-L241 PolarHBondContact O-N 3.34Å; L241-V266 HydrophobicContact CB-CB 4.01Å; L241-V266 HydrophobicContact CB-CG2 3.75Å; L241-V266 WeakPolarHBondContact O-CG2 3.44Å; L241-V266 PolarHBondContact O-N 3.16Å
242	E	88.7	Confident	74.5	Confident	55 Å²	55	68.8 Å²	68.8	26%	0.257	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	139.1	177.4	-57.6	-169.9	148.2	0	0	110.9	V190 V264	V190-E242 PolarHBondContact N-O 3.15Å; V190-E242 PolarHBondContact O-N 2.98Å; E242-V264 WeakPolarHBondContact CA-O 3.28Å
243	I	90.3	Very high	75.7	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.1	164.8	-68.8	-59.8	0	0	0	108.4	M147 L163 V165 V187 S188 L189 V245 R263 V264 V266	M147-I243 HydrophobicContact CE-CB 4.19Å; M147-I243 HydrophobicContact CE-CG1 3.64Å; L163-I243 HydrophobicContact CD2-CD1 3.6Å; L163-I243 HydrophobicContact CD2-CG1 3.76Å; V165-I243 HydrophobicContact CG1-CG2 4.28Å; V165-I243 HydrophobicContact CG2-CD1 3.73Å; V165-I243 HydrophobicContact CG2-CG1 3.92Å; V187-I243 HydrophobicContact CG1-CG2 4.17Å; S188-I243 WeakPolarHBondContact O-CA 3.46Å; L189-I243 HydrophobicContact CB-CD1 3.98Å; L189-I243 HydrophobicContact CD1-CD1 3.68Å; L189-I243 HydrophobicContact CD1-CG1 4.47Å; L189-I243 HydrophobicContact CG-CD1 4.36Å; I243-V245 HydrophobicContact CG2-CG2 3.87Å; I243-R263 CarbonylContact O-C 3.6Å; I243-R263 VanDerWaalsContact O-CA 3.31Å; I243-R263 WeakPolarHBondContact O-CA 3.43Å; I243-V264 HydrophobicContact CB-CB 4.49Å; I243-V264 PolarHBondContact N-O 3.07Å; I243-V264 PolarHBondContact O-N 3.42Å; I243-V266 HydrophobicContact CG1-CG2 4.31Å
244	R	91.4	Very high	77	Confident	68 Å²	68	68.7 Å²	68.7	26%	0.257	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.5	168.7	-175.1	-178.5	-59.5	177	2.7	109	S188 V190 D246 T262 R263	S188-R244 PolarHBondContact N-O 3.5Å; S188-R244 PolarHBondContact O-N 3.06Å; V190-R244 HydrophobicContact CG2-CB 4.02Å; R244-D246 WeakPolarHBondContact CD-OD1 3.42Å; R244-D246 WeakPolarHBondContact CG-OD1 3.42Å; R244-T262 WeakPolarHBondContact CA-O 3.31Å; R244-R263 HydrophobicContact CG-CG 4.32Å
245	V	91.9	Very high	78.4	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	113.8	172.3	-178.1	0	0	0	0	108	L145 I167 A185 T186 V187 I243 E261 T262	L145-V245 HydrophobicContact CD1-CG2 4Å; L145-V245 HydrophobicContact CD2-CG2 4.16Å; I167-V245 HydrophobicContact CD1-CG1 3.87Å; A185-V245 HydrophobicContact CB-CG1 4.34Å; T186-V245 WeakPolarHBondContact O-CA 3.45Å; V187-V245 HydrophobicContact CG1-CG2 4.44Å; V187-V245 HydrophobicContact CG2-CG2 4.37Å; I243-V245 HydrophobicContact CG2-CG2 3.87Å; V245-E261 CarbonylContact O-C 3.56Å; V245-E261 VanDerWaalsContact O-CA 3.25Å; V245-E261 WeakPolarHBondContact O-CA 3.46Å; V245-T262 HydrophobicContact CB-CG2 4.02Å; V245-T262 PolarHBondContact N-O 2.76Å; V245-T262 PolarHBondContact O-N 3.05Å
246	D	91.3	Very high	79.9	Confident	15 Å²	15	62.7 Å²	62.7	8%	0.08	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132	175	-48	-53.8	0	0	0	109.4	A185 T186 R244 W248 F258 E261	A185-D246 CarbonylContact C-O 3.55Å; A185-D246 WeakPolarHBondContact CA-O 3.17Å; T186-D246 PolarHBondContact N-O 3.04Å; T186-D246 PolarHBondContact O-N 2.8Å; T186-D246 WeakPolarHBondContact OG1-CB 3.13Å; T186-D246 PolarHBondContact OG1-O 3.01Å; R244-D246 WeakPolarHBondContact CD-OD1 3.42Å; R244-D246 WeakPolarHBondContact CG-OD1 3.42Å; D246-W248 HydrophobicContact CB-CZ2 4.33Å; D246-W248 VanDerWaalsContact CB-NE1 3.35Å; D246-F258 HydrophobicContact CB-CE2 4.24Å; D246-E261 WeakPolarHBondContact OD1-CB 3.33Å
247	L	90.8	Very high	81.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.8	174.1	-73.1	176.4	0	0	0	110.8	C170 L173 A185 L259 G260 L281	C170-L247 HydrophobicContact CB-CD1 4.31Å; L173-L247 HydrophobicContact CD1-CD1 4.38Å; L173-L247 HydrophobicContact CD2-CD1 3.61Å; A185-L247 HydrophobicContact CB-CD2 3.46Å; A185-L247 VanDerWaalsContact CB-CD2 3.46Å; L247-L259 HydrophobicContact CB-CB 3.88Å; L247-L259 WeakPolarHBondContact O-CB 3.3Å; L247-L259 PolarHBondContact O-N 2.98Å; L247-G260 PolarHBondContact N-O 2.66Å; L247-G260 PolarHBondContact O-N 2.79Å; L247-L281 HydrophobicContact CD1-CD1 3.5Å; L247-L281 VanDerWaalsContact CD1-CD1 3.5Å; L247-L281 HydrophobicContact CD1-CD2 3.66Å; L247-L281 HydrophobicContact CD1-CG 4.2Å; L247-L281 HydrophobicContact CG-CD2 4.24Å
248	W	89.1	Confident	82	Confident	46 Å²	46	58.1 Å²	58.1	17%	0.174	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	147.5	-173.7	-60.1	91.7	0	0	0	110.3	P183 Y184 T186 D246 D256 A257 F258 L259	P183-W248 CarbonylContact C-O 3.54Å; P183-W248 VanDerWaalsContact CA-O 3.23Å; P183-W248 WeakPolarHBondContact CA-O 3.35Å; Y184-W248 HydrophobicContact CD1-CB 3.92Å; Y184-W248 HydrophobicContact CD2-CB 4.36Å; Y184-W248 HydrophobicContact CE1-CB 3.41Å; Y184-W248 VanDerWaalsContact CE1-CB 3.41Å; Y184-W248 HydrophobicContact CE1-CG 4.35Å; Y184-W248 HydrophobicContact CE2-CB 3.89Å; Y184-W248 AromaticContact CE2-CD1 3.89Å; Y184-W248 HydrophobicContact CE2-CG 4.07Å; Y184-W248 HydrophobicContact CG-CB 4.38Å; Y184-W248 AromaticContact CZ-CG 3.84Å; Y184-W248 PolarHBondContact N-O 3.21Å; Y184-W248 PolarHBondContact O-N 2.63Å; T186-W248 PolarHBondContact OG1-NE1 2.98Å; D246-W248 HydrophobicContact CB-CZ2 4.33Å; D246-W248 VanDerWaalsContact CB-NE1 3.35Å; W248-D256 HydrophobicContact CE3-CB 4.31Å; W248-A257 CarbonylContact C-O 3.56Å; W248-A257 WeakPolarHBondContact CA-O 3.44Å; W248-F258 HydrophobicContact CD2-CD2 4.29Å; W248-F258 HydrophobicContact CE3-CB 4.02Å; W248-F258 HydrophobicContact CE3-CD2 4.24Å; W248-F258 HydrophobicContact CH2-CB 4.22Å; W248-F258 AromaticContact CH2-CD2 3.77Å; W248-F258 HydrophobicContact CH2-CD2 3.77Å; W248-F258 HydrophobicContact CH2-CG 4.41Å; W248-F258 AromaticContact CZ2-CD2 3.82Å; W248-F258 HydrophobicContact CZ2-CD2 3.82Å; W248-F258 HydrophobicContact CZ2-CE2 4.4Å; W248-F258 HydrophobicContact CZ3-CB 3.69Å; W248-F258 AromaticContact CZ3-CD2 3.99Å; W248-F258 HydrophobicContact CZ3-CD2 3.99Å; W248-F258 HydrophobicContact CZ3-CG 4.32Å; W248-L259 VanDerWaalsContact C-CD1 3.48Å
249	N	87.9	Confident	82.7	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.059	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.1	167.5	174.3	66.2	0	0	0	109.3	I176 C181 D182 E251 D256 A257 L259	I176-N249 HydrophobicContact CD1-CB 3.27Å; I176-N249 WeakPolarHBondContact CD1-ND2 3.23Å; C181-N249 WeakPolarHBondContact CA-OD1 3.14Å; C181-N249 HydrophobicContact CB-CB 4.26Å; C181-N249 VanDerWaalsContact CB-OD1 3.22Å; C181-N249 WeakPolarHBondContact CB-OD1 3.34Å; D182-N249 PolarHBondContact N-OD1 2.88Å; N249-E251 VanDerWaalsContact ND2-CG 3.25Å; N249-E251 WeakPolarHBondContact ND2-CG 3.46Å; N249-E251 PolarHBondContact O-N 3.25Å; N249-E251 VanDerWaalsContact O-N 3.17Å; N249-D256 VanDerWaalsContact O-CA 3.26Å; N249-D256 WeakPolarHBondContact O-CA 3.48Å; N249-D256 WeakPolarHBondContact O-CB 3.16Å; N249-A257 HydrophobicContact CB-CB 4.21Å; N249-A257 PolarHBondContact N-O 2.88Å; N249-A257 PolarHBondContact O-N 3.04Å; N249-A257 VanDerWaalsContact O-N 3.13Å; N249-L259 HydrophobicContact CB-CD1 4.09Å; N249-L259 HydrophobicContact CB-CD2 4.04Å; N249-L259 HydrophobicContact CB-CG 4.15Å
250	N	87.3	Confident	83.5	Confident	39 Å²	39	49.8 Å²	49.8	21%	0.209	25%	0.254	C	S	.	.			trans	-72.6	106.3	177.7	174.1	65.9	0	0	0	110.6	D182 Y184 V202 N252 D256	D182-N250 HydrophobicContact CB-CB 4.4Å; D182-N250 PolarHBondContact O-N 3.33Å; Y184-N250 HydrophobicContact CD1-CB 4.03Å; Y184-N250 HydrophobicContact CE1-CB 4.13Å; V202-N250 HydrophobicContact CG1-CB 3.85Å; V202-N250 HydrophobicContact CG2-CB 4.05Å; N250-N252 PolarHBondContact ND2-OD1 3.32Å; N250-D256 WeakPolarHBondContact CA-OD1 3.1Å
251	E	80.5	Confident	84.2	Confident	62 Å²	62	44.8 Å²	44.8	29%	0.29	23%	0.232	S	C	.	.			trans	-97.5	96.8	175.5	-65.5	-157.5	168.3	0	0	109.3	N249 L253 A254 D256	N249-E251 VanDerWaalsContact ND2-CG 3.25Å; N249-E251 WeakPolarHBondContact ND2-CG 3.46Å; N249-E251 PolarHBondContact O-N 3.25Å; N249-E251 VanDerWaalsContact O-N 3.17Å; E251-L253 PolarHBondContact O-N 3.37Å; E251-A254 HydrophobicContact CB-CB 3.97Å; E251-A254 PolarHBondContact O-N 3.23Å; E251-A254 VanDerWaalsContact OE2-CB 3.27Å; E251-A254 WeakPolarHBondContact OE2-CB 3.47Å; E251-D256 PolarHBondContact N-OD1 3.23Å
252	N	70	Confident	84.5	Confident	124 Å²	124	44.8 Å²	44.8	66%	0.663	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-24	-171.5	-59.7	-53.4	0	0	0	116.1	N250	N250-N252 PolarHBondContact ND2-OD1 3.32Å
253	L	65.9	Low	84.5	Confident	182 Å²	182	43.3 Å²	43.3	95%	0.953	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.6	1.7	-175.8	-66.3	172.3	0	0	0	113.7	E251	E251-L253 PolarHBondContact O-N 3.37Å
254	A	72.9	Confident	84.4	Confident	60 Å²	60	43.3 Å²	43.3	50%	0.496	22%	0.224	S	C	.	.	S	Bend	trans	-137.4	179.3	-176.1	0	0	0	0	0	110	E251	E251-A254 HydrophobicContact CB-CB 3.97Å; E251-A254 PolarHBondContact O-N 3.23Å; E251-A254 VanDerWaalsContact OE2-CB 3.27Å; E251-A254 WeakPolarHBondContact OE2-CB 3.47Å
255	Q	78.2	Confident	84.3	Confident	180 Å²	180	41.2 Å²	41.2	84%	0.841	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-71.2	133.3	174.9	-174.4	173.2	8.3	0	0	109.5	A257	Q255-A257 PolarHBondContact O-N 2.83Å
256	D	83.4	Confident	83.9	Confident	44 Å²	44	41.3 Å²	41.3	24%	0.235	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-54.7	129.5	178.2	-70.6	-13.5	0	0	0	111.5	Y184 W248 N249 N250 E251	Y184-D256 HydrophobicContact CE1-CB 4.5Å; Y184-D256 VanDerWaalsContact CE1-OD2 3.27Å; Y184-D256 WeakPolarHBondContact CE1-OD2 3.48Å; Y184-D256 VanDerWaalsContact CZ-OD2 3.31Å; Y184-D256 PolarHBondContact OH-OD2 2.87Å; W248-D256 HydrophobicContact CE3-CB 4.31Å; N249-D256 VanDerWaalsContact O-CA 3.26Å; N249-D256 WeakPolarHBondContact O-CA 3.48Å; N249-D256 WeakPolarHBondContact O-CB 3.16Å; N250-D256 WeakPolarHBondContact CA-OD1 3.1Å; E251-D256 PolarHBondContact N-OD1 3.23Å
257	A	82.6	Confident	83.4	Confident	30 Å²	30	45.2 Å²	45.2	25%	0.248	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	128.8	-178.2	0	0	0	0	0	110.1	I176 W248 N249 Q255	I176-A257 HydrophobicContact CD1-CB 3.91Å; W248-A257 CarbonylContact C-O 3.56Å; W248-A257 WeakPolarHBondContact CA-O 3.44Å; N249-A257 HydrophobicContact CB-CB 4.21Å; N249-A257 PolarHBondContact N-O 2.88Å; N249-A257 PolarHBondContact O-N 3.04Å; N249-A257 VanDerWaalsContact O-N 3.13Å; Q255-A257 PolarHBondContact O-N 2.83Å
258	F	85	Confident	83	Confident	14 Å²	14	48 Å²	48	6%	0.061	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.8	176.3	-179.4	-109.3	0	0	0	110.6	V139 D246 W248 G260 E261 K284	V139-F258 HydrophobicContact CG2-CD1 4.19Å; V139-F258 HydrophobicContact CG2-CE1 3.74Å; D246-F258 HydrophobicContact CB-CE2 4.24Å; W248-F258 HydrophobicContact CD2-CD2 4.29Å; W248-F258 HydrophobicContact CE3-CB 4.02Å; W248-F258 HydrophobicContact CE3-CD2 4.24Å; W248-F258 HydrophobicContact CH2-CB 4.22Å; W248-F258 AromaticContact CH2-CD2 3.77Å; W248-F258 HydrophobicContact CH2-CD2 3.77Å; W248-F258 HydrophobicContact CH2-CG 4.41Å; W248-F258 AromaticContact CZ2-CD2 3.82Å; W248-F258 HydrophobicContact CZ2-CD2 3.82Å; W248-F258 HydrophobicContact CZ2-CE2 4.4Å; W248-F258 HydrophobicContact CZ3-CB 3.69Å; W248-F258 AromaticContact CZ3-CD2 3.99Å; W248-F258 HydrophobicContact CZ3-CD2 3.99Å; W248-F258 HydrophobicContact CZ3-CG 4.32Å; F258-G260 VanDerWaalsContact CZ-CA 3.43Å; F258-E261 HydrophobicContact CE2-CB 4.23Å; F258-E261 HydrophobicContact CZ-CB 3.84Å; F258-E261 HydrophobicContact CZ-CG 4.23Å; F258-E261 VanDerWaalsContact CZ-N 3.31Å; F258-K284 HydrophobicContact CD1-CB 4.45Å; F258-K284 HydrophobicContact CE1-CB 3.83Å; F258-K284 HydrophobicContact CZ-CB 3.93Å; F258-K284 HydrophobicContact CZ-CG 4.35Å
259	L	81.8	Confident	82.3	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-20.6	-179.8	-60.1	176.9	0	0	0	112.7	V139 L173 P174 I176 P183 L247 W248 N249	V139-L259 WeakPolarHBondContact CG1-O 3.41Å; L173-L259 HydrophobicContact CD1-CD1 4.3Å; P174-L259 HydrophobicContact CG-CD2 3.68Å; I176-L259 HydrophobicContact CD1-CD2 3.94Å; P183-L259 HydrophobicContact CB-CD1 3.99Å; L247-L259 HydrophobicContact CB-CB 3.88Å; L247-L259 WeakPolarHBondContact O-CB 3.3Å; L247-L259 PolarHBondContact O-N 2.98Å; W248-L259 VanDerWaalsContact C-CD1 3.48Å; N249-L259 HydrophobicContact CB-CD1 4.09Å; N249-L259 HydrophobicContact CB-CD2 4.04Å; N249-L259 HydrophobicContact CB-CG 4.15Å
260	G	85.5	Confident	81.3	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.6	158.9	177.6	0	0	0	0	0	114.9	L247 F258	L247-G260 PolarHBondContact N-O 2.66Å; L247-G260 PolarHBondContact O-N 2.79Å; F258-G260 VanDerWaalsContact CZ-CA 3.43Å
261	E	89.2	Confident	80	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.037	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	153.2	174.2	72.4	173.5	-108.3	0	0	112.4	V245 D246 F258 R263 L281 Q282 K284 G285	V245-E261 CarbonylContact O-C 3.56Å; V245-E261 VanDerWaalsContact O-CA 3.25Å; V245-E261 WeakPolarHBondContact O-CA 3.46Å; D246-E261 WeakPolarHBondContact OD1-CB 3.33Å; F258-E261 HydrophobicContact CE2-CB 4.23Å; F258-E261 HydrophobicContact CZ-CB 3.84Å; F258-E261 HydrophobicContact CZ-CG 4.23Å; F258-E261 VanDerWaalsContact CZ-N 3.31Å; E261-R263 IonicContact OE1-CZ 3.12Å; E261-R263 IonicContact OE1-NE 3.77Å; E261-R263 PolarHBondContact OE1-NE 2.99Å; E261-R263 IonicContact OE1-NH2 3.73Å; E261-R263 PolarHBondContact OE1-NH2 3.02Å; E261-R263 IonicContact OE2-NH2 2.72Å; E261-L281 CarbonylContact O-C 3.51Å; E261-L281 WeakPolarHBondContact O-CA 3.28Å; E261-Q282 PolarHBondContact N-O 3.3Å; E261-Q282 PolarHBondContact O-N 2.92Å; E261-K284 VanDerWaalsContact OE2-CA 3.27Å; E261-K284 WeakPolarHBondContact OE2-CA 3.45Å; E261-G285 PolarHBondContact OE2-N 3.49Å
262	T	90.3	Very high	78.9	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.6	162.6	-162.3	0	0	0	0	110.4	V143 L145 R244 V245 L280	V143-T262 HydrophobicContact CG1-CG2 3.6Å; L145-T262 HydrophobicContact CD1-CG2 4.09Å; R244-T262 WeakPolarHBondContact CA-O 3.31Å; V245-T262 HydrophobicContact CB-CG2 4.02Å; V245-T262 PolarHBondContact N-O 2.76Å; V245-T262 PolarHBondContact O-N 3.05Å; T262-L280 PolarHBondContact OG1-O 2.94Å
263	R	89.1	Confident	78.8	Confident	23 Å²	23	62.2 Å²	62.2	9%	0.087	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.2	179.3	-62.6	-173.5	-169.4	179	11.5	110.2	I243 R244 E261	I243-R263 CarbonylContact O-C 3.6Å; I243-R263 VanDerWaalsContact O-CA 3.31Å; I243-R263 WeakPolarHBondContact O-CA 3.43Å; R244-R263 HydrophobicContact CG-CG 4.32Å; E261-R263 IonicContact OE1-CZ 3.12Å; E261-R263 IonicContact OE1-NE 3.77Å; E261-R263 PolarHBondContact OE1-NE 2.99Å; E261-R263 IonicContact OE1-NH2 3.73Å; E261-R263 PolarHBondContact OE1-NH2 3.02Å; E261-R263 IonicContact OE2-NH2 2.72Å
264	V	89.5	Confident	79.6	Confident	1 Å²	1	56 Å²	56	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	112.6	-177.5	-171.9	0	0	0	0	109.4	L145 M147 E242 I243 V266 I268 Y279	L145-V264 HydrophobicContact CD1-CG2 4.08Å; M147-V264 HydrophobicContact CE-CG1 4.18Å; M147-V264 HydrophobicContact SD-CB 4.06Å; M147-V264 HydrophobicContact SD-CG1 3.63Å; E242-V264 WeakPolarHBondContact CA-O 3.28Å; I243-V264 HydrophobicContact CB-CB 4.49Å; I243-V264 PolarHBondContact N-O 3.07Å; I243-V264 PolarHBondContact O-N 3.42Å; V264-V266 PolarHBondContact O-N 3.47Å; V264-I268 HydrophobicContact CG1-CG2 4.25Å; V264-Y279 HydrophobicContact CB-CE1 4.4Å; V264-Y279 HydrophobicContact CG1-CE1 4.12Å; V264-Y279 WeakPolarHBondContact CG1-OH 2.98Å; V264-Y279 HydrophobicContact CG2-CD1 3.85Å; V264-Y279 HydrophobicContact CG2-CD2 4.31Å; V264-Y279 HydrophobicContact CG2-CE1 3.51Å; V264-Y279 HydrophobicContact CG2-CE2 4Å; V264-Y279 HydrophobicContact CG2-CG 4.22Å
265	P	88.1	Confident	80.3	Confident	24 Å²	24	54.3 Å²	54.3	16%	0.156	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	132.7	174.4	-24.1	35.2	0	0	0	111.6	K267 I268 K833	P265-K267 HydrophobicContact CB-CD 4.47Å; P265-K267 HydrophobicContact CB-CG 3.86Å; P265-K267 PolarHBondContact O-N 2.89Å; P265-I268 VanDerWaalsContact O-CG2 3.31Å; P265-I268 WeakPolarHBondContact O-CG2 3.34Å; P265-I268 PolarHBondContact O-N 2.8Å; P265-K833 HydrophobicContact CG-CD 4.3Å
266	V	84.5	Confident	80.8	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.012	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-66.2	-25	-178.1	178.7	0	0	0	0	111.9	L163 L189 I238 L241 I243 V264 I268 L269	L163-V266 HydrophobicContact CD2-CG1 4.19Å; L163-V266 HydrophobicContact CD2-CG2 3.79Å; L189-V266 HydrophobicContact CD1-CG2 4.07Å; I238-V266 HydrophobicContact CG2-CB 4.42Å; I238-V266 HydrophobicContact CG2-CG1 3.87Å; L241-V266 HydrophobicContact CB-CB 4.01Å; L241-V266 HydrophobicContact CB-CG2 3.75Å; L241-V266 WeakPolarHBondContact O-CG2 3.44Å; L241-V266 PolarHBondContact O-N 3.16Å; I243-V266 HydrophobicContact CG1-CG2 4.31Å; V264-V266 PolarHBondContact O-N 3.47Å; V266-I268 PolarHBondContact O-N 3.47Å; V266-L269 HydrophobicContact CG1-CD1 4.38Å; V266-L269 WeakPolarHBondContact O-CB 3.49Å; V266-L269 PolarHBondContact O-N 3.43Å
267	K	80.8	Confident	81.1	Confident	97 Å²	97	49.4 Å²	49.4	42%	0.422	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-54.6	-21.2	175.6	69.1	176.4	-173.4	172.4	0	115.2	P265 L269 Q270	P265-K267 HydrophobicContact CB-CD 4.47Å; P265-K267 HydrophobicContact CB-CG 3.86Å; P265-K267 PolarHBondContact O-N 2.89Å; K267-L269 PolarHBondContact O-N 2.74Å; K267-L269 VanDerWaalsContact O-N 3.16Å; K267-Q270 WeakPolarHBondContact O-CB 3.36Å; K267-Q270 PolarHBondContact O-N 3.23Å
268	I	80.8	Confident	81.5	Confident	57 Å²	57	48.8 Å²	48.8	29%	0.292	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-59.8	-25.4	177	-161.6	164.1	0	0	0	112.3	V264 P265 V266 Q270 H275	V264-I268 HydrophobicContact CG1-CG2 4.25Å; P265-I268 VanDerWaalsContact O-CG2 3.31Å; P265-I268 WeakPolarHBondContact O-CG2 3.34Å; P265-I268 PolarHBondContact O-N 2.8Å; V266-I268 PolarHBondContact O-N 3.47Å; I268-Q270 VanDerWaalsContact C-N 3.3Å; I268-Q270 PolarHBondContact O-N 3.34Å; I268-H275 VanDerWaalsContact CD1-CE1 3.45Å; I268-H275 WeakPolarHBondContact CD1-CE1 3.19Å; I268-H275 HydrophobicContact CG2-CB 4.42Å
269	L	75.6	Confident	81.6	Confident	13 Å²	13	48.3 Å²	48.3	7%	0.068	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-80.8	-4.4	178.9	-63	170.8	0	0	0	114	M147 L149 L163 V266 K267 S271 D272 H275	M147-L269 HydrophobicContact CB-CD1 4.1Å; M147-L269 HydrophobicContact CB-CD2 3.94Å; M147-L269 HydrophobicContact CB-CG 4.45Å; M147-L269 HydrophobicContact CE-CD1 4.15Å; M147-L269 WeakPolarHBondContact O-CD2 3.45Å; L149-L269 HydrophobicContact CB-CD1 4.35Å; L163-L269 HydrophobicContact CD1-CD1 3.35Å; V266-L269 HydrophobicContact CG1-CD1 4.38Å; V266-L269 WeakPolarHBondContact O-CB 3.49Å; V266-L269 PolarHBondContact O-N 3.43Å; K267-L269 PolarHBondContact O-N 2.74Å; K267-L269 VanDerWaalsContact O-N 3.16Å; L269-S271 VanDerWaalsContact C-N 3.34Å; L269-D272 CarbonylContact C-O 3.6Å; L269-D272 VanDerWaalsContact O-O 3.13Å; L269-H275 HydrophobicContact CD2-CB 3.54Å
270	Q	66.8	Low	81.7	Confident	124 Å²	124	49.1 Å²	49.1	58%	0.579	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-73.2	-29.3	174.2	-69.6	178.2	-16.7	0	0	111.9	K267 I268	K267-Q270 WeakPolarHBondContact O-CB 3.36Å; K267-Q270 PolarHBondContact O-N 3.23Å; I268-Q270 VanDerWaalsContact C-N 3.3Å; I268-Q270 PolarHBondContact O-N 3.34Å
271	S	58.9	Low	81.7	Confident	119 Å²	119	49.2 Å²	49.2	83%	0.832	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-28.5	-179.9	-55.2	0	0	0	0	113.3	L269	L269-S271 VanDerWaalsContact C-N 3.34Å
272	D	58.8	Low	81.3	Confident	103 Å²	103	49.3 Å²	49.3	55%	0.551	24%	0.241	S	C	*	.			trans	-140.4	127.4	-172.8	-140.6	-14.3	0	0	0	110.3	L269 V274	L269-D272 CarbonylContact C-O 3.6Å; L269-D272 VanDerWaalsContact O-O 3.13Å; D272-V274 PolarHBondContact O-N 2.97Å; D272-V274 VanDerWaalsContact O-N 3.16Å
273	R	67.6	Low	80.7	Confident	223 Å²	223	51.6 Å²	51.6	84%	0.842	26%	0.255	S	S	*	.	S	Bend	trans	-64.8	-21.5	-175.2	-70.3	-173	177.5	-163.3	-2	112.8
274	V	81.6	Confident	80	Confident	52 Å²	52	55.1 Å²	55.1	32%	0.315	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	119.9	177.2	179.9	0	0	0	0	108.1	E146 R148 D272	E146-V274 HydrophobicContact CG-CG1 4.26Å; R148-V274 HydrophobicContact CG-CB 4.17Å; R148-V274 HydrophobicContact CG-CG1 3.87Å; R148-V274 HydrophobicContact CG-CG2 3.83Å; D272-V274 PolarHBondContact O-N 2.97Å; D272-V274 VanDerWaalsContact O-N 3.16Å
275	H	87.8	Confident	78.7	Confident	24 Å²	24	56.4 Å²	56.4	11%	0.111	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	118.9	173.7	-179.6	68.4	0	0	0	110	E146 M147 I268 L269 Y279	E146-H275 CarbonylContact C-O 3.57Å; E146-H275 WeakPolarHBondContact CA-O 3.23Å; M147-H275 PolarHBondContact N-O 3.18Å; M147-H275 PolarHBondContact O-N 2.75Å; I268-H275 VanDerWaalsContact CD1-CE1 3.45Å; I268-H275 WeakPolarHBondContact CD1-CE1 3.19Å; I268-H275 HydrophobicContact CG2-CB 4.42Å; L269-H275 HydrophobicContact CD2-CB 3.54Å; H275-Y279 PolarHBondContact CD2-OH 3.17Å; H275-Y279 VanDerWaalsContact CD2-OH 3.26Å; H275-Y279 AromaticContact NE2-CE2 3.8Å; H275-Y279 AromaticContact NE2-CZ 3.58Å; H275-Y279 PolarHBondContact NE2-OH 3.43Å
276	K	90.4	Very high	76.7	Confident	117 Å²	117	60.1 Å²	60.1	51%	0.509	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	114.7	179.7	-177.5	172.5	-179.2	165.3	0	109.8	H144 L145 E146 I168	H144-K276 VanDerWaalsContact CE1-CE 3.41Å; H144-K276 WeakPolarHBondContact CE1-CE 3.46Å; H144-K276 WeakPolarHBondContact NE2-CE 3.28Å; H144-K276 WeakPolarHBondContact NE2-CG 3.42Å; L145-K276 WeakPolarHBondContact O-CA 3.37Å; E146-K276 HydrophobicContact CB-CB 4.42Å; E146-K276 HydrophobicContact CB-CG 4.23Å; E146-K276 HydrophobicContact CG-CB 4.34Å; E146-K276 HydrophobicContact CG-CD 4.49Å; E146-K276 HydrophobicContact CG-CG 4.5Å; E146-K276 IonicContact OE2-NZ 2.77Å; I168-K276 HydrophobicContact CD1-CD 4.46Å
277	A	89.3	Confident	74.6	Confident	3 Å²	3	64.4 Å²	64.4	3%	0.025	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	158.6	-176.1	0	0	0	0	0	112.5	L145 Y279 G824 I830	L145-A277 PolarHBondContact N-O 3.34Å; L145-A277 PolarHBondContact O-N 2.71Å; A277-Y279 HydrophobicContact CB-CD2 4.5Å; A277-Y279 HydrophobicContact CB-CE2 3.96Å; A277-G824 WeakPolarHBondContact CA-O 3.43Å; A277-I830 HydrophobicContact CB-CD1 3.6Å; A277-I830 HydrophobicContact CB-CG1 4.37Å
278	W	89.4	Confident	72.5	Confident	18 Å²	18	64.1 Å²	64.1	7%	0.068	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	136.4	165.4	-71.2	86.4	0	0	0	110.4	K142 V143 H144 E169 K171 G824 L826 P829 I830	K142-W278 HydrophobicContact CB-CE3 3.81Å; K142-W278 HydrophobicContact CB-CZ3 4.21Å; V143-W278 WeakPolarHBondContact O-CA 3.3Å; H144-W278 HydrophobicContact CB-CD2 3.81Å; H144-W278 HydrophobicContact CB-CE3 3.77Å; H144-W278 HydrophobicContact CB-CH2 3.75Å; H144-W278 HydrophobicContact CB-CZ2 3.74Å; H144-W278 HydrophobicContact CB-CZ3 3.76Å; H144-W278 AromaticContact CG-CE2 3.7Å; H144-W278 AromaticContact CG-CZ2 3.85Å; H144-W278 AromaticContact CG-NE1 3.94Å; H144-W278 AromaticContact ND1-CE2 3.84Å; H144-W278 AromaticContact ND1-CZ2 3.69Å; H144-W278 AromaticContact ND1-NE1 3.98Å; E169-W278 HydrophobicContact CG-CH2 3.55Å; E169-W278 HydrophobicContact CG-CZ2 4.08Å; E169-W278 HydrophobicContact CG-CZ3 4.37Å; E169-W278 WeakPolarHBondContact OE1-CZ2 3.42Å; K171-W278 HydrophobicContact CB-CH2 4.42Å; K171-W278 HydrophobicContact CB-CZ3 4.19Å; K171-W278 HydrophobicContact CD-CH2 3.67Å; K171-W278 HydrophobicContact CD-CZ2 4.41Å; K171-W278 HydrophobicContact CD-CZ3 4.24Å; K171-W278 HydrophobicContact CG-CH2 3.81Å; K171-W278 HydrophobicContact CG-CZ3 4.07Å; W278-G824 PolarHBondContact N-O 3.1Å; W278-L826 VanDerWaalsContact CD1-N 3.28Å; W278-L826 HydrophobicContact CD2-CB 4.38Å; W278-L826 HydrophobicContact CD2-CD1 3.74Å; W278-L826 HydrophobicContact CE3-CD1 3.83Å; W278-L826 HydrophobicContact CG-CB 4.4Å; W278-L826 HydrophobicContact CG-CD1 4.43Å; W278-L826 HydrophobicContact CH2-CD1 3.82Å; W278-L826 HydrophobicContact CZ2-CD1 3.78Å; W278-L826 HydrophobicContact CZ3-CD1 3.86Å; W278-P829 HydrophobicContact CB-CB 3.75Å; W278-P829 CarbonylContact O-C 3.57Å; W278-P829 WeakPolarHBondContact O-CA 3.29Å; W278-I830 PolarHBondContact O-N 3.28Å
279	Y	87.4	Confident	70.6	Confident	4 Å²	4	71.3 Å²	71.3	2%	0.016	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.6	176.6	-73.4	-90.4	0	0	0	110.9	K142 V143 L145 V264 H275 A277 I830	K142-Y279 CarbonylContact C-O 3.53Å; K142-Y279 VanDerWaalsContact CA-O 3.27Å; K142-Y279 WeakPolarHBondContact CA-O 3.25Å; V143-Y279 PolarHBondContact N-O 3.21Å; V143-Y279 PolarHBondContact O-N 3.23Å; L145-Y279 HydrophobicContact CB-CD2 4.12Å; L145-Y279 HydrophobicContact CB-CE2 4.24Å; L145-Y279 HydrophobicContact CD1-CD2 3.83Å; L145-Y279 HydrophobicContact CD1-CE2 4.26Å; L145-Y279 HydrophobicContact CD1-CG 4.4Å; L145-Y279 HydrophobicContact CG-CD2 4.14Å; V264-Y279 HydrophobicContact CB-CE1 4.4Å; V264-Y279 HydrophobicContact CG1-CE1 4.12Å; V264-Y279 WeakPolarHBondContact CG1-OH 2.98Å; V264-Y279 HydrophobicContact CG2-CD1 3.85Å; V264-Y279 HydrophobicContact CG2-CD2 4.31Å; V264-Y279 HydrophobicContact CG2-CE1 3.51Å; V264-Y279 HydrophobicContact CG2-CE2 4Å; V264-Y279 HydrophobicContact CG2-CG 4.22Å; H275-Y279 PolarHBondContact CD2-OH 3.17Å; H275-Y279 VanDerWaalsContact CD2-OH 3.26Å; H275-Y279 AromaticContact NE2-CE2 3.8Å; H275-Y279 AromaticContact NE2-CZ 3.58Å; H275-Y279 PolarHBondContact NE2-OH 3.43Å; A277-Y279 HydrophobicContact CB-CD2 4.5Å; A277-Y279 HydrophobicContact CB-CE2 3.96Å; Y279-I830 CarbonylContact C-O 3.55Å; Y279-I830 VanDerWaalsContact CA-O 3.31Å; Y279-I830 WeakPolarHBondContact CA-O 3.32Å; Y279-I830 HydrophobicContact CD1-CB 3.76Å; Y279-I830 HydrophobicContact CD1-CG2 3.92Å; Y279-I830 HydrophobicContact CE1-CB 3.76Å; Y279-I830 HydrophobicContact CE1-CD1 4.09Å; Y279-I830 HydrophobicContact CE1-CG1 4.5Å; Y279-I830 HydrophobicContact CE1-CG2 3.64Å; Y279-I830 HydrophobicContact CG-CB 4.45Å
280	L	83.7	Confident	69	Low	18 Å²	18	74.8 Å²	74.8	9%	0.094	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	136.3	171.4	-73.4	164.9	0	0	0	110.4	Q90 K142 T262 P829 I830 V831	Q90-L280 VanDerWaalsContact CD-CD2 3.45Å; Q90-L280 HydrophobicContact CG-CD2 4.42Å; K142-L280 HydrophobicContact CD-CD2 4.49Å; K142-L280 HydrophobicContact CG-CD2 3.81Å; T262-L280 PolarHBondContact OG1-O 2.94Å; L280-P829 HydrophobicContact CD1-CG 3.87Å; L280-P829 HydrophobicContact CD2-CB 4.47Å; L280-P829 HydrophobicContact CD2-CG 3.75Å; L280-P829 HydrophobicContact CG-CB 3.99Å; L280-P829 HydrophobicContact CG-CG 3.57Å; L280-I830 PolarHBondContact N-O 3.05Å; L280-V831 HydrophobicContact CD1-CG2 3.61Å
281	L	86.3	Confident	67.9	Low	2 Å²	2	77.8 Å²	77.8	1%	0.01	43%	0.428	C	S	.	.			trans	-74.6	143.6	169.9	-60.7	168	0	0	0	109.2	V139 Q140 G141 V143 L173 L247 E261	V139-L281 VanDerWaalsContact CG1-C 3.46Å; V139-L281 HydrophobicContact CG1-CB 3.4Å; Q140-L281 WeakPolarHBondContact O-CD1 3.49Å; G141-L281 WeakPolarHBondContact O-CG 3.49Å; G141-L281 PolarHBondContact O-N 2.94Å; V143-L281 HydrophobicContact CB-CD2 4.37Å; V143-L281 HydrophobicContact CG1-CD2 4.06Å; L173-L281 HydrophobicContact CD2-CD1 3.54Å; L247-L281 HydrophobicContact CD1-CD1 3.5Å; L247-L281 VanDerWaalsContact CD1-CD1 3.5Å; L247-L281 HydrophobicContact CD1-CD2 3.66Å; L247-L281 HydrophobicContact CD1-CG 4.2Å; L247-L281 HydrophobicContact CG-CD2 4.24Å; E261-L281 CarbonylContact O-C 3.51Å; E261-L281 WeakPolarHBondContact O-CA 3.28Å
282	Q	80.9	Confident	67.3	Low	11 Å²	11	77.7 Å²	77.7	5%	0.051	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-125.7	153.8	-177.9	-62.3	-61.7	-68.7	0	0	110.2	E261 T834	E261-Q282 PolarHBondContact N-O 3.3Å; E261-Q282 PolarHBondContact O-N 2.92Å; Q282-T834 HydrophobicContact CB-CG2 4.15Å; Q282-T834 HydrophobicContact CG-CG2 4.13Å
283	P	77.1	Confident	67.2	Low	48 Å²	48	78.8 Å²	78.8	31%	0.312	43%	0.433	S	S	.	.			trans	-51.7	155.6	167.7	-29.4	38.3	0	0	0	113.2	V139 G285	V139-P283 HydrophobicContact CB-CG 4.45Å; V139-P283 HydrophobicContact CG2-CG 4.46Å; P283-G285 PolarHBondContact O-N 3.02Å
284	K	75.3	Confident	67.3	Low	97 Å²	97	73.7 Å²	73.7	42%	0.422	42%	0.423	S	S	.	.			trans	-62.1	122	-179.6	-161.5	174.3	-175.6	173.2	0	110.8	F258 E261 T286	F258-K284 HydrophobicContact CD1-CB 4.45Å; F258-K284 HydrophobicContact CE1-CB 3.83Å; F258-K284 HydrophobicContact CZ-CB 3.93Å; F258-K284 HydrophobicContact CZ-CG 4.35Å; E261-K284 VanDerWaalsContact OE2-CA 3.27Å; E261-K284 WeakPolarHBondContact OE2-CA 3.45Å; K284-T286 HydrophobicContact CD-CG2 4.47Å; K284-T286 HydrophobicContact CG-CG2 4.34Å; K284-T286 PolarHBondContact O-N 3.44Å
285	G	61.4	Low	67.1	Low	28 Å²	28	72.7 Å²	72.7	29%	0.289	42%	0.415	S	S	.	.			trans	-78	82.9	178.4	0	0	0	0	0	111	E261 P283	E261-G285 PolarHBondContact OE2-N 3.49Å; P283-G285 PolarHBondContact O-N 3.02Å
286	T	45.5	Very low	67	Low	102 Å²	102	71.7 Å²	71.7	63%	0.626	41%	0.411	S	S	*	.			trans	-116.5	111.8	170.4	46.9	0	0	0	0	111.2	K284 S288	K284-T286 HydrophobicContact CD-CG2 4.47Å; K284-T286 HydrophobicContact CG-CG2 4.34Å; K284-T286 PolarHBondContact O-N 3.44Å; T286-S288 PolarHBondContact O-N 3.38Å
287	G	41.6	Very low	67	Low	93 Å²	93	69.1 Å²	69.1	96%	0.959	40%	0.401	S	S	*	.			trans	-67.8	59.4	168	0	0	0	0	0	113.7
288	S	35.6	Very low	67.1	Low	91 Å²	91	69 Å²	69	64%	0.636	40%	0.4	S	S	*	.			trans	-113.7	98.9	153.3	-176.2	0	0	0	0	106.4	T286 S290	T286-S288 PolarHBondContact O-N 3.38Å; S288-S290 PolarHBondContact O-N 2.89Å
289	K	41.2	Very low	67.3	Low	207 Å²	207	71.8 Å²	71.8	90%	0.9	41%	0.411	S	S	*	.			trans	-62.4	83.1	154.7	-70.3	-179.9	179.5	177.7	0	105.6	K291	K289-K291 PolarHBondContact O-N 3.36Å
290	S	42.1	Very low	67.5	Low	86 Å²	86	71.7 Å²	71.7	60%	0.601	41%	0.41	S	S	*	.			trans	-48.2	126.9	153.3	53.5	0	0	0	0	104.9	S288 S292	S288-S290 PolarHBondContact O-N 2.89Å; S290-S292 PolarHBondContact O-N 3.17Å; S290-S292 VanDerWaalsContact O-N 3.16Å
291	K	43.2	Very low	67.9	Low	188 Å²	188	75.6 Å²	75.6	82%	0.817	43%	0.427	S	S	*	.			trans	-36.3	127.8	-178.4	-73.5	178.9	176	178.7	0	108.6	K289 D293	K289-K291 PolarHBondContact O-N 3.36Å; K291-D293 PolarHBondContact O-N 2.94Å
292	S	47.6	Very low	68.1	Low	117 Å²	117	75.7 Å²	75.7	82%	0.818	43%	0.427	S	S	*	.			trans	-60.1	91.3	173.1	54.7	0	0	0	0	106.8	S290 D294	S290-S292 PolarHBondContact O-N 3.17Å; S290-S292 VanDerWaalsContact O-N 3.16Å; S292-D294 PolarHBondContact O-N 3.42Å; S292-D294 VanDerWaalsContact O-N 3.16Å
293	D	57	Low	68.4	Low	126 Å²	126	76.1 Å²	76.1	67%	0.674	43%	0.43	S	S	*	.			trans	-55.4	123	159.7	-76.7	-20.4	0	0	0	104.4	K291 L295	K291-D293 PolarHBondContact O-N 2.94Å; D293-L295 HydrophobicContact CB-CD2 4.05Å; D293-L295 HydrophobicContact CB-CG 4.39Å; D293-L295 WeakPolarHBondContact O-CG 3.47Å; D293-L295 PolarHBondContact O-N 2.99Å
294	D	70.1	Confident	69	Low	116 Å²	116	74.6 Å²	74.6	62%	0.62	42%	0.419	S	S	*	.			trans	-68.5	87.3	174.3	-174.7	11.9	0	0	0	106.8	S292 G296	S292-D294 PolarHBondContact O-N 3.42Å; S292-D294 VanDerWaalsContact O-N 3.16Å; D294-G296 PolarHBondContact O-N 2.81Å; D294-G296 PolarHBondContact OD1-N 3.31Å
295	L	77.3	Confident	69.4	Low	31 Å²	31	70.7 Å²	70.7	16%	0.162	40%	0.402	C	S	.	.			trans	-74.2	-3.9	-179.3	-63.3	176.9	0	0	0	111.6	L130 P132 D293	L130-L295 HydrophobicContact CB-CB 3.87Å; L130-L295 VanDerWaalsContact CD1-O 3.29Å; L130-L295 WeakPolarHBondContact CD1-O 3.43Å; P132-L295 HydrophobicContact CB-CD1 4Å; D293-L295 HydrophobicContact CB-CD2 4.05Å; D293-L295 HydrophobicContact CB-CG 4.39Å; D293-L295 WeakPolarHBondContact O-CG 3.47Å; D293-L295 PolarHBondContact O-N 2.99Å
296	G	85.1	Confident	70.6	Confident	3 Å²	3	73.2 Å²	73.2	3%	0.031	41%	0.406	C	S	.	.			trans	95.2	-170.7	-178	0	0	0	0	0	113.5	K36 N37 L130 D294	K36-G296 CarbonylContact O-C 3.47Å; K36-G296 WeakPolarHBondContact O-CA 3.34Å; N37-G296 WeakPolarHBondContact O-CA 3.43Å; N37-G296 PolarHBondContact O-N 3.36Å; L130-G296 WeakPolarHBondContact CB-O 3.39Å; L130-G296 PolarHBondContact N-O 3.07Å; D294-G296 PolarHBondContact O-N 2.81Å; D294-G296 PolarHBondContact OD1-N 3.31Å
297	Q	90.4	Very high	72.4	Confident	62 Å²	62	68.5 Å²	68.5	29%	0.29	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	150.8	-175.9	-54.8	-177.9	-59.4	0	0	110.9	A35 K36 W127 F128 N129	A35-Q297 CarbonylContact C-O 3.59Å; A35-Q297 WeakPolarHBondContact CA-O 3.35Å; A35-Q297 WeakPolarHBondContact CB-O 3.4Å; K36-Q297 PolarHBondContact N-O 2.96Å; K36-Q297 PolarHBondContact O-N 2.82Å; W127-Q297 HydrophobicContact CE3-CB 3.68Å; W127-Q297 HydrophobicContact CZ3-CB 4.21Å; F128-Q297 CarbonylContact O-C 3.16Å; F128-Q297 VanDerWaalsContact O-CA 3.24Å; F128-Q297 WeakPolarHBondContact O-CA 3.45Å; N129-Q297 WeakPolarHBondContact OD1-CG 3.39Å; N129-Q297 PolarHBondContact OD1-NE2 2.82Å
298	L	91.8	Very high	74.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.9	176.1	-175.4	65.9	0	0	0	109.5	I32 A35 Y77 F94 V96 V111 F128 L130 L300	I32-L298 HydrophobicContact CG2-CD1 4.19Å; A35-L298 HydrophobicContact CB-CD1 4.03Å; Y77-L298 HydrophobicContact CD2-CD1 4.47Å; Y77-L298 HydrophobicContact CE2-CD1 4.08Å; F94-L298 HydrophobicContact CB-CD2 3.78Å; F94-L298 HydrophobicContact CG-CD2 4.48Å; V96-L298 HydrophobicContact CG2-CD1 4.38Å; V96-L298 HydrophobicContact CG2-CD2 4.36Å; V111-L298 HydrophobicContact CG2-CB 4.13Å; V111-L298 HydrophobicContact CG2-CD2 4.21Å; F128-L298 PolarHBondContact N-O 2.85Å; F128-L298 PolarHBondContact O-N 3.36Å; L130-L298 HydrophobicContact CD2-CB 4.31Å; L298-L300 HydrophobicContact CD2-CD1 4.18Å; L298-L300 HydrophobicContact CD2-CD2 3.77Å; L298-L300 HydrophobicContact CD2-CG 4.1Å; L298-L300 HydrophobicContact CG-CD2 3.83Å; L298-L300 HydrophobicContact CG-CG 4.02Å
299	R	93.2	Very high	76.9	Confident	78 Å²	78	61 Å²	61	29%	0.294	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	121.4	175.9	-173.1	-178.9	179.2	163.8	8.2	110.1	C33 E34 D125 D126 W127	C33-R299 HydrophobicContact CB-CB 3.98Å; C33-R299 HydrophobicContact CB-CG 3.88Å; C33-R299 WeakPolarHBondContact CB-O 3.44Å; C33-R299 PolarHBondContact N-O 3.45Å; E34-R299 HydrophobicContact CG-CB 4.16Å; E34-R299 WeakPolarHBondContact O-CB 3.37Å; E34-R299 PolarHBondContact O-N 2.83Å; E34-R299 IonicContact OE1-NH1 3.17Å; D125-R299 VanDerWaalsContact CG-NE 3.32Å; D125-R299 VanDerWaalsContact OD1-CG 3.25Å; D125-R299 WeakPolarHBondContact OD1-CG 3.44Å; D125-R299 IonicContact OD1-CZ 2.7Å; D125-R299 IonicContact OD1-NE 2.69Å; D125-R299 PolarHBondContact OD1-NE 2.92Å; D125-R299 IonicContact OD1-NH2 3.93Å; D125-R299 IonicContact OD2-CZ 3.76Å; D125-R299 VanDerWaalsContact OD2-CZ 3.3Å; D125-R299 IonicContact OD2-NE 3.36Å; D125-R299 PolarHBondContact OD2-NE 2.93Å; D125-R299 IonicContact OD2-NH2 2.91Å; D125-R299 PolarHBondContact OD2-NH2 3.5Å; D126-R299 WeakPolarHBondContact O-CA 3.32Å; W127-R299 HydrophobicContact CD2-CB 3.84Å; W127-R299 HydrophobicContact CD2-CG 4.24Å; W127-R299 HydrophobicContact CE3-CB 3.73Å; W127-R299 HydrophobicContact CH2-CB 3.75Å; W127-R299 HydrophobicContact CZ2-CB 3.85Å; W127-R299 HydrophobicContact CZ2-CG 4.15Å; W127-R299 HydrophobicContact CZ3-CB 3.71Å
300	L	92.3	Very high	79	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.1	-177.2	-59.3	173.5	0	0	0	110.3	I32 F94 V111 D126 F128 L298 L302	I32-L300 HydrophobicContact CB-CD2 4.43Å; I32-L300 HydrophobicContact CG1-CD2 4.17Å; I32-L300 HydrophobicContact CG2-CD2 4.3Å; F94-L300 HydrophobicContact CB-CD1 4.39Å; F94-L300 HydrophobicContact CD1-CD1 4.08Å; F94-L300 HydrophobicContact CD1-CD2 3.88Å; F94-L300 HydrophobicContact CD2-CD1 3.5Å; F94-L300 VanDerWaalsContact CD2-CD1 3.5Å; F94-L300 HydrophobicContact CE1-CD1 4.25Å; F94-L300 HydrophobicContact CE1-CD2 4.05Å; F94-L300 HydrophobicContact CE2-CD1 3.7Å; F94-L300 HydrophobicContact CG-CD1 3.72Å; F94-L300 HydrophobicContact CG-CD2 4.27Å; F94-L300 HydrophobicContact CZ-CD1 4.09Å; V111-L300 HydrophobicContact CG1-CD1 4.47Å; D126-L300 PolarHBondContact N-O 3.39Å; D126-L300 VanDerWaalsContact N-O 3.08Å; D126-L300 PolarHBondContact O-N 2.93Å; F128-L300 HydrophobicContact CD2-CB 3.96Å; F128-L300 HydrophobicContact CD2-CD1 3.89Å; F128-L300 HydrophobicContact CD2-CG 4.05Å; F128-L300 HydrophobicContact CE2-CB 3.79Å; F128-L300 HydrophobicContact CE2-CD1 4.19Å; F128-L300 HydrophobicContact CE2-CG 4.35Å; F128-L300 HydrophobicContact CG-CD1 4.44Å; L298-L300 HydrophobicContact CD2-CD1 4.18Å; L298-L300 HydrophobicContact CD2-CD2 3.77Å; L298-L300 HydrophobicContact CD2-CG 4.1Å; L298-L300 HydrophobicContact CG-CD2 3.83Å; L298-L300 HydrophobicContact CG-CG 4.02Å; L300-L302 HydrophobicContact CB-CD2 4.25Å; L300-L302 HydrophobicContact CB-CG 4.17Å
301	K	91.1	Very high	81	Confident	101 Å²	101	47.5 Å²	47.5	44%	0.439	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	111.6	166.1	-177.3	175.8	-176.4	175.8	0	108.7	G30 K31 K124	G30-K301 CarbonylContact C-O 3.55Å; G30-K301 WeakPolarHBondContact CA-O 3.32Å; K31-K301 HydrophobicContact CB-CB 4.29Å; K31-K301 PolarHBondContact N-O 3.34Å; K31-K301 PolarHBondContact O-N 3.4Å; K124-K301 WeakPolarHBondContact O-CA 3.34Å
302	L	90.6	Very high	82.8	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	148.2	-174	-56	-179.3	0	0	0	110.7	F81 L92 F94 I113 S122 G123 L300	F81-L302 HydrophobicContact CE1-CD2 4.38Å; F81-L302 HydrophobicContact CZ-CD2 3.69Å; L92-L302 HydrophobicContact CD2-CD1 4.39Å; F94-L302 HydrophobicContact CE1-CD2 4.21Å; F94-L302 HydrophobicContact CE2-CD1 4.05Å; F94-L302 HydrophobicContact CE2-CD2 4.22Å; F94-L302 HydrophobicContact CZ-CD1 4.16Å; F94-L302 HydrophobicContact CZ-CD2 3.49Å; F94-L302 VanDerWaalsContact CZ-CD2 3.49Å; F94-L302 HydrophobicContact CZ-CG 4.48Å; I113-L302 HydrophobicContact CD1-CD1 3.55Å; S122-L302 CarbonylContact C-O 3.53Å; S122-L302 WeakPolarHBondContact CA-O 3.46Å; G123-L302 PolarHBondContact N-O 2.97Å; L300-L302 HydrophobicContact CB-CD2 4.25Å; L300-L302 HydrophobicContact CB-CG 4.17Å
303	T	88.3	Confident	84.5	Confident	20 Å²	20	39.2 Å²	39.2	12%	0.123	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	109.5	167.7	-56	0	0	0	0	107.4	R29 S122 I305	R29-T303 HydrophobicContact CG-CG2 4.13Å; R29-T303 PolarHBondContact N-O 3.42Å; R29-T303 PolarHBondContact O-N 2.94Å; S122-T303 WeakPolarHBondContact OG-CA 3.44Å; T303-I305 HydrophobicContact CG2-CD1 4.22Å; T303-I305 HydrophobicContact CG2-CG1 4.15Å
304	Y	88.8	Confident	85.8	Confident	17 Å²	17	33.6 Å²	33.6	7%	0.067	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	131.3	174.2	176	-106.9	0	0	0	108.6	Q26 L28 I85 F89 K115 L118 S122 E306	Q26-Y304 HydrophobicContact CB-CE2 4.32Å; Q26-Y304 VanDerWaalsContact CD-OH 3.23Å; Q26-Y304 HydrophobicContact CG-CE2 4.44Å; Q26-Y304 WeakPolarHBondContact CG-OH 3.26Å; Q26-Y304 PolarHBondContact NE2-OH 3.47Å; L28-Y304 HydrophobicContact CD1-CD2 4.31Å; I85-Y304 HydrophobicContact CD1-CD2 4.13Å; I85-Y304 HydrophobicContact CD1-CE2 3.76Å; F89-Y304 HydrophobicContact CE1-CE2 4.21Å; F89-Y304 HydrophobicContact CZ-CE2 4.19Å; K115-Y304 VanDerWaalsContact CE-OH 3.22Å; K115-Y304 WeakPolarHBondContact CE-OH 3.28Å; L118-Y304 HydrophobicContact CB-CD1 4.15Å; L118-Y304 HydrophobicContact CB-CG 4.06Å; L118-Y304 HydrophobicContact CD1-CD1 4.5Å; L118-Y304 HydrophobicContact CD1-CD2 3.94Å; L118-Y304 HydrophobicContact CD1-CE2 4.31Å; L118-Y304 HydrophobicContact CD1-CG 4.02Å; S122-Y304 PolarHBondContact OG-N 3.46Å; S122-Y304 PolarHBondContact OG-O 3.31Å; Y304-E306 HydrophobicContact CE1-CB 3.94Å; Y304-E306 PolarHBondContact OH-OE2 3.49Å
305	I	84.4	Confident	86.7	Confident	14 Å²	14	28.1 Å²	28.1	7%	0.072	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.8	178.8	-65.9	166.1	0	0	0	107.5	Q26 S27 T303 D307	Q26-I305 CarbonylContact C-O 3.33Å; Q26-I305 WeakPolarHBondContact CA-O 3.41Å; S27-I305 PolarHBondContact N-O 3.11Å; S27-I305 PolarHBondContact O-N 3.35Å; T303-I305 HydrophobicContact CG2-CD1 4.22Å; T303-I305 HydrophobicContact CG2-CG1 4.15Å; I305-D307 VanDerWaalsContact CG2-OD1 3.26Å; I305-D307 WeakPolarHBondContact CG2-OD1 3.48Å; I305-D307 WeakPolarHBondContact CG2-OD2 3.36Å
306	E	85.2	Confident	87.2	Confident	81 Å²	81	29.8 Å²	29.8	38%	0.379	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	107	172.5	-177.8	171	116	0	0	107.3	I24 Q26 K115 Y304	I24-E306 HydrophobicContact CG2-CG 3.85Å; Q26-E306 HydrophobicContact CG-CB 4.24Å; Q26-E306 HydrophobicContact CG-CG 3.9Å; Q26-E306 PolarHBondContact NE2-OE2 2.59Å; K115-E306 WeakPolarHBondContact CE-OE2 3.46Å; K115-E306 IonicContact NZ-OE2 3.19Å; K115-E306 PolarHBondContact NZ-OE2 3.06Å; Y304-E306 HydrophobicContact CE1-CB 3.94Å; Y304-E306 PolarHBondContact OH-OE2 3.49Å
307	D	84.3	Confident	87.5	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.8	179.9	-57.8	-49.2	0	0	0	108.4	L25 I305 V309 R745 E748 R749	L25-D307 PolarHBondContact N-O 3.23Å; L25-D307 PolarHBondContact O-N 3.33Å; I305-D307 VanDerWaalsContact CG2-OD1 3.26Å; I305-D307 WeakPolarHBondContact CG2-OD1 3.48Å; I305-D307 WeakPolarHBondContact CG2-OD2 3.36Å; D307-V309 HydrophobicContact CB-CG2 4.4Å; D307-V309 PolarHBondContact O-N 3Å; D307-R745 IonicContact OD2-NE 3.25Å; D307-E748 HydrophobicContact CB-CG 4.15Å; D307-R749 IonicContact OD1-NH1 3.1Å; D307-R749 PolarHBondContact OD1-NH1 3.05Å
308	T	86.4	Confident	87.5	Confident	26 Å²	26	29.8 Å²	29.8	16%	0.16	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	90.2	177.2	-60.7	0	0	0	0	108.7	I22 L310 Y315 E748 H813	I22-T308 HydrophobicContact CG2-CG2 3.39Å; T308-L310 PolarHBondContact O-N 3.49Å; T308-Y315 PolarHBondContact O-OH 3.34Å; T308-E748 VanDerWaalsContact O-CD 3.28Å; T308-H813 PolarHBondContact O-CE1 3.33Å
309	V	85.7	Confident	87.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	117.2	-173.6	-171.8	0	0	0	0	110.3	I22 R23 L25 D307 Y315 D744 R745 E748	I22-V309 WeakPolarHBondContact CA-O 3.28Å; R23-V309 HydrophobicContact CB-CB 4.23Å; R23-V309 PolarHBondContact N-O 2.91Å; R23-V309 PolarHBondContact O-N 3.2Å; L25-V309 HydrophobicContact CD1-CG2 3.96Å; L25-V309 HydrophobicContact CG-CG2 4.33Å; D307-V309 HydrophobicContact CB-CG2 4.4Å; D307-V309 PolarHBondContact O-N 3Å; V309-Y315 HydrophobicContact CG1-CE2 3.95Å; V309-D744 HydrophobicContact CG1-CB 3.5Å; V309-D744 VanDerWaalsContact CG1-CB 3.5Å; V309-R745 HydrophobicContact CG2-CB 4.17Å; V309-R745 HydrophobicContact CG2-CG 4.33Å; V309-E748 HydrophobicContact CG2-CB 4.19Å; V309-E748 HydrophobicContact CG2-CG 4.28Å
310	L	85.1	Confident	87.3	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.016	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-76.9	169.6	173.9	-61.1	-176.2	0	0	0	111.6	I22 T308 C314 Y315 Q812	I22-L310 HydrophobicContact CG1-CD2 4.29Å; T308-L310 PolarHBondContact O-N 3.49Å; L310-C314 HydrophobicContact CB-CB 3.93Å; L310-C314 HydrophobicContact CD1-CB 4.22Å; L310-Y315 HydrophobicContact CB-CE2 3.81Å; L310-Y315 WeakPolarHBondContact CB-OH 3.22Å; L310-Y315 PolarHBondContact N-OH 2.91Å; L310-Y315 VanDerWaalsContact O-CE2 3.29Å; L310-Y315 WeakPolarHBondContact O-CE2 3.27Å; L310-Q812 HydrophobicContact CD1-CB 4.25Å
311	P	82.8	Confident	87.3	Confident	7 Å²	7	31.5 Å²	31.5	5%	0.045	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-51.2	149.3	170.5	-32.4	39.6	0	0	0	113.8	D19 T313 C314	D19-P311 WeakPolarHBondContact O-CB 3.42Å; D19-P311 WeakPolarHBondContact O-CG 3.3Å; P311-T313 PolarHBondContact O-N 3.42Å; P311-T313 VanDerWaalsContact O-N 3.09Å; P311-C314 VanDerWaalsContact O-CB 3.26Å; P311-C314 WeakPolarHBondContact O-CB 3.47Å; P311-C314 PolarHBondContact O-N 3.5Å
312	S	81.4	Confident	87.3	Confident	37 Å²	37	26.8 Å²	26.8	26%	0.259	16%	0.155	S	C	.	.	H	α-helix	trans	-58.7	-30.6	-177.6	-49.3	0	0	0	0	112.6	D19 C314 Y315 T316 D744	D19-S312 PolarHBondContact OD1-N 2.73Å; D19-S312 VanDerWaalsContact OD1-N 3.15Å; D19-S312 PolarHBondContact OD1-OG 2.83Å; S312-C314 PolarHBondContact O-N 3.34Å; S312-Y315 PolarHBondContact O-N 2.92Å; S312-T316 PolarHBondContact O-N 2.83Å; S312-T316 PolarHBondContact O-OG1 3.45Å; S312-D744 WeakPolarHBondContact CA-OD1 3.28Å; S312-D744 WeakPolarHBondContact CB-OD1 3.2Å; S312-D744 VanDerWaalsContact OG-CG 3.28Å; S312-D744 PolarHBondContact OG-OD1 2.84Å; S312-D744 PolarHBondContact OG-OD2 2.97Å
313	T	83.1	Confident	87.3	Confident	93 Å²	93	27.6 Å²	27.6	57%	0.571	16%	0.159	S	C	*	.	H	α-helix	trans	-59.5	-32.3	177.1	58.4	0	0	0	0	112.8	P311	P311-T313 PolarHBondContact O-N 3.42Å; P311-T313 VanDerWaalsContact O-N 3.09Å
314	C	85.6	Confident	87.4	Confident	8 Å²	8	32.9 Å²	32.9	5%	0.054	18%	0.18	C	C	.	.	H	α-helix	trans	-67.9	-40	-178.9	-62.4	0	0	0	0	111.3	L310 P311 S312 P317 L809 Q812	L310-C314 HydrophobicContact CB-CB 3.93Å; L310-C314 HydrophobicContact CD1-CB 4.22Å; P311-C314 VanDerWaalsContact O-CB 3.26Å; P311-C314 WeakPolarHBondContact O-CB 3.47Å; P311-C314 PolarHBondContact O-N 3.5Å; S312-C314 PolarHBondContact O-N 3.34Å; C314-P317 WeakPolarHBondContact O-CD 3.35Å; C314-L809 HydrophobicContact CB-CD2 4.2Å; C314-L809 VanDerWaalsContact O-CD2 3.26Å; C314-L809 WeakPolarHBondContact O-CD2 3.5Å; C314-Q812 PolarHBondContact SG-OE1 2.89Å
315	Y	88.8	Confident	87.5	Confident	1 Å²	1	32.1 Å²	32.1	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-84.1	-8.5	-176.5	-61.1	-64.6	0	0	0	114.7	T308 V309 L310 S312 L318 C319 D744 A747 E748 L809	T308-Y315 PolarHBondContact O-OH 3.34Å; V309-Y315 HydrophobicContact CG1-CE2 3.95Å; L310-Y315 HydrophobicContact CB-CE2 3.81Å; L310-Y315 WeakPolarHBondContact CB-OH 3.22Å; L310-Y315 PolarHBondContact N-OH 2.91Å; L310-Y315 VanDerWaalsContact O-CE2 3.29Å; L310-Y315 WeakPolarHBondContact O-CE2 3.27Å; S312-Y315 PolarHBondContact O-N 2.92Å; Y315-L318 PolarHBondContact O-N 3.06Å; Y315-L318 VanDerWaalsContact O-N 3.14Å; Y315-C319 PolarHBondContact O-N 2.95Å; Y315-C319 PolarHBondContact O-SG 3.29Å; Y315-D744 HydrophobicContact CD2-CB 4.01Å; Y315-D744 HydrophobicContact CE2-CB 4.16Å; Y315-A747 HydrophobicContact CD1-CB 3.79Å; Y315-A747 HydrophobicContact CD2-CB 4.43Å; Y315-A747 HydrophobicContact CG-CB 3.73Å; Y315-E748 HydrophobicContact CE1-CB 4.03Å; Y315-E748 VanDerWaalsContact CE1-OE2 3.3Å; Y315-E748 WeakPolarHBondContact CE1-OE2 3.31Å; Y315-E748 VanDerWaalsContact CZ-OE2 3.3Å; Y315-E748 WeakPolarHBondContact OH-CB 3.42Å; Y315-E748 PolarHBondContact OH-OE2 2.71Å; Y315-L809 HydrophobicContact CD1-CD1 4.44Å; Y315-L809 HydrophobicContact CD1-CD2 4.07Å; Y315-L809 HydrophobicContact CE1-CD2 4.25Å
316	T	87.6	Confident	87.6	Confident	67 Å²	67	32.3 Å²	32.3	41%	0.411	18%	0.18	S	C	.	.	H	α-helix	trans	-53.6	-44.5	-176.6	-64.7	0	0	0	0	113.4	S312 L318 C319 N320	S312-T316 PolarHBondContact O-N 2.83Å; S312-T316 PolarHBondContact O-OG1 3.45Å; T316-L318 PolarHBondContact O-N 3.1Å; T316-C319 PolarHBondContact O-N 3.16Å; T316-N320 WeakPolarHBondContact CG2-ND2 3.33Å; T316-N320 WeakPolarHBondContact O-CB 3.31Å; T316-N320 PolarHBondContact O-N 3.01Å; T316-N320 PolarHBondContact O-ND2 2.93Å
317	P	90.5	Very high	87.8	Confident	64 Å²	64	33.4 Å²	33.4	42%	0.416	19%	0.189	S	C	.	.	H	α-helix	trans	-62.4	-42.4	177.7	-22.8	35.1	0	0	0	113.2	C314 N320 L321 V805	C314-P317 WeakPolarHBondContact O-CD 3.35Å; P317-N320 PolarHBondContact O-N 2.91Å; P317-L321 PolarHBondContact O-N 2.97Å; P317-L321 VanDerWaalsContact O-N 3.11Å; P317-V805 HydrophobicContact CB-CG1 4.09Å; P317-V805 HydrophobicContact CB-CG2 3.99Å
318	L	91.6	Very high	87.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.6	-47.2	178.5	179.9	60.8	0	0	0	111	Y315 T316 N320 L321 L322 I750 F751 L802 V805 L809	Y315-L318 PolarHBondContact O-N 3.06Å; Y315-L318 VanDerWaalsContact O-N 3.14Å; T316-L318 PolarHBondContact O-N 3.1Å; L318-N320 PolarHBondContact O-N 3.16Å; L318-L321 PolarHBondContact O-N 3.27Å; L318-L322 HydrophobicContact CD1-CD1 4.34Å; L318-L322 HydrophobicContact CG-CD1 4.26Å; L318-L322 WeakPolarHBondContact O-CG 3.5Å; L318-L322 PolarHBondContact O-N 3.2Å; L318-L322 VanDerWaalsContact O-N 3.08Å; L318-I750 HydrophobicContact CD2-CG2 4.43Å; L318-F751 HydrophobicContact CD2-CB 4.23Å; L318-L802 HydrophobicContact CD1-CD1 3.88Å; L318-V805 HydrophobicContact CB-CG1 3.75Å; L318-V805 HydrophobicContact CD1-CG1 4.34Å; L318-L809 HydrophobicContact CB-CD1 4.17Å; L318-L809 HydrophobicContact CD2-CD1 4.05Å
319	C	90.1	Very high	87.9	Confident	14 Å²	14	42.2 Å²	42.2	10%	0.095	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-46.4	177.6	-65.7	0	0	0	0	111	Y315 T316 L321 L322 L323	Y315-C319 PolarHBondContact O-N 2.95Å; Y315-C319 PolarHBondContact O-SG 3.29Å; T316-C319 PolarHBondContact O-N 3.16Å; C319-L321 VanDerWaalsContact C-N 3.31Å; C319-L321 PolarHBondContact O-N 3.29Å; C319-L322 PolarHBondContact O-N 3.49Å; C319-L323 WeakPolarHBondContact O-CB 3.37Å; C319-L323 WeakPolarHBondContact O-CG 3.39Å; C319-L323 PolarHBondContact O-N 3.33Å
320	N	90.7	Very high	87.9	Confident	80 Å²	80	43.8 Å²	43.8	43%	0.428	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-39.4	178.8	-76	-24.4	0	0	0	112.8	T316 P317 L318 K324	T316-N320 WeakPolarHBondContact CG2-ND2 3.33Å; T316-N320 WeakPolarHBondContact O-CB 3.31Å; T316-N320 PolarHBondContact O-N 3.01Å; T316-N320 PolarHBondContact O-ND2 2.93Å; P317-N320 PolarHBondContact O-N 2.91Å; L318-N320 PolarHBondContact O-N 3.16Å; N320-K324 WeakPolarHBondContact O-CB 3.42Å; N320-K324 VanDerWaalsContact O-CG 3.27Å; N320-K324 WeakPolarHBondContact O-CG 3.49Å; N320-K324 PolarHBondContact O-N 2.93Å; N320-K324 VanDerWaalsContact O-N 3.13Å
321	L	90.9	Very high	88.1	Confident	21 Å²	21	44.4 Å²	44.4	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-44.6	176.7	-174.2	63.8	0	0	0	111.3	P317 L318 C319 K324 A335 Q801 L802	P317-L321 PolarHBondContact O-N 2.97Å; P317-L321 VanDerWaalsContact O-N 3.11Å; L318-L321 PolarHBondContact O-N 3.27Å; C319-L321 VanDerWaalsContact C-N 3.31Å; C319-L321 PolarHBondContact O-N 3.29Å; L321-K324 PolarHBondContact O-N 3.28Å; L321-A335 HydrophobicContact CD2-CB 4.14Å; L321-A335 HydrophobicContact CG-CB 3.81Å; L321-Q801 HydrophobicContact CD1-CB 4.32Å; L321-Q801 HydrophobicContact CD2-CB 4.37Å; L321-L802 HydrophobicContact CD2-CB 4.03Å; L321-L802 HydrophobicContact CD2-CD1 3.84Å
322	L	91.2	Very high	88.3	Confident	3 Å²	3	44 Å²	44	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-41.4	177.9	-66.6	172.6	0	0	0	112.6	L318 C319 K324 S325 A335 A336 L339 L356 I750	L318-L322 HydrophobicContact CD1-CD1 4.34Å; L318-L322 HydrophobicContact CG-CD1 4.26Å; L318-L322 WeakPolarHBondContact O-CG 3.5Å; L318-L322 PolarHBondContact O-N 3.2Å; L318-L322 VanDerWaalsContact O-N 3.08Å; C319-L322 PolarHBondContact O-N 3.49Å; L322-K324 VanDerWaalsContact C-N 3.28Å; L322-K324 PolarHBondContact O-N 3.11Å; L322-S325 WeakPolarHBondContact O-CB 3.5Å; L322-S325 PolarHBondContact O-N 2.75Å; L322-S325 VanDerWaalsContact O-N 3.09Å; L322-S325 PolarHBondContact O-OG 2.89Å; L322-A335 HydrophobicContact CD2-CB 3.99Å; L322-A336 HydrophobicContact CD2-CB 4.46Å; L322-L339 HydrophobicContact CD1-CD1 4.43Å; L322-L339 HydrophobicContact CD2-CD1 3.4Å; L322-L339 HydrophobicContact CD2-CG 4.48Å; L322-L356 HydrophobicContact CB-CD2 4.13Å; L322-L356 HydrophobicContact CD1-CD2 3.69Å; L322-I750 HydrophobicContact CD1-CD1 3.73Å; L322-I750 HydrophobicContact CD1-CG2 4.26Å
323	L	90.5	Very high	88.6	Confident	19 Å²	19	42.3 Å²	42.3	10%	0.099	23%	0.227	C	C	.	.	H	α-helix	trans	-69	-24.8	-179.9	-67.8	174.4	0	0	0	113.4	C319 S325 P326 L357 H360 R362	C319-L323 WeakPolarHBondContact O-CB 3.37Å; C319-L323 WeakPolarHBondContact O-CG 3.39Å; C319-L323 PolarHBondContact O-N 3.33Å; L323-S325 VanDerWaalsContact C-N 3.28Å; L323-P326 VanDerWaalsContact O-CD 3.27Å; L323-P326 WeakPolarHBondContact O-CD 3.48Å; L323-L357 HydrophobicContact CD2-CD2 4.3Å; L323-H360 HydrophobicContact CD1-CB 4.18Å; L323-H360 HydrophobicContact CD2-CB 3.47Å; L323-H360 VanDerWaalsContact CD2-CB 3.47Å; L323-H360 HydrophobicContact CG-CB 4.48Å; L323-R362 HydrophobicContact CD2-CB 4.32Å; L323-R362 HydrophobicContact CD2-CG 4.16Å; L323-R362 VanDerWaalsContact O-CZ 3.24Å; L323-R362 PolarHBondContact O-NH1 3.2Å; L323-R362 PolarHBondContact O-NH2 3.36Å
324	K	91.2	Very high	89	Confident	131 Å²	131	37.9 Å²	37.9	57%	0.57	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-10	172.1	-75.7	176.7	-179.4	-177.6	0	113.6	N320 L321 L322 P326 D327	N320-K324 WeakPolarHBondContact O-CB 3.42Å; N320-K324 VanDerWaalsContact O-CG 3.27Å; N320-K324 WeakPolarHBondContact O-CG 3.49Å; N320-K324 PolarHBondContact O-N 2.93Å; N320-K324 VanDerWaalsContact O-N 3.13Å; L321-K324 PolarHBondContact O-N 3.28Å; L322-K324 VanDerWaalsContact C-N 3.28Å; L322-K324 PolarHBondContact O-N 3.11Å; K324-P326 VanDerWaalsContact C-N 3.34Å; K324-D327 WeakPolarHBondContact O-CB 3.34Å; K324-D327 PolarHBondContact O-N 2.87Å
325	S	90.4	Very high	89.2	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.007	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-51.5	-39.9	-176.9	-60.3	0	0	0	0	115.3	L322 L323 D327 V328 I331 S334 A336	L322-S325 WeakPolarHBondContact O-CB 3.5Å; L322-S325 PolarHBondContact O-N 2.75Å; L322-S325 VanDerWaalsContact O-N 3.09Å; L322-S325 PolarHBondContact O-OG 2.89Å; L323-S325 VanDerWaalsContact C-N 3.28Å; S325-D327 PolarHBondContact O-N 3.48Å; S325-V328 PolarHBondContact O-N 3.42Å; S325-I331 VanDerWaalsContact O-CD1 3.31Å; S325-I331 WeakPolarHBondContact O-CD1 3.35Å; S325-S334 WeakPolarHBondContact O-CB 3.27Å; S325-A336 VanDerWaalsContact OG-CB 3.23Å; S325-A336 WeakPolarHBondContact OG-CB 3.37Å; S325-A336 PolarHBondContact OG-N 3.06Å; S325-A336 VanDerWaalsContact OG-N 3.08Å
326	P	86.6	Confident	89.2	Confident	19 Å²	19	37.5 Å²	37.5	12%	0.123	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-64.7	-20.9	178	-19.8	32.7	0	0	0	114.5	L323 K324 P365 F366	L323-P326 VanDerWaalsContact O-CD 3.27Å; L323-P326 WeakPolarHBondContact O-CD 3.48Å; K324-P326 VanDerWaalsContact C-N 3.34Å; P326-P365 HydrophobicContact CB-CB 3.83Å; P326-P365 HydrophobicContact CG-CB 4.34Å; P326-F366 HydrophobicContact CG-CB 3.93Å
327	D	89.5	Confident	89.3	Confident	104 Å²	104	34.7 Å²	34.7	56%	0.556	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-92.1	-13.6	-174.2	-50.7	-33.7	0	0	0	111.9	K324 S325 R362	K324-D327 WeakPolarHBondContact O-CB 3.34Å; K324-D327 PolarHBondContact O-N 2.87Å; S325-D327 PolarHBondContact O-N 3.48Å; D327-R362 IonicContact OD1-NH2 2.81Å; D327-R362 PolarHBondContact OD1-NH2 3.12Å; D327-R362 IonicContact OD2-CZ 3.02Å; D327-R362 IonicContact OD2-NH1 3.5Å; D327-R362 IonicContact OD2-NH2 2.78Å; D327-R362 PolarHBondContact OD2-NH2 3.04Å
328	V	87.4	Confident	89.2	Confident	42 Å²	42	31.7 Å²	31.7	26%	0.255	16%	0.16	S	C	.	.	S	Bend	trans	-79.6	133.5	179.3	-179.4	0	0	0	0	110.2	S325 P330 A333	S325-V328 PolarHBondContact O-N 3.42Å; V328-P330 CarbonylContact O-C 3.59Å; V328-A333 HydrophobicContact CG1-CB 4.19Å
329	K	85.2	Confident	89	Confident	172 Å²	172	31.7 Å²	31.7	75%	0.748	16%	0.16	S	C	*	.	S	Bend	trans	-131.7	116.4	180	-67	-174.8	-178	179.3	0	110.3
330	P	86.9	Confident	88.8	Confident	33 Å²	33	31.1 Å²	31.1	21%	0.214	16%	0.156	C	C	.	.	S	Bend	cis	-77.7	152.7	10.5	30	-33.8	0	0	0	113.4	V328 S332 A333 Q790 E791 E794	V328-P330 CarbonylContact O-C 3.59Å; P330-S332 PolarHBondContact O-N 3.23Å; P330-S332 VanDerWaalsContact O-N 3.09Å; P330-A333 HydrophobicContact CG-CB 4.37Å; P330-A333 WeakPolarHBondContact O-CB 3.27Å; P330-A333 PolarHBondContact O-N 3.39Å; P330-Q790 HydrophobicContact CB-CB 4.28Å; P330-Q790 VanDerWaalsContact CB-OE1 3.32Å; P330-Q790 HydrophobicContact CG-CB 4.08Å; P330-E791 HydrophobicContact CG-CB 3.68Å; P330-E794 WeakPolarHBondContact CD-OE2 3.18Å
331	I	88.3	Confident	88.5	Confident	16 Å²	16	27.8 Å²	27.8	8%	0.082	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-59.9	-24.5	179.7	-170.3	62	0	0	0	112.3	S325 A333 S334 H337 F366 A369 V370 L373	S325-I331 VanDerWaalsContact O-CD1 3.31Å; S325-I331 WeakPolarHBondContact O-CD1 3.35Å; I331-A333 PolarHBondContact O-N 2.94Å; I331-S334 VanDerWaalsContact O-CB 3.22Å; I331-S334 WeakPolarHBondContact O-CB 3.31Å; I331-S334 PolarHBondContact O-N 2.66Å; I331-S334 VanDerWaalsContact O-N 3.08Å; I331-S334 PolarHBondContact O-OG 3.02Å; I331-H337 WeakPolarHBondContact O-CB 3.44Å; I331-F366 HydrophobicContact CD1-CD2 4.19Å; I331-F366 HydrophobicContact CD1-CE2 4.22Å; I331-A369 HydrophobicContact CB-CB 4.24Å; I331-A369 HydrophobicContact CD1-CB 3.91Å; I331-A369 HydrophobicContact CG1-CB 3.85Å; I331-V370 HydrophobicContact CG1-CG2 3.87Å; I331-L373 HydrophobicContact CG2-CB 3.92Å; I331-L373 HydrophobicContact CG2-CD2 3.68Å; I331-L373 HydrophobicContact CG2-CG 4.35Å
332	S	86.8	Confident	88.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-61.5	-29.6	174.4	48.9	0	0	0	0	113.5	P330 S334 H337 T788 Q790	P330-S332 PolarHBondContact O-N 3.23Å; P330-S332 VanDerWaalsContact O-N 3.09Å; S332-S334 VanDerWaalsContact C-N 3.28Å; S332-S334 PolarHBondContact O-N 2.9Å; S332-H337 VanDerWaalsContact CA-CD2 3.46Å; S332-H337 WeakPolarHBondContact CA-CD2 3.38Å; S332-T788 WeakPolarHBondContact CB-O 3.45Å; S332-Q790 WeakPolarHBondContact OG-CB 3.4Å; S332-Q790 WeakPolarHBondContact OG-CG 3.41Å; S332-Q790 PolarHBondContact OG-OE1 3.31Å
333	A	87.6	Confident	87.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-82.3	-2.1	176	0	0	0	0	0	113.4	V328 P330 I331 E794 T798	V328-A333 HydrophobicContact CG1-CB 4.19Å; P330-A333 HydrophobicContact CG-CB 4.37Å; P330-A333 WeakPolarHBondContact O-CB 3.27Å; P330-A333 PolarHBondContact O-N 3.39Å; I331-A333 PolarHBondContact O-N 2.94Å; A333-E794 HydrophobicContact CB-CB 3.88Å; A333-T798 WeakPolarHBondContact O-CB 3.37Å; A333-T798 WeakPolarHBondContact O-CG2 3.45Å; A333-T798 PolarHBondContact O-OG1 2.65Å
334	S	91.6	Very high	86.9	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-76.4	147.8	-178.9	75	0	0	0	0	112.6	S325 I331 S332 A336 H337 I338	S325-S334 WeakPolarHBondContact O-CB 3.27Å; I331-S334 VanDerWaalsContact O-CB 3.22Å; I331-S334 WeakPolarHBondContact O-CB 3.31Å; I331-S334 PolarHBondContact O-N 2.66Å; I331-S334 VanDerWaalsContact O-N 3.08Å; I331-S334 PolarHBondContact O-OG 3.02Å; S332-S334 VanDerWaalsContact C-N 3.28Å; S332-S334 PolarHBondContact O-N 2.9Å; S334-A336 VanDerWaalsContact C-N 3.31Å; S334-A336 PolarHBondContact O-N 2.75Å; S334-H337 PolarHBondContact O-N 2.93Å; S334-H337 VanDerWaalsContact O-N 3.11Å; S334-H337 VanDerWaalsContact OG-CB 3.25Å; S334-H337 WeakPolarHBondContact OG-CB 3.35Å; S334-H337 PolarHBondContact OG-N 2.96Å; S334-I338 VanDerWaalsContact O-CG1 3.32Å; S334-I338 WeakPolarHBondContact O-CG1 3.33Å; S334-I338 PolarHBondContact O-N 2.85Å
335	A	89.8	Confident	86	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-39.3	-178	0	0	0	0	0	112.7	L321 L322 I338 L339 T798	L321-A335 HydrophobicContact CD2-CB 4.14Å; L321-A335 HydrophobicContact CG-CB 3.81Å; L322-A335 HydrophobicContact CD2-CB 3.99Å; A335-I338 PolarHBondContact O-N 2.8Å; A335-L339 WeakPolarHBondContact O-CG 3.47Å; A335-L339 PolarHBondContact O-N 2.97Å; A335-T798 HydrophobicContact CB-CG2 3.91Å
336	A	89.1	Confident	85	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.2	-34.8	176.2	0	0	0	0	0	113	L322 S325 S334 G340 M353 F366	L322-A336 HydrophobicContact CD2-CB 4.46Å; S325-A336 VanDerWaalsContact OG-CB 3.23Å; S325-A336 WeakPolarHBondContact OG-CB 3.37Å; S325-A336 PolarHBondContact OG-N 3.06Å; S325-A336 VanDerWaalsContact OG-N 3.08Å; S334-A336 VanDerWaalsContact C-N 3.31Å; S334-A336 PolarHBondContact O-N 2.75Å; A336-G340 PolarHBondContact O-N 2.78Å; A336-G340 VanDerWaalsContact O-N 3.13Å; A336-M353 HydrophobicContact CB-CG 4.27Å; A336-M353 HydrophobicContact CB-SD 3.58Å; A336-M353 VanDerWaalsContact CB-SD 3.58Å; A336-F366 HydrophobicContact CB-CD2 4.21Å; A336-F366 HydrophobicContact CB-CE1 4.39Å; A336-F366 HydrophobicContact CB-CE2 3.41Å; A336-F366 VanDerWaalsContact CB-CE2 3.41Å; A336-F366 HydrophobicContact CB-CZ 3.51Å
337	H	89.7	Confident	84.6	Confident	9 Å²	9	41.9 Å²	41.9	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-71.6	-44.2	174.6	-169.4	89.7	0	0	0	111.9	I331 S332 S334 L339 G340 D341	I331-H337 WeakPolarHBondContact O-CB 3.44Å; S332-H337 VanDerWaalsContact CA-CD2 3.46Å; S332-H337 WeakPolarHBondContact CA-CD2 3.38Å; S334-H337 PolarHBondContact O-N 2.93Å; S334-H337 VanDerWaalsContact O-N 3.11Å; S334-H337 VanDerWaalsContact OG-CB 3.25Å; S334-H337 WeakPolarHBondContact OG-CB 3.35Å; S334-H337 PolarHBondContact OG-N 2.96Å; H337-L339 VanDerWaalsContact C-N 3.27Å; H337-L339 PolarHBondContact O-N 3.19Å; H337-G340 CarbonylContact O-C 3.44Å; H337-G340 WeakPolarHBondContact O-CA 3.25Å; H337-G340 PolarHBondContact O-N 2.81Å; H337-D341 IonicContact NE2-OD1 2.98Å; H337-D341 IonicContact NE2-OD2 2.8Å; H337-D341 PolarHBondContact O-N 2.9Å
338	I	88.8	Confident	84.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.2	-44.7	174.5	-70.4	166.1	0	0	0	110.5	S334 A335 G340 D341 I342 M764 T795 T798 L799	S334-I338 VanDerWaalsContact O-CG1 3.32Å; S334-I338 WeakPolarHBondContact O-CG1 3.33Å; S334-I338 PolarHBondContact O-N 2.85Å; A335-I338 PolarHBondContact O-N 2.8Å; I338-G340 PolarHBondContact O-N 2.89Å; I338-D341 PolarHBondContact O-N 2.97Å; I338-I342 HydrophobicContact CG2-CD1 3.68Å; I338-I342 HydrophobicContact CG2-CG1 4.34Å; I338-I342 VanDerWaalsContact O-CG1 3.31Å; I338-I342 WeakPolarHBondContact O-CG1 3.4Å; I338-I342 PolarHBondContact O-N 3.43Å; I338-M764 HydrophobicContact CG1-CE 3.99Å; I338-M764 HydrophobicContact CG2-CE 4.44Å; I338-M764 HydrophobicContact CG2-SD 3.96Å; I338-T795 HydrophobicContact CD1-CG2 4.15Å; I338-T795 HydrophobicContact CG1-CG2 4.44Å; I338-T798 HydrophobicContact CD1-CG2 3.76Å; I338-L799 HydrophobicContact CD1-CD2 4.21Å; I338-L799 HydrophobicContact CD1-CG 4.23Å; I338-L799 HydrophobicContact CG2-CD2 3.73Å
339	L	87.8	Confident	83.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56.8	-49.3	172	-80.3	176.9	0	0	0	112	L322 A335 H337 D341 I342 F343 I750 L754	L322-L339 HydrophobicContact CD1-CD1 4.43Å; L322-L339 HydrophobicContact CD2-CD1 3.4Å; L322-L339 HydrophobicContact CD2-CG 4.48Å; A335-L339 WeakPolarHBondContact O-CG 3.47Å; A335-L339 PolarHBondContact O-N 2.97Å; H337-L339 VanDerWaalsContact C-N 3.27Å; H337-L339 PolarHBondContact O-N 3.19Å; L339-D341 PolarHBondContact O-N 3.1Å; L339-I342 PolarHBondContact O-N 3.5Å; L339-F343 HydrophobicContact CD2-CD2 4.37Å; L339-F343 HydrophobicContact CD2-CE2 3.99Å; L339-F343 WeakPolarHBondContact O-CD2 3.34Å; L339-F343 PolarHBondContact O-N 2.68Å; L339-F343 VanDerWaalsContact O-N 3.14Å; L339-I750 HydrophobicContact CD1-CG2 3.78Å; L339-I750 HydrophobicContact CD2-CG2 4.21Å; L339-L754 HydrophobicContact CD2-CD1 3.9Å; L339-L754 HydrophobicContact CD2-CD2 3.45Å; L339-L754 VanDerWaalsContact CD2-CD2 3.45Å; L339-L754 HydrophobicContact CD2-CG 3.63Å
340	G	85.6	Confident	84.1	Confident	2 Å²	2	30 Å²	30	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-56	-37.1	176.9	0	0	0	0	0	113.5	A336 H337 I338 F343 R344	A336-G340 PolarHBondContact O-N 2.78Å; A336-G340 VanDerWaalsContact O-N 3.13Å; H337-G340 CarbonylContact O-C 3.44Å; H337-G340 WeakPolarHBondContact O-CA 3.25Å; H337-G340 PolarHBondContact O-N 2.81Å; I338-G340 PolarHBondContact O-N 2.89Å; G340-F343 CarbonylContact O-C 3.57Å; G340-R344 WeakPolarHBondContact O-CA 3.45Å; G340-R344 PolarHBondContact O-N 3.35Å
341	D	83.8	Confident	84.2	Confident	11 Å²	11	31.3 Å²	31.3	6%	0.059	14%	0.136	C	C	.	.	H	α-helix	trans	-76.3	-43.3	-179.8	-93.9	9.1	0	0	0	113.5	H337 I338 L339 F343 R344 T788	H337-D341 IonicContact NE2-OD1 2.98Å; H337-D341 IonicContact NE2-OD2 2.8Å; H337-D341 PolarHBondContact O-N 2.9Å; I338-D341 PolarHBondContact O-N 2.97Å; L339-D341 PolarHBondContact O-N 3.1Å; D341-F343 PolarHBondContact O-N 3.07Å; D341-R344 VanDerWaalsContact O-CB 3.27Å; D341-R344 WeakPolarHBondContact O-CB 3.08Å; D341-R344 PolarHBondContact O-N 3.12Å; D341-R344 IonicContact OD1-CZ 2.7Å; D341-R344 IonicContact OD1-NE 3.69Å; D341-R344 PolarHBondContact OD1-NE 3.3Å; D341-R344 IonicContact OD1-NH2 2.86Å; D341-R344 PolarHBondContact OD1-NH2 2.84Å; D341-R344 IonicContact OD2-NH2 3.47Å; D341-R344 PolarHBondContact OD2-NH2 3.34Å; D341-R344 VanDerWaalsContact OD2-NH2 3.08Å; D341-T788 VanDerWaalsContact OD2-CB 3.31Å; D341-T788 WeakPolarHBondContact OD2-CB 3.35Å; D341-T788 PolarHBondContact OD2-N 3.23Å
342	I	83.8	Confident	84.2	Confident	6 Å²	6	30.9 Å²	30.9	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-59.9	-37.1	176.2	-69.2	168.4	0	0	0	110.8	I338 L339 K760 L761 M764	I338-I342 HydrophobicContact CG2-CD1 3.68Å; I338-I342 HydrophobicContact CG2-CG1 4.34Å; I338-I342 VanDerWaalsContact O-CG1 3.31Å; I338-I342 WeakPolarHBondContact O-CG1 3.4Å; I338-I342 PolarHBondContact O-N 3.43Å; L339-I342 PolarHBondContact O-N 3.5Å; I342-K760 HydrophobicContact CG2-CB 4.09Å; I342-K760 HydrophobicContact CG2-CD 4.33Å; I342-L761 HydrophobicContact CD1-CB 4.44Å; I342-L761 HydrophobicContact CD1-CD1 3.47Å; I342-L761 VanDerWaalsContact CD1-CD1 3.47Å; I342-M764 HydrophobicContact CG1-SD 4.42Å
343	F	80.9	Confident	84.5	Confident	9 Å²	9	31 Å²	31	4%	0.039	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	21.8	-177.8	-63	-77.9	0	0	0	113.8	L339 G340 D341 E345 R346 Y347 A349 L753 L754 N757	L339-F343 HydrophobicContact CD2-CD2 4.37Å; L339-F343 HydrophobicContact CD2-CE2 3.99Å; L339-F343 WeakPolarHBondContact O-CD2 3.34Å; L339-F343 PolarHBondContact O-N 2.68Å; L339-F343 VanDerWaalsContact O-N 3.14Å; G340-F343 CarbonylContact O-C 3.57Å; D341-F343 PolarHBondContact O-N 3.07Å; F343-E345 PolarHBondContact O-N 3.29Å; F343-E345 VanDerWaalsContact O-N 3.08Å; F343-R346 PolarHBondContact O-N 2.78Å; F343-Y347 WeakPolarHBondContact O-CA 3.33Å; F343-Y347 PolarHBondContact O-N 2.84Å; F343-A349 HydrophobicContact CB-CB 4.04Å; F343-A349 HydrophobicContact CD1-CB 4.48Å; F343-A349 HydrophobicContact CD2-CB 3.35Å; F343-A349 HydrophobicContact CE2-CB 3.94Å; F343-A349 HydrophobicContact CG-CB 3.7Å; F343-L753 HydrophobicContact CE1-CB 4.06Å; F343-L753 HydrophobicContact CE1-CD2 4.42Å; F343-L753 HydrophobicContact CE2-CB 4.41Å; F343-L753 HydrophobicContact CZ-CB 3.76Å; F343-L753 WeakPolarHBondContact CZ-O 3.25Å; F343-L754 HydrophobicContact CE2-CD2 4.38Å; F343-N757 HydrophobicContact CE1-CB 4.24Å; F343-N757 WeakPolarHBondContact CE1-ND2 3.42Å; F343-N757 HydrophobicContact CZ-CB 4.17Å
344	R	74.8	Confident	84.7	Confident	89 Å²	89	31 Å²	31	34%	0.336	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-28.2	-174.2	-171.1	-177.8	-73.1	-174.7	-6.4	114.9	G340 D341 Y347 K786 T788	G340-R344 WeakPolarHBondContact O-CA 3.45Å; G340-R344 PolarHBondContact O-N 3.35Å; D341-R344 VanDerWaalsContact O-CB 3.27Å; D341-R344 WeakPolarHBondContact O-CB 3.08Å; D341-R344 PolarHBondContact O-N 3.12Å; D341-R344 IonicContact OD1-CZ 2.7Å; D341-R344 IonicContact OD1-NE 3.69Å; D341-R344 PolarHBondContact OD1-NE 3.3Å; D341-R344 IonicContact OD1-NH2 2.86Å; D341-R344 PolarHBondContact OD1-NH2 2.84Å; D341-R344 IonicContact OD2-NH2 3.47Å; D341-R344 PolarHBondContact OD2-NH2 3.34Å; D341-R344 VanDerWaalsContact OD2-NH2 3.08Å; R344-Y347 VanDerWaalsContact O-CE2 3.27Å; R344-Y347 WeakPolarHBondContact O-CE2 3.33Å; R344-Y347 VanDerWaalsContact O-CZ 3.24Å; R344-K786 PolarHBondContact NH1-O 2.9Å; R344-T788 PolarHBondContact NH2-OG1 3.41Å
345	E	72.3	Confident	84.5	Confident	163 Å²	163	34.7 Å²	34.7	76%	0.762	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-40.9	-178	-66.5	178	174.4	0	0	113.8	F343	F343-E345 PolarHBondContact O-N 3.29Å; F343-E345 VanDerWaalsContact O-N 3.08Å
346	R	69.5	Low	84.5	Confident	178 Å²	178	34.7 Å²	34.7	67%	0.672	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-13.3	-173.1	-61.4	-170.5	178.5	-174.6	0.9	114	F343 E348	F343-R346 PolarHBondContact O-N 2.78Å; R346-E348 HydrophobicContact CB-CG 3.79Å; R346-E348 PolarHBondContact O-N 2.69Å
347	Y	77.1	Confident	84.5	Confident	44 Å²	44	34.8 Å²	34.8	17%	0.173	15%	0.149	C	C	.	.			trans	50.5	24.7	-177	-61.3	-74.3	0	0	0	114.5	F343 R344 A349 V350 N388 R393	F343-Y347 WeakPolarHBondContact O-CA 3.33Å; F343-Y347 PolarHBondContact O-N 2.84Å; R344-Y347 VanDerWaalsContact O-CE2 3.27Å; R344-Y347 WeakPolarHBondContact O-CE2 3.33Å; R344-Y347 VanDerWaalsContact O-CZ 3.24Å; Y347-A349 PolarHBondContact O-N 3.21Å; Y347-V350 HydrophobicContact CD1-CG2 3.75Å; Y347-V350 HydrophobicContact CG-CG2 4.32Å; Y347-V350 WeakPolarHBondContact O-CB 3.18Å; Y347-V350 PolarHBondContact O-N 3.26Å; Y347-V350 VanDerWaalsContact O-N 3.1Å; Y347-N388 PolarHBondContact OH-O 3.45Å; Y347-R393 HydrophobicContact CD1-CB 4.37Å; Y347-R393 HydrophobicContact CD1-CG 3.99Å; Y347-R393 HydrophobicContact CD2-CG 4.17Å; Y347-R393 HydrophobicContact CE1-CG 3.97Å; Y347-R393 HydrophobicContact CE2-CG 4.15Å; Y347-R393 HydrophobicContact CG-CG 4.08Å
348	E	79.4	Confident	84.4	Confident	67 Å²	67	34.8 Å²	34.8	31%	0.313	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.1	-174.8	-72.1	174.6	153.1	0	0	112.9	R346 P352 L753	R346-E348 HydrophobicContact CB-CG 3.79Å; R346-E348 PolarHBondContact O-N 2.69Å; E348-P352 WeakPolarHBondContact O-CD 3.39Å; E348-L753 HydrophobicContact CB-CD1 4.39Å; E348-L753 HydrophobicContact CB-CD2 4.2Å
349	A	84.4	Confident	84.1	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.008	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-13	177.8	0	0	0	0	0	114	F343 Y347 M353 L753	F343-A349 HydrophobicContact CB-CB 4.04Å; F343-A349 HydrophobicContact CD1-CB 4.48Å; F343-A349 HydrophobicContact CD2-CB 3.35Å; F343-A349 HydrophobicContact CE2-CB 3.94Å; F343-A349 HydrophobicContact CG-CB 3.7Å; Y347-A349 PolarHBondContact O-N 3.21Å; A349-M353 VanDerWaalsContact O-CB 3.24Å; A349-M353 WeakPolarHBondContact O-CB 3.49Å; A349-M353 PolarHBondContact O-N 3.14Å; A349-L753 HydrophobicContact CB-CD1 3.98Å
350	V	88.6	Confident	83.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.8	-47.1	-175.9	176.8	0	0	0	0	111	Y347 M353 V354 L390 R393	Y347-V350 HydrophobicContact CD1-CG2 3.75Å; Y347-V350 HydrophobicContact CG-CG2 4.32Å; Y347-V350 WeakPolarHBondContact O-CB 3.18Å; Y347-V350 PolarHBondContact O-N 3.26Å; Y347-V350 VanDerWaalsContact O-N 3.1Å; V350-M353 HydrophobicContact CG1-CE 4.42Å; V350-M353 WeakPolarHBondContact O-CB 3.22Å; V350-M353 PolarHBondContact O-N 3.06Å; V350-V354 HydrophobicContact CG1-CG2 3.89Å; V350-V354 WeakPolarHBondContact O-CB 3.27Å; V350-V354 WeakPolarHBondContact O-CG2 3.23Å; V350-V354 PolarHBondContact O-N 3.29Å; V350-L390 HydrophobicContact CG2-CD1 3.84Å; V350-R393 HydrophobicContact CG1-CB 4.24Å
351	L	88.4	Confident	83.7	Confident	61 Å²	61	46.4 Å²	46.4	32%	0.319	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-49.4	-177.3	176	67.5	0	0	0	112.7	M353 V354 R355 D397 I401	L351-M353 VanDerWaalsContact C-N 3.32Å; L351-M353 PolarHBondContact O-N 3.2Å; L351-V354 PolarHBondContact O-N 3.35Å; L351-R355 HydrophobicContact CD1-CG 4.37Å; L351-R355 WeakPolarHBondContact O-CG 3.32Å; L351-R355 PolarHBondContact O-N 3.17Å; L351-D397 HydrophobicContact CD1-CB 4.07Å; L351-I401 HydrophobicContact CD1-CD1 3.99Å
352	P	89.6	Confident	83.9	Confident	7 Å²	7	49.2 Å²	49.2	5%	0.045	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-42	175	-26.5	35.7	0	0	0	113.4	E348 R355 L356 E746 R749 I750	E348-P352 WeakPolarHBondContact O-CD 3.39Å; P352-R355 PolarHBondContact O-N 3.05Å; P352-L356 WeakPolarHBondContact O-CB 3.47Å; P352-L356 PolarHBondContact O-N 3.38Å; P352-E746 WeakPolarHBondContact CA-OE2 3.33Å; P352-E746 HydrophobicContact CB-CB 4.3Å; P352-E746 VanDerWaalsContact CB-OE2 3.24Å; P352-E746 WeakPolarHBondContact CB-OE2 3.5Å; P352-R749 HydrophobicContact CB-CB 4.43Å; P352-R749 HydrophobicContact CB-CG 4.43Å; P352-R749 HydrophobicContact CG-CB 4.28Å; P352-R749 HydrophobicContact CG-CG 3.75Å; P352-I750 HydrophobicContact CB-CD1 4.2Å; P352-I750 HydrophobicContact CB-CG1 3.8Å
353	M	91.9	Very high	84.2	Confident	2 Å²	2	49 Å²	49	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-44.7	177.6	179.2	-170.8	72.5	0	0	112	A336 A349 V350 L351 L356 L357 F366 L390	A336-M353 HydrophobicContact CB-CG 4.27Å; A336-M353 HydrophobicContact CB-SD 3.58Å; A336-M353 VanDerWaalsContact CB-SD 3.58Å; A349-M353 VanDerWaalsContact O-CB 3.24Å; A349-M353 WeakPolarHBondContact O-CB 3.49Å; A349-M353 PolarHBondContact O-N 3.14Å; V350-M353 HydrophobicContact CG1-CE 4.42Å; V350-M353 WeakPolarHBondContact O-CB 3.22Å; V350-M353 PolarHBondContact O-N 3.06Å; L351-M353 VanDerWaalsContact C-N 3.32Å; L351-M353 PolarHBondContact O-N 3.2Å; M353-L356 PolarHBondContact O-N 2.85Å; M353-L357 HydrophobicContact CG-CD1 4.04Å; M353-L357 WeakPolarHBondContact O-CB 3.39Å; M353-L357 VanDerWaalsContact O-CG 3.31Å; M353-L357 WeakPolarHBondContact O-CG 3.42Å; M353-L357 PolarHBondContact O-N 2.86Å; M353-F366 HydrophobicContact CE-CE1 3.85Å; M353-F366 HydrophobicContact CE-CZ 4.23Å; M353-F366 HydrophobicContact SD-CE1 4.35Å; M353-F366 HydrophobicContact SD-CZ 4.3Å; M353-L390 HydrophobicContact CE-CD1 4.2Å
354	V	91.4	Very high	84.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-46.2	176.7	169.3	0	0	0	0	110.2	V350 L351 L356 L357 L358 F363 C394 D397 M398 I401	V350-V354 HydrophobicContact CG1-CG2 3.89Å; V350-V354 WeakPolarHBondContact O-CB 3.27Å; V350-V354 WeakPolarHBondContact O-CG2 3.23Å; V350-V354 PolarHBondContact O-N 3.29Å; L351-V354 PolarHBondContact O-N 3.35Å; V354-L356 PolarHBondContact O-N 2.92Å; V354-L357 PolarHBondContact O-N 3.01Å; V354-L358 HydrophobicContact CG1-CD1 3.68Å; V354-L358 HydrophobicContact CG1-CG 4.15Å; V354-L358 WeakPolarHBondContact O-CB 3.49Å; V354-L358 WeakPolarHBondContact O-CG 3.46Å; V354-L358 PolarHBondContact O-N 2.84Å; V354-F363 HydrophobicContact CB-CE2 4.43Å; V354-F363 HydrophobicContact CG1-CD2 4.17Å; V354-F363 HydrophobicContact CG1-CE2 3.82Å; V354-F363 HydrophobicContact CG2-CE2 4.1Å; V354-C394 HydrophobicContact CG2-CB 4.01Å; V354-D397 HydrophobicContact CG1-CB 4.42Å; V354-M398 HydrophobicContact CG1-CB 4.19Å; V354-I401 HydrophobicContact CG1-CD1 4.31Å
355	R	88.9	Confident	85.2	Confident	79 Å²	79	49 Å²	49	30%	0.298	23%	0.233	S	C	.	.	H	α-helix	trans	-59.1	-46	177.7	-75.2	177.7	176.2	-171.5	-5	112.2	L351 P352 L358 Y359 I401 I741 E746	L351-R355 HydrophobicContact CD1-CG 4.37Å; L351-R355 WeakPolarHBondContact O-CG 3.32Å; L351-R355 PolarHBondContact O-N 3.17Å; P352-R355 PolarHBondContact O-N 3.05Å; R355-L358 PolarHBondContact O-N 3.36Å; R355-Y359 PolarHBondContact O-N 2.69Å; R355-I401 HydrophobicContact CG-CD1 3.74Å; R355-I741 HydrophobicContact CB-CD1 3.92Å; R355-I741 HydrophobicContact CB-CG1 4.22Å; R355-I741 HydrophobicContact CB-CG2 3.84Å; R355-I741 HydrophobicContact CG-CD1 4.08Å; R355-I741 HydrophobicContact CG-CG1 4.22Å; R355-I741 WeakPolarHBondContact O-CD1 3.43Å; R355-E746 HydrophobicContact CB-CG 3.94Å; R355-E746 VanDerWaalsContact CD-CD 3.46Å; R355-E746 WeakPolarHBondContact CD-OE1 3.39Å; R355-E746 IonicContact CZ-OE1 3.16Å; R355-E746 IonicContact NE-OE1 2.81Å; R355-E746 IonicContact NH1-OE1 2.64Å; R355-E746 PolarHBondContact NH1-OE1 2.86Å
356	L	89.1	Confident	86.2	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-46.9	176.4	-172	71.5	0	0	0	111.8	L322 P352 M353 V354 L358 Y359 H360 C743 I750	L322-L356 HydrophobicContact CB-CD2 4.13Å; L322-L356 HydrophobicContact CD1-CD2 3.69Å; P352-L356 WeakPolarHBondContact O-CB 3.47Å; P352-L356 PolarHBondContact O-N 3.38Å; M353-L356 PolarHBondContact O-N 2.85Å; V354-L356 PolarHBondContact O-N 2.92Å; L356-L358 VanDerWaalsContact C-N 3.35Å; L356-L358 PolarHBondContact O-N 3.11Å; L356-Y359 PolarHBondContact O-N 3.04Å; L356-H360 PolarHBondContact O-CD2 3.42Å; L356-H360 PolarHBondContact O-N 2.92Å; L356-C743 HydrophobicContact CD1-CB 4.3Å; L356-I750 HydrophobicContact CD2-CD1 4.38Å
357	L	89.1	Confident	87.4	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-66.3	-35	179.4	-71.8	170.6	0	0	0	113	L323 M353 V354 S361 R362 F363 F366	L323-L357 HydrophobicContact CD2-CD2 4.3Å; M353-L357 HydrophobicContact CG-CD1 4.04Å; M353-L357 WeakPolarHBondContact O-CB 3.39Å; M353-L357 VanDerWaalsContact O-CG 3.31Å; M353-L357 WeakPolarHBondContact O-CG 3.42Å; M353-L357 PolarHBondContact O-N 2.86Å; V354-L357 PolarHBondContact O-N 3.01Å; L357-S361 PolarHBondContact O-N 3.23Å; L357-R362 HydrophobicContact CD2-CB 4.05Å; L357-R362 PolarHBondContact O-N 2.91Å; L357-F363 HydrophobicContact CB-CB 4.15Å; L357-F363 HydrophobicContact CB-CD2 4.32Å; L357-F363 PolarHBondContact O-N 2.93Å; L357-F366 HydrophobicContact CD1-CB 4.13Å; L357-F366 HydrophobicContact CD1-CD1 3.45Å; L357-F366 VanDerWaalsContact CD1-CD1 3.45Å; L357-F366 HydrophobicContact CD1-CE1 3.96Å; L357-F366 HydrophobicContact CD1-CG 3.79Å
358	L	86.3	Confident	88.1	Confident	9 Å²	9	31.9 Å²	31.9	5%	0.047	17%	0.165	C	C	.	.	H	α-helix	trans	-66.3	-46.1	175.3	-74.6	173	0	0	0	111.2	V354 R355 L356 H360 S361 F363 M398 I401 V402 L466 L739 I741	V354-L358 HydrophobicContact CG1-CD1 3.68Å; V354-L358 HydrophobicContact CG1-CG 4.15Å; V354-L358 WeakPolarHBondContact O-CB 3.49Å; V354-L358 WeakPolarHBondContact O-CG 3.46Å; V354-L358 PolarHBondContact O-N 2.84Å; R355-L358 PolarHBondContact O-N 3.36Å; L356-L358 VanDerWaalsContact C-N 3.35Å; L356-L358 PolarHBondContact O-N 3.11Å; L358-H360 VanDerWaalsContact C-N 3.3Å; L358-H360 PolarHBondContact O-N 3.21Å; L358-S361 PolarHBondContact O-N 2.88Å; L358-S361 VanDerWaalsContact O-N 3.09Å; L358-F363 HydrophobicContact CD2-CB 3.79Å; L358-F363 HydrophobicContact CD2-CD1 4.11Å; L358-F363 HydrophobicContact CD2-CD2 4.18Å; L358-F363 HydrophobicContact CD2-CG 3.75Å; L358-F363 HydrophobicContact CG-CB 4.27Å; L358-F363 HydrophobicContact CG-CD2 4.23Å; L358-F363 HydrophobicContact CG-CG 4.25Å; L358-M398 HydrophobicContact CD1-CG 4.39Å; L358-M398 HydrophobicContact CD2-CG 3.89Å; L358-I401 HydrophobicContact CD1-CD1 3.95Å; L358-I401 HydrophobicContact CD1-CG2 4.41Å; L358-V402 HydrophobicContact CD1-CG2 4.48Å; L358-V402 HydrophobicContact CD2-CG2 4.44Å; L358-L466 HydrophobicContact CD2-CD2 3.43Å; L358-L466 VanDerWaalsContact CD2-CD2 3.43Å; L358-L739 HydrophobicContact CB-CD1 4.35Å; L358-I741 HydrophobicContact CB-CD1 4.38Å
359	Y	83.8	Confident	88.6	Confident	66 Å²	66	30.1 Å²	30.1	26%	0.259	16%	0.162	S	C	.	.	H	α-helix	trans	-57.4	-43.9	179.5	-179.2	-90.3	0	0	0	112.2	R355 L356 S361 L734 C743	R355-Y359 PolarHBondContact O-N 2.69Å; L356-Y359 PolarHBondContact O-N 3.04Å; Y359-S361 VanDerWaalsContact C-N 3.31Å; Y359-S361 PolarHBondContact O-N 2.67Å; Y359-L734 WeakPolarHBondContact CE2-O 3.49Å; Y359-L734 WeakPolarHBondContact OH-CB 3.5Å; Y359-C743 WeakPolarHBondContact CD1-SG 3.36Å; Y359-C743 VanDerWaalsContact CD2-SG 3.53Å; Y359-C743 WeakPolarHBondContact CE1-SG 3.34Å
360	H	82.6	Confident	89	Confident	75 Å²	75	30.4 Å²	30.4	35%	0.347	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	8.1	179.7	-68.6	-76.1	0	0	0	114.3	L323 L356 L358 R362	L323-H360 HydrophobicContact CD1-CB 4.18Å; L323-H360 HydrophobicContact CD2-CB 3.47Å; L323-H360 VanDerWaalsContact CD2-CB 3.47Å; L323-H360 HydrophobicContact CG-CB 4.48Å; L356-H360 PolarHBondContact O-CD2 3.42Å; L356-H360 PolarHBondContact O-N 2.92Å; L358-H360 VanDerWaalsContact C-N 3.3Å; L358-H360 PolarHBondContact O-N 3.21Å; H360-R362 HydrophobicContact CB-CG 4.35Å; H360-R362 PolarHBondContact O-N 2.99Å
361	S	82.8	Confident	89.1	Confident	105 Å²	105	30.4 Å²	30.4	73%	0.734	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	27.9	-178.5	-56	0	0	0	0	114.5	L357 L358 Y359	L357-S361 PolarHBondContact O-N 3.23Å; L358-S361 PolarHBondContact O-N 2.88Å; L358-S361 VanDerWaalsContact O-N 3.09Å; Y359-S361 VanDerWaalsContact C-N 3.31Å; Y359-S361 PolarHBondContact O-N 2.67Å
362	R	87.4	Confident	89.2	Confident	71 Å²	71	28.8 Å²	28.8	27%	0.268	16%	0.159	S	C	.	.			trans	-102	2.7	178.1	-63.9	-62	-66.1	-95.3	2.8	113.5	L323 D327 L357 H360 P365 F366	L323-R362 HydrophobicContact CD2-CB 4.32Å; L323-R362 HydrophobicContact CD2-CG 4.16Å; L323-R362 VanDerWaalsContact O-CZ 3.24Å; L323-R362 PolarHBondContact O-NH1 3.2Å; L323-R362 PolarHBondContact O-NH2 3.36Å; D327-R362 IonicContact OD1-NH2 2.81Å; D327-R362 PolarHBondContact OD1-NH2 3.12Å; D327-R362 IonicContact OD2-CZ 3.02Å; D327-R362 IonicContact OD2-NH1 3.5Å; D327-R362 IonicContact OD2-NH2 2.78Å; D327-R362 PolarHBondContact OD2-NH2 3.04Å; L357-R362 HydrophobicContact CD2-CB 4.05Å; L357-R362 PolarHBondContact O-N 2.91Å; H360-R362 HydrophobicContact CB-CG 4.35Å; H360-R362 PolarHBondContact O-N 2.99Å; R362-P365 WeakPolarHBondContact O-CD 3.47Å; R362-F366 PolarHBondContact O-N 2.86Å
363	F	89.8	Confident	89.1	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-48.3	-177.8	-178.3	-93.8	0	0	0	114.2	V354 L357 L358 F366 V367 C394 M398 V470	V354-F363 HydrophobicContact CB-CE2 4.43Å; V354-F363 HydrophobicContact CG1-CD2 4.17Å; V354-F363 HydrophobicContact CG1-CE2 3.82Å; V354-F363 HydrophobicContact CG2-CE2 4.1Å; L357-F363 HydrophobicContact CB-CB 4.15Å; L357-F363 HydrophobicContact CB-CD2 4.32Å; L357-F363 PolarHBondContact O-N 2.93Å; L358-F363 HydrophobicContact CD2-CB 3.79Å; L358-F363 HydrophobicContact CD2-CD1 4.11Å; L358-F363 HydrophobicContact CD2-CD2 4.18Å; L358-F363 HydrophobicContact CD2-CG 3.75Å; L358-F363 HydrophobicContact CG-CB 4.27Å; L358-F363 HydrophobicContact CG-CD2 4.23Å; L358-F363 HydrophobicContact CG-CG 4.25Å; F363-F366 WeakPolarHBondContact O-CB 3.36Å; F363-F366 PolarHBondContact O-N 2.55Å; F363-V367 HydrophobicContact CD1-CG1 4.22Å; F363-V367 HydrophobicContact CE1-CB 4.06Å; F363-V367 HydrophobicContact CE1-CG1 3.83Å; F363-V367 HydrophobicContact CE1-CG2 4.37Å; F363-V367 HydrophobicContact CZ-CB 4.08Å; F363-V367 HydrophobicContact CZ-CG1 4.34Å; F363-V367 HydrophobicContact CZ-CG2 4.1Å; F363-V367 PolarHBondContact O-N 3.1Å; F363-C394 HydrophobicContact CE2-CB 4.14Å; F363-C394 HydrophobicContact CZ-CB 4.33Å; F363-C394 WeakPolarHBondContact CZ-O 3.34Å; F363-M398 HydrophobicContact CD1-CG 4.1Å; F363-M398 HydrophobicContact CE1-CB 3.82Å; F363-M398 HydrophobicContact CE1-CE 4.09Å; F363-M398 HydrophobicContact CE1-CG 3.6Å; F363-M398 HydrophobicContact CE2-CB 3.99Å; F363-M398 HydrophobicContact CE2-CG 4.46Å; F363-M398 HydrophobicContact CZ-CB 3.45Å; F363-M398 VanDerWaalsContact CZ-CB 3.45Å; F363-M398 HydrophobicContact CZ-CG 3.81Å; F363-V470 HydrophobicContact CD1-CG2 4.21Å; F363-V470 HydrophobicContact CE1-CG2 3.92Å
364	V	87.3	Confident	88.9	Confident	35 Å²	35	30.6 Å²	30.6	21%	0.212	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-46.9	-175.3	-178	0	0	0	0	112.3	F366 S368 L466 D469 V470	V364-F366 PolarHBondContact O-N 3.04Å; V364-S368 VanDerWaalsContact O-CB 3.3Å; V364-S368 WeakPolarHBondContact O-CB 3.35Å; V364-S368 PolarHBondContact O-N 2.85Å; V364-S368 VanDerWaalsContact O-N 3.07Å; V364-S368 PolarHBondContact O-OG 3.5Å; V364-L466 HydrophobicContact CG2-CD1 3.42Å; V364-L466 VanDerWaalsContact CG2-CD1 3.42Å; V364-D469 HydrophobicContact CG2-CB 4.45Å; V364-V470 HydrophobicContact CG2-CG2 4Å
365	P	90.6	Very high	88.7	Confident	63 Å²	63	30.8 Å²	30.8	41%	0.409	17%	0.168	S	C	.	.	H	α-helix	trans	-58.6	-44.3	173.8	-26.2	35.9	0	0	0	113.1	P326 R362 A369	P326-P365 HydrophobicContact CB-CB 3.83Å; P326-P365 HydrophobicContact CG-CB 4.34Å; R362-P365 WeakPolarHBondContact O-CD 3.47Å; P365-A369 PolarHBondContact O-N 3.44Å
366	F	93.1	Very high	88.4	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-55.5	179.3	-179.2	-113.5	0	0	0	111.8	P326 I331 A336 M353 L357 R362 F363 V364 S368 A369 V370	P326-F366 HydrophobicContact CG-CB 3.93Å; I331-F366 HydrophobicContact CD1-CD2 4.19Å; I331-F366 HydrophobicContact CD1-CE2 4.22Å; A336-F366 HydrophobicContact CB-CD2 4.21Å; A336-F366 HydrophobicContact CB-CE1 4.39Å; A336-F366 HydrophobicContact CB-CE2 3.41Å; A336-F366 VanDerWaalsContact CB-CE2 3.41Å; A336-F366 HydrophobicContact CB-CZ 3.51Å; M353-F366 HydrophobicContact CE-CE1 3.85Å; M353-F366 HydrophobicContact CE-CZ 4.23Å; M353-F366 HydrophobicContact SD-CE1 4.35Å; M353-F366 HydrophobicContact SD-CZ 4.3Å; L357-F366 HydrophobicContact CD1-CB 4.13Å; L357-F366 HydrophobicContact CD1-CD1 3.45Å; L357-F366 VanDerWaalsContact CD1-CD1 3.45Å; L357-F366 HydrophobicContact CD1-CE1 3.96Å; L357-F366 HydrophobicContact CD1-CG 3.79Å; R362-F366 PolarHBondContact O-N 2.86Å; F363-F366 WeakPolarHBondContact O-CB 3.36Å; F363-F366 PolarHBondContact O-N 2.55Å; V364-F366 PolarHBondContact O-N 3.04Å; F366-S368 VanDerWaalsContact C-N 3.26Å; F366-S368 PolarHBondContact O-N 3.47Å; F366-A369 PolarHBondContact O-N 2.96Å; F366-A369 VanDerWaalsContact O-N 3.13Å; F366-V370 HydrophobicContact CD1-CG2 4.44Å; F366-V370 HydrophobicContact CD2-CG2 4.21Å; F366-V370 HydrophobicContact CE1-CG2 4.03Å; F366-V370 HydrophobicContact CE2-CG2 3.75Å; F366-V370 HydrophobicContact CZ-CG2 3.67Å; F366-V370 WeakPolarHBondContact O-CG2 3.38Å; F366-V370 PolarHBondContact O-N 3.28Å
367	V	93.1	Very high	88	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-66.2	-32.4	-174.2	79	0	0	0	0	111.7	F363 A371 C394 I395 V470	F363-V367 HydrophobicContact CD1-CG1 4.22Å; F363-V367 HydrophobicContact CE1-CB 4.06Å; F363-V367 HydrophobicContact CE1-CG1 3.83Å; F363-V367 HydrophobicContact CE1-CG2 4.37Å; F363-V367 HydrophobicContact CZ-CB 4.08Å; F363-V367 HydrophobicContact CZ-CG1 4.34Å; F363-V367 HydrophobicContact CZ-CG2 4.1Å; F363-V367 PolarHBondContact O-N 3.1Å; V367-A371 WeakPolarHBondContact O-CB 3.45Å; V367-A371 PolarHBondContact O-N 3.39Å; V367-C394 HydrophobicContact CG2-CB 4.31Å; V367-I395 HydrophobicContact CG2-CD1 3.89Å; V367-I395 HydrophobicContact CG2-CG1 3.47Å; V367-I395 VanDerWaalsContact CG2-CG1 3.47Å; V367-V470 HydrophobicContact CG1-CG1 4.3Å; V367-V470 HydrophobicContact CG1-CG2 4.29Å
368	S	91.9	Very high	87.6	Confident	23 Å²	23	38.1 Å²	38.1	16%	0.161	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-41.4	175.2	-56.7	0	0	0	0	111.5	V364 F366 A372 S473 L477	V364-S368 VanDerWaalsContact O-CB 3.3Å; V364-S368 WeakPolarHBondContact O-CB 3.35Å; V364-S368 PolarHBondContact O-N 2.85Å; V364-S368 VanDerWaalsContact O-N 3.07Å; V364-S368 PolarHBondContact O-OG 3.5Å; F366-S368 VanDerWaalsContact C-N 3.26Å; F366-S368 PolarHBondContact O-N 3.47Å; S368-A372 WeakPolarHBondContact O-CB 3.47Å; S368-A372 PolarHBondContact O-N 2.84Å; S368-S473 WeakPolarHBondContact CB-OG 3.25Å; S368-S473 PolarHBondContact OG-OG 2.69Å; S368-L477 WeakPolarHBondContact O-CD1 3.31Å
369	A	91.7	Very high	87.1	Confident	30 Å²	30	46.3 Å²	46.3	25%	0.248	25%	0.252	C	S	.	.	H	α-helix	trans	-67.8	-43.8	177.1	0	0	0	0	0	112.2	I331 P365 F366 A372 L373	I331-A369 HydrophobicContact CB-CB 4.24Å; I331-A369 HydrophobicContact CD1-CB 3.91Å; I331-A369 HydrophobicContact CG1-CB 3.85Å; P365-A369 PolarHBondContact O-N 3.44Å; F366-A369 PolarHBondContact O-N 2.96Å; F366-A369 VanDerWaalsContact O-N 3.13Å; A369-A372 PolarHBondContact O-N 2.93Å; A369-L373 PolarHBondContact O-N 3.32Å; A369-L373 VanDerWaalsContact O-N 3.12Å
370	V	91.5	Very high	86.8	Confident	6 Å²	6	48.9 Å²	48.9	4%	0.036	27%	0.266	C	S	.	.	H	α-helix	trans	-68	-39	177.7	-176.6	0	0	0	0	111.3	I331 F366 L373 E374 L390 A391	I331-V370 HydrophobicContact CG1-CG2 3.87Å; F366-V370 HydrophobicContact CD1-CG2 4.44Å; F366-V370 HydrophobicContact CD2-CG2 4.21Å; F366-V370 HydrophobicContact CE1-CG2 4.03Å; F366-V370 HydrophobicContact CE2-CG2 3.75Å; F366-V370 HydrophobicContact CZ-CG2 3.67Å; F366-V370 WeakPolarHBondContact O-CG2 3.38Å; F366-V370 PolarHBondContact O-N 3.28Å; V370-L373 PolarHBondContact O-N 3.18Å; V370-E374 PolarHBondContact O-N 3.13Å; V370-L390 HydrophobicContact CG1-CB 4.18Å; V370-L390 HydrophobicContact CG1-CD2 4.12Å; V370-L390 HydrophobicContact CG1-CG 4.2Å; V370-A391 HydrophobicContact CB-CB 4.45Å; V370-A391 HydrophobicContact CG1-CB 3.96Å
371	A	90.8	Very high	86.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.2	-36.3	175.5	0	0	0	0	0	112.3	V367 E374 L375 F385 A391 L474 L477	V367-A371 WeakPolarHBondContact O-CB 3.45Å; V367-A371 PolarHBondContact O-N 3.39Å; A371-E374 PolarHBondContact O-N 3.25Å; A371-L375 WeakPolarHBondContact O-CB 3.48Å; A371-L375 WeakPolarHBondContact O-CG 3.45Å; A371-L375 PolarHBondContact O-N 3.03Å; A371-F385 HydrophobicContact CB-CE1 4.04Å; A371-F385 HydrophobicContact CB-CZ 3.92Å; A371-A391 HydrophobicContact CB-CB 4.26Å; A371-L474 HydrophobicContact CB-CD2 3.74Å; A371-L477 HydrophobicContact CB-CD1 4.24Å
372	A	90.2	Very high	85.7	Confident	28 Å²	28	46.5 Å²	46.5	23%	0.231	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-45.7	173.3	0	0	0	0	0	111.3	S368 A369 E374 L375 D376 L477	S368-A372 WeakPolarHBondContact O-CB 3.47Å; S368-A372 PolarHBondContact O-N 2.84Å; A369-A372 PolarHBondContact O-N 2.93Å; A372-E374 VanDerWaalsContact C-N 3.31Å; A372-E374 PolarHBondContact O-N 3.1Å; A372-L375 PolarHBondContact O-N 2.78Å; A372-L375 VanDerWaalsContact O-N 3.16Å; A372-D376 PolarHBondContact O-N 3.19Å; A372-L477 HydrophobicContact CB-CD1 4.43Å; A372-L477 HydrophobicContact CB-CD2 4.09Å
373	L	88.1	Confident	85.1	Confident	13 Å²	13	46.3 Å²	46.3	7%	0.068	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-40.2	175.3	177.4	63.1	0	0	0	112.3	I331 A369 V370 N377	I331-L373 HydrophobicContact CG2-CB 3.92Å; I331-L373 HydrophobicContact CG2-CD2 3.68Å; I331-L373 HydrophobicContact CG2-CG 4.35Å; A369-L373 PolarHBondContact O-N 3.32Å; A369-L373 VanDerWaalsContact O-N 3.12Å; V370-L373 PolarHBondContact O-N 3.18Å; L373-N377 PolarHBondContact O-N 3.45Å; L373-N377 PolarHBondContact O-ND2 2.99Å
374	E	87.4	Confident	84.7	Confident	34 Å²	34	46.3 Å²	46.3	16%	0.159	26%	0.258	C	S	.	.	H	α-helix	trans	-66.2	-40.8	175.6	-176.7	176.7	162.2	0	0	112.4	V370 A371 A372 D376 N377 T378 F385 S389 A391	V370-E374 PolarHBondContact O-N 3.13Å; A371-E374 PolarHBondContact O-N 3.25Å; A372-E374 VanDerWaalsContact C-N 3.31Å; A372-E374 PolarHBondContact O-N 3.1Å; E374-D376 VanDerWaalsContact C-N 3.34Å; E374-D376 PolarHBondContact O-N 3.26Å; E374-N377 PolarHBondContact O-N 3.24Å; E374-T378 PolarHBondContact O-N 3.14Å; E374-T378 VanDerWaalsContact O-N 3.17Å; E374-T378 PolarHBondContact O-OG1 3.5Å; E374-F385 HydrophobicContact CB-CE1 4.41Å; E374-F385 HydrophobicContact CG-CE1 4.33Å; E374-F385 WeakPolarHBondContact OE1-CD1 3.3Å; E374-S389 PolarHBondContact OE1-OG 3.11Å; E374-S389 WeakPolarHBondContact OE2-CB 3.26Å; E374-S389 PolarHBondContact OE2-OG 2.99Å; E374-A391 WeakPolarHBondContact OE2-CB 3.48Å
375	L	86.6	Confident	84.3	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-67.5	-33	178.3	-75.7	169.3	0	0	0	112.8	A371 A372 N377 T378 I384 F385 L477 R481	A371-L375 WeakPolarHBondContact O-CB 3.48Å; A371-L375 WeakPolarHBondContact O-CG 3.45Å; A371-L375 PolarHBondContact O-N 3.03Å; A372-L375 PolarHBondContact O-N 2.78Å; A372-L375 VanDerWaalsContact O-N 3.16Å; L375-N377 VanDerWaalsContact C-N 3.27Å; L375-N377 PolarHBondContact O-N 3.14Å; L375-T378 PolarHBondContact O-N 2.81Å; L375-I384 HydrophobicContact CD2-CD1 4.5Å; L375-I384 HydrophobicContact CD2-CG1 4.24Å; L375-I384 HydrophobicContact CD2-CG2 3.77Å; L375-F385 HydrophobicContact CD1-CE2 4.25Å; L375-F385 HydrophobicContact CD1-CZ 3.82Å; L375-F385 HydrophobicContact CD2-CE2 4.05Å; L375-F385 HydrophobicContact CD2-CZ 3.91Å; L375-F385 HydrophobicContact CG-CE1 4.37Å; L375-F385 HydrophobicContact CG-CE2 4.25Å; L375-F385 HydrophobicContact CG-CZ 3.66Å; L375-L477 HydrophobicContact CD1-CB 3.61Å; L375-R481 PolarHBondContact O-NE 2.87Å
376	D	84.1	Confident	83.6	Confident	104 Å²	104	47.9 Å²	47.9	56%	0.556	25%	0.252	S	S	*	.	H	α-helix	trans	-63.4	-37.9	175.1	-71.4	-20.6	0	0	0	111.1	A372 E374 T378	A372-D376 PolarHBondContact O-N 3.19Å; E374-D376 VanDerWaalsContact C-N 3.34Å; E374-D376 PolarHBondContact O-N 3.26Å; D376-T378 VanDerWaalsContact C-N 3.34Å
377	N	79.9	Confident	82.8	Confident	112 Å²	112	49.8 Å²	49.8	60%	0.599	27%	0.272	S	S	*	.	H	α-helix	trans	-80.1	-11.1	177.5	-66.6	-34.9	0	0	0	114.2	L373 E374 L375	L373-N377 PolarHBondContact O-N 3.45Å; L373-N377 PolarHBondContact O-ND2 2.99Å; E374-N377 PolarHBondContact O-N 3.24Å; L375-N377 VanDerWaalsContact C-N 3.27Å; L375-N377 PolarHBondContact O-N 3.14Å
378	T	81.4	Confident	82.3	Confident	18 Å²	18	54.8 Å²	54.8	11%	0.11	30%	0.299	C	S	.	.			trans	-85.7	120.2	-176.8	-58.9	0	0	0	0	111	E374 L375 D376 E380 I384	E374-T378 PolarHBondContact O-N 3.14Å; E374-T378 VanDerWaalsContact O-N 3.17Å; E374-T378 PolarHBondContact O-OG1 3.5Å; L375-T378 PolarHBondContact O-N 2.81Å; D376-T378 VanDerWaalsContact C-N 3.34Å; T378-E380 WeakPolarHBondContact CG2-O 3.42Å; T378-I384 HydrophobicContact CG2-CG1 4.01Å
379	Q	75.4	Confident	82.1	Confident	181 Å²	181	54.7 Å²	54.7	85%	0.846	30%	0.298	S	S	*	.			trans	-86.3	-34.4	-179.1	-62.5	-172	1.4	0	0	113.5
380	E	76.2	Confident	81.9	Confident	120 Å²	120	54 Å²	54	56%	0.561	29%	0.29	S	S	*	.			trans	-112.7	135.9	-174.8	-67	-174.8	-176.3	0	0	112.8	T378 N382 T383	T378-E380 WeakPolarHBondContact CG2-O 3.42Å; E380-N382 PolarHBondContact O-N 3.19Å; E380-T383 HydrophobicContact CB-CG2 4.33Å; E380-T383 PolarHBondContact O-N 3.06Å; E380-T383 PolarHBondContact O-OG1 2.82Å
381	A	71.9	Confident	81.9	Confident	24 Å²	24	53.8 Å²	53.8	20%	0.198	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-58.7	-29	175.3	0	0	0	0	0	113.8	T383 I384 F482 V488	A381-T383 VanDerWaalsContact C-N 3.32Å; A381-T383 PolarHBondContact O-N 3.25Å; A381-I384 WeakPolarHBondContact O-CD1 3.36Å; A381-I384 WeakPolarHBondContact O-CG1 3.17Å; A381-F482 HydrophobicContact CB-CD1 4.39Å; A381-F482 HydrophobicContact CB-CE1 4.42Å; A381-V488 HydrophobicContact CB-CG2 3.59Å
382	N	71.1	Confident	81.9	Confident	106 Å²	106	53.8 Å²	53.8	57%	0.567	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-81	-7.2	-176.2	-69.2	-36.3	0	0	0	114.2	E380 R386	E380-N382 PolarHBondContact O-N 3.19Å; N382-R386 VanDerWaalsContact O-CD 3.25Å; N382-R386 WeakPolarHBondContact O-CD 3.48Å; N382-R386 PolarHBondContact O-NE 3.06Å; N382-R386 PolarHBondContact O-NH1 2.96Å
383	T	76.1	Confident	81.9	Confident	68 Å²	68	55.9 Å²	55.9	42%	0.417	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-110.1	-4.4	-177.8	57.8	0	0	0	0	113.6	E380 A381 F385 R386	E380-T383 HydrophobicContact CB-CG2 4.33Å; E380-T383 PolarHBondContact O-N 3.06Å; E380-T383 PolarHBondContact O-OG1 2.82Å; A381-T383 VanDerWaalsContact C-N 3.32Å; A381-T383 PolarHBondContact O-N 3.25Å; T383-F385 PolarHBondContact O-N 3.24Å; T383-R386 PolarHBondContact O-N 3.46Å; T383-R386 VanDerWaalsContact O-N 3.1Å
384	I	80	Confident	82.2	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	120.3	179.8	-63.9	170.2	0	0	0	111.2	L375 T378 A381 R386 F482 V488 A492	L375-I384 HydrophobicContact CD2-CD1 4.5Å; L375-I384 HydrophobicContact CD2-CG1 4.24Å; L375-I384 HydrophobicContact CD2-CG2 3.77Å; T378-I384 HydrophobicContact CG2-CG1 4.01Å; A381-I384 WeakPolarHBondContact O-CD1 3.36Å; A381-I384 WeakPolarHBondContact O-CG1 3.17Å; I384-R386 PolarHBondContact O-N 2.93Å; I384-F482 HydrophobicContact CD1-CD2 3.68Å; I384-F482 HydrophobicContact CD1-CE2 3.41Å; I384-F482 VanDerWaalsContact CD1-CE2 3.41Å; I384-F482 HydrophobicContact CD1-CZ 4.14Å; I384-F482 HydrophobicContact CG1-CE2 3.99Å; I384-F482 HydrophobicContact CG1-CZ 4.47Å; I384-V488 HydrophobicContact CD1-CG1 3.43Å; I384-V488 VanDerWaalsContact CD1-CG1 3.43Å; I384-V488 HydrophobicContact CD1-CG2 4.46Å; I384-A492 HydrophobicContact CG2-CB 4.13Å
385	F	80.2	Confident	82.4	Confident	1 Å²	1	53.7 Å²	53.7	0%	0.004	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	24.5	177.6	-54.8	-53.9	0	0	0	115	A371 E374 L375 T383 T392 L474 A492 F496 R500	A371-F385 HydrophobicContact CB-CE1 4.04Å; A371-F385 HydrophobicContact CB-CZ 3.92Å; E374-F385 HydrophobicContact CB-CE1 4.41Å; E374-F385 HydrophobicContact CG-CE1 4.33Å; E374-F385 WeakPolarHBondContact OE1-CD1 3.3Å; L375-F385 HydrophobicContact CD1-CE2 4.25Å; L375-F385 HydrophobicContact CD1-CZ 3.82Å; L375-F385 HydrophobicContact CD2-CE2 4.05Å; L375-F385 HydrophobicContact CD2-CZ 3.91Å; L375-F385 HydrophobicContact CG-CE1 4.37Å; L375-F385 HydrophobicContact CG-CE2 4.25Å; L375-F385 HydrophobicContact CG-CZ 3.66Å; T383-F385 PolarHBondContact O-N 3.24Å; F385-T392 HydrophobicContact CB-CG2 3.95Å; F385-T392 HydrophobicContact CD1-CG2 4.13Å; F385-T392 HydrophobicContact CG-CG2 4.5Å; F385-L474 HydrophobicContact CE2-CD2 3.92Å; F385-L474 HydrophobicContact CZ-CD2 3.87Å; F385-A492 HydrophobicContact CD2-CB 4.26Å; F385-A492 HydrophobicContact CE2-CB 4.42Å; F385-F496 HydrophobicContact CB-CE2 3.61Å; F385-F496 HydrophobicContact CB-CZ 3.69Å; F385-F496 HydrophobicContact CD1-CE2 4.29Å; F385-F496 HydrophobicContact CD1-CZ 4.15Å; F385-F496 AromaticContact CD2-CE2 3.73Å; F385-F496 HydrophobicContact CD2-CE2 3.73Å; F385-F496 HydrophobicContact CD2-CZ 4.39Å; F385-F496 AromaticContact CG-CE2 3.62Å; F385-F496 HydrophobicContact CG-CE2 3.62Å; F385-F496 AromaticContact CG-CZ 3.83Å; F385-F496 HydrophobicContact CG-CZ 3.83Å; F385-R500 PolarHBondContact O-NE 3.24Å; F385-R500 PolarHBondContact O-NH2 3.47Å
386	R	75.4	Confident	82.6	Confident	130 Å²	130	54.2 Å²	54.2	49%	0.491	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-18	173.6	-67.7	-168.5	176.5	171.1	-3.7	113.4	N382 T383 I384 R500	N382-R386 VanDerWaalsContact O-CD 3.25Å; N382-R386 WeakPolarHBondContact O-CD 3.48Å; N382-R386 PolarHBondContact O-NE 3.06Å; N382-R386 PolarHBondContact O-NH1 2.96Å; T383-R386 PolarHBondContact O-N 3.46Å; T383-R386 VanDerWaalsContact O-N 3.1Å; I384-R386 PolarHBondContact O-N 2.93Å; R386-R500 VanDerWaalsContact C-NH2 3.27Å; R386-R500 PolarHBondContact O-NH2 2.85Å
387	G	76.8	Confident	82.8	Confident	41 Å²	41	50.6 Å²	50.6	42%	0.423	26%	0.264	S	S	.	.	S	Bend	trans	-80	176	178.1	0	0	0	0	0	114.3	T392 R500	G387-T392 PolarHBondContact O-OG1 2.97Å; G387-R500 PolarHBondContact O-NH2 2.89Å
388	N	81.6	Confident	83.4	Confident	107 Å²	107	45.2 Å²	45.2	57%	0.572	24%	0.235	S	C	*	.			trans	-93.2	109.7	165.9	-72.5	-42	0	0	0	108.1	Y347 R393	Y347-N388 PolarHBondContact OH-O 3.45Å; N388-R393 PolarHBondContact OD1-NH2 3.08Å
389	S	87.1	Confident	83.8	Confident	21 Å²	21	44.4 Å²	44.4	15%	0.147	23%	0.23	C	C	.	.			trans	-134.2	166.7	-177.1	70.1	0	0	0	0	110.2	E374 A391 T392 R393	E374-S389 PolarHBondContact OE1-OG 3.11Å; E374-S389 WeakPolarHBondContact OE2-CB 3.26Å; E374-S389 PolarHBondContact OE2-OG 2.99Å; S389-A391 VanDerWaalsContact C-N 3.32Å; S389-A391 PolarHBondContact O-N 3.24Å; S389-T392 PolarHBondContact N-OG1 2.79Å; S389-T392 PolarHBondContact O-N 2.85Å; S389-T392 PolarHBondContact O-OG1 3.43Å; S389-T392 WeakPolarHBondContact OG-CB 3.36Å; S389-T392 WeakPolarHBondContact OG-CG2 3.45Å; S389-T392 PolarHBondContact OG-N 2.93Å; S389-T392 PolarHBondContact OG-OG1 3.46Å; S389-R393 WeakPolarHBondContact O-CB 3.47Å; S389-R393 VanDerWaalsContact O-CG 3.25Å; S389-R393 WeakPolarHBondContact O-CG 3.4Å; S389-R393 PolarHBondContact O-N 3.37Å
390	L	89.1	Confident	84.3	Confident	15 Å²	15	40 Å²	40	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-43.9	174.5	-177	60	0	0	0	111.6	V350 M353 V370 R393 C394	V350-L390 HydrophobicContact CG2-CD1 3.84Å; M353-L390 HydrophobicContact CE-CD1 4.2Å; V370-L390 HydrophobicContact CG1-CB 4.18Å; V370-L390 HydrophobicContact CG1-CD2 4.12Å; V370-L390 HydrophobicContact CG1-CG 4.2Å; L390-R393 PolarHBondContact O-N 2.81Å; L390-C394 WeakPolarHBondContact O-CB 3.44Å; L390-C394 PolarHBondContact O-N 2.94Å; L390-C394 PolarHBondContact O-SG 3.12Å
391	A	90.7	Very high	84.6	Confident	1 Å²	1	36 Å²	36	1%	0.008	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-48.8	179.7	0	0	0	0	0	111.3	V370 A371 E374 S389 R393 C394 I395	V370-A391 HydrophobicContact CB-CB 4.45Å; V370-A391 HydrophobicContact CG1-CB 3.96Å; A371-A391 HydrophobicContact CB-CB 4.26Å; E374-A391 WeakPolarHBondContact OE2-CB 3.48Å; S389-A391 VanDerWaalsContact C-N 3.32Å; S389-A391 PolarHBondContact O-N 3.24Å; A391-R393 VanDerWaalsContact C-N 3.3Å; A391-R393 PolarHBondContact O-N 3.2Å; A391-C394 PolarHBondContact O-N 3.16Å; A391-I395 WeakPolarHBondContact O-CD1 3.5Å; A391-I395 VanDerWaalsContact O-CG1 3.27Å; A391-I395 WeakPolarHBondContact O-CG1 3.38Å; A391-I395 PolarHBondContact O-N 3.41Å
392	T	90.8	Very high	85.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-39.8	-179	52.1	0	0	0	0	111.7	F385 G387 S389 I395 D396 F496	F385-T392 HydrophobicContact CB-CG2 3.95Å; F385-T392 HydrophobicContact CD1-CG2 4.13Å; F385-T392 HydrophobicContact CG-CG2 4.5Å; G387-T392 PolarHBondContact O-OG1 2.97Å; S389-T392 PolarHBondContact N-OG1 2.79Å; S389-T392 PolarHBondContact O-N 2.85Å; S389-T392 PolarHBondContact O-OG1 3.43Å; S389-T392 WeakPolarHBondContact OG-CB 3.36Å; S389-T392 WeakPolarHBondContact OG-CG2 3.45Å; S389-T392 PolarHBondContact OG-N 2.93Å; S389-T392 PolarHBondContact OG-OG1 3.46Å; T392-I395 PolarHBondContact O-N 2.82Å; T392-D396 WeakPolarHBondContact O-CB 3.27Å; T392-D396 PolarHBondContact O-N 3.17Å; T392-F496 HydrophobicContact CG2-CE1 3.96Å; T392-F496 HydrophobicContact CG2-CZ 3.77Å
393	R	90.8	Very high	85.7	Confident	73 Å²	73	30.7 Å²	30.7	28%	0.275	16%	0.159	S	C	.	.	H	α-helix	trans	-67.7	-41.7	175.8	-68.5	-65.2	-179.3	-176	-2.4	113.3	Y347 V350 N388 S389 L390 A391 I395 D396 D397	Y347-R393 HydrophobicContact CD1-CB 4.37Å; Y347-R393 HydrophobicContact CD1-CG 3.99Å; Y347-R393 HydrophobicContact CD2-CG 4.17Å; Y347-R393 HydrophobicContact CE1-CG 3.97Å; Y347-R393 HydrophobicContact CE2-CG 4.15Å; Y347-R393 HydrophobicContact CG-CG 4.08Å; V350-R393 HydrophobicContact CG1-CB 4.24Å; N388-R393 PolarHBondContact OD1-NH2 3.08Å; S389-R393 WeakPolarHBondContact O-CB 3.47Å; S389-R393 VanDerWaalsContact O-CG 3.25Å; S389-R393 WeakPolarHBondContact O-CG 3.4Å; S389-R393 PolarHBondContact O-N 3.37Å; L390-R393 PolarHBondContact O-N 2.81Å; A391-R393 VanDerWaalsContact C-N 3.3Å; A391-R393 PolarHBondContact O-N 3.2Å; R393-I395 VanDerWaalsContact C-N 3.3Å; R393-I395 PolarHBondContact O-N 3.49Å; R393-D396 PolarHBondContact O-N 2.95Å; R393-D397 PolarHBondContact O-N 2.77Å
394	C	92.5	Very high	85.9	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-59.7	-42.9	175.5	-70.7	0	0	0	0	111.6	V354 F363 V367 L390 A391 M398	V354-C394 HydrophobicContact CG2-CB 4.01Å; F363-C394 HydrophobicContact CE2-CB 4.14Å; F363-C394 HydrophobicContact CZ-CB 4.33Å; F363-C394 WeakPolarHBondContact CZ-O 3.34Å; V367-C394 HydrophobicContact CG2-CB 4.31Å; L390-C394 WeakPolarHBondContact O-CB 3.44Å; L390-C394 PolarHBondContact O-N 2.94Å; L390-C394 PolarHBondContact O-SG 3.12Å; A391-C394 PolarHBondContact O-N 3.16Å; C394-M398 WeakPolarHBondContact O-CB 3.48Å; C394-M398 PolarHBondContact O-N 3.35Å
395	I	92.4	Very high	85.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.8	-42.4	178.4	-61.4	161.5	0	0	0	110.3	V367 A391 T392 R393 D397 M398 M399 V470 L474 F496	V367-I395 HydrophobicContact CG2-CD1 3.89Å; V367-I395 HydrophobicContact CG2-CG1 3.47Å; V367-I395 VanDerWaalsContact CG2-CG1 3.47Å; A391-I395 WeakPolarHBondContact O-CD1 3.5Å; A391-I395 VanDerWaalsContact O-CG1 3.27Å; A391-I395 WeakPolarHBondContact O-CG1 3.38Å; A391-I395 PolarHBondContact O-N 3.41Å; T392-I395 PolarHBondContact O-N 2.82Å; R393-I395 VanDerWaalsContact C-N 3.3Å; R393-I395 PolarHBondContact O-N 3.49Å; I395-D397 PolarHBondContact O-N 2.77Å; I395-M398 HydrophobicContact CG2-CE 4.06Å; I395-M398 PolarHBondContact O-N 3.26Å; I395-M399 HydrophobicContact CG2-CE 4.07Å; I395-M399 HydrophobicContact CG2-CG 4.16Å; I395-M399 HydrophobicContact CG2-SD 4.17Å; I395-M399 WeakPolarHBondContact O-CB 3.45Å; I395-M399 VanDerWaalsContact O-CG 3.27Å; I395-M399 WeakPolarHBondContact O-CG 3.44Å; I395-M399 PolarHBondContact O-N 3.2Å; I395-V470 HydrophobicContact CG1-CG1 4.27Å; I395-V470 HydrophobicContact CG2-CG1 4.47Å; I395-L474 HydrophobicContact CD1-CD1 3.84Å; I395-L474 HydrophobicContact CD1-CD2 4.08Å; I395-F496 HydrophobicContact CB-CD1 4.04Å; I395-F496 HydrophobicContact CB-CE1 3.77Å; I395-F496 HydrophobicContact CB-CZ 4.37Å; I395-F496 HydrophobicContact CD1-CD1 4.45Å; I395-F496 HydrophobicContact CD1-CE1 3.73Å; I395-F496 HydrophobicContact CD1-CE2 3.92Å; I395-F496 HydrophobicContact CD1-CZ 3.4Å; I395-F496 VanDerWaalsContact CD1-CZ 3.4Å; I395-F496 HydrophobicContact CG1-CE1 4.35Å; I395-F496 HydrophobicContact CG1-CZ 4.48Å; I395-F496 HydrophobicContact CG2-CD1 3.53Å; I395-F496 HydrophobicContact CG2-CE1 3.79Å; I395-F496 HydrophobicContact CG2-CG 4.03Å; I395-F496 HydrophobicContact CG2-CZ 4.45Å
396	D	90.3	Very high	85.8	Confident	15 Å²	15	35.1 Å²	35.1	8%	0.08	18%	0.179	C	C	.	.	H	α-helix	trans	-57.3	-46.9	177.4	-73.1	-14.9	0	0	0	111.9	T392 R393 M399 K400 R500	T392-D396 WeakPolarHBondContact O-CB 3.27Å; T392-D396 PolarHBondContact O-N 3.17Å; R393-D396 PolarHBondContact O-N 2.95Å; D396-M399 PolarHBondContact O-N 3.17Å; D396-K400 WeakPolarHBondContact O-CG 3.1Å; D396-K400 PolarHBondContact O-N 3.24Å; D396-K400 VanDerWaalsContact O-N 3.1Å; D396-R500 WeakPolarHBondContact OD1-CB 3.39Å; D396-R500 WeakPolarHBondContact OD1-CD 3.09Å; D396-R500 IonicContact OD2-NH1 3.62Å; D396-R500 PolarHBondContact OD2-NH1 2.96Å
397	D	89.8	Confident	86.4	Confident	27 Å²	27	28.9 Å²	28.9	14%	0.144	16%	0.156	C	C	.	.	H	α-helix	trans	-71.1	-38.4	179.5	-73.4	-17.9	0	0	0	112.1	L351 V354 R393 I395 M399 K400 I401	L351-D397 HydrophobicContact CD1-CB 4.07Å; V354-D397 HydrophobicContact CG1-CB 4.42Å; R393-D397 PolarHBondContact O-N 2.77Å; I395-D397 PolarHBondContact O-N 2.77Å; D397-M399 PolarHBondContact O-N 2.89Å; D397-K400 PolarHBondContact O-N 3.4Å; D397-K400 IonicContact OD1-NZ 3.32Å; D397-K400 PolarHBondContact OD1-NZ 3.47Å; D397-I401 WeakPolarHBondContact O-CD1 3.32Å; D397-I401 VanDerWaalsContact O-CG1 3.27Å; D397-I401 WeakPolarHBondContact O-CG1 3.49Å; D397-I401 PolarHBondContact O-N 3.1Å
398	M	91.2	Very high	86.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.7	-46.7	172.1	175.7	-81.5	-59.2	0	0	111.7	V354 L358 F363 C394 I395 K400 I401 V402 M467 V470	V354-M398 HydrophobicContact CG1-CB 4.19Å; L358-M398 HydrophobicContact CD1-CG 4.39Å; L358-M398 HydrophobicContact CD2-CG 3.89Å; F363-M398 HydrophobicContact CD1-CG 4.1Å; F363-M398 HydrophobicContact CE1-CB 3.82Å; F363-M398 HydrophobicContact CE1-CE 4.09Å; F363-M398 HydrophobicContact CE1-CG 3.6Å; F363-M398 HydrophobicContact CE2-CB 3.99Å; F363-M398 HydrophobicContact CE2-CG 4.46Å; F363-M398 HydrophobicContact CZ-CB 3.45Å; F363-M398 VanDerWaalsContact CZ-CB 3.45Å; F363-M398 HydrophobicContact CZ-CG 3.81Å; C394-M398 WeakPolarHBondContact O-CB 3.48Å; C394-M398 PolarHBondContact O-N 3.35Å; I395-M398 HydrophobicContact CG2-CE 4.06Å; I395-M398 PolarHBondContact O-N 3.26Å; M398-K400 VanDerWaalsContact C-N 3.28Å; M398-K400 PolarHBondContact O-N 3.44Å; M398-I401 PolarHBondContact O-N 3.09Å; M398-V402 HydrophobicContact CG-CG2 4.03Å; M398-V402 WeakPolarHBondContact O-CB 3.31Å; M398-V402 WeakPolarHBondContact O-CG2 3.45Å; M398-V402 PolarHBondContact O-N 3.15Å; M398-V402 HydrophobicContact SD-CB 4.28Å; M398-V402 HydrophobicContact SD-CG2 4.09Å; M398-M467 HydrophobicContact CE-CG 4.44Å; M398-M467 HydrophobicContact SD-CG 3.85Å; M398-V470 HydrophobicContact CE-CB 4.17Å; M398-V470 HydrophobicContact CE-CG1 4.11Å; M398-V470 HydrophobicContact CE-CG2 3.99Å
399	M	90.1	Very high	86.6	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-36.5	178.9	-71.8	-169.3	-59.6	0	0	111.6	I395 D396 D397 G403 M467 F471 F496 R500 F501	I395-M399 HydrophobicContact CG2-CE 4.07Å; I395-M399 HydrophobicContact CG2-CG 4.16Å; I395-M399 HydrophobicContact CG2-SD 4.17Å; I395-M399 WeakPolarHBondContact O-CB 3.45Å; I395-M399 VanDerWaalsContact O-CG 3.27Å; I395-M399 WeakPolarHBondContact O-CG 3.44Å; I395-M399 PolarHBondContact O-N 3.2Å; D396-M399 PolarHBondContact O-N 3.17Å; D397-M399 PolarHBondContact O-N 2.89Å; M399-G403 WeakPolarHBondContact O-CA 3.43Å; M399-G403 PolarHBondContact O-N 2.73Å; M399-M467 HydrophobicContact CB-CE 4.44Å; M399-M467 HydrophobicContact CG-CE 3.99Å; M399-M467 HydrophobicContact SD-CE 4.3Å; M399-F471 HydrophobicContact SD-CE1 4.03Å; M399-F471 HydrophobicContact SD-CZ 3.9Å; M399-F496 HydrophobicContact CE-CB 4.11Å; M399-F496 HydrophobicContact CE-CD1 4.1Å; M399-F496 HydrophobicContact SD-CB 4.16Å; M399-R500 HydrophobicContact CE-CB 4.27Å; M399-F501 HydrophobicContact CB-CD2 3.72Å; M399-F501 HydrophobicContact CB-CE2 3.92Å; M399-F501 HydrophobicContact CB-CG 4.39Å; M399-F501 HydrophobicContact CE-CB 3.95Å; M399-F501 VanDerWaalsContact O-CE2 3.23Å; M399-F501 WeakPolarHBondContact O-CE2 3.31Å; M399-F501 HydrophobicContact SD-CB 3.94Å; M399-F501 HydrophobicContact SD-CD2 4.43Å; M399-F501 HydrophobicContact SD-CG 4.18Å
400	K	86.5	Confident	86.5	Confident	89 Å²	89	27.3 Å²	27.3	39%	0.387	15%	0.145	S	C	.	.	H	α-helix	trans	-66.3	-41.1	175	-73.1	169.6	-169.1	163	0	112.8	D396 D397 M398 F512	D396-K400 WeakPolarHBondContact O-CG 3.1Å; D396-K400 PolarHBondContact O-N 3.24Å; D396-K400 VanDerWaalsContact O-N 3.1Å; D397-K400 PolarHBondContact O-N 3.4Å; D397-K400 IonicContact OD1-NZ 3.32Å; D397-K400 PolarHBondContact OD1-NZ 3.47Å; M398-K400 VanDerWaalsContact C-N 3.28Å; M398-K400 PolarHBondContact O-N 3.44Å; K400-F512 HydrophobicContact CG-CD1 4.34Å; K400-F512 HydrophobicContact CG-CE1 3.7Å; K400-F512 HydrophobicContact CG-CZ 4.27Å
401	I	82.8	Confident	86.6	Confident	34 Å²	34	26.6 Å²	26.6	17%	0.174	14%	0.141	C	C	.	.	H	α-helix	trans	-71.1	-56.8	-179.3	-63.5	163	0	0	0	109.8	L351 V354 R355 L358 D397 M398 L739	L351-I401 HydrophobicContact CD1-CD1 3.99Å; V354-I401 HydrophobicContact CG1-CD1 4.31Å; R355-I401 HydrophobicContact CG-CD1 3.74Å; L358-I401 HydrophobicContact CD1-CD1 3.95Å; L358-I401 HydrophobicContact CD1-CG2 4.41Å; D397-I401 WeakPolarHBondContact O-CD1 3.32Å; D397-I401 VanDerWaalsContact O-CG1 3.27Å; D397-I401 WeakPolarHBondContact O-CG1 3.49Å; D397-I401 PolarHBondContact O-N 3.1Å; M398-I401 PolarHBondContact O-N 3.09Å; I401-L739 HydrophobicContact CG2-CD2 3.75Å
402	V	83	Confident	86.4	Confident	20 Å²	20	29.7 Å²	29.7	12%	0.121	15%	0.154	C	C	.	.	H	α-helix	trans	-77.3	-34.6	-171.9	-178.6	0	0	0	0	111.6	L358 M398 P464 L466 M467 L739	L358-V402 HydrophobicContact CD1-CG2 4.48Å; L358-V402 HydrophobicContact CD2-CG2 4.44Å; M398-V402 HydrophobicContact CG-CG2 4.03Å; M398-V402 WeakPolarHBondContact O-CB 3.31Å; M398-V402 WeakPolarHBondContact O-CG2 3.45Å; M398-V402 PolarHBondContact O-N 3.15Å; M398-V402 HydrophobicContact SD-CB 4.28Å; M398-V402 HydrophobicContact SD-CG2 4.09Å; V402-P464 HydrophobicContact CG1-CB 3.61Å; V402-P464 HydrophobicContact CG1-CG 4.08Å; V402-L466 HydrophobicContact CG1-CB 4.4Å; V402-L466 HydrophobicContact CG1-CD2 4.44Å; V402-L466 HydrophobicContact CG2-CD2 3.75Å; V402-M467 HydrophobicContact CG1-CG 4.25Å; V402-L739 HydrophobicContact CG2-CD2 4.02Å
403	G	82	Confident	86.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	0.9	-175.7	0	0	0	0	0	114.8	M399 S405 Y406 L407	M399-G403 WeakPolarHBondContact O-CA 3.43Å; M399-G403 PolarHBondContact O-N 2.73Å; G403-S405 PolarHBondContact O-N 2.84Å; G403-Y406 WeakPolarHBondContact O-CB 3.36Å; G403-Y406 PolarHBondContact O-N 2.69Å; G403-L407 WeakPolarHBondContact O-CG 3.43Å; G403-L407 PolarHBondContact O-N 3Å
404	K	81.1	Confident	86.3	Confident	101 Å²	101	30.9 Å²	30.9	44%	0.439	17%	0.171	S	C	.	.	H	α-helix	trans	-54.8	-51.1	-179.2	-180	179.3	171.4	-178.3	0	112.5	Y406 L407 A408	K404-Y406 VanDerWaalsContact C-N 3.35Å; K404-L407 PolarHBondContact O-N 3.35Å; K404-A408 PolarHBondContact O-N 3.46Å; K404-A408 VanDerWaalsContact O-N 3.07Å
405	S	75.5	Confident	86.2	Confident	54 Å²	54	30.9 Å²	30.9	38%	0.378	17%	0.171	S	C	.	.	H	α-helix	trans	-65	-40.6	178.3	55.1	0	0	0	0	111.7	G403 L407 A408 V409	G403-S405 PolarHBondContact O-N 2.84Å; S405-L407 PolarHBondContact O-N 2.87Å; S405-A408 PolarHBondContact O-N 3.3Å; S405-V409 WeakPolarHBondContact O-CG2 3.47Å; S405-V409 PolarHBondContact O-N 2.91Å
406	Y	82.2	Confident	85.9	Confident	7 Å²	7	32.8 Å²	32.8	3%	0.027	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-43.6	177.9	177	-128.8	0	0	0	112.3	G403 K404 V409 T410 S459 N462 C463 F501 F502	G403-Y406 WeakPolarHBondContact O-CB 3.36Å; G403-Y406 PolarHBondContact O-N 2.69Å; K404-Y406 VanDerWaalsContact C-N 3.35Å; Y406-V409 PolarHBondContact O-N 3.45Å; Y406-T410 WeakPolarHBondContact CE2-OG1 3.44Å; Y406-T410 VanDerWaalsContact O-CB 3.25Å; Y406-T410 WeakPolarHBondContact O-CB 3.17Å; Y406-T410 PolarHBondContact O-N 3.07Å; Y406-T410 PolarHBondContact O-OG1 3.17Å; Y406-S459 WeakPolarHBondContact CE2-O 3.31Å; Y406-S459 PolarHBondContact OH-O 3.43Å; Y406-S459 PolarHBondContact OH-OG 2.92Å; Y406-N462 HydrophobicContact CD2-CB 3.98Å; Y406-N462 VanDerWaalsContact CD2-O 3.25Å; Y406-N462 WeakPolarHBondContact CD2-O 3.15Å; Y406-N462 HydrophobicContact CE2-CB 3.98Å; Y406-C463 HydrophobicContact CE1-CB 4.48Å; Y406-C463 HydrophobicContact CE2-CB 4.44Å; Y406-F501 AromaticContact CD1-CE1 3.85Å; Y406-F501 HydrophobicContact CD1-CE1 3.85Å; Y406-F501 HydrophobicContact CD1-CZ 4.3Å; Y406-F501 HydrophobicContact CE1-CE1 4.13Å; Y406-F502 HydrophobicContact CD1-CZ 4.43Å; Y406-F502 HydrophobicContact CE1-CE1 4.06Å; Y406-F502 HydrophobicContact CE1-CE2 4.42Å; Y406-F502 AromaticContact CE1-CZ 3.48Å; Y406-F502 HydrophobicContact CE1-CZ 3.48Å; Y406-F502 VanDerWaalsContact CE1-CZ 3.48Å; Y406-F502 AromaticContact CZ-CZ 3.81Å
407	L	87.3	Confident	85.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-39.7	173.7	-70.3	172.2	0	0	0	112.2	G403 K404 S405 V409 T410 L411 K412 F501 F502 A505 F512 L514	G403-L407 WeakPolarHBondContact O-CG 3.43Å; G403-L407 PolarHBondContact O-N 3Å; K404-L407 PolarHBondContact O-N 3.35Å; S405-L407 PolarHBondContact O-N 2.87Å; L407-V409 PolarHBondContact O-N 3.22Å; L407-T410 PolarHBondContact O-N 3.13Å; L407-L411 HydrophobicContact CD2-CD1 3.88Å; L407-L411 HydrophobicContact CD2-CG 4.44Å; L407-L411 WeakPolarHBondContact O-CB 3.35Å; L407-L411 PolarHBondContact O-N 2.98Å; L407-K412 PolarHBondContact O-N 3.31Å; L407-F501 HydrophobicContact CD1-CD2 4.19Å; L407-F501 HydrophobicContact CD1-CE1 4.4Å; L407-F501 HydrophobicContact CD1-CE2 3.43Å; L407-F501 VanDerWaalsContact CD1-CE2 3.43Å; L407-F501 HydrophobicContact CD1-CZ 3.57Å; L407-F501 HydrophobicContact CD2-CD1 4.16Å; L407-F501 HydrophobicContact CD2-CE1 3.62Å; L407-F501 HydrophobicContact CD2-CE2 4.14Å; L407-F501 HydrophobicContact CD2-CZ 3.63Å; L407-F501 HydrophobicContact CG-CE1 3.88Å; L407-F501 HydrophobicContact CG-CE2 3.8Å; L407-F501 HydrophobicContact CG-CZ 3.35Å; L407-F502 HydrophobicContact CD2-CD1 3.66Å; L407-F502 HydrophobicContact CD2-CE1 3.8Å; L407-A505 HydrophobicContact CD1-CB 3.98Å; L407-A505 HydrophobicContact CD2-CB 3.91Å; L407-F512 HydrophobicContact CD1-CB 4.24Å; L407-F512 HydrophobicContact CD1-CD1 3.27Å; L407-F512 HydrophobicContact CD1-CE1 3.83Å; L407-F512 HydrophobicContact CD1-CG 4.03Å; L407-L514 HydrophobicContact CB-CD2 4.07Å
408	A	82	Confident	85.8	Confident	39 Å²	39	35 Å²	35	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-62.7	-42.9	178.6	0	0	0	0	0	111.6	K404 S405 K412 L514	K404-A408 PolarHBondContact O-N 3.46Å; K404-A408 VanDerWaalsContact O-N 3.07Å; S405-A408 PolarHBondContact O-N 3.3Å; A408-K412 WeakPolarHBondContact O-CB 3.47Å; A408-K412 PolarHBondContact O-N 2.87Å; A408-L514 HydrophobicContact CB-CD2 4.4Å
409	V	80.6	Confident	85.5	Confident	93 Å²	93	35.5 Å²	35.5	56%	0.564	19%	0.193	S	C	*	.	H	α-helix	trans	-70.2	-40	177.1	175.2	0	0	0	0	111.5	S405 Y406 L407	S405-V409 WeakPolarHBondContact O-CG2 3.47Å; S405-V409 PolarHBondContact O-N 2.91Å; Y406-V409 PolarHBondContact O-N 3.45Å; L407-V409 PolarHBondContact O-N 3.22Å
410	T	86.8	Confident	85.3	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-82.8	-46	-171	-53.3	0	0	0	0	113.3	Y406 L407 S455 I456 S459 F502	Y406-T410 WeakPolarHBondContact CE2-OG1 3.44Å; Y406-T410 VanDerWaalsContact O-CB 3.25Å; Y406-T410 WeakPolarHBondContact O-CB 3.17Å; Y406-T410 PolarHBondContact O-N 3.07Å; Y406-T410 PolarHBondContact O-OG1 3.17Å; L407-T410 PolarHBondContact O-N 3.13Å; T410-S455 PolarHBondContact O-OG 3.43Å; T410-I456 HydrophobicContact CG2-CG1 4.45Å; T410-S459 WeakPolarHBondContact CG2-OG 3.47Å; T410-F502 HydrophobicContact CG2-CE1 4.36Å
411	L	90.9	Very high	85.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-31.5	-170.3	-65.7	-173.1	0	0	0	113.8	L407 V414 I415 V452 I456 F502 A505 V506 L514	L407-L411 HydrophobicContact CD2-CD1 3.88Å; L407-L411 HydrophobicContact CD2-CG 4.44Å; L407-L411 WeakPolarHBondContact O-CB 3.35Å; L407-L411 PolarHBondContact O-N 2.98Å; L411-V414 PolarHBondContact O-N 3.23Å; L411-V414 VanDerWaalsContact O-N 3.16Å; L411-I415 HydrophobicContact CB-CD1 3.85Å; L411-I415 HydrophobicContact CB-CG1 4.45Å; L411-I415 HydrophobicContact CD1-CD1 4.5Å; L411-I415 WeakPolarHBondContact O-CG1 3.43Å; L411-I415 PolarHBondContact O-N 3.15Å; L411-V452 HydrophobicContact CD2-CG1 4.14Å; L411-I456 HydrophobicContact CD2-CD1 4.23Å; L411-I456 HydrophobicContact CD2-CG1 3.98Å; L411-F502 HydrophobicContact CD1-CD1 3.99Å; L411-F502 HydrophobicContact CG-CD1 4.32Å; L411-A505 HydrophobicContact CD1-CB 3.99Å; L411-V506 HydrophobicContact CD1-CG2 3.88Å; L411-V506 HydrophobicContact CD2-CG2 4.44Å; L411-L514 HydrophobicContact CB-CD1 4.3Å
412	K	86.9	Confident	84.8	Confident	65 Å²	65	42.2 Å²	42.2	28%	0.283	24%	0.237	S	C	.	.	H	α-helix	trans	-56.2	-46	-172.3	-172.5	170.6	171.2	41.2	0	113.6	L407 A408 V414 I415 D416 L514	L407-K412 PolarHBondContact O-N 3.31Å; A408-K412 WeakPolarHBondContact O-CB 3.47Å; A408-K412 PolarHBondContact O-N 2.87Å; K412-V414 VanDerWaalsContact C-N 3.3Å; K412-V414 PolarHBondContact O-N 3Å; K412-I415 PolarHBondContact O-N 3.34Å; K412-D416 WeakPolarHBondContact CG-OD2 3.23Å; K412-D416 IonicContact NZ-OD1 2.74Å; K412-D416 IonicContact NZ-OD2 2.59Å; K412-D416 PolarHBondContact NZ-OD2 3.02Å; K412-D416 WeakPolarHBondContact O-CB 3.33Å; K412-D416 PolarHBondContact O-N 2.91Å; K412-L514 HydrophobicContact CB-CD2 4.33Å; K412-L514 PolarHBondContact NZ-O 3.34Å
413	P	88.2	Confident	84.7	Confident	81 Å²	81	46.3 Å²	46.3	53%	0.526	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-39.7	179.8	-22.7	34.6	0	0	0	112.6	E417	P413-E417 PolarHBondContact O-N 3.44Å
414	V	90.1	Very high	84.6	Confident	17 Å²	17	49.3 Å²	49.3	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-72.6	-41.3	-179.3	-173.8	0	0	0	0	110.9	L411 K412 E417 I418 K451 V452	L411-V414 PolarHBondContact O-N 3.23Å; L411-V414 VanDerWaalsContact O-N 3.16Å; K412-V414 VanDerWaalsContact C-N 3.3Å; K412-V414 PolarHBondContact O-N 3Å; V414-E417 PolarHBondContact O-N 3.06Å; V414-I418 HydrophobicContact CG1-CD1 4.05Å; V414-I418 WeakPolarHBondContact O-CD1 3.35Å; V414-I418 VanDerWaalsContact O-CG1 3.25Å; V414-I418 WeakPolarHBondContact O-CG1 3.35Å; V414-I418 PolarHBondContact O-N 3.45Å; V414-K451 HydrophobicContact CG1-CB 4.05Å; V414-V452 HydrophobicContact CG1-CG2 3.61Å
415	I	90.1	Very high	84.6	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-41.5	176.6	-69	171.5	0	0	0	110.9	L411 K412 E417 I418 C419 P509 L514 R515	L411-I415 HydrophobicContact CB-CD1 3.85Å; L411-I415 HydrophobicContact CB-CG1 4.45Å; L411-I415 HydrophobicContact CD1-CD1 4.5Å; L411-I415 WeakPolarHBondContact O-CG1 3.43Å; L411-I415 PolarHBondContact O-N 3.15Å; K412-I415 PolarHBondContact O-N 3.34Å; I415-E417 VanDerWaalsContact C-N 3.34Å; I415-I418 PolarHBondContact O-N 3.35Å; I415-C419 WeakPolarHBondContact O-CB 3.44Å; I415-C419 PolarHBondContact O-N 3.37Å; I415-C419 PolarHBondContact O-SG 3.16Å; I415-P509 HydrophobicContact CD1-CB 4.31Å; I415-P509 HydrophobicContact CD1-CG 4.24Å; I415-P509 HydrophobicContact CG2-CB 4.16Å; I415-P509 HydrophobicContact CG2-CG 4.1Å; I415-L514 HydrophobicContact CD1-CD1 3.66Å; I415-R515 HydrophobicContact CG2-CG 4.15Å
416	D	87.6	Confident	85.1	Confident	40 Å²	40	43.2 Å²	43.2	21%	0.214	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-42.7	176.5	-75.5	-24.3	0	0	0	110.5	K412 C419 D420 R515	K412-D416 WeakPolarHBondContact CG-OD2 3.23Å; K412-D416 IonicContact NZ-OD1 2.74Å; K412-D416 IonicContact NZ-OD2 2.59Å; K412-D416 PolarHBondContact NZ-OD2 3.02Å; K412-D416 WeakPolarHBondContact O-CB 3.33Å; K412-D416 PolarHBondContact O-N 2.91Å; D416-C419 PolarHBondContact O-N 3.36Å; D416-D420 WeakPolarHBondContact O-CB 3.39Å; D416-D420 PolarHBondContact O-N 2.96Å; D416-R515 WeakPolarHBondContact OD1-CD 3.33Å; D416-R515 IonicContact OD1-CZ 3.94Å; D416-R515 IonicContact OD1-NE 3.44Å; D416-R515 IonicContact OD1-NH1 3.03Å; D416-R515 PolarHBondContact OD1-NH1 2.96Å
417	E	89.2	Confident	85.1	Confident	85 Å²	85	43.3 Å²	43.3	40%	0.397	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-47.3	173.3	-166	-163.3	149.6	0	0	112.7	P413 V414 I415 C419 D420 S421 K451	P413-E417 PolarHBondContact O-N 3.44Å; V414-E417 PolarHBondContact O-N 3.06Å; I415-E417 VanDerWaalsContact C-N 3.34Å; E417-C419 VanDerWaalsContact C-N 3.3Å; E417-C419 PolarHBondContact O-N 3.07Å; E417-D420 PolarHBondContact O-N 3.35Å; E417-S421 VanDerWaalsContact O-CB 3.27Å; E417-S421 WeakPolarHBondContact O-CB 3.18Å; E417-S421 PolarHBondContact O-N 3.04Å; E417-S421 PolarHBondContact O-OG 3.33Å; E417-K451 IonicContact OE1-NZ 2.83Å; E417-K451 PolarHBondContact OE1-NZ 3.18Å; E417-K451 IonicContact OE2-NZ 3.42Å; E417-K451 PolarHBondContact OE2-NZ 2.84Å
418	I	88.4	Confident	84.9	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-59	-46.2	179.2	-69.3	161.4	0	0	0	110	V414 I415 S421 Y448 V452 T526 L527 I530	V414-I418 HydrophobicContact CG1-CD1 4.05Å; V414-I418 WeakPolarHBondContact O-CD1 3.35Å; V414-I418 VanDerWaalsContact O-CG1 3.25Å; V414-I418 WeakPolarHBondContact O-CG1 3.35Å; V414-I418 PolarHBondContact O-N 3.45Å; I415-I418 PolarHBondContact O-N 3.35Å; I418-S421 PolarHBondContact O-OG 2.97Å; I418-Y448 HydrophobicContact CD1-CG 4.4Å; I418-Y448 HydrophobicContact CG1-CD1 3.8Å; I418-Y448 HydrophobicContact CG1-CD2 4.34Å; I418-Y448 HydrophobicContact CG1-CE1 4.15Å; I418-Y448 HydrophobicContact CG1-CG 3.93Å; I418-V452 HydrophobicContact CD1-CG2 4.25Å; I418-T526 HydrophobicContact CG2-CG2 4.29Å; I418-L527 HydrophobicContact CG2-CD2 4.35Å; I418-I530 HydrophobicContact CD1-CD1 3.84Å
419	C	84.8	Confident	84.7	Confident	10 Å²	10	46.5 Å²	46.5	7%	0.068	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-39.1	-179.2	-67.8	0	0	0	0	112.6	I415 D416 E417	I415-C419 WeakPolarHBondContact O-CB 3.44Å; I415-C419 PolarHBondContact O-N 3.37Å; I415-C419 PolarHBondContact O-SG 3.16Å; D416-C419 PolarHBondContact O-N 3.36Å; E417-C419 VanDerWaalsContact C-N 3.3Å; E417-C419 PolarHBondContact O-N 3.07Å
420	D	84.4	Confident	84.7	Confident	127 Å²	127	49.5 Å²	49.5	68%	0.679	27%	0.268	S	S	*	.	H	α-helix	trans	-78	-27.2	-176.7	-67	-5.9	0	0	0	112.1	D416 E417 R515	D416-D420 WeakPolarHBondContact O-CB 3.39Å; D416-D420 PolarHBondContact O-N 2.96Å; E417-D420 PolarHBondContact O-N 3.35Å; D420-R515 IonicContact OD1-NH1 3.3Å
421	S	82.9	Confident	84.3	Confident	43 Å²	43	54.9 Å²	54.9	30%	0.301	29%	0.291	S	S	.	.	H	α-helix	trans	-73.8	-26.7	179.1	72	0	0	0	0	114.6	E417 I418 K423 Y448	E417-S421 VanDerWaalsContact O-CB 3.27Å; E417-S421 WeakPolarHBondContact O-CB 3.18Å; E417-S421 PolarHBondContact O-N 3.04Å; E417-S421 PolarHBondContact O-OG 3.33Å; I418-S421 PolarHBondContact O-OG 2.97Å; S421-K423 PolarHBondContact O-N 3.43Å; S421-K423 VanDerWaalsContact O-N 3.12Å; S421-Y448 WeakPolarHBondContact CB-OH 3.45Å; S421-Y448 PolarHBondContact OG-OH 3.5Å
422	N	77.2	Confident	83.8	Confident	94 Å²	94	57 Å²	57	50%	0.503	30%	0.302	S	S	.	.			trans	43	40.8	-177.2	-158.3	36.7	0	0	0	115.6
423	K	81.6	Confident	83.3	Confident	107 Å²	107	59.9 Å²	59.9	47%	0.465	31%	0.314	S	S	.	.			trans	-83.4	140	177.8	-60.6	-169.4	-170.7	175.2	0	112.2	S421 Y448	S421-K423 PolarHBondContact O-N 3.43Å; S421-K423 VanDerWaalsContact O-N 3.12Å; K423-Y448 HydrophobicContact CB-CE2 4.36Å; K423-Y448 WeakPolarHBondContact CD-OH 3.14Å; K423-Y448 WeakPolarHBondContact CG-OH 3.25Å
424	T	78.1	Confident	82.3	Confident	63 Å²	63	66 Å²	66	39%	0.387	34%	0.336	S	S	.	.			trans	-68.9	132.4	173.4	51.9	0	0	0	0	111.1	N441 N444	T424-N441 WeakPolarHBondContact CB-OD1 3.48Å; T424-N441 PolarHBondContact O-OD1 3.12Å; T424-N441 VanDerWaalsContact O-OD1 3.06Å; T424-N441 PolarHBondContact OG1-OD1 3.03Å; T424-N444 PolarHBondContact O-ND2 2.87Å
425	C	81.6	Confident	81.4	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.007	37%	0.372	C	S	.	.			trans	-130.1	21	178.3	-62.1	0	0	0	0	111.6	I427 L445 T526 L529	C425-I427 PolarHBondContact O-N 3.46Å; C425-L445 HydrophobicContact CB-CB 4.14Å; C425-L445 HydrophobicContact CB-CD1 4.2Å; C425-T526 HydrophobicContact CB-CG2 3.7Å; C425-T526 VanDerWaalsContact SG-CG2 3.59Å; C425-L529 WeakPolarHBondContact O-CD1 3.19Å
426	E	85.6	Confident	80.8	Confident	26 Å²	26	71.7 Å²	71.7	12%	0.121	39%	0.386	C	S	.	.			trans	-75.1	127.7	180	-171.8	58.5	-98.7	0	0	110.2	D428 K431 L432 N441 R525	E426-D428 WeakPolarHBondContact OE1-CB 3.22Å; E426-D428 PolarHBondContact OE1-N 3.28Å; E426-K431 HydrophobicContact CG-CB 4.07Å; E426-L432 HydrophobicContact CB-CD2 4.43Å; E426-L432 HydrophobicContact CG-CD2 4.39Å; E426-L432 WeakPolarHBondContact O-CD2 3.29Å; E426-N441 VanDerWaalsContact O-CB 3.23Å; E426-N441 WeakPolarHBondContact O-CB 3.37Å; E426-N441 PolarHBondContact O-ND2 2.8Å; E426-R525 IonicContact OE1-CZ 3.2Å; E426-R525 IonicContact OE1-NE 2.85Å; E426-R525 IonicContact OE1-NH2 2.76Å; E426-R525 PolarHBondContact OE1-NH2 3.49Å; E426-R525 VanDerWaalsContact OE2-CG 3.27Å; E426-R525 WeakPolarHBondContact OE2-CG 3.37Å; E426-R525 IonicContact OE2-CZ 2.69Å; E426-R525 IonicContact OE2-NE 3.63Å; E426-R525 PolarHBondContact OE2-NE 2.83Å; E426-R525 IonicContact OE2-NH2 3.65Å
427	I	83.1	Confident	80.5	Confident	9 Å²	9	73.5 Å²	73.5	5%	0.046	40%	0.395	C	S	.	.			trans	-125.7	-1.6	-176.2	55.6	165.1	0	0	0	111.9	C425 P429 N441 K442 L445 L529 Y554 M555 F558	C425-I427 PolarHBondContact O-N 3.46Å; I427-P429 WeakPolarHBondContact O-CD 3.48Å; I427-N441 HydrophobicContact CG2-CB 4.48Å; I427-K442 HydrophobicContact CG2-CB 4.21Å; I427-L445 HydrophobicContact CD1-CD2 3.66Å; I427-L445 HydrophobicContact CG1-CD2 4.26Å; I427-L445 HydrophobicContact CG2-CD2 4.35Å; I427-L529 HydrophobicContact CG1-CD1 4.16Å; I427-L529 HydrophobicContact CG1-CD2 4.46Å; I427-Y554 HydrophobicContact CD1-CD2 4.08Å; I427-Y554 HydrophobicContact CD1-CE2 4.2Å; I427-Y554 HydrophobicContact CG1-CD2 3.96Å; I427-Y554 HydrophobicContact CG1-CE2 4.04Å; I427-M555 HydrophobicContact CD1-SD 3.44Å; I427-M555 WeakPolarHBondContact CD1-SD 3.41Å; I427-M555 HydrophobicContact CG1-SD 4.42Å; I427-F558 HydrophobicContact CD1-CB 4.48Å; I427-F558 HydrophobicContact CD1-CG 4.5Å
428	D	82.3	Confident	80.1	Confident	16 Å²	16	71.7 Å²	71.7	9%	0.086	39%	0.39	C	S	.	.			trans	-79.6	114.3	173.2	-177.6	-11.9	0	0	0	109.9	E426 I430 K431 L432 Y554	E426-D428 WeakPolarHBondContact OE1-CB 3.22Å; E426-D428 PolarHBondContact OE1-N 3.28Å; D428-I430 PolarHBondContact O-N 3.44Å; D428-I430 PolarHBondContact OD1-N 2.92Å; D428-I430 VanDerWaalsContact OD1-N 3.1Å; D428-K431 HydrophobicContact CB-CB 4.24Å; D428-K431 HydrophobicContact CB-CD 4.29Å; D428-K431 HydrophobicContact CB-CG 4.37Å; D428-K431 PolarHBondContact O-N 3.04Å; D428-K431 WeakPolarHBondContact OD2-CD 3.23Å; D428-K431 VanDerWaalsContact OD2-CE 3.32Å; D428-K431 WeakPolarHBondContact OD2-CE 3.26Å; D428-K431 IonicContact OD2-NZ 3.72Å; D428-L432 PolarHBondContact O-N 3.3Å; D428-Y554 HydrophobicContact CB-CD2 4.41Å; D428-Y554 HydrophobicContact CB-CE2 4.25Å
429	P	77.8	Confident	79.9	Confident	90 Å²	90	77.5 Å²	77.5	58%	0.584	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.7	-176.9	-25.8	35.4	0	0	0	114.8	I427	I427-P429 WeakPolarHBondContact O-CD 3.48Å
430	I	81.3	Confident	79.8	Confident	155 Å²	155	80.2 Å²	80.2	80%	0.795	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-21.1	-177.8	-57.9	170.7	0	0	0	111.5	D428	D428-I430 PolarHBondContact O-N 3.44Å; D428-I430 PolarHBondContact OD1-N 2.92Å; D428-I430 VanDerWaalsContact OD1-N 3.1Å
431	K	78.8	Confident	79.9	Confident	118 Å²	118	74.4 Å²	74.4	51%	0.513	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	1.4	-173.3	-64.2	-180	-175.6	162.7	0	114	E426 D428	E426-K431 HydrophobicContact CG-CB 4.07Å; D428-K431 HydrophobicContact CB-CB 4.24Å; D428-K431 HydrophobicContact CB-CD 4.29Å; D428-K431 HydrophobicContact CB-CG 4.37Å; D428-K431 PolarHBondContact O-N 3.04Å; D428-K431 WeakPolarHBondContact OD2-CD 3.23Å; D428-K431 VanDerWaalsContact OD2-CE 3.32Å; D428-K431 WeakPolarHBondContact OD2-CE 3.26Å; D428-K431 IonicContact OD2-NZ 3.72Å
432	L	79.5	Confident	80	Confident	45 Å²	45	75.4 Å²	75.4	24%	0.236	40%	0.401	C	S	.	.			trans	-68.6	140.9	175.8	-68.3	163	0	0	0	110.6	E426 D428 D436 V438	E426-L432 HydrophobicContact CB-CD2 4.43Å; E426-L432 HydrophobicContact CG-CD2 4.39Å; E426-L432 WeakPolarHBondContact O-CD2 3.29Å; D428-L432 PolarHBondContact O-N 3.3Å; L432-D436 HydrophobicContact CB-CB 4.4Å; L432-D436 HydrophobicContact CD2-CB 3.82Å; L432-V438 HydrophobicContact CD1-CG2 3.23Å; L432-V438 HydrophobicContact CD2-CG2 4.06Å; L432-V438 HydrophobicContact CG-CG2 4.28Å
433	K	77.9	Confident	80.5	Confident	125 Å²	125	76.8 Å²	76.8	54%	0.543	40%	0.404	S	S	.	.			trans	-85.2	156.5	172	-59.7	177.4	-172.5	172.3	0	109.6	G435 D436 E522	K433-G435 PolarHBondContact O-N 3.42Å; K433-G435 VanDerWaalsContact O-N 3.09Å; K433-D436 PolarHBondContact N-OD2 3.02Å; K433-D436 PolarHBondContact O-N 3.45Å; K433-D436 VanDerWaalsContact O-N 3.09Å; K433-E522 IonicContact NZ-OE1 3.96Å; K433-E522 PolarHBondContact NZ-OE1 3.27Å
434	E	66.8	Low	80.8	Confident	209 Å²	209	73 Å²	73	98%	0.977	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	115.3	173.8	-71.2	-177.1	165.3	0	0	110.1
435	G	69.7	Low	81.3	Confident	84 Å²	84	70 Å²	70	87%	0.866	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.8	-6.3	-177.9	0	0	0	0	0	115.7	K433	K433-G435 PolarHBondContact O-N 3.42Å; K433-G435 VanDerWaalsContact O-N 3.09Å
436	D	78.3	Confident	81.6	Confident	53 Å²	53	72.3 Å²	72.3	28%	0.283	38%	0.382	S	S	.	.			trans	-72.3	139	175.4	-74.5	-23.8	0	0	0	111.9	L432 K433	L432-D436 HydrophobicContact CB-CB 4.4Å; L432-D436 HydrophobicContact CD2-CB 3.82Å; K433-D436 PolarHBondContact N-OD2 3.02Å; K433-D436 PolarHBondContact O-N 3.45Å; K433-D436 VanDerWaalsContact O-N 3.09Å
437	N	80.8	Confident	81.8	Confident	79 Å²	79	74.5 Å²	74.5	42%	0.422	40%	0.396	S	S	.	.			trans	-103.5	114.5	175	-175.4	-56.4	0	0	0	110.1	E439 V440 N441	N437-E439 VanDerWaalsContact C-N 3.34Å; N437-E439 PolarHBondContact O-N 3.25Å; N437-E439 WeakPolarHBondContact OD1-CB 3.38Å; N437-E439 PolarHBondContact OD1-N 2.94Å; N437-E439 PolarHBondContact OD1-OE2 3.36Å; N437-E439 VanDerWaalsContact OD1-OE2 3.09Å; N437-V440 HydrophobicContact CB-CB 4.17Å; N437-V440 HydrophobicContact CB-CG2 4.16Å; N437-V440 PolarHBondContact O-N 3.45Å; N437-V440 PolarHBondContact OD1-N 3.01Å; N437-N441 WeakPolarHBondContact O-CB 3.38Å; N437-N441 VanDerWaalsContact O-CG 3.25Å; N437-N441 PolarHBondContact O-N 2.54Å
438	V	82.3	Confident	82.3	Confident	46 Å²	46	74.3 Å²	74.3	28%	0.279	40%	0.395	S	S	.	.	H	α-helix	trans	-65.7	-38.6	-174.9	-176.5	0	0	0	0	111.4	L432 N441 K442	L432-V438 HydrophobicContact CD1-CG2 3.23Å; L432-V438 HydrophobicContact CD2-CG2 4.06Å; L432-V438 HydrophobicContact CG-CG2 4.28Å; V438-N441 PolarHBondContact O-N 3.26Å; V438-K442 WeakPolarHBondContact O-CB 3.49Å; V438-K442 PolarHBondContact O-N 2.79Å
439	E	82.5	Confident	82.7	Confident	128 Å²	128	73.6 Å²	73.6	60%	0.598	39%	0.391	S	S	*	.	H	α-helix	trans	-65.5	-44.7	-179.1	-64.7	70	-155.2	0	0	110.8	N437 K442 E443	N437-E439 VanDerWaalsContact C-N 3.34Å; N437-E439 PolarHBondContact O-N 3.25Å; N437-E439 WeakPolarHBondContact OD1-CB 3.38Å; N437-E439 PolarHBondContact OD1-N 2.94Å; N437-E439 PolarHBondContact OD1-OE2 3.36Å; N437-E439 VanDerWaalsContact OD1-OE2 3.09Å; E439-K442 WeakPolarHBondContact O-CB 3.45Å; E439-K442 PolarHBondContact O-N 3.28Å; E439-E443 WeakPolarHBondContact O-CG 3.17Å; E439-E443 PolarHBondContact O-N 3.24Å
440	V	84.4	Confident	83.3	Confident	67 Å²	67	73.7 Å²	73.7	41%	0.406	38%	0.384	S	S	.	.	H	α-helix	trans	-66.5	-42.1	176	174.8	0	0	0	0	111.3	N437 K442 E443 N444	N437-V440 HydrophobicContact CB-CB 4.17Å; N437-V440 HydrophobicContact CB-CG2 4.16Å; N437-V440 PolarHBondContact O-N 3.45Å; N437-V440 PolarHBondContact OD1-N 3.01Å; V440-K442 VanDerWaalsContact C-N 3.28Å; V440-K442 PolarHBondContact O-N 3.44Å; V440-E443 PolarHBondContact O-N 3.07Å; V440-N444 WeakPolarHBondContact O-CB 3.05Å; V440-N444 VanDerWaalsContact O-CG 3.27Å; V440-N444 PolarHBondContact O-N 3.18Å; V440-N444 PolarHBondContact O-ND2 3.32Å
441	N	85.8	Confident	83.8	Confident	4 Å²	4	70 Å²	70	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-62.6	-37.1	175.2	-73	-9.7	0	0	0	111.7	T424 E426 I427 N437 V438 L445	T424-N441 WeakPolarHBondContact CB-OD1 3.48Å; T424-N441 PolarHBondContact O-OD1 3.12Å; T424-N441 VanDerWaalsContact O-OD1 3.06Å; T424-N441 PolarHBondContact OG1-OD1 3.03Å; E426-N441 VanDerWaalsContact O-CB 3.23Å; E426-N441 WeakPolarHBondContact O-CB 3.37Å; E426-N441 PolarHBondContact O-ND2 2.8Å; I427-N441 HydrophobicContact CG2-CB 4.48Å; N437-N441 WeakPolarHBondContact O-CB 3.38Å; N437-N441 VanDerWaalsContact O-CG 3.25Å; N437-N441 PolarHBondContact O-N 2.54Å; V438-N441 PolarHBondContact O-N 3.26Å; N441-L445 WeakPolarHBondContact O-CB 3.43Å; N441-L445 PolarHBondContact O-N 2.73Å
442	K	85.7	Confident	84.5	Confident	65 Å²	65	64.4 Å²	64.4	28%	0.283	34%	0.338	S	S	.	.	H	α-helix	trans	-66.2	-43.6	176	-172.3	-175.5	-178.5	179.2	0	111.6	I427 V438 E439 V440 L445 Q446 D557 F558	I427-K442 HydrophobicContact CG2-CB 4.21Å; V438-K442 WeakPolarHBondContact O-CB 3.49Å; V438-K442 PolarHBondContact O-N 2.79Å; E439-K442 WeakPolarHBondContact O-CB 3.45Å; E439-K442 PolarHBondContact O-N 3.28Å; V440-K442 VanDerWaalsContact C-N 3.28Å; V440-K442 PolarHBondContact O-N 3.44Å; K442-L445 PolarHBondContact O-N 3.17Å; K442-Q446 WeakPolarHBondContact O-CB 3.37Å; K442-Q446 PolarHBondContact O-N 3.25Å; K442-D557 WeakPolarHBondContact CE-O 3.31Å; K442-D557 PolarHBondContact NZ-O 3.25Å; K442-F558 HydrophobicContact CG-CD2 3.76Å; K442-F558 HydrophobicContact CG-CE2 4.43Å
443	E	86.3	Confident	85	Confident	122 Å²	122	62.7 Å²	62.7	57%	0.57	33%	0.329	S	S	*	.	H	α-helix	trans	-63.3	-45.4	174.7	-74.6	-179.8	-179.6	0	0	111.8	E439 V440 L445 Q446 V447	E439-E443 WeakPolarHBondContact O-CG 3.17Å; E439-E443 PolarHBondContact O-N 3.24Å; V440-E443 PolarHBondContact O-N 3.07Å; E443-L445 VanDerWaalsContact C-N 3.33Å; E443-L445 PolarHBondContact O-N 3.46Å; E443-Q446 WeakPolarHBondContact O-CB 3.38Å; E443-Q446 PolarHBondContact O-N 3.28Å; E443-V447 WeakPolarHBondContact O-CG2 3.1Å; E443-V447 PolarHBondContact O-N 2.8Å
444	N	88.4	Confident	85.6	Confident	29 Å²	29	58.4 Å²	58.4	16%	0.155	31%	0.314	C	S	.	.	H	α-helix	trans	-56.2	-48.1	175	-73.1	-31.5	0	0	0	111.3	T424 V440 Q446 V447 Y448	T424-N444 PolarHBondContact O-ND2 2.87Å; V440-N444 WeakPolarHBondContact O-CB 3.05Å; V440-N444 VanDerWaalsContact O-CG 3.27Å; V440-N444 PolarHBondContact O-N 3.18Å; V440-N444 PolarHBondContact O-ND2 3.32Å; N444-Q446 VanDerWaalsContact C-N 3.34Å; N444-Q446 PolarHBondContact O-N 3.46Å; N444-V447 PolarHBondContact O-N 2.98Å; N444-Y448 WeakPolarHBondContact O-CD2 3.5Å; N444-Y448 PolarHBondContact O-N 3.3Å; N444-Y448 VanDerWaalsContact O-N 3.11Å
445	L	88.6	Confident	86.8	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-41.4	177.6	-176.1	63.1	0	0	0	111.6	C425 I427 N441 K442 E443 V447 Y448 V449 L529 I530 F558	C425-L445 HydrophobicContact CB-CB 4.14Å; C425-L445 HydrophobicContact CB-CD1 4.2Å; I427-L445 HydrophobicContact CD1-CD2 3.66Å; I427-L445 HydrophobicContact CG1-CD2 4.26Å; I427-L445 HydrophobicContact CG2-CD2 4.35Å; N441-L445 WeakPolarHBondContact O-CB 3.43Å; N441-L445 PolarHBondContact O-N 2.73Å; K442-L445 PolarHBondContact O-N 3.17Å; E443-L445 VanDerWaalsContact C-N 3.33Å; E443-L445 PolarHBondContact O-N 3.46Å; L445-V447 PolarHBondContact O-N 2.7Å; L445-Y448 PolarHBondContact O-N 3.41Å; L445-V449 HydrophobicContact CD1-CG2 4.28Å; L445-V449 HydrophobicContact CG-CG2 4.4Å; L445-V449 WeakPolarHBondContact O-CB 3.23Å; L445-V449 VanDerWaalsContact O-CG2 3.3Å; L445-V449 WeakPolarHBondContact O-CG2 3.39Å; L445-V449 PolarHBondContact O-N 2.86Å; L445-L529 HydrophobicContact CD1-CB 3.88Å; L445-L529 HydrophobicContact CD2-CB 4.19Å; L445-L529 HydrophobicContact CD2-CD1 4.41Å; L445-I530 HydrophobicContact CD1-CG1 3.74Å; L445-F558 HydrophobicContact CB-CE2 4.16Å; L445-F558 HydrophobicContact CB-CZ 4.21Å; L445-F558 HydrophobicContact CD2-CD1 4.3Å; L445-F558 HydrophobicContact CD2-CD2 4.41Å; L445-F558 HydrophobicContact CD2-CE1 3.82Å; L445-F558 HydrophobicContact CD2-CE2 3.95Å; L445-F558 HydrophobicContact CD2-CZ 3.64Å; L445-F558 HydrophobicContact CG-CE1 4.14Å; L445-F558 HydrophobicContact CG-CE2 3.96Å; L445-F558 HydrophobicContact CG-CZ 3.55Å
446	Q	88.4	Confident	87.9	Confident	49 Å²	49	46 Å²	46	23%	0.229	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-44.7	178.5	-166	-179.7	3.3	0	0	111.4	K442 E443 N444 V449 Q450 F558 F562	K442-Q446 WeakPolarHBondContact O-CB 3.37Å; K442-Q446 PolarHBondContact O-N 3.25Å; E443-Q446 WeakPolarHBondContact O-CB 3.38Å; E443-Q446 PolarHBondContact O-N 3.28Å; N444-Q446 VanDerWaalsContact C-N 3.34Å; N444-Q446 PolarHBondContact O-N 3.46Å; Q446-V449 PolarHBondContact O-N 2.92Å; Q446-Q450 WeakPolarHBondContact O-CB 3.47Å; Q446-Q450 VanDerWaalsContact O-CG 3.28Å; Q446-Q450 WeakPolarHBondContact O-CG 3.24Å; Q446-Q450 PolarHBondContact O-N 3.28Å; Q446-F558 HydrophobicContact CB-CE2 3.94Å; Q446-F558 HydrophobicContact CG-CE2 4.49Å; Q446-F562 HydrophobicContact CG-CE1 4.3Å; Q446-F562 HydrophobicContact CG-CZ 3.97Å
447	V	89.9	Confident	88.4	Confident	71 Å²	71	44.4 Å²	44.4	43%	0.43	23%	0.229	S	C	.	.	H	α-helix	trans	-61.3	-46.8	177.3	171.7	0	0	0	0	111	E443 N444 L445 Q450 K451	E443-V447 WeakPolarHBondContact O-CG2 3.1Å; E443-V447 PolarHBondContact O-N 2.8Å; N444-V447 PolarHBondContact O-N 2.98Å; L445-V447 PolarHBondContact O-N 2.7Å; V447-Q450 PolarHBondContact O-N 2.88Å; V447-K451 HydrophobicContact CG1-CD 4.45Å; V447-K451 WeakPolarHBondContact O-CG 3.21Å; V447-K451 PolarHBondContact O-N 3.07Å
448	Y	92	Very high	88.8	Confident	6 Å²	6	47.4 Å²	47.4	2%	0.024	24%	0.241	C	C	.	.	H	α-helix	trans	-65.3	-42.6	179.2	-66.4	-32.5	0	0	0	112.9	I418 S421 K423 N444 L445 Q450 K451 V452 T526 I530	I418-Y448 HydrophobicContact CD1-CG 4.4Å; I418-Y448 HydrophobicContact CG1-CD1 3.8Å; I418-Y448 HydrophobicContact CG1-CD2 4.34Å; I418-Y448 HydrophobicContact CG1-CE1 4.15Å; I418-Y448 HydrophobicContact CG1-CG 3.93Å; S421-Y448 WeakPolarHBondContact CB-OH 3.45Å; S421-Y448 PolarHBondContact OG-OH 3.5Å; K423-Y448 HydrophobicContact CB-CE2 4.36Å; K423-Y448 WeakPolarHBondContact CD-OH 3.14Å; K423-Y448 WeakPolarHBondContact CG-OH 3.25Å; N444-Y448 WeakPolarHBondContact O-CD2 3.5Å; N444-Y448 PolarHBondContact O-N 3.3Å; N444-Y448 VanDerWaalsContact O-N 3.11Å; L445-Y448 PolarHBondContact O-N 3.41Å; Y448-Q450 VanDerWaalsContact C-N 3.35Å; Y448-Q450 PolarHBondContact O-N 3.21Å; Y448-K451 PolarHBondContact O-N 3.24Å; Y448-V452 WeakPolarHBondContact O-CG2 3.17Å; Y448-V452 PolarHBondContact O-N 2.88Å; Y448-T526 HydrophobicContact CD2-CG2 4.41Å; Y448-I530 HydrophobicContact CD2-CD1 4.5Å; Y448-I530 HydrophobicContact CG-CD1 4.48Å
449	V	91.4	Very high	89.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-45.2	174.7	169.9	0	0	0	0	110.8	L445 Q446 K451 V452 F453 I530 T533 I534 L537 F558 F562	L445-V449 HydrophobicContact CD1-CG2 4.28Å; L445-V449 HydrophobicContact CG-CG2 4.4Å; L445-V449 WeakPolarHBondContact O-CB 3.23Å; L445-V449 VanDerWaalsContact O-CG2 3.3Å; L445-V449 WeakPolarHBondContact O-CG2 3.39Å; L445-V449 PolarHBondContact O-N 2.86Å; Q446-V449 PolarHBondContact O-N 2.92Å; V449-K451 VanDerWaalsContact C-N 3.34Å; V449-K451 PolarHBondContact O-N 3.47Å; V449-V452 PolarHBondContact O-N 3.01Å; V449-F453 WeakPolarHBondContact O-CB 3.48Å; V449-F453 PolarHBondContact O-N 2.97Å; V449-I530 HydrophobicContact CG2-CB 4.41Å; V449-I530 HydrophobicContact CG2-CG1 4.18Å; V449-I530 HydrophobicContact CG2-CG2 4.26Å; V449-T533 HydrophobicContact CB-CG2 4.39Å; V449-T533 HydrophobicContact CG1-CG2 3.59Å; V449-T533 HydrophobicContact CG2-CG2 3.92Å; V449-I534 HydrophobicContact CG1-CD1 4.18Å; V449-L537 HydrophobicContact CG1-CD1 3.9Å; V449-F558 HydrophobicContact CG2-CE1 4.48Å; V449-F558 HydrophobicContact CG2-CZ 4.14Å; V449-F562 HydrophobicContact CB-CE1 4.33Å; V449-F562 HydrophobicContact CB-CZ 3.98Å; V449-F562 HydrophobicContact CG1-CE1 3.7Å; V449-F562 HydrophobicContact CG1-CZ 3.61Å
450	Q	90.3	Very high	89.2	Confident	92 Å²	92	40.2 Å²	40.2	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-63.4	-39	179.4	-75.5	180	4	0	0	112.5	Q446 V447 Y448 S454 F562	Q446-Q450 WeakPolarHBondContact O-CB 3.47Å; Q446-Q450 VanDerWaalsContact O-CG 3.28Å; Q446-Q450 WeakPolarHBondContact O-CG 3.24Å; Q446-Q450 PolarHBondContact O-N 3.28Å; V447-Q450 PolarHBondContact O-N 2.88Å; Y448-Q450 VanDerWaalsContact C-N 3.35Å; Y448-Q450 PolarHBondContact O-N 3.21Å; Q450-S454 WeakPolarHBondContact O-CB 3.13Å; Q450-S454 PolarHBondContact O-N 3.05Å; Q450-S454 PolarHBondContact O-OG 3.38Å; Q450-F562 HydrophobicContact CG-CE1 4Å
451	K	91.4	Very high	88.8	Confident	78 Å²	78	40.5 Å²	40.5	34%	0.339	21%	0.212	S	C	.	.	H	α-helix	trans	-62.6	-50.6	174.5	-76.6	-175.4	173.4	-163.4	0	111.7	V414 E417 V447 Y448 V449 S454 S455	V414-K451 HydrophobicContact CG1-CB 4.05Å; E417-K451 IonicContact OE1-NZ 2.83Å; E417-K451 PolarHBondContact OE1-NZ 3.18Å; E417-K451 IonicContact OE2-NZ 3.42Å; E417-K451 PolarHBondContact OE2-NZ 2.84Å; V447-K451 HydrophobicContact CG1-CD 4.45Å; V447-K451 WeakPolarHBondContact O-CG 3.21Å; V447-K451 PolarHBondContact O-N 3.07Å; Y448-K451 PolarHBondContact O-N 3.24Å; V449-K451 VanDerWaalsContact C-N 3.34Å; V449-K451 PolarHBondContact O-N 3.47Å; K451-S454 PolarHBondContact O-N 3.41Å; K451-S455 WeakPolarHBondContact O-CB 3.16Å; K451-S455 PolarHBondContact O-N 2.78Å
452	V	93.2	Very high	88.3	Confident	1 Å²	1	44 Å²	44	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-47.8	178.8	173.2	0	0	0	0	110.7	L411 V414 I418 Y448 V449 S454 S455 I456 V506 I530 I534	L411-V452 HydrophobicContact CD2-CG1 4.14Å; V414-V452 HydrophobicContact CG1-CG2 3.61Å; I418-V452 HydrophobicContact CD1-CG2 4.25Å; Y448-V452 WeakPolarHBondContact O-CG2 3.17Å; Y448-V452 PolarHBondContact O-N 2.88Å; V449-V452 PolarHBondContact O-N 3.01Å; V452-S454 PolarHBondContact O-N 2.93Å; V452-S455 PolarHBondContact O-N 2.85Å; V452-I456 HydrophobicContact CG1-CD1 3.8Å; V452-I456 VanDerWaalsContact O-CG1 3.31Å; V452-I456 WeakPolarHBondContact O-CG1 3.27Å; V452-I456 PolarHBondContact O-N 3.49Å; V452-V506 HydrophobicContact CG1-CG2 4.17Å; V452-I530 HydrophobicContact CB-CG2 4.36Å; V452-I530 HydrophobicContact CG1-CG2 4.48Å; V452-I530 HydrophobicContact CG2-CG2 4.1Å; V452-I534 HydrophobicContact CB-CD1 4.24Å; V452-I534 HydrophobicContact CG1-CD1 3.88Å; V452-I534 HydrophobicContact CG1-CG1 3.92Å
453	F	91.3	Very high	88	Confident	9 Å²	9	41.2 Å²	41.2	4%	0.039	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-41	179.9	-175.7	-100.5	0	0	0	112.7	V449 I456 T457 I534 L537 C567 K570 V571	V449-F453 WeakPolarHBondContact O-CB 3.48Å; V449-F453 PolarHBondContact O-N 2.97Å; F453-I456 PolarHBondContact O-N 2.96Å; F453-T457 HydrophobicContact CD1-CG2 4.31Å; F453-T457 HydrophobicContact CD2-CG2 4.5Å; F453-T457 HydrophobicContact CE1-CG2 3.95Å; F453-T457 HydrophobicContact CE2-CG2 4.15Å; F453-T457 HydrophobicContact CZ-CG2 3.87Å; F453-T457 WeakPolarHBondContact O-CB 3.47Å; F453-T457 WeakPolarHBondContact O-CG2 3.4Å; F453-T457 PolarHBondContact O-N 3.34Å; F453-T457 PolarHBondContact O-OG1 3.17Å; F453-I534 HydrophobicContact CB-CD1 3.77Å; F453-I534 HydrophobicContact CD2-CD1 4.24Å; F453-L537 HydrophobicContact CD2-CB 4.33Å; F453-L537 HydrophobicContact CD2-CD1 4.02Å; F453-L537 HydrophobicContact CE2-CB 4.09Å; F453-L537 HydrophobicContact CE2-CD1 4.37Å; F453-L537 HydrophobicContact CG-CD1 4.43Å; F453-C567 HydrophobicContact CE1-CB 4.37Å; F453-C567 HydrophobicContact CZ-CB 4Å; F453-K570 HydrophobicContact CE1-CB 4.34Å; F453-K570 HydrophobicContact CE1-CD 4.02Å; F453-K570 HydrophobicContact CZ-CB 4.45Å; F453-V571 HydrophobicContact CE2-CG2 3.65Å; F453-V571 HydrophobicContact CZ-CG2 3.71Å
454	S	90.6	Very high	87.7	Confident	35 Å²	35	36.2 Å²	36.2	25%	0.245	20%	0.197	C	C	.	.	H	α-helix	trans	-68.1	-40.7	177.3	-58.5	0	0	0	0	111.6	Q450 K451 V452 I456 T457 Q458	Q450-S454 WeakPolarHBondContact O-CB 3.13Å; Q450-S454 PolarHBondContact O-N 3.05Å; Q450-S454 PolarHBondContact O-OG 3.38Å; K451-S454 PolarHBondContact O-N 3.41Å; V452-S454 PolarHBondContact O-N 2.93Å; S454-I456 VanDerWaalsContact C-N 3.34Å; S454-I456 PolarHBondContact O-N 3.43Å; S454-T457 PolarHBondContact O-N 2.98Å; S454-T457 PolarHBondContact O-OG1 3.23Å; S454-Q458 WeakPolarHBondContact O-CB 3.11Å; S454-Q458 VanDerWaalsContact O-CG 3.26Å; S454-Q458 WeakPolarHBondContact O-CG 3.39Å; S454-Q458 PolarHBondContact O-N 3.11Å; S454-Q458 VanDerWaalsContact O-N 3.07Å
455	S	91.8	Very high	87.2	Confident	33 Å²	33	39 Å²	39	23%	0.231	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-45.1	175.2	-163.9	0	0	0	0	111.5	T410 K451 V452 S459	T410-S455 PolarHBondContact O-OG 3.43Å; K451-S455 WeakPolarHBondContact O-CB 3.16Å; K451-S455 PolarHBondContact O-N 2.78Å; V452-S455 PolarHBondContact O-N 2.85Å; S455-S459 VanDerWaalsContact O-CB 3.29Å; S455-S459 WeakPolarHBondContact O-CB 3.49Å; S455-S459 PolarHBondContact O-N 3.36Å; S455-S459 PolarHBondContact O-OG 2.91Å
456	I	92.3	Very high	86.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-48.4	177.7	-66.6	165.8	0	0	0	111.7	T410 L411 V452 F453 S454 Q458 S459 F498 F502 I534 F574	T410-I456 HydrophobicContact CG2-CG1 4.45Å; L411-I456 HydrophobicContact CD2-CD1 4.23Å; L411-I456 HydrophobicContact CD2-CG1 3.98Å; V452-I456 HydrophobicContact CG1-CD1 3.8Å; V452-I456 VanDerWaalsContact O-CG1 3.31Å; V452-I456 WeakPolarHBondContact O-CG1 3.27Å; V452-I456 PolarHBondContact O-N 3.49Å; F453-I456 PolarHBondContact O-N 2.96Å; S454-I456 VanDerWaalsContact C-N 3.34Å; S454-I456 PolarHBondContact O-N 3.43Å; I456-Q458 PolarHBondContact O-N 2.91Å; I456-S459 PolarHBondContact O-N 3.03Å; I456-S459 PolarHBondContact O-OG 2.67Å; I456-F498 HydrophobicContact CG2-CE1 3.89Å; I456-F498 HydrophobicContact CG2-CZ 4Å; I456-F502 HydrophobicContact CD1-CB 3.96Å; I456-F502 HydrophobicContact CD1-CD1 4.23Å; I456-F502 HydrophobicContact CD1-CD2 4.37Å; I456-F502 HydrophobicContact CD1-CG 3.96Å; I456-F502 HydrophobicContact CG1-CD1 4.06Å; I456-F502 HydrophobicContact CG1-CD2 4.4Å; I456-F502 HydrophobicContact CG1-CE1 4.19Å; I456-F502 HydrophobicContact CG1-CG 4.16Å; I456-F502 HydrophobicContact CG1-CZ 4.41Å; I456-F502 HydrophobicContact CG2-CD2 3.75Å; I456-F502 HydrophobicContact CG2-CE2 3.56Å; I456-F502 HydrophobicContact CG2-CG 4.35Å; I456-F502 HydrophobicContact CG2-CZ 3.99Å; I456-I534 HydrophobicContact CD1-CG2 4.07Å; I456-F574 HydrophobicContact CG2-CE1 4.46Å; I456-F574 HydrophobicContact CG2-CZ 4.3Å; I456-F574 WeakPolarHBondContact O-CD2 3.35Å; I456-F574 WeakPolarHBondContact O-CE2 3.29Å
457	T	89.1	Confident	86.7	Confident	18 Å²	18	39 Å²	39	11%	0.11	22%	0.218	C	C	.	.	H	α-helix	trans	-71	-19.9	-174.9	50.4	0	0	0	0	113.5	F453 S454 K570	F453-T457 HydrophobicContact CD1-CG2 4.31Å; F453-T457 HydrophobicContact CD2-CG2 4.5Å; F453-T457 HydrophobicContact CE1-CG2 3.95Å; F453-T457 HydrophobicContact CE2-CG2 4.15Å; F453-T457 HydrophobicContact CZ-CG2 3.87Å; F453-T457 WeakPolarHBondContact O-CB 3.47Å; F453-T457 WeakPolarHBondContact O-CG2 3.4Å; F453-T457 PolarHBondContact O-N 3.34Å; F453-T457 PolarHBondContact O-OG1 3.17Å; S454-T457 PolarHBondContact O-N 2.98Å; S454-T457 PolarHBondContact O-OG1 3.23Å; T457-K570 HydrophobicContact CG2-CB 4.13Å
458	Q	88.5	Confident	86.5	Confident	143 Å²	143	36.2 Å²	36.2	67%	0.668	20%	0.202	S	C	*	.	H	α-helix	trans	-94.5	-8	176	-66.3	172.7	4	0	0	113.3	S454 I456 S460	S454-Q458 WeakPolarHBondContact O-CB 3.11Å; S454-Q458 VanDerWaalsContact O-CG 3.26Å; S454-Q458 WeakPolarHBondContact O-CG 3.39Å; S454-Q458 PolarHBondContact O-N 3.11Å; S454-Q458 VanDerWaalsContact O-N 3.07Å; I456-Q458 PolarHBondContact O-N 2.91Å; Q458-S460 VanDerWaalsContact C-N 3.33Å; Q458-S460 PolarHBondContact O-N 3.38Å
459	S	88.6	Confident	86.1	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.042	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-88.5	8	-175.1	68.4	0	0	0	0	114.4	Y406 T410 S455 I456 S461 N462	Y406-S459 WeakPolarHBondContact CE2-O 3.31Å; Y406-S459 PolarHBondContact OH-O 3.43Å; Y406-S459 PolarHBondContact OH-OG 2.92Å; T410-S459 WeakPolarHBondContact CG2-OG 3.47Å; S455-S459 VanDerWaalsContact O-CB 3.29Å; S455-S459 WeakPolarHBondContact O-CB 3.49Å; S455-S459 PolarHBondContact O-N 3.36Å; S455-S459 PolarHBondContact O-OG 2.91Å; I456-S459 PolarHBondContact O-N 3.03Å; I456-S459 PolarHBondContact O-OG 2.67Å; S459-S461 PolarHBondContact O-N 2.99Å; S459-S461 VanDerWaalsContact O-N 3.14Å; S459-N462 PolarHBondContact O-N 2.79Å
460	S	84.3	Confident	86	Confident	16 Å²	16	38.9 Å²	38.9	11%	0.112	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-55.2	-33.1	-178	57.3	0	0	0	0	113.4	Q458 N462 C463 E577 K584	Q458-S460 VanDerWaalsContact C-N 3.33Å; Q458-S460 PolarHBondContact O-N 3.38Å; S460-N462 VanDerWaalsContact C-N 3.26Å; S460-N462 PolarHBondContact O-N 2.97Å; S460-C463 PolarHBondContact O-N 3.44Å; S460-E577 WeakPolarHBondContact CB-OE2 3.13Å; S460-E577 PolarHBondContact OG-OE2 3.24Å; S460-K584 PolarHBondContact O-NZ 3.32Å
461	S	77.3	Confident	86.1	Confident	73 Å²	73	34.6 Å²	34.6	51%	0.51	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-63.4	-29.4	176	61	0	0	0	0	113.2	S459 K584	S459-S461 PolarHBondContact O-N 2.99Å; S459-S461 VanDerWaalsContact O-N 3.14Å; S461-K584 PolarHBondContact O-NZ 3.04Å
462	N	75.7	Confident	85.9	Confident	78 Å²	78	34 Å²	34	42%	0.417	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-97.3	-1	-173	-59	-12.1	0	0	0	112.9	Y406 S459 S460	Y406-N462 HydrophobicContact CD2-CB 3.98Å; Y406-N462 VanDerWaalsContact CD2-O 3.25Å; Y406-N462 WeakPolarHBondContact CD2-O 3.15Å; Y406-N462 HydrophobicContact CE2-CB 3.98Å; S459-N462 PolarHBondContact O-N 2.79Å; S460-N462 VanDerWaalsContact C-N 3.26Å; S460-N462 PolarHBondContact O-N 2.97Å
463	C	77.9	Confident	85.8	Confident	6 Å²	6	35.2 Å²	35.2	4%	0.041	20%	0.201	C	C	.	.	S	Bend	trans	-63.5	130	177.4	-173.2	0	0	0	0	111	Y406 S460 C468 I578	Y406-C463 HydrophobicContact CE1-CB 4.48Å; Y406-C463 HydrophobicContact CE2-CB 4.44Å; S460-C463 PolarHBondContact O-N 3.44Å; C463-C468 VanDerWaalsContact SG-SG 3.64Å; C463-I578 HydrophobicContact CB-CG2 3.99Å
464	P	80.9	Confident	85.7	Confident	18 Å²	18	34.9 Å²	34.9	12%	0.117	20%	0.199	C	C	.	.			trans	-59.2	139.4	179.9	-26.5	35	0	0	0	113.3	V402 L466 M467 C468	V402-P464 HydrophobicContact CG1-CB 3.61Å; V402-P464 HydrophobicContact CG1-CG 4.08Å; P464-L466 VanDerWaalsContact C-N 3.33Å; P464-L466 PolarHBondContact O-N 3.46Å; P464-M467 HydrophobicContact CB-CG 4.3Å; P464-M467 HydrophobicContact CB-SD 4.27Å; P464-M467 HydrophobicContact CG-CG 4.49Å; P464-M467 HydrophobicContact CG-SD 3.82Å; P464-M467 WeakPolarHBondContact O-CB 3.38Å; P464-M467 PolarHBondContact O-N 2.99Å; P464-M467 VanDerWaalsContact O-N 3.12Å; P464-C468 PolarHBondContact O-N 3.3Å
465	P	76.8	Confident	85.6	Confident	86 Å²	86	35.3 Å²	35.3	56%	0.558	20%	0.195	S	C	*	.	H	α-helix	trans	-56.5	-42.7	-177.9	-27	34.6	0	0	0	113.9	M467 C468 D469	P465-M467 VanDerWaalsContact C-N 3.3Å; P465-M467 PolarHBondContact O-N 3.4Å; P465-C468 WeakPolarHBondContact O-CA 3.17Å; P465-C468 VanDerWaalsContact O-CB 3.3Å; P465-C468 WeakPolarHBondContact O-CB 3.38Å; P465-C468 PolarHBondContact O-N 2.86Å; P465-D469 PolarHBondContact O-N 2.7Å
466	L	81.9	Confident	85.4	Confident	48 Å²	48	39.7 Å²	39.7	25%	0.251	21%	0.212	S	C	.	.	H	α-helix	trans	-61.6	-37.4	179.4	176.6	63.7	0	0	0	112.6	L358 V364 V402 P464 C468 D469 V470	L358-L466 HydrophobicContact CD2-CD2 3.43Å; L358-L466 VanDerWaalsContact CD2-CD2 3.43Å; V364-L466 HydrophobicContact CG2-CD1 3.42Å; V364-L466 VanDerWaalsContact CG2-CD1 3.42Å; V402-L466 HydrophobicContact CG1-CB 4.4Å; V402-L466 HydrophobicContact CG1-CD2 4.44Å; V402-L466 HydrophobicContact CG2-CD2 3.75Å; P464-L466 VanDerWaalsContact C-N 3.33Å; P464-L466 PolarHBondContact O-N 3.46Å; L466-C468 VanDerWaalsContact C-N 3.35Å; L466-D469 PolarHBondContact O-N 3.32Å; L466-V470 WeakPolarHBondContact O-CG2 3.24Å; L466-V470 PolarHBondContact O-N 2.91Å
467	M	85.4	Confident	85.2	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-41.9	174.1	-71.3	176.8	61.9	0	0	110.6	M398 M399 V402 P464 P465 D469 V470 F471 F501	M398-M467 HydrophobicContact CE-CG 4.44Å; M398-M467 HydrophobicContact SD-CG 3.85Å; M399-M467 HydrophobicContact CB-CE 4.44Å; M399-M467 HydrophobicContact CG-CE 3.99Å; M399-M467 HydrophobicContact SD-CE 4.3Å; V402-M467 HydrophobicContact CG1-CG 4.25Å; P464-M467 HydrophobicContact CB-CG 4.3Å; P464-M467 HydrophobicContact CB-SD 4.27Å; P464-M467 HydrophobicContact CG-CG 4.49Å; P464-M467 HydrophobicContact CG-SD 3.82Å; P464-M467 WeakPolarHBondContact O-CB 3.38Å; P464-M467 PolarHBondContact O-N 2.99Å; P464-M467 VanDerWaalsContact O-N 3.12Å; P465-M467 VanDerWaalsContact C-N 3.3Å; P465-M467 PolarHBondContact O-N 3.4Å; M467-D469 VanDerWaalsContact C-N 3.33Å; M467-D469 PolarHBondContact O-N 2.56Å; M467-V470 PolarHBondContact O-N 3.35Å; M467-F471 HydrophobicContact CB-CD2 4.45Å; M467-F471 HydrophobicContact CB-CE2 3.88Å; M467-F471 HydrophobicContact CB-CZ 4.22Å; M467-F471 HydrophobicContact CE-CE2 3.92Å; M467-F471 HydrophobicContact CE-CZ 3.73Å; M467-F471 WeakPolarHBondContact O-CD2 3.27Å; M467-F471 WeakPolarHBondContact O-CG 3.5Å; M467-F471 PolarHBondContact O-N 3.41Å; M467-F501 HydrophobicContact CE-CD1 4.25Å; M467-F501 HydrophobicContact CE-CE1 3.86Å; M467-F501 HydrophobicContact CE-CZ 4.11Å
468	C	86.1	Confident	85.1	Confident	13 Å²	13	40.3 Å²	40.3	9%	0.088	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-41.8	176	-64.9	0	0	0	0	112.4	C463 P464 P465 L466 F471 R472 I578	C463-C468 VanDerWaalsContact SG-SG 3.64Å; P464-C468 PolarHBondContact O-N 3.3Å; P465-C468 WeakPolarHBondContact O-CA 3.17Å; P465-C468 VanDerWaalsContact O-CB 3.3Å; P465-C468 WeakPolarHBondContact O-CB 3.38Å; P465-C468 PolarHBondContact O-N 2.86Å; L466-C468 VanDerWaalsContact C-N 3.35Å; C468-F471 PolarHBondContact O-N 3.29Å; C468-R472 WeakPolarHBondContact O-CB 3.49Å; C468-R472 PolarHBondContact O-N 3.06Å; C468-I578 VanDerWaalsContact CA-O 3.23Å; C468-I578 WeakPolarHBondContact CA-O 3.07Å; C468-I578 VanDerWaalsContact CB-O 3.25Å; C468-I578 WeakPolarHBondContact CB-O 3.2Å; C468-I578 PolarHBondContact SG-O 3.47Å
469	D	83.8	Confident	85	Confident	62 Å²	62	35.6 Å²	35.6	33%	0.332	20%	0.197	S	C	.	.	H	α-helix	trans	-63.8	-41.5	177.9	-67.3	-29.1	0	0	0	112.2	V364 P465 L466 M467 R472 S473	V364-D469 HydrophobicContact CG2-CB 4.45Å; P465-D469 PolarHBondContact O-N 2.7Å; L466-D469 PolarHBondContact O-N 3.32Å; M467-D469 VanDerWaalsContact C-N 3.33Å; M467-D469 PolarHBondContact O-N 2.56Å; D469-R472 PolarHBondContact O-N 2.7Å; D469-R472 IonicContact OD1-CZ 2.91Å; D469-R472 IonicContact OD1-NH1 2.81Å; D469-R472 PolarHBondContact OD1-NH1 3.22Å; D469-R472 IonicContact OD1-NH2 3.57Å; D469-S473 PolarHBondContact O-N 3.42Å
470	V	89.6	Confident	84.8	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-47.2	175.3	174	0	0	0	0	110.7	F363 V364 V367 I395 M398 L466 M467 R472 S473 L474	F363-V470 HydrophobicContact CD1-CG2 4.21Å; F363-V470 HydrophobicContact CE1-CG2 3.92Å; V364-V470 HydrophobicContact CG2-CG2 4Å; V367-V470 HydrophobicContact CG1-CG1 4.3Å; V367-V470 HydrophobicContact CG1-CG2 4.29Å; I395-V470 HydrophobicContact CG1-CG1 4.27Å; I395-V470 HydrophobicContact CG2-CG1 4.47Å; M398-V470 HydrophobicContact CE-CB 4.17Å; M398-V470 HydrophobicContact CE-CG1 4.11Å; M398-V470 HydrophobicContact CE-CG2 3.99Å; L466-V470 WeakPolarHBondContact O-CG2 3.24Å; L466-V470 PolarHBondContact O-N 2.91Å; M467-V470 PolarHBondContact O-N 3.35Å; V470-R472 VanDerWaalsContact C-N 3.31Å; V470-R472 PolarHBondContact O-N 3.33Å; V470-S473 WeakPolarHBondContact O-CB 3.41Å; V470-S473 PolarHBondContact O-N 2.95Å; V470-L474 HydrophobicContact CG1-CD1 3.93Å; V470-L474 HydrophobicContact CG1-CG 4.36Å; V470-L474 VanDerWaalsContact O-CG 3.31Å; V470-L474 WeakPolarHBondContact O-CG 3.29Å; V470-L474 PolarHBondContact O-N 2.99Å
471	F	90.9	Very high	84.8	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-37.9	178.5	-61.6	-30.7	0	0	0	112.6	M399 M467 C468 L474 R475 V493 F496 V497 I578	M399-F471 HydrophobicContact SD-CE1 4.03Å; M399-F471 HydrophobicContact SD-CZ 3.9Å; M467-F471 HydrophobicContact CB-CD2 4.45Å; M467-F471 HydrophobicContact CB-CE2 3.88Å; M467-F471 HydrophobicContact CB-CZ 4.22Å; M467-F471 HydrophobicContact CE-CE2 3.92Å; M467-F471 HydrophobicContact CE-CZ 3.73Å; M467-F471 WeakPolarHBondContact O-CD2 3.27Å; M467-F471 WeakPolarHBondContact O-CG 3.5Å; M467-F471 PolarHBondContact O-N 3.41Å; C468-F471 PolarHBondContact O-N 3.29Å; F471-L474 HydrophobicContact CD1-CD1 4.45Å; F471-L474 PolarHBondContact O-N 3.24Å; F471-R475 VanDerWaalsContact O-CB 3.31Å; F471-R475 WeakPolarHBondContact O-CB 3.32Å; F471-R475 PolarHBondContact O-N 2.97Å; F471-V493 HydrophobicContact CB-CG1 3.88Å; F471-V493 HydrophobicContact CB-CG2 4.4Å; F471-V493 HydrophobicContact CD1-CG1 4.11Å; F471-V493 HydrophobicContact CD2-CG1 4.42Å; F471-V493 HydrophobicContact CG-CG1 3.89Å; F471-F496 HydrophobicContact CE1-CB 4.13Å; F471-V497 HydrophobicContact CD1-CG2 4.39Å; F471-V497 HydrophobicContact CD2-CG2 4.21Å; F471-V497 HydrophobicContact CE1-CG2 3.84Å; F471-V497 HydrophobicContact CE2-CG2 3.61Å; F471-V497 HydrophobicContact CZ-CG2 3.42Å; F471-V497 VanDerWaalsContact CZ-CG2 3.42Å; F471-I578 HydrophobicContact CD2-CD1 3.94Å; F471-I578 HydrophobicContact CD2-CG1 4.25Å; F471-I578 HydrophobicContact CE2-CD1 4.16Å
472	R	88.6	Confident	85	Confident	67 Å²	67	45 Å²	45	25%	0.253	22%	0.223	S	C	.	.	H	α-helix	trans	-61.4	-47.2	172.8	-175.4	-168.8	-57.8	129.5	4.9	111.5	C468 D469 V470 R475 H476 S580 N581	C468-R472 WeakPolarHBondContact O-CB 3.49Å; C468-R472 PolarHBondContact O-N 3.06Å; D469-R472 PolarHBondContact O-N 2.7Å; D469-R472 IonicContact OD1-CZ 2.91Å; D469-R472 IonicContact OD1-NH1 2.81Å; D469-R472 PolarHBondContact OD1-NH1 3.22Å; D469-R472 IonicContact OD1-NH2 3.57Å; V470-R472 VanDerWaalsContact C-N 3.31Å; V470-R472 PolarHBondContact O-N 3.33Å; R472-R475 PolarHBondContact O-N 3.38Å; R472-H476 WeakPolarHBondContact O-CB 3.5Å; R472-H476 PolarHBondContact O-N 3.46Å; R472-S580 PolarHBondContact NE-O 3.48Å; R472-S580 PolarHBondContact NH2-O 3.45Å; R472-N581 WeakPolarHBondContact CD-OD1 3.26Å; R472-N581 PolarHBondContact NE-OD1 2.92Å
473	S	89.9	Confident	84.9	Confident	26 Å²	26	49 Å²	49	18%	0.182	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-48	178	-173.8	0	0	0	0	111.5	S368 D469 V470 R475 H476 L477	S368-S473 WeakPolarHBondContact CB-OG 3.25Å; S368-S473 PolarHBondContact OG-OG 2.69Å; D469-S473 PolarHBondContact O-N 3.42Å; V470-S473 WeakPolarHBondContact O-CB 3.41Å; V470-S473 PolarHBondContact O-N 2.95Å; S473-R475 PolarHBondContact O-N 3.05Å; S473-H476 PolarHBondContact O-N 2.86Å; S473-L477 VanDerWaalsContact O-CG 3.31Å; S473-L477 WeakPolarHBondContact O-CG 3.49Å; S473-L477 PolarHBondContact O-N 2.96Å
474	L	90.2	Very high	84.4	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-43.5	177.7	-66.9	170.2	0	0	0	112.3	A371 F385 I395 V470 F471 L477 A478 F496	A371-L474 HydrophobicContact CB-CD2 3.74Å; F385-L474 HydrophobicContact CE2-CD2 3.92Å; F385-L474 HydrophobicContact CZ-CD2 3.87Å; I395-L474 HydrophobicContact CD1-CD1 3.84Å; I395-L474 HydrophobicContact CD1-CD2 4.08Å; V470-L474 HydrophobicContact CG1-CD1 3.93Å; V470-L474 HydrophobicContact CG1-CG 4.36Å; V470-L474 VanDerWaalsContact O-CG 3.31Å; V470-L474 WeakPolarHBondContact O-CG 3.29Å; V470-L474 PolarHBondContact O-N 2.99Å; F471-L474 HydrophobicContact CD1-CD1 4.45Å; F471-L474 PolarHBondContact O-N 3.24Å; L474-L477 PolarHBondContact O-N 2.96Å; L474-A478 VanDerWaalsContact O-CB 3.31Å; L474-A478 WeakPolarHBondContact O-CB 3.38Å; L474-A478 PolarHBondContact O-N 3.38Å; L474-F496 HydrophobicContact CD1-CD2 3.79Å; L474-F496 HydrophobicContact CD1-CE2 3.73Å
475	R	88.5	Confident	84.1	Confident	44 Å²	44	54.4 Å²	54.4	17%	0.166	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-47.8	175.5	-173.9	-177.5	176.7	161.6	4.7	110.9	F471 R472 S473 A478 C479 Q489 V493 D576 S579	F471-R475 VanDerWaalsContact O-CB 3.31Å; F471-R475 WeakPolarHBondContact O-CB 3.32Å; F471-R475 PolarHBondContact O-N 2.97Å; R472-R475 PolarHBondContact O-N 3.38Å; S473-R475 PolarHBondContact O-N 3.05Å; R475-A478 PolarHBondContact O-N 3.12Å; R475-C479 WeakPolarHBondContact O-CB 3.45Å; R475-C479 PolarHBondContact O-N 3.37Å; R475-C479 PolarHBondContact O-SG 2.83Å; R475-Q489 HydrophobicContact CG-CB 3.91Å; R475-V493 HydrophobicContact CB-CG2 4.04Å; R475-D576 IonicContact CZ-OD1 2.73Å; R475-D576 VanDerWaalsContact CZ-OD1 3.27Å; R475-D576 IonicContact NH1-OD1 3.5Å; R475-D576 PolarHBondContact NH1-OD1 3.03Å; R475-D576 IonicContact NH2-OD1 3.08Å; R475-D576 PolarHBondContact NH2-OD1 3.27Å; R475-S579 PolarHBondContact NH1-OG 3.26Å
476	H	88.2	Confident	83.8	Confident	125 Å²	125	54.4 Å²	54.4	58%	0.579	29%	0.289	S	S	*	.	H	α-helix	trans	-61.8	-45.4	179.3	-179.7	73.5	0	0	0	112.3	R472 S473 C479 K480	R472-H476 WeakPolarHBondContact O-CB 3.5Å; R472-H476 PolarHBondContact O-N 3.46Å; S473-H476 PolarHBondContact O-N 2.86Å; H476-C479 PolarHBondContact O-N 2.91Å; H476-K480 WeakPolarHBondContact O-CB 3.27Å; H476-K480 PolarHBondContact O-N 3.3Å
477	L	87.4	Confident	83.5	Confident	31 Å²	31	56.3 Å²	56.3	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-43.6	177.9	-69.4	170.9	0	0	0	111.9	S368 A371 A372 L375 S473 L474 K480 R481	S368-L477 WeakPolarHBondContact O-CD1 3.31Å; A371-L477 HydrophobicContact CB-CD1 4.24Å; A372-L477 HydrophobicContact CB-CD1 4.43Å; A372-L477 HydrophobicContact CB-CD2 4.09Å; L375-L477 HydrophobicContact CD1-CB 3.61Å; S473-L477 VanDerWaalsContact O-CG 3.31Å; S473-L477 WeakPolarHBondContact O-CG 3.49Å; S473-L477 PolarHBondContact O-N 2.96Å; L474-L477 PolarHBondContact O-N 2.96Å; L477-K480 PolarHBondContact O-N 2.76Å; L477-R481 PolarHBondContact O-N 2.99Å; L477-R481 VanDerWaalsContact O-N 3.12Å
478	A	87	Confident	83.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-43.4	178	0	0	0	0	0	111.9	L474 R475 K480 R481 F482 V488 A492	L474-A478 VanDerWaalsContact O-CB 3.31Å; L474-A478 WeakPolarHBondContact O-CB 3.38Å; L474-A478 PolarHBondContact O-N 3.38Å; R475-A478 PolarHBondContact O-N 3.12Å; A478-K480 VanDerWaalsContact C-N 3.33Å; A478-K480 PolarHBondContact O-N 3.34Å; A478-R481 PolarHBondContact O-N 2.93Å; A478-F482 PolarHBondContact O-N 3.15Å; A478-V488 HydrophobicContact CB-CG1 3.97Å; A478-A492 HydrophobicContact CB-CB 3.77Å
479	C	85.3	Confident	82.8	Confident	44 Å²	44	57.3 Å²	57.3	30%	0.297	30%	0.3	S	S	.	.	H	α-helix	trans	-59.3	-42.8	173.7	-75.6	0	0	0	0	112.3	R475 H476 R481 F482 L483 Q489	R475-C479 WeakPolarHBondContact O-CB 3.45Å; R475-C479 PolarHBondContact O-N 3.37Å; R475-C479 PolarHBondContact O-SG 2.83Å; H476-C479 PolarHBondContact O-N 2.91Å; C479-R481 VanDerWaalsContact C-N 3.33Å; C479-R481 PolarHBondContact O-N 3.27Å; C479-F482 CarbonylContact O-C 3.53Å; C479-L483 WeakPolarHBondContact O-CD2 3.15Å; C479-L483 PolarHBondContact O-N 2.64Å; C479-Q489 WeakPolarHBondContact SG-CB 3.2Å
480	K	85.7	Confident	82.8	Confident	152 Å²	152	55.5 Å²	55.5	66%	0.661	29%	0.289	S	S	*	.	H	α-helix	trans	-64.3	-37.8	-179.7	-174.5	-178.8	176.7	-175	0	112.1	H476 L477 A478	H476-K480 WeakPolarHBondContact O-CB 3.27Å; H476-K480 PolarHBondContact O-N 3.3Å; L477-K480 PolarHBondContact O-N 2.76Å; A478-K480 VanDerWaalsContact C-N 3.33Å; A478-K480 PolarHBondContact O-N 3.34Å
481	R	82.7	Confident	82.4	Confident	106 Å²	106	56.4 Å²	56.4	40%	0.4	30%	0.295	S	S	.	.	H	α-helix	trans	-78	-37.1	-178.4	-176.8	65.6	177	95.6	-3.6	113.1	L375 L477 A478 C479	L375-R481 PolarHBondContact O-NE 2.87Å; L477-R481 PolarHBondContact O-N 2.99Å; L477-R481 VanDerWaalsContact O-N 3.12Å; A478-R481 PolarHBondContact O-N 2.93Å; C479-R481 VanDerWaalsContact C-N 3.33Å; C479-R481 PolarHBondContact O-N 3.27Å
482	F	81.6	Confident	82.2	Confident	35 Å²	35	56.4 Å²	56.4	15%	0.154	30%	0.295	C	S	.	.			trans	-122	66.6	-174.5	-62.4	-82.1	0	0	0	111.4	A381 I384 A478 C479 G484 D485 V488	A381-F482 HydrophobicContact CB-CD1 4.39Å; A381-F482 HydrophobicContact CB-CE1 4.42Å; I384-F482 HydrophobicContact CD1-CD2 3.68Å; I384-F482 HydrophobicContact CD1-CE2 3.41Å; I384-F482 VanDerWaalsContact CD1-CE2 3.41Å; I384-F482 HydrophobicContact CD1-CZ 4.14Å; I384-F482 HydrophobicContact CG1-CE2 3.99Å; I384-F482 HydrophobicContact CG1-CZ 4.47Å; A478-F482 PolarHBondContact O-N 3.15Å; C479-F482 CarbonylContact O-C 3.53Å; F482-G484 PolarHBondContact O-N 3.42Å; F482-D485 PolarHBondContact O-N 3.25Å; F482-V488 HydrophobicContact CB-CB 4.29Å; F482-V488 HydrophobicContact CB-CG1 3.99Å; F482-V488 HydrophobicContact CB-CG2 4.18Å; F482-V488 HydrophobicContact CD2-CG1 3.88Å; F482-V488 HydrophobicContact CG-CG1 4.19Å; F482-V488 HydrophobicContact CG-CG2 4.47Å
483	L	74.6	Confident	82.2	Confident	161 Å²	161	53.2 Å²	53.2	84%	0.843	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.4	-176.1	-67	164	0	0	0	114.8	C479	C479-L483 WeakPolarHBondContact O-CD2 3.15Å; C479-L483 PolarHBondContact O-N 2.64Å
484	G	67.3	Low	82	Confident	78 Å²	78	52.3 Å²	52.3	80%	0.804	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-5.6	-175.5	0	0	0	0	0	116.4	F482	F482-G484 PolarHBondContact O-N 3.42Å
485	D	73.8	Confident	81.8	Confident	60 Å²	60	52.5 Å²	52.5	32%	0.321	28%	0.278	S	S	.	.			trans	-129.2	103.2	-177.2	-171.8	-10.8	0	0	0	112	F482 H487 V488	F482-D485 PolarHBondContact O-N 3.25Å; D485-H487 PolarHBondContact O-N 3.26Å; D485-H487 VanDerWaalsContact O-N 3.11Å; D485-H487 WeakPolarHBondContact OD1-CA 3.43Å; D485-H487 WeakPolarHBondContact OD1-CB 3.27Å; D485-H487 IonicContact OD1-CD2 3.27Å; D485-H487 PolarHBondContact OD1-CD2 2.83Å; D485-H487 IonicContact OD1-CG 2.91Å; D485-H487 PolarHBondContact OD1-N 3.31Å; D485-V488 HydrophobicContact CB-CG2 3.78Å; D485-V488 PolarHBondContact O-N 3.12Å
486	P	71.6	Confident	81.9	Confident	85 Å²	85	50.4 Å²	50.4	55%	0.552	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.4	176.5	-21.4	32.7	0	0	0	114.2	Q489 Y490	P486-Q489 WeakPolarHBondContact O-CG 3.46Å; P486-Q489 PolarHBondContact O-NE2 3.45Å; P486-Y490 WeakPolarHBondContact O-CD2 3.47Å; P486-Y490 WeakPolarHBondContact O-CE2 3.46Å
487	H	74.7	Confident	82	Confident	88 Å²	88	44.6 Å²	44.6	41%	0.407	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-26.4	-179.6	-56.3	-60.3	0	0	0	112.5	D485 Q489 Y490 S491 W540	D485-H487 PolarHBondContact O-N 3.26Å; D485-H487 VanDerWaalsContact O-N 3.11Å; D485-H487 WeakPolarHBondContact OD1-CA 3.43Å; D485-H487 WeakPolarHBondContact OD1-CB 3.27Å; D485-H487 IonicContact OD1-CD2 3.27Å; D485-H487 PolarHBondContact OD1-CD2 2.83Å; D485-H487 IonicContact OD1-CG 2.91Å; D485-H487 PolarHBondContact OD1-N 3.31Å; H487-Q489 VanDerWaalsContact C-N 3.27Å; H487-Q489 PolarHBondContact O-N 3.19Å; H487-Y490 PolarHBondContact O-N 3.36Å; H487-Y490 VanDerWaalsContact O-N 3.13Å; H487-S491 PolarHBondContact O-N 3.09Å; H487-W540 AromaticContact CE1-CE2 3.88Å; H487-W540 AromaticContact CE1-CZ2 3.71Å; H487-W540 AromaticContact CE1-NE1 3.53Å; H487-W540 AromaticContact CG-NE1 3.44Å; H487-W540 AromaticContact ND1-CD1 3.92Å; H487-W540 AromaticContact ND1-CE2 3.22Å; H487-W540 AromaticContact ND1-CZ2 3.31Å; H487-W540 VanDerWaalsContact ND1-CZ2 3.31Å; H487-W540 WeakPolarHBondContact ND1-CZ2 3.28Å; H487-W540 AromaticContact ND1-NE1 2.92Å; H487-W540 PolarHBondContact ND1-NE1 3.37Å
488	V	79.3	Confident	82.1	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-37.9	-178.6	167.6	0	0	0	0	112.1	A381 I384 A478 F482 D485 Y490 S491 A492	A381-V488 HydrophobicContact CB-CG2 3.59Å; I384-V488 HydrophobicContact CD1-CG1 3.43Å; I384-V488 VanDerWaalsContact CD1-CG1 3.43Å; I384-V488 HydrophobicContact CD1-CG2 4.46Å; A478-V488 HydrophobicContact CB-CG1 3.97Å; F482-V488 HydrophobicContact CB-CB 4.29Å; F482-V488 HydrophobicContact CB-CG1 3.99Å; F482-V488 HydrophobicContact CB-CG2 4.18Å; F482-V488 HydrophobicContact CD2-CG1 3.88Å; F482-V488 HydrophobicContact CG-CG1 4.19Å; F482-V488 HydrophobicContact CG-CG2 4.47Å; D485-V488 HydrophobicContact CB-CG2 3.78Å; D485-V488 PolarHBondContact O-N 3.12Å; V488-Y490 VanDerWaalsContact C-N 3.27Å; V488-Y490 PolarHBondContact O-N 3.35Å; V488-S491 PolarHBondContact O-N 3.06Å; V488-A492 WeakPolarHBondContact O-CB 3.32Å; V488-A492 PolarHBondContact O-N 3.02Å
489	Q	79.1	Confident	82	Confident	34 Å²	34	45.3 Å²	45.3	16%	0.159	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-34.7	179.3	83.3	-171.5	-60.5	0	0	112.8	R475 C479 P486 H487	R475-Q489 HydrophobicContact CG-CB 3.91Å; C479-Q489 WeakPolarHBondContact SG-CB 3.2Å; P486-Q489 WeakPolarHBondContact O-CG 3.46Å; P486-Q489 PolarHBondContact O-NE2 3.45Å; H487-Q489 VanDerWaalsContact C-N 3.27Å; H487-Q489 PolarHBondContact O-N 3.19Å
490	Y	82.1	Confident	82.2	Confident	24 Å²	24	44.8 Å²	44.8	9%	0.094	24%	0.239	C	C	.	.	H	α-helix	trans	-84.5	-38	178.1	-60.3	-75.7	0	0	0	111	P486 H487 V488 A492 V493 S494 K572 L575 D576	P486-Y490 WeakPolarHBondContact O-CD2 3.47Å; P486-Y490 WeakPolarHBondContact O-CE2 3.46Å; H487-Y490 PolarHBondContact O-N 3.36Å; H487-Y490 VanDerWaalsContact O-N 3.13Å; V488-Y490 VanDerWaalsContact C-N 3.27Å; V488-Y490 PolarHBondContact O-N 3.35Å; Y490-A492 VanDerWaalsContact C-N 3.33Å; Y490-A492 PolarHBondContact O-N 2.68Å; Y490-V493 PolarHBondContact O-N 3.47Å; Y490-S494 WeakPolarHBondContact O-CB 3.4Å; Y490-S494 PolarHBondContact O-N 2.77Å; Y490-K572 HydrophobicContact CD1-CG 4.31Å; Y490-K572 HydrophobicContact CE1-CG 3.73Å; Y490-K572 WeakPolarHBondContact OH-CE 3.44Å; Y490-L575 HydrophobicContact CD1-CB 4.19Å; Y490-L575 HydrophobicContact CD1-CD1 4.21Å; Y490-D576 WeakPolarHBondContact CE1-OD1 3.2Å; Y490-D576 PolarHBondContact OH-OD1 3.36Å
491	S	82.6	Confident	82.5	Confident	20 Å²	20	37.6 Å²	37.6	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-42.8	176.8	-173.4	0	0	0	0	111.9	H487 V488 V493 S494 S495	H487-S491 PolarHBondContact O-N 3.09Å; V488-S491 PolarHBondContact O-N 3.06Å; S491-V493 PolarHBondContact O-N 3Å; S491-S494 PolarHBondContact O-N 3Å; S491-S495 PolarHBondContact O-N 3.06Å; S491-S495 VanDerWaalsContact O-N 3.11Å
492	A	84.9	Confident	83	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-38.6	-179.7	0	0	0	0	0	113.2	I384 F385 A478 V488 Y490 S495 F496	I384-A492 HydrophobicContact CG2-CB 4.13Å; F385-A492 HydrophobicContact CD2-CB 4.26Å; F385-A492 HydrophobicContact CE2-CB 4.42Å; A478-A492 HydrophobicContact CB-CB 3.77Å; V488-A492 WeakPolarHBondContact O-CB 3.32Å; V488-A492 PolarHBondContact O-N 3.02Å; Y490-A492 VanDerWaalsContact C-N 3.33Å; Y490-A492 PolarHBondContact O-N 2.68Å; A492-S495 PolarHBondContact O-OG 3.44Å; A492-S495 VanDerWaalsContact O-OG 3.06Å; A492-F496 VanDerWaalsContact O-CD2 3.3Å; A492-F496 WeakPolarHBondContact O-CD2 3.37Å
493	V	89.1	Confident	83.5	Confident	1 Å²	1	31 Å²	31	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-82.8	-39.8	178.3	-178.6	0	0	0	0	111.3	F471 R475 Y490 S491 S495 F496 V497 L575 I578	F471-V493 HydrophobicContact CB-CG1 3.88Å; F471-V493 HydrophobicContact CB-CG2 4.4Å; F471-V493 HydrophobicContact CD1-CG1 4.11Å; F471-V493 HydrophobicContact CD2-CG1 4.42Å; F471-V493 HydrophobicContact CG-CG1 3.89Å; R475-V493 HydrophobicContact CB-CG2 4.04Å; Y490-V493 PolarHBondContact O-N 3.47Å; S491-V493 PolarHBondContact O-N 3Å; V493-S495 VanDerWaalsContact C-N 3.29Å; V493-S495 PolarHBondContact O-N 3.43Å; V493-F496 PolarHBondContact O-N 3.05Å; V493-F496 VanDerWaalsContact O-N 3.16Å; V493-V497 HydrophobicContact CG1-CG2 4.03Å; V493-V497 WeakPolarHBondContact O-CG2 3.45Å; V493-V497 PolarHBondContact O-N 2.8Å; V493-V497 VanDerWaalsContact O-N 3.1Å; V493-L575 HydrophobicContact CB-CD2 4.42Å; V493-L575 HydrophobicContact CG1-CD2 3.95Å; V493-I578 HydrophobicContact CG1-CD1 4.32Å
494	S	87.3	Confident	84.3	Confident	6 Å²	6	25.9 Å²	25.9	4%	0.042	16%	0.158	C	C	.	.	H	α-helix	trans	-61.7	-36.2	-179	-177.6	0	0	0	0	112.7	Y490 S491 F496 V497 F498 L499 G538	Y490-S494 WeakPolarHBondContact O-CB 3.4Å; Y490-S494 PolarHBondContact O-N 2.77Å; S491-S494 PolarHBondContact O-N 3Å; S494-F496 PolarHBondContact O-N 3.42Å; S494-V497 PolarHBondContact O-N 3.19Å; S494-F498 PolarHBondContact O-N 3.24Å; S494-L499 PolarHBondContact O-N 2.81Å; S494-G538 PolarHBondContact OG-O 3.09Å
495	S	85.8	Confident	85.4	Confident	7 Å²	7	22.1 Å²	22.1	5%	0.049	12%	0.119	C	C	.	.	I	π-helix	trans	-60.2	-32.7	177.2	70	0	0	0	0	112.8	S491 A492 V493 L499 R500	S491-S495 PolarHBondContact O-N 3.06Å; S491-S495 VanDerWaalsContact O-N 3.11Å; A492-S495 PolarHBondContact O-OG 3.44Å; A492-S495 VanDerWaalsContact O-OG 3.06Å; V493-S495 VanDerWaalsContact C-N 3.29Å; V493-S495 PolarHBondContact O-N 3.43Å; S495-L499 WeakPolarHBondContact O-CB 3.33Å; S495-R500 WeakPolarHBondContact O-CG 3.26Å; S495-R500 PolarHBondContact O-N 2.94Å
496	F	89.7	Confident	86.2	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.104	C	C	.	.	I	π-helix	trans	-79.1	-50.9	173.9	-72.5	-70.6	0	0	0	111.7	F385 T392 I395 M399 F471 L474 A492 V493 S494 R500 F501	F385-F496 HydrophobicContact CB-CE2 3.61Å; F385-F496 HydrophobicContact CB-CZ 3.69Å; F385-F496 HydrophobicContact CD1-CE2 4.29Å; F385-F496 HydrophobicContact CD1-CZ 4.15Å; F385-F496 AromaticContact CD2-CE2 3.73Å; F385-F496 HydrophobicContact CD2-CE2 3.73Å; F385-F496 HydrophobicContact CD2-CZ 4.39Å; F385-F496 AromaticContact CG-CE2 3.62Å; F385-F496 HydrophobicContact CG-CE2 3.62Å; F385-F496 AromaticContact CG-CZ 3.83Å; F385-F496 HydrophobicContact CG-CZ 3.83Å; T392-F496 HydrophobicContact CG2-CE1 3.96Å; T392-F496 HydrophobicContact CG2-CZ 3.77Å; I395-F496 HydrophobicContact CB-CD1 4.04Å; I395-F496 HydrophobicContact CB-CE1 3.77Å; I395-F496 HydrophobicContact CB-CZ 4.37Å; I395-F496 HydrophobicContact CD1-CD1 4.45Å; I395-F496 HydrophobicContact CD1-CE1 3.73Å; I395-F496 HydrophobicContact CD1-CE2 3.92Å; I395-F496 HydrophobicContact CD1-CZ 3.4Å; I395-F496 VanDerWaalsContact CD1-CZ 3.4Å; I395-F496 HydrophobicContact CG1-CE1 4.35Å; I395-F496 HydrophobicContact CG1-CZ 4.48Å; I395-F496 HydrophobicContact CG2-CD1 3.53Å; I395-F496 HydrophobicContact CG2-CE1 3.79Å; I395-F496 HydrophobicContact CG2-CG 4.03Å; I395-F496 HydrophobicContact CG2-CZ 4.45Å; M399-F496 HydrophobicContact CE-CB 4.11Å; M399-F496 HydrophobicContact CE-CD1 4.1Å; M399-F496 HydrophobicContact SD-CB 4.16Å; F471-F496 HydrophobicContact CE1-CB 4.13Å; L474-F496 HydrophobicContact CD1-CD2 3.79Å; L474-F496 HydrophobicContact CD1-CE2 3.73Å; A492-F496 VanDerWaalsContact O-CD2 3.3Å; A492-F496 WeakPolarHBondContact O-CD2 3.37Å; V493-F496 PolarHBondContact O-N 3.05Å; V493-F496 VanDerWaalsContact O-N 3.16Å; S494-F496 PolarHBondContact O-N 3.42Å; F496-R500 CarbonylContact O-C 3.59Å; F496-R500 WeakPolarHBondContact O-CB 3.48Å; F496-R500 PolarHBondContact O-N 2.85Å; F496-F501 WeakPolarHBondContact O-CB 3.47Å; F496-F501 PolarHBondContact O-N 2.86Å
497	V	90.4	Very high	87.1	Confident	3 Å²	3	18.6 Å²	18.6	2%	0.018	10%	0.096	C	C	.	.	I	π-helix	trans	-72.6	-48	-169.2	-179.2	0	0	0	0	112.3	F471 V493 S494 F501 F502 F574 I578	F471-V497 HydrophobicContact CD1-CG2 4.39Å; F471-V497 HydrophobicContact CD2-CG2 4.21Å; F471-V497 HydrophobicContact CE1-CG2 3.84Å; F471-V497 HydrophobicContact CE2-CG2 3.61Å; F471-V497 HydrophobicContact CZ-CG2 3.42Å; F471-V497 VanDerWaalsContact CZ-CG2 3.42Å; V493-V497 HydrophobicContact CG1-CG2 4.03Å; V493-V497 WeakPolarHBondContact O-CG2 3.45Å; V493-V497 PolarHBondContact O-N 2.8Å; V493-V497 VanDerWaalsContact O-N 3.1Å; S494-V497 PolarHBondContact O-N 3.19Å; V497-F501 WeakPolarHBondContact O-CB 3.35Å; V497-F502 HydrophobicContact CG1-CD2 3.58Å; V497-F502 HydrophobicContact CG1-CE2 3.42Å; V497-F502 VanDerWaalsContact CG1-CE2 3.42Å; V497-F502 WeakPolarHBondContact O-CD2 3.37Å; V497-F502 PolarHBondContact O-N 2.81Å; V497-F574 HydrophobicContact CG1-CE1 3.78Å; V497-F574 HydrophobicContact CG1-CZ 4.24Å; V497-I578 HydrophobicContact CG1-CD1 4.36Å; V497-I578 HydrophobicContact CG2-CD1 3.84Å
498	F	89.3	Confident	87.6	Confident	1 Å²	1	16.4 Å²	16.4	0%	0.004	9%	0.09	C	C	.	.	I	π-helix	trans	-87.9	-49.7	-178.5	-76.7	-84.6	0	0	0	112	I456 S494 A503 I534 V571 F574 L575	I456-F498 HydrophobicContact CG2-CE1 3.89Å; I456-F498 HydrophobicContact CG2-CZ 4Å; S494-F498 PolarHBondContact O-N 3.24Å; F498-A503 WeakPolarHBondContact O-CB 3.4Å; F498-A503 PolarHBondContact O-N 2.86Å; F498-I534 HydrophobicContact CD1-CG2 3.97Å; F498-I534 HydrophobicContact CE1-CG2 4.44Å; F498-V571 HydrophobicContact CE2-CG1 3.89Å; F498-V571 HydrophobicContact CE2-CG2 4.46Å; F498-V571 HydrophobicContact CZ-CG1 4.31Å; F498-V571 HydrophobicContact CZ-CG2 4.07Å; F498-F574 HydrophobicContact CE2-CD1 4.14Å; F498-F574 HydrophobicContact CE2-CE1 4.2Å; F498-F574 HydrophobicContact CZ-CD1 4.27Å; F498-F574 HydrophobicContact CZ-CE1 4.36Å; F498-L575 HydrophobicContact CE2-CD2 4.4Å
499	L	86.3	Confident	87.8	Confident	44 Å²	44	16.3 Å²	16.3	23%	0.23	9%	0.09	C	C	.	.	I	π-helix	trans	-75.8	-42	-172.8	159.4	78.3	0	0	0	112.9	S494 S495 V504 Q535	S494-L499 PolarHBondContact O-N 2.81Å; S495-L499 WeakPolarHBondContact O-CB 3.33Å; L499-V504 VanDerWaalsContact O-CG2 3.28Å; L499-V504 WeakPolarHBondContact O-CG2 3.24Å; L499-Q535 HydrophobicContact CB-CG 4.46Å; L499-Q535 HydrophobicContact CD1-CG 3.96Å
500	R	89.4	Confident	87.8	Confident	33 Å²	33	16.7 Å²	16.7	13%	0.125	9%	0.091	C	C	.	.	I	π-helix	trans	-101.3	-19.6	-173	-64.5	170.1	-179	-85.7	-1.2	114.6	F385 R386 G387 D396 M399 S495 F496 V504	F385-R500 PolarHBondContact O-NE 3.24Å; F385-R500 PolarHBondContact O-NH2 3.47Å; R386-R500 VanDerWaalsContact C-NH2 3.27Å; R386-R500 PolarHBondContact O-NH2 2.85Å; G387-R500 PolarHBondContact O-NH2 2.89Å; D396-R500 WeakPolarHBondContact OD1-CB 3.39Å; D396-R500 WeakPolarHBondContact OD1-CD 3.09Å; D396-R500 IonicContact OD2-NH1 3.62Å; D396-R500 PolarHBondContact OD2-NH1 2.96Å; M399-R500 HydrophobicContact CE-CB 4.27Å; S495-R500 WeakPolarHBondContact O-CG 3.26Å; S495-R500 PolarHBondContact O-N 2.94Å; F496-R500 CarbonylContact O-C 3.59Å; F496-R500 WeakPolarHBondContact O-CB 3.48Å; F496-R500 PolarHBondContact O-N 2.85Å; R500-V504 VanDerWaalsContact O-CG2 3.31Å; R500-V504 WeakPolarHBondContact O-CG2 3.27Å
501	F	92.1	Very high	87.5	Confident	2 Å²	2	19.4 Å²	19.4	1%	0.009	11%	0.113	C	C	.	.	I	π-helix	trans	-110	-74.4	-176.6	-172.4	-121.2	0	0	0	112.6	M399 Y406 L407 M467 F496 V497 A505 F512	M399-F501 HydrophobicContact CB-CD2 3.72Å; M399-F501 HydrophobicContact CB-CE2 3.92Å; M399-F501 HydrophobicContact CB-CG 4.39Å; M399-F501 HydrophobicContact CE-CB 3.95Å; M399-F501 VanDerWaalsContact O-CE2 3.23Å; M399-F501 WeakPolarHBondContact O-CE2 3.31Å; M399-F501 HydrophobicContact SD-CB 3.94Å; M399-F501 HydrophobicContact SD-CD2 4.43Å; M399-F501 HydrophobicContact SD-CG 4.18Å; Y406-F501 AromaticContact CD1-CE1 3.85Å; Y406-F501 HydrophobicContact CD1-CE1 3.85Å; Y406-F501 HydrophobicContact CD1-CZ 4.3Å; Y406-F501 HydrophobicContact CE1-CE1 4.13Å; L407-F501 HydrophobicContact CD1-CD2 4.19Å; L407-F501 HydrophobicContact CD1-CE1 4.4Å; L407-F501 HydrophobicContact CD1-CE2 3.43Å; L407-F501 VanDerWaalsContact CD1-CE2 3.43Å; L407-F501 HydrophobicContact CD1-CZ 3.57Å; L407-F501 HydrophobicContact CD2-CD1 4.16Å; L407-F501 HydrophobicContact CD2-CE1 3.62Å; L407-F501 HydrophobicContact CD2-CE2 4.14Å; L407-F501 HydrophobicContact CD2-CZ 3.63Å; L407-F501 HydrophobicContact CG-CE1 3.88Å; L407-F501 HydrophobicContact CG-CE2 3.8Å; L407-F501 HydrophobicContact CG-CZ 3.35Å; M467-F501 HydrophobicContact CE-CD1 4.25Å; M467-F501 HydrophobicContact CE-CE1 3.86Å; M467-F501 HydrophobicContact CE-CZ 4.11Å; F496-F501 WeakPolarHBondContact O-CB 3.47Å; F496-F501 PolarHBondContact O-N 2.86Å; V497-F501 WeakPolarHBondContact O-CB 3.35Å; F501-A505 VanDerWaalsContact O-CB 3.28Å; F501-A505 WeakPolarHBondContact O-CB 3.47Å; F501-A505 PolarHBondContact O-N 2.89Å; F501-F512 HydrophobicContact CD2-CE1 4.24Å; F501-F512 HydrophobicContact CE2-CE1 4.39Å
502	F	93	Very high	87.4	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	I	π-helix	trans	-66.7	-47.5	-174.8	-72	-58.9	0	0	0	113.8	Y406 L407 T410 L411 I456 V497 V504 A505 V506 F574	Y406-F502 HydrophobicContact CD1-CZ 4.43Å; Y406-F502 HydrophobicContact CE1-CE1 4.06Å; Y406-F502 HydrophobicContact CE1-CE2 4.42Å; Y406-F502 AromaticContact CE1-CZ 3.48Å; Y406-F502 HydrophobicContact CE1-CZ 3.48Å; Y406-F502 VanDerWaalsContact CE1-CZ 3.48Å; Y406-F502 AromaticContact CZ-CZ 3.81Å; L407-F502 HydrophobicContact CD2-CD1 3.66Å; L407-F502 HydrophobicContact CD2-CE1 3.8Å; T410-F502 HydrophobicContact CG2-CE1 4.36Å; L411-F502 HydrophobicContact CD1-CD1 3.99Å; L411-F502 HydrophobicContact CG-CD1 4.32Å; I456-F502 HydrophobicContact CD1-CB 3.96Å; I456-F502 HydrophobicContact CD1-CD1 4.23Å; I456-F502 HydrophobicContact CD1-CD2 4.37Å; I456-F502 HydrophobicContact CD1-CG 3.96Å; I456-F502 HydrophobicContact CG1-CD1 4.06Å; I456-F502 HydrophobicContact CG1-CD2 4.4Å; I456-F502 HydrophobicContact CG1-CE1 4.19Å; I456-F502 HydrophobicContact CG1-CG 4.16Å; I456-F502 HydrophobicContact CG1-CZ 4.41Å; I456-F502 HydrophobicContact CG2-CD2 3.75Å; I456-F502 HydrophobicContact CG2-CE2 3.56Å; I456-F502 HydrophobicContact CG2-CG 4.35Å; I456-F502 HydrophobicContact CG2-CZ 3.99Å; V497-F502 HydrophobicContact CG1-CD2 3.58Å; V497-F502 HydrophobicContact CG1-CE2 3.42Å; V497-F502 VanDerWaalsContact CG1-CE2 3.42Å; V497-F502 WeakPolarHBondContact O-CD2 3.37Å; V497-F502 PolarHBondContact O-N 2.81Å; F502-V504 VanDerWaalsContact C-N 3.3Å; F502-V504 PolarHBondContact O-N 2.9Å; F502-A505 PolarHBondContact O-N 3.04Å; F502-V506 WeakPolarHBondContact O-CG2 3.33Å; F502-V506 PolarHBondContact O-N 3.3Å; F502-F574 HydrophobicContact CE2-CE1 4.43Å; F502-F574 HydrophobicContact CE2-CZ 4.03Å
503	A	91.1	Very high	87	Confident	2 Å²	2	25.7 Å²	25.7	2%	0.017	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-38.7	-179.2	0	0	0	0	0	111.5	F498 V506 L507 S531 Q535	F498-A503 WeakPolarHBondContact O-CB 3.4Å; F498-A503 PolarHBondContact O-N 2.86Å; A503-V506 PolarHBondContact O-N 2.86Å; A503-L507 WeakPolarHBondContact O-CB 3.45Å; A503-L507 PolarHBondContact O-N 3.49Å; A503-S531 WeakPolarHBondContact O-CB 3.27Å; A503-S531 PolarHBondContact O-OG 2.79Å; A503-Q535 HydrophobicContact CB-CB 4.06Å
504	V	90.9	Very high	86.6	Confident	53 Å²	53	25.8 Å²	25.8	32%	0.321	14%	0.141	S	C	.	.	H	α-helix	trans	-69.7	-37.9	177	-166.9	0	0	0	0	111	L499 R500 F502 V506 L507 S508 F512	L499-V504 VanDerWaalsContact O-CG2 3.28Å; L499-V504 WeakPolarHBondContact O-CG2 3.24Å; R500-V504 VanDerWaalsContact O-CG2 3.31Å; R500-V504 WeakPolarHBondContact O-CG2 3.27Å; F502-V504 VanDerWaalsContact C-N 3.3Å; F502-V504 PolarHBondContact O-N 2.9Å; V504-V506 VanDerWaalsContact C-N 3.33Å; V504-V506 PolarHBondContact O-N 2.92Å; V504-L507 PolarHBondContact O-N 3.48Å; V504-S508 PolarHBondContact O-N 3.28Å; V504-F512 HydrophobicContact CB-CE2 4.13Å; V504-F512 HydrophobicContact CB-CZ 4.25Å; V504-F512 HydrophobicContact CG1-CE2 3.88Å; V504-F512 HydrophobicContact CG1-CZ 4.28Å
505	A	90.9	Very high	86.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-34.9	175.2	0	0	0	0	0	113	L407 L411 F501 F502 S508 P509 F512 L514	L407-A505 HydrophobicContact CD1-CB 3.98Å; L407-A505 HydrophobicContact CD2-CB 3.91Å; L411-A505 HydrophobicContact CD1-CB 3.99Å; F501-A505 VanDerWaalsContact O-CB 3.28Å; F501-A505 WeakPolarHBondContact O-CB 3.47Å; F501-A505 PolarHBondContact O-N 2.89Å; F502-A505 PolarHBondContact O-N 3.04Å; A505-S508 CarbonylContact O-C 3.56Å; A505-P509 VanDerWaalsContact O-CA 3.28Å; A505-P509 WeakPolarHBondContact O-CA 3.36Å; A505-F512 VanDerWaalsContact CA-CD2 3.48Å; A505-F512 HydrophobicContact CB-CB 4.43Å; A505-F512 HydrophobicContact CB-CD1 4.16Å; A505-F512 HydrophobicContact CB-CD2 3.87Å; A505-F512 HydrophobicContact CB-CE1 4.32Å; A505-F512 HydrophobicContact CB-CE2 4.06Å; A505-F512 HydrophobicContact CB-CG 3.9Å; A505-F512 HydrophobicContact CB-CZ 4.27Å; A505-L514 HydrophobicContact CB-CD1 4.29Å
506	V	91.8	Very high	85.2	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-71.8	-42	172.5	173.6	0	0	0	0	111.2	L411 V452 F502 A503 V504 P509 L527 I530	L411-V506 HydrophobicContact CD1-CG2 3.88Å; L411-V506 HydrophobicContact CD2-CG2 4.44Å; V452-V506 HydrophobicContact CG1-CG2 4.17Å; F502-V506 WeakPolarHBondContact O-CG2 3.33Å; F502-V506 PolarHBondContact O-N 3.3Å; A503-V506 PolarHBondContact O-N 2.86Å; V504-V506 VanDerWaalsContact C-N 3.33Å; V504-V506 PolarHBondContact O-N 2.92Å; V506-P509 WeakPolarHBondContact O-CD 3.35Å; V506-P509 WeakPolarHBondContact O-CG 3.31Å; V506-L527 HydrophobicContact CG1-CD2 4.12Å; V506-I530 HydrophobicContact CG1-CB 4.2Å; V506-I530 HydrophobicContact CG1-CG2 3.91Å
507	L	89.6	Confident	84.3	Confident	70 Å²	70	35.3 Å²	35.3	37%	0.366	19%	0.191	S	C	.	.	H	α-helix	trans	-63.8	-43.8	179.8	-179	65.2	0	0	0	112	A503 V504 T528	A503-L507 WeakPolarHBondContact O-CB 3.45Å; A503-L507 PolarHBondContact O-N 3.49Å; V504-L507 PolarHBondContact O-N 3.48Å; L507-T528 HydrophobicContact CD1-CG2 4.12Å; L507-T528 WeakPolarHBondContact CD1-OG1 3.12Å
508	S	84.3	Confident	83.4	Confident	42 Å²	42	37.7 Å²	37.7	29%	0.294	20%	0.202	S	C	.	.			trans	-128.8	71	-175.7	-61.1	0	0	0	0	111.6	V504 A505 H510 S511	V504-S508 PolarHBondContact O-N 3.28Å; A505-S508 CarbonylContact O-C 3.56Å; S508-H510 PolarHBondContact O-N 3.43Å; S508-H510 VanDerWaalsContact O-N 3.14Å; S508-S511 PolarHBondContact O-N 3.06Å; S508-S511 VanDerWaalsContact O-N 3.14Å
509	P	84.8	Confident	82.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.9	-176.5	-23.7	34.3	0	0	0	113.8	I415 A505 V506 F512 Q513 L514 R515 L527	I415-P509 HydrophobicContact CD1-CB 4.31Å; I415-P509 HydrophobicContact CD1-CG 4.24Å; I415-P509 HydrophobicContact CG2-CB 4.16Å; I415-P509 HydrophobicContact CG2-CG 4.1Å; A505-P509 VanDerWaalsContact O-CA 3.28Å; A505-P509 WeakPolarHBondContact O-CA 3.36Å; V506-P509 WeakPolarHBondContact O-CD 3.35Å; V506-P509 WeakPolarHBondContact O-CG 3.31Å; P509-F512 PolarHBondContact O-N 2.91Å; P509-Q513 PolarHBondContact O-N 3.13Å; P509-L514 HydrophobicContact CB-CB 4.02Å; P509-L514 WeakPolarHBondContact O-CB 3.4Å; P509-L514 PolarHBondContact O-N 2.97Å; P509-R515 HydrophobicContact CB-CB 4.38Å; P509-R515 HydrophobicContact CB-CG 3.92Å; P509-L527 HydrophobicContact CG-CD1 3.81Å
510	H	78.3	Confident	82.4	Confident	41 Å²	41	40.7 Å²	40.7	19%	0.19	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-45.5	177	178.3	-106.1	0	0	0	112.2	S508 F512 Q513 H518	S508-H510 PolarHBondContact O-N 3.43Å; S508-H510 VanDerWaalsContact O-N 3.14Å; H510-F512 PolarHBondContact O-N 3.41Å; H510-F512 VanDerWaalsContact O-N 3.13Å; H510-Q513 PolarHBondContact O-N 3.46Å; H510-H518 AromaticContact ND1-CE1 3.62Å; H510-H518 AromaticContact ND1-NE2 3.62Å
511	S	77.1	Confident	81.8	Confident	81 Å²	81	44.6 Å²	44.6	57%	0.566	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.9	-179.3	-56.7	0	0	0	0	113.5	S508	S508-S511 PolarHBondContact O-N 3.06Å; S508-S511 VanDerWaalsContact O-N 3.14Å
512	F	79.4	Confident	81.2	Confident	17 Å²	17	49 Å²	49	8%	0.075	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	11.3	175.7	-70.6	-95.4	0	0	0	113	K400 L407 F501 V504 A505 P509 H510 L514	K400-F512 HydrophobicContact CG-CD1 4.34Å; K400-F512 HydrophobicContact CG-CE1 3.7Å; K400-F512 HydrophobicContact CG-CZ 4.27Å; L407-F512 HydrophobicContact CD1-CB 4.24Å; L407-F512 HydrophobicContact CD1-CD1 3.27Å; L407-F512 HydrophobicContact CD1-CE1 3.83Å; L407-F512 HydrophobicContact CD1-CG 4.03Å; F501-F512 HydrophobicContact CD2-CE1 4.24Å; F501-F512 HydrophobicContact CE2-CE1 4.39Å; V504-F512 HydrophobicContact CB-CE2 4.13Å; V504-F512 HydrophobicContact CB-CZ 4.25Å; V504-F512 HydrophobicContact CG1-CE2 3.88Å; V504-F512 HydrophobicContact CG1-CZ 4.28Å; A505-F512 VanDerWaalsContact CA-CD2 3.48Å; A505-F512 HydrophobicContact CB-CB 4.43Å; A505-F512 HydrophobicContact CB-CD1 4.16Å; A505-F512 HydrophobicContact CB-CD2 3.87Å; A505-F512 HydrophobicContact CB-CE1 4.32Å; A505-F512 HydrophobicContact CB-CE2 4.06Å; A505-F512 HydrophobicContact CB-CG 3.9Å; A505-F512 HydrophobicContact CB-CZ 4.27Å; P509-F512 PolarHBondContact O-N 2.91Å; H510-F512 PolarHBondContact O-N 3.41Å; H510-F512 VanDerWaalsContact O-N 3.13Å; F512-L514 HydrophobicContact CB-CD1 4.26Å; F512-L514 HydrophobicContact CB-CG 4.08Å; F512-L514 PolarHBondContact O-N 2.99Å; F512-L514 VanDerWaalsContact O-N 3.16Å
513	Q	75.9	Confident	80.8	Confident	136 Å²	136	49.7 Å²	49.7	64%	0.636	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	24.5	-179.7	-54.6	178.7	7.7	0	0	114	P509 H510 R515	P509-Q513 PolarHBondContact O-N 3.13Å; H510-Q513 PolarHBondContact O-N 3.46Å; Q513-R515 VanDerWaalsContact C-N 3.31Å
514	L	80.4	Confident	80.6	Confident	2 Å²	2	51 Å²	51	1%	0.01	29%	0.285	C	S	.	.	S	Bend	trans	-76.1	-26.2	174.3	-58.1	176.5	0	0	0	110.9	L407 A408 L411 K412 I415 A505 P509 F512	L407-L514 HydrophobicContact CB-CD2 4.07Å; A408-L514 HydrophobicContact CB-CD2 4.4Å; L411-L514 HydrophobicContact CB-CD1 4.3Å; K412-L514 HydrophobicContact CB-CD2 4.33Å; K412-L514 PolarHBondContact NZ-O 3.34Å; I415-L514 HydrophobicContact CD1-CD1 3.66Å; A505-L514 HydrophobicContact CB-CD1 4.29Å; P509-L514 HydrophobicContact CB-CB 4.02Å; P509-L514 WeakPolarHBondContact O-CB 3.4Å; P509-L514 PolarHBondContact O-N 2.97Å; F512-L514 HydrophobicContact CB-CD1 4.26Å; F512-L514 HydrophobicContact CB-CG 4.08Å; F512-L514 PolarHBondContact O-N 2.99Å; F512-L514 VanDerWaalsContact O-N 3.16Å
515	R	77.3	Confident	80.4	Confident	62 Å²	62	50.7 Å²	50.7	23%	0.234	28%	0.278	C	S	.	.	S	Bend	trans	-134.6	148.2	176.9	-64.6	-69	-68.5	-144.4	-8.4	110.1	I415 D416 D420 P509 Q513	I415-R515 HydrophobicContact CG2-CG 4.15Å; D416-R515 WeakPolarHBondContact OD1-CD 3.33Å; D416-R515 IonicContact OD1-CZ 3.94Å; D416-R515 IonicContact OD1-NE 3.44Å; D416-R515 IonicContact OD1-NH1 3.03Å; D416-R515 PolarHBondContact OD1-NH1 2.96Å; D420-R515 IonicContact OD1-NH1 3.3Å; P509-R515 HydrophobicContact CB-CB 4.38Å; P509-R515 HydrophobicContact CB-CG 3.92Å; Q513-R515 VanDerWaalsContact C-N 3.31Å
516	S	67.3	Low	80.3	Confident	91 Å²	91	51.1 Å²	51.1	64%	0.636	28%	0.28	S	S	*	.	S	Bend	trans	-78.9	-18.2	179	58.3	0	0	0	0	114.2
517	H	69.9	Low	80.3	Confident	60 Å²	60	51.1 Å²	51.1	28%	0.278	28%	0.28	S	S	.	.	S	Bend	trans	-139.1	160.6	-179.8	-58.4	-75.3	0	0	0	110.3	K67 E79	K67-H517 HydrophobicContact CD-CB 3.86Å; K67-H517 HydrophobicContact CG-CB 4.21Å; E79-H517 IonicContact OE2-ND1 2.79Å
518	H	72.3	Confident	80.3	Confident	54 Å²	54	49.6 Å²	49.6	25%	0.25	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-59.5	138.6	171.4	-74.6	-68.4	0	0	0	111.2	K67 G78 D80 H510	K67-H518 PolarHBondContact NZ-O 3.46Å; G78-H518 PolarHBondContact O-CD2 3.31Å; G78-H518 VanDerWaalsContact O-CD2 3.28Å; G78-H518 PolarHBondContact O-NE2 2.91Å; D80-H518 IonicContact OD2-CE1 3.51Å; D80-H518 PolarHBondContact OD2-CE1 2.77Å; D80-H518 IonicContact OD2-NE2 3.49Å; D80-H518 PolarHBondContact OD2-NE2 3.48Å; H510-H518 AromaticContact ND1-CE1 3.62Å; H510-H518 AromaticContact ND1-NE2 3.62Å
519	P	77.4	Confident	80.5	Confident	25 Å²	25	47.6 Å²	47.6	16%	0.162	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-62.2	148.8	172.2	-16.6	29.2	0	0	0	110.8	I523 A524 L527	P519-I523 HydrophobicContact CB-CB 4.08Å; P519-I523 HydrophobicContact CB-CG2 3.85Å; P519-A524 HydrophobicContact CB-CB 4.34Å; P519-L527 HydrophobicContact CB-CD1 4.08Å; P519-L527 HydrophobicContact CG-CD1 3.67Å
520	D	76.6	Confident	80.8	Confident	83 Å²	83	47.6 Å²	47.6	44%	0.444	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-65.6	156.1	176.9	-51.2	-30.9	0	0	0	109.8	K67 E522 I523 A524	K67-D520 IonicContact NZ-OD1 3.18Å; K67-D520 PolarHBondContact NZ-OD1 2.62Å; D520-E522 PolarHBondContact O-N 2.63Å; D520-I523 PolarHBondContact O-N 3.15Å; D520-A524 WeakPolarHBondContact O-CB 3.23Å; D520-A524 PolarHBondContact O-N 3.49Å
521	P	78.2	Confident	81.5	Confident	114 Å²	114	45.9 Å²	45.9	74%	0.74	25%	0.253	S	S	*	.	H	α-helix	trans	-53.4	-36.6	-169.4	-29.2	35.5	0	0	0	115	R525	P521-R525 WeakPolarHBondContact O-CB 3.39Å; P521-R525 PolarHBondContact O-N 2.93Å
522	E	79.1	Confident	82.1	Confident	96 Å²	96	44.8 Å²	44.8	45%	0.449	24%	0.238	S	C	.	.	H	α-helix	trans	-68.6	-42.3	177.9	-61.1	-174.6	163	0	0	112.1	K433 D520 R525 T526	K433-E522 IonicContact NZ-OE1 3.96Å; K433-E522 PolarHBondContact NZ-OE1 3.27Å; D520-E522 PolarHBondContact O-N 2.63Å; E522-R525 PolarHBondContact O-N 3.12Å; E522-T526 PolarHBondContact O-N 2.99Å; E522-T526 PolarHBondContact O-OG1 3.3Å; E522-T526 VanDerWaalsContact O-OG1 3.11Å
523	I	84.9	Confident	82.5	Confident	13 Å²	13	44 Å²	44	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-70.8	-41.1	176.2	-60.2	169.8	0	0	0	110	P519 D520 R525 T526 L527	P519-I523 HydrophobicContact CB-CB 4.08Å; P519-I523 HydrophobicContact CB-CG2 3.85Å; D520-I523 PolarHBondContact O-N 3.15Å; I523-R525 VanDerWaalsContact C-N 3.27Å; I523-R525 PolarHBondContact O-N 3.24Å; I523-T526 WeakPolarHBondContact O-CB 3.28Å; I523-T526 PolarHBondContact O-N 3.13Å; I523-T526 VanDerWaalsContact O-N 3.14Å; I523-L527 HydrophobicContact CG2-CD1 4.08Å; I523-L527 HydrophobicContact CG2-CG 4.29Å; I523-L527 WeakPolarHBondContact O-CB 3.25Å; I523-L527 WeakPolarHBondContact O-CG 3.22Å; I523-L527 PolarHBondContact O-N 3.45Å
524	A	85.6	Confident	83.1	Confident	31 Å²	31	37.5 Å²	37.5	26%	0.256	20%	0.204	S	C	.	.	H	α-helix	trans	-59.3	-39.3	175.5	0	0	0	0	0	111.4	P519 D520 L527 T528	P519-A524 HydrophobicContact CB-CB 4.34Å; D520-A524 WeakPolarHBondContact O-CB 3.23Å; D520-A524 PolarHBondContact O-N 3.49Å; A524-L527 PolarHBondContact O-N 2.84Å; A524-T528 WeakPolarHBondContact O-CB 3.15Å; A524-T528 PolarHBondContact O-N 3.34Å; A524-T528 PolarHBondContact O-OG1 3.38Å
525	R	87.1	Confident	83.4	Confident	45 Å²	45	40.7 Å²	40.7	17%	0.17	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-44.9	173.1	177.9	56.1	176.7	152.4	4.8	112.1	E426 P521 E522 I523 T528 L529	E426-R525 IonicContact OE1-CZ 3.2Å; E426-R525 IonicContact OE1-NE 2.85Å; E426-R525 IonicContact OE1-NH2 2.76Å; E426-R525 PolarHBondContact OE1-NH2 3.49Å; E426-R525 VanDerWaalsContact OE2-CG 3.27Å; E426-R525 WeakPolarHBondContact OE2-CG 3.37Å; E426-R525 IonicContact OE2-CZ 2.69Å; E426-R525 IonicContact OE2-NE 3.63Å; E426-R525 PolarHBondContact OE2-NE 2.83Å; E426-R525 IonicContact OE2-NH2 3.65Å; P521-R525 WeakPolarHBondContact O-CB 3.39Å; P521-R525 PolarHBondContact O-N 2.93Å; E522-R525 PolarHBondContact O-N 3.12Å; I523-R525 VanDerWaalsContact C-N 3.27Å; I523-R525 PolarHBondContact O-N 3.24Å; R525-T528 WeakPolarHBondContact O-CB 3.44Å; R525-T528 PolarHBondContact O-N 3.09Å; R525-L529 PolarHBondContact O-N 3.47Å
526	T	89.5	Confident	83.7	Confident	10 Å²	10	38.8 Å²	38.8	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-58.8	-48.8	175	-62.6	0	0	0	0	111.5	I418 C425 Y448 E522 I523 T528 L529 I530	I418-T526 HydrophobicContact CG2-CG2 4.29Å; C425-T526 HydrophobicContact CB-CG2 3.7Å; C425-T526 VanDerWaalsContact SG-CG2 3.59Å; Y448-T526 HydrophobicContact CD2-CG2 4.41Å; E522-T526 PolarHBondContact O-N 2.99Å; E522-T526 PolarHBondContact O-OG1 3.3Å; E522-T526 VanDerWaalsContact O-OG1 3.11Å; I523-T526 WeakPolarHBondContact O-CB 3.28Å; I523-T526 PolarHBondContact O-N 3.13Å; I523-T526 VanDerWaalsContact O-N 3.14Å; T526-T528 VanDerWaalsContact C-N 3.27Å; T526-T528 PolarHBondContact O-N 3.13Å; T526-L529 PolarHBondContact O-N 3.33Å; T526-L529 VanDerWaalsContact O-N 3.15Å; T526-I530 HydrophobicContact CG2-CD1 3.94Å; T526-I530 WeakPolarHBondContact O-CG1 3.46Å; T526-I530 PolarHBondContact O-N 3.3Å
527	L	90.5	Very high	84.5	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-35	176	-70.4	173.2	0	0	0	112.4	I418 V506 P509 P519 I523 A524 I530 S531	I418-L527 HydrophobicContact CG2-CD2 4.35Å; V506-L527 HydrophobicContact CG1-CD2 4.12Å; P509-L527 HydrophobicContact CG-CD1 3.81Å; P519-L527 HydrophobicContact CB-CD1 4.08Å; P519-L527 HydrophobicContact CG-CD1 3.67Å; I523-L527 HydrophobicContact CG2-CD1 4.08Å; I523-L527 HydrophobicContact CG2-CG 4.29Å; I523-L527 WeakPolarHBondContact O-CB 3.25Å; I523-L527 WeakPolarHBondContact O-CG 3.22Å; I523-L527 PolarHBondContact O-N 3.45Å; A524-L527 PolarHBondContact O-N 2.84Å; L527-I530 PolarHBondContact O-N 3.2Å; L527-S531 WeakPolarHBondContact O-CB 3.32Å; L527-S531 PolarHBondContact O-N 3.08Å
528	T	90.6	Very high	84.8	Confident	38 Å²	38	32.1 Å²	32.1	23%	0.233	17%	0.174	C	C	.	.	H	α-helix	trans	-63.1	-44.8	174.1	-59.3	0	0	0	0	111.5	L507 A524 R525 T526 S531 K532	L507-T528 HydrophobicContact CD1-CG2 4.12Å; L507-T528 WeakPolarHBondContact CD1-OG1 3.12Å; A524-T528 WeakPolarHBondContact O-CB 3.15Å; A524-T528 PolarHBondContact O-N 3.34Å; A524-T528 PolarHBondContact O-OG1 3.38Å; R525-T528 WeakPolarHBondContact O-CB 3.44Å; R525-T528 PolarHBondContact O-N 3.09Å; T526-T528 VanDerWaalsContact C-N 3.27Å; T526-T528 PolarHBondContact O-N 3.13Å; T528-S531 PolarHBondContact O-N 3.46Å; T528-K532 WeakPolarHBondContact O-CB 3.37Å; T528-K532 WeakPolarHBondContact O-CG 3.24Å; T528-K532 PolarHBondContact O-N 3.31Å
529	L	89.1	Confident	84.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.4	-41.7	177.5	-69.5	172.2	0	0	0	111.7	C425 I427 L445 R525 T526 T533 Y554 M555	C425-L529 WeakPolarHBondContact O-CD1 3.19Å; I427-L529 HydrophobicContact CG1-CD1 4.16Å; I427-L529 HydrophobicContact CG1-CD2 4.46Å; L445-L529 HydrophobicContact CD1-CB 3.88Å; L445-L529 HydrophobicContact CD2-CB 4.19Å; L445-L529 HydrophobicContact CD2-CD1 4.41Å; R525-L529 PolarHBondContact O-N 3.47Å; T526-L529 PolarHBondContact O-N 3.33Å; T526-L529 VanDerWaalsContact O-N 3.15Å; L529-T533 WeakPolarHBondContact O-CB 3.4Å; L529-T533 PolarHBondContact O-N 2.86Å; L529-T533 PolarHBondContact O-OG1 3.01Å; L529-Y554 HydrophobicContact CD2-CE2 4.43Å; L529-M555 HydrophobicContact CD2-SD 3.99Å
530	I	91.4	Very high	84.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-49.7	174.9	-62.9	167.2	0	0	0	110	I418 L445 Y448 V449 V452 V506 T526 L527 K532 T533 I534	I418-I530 HydrophobicContact CD1-CD1 3.84Å; L445-I530 HydrophobicContact CD1-CG1 3.74Å; Y448-I530 HydrophobicContact CD2-CD1 4.5Å; Y448-I530 HydrophobicContact CG-CD1 4.48Å; V449-I530 HydrophobicContact CG2-CB 4.41Å; V449-I530 HydrophobicContact CG2-CG1 4.18Å; V449-I530 HydrophobicContact CG2-CG2 4.26Å; V452-I530 HydrophobicContact CB-CG2 4.36Å; V452-I530 HydrophobicContact CG1-CG2 4.48Å; V452-I530 HydrophobicContact CG2-CG2 4.1Å; V506-I530 HydrophobicContact CG1-CB 4.2Å; V506-I530 HydrophobicContact CG1-CG2 3.91Å; T526-I530 HydrophobicContact CG2-CD1 3.94Å; T526-I530 WeakPolarHBondContact O-CG1 3.46Å; T526-I530 PolarHBondContact O-N 3.3Å; L527-I530 PolarHBondContact O-N 3.2Å; I530-K532 PolarHBondContact O-N 2.71Å; I530-T533 PolarHBondContact O-N 3.38Å; I530-T533 VanDerWaalsContact O-N 3.12Å; I530-I534 HydrophobicContact CG2-CG1 4.11Å; I530-I534 VanDerWaalsContact O-CG1 3.3Å; I530-I534 WeakPolarHBondContact O-CG1 3.44Å; I530-I534 PolarHBondContact O-N 3.22Å
531	S	91.6	Very high	83.1	Confident	6 Å²	6	30.9 Å²	30.9	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-56.6	-49.6	179.3	174.9	0	0	0	0	112.1	A503 L527 T528 T533 I534 Q535	A503-S531 WeakPolarHBondContact O-CB 3.27Å; A503-S531 PolarHBondContact O-OG 2.79Å; L527-S531 WeakPolarHBondContact O-CB 3.32Å; L527-S531 PolarHBondContact O-N 3.08Å; T528-S531 PolarHBondContact O-N 3.46Å; S531-T533 VanDerWaalsContact C-N 3.28Å; S531-T533 PolarHBondContact O-N 3.37Å; S531-I534 PolarHBondContact O-N 2.89Å; S531-Q535 VanDerWaalsContact O-CB 3.31Å; S531-Q535 WeakPolarHBondContact O-CB 3.39Å; S531-Q535 PolarHBondContact O-N 3.32Å
532	K	89.1	Confident	82	Confident	58 Å²	58	26.4 Å²	26.4	25%	0.252	14%	0.143	S	C	.	.	H	α-helix	trans	-57.5	-41.3	175.2	-78.9	-177.5	169.3	-167.6	0	112.4	T528 I530 T536 E552	T528-K532 WeakPolarHBondContact O-CB 3.37Å; T528-K532 WeakPolarHBondContact O-CG 3.24Å; T528-K532 PolarHBondContact O-N 3.31Å; I530-K532 PolarHBondContact O-N 2.71Å; K532-T536 WeakPolarHBondContact O-CB 3.37Å; K532-T536 PolarHBondContact O-N 3.11Å; K532-T536 PolarHBondContact O-OG1 3.47Å; K532-E552 IonicContact NZ-OE1 3.8Å; K532-E552 PolarHBondContact NZ-OE1 3.37Å; K532-E552 IonicContact NZ-OE2 3.43Å; K532-E552 PolarHBondContact NZ-OE2 2.86Å
533	T	88.1	Confident	80.7	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67.8	-48.5	179.5	-55.1	0	0	0	0	110.7	V449 L529 I530 S531 Q535 T536 L537 F558 Y559 F562	V449-T533 HydrophobicContact CB-CG2 4.39Å; V449-T533 HydrophobicContact CG1-CG2 3.59Å; V449-T533 HydrophobicContact CG2-CG2 3.92Å; L529-T533 WeakPolarHBondContact O-CB 3.4Å; L529-T533 PolarHBondContact O-N 2.86Å; L529-T533 PolarHBondContact O-OG1 3.01Å; I530-T533 PolarHBondContact O-N 3.38Å; I530-T533 VanDerWaalsContact O-N 3.12Å; S531-T533 VanDerWaalsContact C-N 3.28Å; S531-T533 PolarHBondContact O-N 3.37Å; T533-Q535 VanDerWaalsContact C-N 3.31Å; T533-Q535 PolarHBondContact O-N 2.67Å; T533-T536 WeakPolarHBondContact O-CB 3.46Å; T533-T536 PolarHBondContact O-N 3.08Å; T533-T536 VanDerWaalsContact O-N 3.09Å; T533-L537 HydrophobicContact CG2-CD1 4.09Å; T533-L537 HydrophobicContact CG2-CG 4.23Å; T533-L537 VanDerWaalsContact O-CG 3.3Å; T533-L537 WeakPolarHBondContact O-CG 3.38Å; T533-L537 PolarHBondContact O-N 2.96Å; T533-F558 HydrophobicContact CG2-CE1 3.74Å; T533-Y559 HydrophobicContact CG2-CD1 4.48Å; T533-Y559 HydrophobicContact CG2-CE1 3.97Å; T533-F562 HydrophobicContact CG2-CE2 4.34Å; T533-F562 HydrophobicContact CG2-CZ 4.46Å
534	I	88.9	Confident	78.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-40.8	177.5	-66.2	-64.6	0	0	0	111.4	V449 V452 F453 I456 F498 I530 S531 T536 L537 G538	V449-I534 HydrophobicContact CG1-CD1 4.18Å; V452-I534 HydrophobicContact CB-CD1 4.24Å; V452-I534 HydrophobicContact CG1-CD1 3.88Å; V452-I534 HydrophobicContact CG1-CG1 3.92Å; F453-I534 HydrophobicContact CB-CD1 3.77Å; F453-I534 HydrophobicContact CD2-CD1 4.24Å; I456-I534 HydrophobicContact CD1-CG2 4.07Å; F498-I534 HydrophobicContact CD1-CG2 3.97Å; F498-I534 HydrophobicContact CE1-CG2 4.44Å; I530-I534 HydrophobicContact CG2-CG1 4.11Å; I530-I534 VanDerWaalsContact O-CG1 3.3Å; I530-I534 WeakPolarHBondContact O-CG1 3.44Å; I530-I534 PolarHBondContact O-N 3.22Å; S531-I534 PolarHBondContact O-N 2.89Å; I534-T536 VanDerWaalsContact C-N 3.33Å; I534-T536 PolarHBondContact O-N 3.36Å; I534-L537 PolarHBondContact O-N 3.08Å; I534-G538 PolarHBondContact O-N 2.85Å
535	Q	87.3	Confident	77.1	Confident	69 Å²	69	30.2 Å²	30.2	32%	0.322	16%	0.163	S	C	.	.	H	α-helix	trans	-60.3	-43.1	173.9	-177.5	-171.4	2.4	0	0	111.6	L499 A503 S531 T533 S539	L499-Q535 HydrophobicContact CB-CG 4.46Å; L499-Q535 HydrophobicContact CD1-CG 3.96Å; A503-Q535 HydrophobicContact CB-CB 4.06Å; S531-Q535 VanDerWaalsContact O-CB 3.31Å; S531-Q535 WeakPolarHBondContact O-CB 3.39Å; S531-Q535 PolarHBondContact O-N 3.32Å; T533-Q535 VanDerWaalsContact C-N 3.31Å; T533-Q535 PolarHBondContact O-N 2.67Å; Q535-S539 VanDerWaalsContact O-CB 3.29Å; Q535-S539 WeakPolarHBondContact O-CB 3.19Å; Q535-S539 PolarHBondContact O-N 3.27Å; Q535-S539 PolarHBondContact O-OG 2.93Å
536	T	84.1	Confident	75.1	Confident	22 Å²	22	36.1 Å²	36.1	14%	0.135	19%	0.19	C	C	.	.	H	α-helix	trans	-68.7	-42.5	178.7	-57.4	0	0	0	0	111.6	K532 T533 I534 S539 Y559	K532-T536 WeakPolarHBondContact O-CB 3.37Å; K532-T536 PolarHBondContact O-N 3.11Å; K532-T536 PolarHBondContact O-OG1 3.47Å; T533-T536 WeakPolarHBondContact O-CB 3.46Å; T533-T536 PolarHBondContact O-N 3.08Å; T533-T536 VanDerWaalsContact O-N 3.09Å; I534-T536 VanDerWaalsContact C-N 3.33Å; I534-T536 PolarHBondContact O-N 3.36Å; T536-S539 PolarHBondContact O-N 3.13Å; T536-Y559 HydrophobicContact CG2-CD1 4.4Å; T536-Y559 HydrophobicContact CG2-CE1 3.93Å; T536-Y559 HydrophobicContact CG2-CE2 4.5Å; T536-Y559 PolarHBondContact OG1-OH 3.35Å
537	L	83.3	Confident	72.9	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-65.9	-36	176.8	-67.7	-179.6	0	0	0	112.5	V449 F453 T533 I534 L543 F562	V449-L537 HydrophobicContact CG1-CD1 3.9Å; F453-L537 HydrophobicContact CD2-CB 4.33Å; F453-L537 HydrophobicContact CD2-CD1 4.02Å; F453-L537 HydrophobicContact CE2-CB 4.09Å; F453-L537 HydrophobicContact CE2-CD1 4.37Å; F453-L537 HydrophobicContact CG-CD1 4.43Å; T533-L537 HydrophobicContact CG2-CD1 4.09Å; T533-L537 HydrophobicContact CG2-CG 4.23Å; T533-L537 VanDerWaalsContact O-CG 3.3Å; T533-L537 WeakPolarHBondContact O-CG 3.38Å; T533-L537 PolarHBondContact O-N 2.96Å; I534-L537 PolarHBondContact O-N 3.08Å; L537-L543 HydrophobicContact CD2-CD1 3.83Å; L537-F562 HydrophobicContact CD1-CD1 4.46Å; L537-F562 HydrophobicContact CD2-CB 4.42Å; L537-F562 HydrophobicContact CD2-CG 4.45Å
538	G	76.6	Confident	70.6	Confident	2 Å²	2	45.5 Å²	45.5	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-76.8	-27.9	176.3	0	0	0	0	0	113.5	S494 I534 W540	S494-G538 PolarHBondContact OG-O 3.09Å; I534-G538 PolarHBondContact O-N 2.85Å; G538-W540 PolarHBondContact O-N 2.99Å
539	S	74.7	Confident	68.8	Low	31 Å²	31	47 Å²	47	22%	0.217	26%	0.26	C	S	.	.	S	Bend	trans	-76.3	111.3	179.4	-63.8	0	0	0	0	110.9	Q535 T536 G541 S542	Q535-S539 VanDerWaalsContact O-CB 3.29Å; Q535-S539 WeakPolarHBondContact O-CB 3.19Å; Q535-S539 PolarHBondContact O-N 3.27Å; Q535-S539 PolarHBondContact O-OG 2.93Å; T536-S539 PolarHBondContact O-N 3.13Å; S539-G541 PolarHBondContact O-N 3.48Å; S539-S542 PolarHBondContact O-N 3.35Å
540	W	61.6	Low	67.2	Low	77 Å²	77	48.7 Å²	48.7	29%	0.292	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	128.6	178.8	-166.1	-85.5	0	0	0	112	H487 G538 S542 I568 K572	H487-W540 AromaticContact CE1-CE2 3.88Å; H487-W540 AromaticContact CE1-CZ2 3.71Å; H487-W540 AromaticContact CE1-NE1 3.53Å; H487-W540 AromaticContact CG-NE1 3.44Å; H487-W540 AromaticContact ND1-CD1 3.92Å; H487-W540 AromaticContact ND1-CE2 3.22Å; H487-W540 AromaticContact ND1-CZ2 3.31Å; H487-W540 VanDerWaalsContact ND1-CZ2 3.31Å; H487-W540 WeakPolarHBondContact ND1-CZ2 3.28Å; H487-W540 AromaticContact ND1-NE1 2.92Å; H487-W540 PolarHBondContact ND1-NE1 3.37Å; G538-W540 PolarHBondContact O-N 2.99Å; W540-S542 PolarHBondContact O-N 2.92Å; W540-I568 HydrophobicContact CE3-CG2 4.22Å; W540-I568 HydrophobicContact CH2-CG2 3.63Å; W540-I568 HydrophobicContact CZ2-CG2 4.25Å; W540-I568 HydrophobicContact CZ3-CG2 3.62Å; W540-K572 HydrophobicContact CH2-CD 4.38Å; W540-K572 HydrophobicContact CZ3-CB 4.23Å; W540-K572 HydrophobicContact CZ3-CG 4.46Å
541	G	54.6	Low	65.7	Low	29 Å²	29	58.9 Å²	58.9	30%	0.299	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	18.5	175.1	0	0	0	0	0	116.5	S539 S544	S539-G541 PolarHBondContact O-N 3.48Å; G541-S544 PolarHBondContact O-OG 2.96Å
542	S	54.2	Low	64.5	Low	20 Å²	20	61.6 Å²	61.6	14%	0.14	32%	0.324	C	S	.	.	S	Bend	trans	-87.8	-23.5	-179.8	-161.2	0	0	0	0	115.1	S539 W540	S539-S542 PolarHBondContact O-N 3.35Å; W540-S542 PolarHBondContact O-N 2.92Å
543	L	51.4	Low	63.5	Low	27 Å²	27	63.2 Å²	63.2	14%	0.141	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-26.2	-179.6	-75.2	167.3	0	0	0	112	L537 K545 Y559 E564	L537-L543 HydrophobicContact CD2-CD1 3.83Å; L543-K545 PolarHBondContact O-N 2.87Å; L543-Y559 HydrophobicContact CD2-CD1 3.98Å; L543-Y559 HydrophobicContact CD2-CG 3.97Å; L543-E564 HydrophobicContact CB-CB 4.38Å; L543-E564 HydrophobicContact CB-CG 3.77Å; L543-E564 WeakPolarHBondContact CB-OE1 3.36Å; L543-E564 WeakPolarHBondContact CB-OE2 2.92Å; L543-E564 HydrophobicContact CD1-CB 3.95Å; L543-E564 HydrophobicContact CD1-CG 3.74Å; L543-E564 HydrophobicContact CG-CG 4.44Å
544	S	43.7	Very low	62.8	Low	87 Å²	87	65.1 Å²	65.1	61%	0.608	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	4.7	176.3	77.6	0	0	0	0	115.6	G541 E564	G541-S544 PolarHBondContact O-OG 2.96Å; S544-E564 PolarHBondContact N-OE1 3.29Å
545	K	51.9	Low	62.2	Low	105 Å²	105	65.2 Å²	65.2	46%	0.457	35%	0.35	S	S	.	.	S	Bend	trans	-78.2	140.4	-179	-67.1	-178.6	178.6	169.8	0	110.7	L543 F550	L543-K545 PolarHBondContact O-N 2.87Å; K545-F550 HydrophobicContact CB-CE2 4.28Å; K545-F550 WeakPolarHBondContact O-CE2 3.11Å
546	K	44.4	Very low	61.6	Low	169 Å²	169	64.5 Å²	64.5	74%	0.735	35%	0.345	S	S	*	.			trans	-58.4	153.6	175.7	-69.7	-177.2	179.3	179.6	0	110.5	S548 S549	K546-S548 PolarHBondContact O-N 2.72Å; K546-S549 WeakPolarHBondContact O-CB 3.38Å; K546-S549 PolarHBondContact O-N 3.1Å
547	L	44.6	Very low	61	Low	99 Å²	99	68 Å²	68	52%	0.518	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-47.3	-33.8	176.5	-178.6	65.4	0	0	0	112.8	S549 F550 Y556	L547-S549 PolarHBondContact O-N 3.42Å; L547-F550 PolarHBondContact O-N 3.47Å; L547-Y556 HydrophobicContact CB-CE2 4.41Å; L547-Y556 HydrophobicContact CD1-CD1 3.49Å; L547-Y556 VanDerWaalsContact CD1-CD1 3.49Å; L547-Y556 HydrophobicContact CD1-CD2 3.83Å; L547-Y556 HydrophobicContact CD1-CE1 3.76Å; L547-Y556 HydrophobicContact CD1-CE2 4.16Å; L547-Y556 HydrophobicContact CD1-CG 3.48Å; L547-Y556 VanDerWaalsContact CD1-CG 3.48Å
548	S	42.4	Very low	60.8	Low	109 Å²	109	67.8 Å²	67.8	76%	0.762	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-67.1	-11.6	176.9	58.7	0	0	0	0	115.8	K546	K546-S548 PolarHBondContact O-N 2.72Å
549	S	51.7	Low	60.8	Low	69 Å²	69	68.5 Å²	68.5	48%	0.483	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-98.8	-8.3	-179.6	-57.8	0	0	0	0	113.3	K546 L547	K546-S549 WeakPolarHBondContact O-CB 3.38Å; K546-S549 PolarHBondContact O-N 3.1Å; L547-S549 PolarHBondContact O-N 3.42Å
550	F	56.5	Low	60.8	Low	36 Å²	36	73.2 Å²	73.2	16%	0.158	38%	0.38	C	S	.	.			trans	-87.9	119.2	176	-72.7	-83	0	0	0	109.8	K545 L547 E552 Y556 Y559	K545-F550 HydrophobicContact CB-CE2 4.28Å; K545-F550 WeakPolarHBondContact O-CE2 3.11Å; L547-F550 PolarHBondContact O-N 3.47Å; F550-E552 PolarHBondContact O-N 3.44Å; F550-Y556 AromaticContact CD2-CD2 3.71Å; F550-Y556 HydrophobicContact CD2-CD2 3.71Å; F550-Y556 HydrophobicContact CD2-CE2 4.2Å; F550-Y556 AromaticContact CE2-CD2 3.7Å; F550-Y556 HydrophobicContact CE2-CD2 3.7Å; F550-Y556 AromaticContact CE2-CE2 3.95Å; F550-Y556 HydrophobicContact CE2-CE2 3.95Å; F550-Y556 HydrophobicContact CG-CD2 4.45Å; F550-Y556 HydrophobicContact CZ-CD2 4.45Å; F550-Y559 HydrophobicContact CD1-CD2 4.24Å; F550-Y559 HydrophobicContact CD1-CE2 4.2Å; F550-Y559 AromaticContact CE1-CD2 3.72Å; F550-Y559 HydrophobicContact CE1-CD2 3.72Å; F550-Y559 AromaticContact CE1-CE2 3.9Å; F550-Y559 HydrophobicContact CE1-CE2 3.9Å; F550-Y559 HydrophobicContact CZ-CD2 4.37Å
551	K	58.4	Low	61.3	Low	214 Å²	214	71.5 Å²	71.5	93%	0.93	38%	0.38	S	S	*	.	S	Bend	trans	-68	-19.9	175.2	-68.7	-175.1	176.6	-177	0	113
552	E	68	Low	62.2	Low	63 Å²	63	71 Å²	71	29%	0.294	37%	0.37	S	S	.	.			trans	-125.4	95	-176.8	-69.7	-177.6	134.6	0	0	109.4	K532 F550 Y554 M555	K532-E552 IonicContact NZ-OE1 3.8Å; K532-E552 PolarHBondContact NZ-OE1 3.37Å; K532-E552 IonicContact NZ-OE2 3.43Å; K532-E552 PolarHBondContact NZ-OE2 2.86Å; F550-E552 PolarHBondContact O-N 3.44Å; E552-Y554 VanDerWaalsContact C-N 3.29Å; E552-Y554 HydrophobicContact CB-CD1 4.05Å; E552-Y554 HydrophobicContact CB-CE1 3.56Å; E552-Y554 HydrophobicContact CG-CE1 3.82Å; E552-Y554 PolarHBondContact O-N 2.85Å; E552-Y554 PolarHBondContact OE1-OH 2.86Å; E552-M555 HydrophobicContact CB-CG 4.04Å; E552-M555 PolarHBondContact O-N 3.1Å
553	S	66.5	Low	63.1	Low	91 Å²	91	76.6 Å²	76.6	64%	0.636	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-61.1	-33.7	-174.4	50.9	0	0	0	0	113.6	M555 Y556	S553-M555 PolarHBondContact O-N 3.24Å; S553-Y556 VanDerWaalsContact O-CB 3.3Å; S553-Y556 WeakPolarHBondContact O-CB 3.49Å; S553-Y556 PolarHBondContact O-N 3.03Å; S553-Y556 VanDerWaalsContact O-N 3.15Å
554	Y	73.7	Confident	63.9	Low	41 Å²	41	78.2 Å²	78.2	16%	0.161	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-63	-25.4	178.9	69	-90.8	0	0	0	113.7	I427 D428 L529 E552 Y556	I427-Y554 HydrophobicContact CD1-CD2 4.08Å; I427-Y554 HydrophobicContact CD1-CE2 4.2Å; I427-Y554 HydrophobicContact CG1-CD2 3.96Å; I427-Y554 HydrophobicContact CG1-CE2 4.04Å; D428-Y554 HydrophobicContact CB-CD2 4.41Å; D428-Y554 HydrophobicContact CB-CE2 4.25Å; L529-Y554 HydrophobicContact CD2-CE2 4.43Å; E552-Y554 VanDerWaalsContact C-N 3.29Å; E552-Y554 HydrophobicContact CB-CD1 4.05Å; E552-Y554 HydrophobicContact CB-CE1 3.56Å; E552-Y554 HydrophobicContact CG-CE1 3.82Å; E552-Y554 PolarHBondContact O-N 2.85Å; E552-Y554 PolarHBondContact OE1-OH 2.86Å; Y554-Y556 VanDerWaalsContact C-N 3.32Å
555	M	76.8	Confident	65.2	Low	1 Å²	1	82.2 Å²	82.2	1%	0.005	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-78.2	-17.1	178.9	-65.9	-69.9	-68.2	0	0	112.8	I427 L529 E552 S553 F558 Y559	I427-M555 HydrophobicContact CD1-SD 3.44Å; I427-M555 WeakPolarHBondContact CD1-SD 3.41Å; I427-M555 HydrophobicContact CG1-SD 4.42Å; L529-M555 HydrophobicContact CD2-SD 3.99Å; E552-M555 HydrophobicContact CB-CG 4.04Å; E552-M555 PolarHBondContact O-N 3.1Å; S553-M555 PolarHBondContact O-N 3.24Å; M555-F558 HydrophobicContact CE-CD1 4.23Å; M555-F558 WeakPolarHBondContact O-CB 3.11Å; M555-F558 PolarHBondContact O-N 3.21Å; M555-Y559 HydrophobicContact CB-CD2 3.99Å; M555-Y559 HydrophobicContact CB-CE2 3.5Å; M555-Y559 VanDerWaalsContact CB-CE2 3.5Å; M555-Y559 HydrophobicContact CE-CE1 4.2Å; M555-Y559 HydrophobicContact CE-CE2 4.2Å; M555-Y559 VanDerWaalsContact CE-OH 3.27Å; M555-Y559 WeakPolarHBondContact CE-OH 3.35Å; M555-Y559 HydrophobicContact CG-CE2 4.44Å; M555-Y559 WeakPolarHBondContact O-CD2 3.22Å; M555-Y559 PolarHBondContact O-N 3.44Å
556	Y	73.5	Confident	66.6	Low	55 Å²	55	82.6 Å²	82.6	22%	0.216	41%	0.411	C	S	.	.	H	α-helix	trans	-64.7	-46.9	-171.9	-178.9	-107.8	0	0	0	112.8	L547 F550 S553 Y554 F558 Y559 K560	L547-Y556 HydrophobicContact CB-CE2 4.41Å; L547-Y556 HydrophobicContact CD1-CD1 3.49Å; L547-Y556 VanDerWaalsContact CD1-CD1 3.49Å; L547-Y556 HydrophobicContact CD1-CD2 3.83Å; L547-Y556 HydrophobicContact CD1-CE1 3.76Å; L547-Y556 HydrophobicContact CD1-CE2 4.16Å; L547-Y556 HydrophobicContact CD1-CG 3.48Å; L547-Y556 VanDerWaalsContact CD1-CG 3.48Å; F550-Y556 AromaticContact CD2-CD2 3.71Å; F550-Y556 HydrophobicContact CD2-CD2 3.71Å; F550-Y556 HydrophobicContact CD2-CE2 4.2Å; F550-Y556 AromaticContact CE2-CD2 3.7Å; F550-Y556 HydrophobicContact CE2-CD2 3.7Å; F550-Y556 AromaticContact CE2-CE2 3.95Å; F550-Y556 HydrophobicContact CE2-CE2 3.95Å; F550-Y556 HydrophobicContact CG-CD2 4.45Å; F550-Y556 HydrophobicContact CZ-CD2 4.45Å; S553-Y556 VanDerWaalsContact O-CB 3.3Å; S553-Y556 WeakPolarHBondContact O-CB 3.49Å; S553-Y556 PolarHBondContact O-N 3.03Å; S553-Y556 VanDerWaalsContact O-N 3.15Å; Y554-Y556 VanDerWaalsContact C-N 3.32Å; Y556-F558 PolarHBondContact O-N 2.73Å; Y556-Y559 PolarHBondContact O-N 2.73Å; Y556-K560 HydrophobicContact CD1-CD 4.46Å; Y556-K560 HydrophobicContact CE1-CD 4.09Å; Y556-K560 PolarHBondContact O-N 3.36Å; Y556-K560 VanDerWaalsContact O-N 3.13Å; Y556-K560 VanDerWaalsContact OH-CE 3.27Å; Y556-K560 WeakPolarHBondContact OH-CE 3.36Å
557	D	72.1	Confident	68.3	Low	95 Å²	95	75.2 Å²	75.2	51%	0.508	38%	0.381	S	S	.	.	H	α-helix	trans	-70.1	-19.7	178.2	-66.9	-33.4	0	0	0	112.7	K442	K442-D557 WeakPolarHBondContact CE-O 3.31Å; K442-D557 PolarHBondContact NZ-O 3.25Å
558	F	78.9	Confident	69.9	Low	3 Å²	3	72.6 Å²	72.6	1%	0.013	37%	0.367	C	S	.	.	H	α-helix	trans	-77.1	-44.8	170.6	178.6	-110.9	0	0	0	111.4	I427 K442 L445 Q446 V449 T533 M555 Y556 K560 S561 F562	I427-F558 HydrophobicContact CD1-CB 4.48Å; I427-F558 HydrophobicContact CD1-CG 4.5Å; K442-F558 HydrophobicContact CG-CD2 3.76Å; K442-F558 HydrophobicContact CG-CE2 4.43Å; L445-F558 HydrophobicContact CB-CE2 4.16Å; L445-F558 HydrophobicContact CB-CZ 4.21Å; L445-F558 HydrophobicContact CD2-CD1 4.3Å; L445-F558 HydrophobicContact CD2-CD2 4.41Å; L445-F558 HydrophobicContact CD2-CE1 3.82Å; L445-F558 HydrophobicContact CD2-CE2 3.95Å; L445-F558 HydrophobicContact CD2-CZ 3.64Å; L445-F558 HydrophobicContact CG-CE1 4.14Å; L445-F558 HydrophobicContact CG-CE2 3.96Å; L445-F558 HydrophobicContact CG-CZ 3.55Å; Q446-F558 HydrophobicContact CB-CE2 3.94Å; Q446-F558 HydrophobicContact CG-CE2 4.49Å; V449-F558 HydrophobicContact CG2-CE1 4.48Å; V449-F558 HydrophobicContact CG2-CZ 4.14Å; T533-F558 HydrophobicContact CG2-CE1 3.74Å; M555-F558 HydrophobicContact CE-CD1 4.23Å; M555-F558 WeakPolarHBondContact O-CB 3.11Å; M555-F558 PolarHBondContact O-N 3.21Å; Y556-F558 PolarHBondContact O-N 2.73Å; F558-K560 VanDerWaalsContact C-N 3.29Å; F558-K560 PolarHBondContact O-N 3.08Å; F558-S561 VanDerWaalsContact O-CB 3.31Å; F558-S561 WeakPolarHBondContact O-CB 3.36Å; F558-S561 PolarHBondContact O-N 2.9Å; F558-S561 PolarHBondContact O-OG 3.06Å; F558-F562 HydrophobicContact CD1-CE2 4.1Å; F558-F562 HydrophobicContact CD2-CE2 4.37Å; F558-F562 AromaticContact CE1-CE2 3.62Å; F558-F562 HydrophobicContact CE1-CE2 3.62Å; F558-F562 HydrophobicContact CE1-CZ 4.12Å; F558-F562 AromaticContact CE2-CE2 3.92Å; F558-F562 HydrophobicContact CE2-CE2 3.92Å; F558-F562 HydrophobicContact CE2-CZ 4.2Å; F558-F562 HydrophobicContact CG-CE2 4.46Å; F558-F562 AromaticContact CZ-CE2 3.51Å; F558-F562 HydrophobicContact CZ-CE2 3.51Å; F558-F562 AromaticContact CZ-CZ 3.66Å; F558-F562 HydrophobicContact CZ-CZ 3.66Å; F558-F562 WeakPolarHBondContact O-CD2 3.25Å
559	Y	77.6	Confident	71.9	Confident	17 Å²	17	74 Å²	74	7%	0.067	36%	0.362	C	S	.	.	H	α-helix	trans	-61.6	-35.6	177.4	-71.3	-48.5	0	0	0	113.3	T533 T536 L543 F550 M555 Y556 S561 F562	T533-Y559 HydrophobicContact CG2-CD1 4.48Å; T533-Y559 HydrophobicContact CG2-CE1 3.97Å; T536-Y559 HydrophobicContact CG2-CD1 4.4Å; T536-Y559 HydrophobicContact CG2-CE1 3.93Å; T536-Y559 HydrophobicContact CG2-CE2 4.5Å; T536-Y559 PolarHBondContact OG1-OH 3.35Å; L543-Y559 HydrophobicContact CD2-CD1 3.98Å; L543-Y559 HydrophobicContact CD2-CG 3.97Å; F550-Y559 HydrophobicContact CD1-CD2 4.24Å; F550-Y559 HydrophobicContact CD1-CE2 4.2Å; F550-Y559 AromaticContact CE1-CD2 3.72Å; F550-Y559 HydrophobicContact CE1-CD2 3.72Å; F550-Y559 AromaticContact CE1-CE2 3.9Å; F550-Y559 HydrophobicContact CE1-CE2 3.9Å; F550-Y559 HydrophobicContact CZ-CD2 4.37Å; M555-Y559 HydrophobicContact CB-CD2 3.99Å; M555-Y559 HydrophobicContact CB-CE2 3.5Å; M555-Y559 VanDerWaalsContact CB-CE2 3.5Å; M555-Y559 HydrophobicContact CE-CE1 4.2Å; M555-Y559 HydrophobicContact CE-CE2 4.2Å; M555-Y559 VanDerWaalsContact CE-OH 3.27Å; M555-Y559 WeakPolarHBondContact CE-OH 3.35Å; M555-Y559 HydrophobicContact CG-CE2 4.44Å; M555-Y559 WeakPolarHBondContact O-CD2 3.22Å; M555-Y559 PolarHBondContact O-N 3.44Å; Y556-Y559 PolarHBondContact O-N 2.73Å; Y559-S561 PolarHBondContact O-N 3.03Å; Y559-F562 PolarHBondContact O-N 3.14Å; Y559-F562 VanDerWaalsContact O-N 3.13Å
560	K	74.2	Confident	73.5	Confident	130 Å²	130	74.5 Å²	74.5	57%	0.565	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.4	173	-78.2	-178.2	171.7	172.2	0	114.5	Y556 F558 F562	Y556-K560 HydrophobicContact CD1-CD 4.46Å; Y556-K560 HydrophobicContact CE1-CD 4.09Å; Y556-K560 PolarHBondContact O-N 3.36Å; Y556-K560 VanDerWaalsContact O-N 3.13Å; Y556-K560 VanDerWaalsContact OH-CE 3.27Å; Y556-K560 WeakPolarHBondContact OH-CE 3.36Å; F558-K560 VanDerWaalsContact C-N 3.29Å; F558-K560 PolarHBondContact O-N 3.08Å; K560-F562 PolarHBondContact O-N 2.98Å
561	S	72.4	Confident	75	Confident	42 Å²	42	73 Å²	73	29%	0.294	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-12	178.7	75.7	0	0	0	0	113.3	F558 Y559	F558-S561 VanDerWaalsContact O-CB 3.31Å; F558-S561 WeakPolarHBondContact O-CB 3.36Å; F558-S561 PolarHBondContact O-N 2.9Å; F558-S561 PolarHBondContact O-OG 3.06Å; Y559-S561 PolarHBondContact O-N 3.03Å
562	F	74.4	Confident	76.3	Confident	18 Å²	18	66.9 Å²	66.9	8%	0.079	32%	0.322	C	S	.	.	S	Bend	trans	-98	130.2	176.5	-63.2	-88.3	0	0	0	110.3	Q446 V449 Q450 T533 L537 F558 Y559 K560 E564	Q446-F562 HydrophobicContact CG-CE1 4.3Å; Q446-F562 HydrophobicContact CG-CZ 3.97Å; V449-F562 HydrophobicContact CB-CE1 4.33Å; V449-F562 HydrophobicContact CB-CZ 3.98Å; V449-F562 HydrophobicContact CG1-CE1 3.7Å; V449-F562 HydrophobicContact CG1-CZ 3.61Å; Q450-F562 HydrophobicContact CG-CE1 4Å; T533-F562 HydrophobicContact CG2-CE2 4.34Å; T533-F562 HydrophobicContact CG2-CZ 4.46Å; L537-F562 HydrophobicContact CD1-CD1 4.46Å; L537-F562 HydrophobicContact CD2-CB 4.42Å; L537-F562 HydrophobicContact CD2-CG 4.45Å; F558-F562 HydrophobicContact CD1-CE2 4.1Å; F558-F562 HydrophobicContact CD2-CE2 4.37Å; F558-F562 AromaticContact CE1-CE2 3.62Å; F558-F562 HydrophobicContact CE1-CE2 3.62Å; F558-F562 HydrophobicContact CE1-CZ 4.12Å; F558-F562 AromaticContact CE2-CE2 3.92Å; F558-F562 HydrophobicContact CE2-CE2 3.92Å; F558-F562 HydrophobicContact CE2-CZ 4.2Å; F558-F562 HydrophobicContact CG-CE2 4.46Å; F558-F562 AromaticContact CZ-CE2 3.51Å; F558-F562 HydrophobicContact CZ-CE2 3.51Å; F558-F562 AromaticContact CZ-CZ 3.66Å; F558-F562 HydrophobicContact CZ-CZ 3.66Å; F558-F562 WeakPolarHBondContact O-CD2 3.25Å; Y559-F562 PolarHBondContact O-N 3.14Å; Y559-F562 VanDerWaalsContact O-N 3.13Å; K560-F562 PolarHBondContact O-N 2.98Å; F562-E564 PolarHBondContact O-N 2.81Å
563	Q	72.4	Confident	77.3	Confident	138 Å²	138	70.1 Å²	70.1	65%	0.645	34%	0.336	S	S	*	.			trans	-70	96.7	172.9	-68.7	-179.7	-17.5	0	0	109.7	E565 K566 C567	Q563-E565 PolarHBondContact O-N 2.98Å; Q563-K566 HydrophobicContact CB-CB 4.17Å; Q563-K566 PolarHBondContact O-N 3.08Å; Q563-C567 PolarHBondContact O-N 3.02Å; Q563-C567 VanDerWaalsContact O-N 3.12Å
564	E	68.6	Low	78.4	Confident	60 Å²	60	65.9 Å²	65.9	28%	0.28	31%	0.306	S	S	.	.	H	α-helix	trans	-50.8	-50.8	-173.6	178.1	169.6	-169.1	0	0	112.7	L543 S544 F562 K566 C567 I568	L543-E564 HydrophobicContact CB-CB 4.38Å; L543-E564 HydrophobicContact CB-CG 3.77Å; L543-E564 WeakPolarHBondContact CB-OE1 3.36Å; L543-E564 WeakPolarHBondContact CB-OE2 2.92Å; L543-E564 HydrophobicContact CD1-CB 3.95Å; L543-E564 HydrophobicContact CD1-CG 3.74Å; L543-E564 HydrophobicContact CG-CG 4.44Å; S544-E564 PolarHBondContact N-OE1 3.29Å; F562-E564 PolarHBondContact O-N 2.81Å; E564-K566 VanDerWaalsContact C-N 3.35Å; E564-K566 PolarHBondContact O-N 2.96Å; E564-C567 PolarHBondContact O-N 2.86Å; E564-I568 HydrophobicContact CG-CD1 3.57Å; E564-I568 HydrophobicContact CG-CG1 4.32Å; E564-I568 VanDerWaalsContact O-CG1 3.3Å; E564-I568 WeakPolarHBondContact O-CG1 3.17Å; E564-I568 PolarHBondContact O-N 2.79Å
565	E	70.6	Confident	79.1	Confident	171 Å²	171	64 Å²	64	80%	0.799	30%	0.299	S	S	*	.	H	α-helix	trans	-58.6	-44.2	-177.6	-66.6	-179.6	171.7	0	0	112.7	Q563 I568 E569	Q563-E565 PolarHBondContact O-N 2.98Å; E565-I568 PolarHBondContact O-N 2.75Å; E565-E569 WeakPolarHBondContact O-CB 3.18Å; E565-E569 PolarHBondContact O-N 3.05Å
566	K	80.6	Confident	79.7	Confident	113 Å²	113	66.3 Å²	66.3	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-69.2	-36	-179.5	-169.7	175.8	-175.3	173.8	0	112.2	Q563 E564 K570	Q563-K566 HydrophobicContact CB-CB 4.17Å; Q563-K566 PolarHBondContact O-N 3.08Å; E564-K566 VanDerWaalsContact C-N 3.35Å; E564-K566 PolarHBondContact O-N 2.96Å; K566-K570 WeakPolarHBondContact O-CG 3.23Å; K566-K570 PolarHBondContact O-N 2.77Å
567	C	79.8	Confident	80.3	Confident	15 Å²	15	67.4 Å²	67.4	10%	0.101	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-44.6	174.9	-71.4	0	0	0	0	110.9	F453 Q563 E564 E569 K570 V571	F453-C567 HydrophobicContact CE1-CB 4.37Å; F453-C567 HydrophobicContact CZ-CB 4Å; Q563-C567 PolarHBondContact O-N 3.02Å; Q563-C567 VanDerWaalsContact O-N 3.12Å; E564-C567 PolarHBondContact O-N 2.86Å; C567-E569 PolarHBondContact O-N 2.79Å; C567-K570 PolarHBondContact O-N 3.01Å; C567-V571 WeakPolarHBondContact O-CG2 3.27Å; C567-V571 PolarHBondContact O-N 2.93Å
568	I	78.9	Confident	81.1	Confident	44 Å²	44	62.9 Å²	62.9	23%	0.226	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-44.1	177.7	-69.4	171.4	0	0	0	110.8	W540 E564 E565 K570 V571 K572	W540-I568 HydrophobicContact CE3-CG2 4.22Å; W540-I568 HydrophobicContact CH2-CG2 3.63Å; W540-I568 HydrophobicContact CZ2-CG2 4.25Å; W540-I568 HydrophobicContact CZ3-CG2 3.62Å; E564-I568 HydrophobicContact CG-CD1 3.57Å; E564-I568 HydrophobicContact CG-CG1 4.32Å; E564-I568 VanDerWaalsContact O-CG1 3.3Å; E564-I568 WeakPolarHBondContact O-CG1 3.17Å; E564-I568 PolarHBondContact O-N 2.79Å; E565-I568 PolarHBondContact O-N 2.75Å; I568-K570 PolarHBondContact O-N 3.08Å; I568-V571 PolarHBondContact O-N 3.49Å; I568-K572 VanDerWaalsContact O-CB 3.32Å; I568-K572 WeakPolarHBondContact O-CB 3.25Å; I568-K572 PolarHBondContact O-N 2.83Å
569	E	84.5	Confident	81.3	Confident	138 Å²	138	63.1 Å²	63.1	65%	0.645	30%	0.295	S	S	*	.	H	α-helix	trans	-62.1	-44.1	178.8	-170.9	-178.6	-167.5	0	0	112	E565 C567 K572 K573	E565-E569 WeakPolarHBondContact O-CB 3.18Å; E565-E569 PolarHBondContact O-N 3.05Å; C567-E569 PolarHBondContact O-N 2.79Å; E569-K572 PolarHBondContact O-N 2.63Å; E569-K573 WeakPolarHBondContact O-CB 3.39Å; E569-K573 PolarHBondContact O-N 2.84Å
570	K	86	Confident	81.4	Confident	80 Å²	80	64.4 Å²	64.4	35%	0.348	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-44.1	175.4	-75.6	178.9	174.5	-171.5	0	112.4	F453 T457 K566 C567 I568 F574	F453-K570 HydrophobicContact CE1-CB 4.34Å; F453-K570 HydrophobicContact CE1-CD 4.02Å; F453-K570 HydrophobicContact CZ-CB 4.45Å; T457-K570 HydrophobicContact CG2-CB 4.13Å; K566-K570 WeakPolarHBondContact O-CG 3.23Å; K566-K570 PolarHBondContact O-N 2.77Å; C567-K570 PolarHBondContact O-N 3.01Å; I568-K570 PolarHBondContact O-N 3.08Å; K570-F574 WeakPolarHBondContact O-CB 3.24Å; K570-F574 PolarHBondContact O-N 2.95Å
571	V	87.2	Confident	80.6	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.024	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-44.7	176.6	170.2	0	0	0	0	110.2	F453 F498 C567 I568 F574 L575	F453-V571 HydrophobicContact CE2-CG2 3.65Å; F453-V571 HydrophobicContact CZ-CG2 3.71Å; F498-V571 HydrophobicContact CE2-CG1 3.89Å; F498-V571 HydrophobicContact CE2-CG2 4.46Å; F498-V571 HydrophobicContact CZ-CG1 4.31Å; F498-V571 HydrophobicContact CZ-CG2 4.07Å; C567-V571 WeakPolarHBondContact O-CG2 3.27Å; C567-V571 PolarHBondContact O-N 2.93Å; I568-V571 PolarHBondContact O-N 3.49Å; V571-F574 PolarHBondContact O-N 2.82Å; V571-L575 HydrophobicContact CG1-CD1 3.76Å; V571-L575 HydrophobicContact CG1-CG 4.1Å; V571-L575 WeakPolarHBondContact O-CB 3.38Å; V571-L575 VanDerWaalsContact O-CG 3.26Å; V571-L575 WeakPolarHBondContact O-CG 3.19Å; V571-L575 PolarHBondContact O-N 3.2Å
572	K	85.6	Confident	79.5	Confident	86 Å²	86	67.3 Å²	67.3	37%	0.374	33%	0.329	S	S	.	.	H	α-helix	trans	-58.9	-50.8	178.1	-172.2	-175.8	176.7	-174.4	0	111.3	Y490 W540 I568 E569 F574 L575 D576	Y490-K572 HydrophobicContact CD1-CG 4.31Å; Y490-K572 HydrophobicContact CE1-CG 3.73Å; Y490-K572 WeakPolarHBondContact OH-CE 3.44Å; W540-K572 HydrophobicContact CH2-CD 4.38Å; W540-K572 HydrophobicContact CZ3-CB 4.23Å; W540-K572 HydrophobicContact CZ3-CG 4.46Å; I568-K572 VanDerWaalsContact O-CB 3.32Å; I568-K572 WeakPolarHBondContact O-CB 3.25Å; I568-K572 PolarHBondContact O-N 2.83Å; E569-K572 PolarHBondContact O-N 2.63Å; K572-F574 VanDerWaalsContact C-N 3.31Å; K572-F574 PolarHBondContact O-N 2.69Å; K572-L575 PolarHBondContact O-N 2.76Å; K572-D576 WeakPolarHBondContact O-CB 3.16Å; K572-D576 PolarHBondContact O-N 2.81Å
573	K	88.5	Confident	78	Confident	131 Å²	131	70.1 Å²	70.1	57%	0.57	35%	0.351	S	S	*	.	H	α-helix	trans	-55.8	-46.9	176.3	-179.6	177.5	174.9	178	0	111.5	E569 D576 E577	E569-K573 WeakPolarHBondContact O-CB 3.39Å; E569-K573 PolarHBondContact O-N 2.84Å; K573-D576 PolarHBondContact O-N 2.85Å; K573-E577 WeakPolarHBondContact CE-OE1 3.14Å; K573-E577 WeakPolarHBondContact CG-OE1 3.17Å; K573-E577 VanDerWaalsContact O-CG 3.32Å; K573-E577 WeakPolarHBondContact O-CG 3.27Å; K573-E577 PolarHBondContact O-N 3.16Å
574	F	90.2	Very high	76.8	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.009	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-47.1	177.1	171.3	-97.8	0	0	0	112.4	I456 V497 F498 F502 K570 V571 K572 D576 E577 I578	I456-F574 HydrophobicContact CG2-CE1 4.46Å; I456-F574 HydrophobicContact CG2-CZ 4.3Å; I456-F574 WeakPolarHBondContact O-CD2 3.35Å; I456-F574 WeakPolarHBondContact O-CE2 3.29Å; V497-F574 HydrophobicContact CG1-CE1 3.78Å; V497-F574 HydrophobicContact CG1-CZ 4.24Å; F498-F574 HydrophobicContact CE2-CD1 4.14Å; F498-F574 HydrophobicContact CE2-CE1 4.2Å; F498-F574 HydrophobicContact CZ-CD1 4.27Å; F498-F574 HydrophobicContact CZ-CE1 4.36Å; F502-F574 HydrophobicContact CE2-CE1 4.43Å; F502-F574 HydrophobicContact CE2-CZ 4.03Å; K570-F574 WeakPolarHBondContact O-CB 3.24Å; K570-F574 PolarHBondContact O-N 2.95Å; V571-F574 PolarHBondContact O-N 2.82Å; K572-F574 VanDerWaalsContact C-N 3.31Å; K572-F574 PolarHBondContact O-N 2.69Å; F574-D576 VanDerWaalsContact C-N 3.33Å; F574-D576 PolarHBondContact O-N 2.89Å; F574-E577 PolarHBondContact O-N 3.1Å; F574-I578 HydrophobicContact CD1-CD1 4.32Å; F574-I578 HydrophobicContact CD2-CG2 4.44Å; F574-I578 HydrophobicContact CE1-CD1 3.77Å; F574-I578 HydrophobicContact CE2-CG2 4Å; F574-I578 HydrophobicContact CZ-CD1 4.12Å; F574-I578 HydrophobicContact CZ-CG2 4.05Å; F574-I578 WeakPolarHBondContact O-CG1 3.03Å; F574-I578 PolarHBondContact O-N 3.25Å; F574-I578 VanDerWaalsContact O-N 3.1Å
575	L	89	Confident	75.3	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-63.5	-38	178.3	-69.9	176.8	0	0	0	112	Y490 V493 F498 V571 K572 I578 S579	Y490-L575 HydrophobicContact CD1-CB 4.19Å; Y490-L575 HydrophobicContact CD1-CD1 4.21Å; V493-L575 HydrophobicContact CB-CD2 4.42Å; V493-L575 HydrophobicContact CG1-CD2 3.95Å; F498-L575 HydrophobicContact CE2-CD2 4.4Å; V571-L575 HydrophobicContact CG1-CD1 3.76Å; V571-L575 HydrophobicContact CG1-CG 4.1Å; V571-L575 WeakPolarHBondContact O-CB 3.38Å; V571-L575 VanDerWaalsContact O-CG 3.26Å; V571-L575 WeakPolarHBondContact O-CG 3.19Å; V571-L575 PolarHBondContact O-N 3.2Å; K572-L575 PolarHBondContact O-N 2.76Å; L575-I578 HydrophobicContact CD2-CD1 4.12Å; L575-I578 WeakPolarHBondContact O-CG1 2.98Å; L575-S579 WeakPolarHBondContact O-CB 3.36Å; L575-S579 PolarHBondContact O-N 3.09Å; L575-S579 PolarHBondContact O-OG 3.4Å
576	D	88.1	Confident	73.6	Confident	49 Å²	49	69.9 Å²	69.9	26%	0.262	36%	0.361	S	S	.	.	H	α-helix	trans	-64.4	-46.4	174.8	-79.7	-37.9	0	0	0	111.3	R475 Y490 K572 K573 F574 I578 S579 S580	R475-D576 IonicContact CZ-OD1 2.73Å; R475-D576 VanDerWaalsContact CZ-OD1 3.27Å; R475-D576 IonicContact NH1-OD1 3.5Å; R475-D576 PolarHBondContact NH1-OD1 3.03Å; R475-D576 IonicContact NH2-OD1 3.08Å; R475-D576 PolarHBondContact NH2-OD1 3.27Å; Y490-D576 WeakPolarHBondContact CE1-OD1 3.2Å; Y490-D576 PolarHBondContact OH-OD1 3.36Å; K572-D576 WeakPolarHBondContact O-CB 3.16Å; K572-D576 PolarHBondContact O-N 2.81Å; K573-D576 PolarHBondContact O-N 2.85Å; F574-D576 VanDerWaalsContact C-N 3.33Å; F574-D576 PolarHBondContact O-N 2.89Å; D576-I578 PolarHBondContact O-N 2.95Å; D576-S579 PolarHBondContact O-N 2.85Å; D576-S580 VanDerWaalsContact O-CB 3.24Å; D576-S580 WeakPolarHBondContact O-CB 3.46Å; D576-S580 PolarHBondContact O-N 3.47Å; D576-S580 VanDerWaalsContact O-N 3.08Å; D576-S580 PolarHBondContact O-OG 3.41Å
577	E	87.1	Confident	71.2	Confident	77 Å²	77	68.9 Å²	68.9	36%	0.36	37%	0.367	S	S	.	.	H	α-helix	trans	-61	-45.3	179.9	-74.3	171.9	-174.1	0	0	112.1	S460 K573 F574 S579 S580	S460-E577 WeakPolarHBondContact CB-OE2 3.13Å; S460-E577 PolarHBondContact OG-OE2 3.24Å; K573-E577 WeakPolarHBondContact CE-OE1 3.14Å; K573-E577 WeakPolarHBondContact CG-OE1 3.17Å; K573-E577 VanDerWaalsContact O-CG 3.32Å; K573-E577 WeakPolarHBondContact O-CG 3.27Å; K573-E577 PolarHBondContact O-N 3.16Å; F574-E577 PolarHBondContact O-N 3.1Å; E577-S579 VanDerWaalsContact C-N 3.31Å; E577-S579 PolarHBondContact O-N 3.19Å; E577-S580 PolarHBondContact O-OG 2.85Å
578	I	87.8	Confident	69.1	Low	1 Å²	1	79.6 Å²	79.6	1%	0.005	41%	0.405	C	S	.	.	H	α-helix	trans	-75.9	-14.1	-179.3	69	176.9	0	0	0	114.2	C463 C468 F471 V493 V497 F574 L575 D576	C463-I578 HydrophobicContact CB-CG2 3.99Å; C468-I578 VanDerWaalsContact CA-O 3.23Å; C468-I578 WeakPolarHBondContact CA-O 3.07Å; C468-I578 VanDerWaalsContact CB-O 3.25Å; C468-I578 WeakPolarHBondContact CB-O 3.2Å; C468-I578 PolarHBondContact SG-O 3.47Å; F471-I578 HydrophobicContact CD2-CD1 3.94Å; F471-I578 HydrophobicContact CD2-CG1 4.25Å; F471-I578 HydrophobicContact CE2-CD1 4.16Å; V493-I578 HydrophobicContact CG1-CD1 4.32Å; V497-I578 HydrophobicContact CG1-CD1 4.36Å; V497-I578 HydrophobicContact CG2-CD1 3.84Å; F574-I578 HydrophobicContact CD1-CD1 4.32Å; F574-I578 HydrophobicContact CD2-CG2 4.44Å; F574-I578 HydrophobicContact CE1-CD1 3.77Å; F574-I578 HydrophobicContact CE2-CG2 4Å; F574-I578 HydrophobicContact CZ-CD1 4.12Å; F574-I578 HydrophobicContact CZ-CG2 4.05Å; F574-I578 WeakPolarHBondContact O-CG1 3.03Å; F574-I578 PolarHBondContact O-N 3.25Å; F574-I578 VanDerWaalsContact O-N 3.1Å; L575-I578 HydrophobicContact CD2-CD1 4.12Å; L575-I578 WeakPolarHBondContact O-CG1 2.98Å; D576-I578 PolarHBondContact O-N 2.95Å
579	S	84.7	Confident	67.2	Low	7 Å²	7	84.6 Å²	84.6	5%	0.049	43%	0.428	C	S	.	.	H	α-helix	trans	-112.1	7.1	-179.4	65	0	0	0	0	114	R475 L575 D576 E577	R475-S579 PolarHBondContact NH1-OG 3.26Å; L575-S579 WeakPolarHBondContact O-CB 3.36Å; L575-S579 PolarHBondContact O-N 3.09Å; L575-S579 PolarHBondContact O-OG 3.4Å; D576-S579 PolarHBondContact O-N 2.85Å; E577-S579 VanDerWaalsContact C-N 3.31Å; E577-S579 PolarHBondContact O-N 3.19Å
580	S	80	Confident	65.5	Low	44 Å²	44	83.6 Å²	83.6	31%	0.308	42%	0.423	S	S	.	.	S	Bend	trans	-90.7	165.6	-179.6	69.1	0	0	0	0	114.2	R472 D576 E577 V582	R472-S580 PolarHBondContact NE-O 3.48Å; R472-S580 PolarHBondContact NH2-O 3.45Å; D576-S580 VanDerWaalsContact O-CB 3.24Å; D576-S580 WeakPolarHBondContact O-CB 3.46Å; D576-S580 PolarHBondContact O-N 3.47Å; D576-S580 VanDerWaalsContact O-N 3.08Å; D576-S580 PolarHBondContact O-OG 3.41Å; E577-S580 PolarHBondContact O-OG 2.85Å; S580-V582 PolarHBondContact O-N 3.14Å
581	N	56	Low	63.9	Low	129 Å²	129	85.3 Å²	85.3	69%	0.69	44%	0.436	S	S	*	.			trans	-77.8	12.3	-176.4	-83	-3.8	0	0	0	115.3	R472 S583	R472-N581 WeakPolarHBondContact CD-OD1 3.26Å; R472-N581 PolarHBondContact NE-OD1 2.92Å; N581-S583 PolarHBondContact O-N 3.27Å
582	V	48.9	Very low	62.7	Low	105 Å²	105	87.6 Å²	87.6	64%	0.636	46%	0.456	S	S	*	.			trans	-73.3	101.3	-178.1	-172.5	0	0	0	0	108.7	S580 K584	S580-V582 PolarHBondContact O-N 3.14Å; V582-K584 VanDerWaalsContact C-N 3.34Å; V582-K584 PolarHBondContact O-N 3.11Å
583	S	42.6	Very low	61.8	Low	77 Å²	77	86.4 Å²	86.4	54%	0.538	46%	0.455	S	S	.	.			trans	-56.7	101.2	164.9	61.3	0	0	0	0	107.3	N581 E585	N581-S583 PolarHBondContact O-N 3.27Å; S583-E585 PolarHBondContact O-N 2.77Å
584	K	48.1	Very low	61.2	Low	85 Å²	85	83 Å²	83	37%	0.37	45%	0.446	S	S	.	.			trans	-72.5	58.6	166.6	-67.4	-179.2	-173.9	166.7	0	108.9	S460 S461 V582 S586	S460-K584 PolarHBondContact O-NZ 3.32Å; S461-K584 PolarHBondContact O-NZ 3.04Å; V582-K584 VanDerWaalsContact C-N 3.34Å; V582-K584 PolarHBondContact O-N 3.11Å; K584-S586 PolarHBondContact O-N 2.75Å
585	E	37.5	Very low	60.5	Low	165 Å²	165	85.9 Å²	85.9	77%	0.771	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-2.1	171.5	-78.6	178.2	165	0	0	111.7	S583	S583-E585 PolarHBondContact O-N 2.77Å
586	S	34	Very low	60.2	Low	113 Å²	113	87.7 Å²	87.7	79%	0.79	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	24	-172.5	56.4	0	0	0	0	116.4	K584	K584-S586 PolarHBondContact O-N 2.75Å
587	C	31.4	Very low	60.2	Low	93 Å²	93	88.8 Å²	88.8	63%	0.628	47%	0.472	S	S	*	.			trans	-126.4	62.6	160.8	-148.6	0	0	0	0	111.9	Q589	C587-Q589 PolarHBondContact O-N 2.88Å
588	R	35.2	Very low	60.2	Low	239 Å²	239	85.9 Å²	85.9	90%	0.902	46%	0.462	S	S	*	.			trans	-77.9	22.7	162.2	-74.2	-171.5	176.6	176.7	0.5	112.7	E590	R588-E590 VanDerWaalsContact C-N 3.29Å; R588-E590 PolarHBondContact O-N 3.49Å
589	Q	39.2	Very low	60.3	Low	149 Å²	149	90.6 Å²	90.6	70%	0.696	48%	0.484	S	S	*	.			trans	-86.8	82.9	153.8	-79.3	-174.9	-15.8	0	0	106.3	C587 D591	C587-Q589 PolarHBondContact O-N 2.88Å; Q589-D591 PolarHBondContact O-N 3.15Å
590	E	48.2	Very low	60.7	Low	117 Å²	117	90.4 Å²	90.4	55%	0.547	48%	0.483	S	S	.	.			trans	-58.3	103.1	173	-70.7	179.2	177.7	0	0	108.8	R588 R625	R588-E590 VanDerWaalsContact C-N 3.29Å; R588-E590 PolarHBondContact O-N 3.49Å; E590-R625 PolarHBondContact O-NE 3.34Å; E590-R625 PolarHBondContact O-NH2 2.94Å
591	D	53.7	Low	61.1	Low	116 Å²	116	91.3 Å²	91.3	62%	0.62	48%	0.483	S	S	*	.			trans	-50.4	146.7	176.9	-76.3	-39.4	0	0	0	110.8	Q589 V593	Q589-D591 PolarHBondContact O-N 3.15Å; D591-V593 WeakPolarHBondContact O-CG2 3.29Å; D591-V593 PolarHBondContact O-N 3.47Å
592	A	60.3	Low	62.7	Low	53 Å²	53	86 Å²	86	44%	0.438	45%	0.453	S	S	.	.			trans	-66	98.6	-179.3	0	0	0	0	0	109.8	N624	A592-N624 WeakPolarHBondContact CA-OD1 3.26Å
593	V	66.6	Low	64.5	Low	60 Å²	60	83.5 Å²	83.5	36%	0.364	43%	0.432	S	S	.	.			trans	-83	124.8	-179	-178.8	0	0	0	0	108.7	D591 L595 T623 N624	D591-V593 WeakPolarHBondContact O-CG2 3.29Å; D591-V593 PolarHBondContact O-N 3.47Å; V593-L595 HydrophobicContact CG1-CD2 4.29Å; V593-L595 PolarHBondContact O-N 2.53Å; V593-T623 CarbonylContact O-C 3.49Å; V593-T623 WeakPolarHBondContact O-CA 3.4Å; V593-T623 WeakPolarHBondContact O-CB 3.37Å; V593-N624 PolarHBondContact N-OD1 3.06Å; V593-N624 PolarHBondContact O-N 3.41Å; V593-N624 VanDerWaalsContact O-N 3.15Å
594	V	76.3	Confident	66.1	Low	60 Å²	60	81.4 Å²	81.4	36%	0.364	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.7	171.9	-172.4	0	0	0	0	108.9	E597 R621 T623	V594-E597 HydrophobicContact CG1-CB 4.48Å; V594-E597 HydrophobicContact CG1-CG 4.46Å; V594-R621 HydrophobicContact CG1-CG 4.12Å; V594-R621 VanDerWaalsContact CG2-NE 3.31Å; V594-T623 HydrophobicContact CG2-CG2 4.26Å
595	L	76.1	Confident	66.9	Low	62 Å²	62	81.6 Å²	81.6	33%	0.325	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-42.8	178.7	-59.3	176.5	0	0	0	110.6	V593 V622 I688 V692	V593-L595 HydrophobicContact CG1-CD2 4.29Å; V593-L595 PolarHBondContact O-N 2.53Å; L595-V622 HydrophobicContact CD1-CG1 4.46Å; L595-V622 PolarHBondContact N-O 2.9Å; L595-I688 HydrophobicContact CB-CG2 3.85Å; L595-I688 HydrophobicContact CD1-CG2 4.2Å; L595-V692 HydrophobicContact CD1-CG1 3.3Å
596	K	83.3	Confident	67.7	Low	40 Å²	40	77.3 Å²	77.3	17%	0.174	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	145.5	176.3	-172.9	173.9	177.1	74.4	0	111.7	V622 E684 W685 I688	K596-V622 PolarHBondContact N-O 3.2Å; K596-V622 PolarHBondContact O-N 2.98Å; K596-E684 HydrophobicContact CD-CB 4.38Å; K596-E684 IonicContact NZ-OE2 3.91Å; K596-E684 PolarHBondContact NZ-OE2 2.91Å; K596-W685 HydrophobicContact CB-CH2 4.2Å; K596-W685 HydrophobicContact CB-CZ3 3.9Å; K596-W685 HydrophobicContact CD-CD2 3.82Å; K596-W685 HydrophobicContact CD-CE3 3.7Å; K596-W685 HydrophobicContact CD-CH2 4.02Å; K596-W685 HydrophobicContact CD-CZ2 4.12Å; K596-W685 HydrophobicContact CD-CZ3 3.79Å; K596-W685 VanDerWaalsContact CE-CE2 3.48Å; K596-W685 HydrophobicContact CG-CE3 4.17Å; K596-W685 HydrophobicContact CG-CH2 3.66Å; K596-W685 HydrophobicContact CG-CZ2 4.05Å; K596-W685 HydrophobicContact CG-CZ3 3.71Å; K596-I688 HydrophobicContact CB-CD1 3.54Å; K596-I688 HydrophobicContact CD-CD1 3.58Å; K596-I688 HydrophobicContact CG-CD1 4.12Å
597	E	87.6	Confident	68.3	Low	73 Å²	73	79.8 Å²	79.8	34%	0.341	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.6	167.4	60.4	167.9	-160.3	0	0	111.5	V594 W619 L620 R621	V594-E597 HydrophobicContact CG1-CB 4.48Å; V594-E597 HydrophobicContact CG1-CG 4.46Å; E597-W619 HydrophobicContact CB-CZ2 4.29Å; E597-W619 HydrophobicContact CG-CZ2 3.98Å; E597-W619 PolarHBondContact OE2-NE1 2.91Å; E597-L620 CarbonylContact C-O 3.58Å; E597-L620 WeakPolarHBondContact CA-O 3.38Å; E597-L620 WeakPolarHBondContact CB-O 3.35Å; E597-R621 HydrophobicContact CB-CB 4.26Å; E597-R621 HydrophobicContact CB-CG 4.34Å
598	G	87.3	Confident	69.2	Low	15 Å²	15	84.9 Å²	84.9	16%	0.155	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-180	170	-179.8	0	0	0	0	0	114.5	W619 L620	G598-W619 CarbonylContact O-C 3.59Å; G598-W619 WeakPolarHBondContact O-CA 3.48Å; G598-L620 PolarHBondContact N-O 3.29Å; G598-L620 PolarHBondContact O-N 3.02Å
599	E	90.3	Very high	69.7	Low	100 Å²	100	78.6 Å²	78.6	47%	0.467	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	129.5	175.6	-175.5	171.3	116.8	0	0	110.9	K617 R618 W619	E599-K617 WeakPolarHBondContact OE1-CD 3.3Å; E599-K617 WeakPolarHBondContact OE1-CE 3.38Å; E599-K617 IonicContact OE1-NZ 3.55Å; E599-K617 PolarHBondContact OE1-NZ 3.29Å; E599-R618 WeakPolarHBondContact CA-O 3.47Å; E599-W619 HydrophobicContact CB-CE3 4.27Å; E599-W619 HydrophobicContact CB-CZ3 4.34Å
600	V	91.9	Very high	70	Confident	3 Å²	3	81.4 Å²	81.4	2%	0.018	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	159.5	178	-58.1	0	0	0	0	111.1	K617 R618 L620 V674 W685	V600-K617 CarbonylContact O-C 3.52Å; V600-K617 WeakPolarHBondContact O-CA 3.42Å; V600-R618 HydrophobicContact CG2-CB 4.49Å; V600-R618 PolarHBondContact N-O 3.42Å; V600-R618 PolarHBondContact O-N 3.32Å; V600-L620 HydrophobicContact CG1-CB 4.14Å; V600-L620 HydrophobicContact CG1-CD2 4.27Å; V600-L620 HydrophobicContact CG2-CB 3.78Å; V600-L620 HydrophobicContact CG2-CD2 4.31Å; V600-L620 HydrophobicContact CG2-CG 4.45Å; V600-V674 HydrophobicContact CB-CG1 3.61Å; V600-V674 HydrophobicContact CG1-CG1 4.1Å; V600-V674 HydrophobicContact CG2-CG1 3.67Å; V600-W685 HydrophobicContact CG1-CZ2 4.14Å
601	Q	89.4	Confident	69.9	Low	64 Å²	64	78.6 Å²	78.6	30%	0.299	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	110.6	169.8	-49.5	-168.6	0.7	0	0	110.7	F615 K617 Q675	Q601-F615 HydrophobicContact CB-CB 4.44Å; Q601-K617 HydrophobicContact CG-CG 4.49Å; Q601-Q675 HydrophobicContact CB-CB 4.02Å; Q601-Q675 PolarHBondContact N-O 3.07Å; Q601-Q675 PolarHBondContact O-N 3.03Å
602	K	89.9	Confident	69.6	Low	16 Å²	16	83.6 Å²	83.6	7%	0.07	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	135.7	-178.8	-175.4	-106.5	178.6	-163.9	0	111.5	F615 K616 R618 L672	K602-F615 WeakPolarHBondContact O-CA 3.2Å; K602-K616 PolarHBondContact N-O 3.38Å; K602-K616 PolarHBondContact O-N 2.89Å; K602-R618 HydrophobicContact CB-CB 4.41Å; K602-R618 HydrophobicContact CB-CG 3.98Å; K602-L672 HydrophobicContact CD-CD1 4.14Å; K602-L672 HydrophobicContact CG-CD1 3.86Å
603	R	85.8	Confident	69.3	Low	53 Å²	53	91.4 Å²	91.4	20%	0.2	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.2	173.7	-168.1	179.1	172.9	-168.6	0.5	111.4	Q605 N614 F615 F657 Y673	R603-Q605 PolarHBondContact O-N 3.49Å; R603-N614 WeakPolarHBondContact CA-O 3.2Å; R603-F615 HydrophobicContact CB-CD1 4.03Å; R603-F615 HydrophobicContact CB-CE1 3.69Å; R603-F615 HydrophobicContact CB-CZ 4.05Å; R603-F615 HydrophobicContact CG-CE1 4.27Å; R603-F615 HydrophobicContact CG-CE2 4.43Å; R603-F615 HydrophobicContact CG-CZ 4.14Å; R603-F657 VanDerWaalsContact NH1-CZ 3.35Å; R603-Y673 PolarHBondContact N-O 3.26Å
604	T	75.3	Confident	69.6	Low	34 Å²	34	90.2 Å²	90.2	21%	0.209	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-65	130.3	172.9	54.9	0	0	0	0	110.7	N614 K616	T604-N614 PolarHBondContact N-O 3.4Å; T604-N614 PolarHBondContact OG1-O 2.97Å; T604-N614 VanDerWaalsContact OG1-O 3.07Å; T604-K616 HydrophobicContact CG2-CD 3.83Å; T604-K616 HydrophobicContact CG2-CG 3.94Å
605	Q	65.4	Low	69.9	Low	89 Å²	89	89.1 Å²	89.1	42%	0.416	43%	0.431	S	S	.	.	S	Bend	trans	-91.7	128.6	175.4	-76.3	158	-34	0	0	107.7	R603	R603-Q605 PolarHBondContact O-N 3.49Å
606	G	54.5	Low	70.3	Confident	75 Å²	75	91 Å²	91	77%	0.773	44%	0.437	S	S	*	.	S	Bend	trans	103.3	18.6	170	0	0	0	0	0	119.1
607	K	47.6	Very low	70.6	Confident	165 Å²	165	95 Å²	95	72%	0.717	45%	0.454	S	S	*	.			trans	-119.6	140.7	171	-68.6	-165.1	176.2	-165.8	0	112.8
608	K	48.8	Very low	70.8	Confident	200 Å²	200	93.9 Å²	93.9	87%	0.87	45%	0.446	S	S	*	.			trans	-55.5	148.3	176	-69.7	-176.1	178.2	-179.1	0	111.2	F610	K608-F610 PolarHBondContact O-N 2.72Å
609	N	47.1	Very low	70.9	Confident	106 Å²	106	95.4 Å²	95.4	57%	0.567	45%	0.448	S	S	*	.	S	Bend	trans	-58.5	6.5	-163	-72.6	-20.9	0	0	0	119
610	F	45.7	Very low	71	Confident	208 Å²	208	90.8 Å²	90.8	91%	0.912	43%	0.426	S	S	*	.			trans	-120.8	54.1	-169.6	-76.2	-83.1	0	0	0	114.8	K608	K608-F610 PolarHBondContact O-N 2.72Å
611	S	46.1	Very low	70.9	Confident	59 Å²	59	94.7 Å²	94.7	41%	0.413	44%	0.441	S	S	.	.			trans	-134	128	166.5	-176.4	0	0	0	0	112.4	R613 N614	S611-R613 PolarHBondContact O-N 3.11Å; S611-R613 PolarHBondContact OG-N 3.32Å; S611-N614 PolarHBondContact O-ND2 3.17Å; S611-N614 PolarHBondContact O-OD1 2.85Å
612	K	46.8	Very low	70.8	Confident	221 Å²	221	91.7 Å²	91.7	96%	0.961	43%	0.426	S	S	*	.	S	Bend	trans	-63.2	1	171.7	-71.4	-179.8	177.1	178.2	0	113.7
613	R	53.3	Low	70.5	Confident	217 Å²	217	91 Å²	91	82%	0.819	42%	0.423	S	S	*	.			trans	-120.3	52	177.1	-69.8	-174.2	-179.4	176.4	0.9	113.2	S611	S611-R613 PolarHBondContact O-N 3.11Å; S611-R613 PolarHBondContact OG-N 3.32Å
614	N	73.6	Confident	70.1	Confident	34 Å²	34	90.4 Å²	90.4	18%	0.182	42%	0.424	C	S	.	.			trans	-82.3	-16.6	-178.5	-79.1	-19.2	0	0	0	115.3	R603 T604 S611	R603-N614 WeakPolarHBondContact CA-O 3.2Å; T604-N614 PolarHBondContact N-O 3.4Å; T604-N614 PolarHBondContact OG1-O 2.97Å; T604-N614 VanDerWaalsContact OG1-O 3.07Å; S611-N614 PolarHBondContact O-ND2 3.17Å; S611-N614 PolarHBondContact O-OD1 2.85Å
615	F	81.4	Confident	70.3	Confident	38 Å²	38	94.4 Å²	94.4	17%	0.167	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.1	-178.6	-70.8	-96.5	0	0	0	111	Q601 K602 R603 F657 M662	Q601-F615 HydrophobicContact CB-CB 4.44Å; K602-F615 WeakPolarHBondContact O-CA 3.2Å; R603-F615 HydrophobicContact CB-CD1 4.03Å; R603-F615 HydrophobicContact CB-CE1 3.69Å; R603-F615 HydrophobicContact CB-CZ 4.05Å; R603-F615 HydrophobicContact CG-CE1 4.27Å; R603-F615 HydrophobicContact CG-CE2 4.43Å; R603-F615 HydrophobicContact CG-CZ 4.14Å; F615-F657 HydrophobicContact CZ-CD1 4.37Å; F615-F657 HydrophobicContact CZ-CG 4.4Å; F615-M662 HydrophobicContact CE1-CE 3.87Å; F615-M662 HydrophobicContact CE1-SD 4.03Å; F615-M662 HydrophobicContact CZ-CE 4.14Å; F615-M662 HydrophobicContact CZ-SD 4.38Å
616	K	86.4	Confident	71.4	Confident	102 Å²	102	93.6 Å²	93.6	44%	0.443	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.7	177.9	-64.2	-174.7	177.3	-179.1	0	110.2	K602 T604 R618	K602-K616 PolarHBondContact N-O 3.38Å; K602-K616 PolarHBondContact O-N 2.89Å; T604-K616 HydrophobicContact CG2-CD 3.83Å; T604-K616 HydrophobicContact CG2-CG 3.94Å; K616-R618 VanDerWaalsContact CD-NH2 3.34Å; K616-R618 PolarHBondContact O-N 2.8Å
617	K	88.8	Confident	73.1	Confident	122 Å²	122	90 Å²	90	53%	0.53	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	131.2	170.3	-70.3	-177.5	164.9	-136.8	0	110.7	E599 V600 Q601	E599-K617 WeakPolarHBondContact OE1-CD 3.3Å; E599-K617 WeakPolarHBondContact OE1-CE 3.38Å; E599-K617 IonicContact OE1-NZ 3.55Å; E599-K617 PolarHBondContact OE1-NZ 3.29Å; V600-K617 CarbonylContact O-C 3.52Å; V600-K617 WeakPolarHBondContact O-CA 3.42Å; Q601-K617 HydrophobicContact CG-CG 4.49Å
618	R	91	Very high	75.1	Confident	50 Å²	50	82.2 Å²	82.2	19%	0.189	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.8	-178.9	-67.6	-63.6	178.5	-103.7	10.1	109.6	E599 V600 K602 K616 H630	E599-R618 WeakPolarHBondContact CA-O 3.47Å; V600-R618 HydrophobicContact CG2-CB 4.49Å; V600-R618 PolarHBondContact N-O 3.42Å; V600-R618 PolarHBondContact O-N 3.32Å; K602-R618 HydrophobicContact CB-CB 4.41Å; K602-R618 HydrophobicContact CB-CG 3.98Å; K616-R618 VanDerWaalsContact CD-NH2 3.34Å; K616-R618 PolarHBondContact O-N 2.8Å; R618-H630 WeakPolarHBondContact CA-O 3.23Å; R618-H630 VanDerWaalsContact CD-O 3.27Å; R618-H630 WeakPolarHBondContact CD-O 3.41Å
619	W	90.9	Very high	77.1	Confident	47 Å²	47	73.9 Å²	73.9	18%	0.178	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	113.1	168.8	-167.7	-97.1	0	0	0	108	E597 G598 E599 Y629 H630 K633	E597-W619 HydrophobicContact CB-CZ2 4.29Å; E597-W619 HydrophobicContact CG-CZ2 3.98Å; E597-W619 PolarHBondContact OE2-NE1 2.91Å; G598-W619 CarbonylContact O-C 3.59Å; G598-W619 WeakPolarHBondContact O-CA 3.48Å; E599-W619 HydrophobicContact CB-CE3 4.27Å; E599-W619 HydrophobicContact CB-CZ3 4.34Å; W619-Y629 CarbonylContact O-C 3.59Å; W619-Y629 VanDerWaalsContact O-CA 3.29Å; W619-Y629 WeakPolarHBondContact O-CA 3.4Å; W619-H630 HydrophobicContact CB-CB 4.22Å; W619-H630 PolarHBondContact N-O 2.92Å; W619-H630 PolarHBondContact O-N 3.24Å; W619-K633 HydrophobicContact CD2-CB 3.95Å; W619-K633 HydrophobicContact CD2-CG 4.34Å; W619-K633 HydrophobicContact CE3-CB 4.22Å; W619-K633 HydrophobicContact CG-CB 4.37Å; W619-K633 HydrophobicContact CH2-CD 4.02Å; W619-K633 HydrophobicContact CH2-CG 4.48Å; W619-K633 HydrophobicContact CZ2-CB 4.31Å; W619-K633 HydrophobicContact CZ2-CD 3.74Å; W619-K633 HydrophobicContact CZ2-CG 3.93Å
620	L	92.4	Very high	79.2	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	137.1	177	-160.4	66.8	0	0	0	108.7	E597 G598 V600 L627 W685	E597-L620 CarbonylContact C-O 3.58Å; E597-L620 WeakPolarHBondContact CA-O 3.38Å; E597-L620 WeakPolarHBondContact CB-O 3.35Å; G598-L620 PolarHBondContact N-O 3.29Å; G598-L620 PolarHBondContact O-N 3.02Å; V600-L620 HydrophobicContact CG1-CB 4.14Å; V600-L620 HydrophobicContact CG1-CD2 4.27Å; V600-L620 HydrophobicContact CG2-CB 3.78Å; V600-L620 HydrophobicContact CG2-CD2 4.31Å; V600-L620 HydrophobicContact CG2-CG 4.45Å; L620-L627 HydrophobicContact CD1-CD1 3.63Å; L620-L627 HydrophobicContact CD2-CD1 4.22Å; L620-L627 HydrophobicContact CG-CD1 3.83Å; L620-W685 HydrophobicContact CB-CH2 3.9Å; L620-W685 HydrophobicContact CB-CZ2 4.18Å; L620-W685 HydrophobicContact CB-CZ3 4.47Å; L620-W685 HydrophobicContact CD2-CD2 4.21Å; L620-W685 HydrophobicContact CD2-CE3 3.94Å; L620-W685 HydrophobicContact CD2-CH2 4.01Å; L620-W685 HydrophobicContact CD2-CZ2 4.28Å; L620-W685 HydrophobicContact CD2-CZ3 3.85Å; L620-W685 HydrophobicContact CG-CH2 4.16Å; L620-W685 HydrophobicContact CG-CZ3 4.24Å
621	R	89.8	Confident	81.2	Confident	85 Å²	85	66.5 Å²	66.5	32%	0.321	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.8	176	179.2	-178.6	-177.7	-167.2	-0.8	108.8	V594 E597 S628	V594-R621 HydrophobicContact CG1-CG 4.12Å; V594-R621 VanDerWaalsContact CG2-NE 3.31Å; E597-R621 HydrophobicContact CB-CB 4.26Å; E597-R621 HydrophobicContact CB-CG 4.34Å; R621-S628 PolarHBondContact N-O 3.14Å; R621-S628 PolarHBondContact O-N 3.28Å
622	V	87.3	Confident	83.1	Confident	0 Å²	0	73 Å²	73	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.8	176.8	178.4	0	0	0	0	108.6	L595 K596 L627 W685 I688 L689	L595-V622 HydrophobicContact CD1-CG1 4.46Å; L595-V622 PolarHBondContact N-O 2.9Å; K596-V622 PolarHBondContact N-O 3.2Å; K596-V622 PolarHBondContact O-N 2.98Å; V622-L627 HydrophobicContact CG2-CD1 3.52Å; V622-W685 HydrophobicContact CB-CZ3 4.43Å; V622-W685 HydrophobicContact CG2-CE3 4.27Å; V622-W685 HydrophobicContact CG2-CZ3 3.72Å; V622-I688 HydrophobicContact CG1-CG2 3.98Å; V622-L689 HydrophobicContact CG1-CD2 4.09Å; V622-L689 HydrophobicContact CG2-CD2 3.59Å; V622-L689 HydrophobicContact CG2-CG 4.25Å
623	T	83.3	Confident	84.8	Confident	1 Å²	1	69 Å²	69	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	174	171.6	66.1	0	0	0	0	110.2	V593 V594 R625 E626	V593-T623 CarbonylContact O-C 3.49Å; V593-T623 WeakPolarHBondContact O-CA 3.4Å; V593-T623 WeakPolarHBondContact O-CB 3.37Å; V594-T623 HydrophobicContact CG2-CG2 4.26Å; T623-R625 PolarHBondContact O-N 2.94Å; T623-R625 VanDerWaalsContact O-N 3.14Å; T623-R625 PolarHBondContact OG1-N 3.37Å; T623-E626 HydrophobicContact CG2-CG 4.46Å; T623-E626 PolarHBondContact N-O 2.69Å; T623-E626 VanDerWaalsContact OG1-CG 3.24Å; T623-E626 WeakPolarHBondContact OG1-CG 3.39Å; T623-E626 PolarHBondContact OG1-N 2.99Å; T623-E626 PolarHBondContact OG1-O 2.73Å
624	N	76.7	Confident	85.9	Confident	41 Å²	41	62.4 Å²	62.4	22%	0.219	29%	0.286	C	S	.	.	S	Bend	trans	-61.8	-11.4	169.5	63.7	-29	0	0	0	114.1	A592 V593	A592-N624 WeakPolarHBondContact CA-OD1 3.26Å; V593-N624 PolarHBondContact N-OD1 3.06Å; V593-N624 PolarHBondContact O-N 3.41Å; V593-N624 VanDerWaalsContact O-N 3.15Å
625	R	78.7	Confident	86.3	Confident	119 Å²	119	67.5 Å²	67.5	45%	0.449	31%	0.306	S	S	.	.	S	Bend	trans	-119.1	-35.7	-176	-66.2	-179.4	175	-162.2	-2.7	114.4	E590 T623 V643	E590-R625 PolarHBondContact O-NE 3.34Å; E590-R625 PolarHBondContact O-NH2 2.94Å; T623-R625 PolarHBondContact O-N 2.94Å; T623-R625 VanDerWaalsContact O-N 3.14Å; T623-R625 PolarHBondContact OG1-N 3.37Å; R625-V643 WeakPolarHBondContact O-CG2 3.26Å; R625-V643 PolarHBondContact O-N 2.79Å
626	E	88.6	Confident	86.4	Confident	71 Å²	71	74.1 Å²	74.1	33%	0.332	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	148	-172	57.9	178.5	-141.7	0	0	113.6	T623 T640 I641	T623-E626 HydrophobicContact CG2-CG 4.46Å; T623-E626 PolarHBondContact N-O 2.69Å; T623-E626 VanDerWaalsContact OG1-CG 3.24Å; T623-E626 WeakPolarHBondContact OG1-CG 3.39Å; T623-E626 PolarHBondContact OG1-N 2.99Å; T623-E626 PolarHBondContact OG1-O 2.73Å; E626-T640 HydrophobicContact CB-CG2 3.76Å; E626-T640 HydrophobicContact CG-CG2 4.17Å; E626-T640 WeakPolarHBondContact OE2-CG2 3.38Å; E626-I641 CarbonylContact C-O 3.55Å; E626-I641 WeakPolarHBondContact CA-O 3.31Å
627	L	90.1	Very high	86.4	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.4	165.3	165.1	65.2	0	0	0	108	L620 V622 I641 I646 V665 L672 L689	L620-L627 HydrophobicContact CD1-CD1 3.63Å; L620-L627 HydrophobicContact CD2-CD1 4.22Å; L620-L627 HydrophobicContact CG-CD1 3.83Å; V622-L627 HydrophobicContact CG2-CD1 3.52Å; L627-I641 HydrophobicContact CB-CB 4.43Å; L627-I641 HydrophobicContact CD2-CD1 4.32Å; L627-I641 PolarHBondContact N-O 3.17Å; L627-I641 PolarHBondContact O-N 2.97Å; L627-I646 HydrophobicContact CD2-CD1 4.37Å; L627-V665 HydrophobicContact CD2-CG1 4.21Å; L627-V665 HydrophobicContact CD2-CG2 4.4Å; L627-L672 HydrophobicContact CD2-CD2 4.41Å; L627-L689 HydrophobicContact CD1-CD2 4.23Å; L627-L689 HydrophobicContact CD2-CD2 4.23Å
628	S	90.6	Very high	86.2	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.014	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	152.5	178.2	68.2	0	0	0	0	111.9	R621 H630 C639	R621-S628 PolarHBondContact N-O 3.14Å; R621-S628 PolarHBondContact O-N 3.28Å; S628-H630 PolarHBondContact OG-NE2 3.39Å; S628-C639 VanDerWaalsContact CA-O 3.31Å; S628-C639 WeakPolarHBondContact CA-O 3.48Å
629	Y	91.1	Very high	86	Confident	25 Å²	25	68.9 Å²	68.9	10%	0.098	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	140.7	169.8	61.6	-103.2	0	0	0	112.6	W619 L638 C639 L672	W619-Y629 CarbonylContact O-C 3.59Å; W619-Y629 VanDerWaalsContact O-CA 3.29Å; W619-Y629 WeakPolarHBondContact O-CA 3.4Å; Y629-L638 HydrophobicContact CD2-CB 3.79Å; Y629-L638 HydrophobicContact CD2-CD1 4.15Å; Y629-L638 HydrophobicContact CE2-CB 3.59Å; Y629-L638 HydrophobicContact CE2-CD1 4.21Å; Y629-L638 WeakPolarHBondContact O-CB 3.49Å; Y629-L638 PolarHBondContact O-N 3.34Å; Y629-C639 HydrophobicContact CD1-CB 4.14Å; Y629-C639 HydrophobicContact CD2-CB 4.49Å; Y629-C639 HydrophobicContact CE1-CB 3.44Å; Y629-C639 VanDerWaalsContact CE1-CB 3.44Å; Y629-C639 HydrophobicContact CE2-CB 3.81Å; Y629-C639 PolarHBondContact N-O 3.22Å; Y629-C639 VanDerWaalsContact OH-CB 3.28Å; Y629-C639 WeakPolarHBondContact OH-CB 3.2Å; Y629-L672 HydrophobicContact CE1-CD1 4.33Å
630	H	91.4	Very high	85.9	Confident	17 Å²	17	70 Å²	70	8%	0.079	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	161	-171.2	-50.4	-107.5	0	0	0	110.9	R618 W619 S628 K635 E636 A637	R618-H630 WeakPolarHBondContact CA-O 3.23Å; R618-H630 VanDerWaalsContact CD-O 3.27Å; R618-H630 WeakPolarHBondContact CD-O 3.41Å; W619-H630 HydrophobicContact CB-CB 4.22Å; W619-H630 PolarHBondContact N-O 2.92Å; W619-H630 PolarHBondContact O-N 3.24Å; S628-H630 PolarHBondContact OG-NE2 3.39Å; H630-K635 PolarHBondContact ND1-O 2.96Å; H630-E636 PolarHBondContact ND1-O 2.8Å; H630-A637 WeakPolarHBondContact ND1-CA 3.31Å; H630-A637 PolarHBondContact ND1-N 3.13Å
631	K	87.1	Confident	85.7	Confident	141 Å²	141	70.8 Å²	70.8	61%	0.613	35%	0.348	S	S	*	.	S	Bend	trans	-64.1	-42.7	173.9	-75.4	-177.9	179.8	168.8	0	111.8	L638	K631-L638 HydrophobicContact CD-CD2 4.49Å; K631-L638 HydrophobicContact CG-CD1 3.81Å; K631-L638 HydrophobicContact CG-CD2 4.01Å; K631-L638 HydrophobicContact CG-CG 4.14Å
632	R	85.9	Confident	85.5	Confident	196 Å²	196	69 Å²	69	74%	0.74	35%	0.349	S	S	*	.	S	Bend	trans	-152.9	165.3	179.9	-63.6	-174.1	-177	173.3	-0	108.5	G634 K635	R632-G634 PolarHBondContact O-N 3.27Å; R632-K635 HydrophobicContact CB-CG 4.35Å; R632-K635 PolarHBondContact O-N 3.35Å
633	K	82.8	Confident	85.3	Confident	136 Å²	136	69.4 Å²	69.4	59%	0.591	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	136	173.6	-168.8	177.1	-175.4	-179.8	0	110.7	W619 K635	W619-K633 HydrophobicContact CD2-CB 3.95Å; W619-K633 HydrophobicContact CD2-CG 4.34Å; W619-K633 HydrophobicContact CE3-CB 4.22Å; W619-K633 HydrophobicContact CG-CB 4.37Å; W619-K633 HydrophobicContact CH2-CD 4.02Å; W619-K633 HydrophobicContact CH2-CG 4.48Å; W619-K633 HydrophobicContact CZ2-CB 4.31Å; W619-K633 HydrophobicContact CZ2-CD 3.74Å; W619-K633 HydrophobicContact CZ2-CG 3.93Å; K633-K635 VanDerWaalsContact C-N 3.3Å; K633-K635 PolarHBondContact O-N 2.95Å
634	G	75.3	Confident	85.2	Confident	80 Å²	80	77 Å²	77	83%	0.825	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	8.3	177.7	0	0	0	0	0	116.4	R632	R632-G634 PolarHBondContact O-N 3.27Å
635	K	83.2	Confident	85.7	Confident	140 Å²	140	79.4 Å²	79.4	61%	0.609	40%	0.397	S	S	*	.	S	Bend	trans	-96.9	164.1	172.6	-67.5	-63	-176.3	-174.1	0	111.4	H630 R632 K633	H630-K635 PolarHBondContact ND1-O 2.96Å; R632-K635 HydrophobicContact CB-CG 4.35Å; R632-K635 PolarHBondContact O-N 3.35Å; K633-K635 VanDerWaalsContact C-N 3.3Å; K633-K635 PolarHBondContact O-N 2.95Å
636	E	83.5	Confident	86	Confident	177 Å²	177	73.8 Å²	73.8	83%	0.827	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-57.6	149.3	175.7	-67.7	179.1	176.2	0	0	112.8	H630	H630-E636 PolarHBondContact ND1-O 2.8Å
637	A	85.6	Confident	85.8	Confident	42 Å²	42	72.5 Å²	72.5	35%	0.347	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	130.9	178.1	0	0	0	0	0	110	H630 C639	H630-A637 WeakPolarHBondContact ND1-CA 3.31Å; H630-A637 PolarHBondContact ND1-N 3.13Å; A637-C639 VanDerWaalsContact C-N 3.34Å
638	L	85.5	Confident	85.5	Confident	80 Å²	80	72.5 Å²	72.5	42%	0.419	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-26.6	172.5	-68.5	175.7	0	0	0	112.1	Y629 K631	Y629-L638 HydrophobicContact CD2-CB 3.79Å; Y629-L638 HydrophobicContact CD2-CD1 4.15Å; Y629-L638 HydrophobicContact CE2-CB 3.59Å; Y629-L638 HydrophobicContact CE2-CD1 4.21Å; Y629-L638 WeakPolarHBondContact O-CB 3.49Å; Y629-L638 PolarHBondContact O-N 3.34Å; K631-L638 HydrophobicContact CD-CD2 4.49Å; K631-L638 HydrophobicContact CG-CD1 3.81Å; K631-L638 HydrophobicContact CG-CD2 4.01Å; K631-L638 HydrophobicContact CG-CG 4.14Å
639	C	87.3	Confident	85.4	Confident	43 Å²	43	72.7 Å²	72.7	29%	0.291	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	142.5	177.6	-174.2	0	0	0	0	107.5	S628 Y629 A637	S628-C639 VanDerWaalsContact CA-O 3.31Å; S628-C639 WeakPolarHBondContact CA-O 3.48Å; Y629-C639 HydrophobicContact CD1-CB 4.14Å; Y629-C639 HydrophobicContact CD2-CB 4.49Å; Y629-C639 HydrophobicContact CE1-CB 3.44Å; Y629-C639 VanDerWaalsContact CE1-CB 3.44Å; Y629-C639 HydrophobicContact CE2-CB 3.81Å; Y629-C639 PolarHBondContact N-O 3.22Å; Y629-C639 VanDerWaalsContact OH-CB 3.28Å; Y629-C639 WeakPolarHBondContact OH-CB 3.2Å; A637-C639 VanDerWaalsContact C-N 3.34Å
640	T	88.3	Confident	85.2	Confident	71 Å²	71	71.7 Å²	71.7	44%	0.436	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.2	174.9	-60	0	0	0	0	107.2	E626	E626-T640 HydrophobicContact CB-CG2 3.76Å; E626-T640 HydrophobicContact CG-CG2 4.17Å; E626-T640 WeakPolarHBondContact OE2-CG2 3.38Å
641	I	87.7	Confident	85	Confident	20 Å²	20	76 Å²	76	10%	0.103	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.7	-177.8	-60.8	160	0	0	0	106.4	E626 L627 V643 L667	E626-I641 CarbonylContact C-O 3.55Å; E626-I641 WeakPolarHBondContact CA-O 3.31Å; L627-I641 HydrophobicContact CB-CB 4.43Å; L627-I641 HydrophobicContact CD2-CD1 4.32Å; L627-I641 PolarHBondContact N-O 3.17Å; L627-I641 PolarHBondContact O-N 2.97Å; I641-V643 PolarHBondContact O-N 2.83Å; I641-L667 HydrophobicContact CD1-CD1 3.86Å; I641-L667 HydrophobicContact CG2-CD1 4.43Å; I641-L667 HydrophobicContact CG2-CD2 3.76Å
642	S	85.1	Confident	84.9	Confident	47 Å²	47	69.7 Å²	69.7	33%	0.329	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	134.9	172.7	-176.9	0	0	0	0	109.8	K644 N645	S642-K644 PolarHBondContact O-N 3.13Å; S642-K644 VanDerWaalsContact O-N 3.11Å; S642-N645 WeakPolarHBondContact O-CB 3.42Å; S642-N645 PolarHBondContact O-N 3.42Å
643	V	84.1	Confident	84.5	Confident	9 Å²	9	62.7 Å²	62.7	6%	0.055	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-58.6	-27	178.4	-64.2	0	0	0	0	111.9	R625 I641 N645 I646 V692 N696	R625-V643 WeakPolarHBondContact O-CG2 3.26Å; R625-V643 PolarHBondContact O-N 2.79Å; I641-V643 PolarHBondContact O-N 2.83Å; V643-N645 PolarHBondContact O-N 2.86Å; V643-I646 HydrophobicContact CB-CD1 4.42Å; V643-I646 HydrophobicContact CG1-CD1 4.5Å; V643-I646 WeakPolarHBondContact O-CB 3.23Å; V643-I646 PolarHBondContact O-N 2.77Å; V643-V692 HydrophobicContact CB-CB 4.23Å; V643-V692 HydrophobicContact CB-CG2 4.12Å; V643-V692 HydrophobicContact CG1-CB 4.12Å; V643-V692 HydrophobicContact CG1-CG2 3.85Å; V643-N696 PolarHBondContact O-ND2 3.16Å
644	K	81.6	Confident	84.1	Confident	161 Å²	161	60.2 Å²	60.2	70%	0.7	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-61.8	-23.8	175.8	-63.1	-173.6	178.4	-173.6	0	113.9	S642 I646 N696	S642-K644 PolarHBondContact O-N 3.13Å; S642-K644 VanDerWaalsContact O-N 3.11Å; K644-I646 VanDerWaalsContact C-N 3.33Å; K644-N696 PolarHBondContact O-ND2 2.9Å
645	N	85.5	Confident	83.7	Confident	91 Å²	91	60.3 Å²	60.3	49%	0.487	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-88.5	-3.3	-178.2	-62.5	-6.7	0	0	0	112.8	S642 V643 Q647	S642-N645 WeakPolarHBondContact O-CB 3.42Å; S642-N645 PolarHBondContact O-N 3.42Å; V643-N645 PolarHBondContact O-N 2.86Å; N645-Q647 PolarHBondContact O-N 2.87Å
646	I	85.8	Confident	83.3	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	119.9	177.9	-60.2	174.2	0	0	0	108.5	L627 V643 K644 V649 V665 L667 L689 N696	L627-I646 HydrophobicContact CD2-CD1 4.37Å; V643-I646 HydrophobicContact CB-CD1 4.42Å; V643-I646 HydrophobicContact CG1-CD1 4.5Å; V643-I646 WeakPolarHBondContact O-CB 3.23Å; V643-I646 PolarHBondContact O-N 2.77Å; K644-I646 VanDerWaalsContact C-N 3.33Å; I646-V649 HydrophobicContact CG2-CG2 3.53Å; I646-V665 HydrophobicContact CB-CG1 4.41Å; I646-V665 HydrophobicContact CD1-CG1 4.14Å; I646-V665 HydrophobicContact CG1-CG1 3.93Å; I646-V665 HydrophobicContact CG2-CG1 3.77Å; I646-L667 HydrophobicContact CG1-CD2 4.09Å; I646-L689 HydrophobicContact CD1-CD2 4.27Å; I646-N696 PolarHBondContact O-ND2 3.44Å
647	Q	85	Confident	82.9	Confident	44 Å²	44	47 Å²	47	21%	0.206	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-28.4	-177.2	-64.6	-175.1	-28.5	0	0	113	N645 V666 S668 G698 R699 L700	N645-Q647 PolarHBondContact O-N 2.87Å; Q647-V666 HydrophobicContact CB-CG1 4.42Å; Q647-V666 PolarHBondContact N-O 3.16Å; Q647-S668 PolarHBondContact NE2-OG 3.41Å; Q647-G698 WeakPolarHBondContact CG-O 3.37Å; Q647-R699 CarbonylContact O-C 3.47Å; Q647-R699 VanDerWaalsContact O-CA 3.26Å; Q647-R699 WeakPolarHBondContact O-CA 3.5Å; Q647-R699 VanDerWaalsContact O-CG 3.28Å; Q647-R699 WeakPolarHBondContact O-CG 3.39Å; Q647-L700 HydrophobicContact CB-CD1 4.28Å; Q647-L700 HydrophobicContact CB-CG 4.15Å; Q647-L700 PolarHBondContact O-N 3.31Å
648	A	83.8	Confident	82.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	156.8	172.8	0	0	0	0	0	109.9	E650 V666 L700	A648-E650 HydrophobicContact CB-CG 4.36Å; A648-V666 HydrophobicContact CB-CB 4.04Å; A648-V666 HydrophobicContact CB-CG2 4Å; A648-V666 PolarHBondContact O-N 2.8Å; A648-L700 HydrophobicContact CB-CB 4.42Å
649	V	87.3	Confident	81.7	Confident	6 Å²	6	50.1 Å²	50.1	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	114.3	174.6	-168.3	0	0	0	0	107.7	I646 F663 Q664 V665 L686 L689	I646-V649 HydrophobicContact CG2-CG2 3.53Å; V649-F663 HydrophobicContact CG1-CD2 4.34Å; V649-Q664 VanDerWaalsContact CA-O 3.32Å; V649-Q664 WeakPolarHBondContact CA-O 3.22Å; V649-V665 HydrophobicContact CG1-CG2 4.33Å; V649-V665 HydrophobicContact CG2-CG1 4.41Å; V649-L686 HydrophobicContact CG1-CD2 3.89Å; V649-L689 HydrophobicContact CB-CB 4.25Å; V649-L689 HydrophobicContact CG1-CB 3.8Å; V649-L689 HydrophobicContact CG1-CD1 4.15Å; V649-L689 HydrophobicContact CG2-CB 3.79Å
650	E	88.6	Confident	81.3	Confident	3 Å²	3	50.1 Å²	50.1	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.7	-166.9	-60.4	-64.7	167.2	0	0	112.5	A648 F663 Q664 Y703 C729 T730	A648-E650 HydrophobicContact CB-CG 4.36Å; E650-F663 CarbonylContact O-C 3.47Å; E650-F663 VanDerWaalsContact O-CA 3.31Å; E650-F663 WeakPolarHBondContact O-CA 3.36Å; E650-F663 WeakPolarHBondContact O-CB 3.42Å; E650-Q664 HydrophobicContact CB-CG 4.35Å; E650-Q664 PolarHBondContact N-O 2.93Å; E650-Q664 PolarHBondContact O-N 2.84Å; E650-Y703 HydrophobicContact CB-CD1 4.22Å; E650-Y703 HydrophobicContact CB-CD2 3.64Å; E650-Y703 HydrophobicContact CB-CE1 4.08Å; E650-Y703 HydrophobicContact CB-CE2 3.51Å; E650-Y703 HydrophobicContact CB-CG 3.99Å; E650-Y703 HydrophobicContact CG-CD1 3.61Å; E650-Y703 HydrophobicContact CG-CD2 3.84Å; E650-Y703 HydrophobicContact CG-CE1 3.77Å; E650-Y703 HydrophobicContact CG-CE2 4.03Å; E650-Y703 HydrophobicContact CG-CG 3.62Å; E650-C729 VanDerWaalsContact OE1-CA 3.23Å; E650-C729 WeakPolarHBondContact OE1-CA 3.45Å; E650-C729 VanDerWaalsContact OE1-CB 3.27Å; E650-C729 WeakPolarHBondContact OE1-CB 3.46Å; E650-T730 PolarHBondContact OE1-N 3.26Å; E650-T730 WeakPolarHBondContact OE2-CB 3.22Å; E650-T730 PolarHBondContact OE2-N 2.96Å; E650-T730 PolarHBondContact OE2-OG1 3.36Å
651	K	86.5	Confident	81.2	Confident	109 Å²	109	47.7 Å²	47.7	47%	0.474	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.2	172.1	-170.5	175.8	178.4	179.7	0	110.1	L686	K651-L686 HydrophobicContact CB-CD1 4.04Å
652	L	85.3	Confident	81.1	Confident	7 Å²	7	47 Å²	47	4%	0.037	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-102.1	149.9	175.8	-67.6	165	0	0	0	111.1	F657 M662 Q664 Y673 S705	L652-F657 HydrophobicContact CD1-CD2 4.34Å; L652-F657 HydrophobicContact CD1-CE2 4.04Å; L652-M662 HydrophobicContact CB-CB 4.08Å; L652-M662 HydrophobicContact CD1-CB 4.16Å; L652-M662 HydrophobicContact CD1-CE 4.24Å; L652-M662 PolarHBondContact N-O 3.37Å; L652-Q664 HydrophobicContact CD1-CB 4.14Å; L652-Q664 HydrophobicContact CD2-CB 4.36Å; L652-Q664 HydrophobicContact CD2-CG 4.06Å; L652-Q664 HydrophobicContact CG-CB 4.35Å; L652-Q664 HydrophobicContact CG-CG 4.33Å; L652-Y673 HydrophobicContact CD1-CD1 3.57Å; L652-Y673 HydrophobicContact CD1-CE1 3.93Å; L652-Y673 HydrophobicContact CD2-CE1 4.41Å; L652-S705 WeakPolarHBondContact CA-O 3.47Å; L652-S705 WeakPolarHBondContact CD2-O 3.27Å
653	D	77.9	Confident	81.4	Confident	50 Å²	50	44.7 Å²	44.7	27%	0.267	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-63.6	138.3	171	-57	-36.3	0	0	0	109.1	S655 A656 S705 S706 K727	D653-S655 PolarHBondContact O-N 3.31Å; D653-S655 VanDerWaalsContact O-N 3.15Å; D653-A656 WeakPolarHBondContact O-CB 3.12Å; D653-A656 PolarHBondContact O-N 3.35Å; D653-S705 PolarHBondContact N-O 2.78Å; D653-S705 PolarHBondContact OD1-OG 2.85Å; D653-S705 WeakPolarHBondContact OD2-CB 3.4Å; D653-S705 PolarHBondContact OD2-OG 3.17Å; D653-S706 PolarHBondContact OD2-OG 2.85Å; D653-S706 VanDerWaalsContact OD2-OG 3.05Å; D653-K727 IonicContact OD1-NZ 2.55Å; D653-K727 PolarHBondContact OD1-NZ 3.3Å; D653-K727 VanDerWaalsContact OD1-NZ 3.12Å; D653-K727 IonicContact OD2-NZ 3.68Å
654	E	74.1	Confident	81.7	Confident	83 Å²	83	44.7 Å²	44.7	39%	0.388	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-59.7	-31.7	-177.2	-62.2	-170.4	167.6	0	0	112.5	A656 N658 R659	E654-A656 PolarHBondContact O-N 2.84Å; E654-N658 WeakPolarHBondContact O-CA 3.13Å; E654-N658 PolarHBondContact O-N 2.84Å; E654-R659 PolarHBondContact O-N 3.4Å
655	S	67.1	Low	82.1	Confident	83 Å²	83	37 Å²	37	58%	0.58	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-65.4	-20.3	176.1	57.4	0	0	0	0	113.5	D653 F657	D653-S655 PolarHBondContact O-N 3.31Å; D653-S655 VanDerWaalsContact O-N 3.15Å; S655-F657 VanDerWaalsContact C-N 3.3Å; S655-F657 PolarHBondContact O-N 3.42Å
656	A	73.9	Confident	82.1	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.033	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-62	-38.9	-177.6	0	0	0	0	0	112.1	D653 E654 N707	D653-A656 WeakPolarHBondContact O-CB 3.12Å; D653-A656 PolarHBondContact O-N 3.35Å; E654-A656 PolarHBondContact O-N 2.84Å; A656-N707 VanDerWaalsContact O-CG 3.22Å; A656-N707 PolarHBondContact O-ND2 3.19Å
657	F	74.4	Confident	82.1	Confident	34 Å²	34	35 Å²	35	15%	0.149	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.8	4.4	179.1	-67.3	-70.9	0	0	0	113.4	R603 F615 L652 S655 R659 M662 Y673 N707	R603-F657 VanDerWaalsContact NH1-CZ 3.35Å; F615-F657 HydrophobicContact CZ-CD1 4.37Å; F615-F657 HydrophobicContact CZ-CG 4.4Å; L652-F657 HydrophobicContact CD1-CD2 4.34Å; L652-F657 HydrophobicContact CD1-CE2 4.04Å; S655-F657 VanDerWaalsContact C-N 3.3Å; S655-F657 PolarHBondContact O-N 3.42Å; F657-R659 HydrophobicContact CB-CB 4.36Å; F657-R659 PolarHBondContact O-N 2.93Å; F657-M662 HydrophobicContact CD2-CE 3.85Å; F657-M662 HydrophobicContact CE2-CE 4.27Å; F657-Y673 AromaticContact CE2-CD1 3.62Å; F657-Y673 HydrophobicContact CE2-CD1 3.62Å; F657-Y673 AromaticContact CE2-CE1 3.91Å; F657-Y673 HydrophobicContact CE2-CE1 3.91Å; F657-Y673 AromaticContact CE2-CG 3.99Å; F657-Y673 HydrophobicContact CE2-CG 3.99Å; F657-Y673 AromaticContact CZ-CD1 3.95Å; F657-Y673 HydrophobicContact CZ-CD1 3.95Å; F657-Y673 HydrophobicContact CZ-CD2 4.13Å; F657-Y673 HydrophobicContact CZ-CE1 4.08Å; F657-Y673 HydrophobicContact CZ-CE2 4.23Å; F657-Y673 AromaticContact CZ-CG 3.97Å; F657-Y673 HydrophobicContact CZ-CG 3.97Å; F657-N707 HydrophobicContact CE1-CB 4Å; F657-N707 HydrophobicContact CE2-CB 4.21Å; F657-N707 HydrophobicContact CZ-CB 3.67Å
658	N	71.6	Confident	81.6	Confident	99 Å²	99	37 Å²	37	53%	0.529	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	46.7	-167.3	-63.3	-38.4	0	0	0	111.1	E654	E654-N658 WeakPolarHBondContact O-CA 3.13Å; E654-N658 PolarHBondContact O-N 2.84Å
659	R	74.5	Confident	81.2	Confident	87 Å²	87	45.9 Å²	45.9	33%	0.328	24%	0.235	S	C	.	.			trans	-142.7	133.9	-179	-74.4	-176.2	172	-115.7	-4.9	109.5	E654 F657 M662	E654-R659 PolarHBondContact O-N 3.4Å; F657-R659 HydrophobicContact CB-CB 4.36Å; F657-R659 PolarHBondContact O-N 2.93Å; R659-M662 HydrophobicContact CB-CG 3.72Å; R659-M662 HydrophobicContact CB-SD 4.22Å; R659-M662 WeakPolarHBondContact O-CG 3.36Å
660	K	79.1	Confident	80.7	Confident	44 Å²	44	51.7 Å²	51.7	19%	0.191	26%	0.26	C	S	.	.	S	Bend	trans	-74.6	160.5	172.5	-63.6	-173.3	168.2	180	0	111.3	L175 M662 Q675	L175-K660 HydrophobicContact CD1-CD 3.69Å; L175-K660 VanDerWaalsContact CD1-CE 3.42Å; L175-K660 HydrophobicContact CD1-CG 4.04Å; K660-M662 PolarHBondContact O-N 2.81Å; K660-Q675 VanDerWaalsContact O-CG 3.31Å; K660-Q675 WeakPolarHBondContact O-CG 3.26Å; K660-Q675 PolarHBondContact O-NE2 2.95Å; K660-Q675 VanDerWaalsContact O-NE2 3.12Å
661	N	85.8	Confident	80.5	Confident	20 Å²	20	53.5 Å²	53.5	11%	0.107	27%	0.272	C	S	.	.	S	Bend	trans	58.5	32.5	172.1	-51.1	-37.7	0	0	0	114.3	E61 Q675 A676 N678 C679 A682	E61-N661 PolarHBondContact OE1-ND2 2.85Å; E61-N661 PolarHBondContact OE1-OD1 2.98Å; N661-Q675 WeakPolarHBondContact O-CA 3.35Å; N661-A676 HydrophobicContact CB-CB 4.45Å; N661-A676 PolarHBondContact O-N 3.13Å; N661-N678 VanDerWaalsContact ND2-C 3.33Å; N661-N678 VanDerWaalsContact ND2-CA 3.32Å; N661-N678 WeakPolarHBondContact ND2-CA 3.23Å; N661-C679 PolarHBondContact ND2-N 3.07Å; N661-C679 VanDerWaalsContact OD1-CA 3.29Å; N661-C679 WeakPolarHBondContact OD1-CA 3.36Å; N661-C679 PolarHBondContact OD1-N 2.62Å; N661-A682 HydrophobicContact CB-CB 4.09Å
662	M	87.2	Confident	80.6	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.02	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.2	176.8	-75.4	-67.4	-48.8	0	0	110.1	F615 L652 F657 R659 K660 V674 Q675	F615-M662 HydrophobicContact CE1-CE 3.87Å; F615-M662 HydrophobicContact CE1-SD 4.03Å; F615-M662 HydrophobicContact CZ-CE 4.14Å; F615-M662 HydrophobicContact CZ-SD 4.38Å; L652-M662 HydrophobicContact CB-CB 4.08Å; L652-M662 HydrophobicContact CD1-CB 4.16Å; L652-M662 HydrophobicContact CD1-CE 4.24Å; L652-M662 PolarHBondContact N-O 3.37Å; F657-M662 HydrophobicContact CD2-CE 3.85Å; F657-M662 HydrophobicContact CE2-CE 4.27Å; R659-M662 HydrophobicContact CB-CG 3.72Å; R659-M662 HydrophobicContact CB-SD 4.22Å; R659-M662 WeakPolarHBondContact O-CG 3.36Å; K660-M662 PolarHBondContact O-N 2.81Å; M662-V674 WeakPolarHBondContact CA-O 3.36Å; M662-Q675 HydrophobicContact CG-CG 4.29Å; M662-Q675 HydrophobicContact SD-CB 3.48Å; M662-Q675 WeakPolarHBondContact SD-CB 3.49Å; M662-Q675 HydrophobicContact SD-CG 3.72Å
663	F	91.3	Very high	80.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	161.4	169.7	67.1	-85.6	0	0	0	110.4	V649 E650 V665 V674 A676 W685 L686 L689	V649-F663 HydrophobicContact CG1-CD2 4.34Å; E650-F663 CarbonylContact O-C 3.47Å; E650-F663 VanDerWaalsContact O-CA 3.31Å; E650-F663 WeakPolarHBondContact O-CA 3.36Å; E650-F663 WeakPolarHBondContact O-CB 3.42Å; F663-V665 HydrophobicContact CD2-CG2 4.36Å; F663-V665 HydrophobicContact CE2-CG2 4.08Å; F663-V674 HydrophobicContact CD1-CB 4.28Å; F663-V674 HydrophobicContact CD2-CB 4.39Å; F663-V674 HydrophobicContact CE1-CB 3.76Å; F663-V674 HydrophobicContact CE1-CG1 3.65Å; F663-V674 HydrophobicContact CE2-CB 3.89Å; F663-V674 HydrophobicContact CE2-CG1 4.32Å; F663-V674 HydrophobicContact CE2-CG2 4.28Å; F663-V674 HydrophobicContact CZ-CB 3.55Å; F663-V674 HydrophobicContact CZ-CG1 3.51Å; F663-V674 HydrophobicContact CZ-CG2 4.27Å; F663-V674 PolarHBondContact N-O 2.81Å; F663-V674 PolarHBondContact O-N 3.04Å; F663-A676 HydrophobicContact CE1-CB 4.35Å; F663-W685 HydrophobicContact CE1-CB 3.99Å; F663-W685 HydrophobicContact CE1-CG 4.25Å; F663-W685 HydrophobicContact CE2-CB 4.35Å; F663-W685 HydrophobicContact CZ-CB 3.76Å; F663-W685 HydrophobicContact CZ-CG 4.04Å; F663-L686 HydrophobicContact CB-CD1 4.44Å; F663-L686 HydrophobicContact CB-CD2 4.02Å; F663-L686 HydrophobicContact CB-CG 4.19Å; F663-L689 HydrophobicContact CE2-CD1 3.85Å
664	Q	90.3	Very high	81.4	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.5	173.8	62.5	-173.2	-18.3	0	0	111.5	V649 E650 L652 V666 L672 Y673 H704	V649-Q664 VanDerWaalsContact CA-O 3.32Å; V649-Q664 WeakPolarHBondContact CA-O 3.22Å; E650-Q664 HydrophobicContact CB-CG 4.35Å; E650-Q664 PolarHBondContact N-O 2.93Å; E650-Q664 PolarHBondContact O-N 2.84Å; L652-Q664 HydrophobicContact CD1-CB 4.14Å; L652-Q664 HydrophobicContact CD2-CB 4.36Å; L652-Q664 HydrophobicContact CD2-CG 4.06Å; L652-Q664 HydrophobicContact CG-CB 4.35Å; L652-Q664 HydrophobicContact CG-CG 4.33Å; Q664-V666 HydrophobicContact CG-CG2 4.04Å; Q664-L672 CarbonylContact C-O 3.53Å; Q664-L672 VanDerWaalsContact CA-O 3.27Å; Q664-L672 WeakPolarHBondContact CA-O 3.31Å; Q664-Y673 HydrophobicContact CB-CD1 4.04Å; Q664-Y673 HydrophobicContact CB-CE1 4.05Å; Q664-H704 PolarHBondContact NE2-O 3.13Å
665	V	89.7	Confident	82.2	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	108.5	163.1	-173.2	0	0	0	0	106.4	L627 I646 V649 F663 L667 P671 L672 L689	L627-V665 HydrophobicContact CD2-CG1 4.21Å; L627-V665 HydrophobicContact CD2-CG2 4.4Å; I646-V665 HydrophobicContact CB-CG1 4.41Å; I646-V665 HydrophobicContact CD1-CG1 4.14Å; I646-V665 HydrophobicContact CG1-CG1 3.93Å; I646-V665 HydrophobicContact CG2-CG1 3.77Å; V649-V665 HydrophobicContact CG1-CG2 4.33Å; V649-V665 HydrophobicContact CG2-CG1 4.41Å; F663-V665 HydrophobicContact CD2-CG2 4.36Å; F663-V665 HydrophobicContact CE2-CG2 4.08Å; V665-L667 HydrophobicContact CG1-CD2 4.16Å; V665-P671 WeakPolarHBondContact O-CA 3.47Å; V665-L672 HydrophobicContact CB-CB 4.09Å; V665-L672 HydrophobicContact CG2-CD2 4.39Å; V665-L672 PolarHBondContact N-O 3.16Å; V665-L672 PolarHBondContact O-N 2.79Å; V665-L689 HydrophobicContact CG2-CD1 3.91Å
666	V	86	Confident	83.3	Confident	20 Å²	20	40.7 Å²	40.7	12%	0.121	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	126.9	-179.8	-171.8	0	0	0	0	108.7	Q647 A648 Q664 L700	Q647-V666 HydrophobicContact CB-CG1 4.42Å; Q647-V666 PolarHBondContact N-O 3.16Å; A648-V666 HydrophobicContact CB-CB 4.04Å; A648-V666 HydrophobicContact CB-CG2 4Å; A648-V666 PolarHBondContact O-N 2.8Å; Q664-V666 HydrophobicContact CG-CG2 4.04Å; V666-L700 HydrophobicContact CG1-CD1 3.74Å
667	L	85.1	Confident	83.8	Confident	28 Å²	28	43.2 Å²	43.2	15%	0.147	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	158.4	-178.8	-56.9	170.7	0	0	0	108.1	I641 I646 V665 E669	I641-L667 HydrophobicContact CD1-CD1 3.86Å; I641-L667 HydrophobicContact CG2-CD1 4.43Å; I641-L667 HydrophobicContact CG2-CD2 3.76Å; I646-L667 HydrophobicContact CG1-CD2 4.09Å; V665-L667 HydrophobicContact CG1-CD2 4.16Å; L667-E669 PolarHBondContact O-N 3.29Å; L667-E669 VanDerWaalsContact O-N 3.16Å
668	S	74.9	Confident	84.3	Confident	87 Å²	87	42.3 Å²	42.3	61%	0.608	23%	0.227	S	C	*	.	S	Bend	trans	-59	-28.9	-178.9	-48.9	0	0	0	0	114.3	Q647	Q647-S668 PolarHBondContact NE2-OG 3.41Å
669	E	74.4	Confident	84.9	Confident	186 Å²	186	38 Å²	38	87%	0.869	20%	0.204	S	C	*	.	S	Bend	trans	-90.1	-67.4	177.5	-64.8	-171.5	174.6	0	0	112.9	L667	L667-E669 PolarHBondContact O-N 3.29Å; L667-E669 VanDerWaalsContact O-N 3.16Å
670	K	76.8	Confident	85.4	Confident	129 Å²	129	34.1 Å²	34.1	56%	0.561	19%	0.19	S	C	*	.			trans	-144.9	135.7	-176	-70.8	-176	-178.2	169.3	0	110.6
671	P	84.4	Confident	85.8	Confident	41 Å²	41	35.1 Å²	35.1	27%	0.266	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-64.8	144.3	176.2	27.2	-33.9	0	0	0	111.1	V665 Y673	V665-P671 WeakPolarHBondContact O-CA 3.47Å; P671-Y673 HydrophobicContact CB-CE2 4.41Å; P671-Y673 HydrophobicContact CG-CE2 3.9Å; P671-Y673 WeakPolarHBondContact CG-OH 3.43Å
672	L	88.1	Confident	85.8	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117	172.4	-174.2	74.9	0	0	0	108.8	K602 L627 Y629 Q664 V665 V674	K602-L672 HydrophobicContact CD-CD1 4.14Å; K602-L672 HydrophobicContact CG-CD1 3.86Å; L627-L672 HydrophobicContact CD2-CD2 4.41Å; Y629-L672 HydrophobicContact CE1-CD1 4.33Å; Q664-L672 CarbonylContact C-O 3.53Å; Q664-L672 VanDerWaalsContact CA-O 3.27Å; Q664-L672 WeakPolarHBondContact CA-O 3.31Å; V665-L672 HydrophobicContact CB-CB 4.09Å; V665-L672 HydrophobicContact CG2-CD2 4.39Å; V665-L672 PolarHBondContact N-O 3.16Å; V665-L672 PolarHBondContact O-N 2.79Å; L672-V674 HydrophobicContact CD2-CG2 3.8Å; L672-V674 HydrophobicContact CG-CG2 3.78Å
673	Y	89.8	Confident	85.7	Confident	25 Å²	25	36.3 Å²	36.3	10%	0.098	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	122.9	175.2	-61.9	-69.5	0	0	0	110.7	R603 L652 F657 Q664 P671	R603-Y673 PolarHBondContact N-O 3.26Å; L652-Y673 HydrophobicContact CD1-CD1 3.57Å; L652-Y673 HydrophobicContact CD1-CE1 3.93Å; L652-Y673 HydrophobicContact CD2-CE1 4.41Å; F657-Y673 AromaticContact CE2-CD1 3.62Å; F657-Y673 HydrophobicContact CE2-CD1 3.62Å; F657-Y673 AromaticContact CE2-CE1 3.91Å; F657-Y673 HydrophobicContact CE2-CE1 3.91Å; F657-Y673 AromaticContact CE2-CG 3.99Å; F657-Y673 HydrophobicContact CE2-CG 3.99Å; F657-Y673 AromaticContact CZ-CD1 3.95Å; F657-Y673 HydrophobicContact CZ-CD1 3.95Å; F657-Y673 HydrophobicContact CZ-CD2 4.13Å; F657-Y673 HydrophobicContact CZ-CE1 4.08Å; F657-Y673 HydrophobicContact CZ-CE2 4.23Å; F657-Y673 AromaticContact CZ-CG 3.97Å; F657-Y673 HydrophobicContact CZ-CG 3.97Å; Q664-Y673 HydrophobicContact CB-CD1 4.04Å; Q664-Y673 HydrophobicContact CB-CE1 4.05Å; P671-Y673 HydrophobicContact CB-CE2 4.41Å; P671-Y673 HydrophobicContact CG-CE2 3.9Å; P671-Y673 WeakPolarHBondContact CG-OH 3.43Å
674	V	90.7	Very high	85.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	140	-174.8	-173.3	0	0	0	0	110	V600 M662 F663 L672	V600-V674 HydrophobicContact CB-CG1 3.61Å; V600-V674 HydrophobicContact CG1-CG1 4.1Å; V600-V674 HydrophobicContact CG2-CG1 3.67Å; M662-V674 WeakPolarHBondContact CA-O 3.36Å; F663-V674 HydrophobicContact CD1-CB 4.28Å; F663-V674 HydrophobicContact CD2-CB 4.39Å; F663-V674 HydrophobicContact CE1-CB 3.76Å; F663-V674 HydrophobicContact CE1-CG1 3.65Å; F663-V674 HydrophobicContact CE2-CB 3.89Å; F663-V674 HydrophobicContact CE2-CG1 4.32Å; F663-V674 HydrophobicContact CE2-CG2 4.28Å; F663-V674 HydrophobicContact CZ-CB 3.55Å; F663-V674 HydrophobicContact CZ-CG1 3.51Å; F663-V674 HydrophobicContact CZ-CG2 4.27Å; F663-V674 PolarHBondContact N-O 2.81Å; F663-V674 PolarHBondContact O-N 3.04Å; L672-V674 HydrophobicContact CD2-CG2 3.8Å; L672-V674 HydrophobicContact CG-CG2 3.78Å
675	Q	90.8	Very high	85.2	Confident	29 Å²	29	39 Å²	39	14%	0.136	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124	169.7	-158.5	-175	-6.3	0	0	109.2	Q601 K660 N661 M662	Q601-Q675 HydrophobicContact CB-CB 4.02Å; Q601-Q675 PolarHBondContact N-O 3.07Å; Q601-Q675 PolarHBondContact O-N 3.03Å; K660-Q675 VanDerWaalsContact O-CG 3.31Å; K660-Q675 WeakPolarHBondContact O-CG 3.26Å; K660-Q675 PolarHBondContact O-NE2 2.95Å; K660-Q675 VanDerWaalsContact O-NE2 3.12Å; N661-Q675 WeakPolarHBondContact O-CA 3.35Å; M662-Q675 HydrophobicContact CG-CG 4.29Å; M662-Q675 HydrophobicContact SD-CB 3.48Å; M662-Q675 WeakPolarHBondContact SD-CB 3.49Å; M662-Q675 HydrophobicContact SD-CG 3.72Å
676	A	90	Very high	84.9	Confident	6 Å²	6	40.7 Å²	40.7	5%	0.05	23%	0.228	C	C	.	.			trans	-79.1	168.8	169.5	0	0	0	0	0	111.3	N661 F663 E681 A682	N661-A676 HydrophobicContact CB-CB 4.45Å; N661-A676 PolarHBondContact O-N 3.13Å; F663-A676 HydrophobicContact CE1-CB 4.35Å; A676-E681 HydrophobicContact CB-CB 4.01Å; A676-A682 HydrophobicContact CB-CB 3.76Å
677	G	85.1	Confident	84.5	Confident	58 Å²	58	43.1 Å²	43.1	60%	0.598	24%	0.237	S	C	*	.	S	Bend	trans	-65.8	-43	178.4	0	0	0	0	0	112.7	E681	G677-E681 WeakPolarHBondContact CA-OE2 3.48Å; G677-E681 PolarHBondContact N-OE2 3.26Å
678	N	85.6	Confident	84.2	Confident	15 Å²	15	43 Å²	43	8%	0.08	24%	0.237	C	C	.	.	S	Bend	trans	-148	179	-178.4	60.3	48.5	0	0	0	111.1	E61 E62 V63 N661 V680 E681 A682	E61-N678 HydrophobicContact CG-CB 4.41Å; E61-N678 WeakPolarHBondContact OE1-CA 3.44Å; E62-N678 VanDerWaalsContact O-CB 3.23Å; E62-N678 WeakPolarHBondContact O-CB 3.45Å; V63-N678 PolarHBondContact O-ND2 3.29Å; N661-N678 VanDerWaalsContact ND2-C 3.33Å; N661-N678 VanDerWaalsContact ND2-CA 3.32Å; N661-N678 WeakPolarHBondContact ND2-CA 3.23Å; N678-V680 VanDerWaalsContact C-N 3.34Å; N678-V680 PolarHBondContact O-N 3.27Å; N678-V680 WeakPolarHBondContact OD1-CB 3.39Å; N678-V680 PolarHBondContact OD1-N 2.9Å; N678-V680 VanDerWaalsContact OD1-N 3.09Å; N678-E681 PolarHBondContact OD1-N 3.22Å; N678-A682 WeakPolarHBondContact O-CB 3.43Å; N678-A682 PolarHBondContact O-N 3.47Å
679	C	84	Confident	84.5	Confident	7 Å²	7	38.9 Å²	38.9	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-65.7	-34.8	-177.8	64.8	0	0	0	0	113.3	E61 P86 N661 A682 S683	E61-C679 PolarHBondContact OE1-N 3.46Å; P86-C679 HydrophobicContact CG-CB 3.94Å; P86-C679 WeakPolarHBondContact CG-O 3.17Å; N661-C679 PolarHBondContact ND2-N 3.07Å; N661-C679 VanDerWaalsContact OD1-CA 3.29Å; N661-C679 WeakPolarHBondContact OD1-CA 3.36Å; N661-C679 PolarHBondContact OD1-N 2.62Å; C679-A682 PolarHBondContact O-N 3.03Å; C679-S683 PolarHBondContact O-N 3.39Å; C679-S683 VanDerWaalsContact O-N 3.07Å
680	V	85.6	Confident	84.6	Confident	6 Å²	6	30.1 Å²	30.1	4%	0.036	17%	0.167	C	C	.	.	H	α-helix	trans	-65	-53.8	177.8	171.5	0	0	0	0	109.6	V63 F83 N678 A682 S683 E684	V63-V680 HydrophobicContact CB-CG2 3.89Å; V63-V680 HydrophobicContact CG1-CG2 3.76Å; F83-V680 HydrophobicContact CB-CB 4.42Å; F83-V680 HydrophobicContact CB-CG1 3.47Å; F83-V680 VanDerWaalsContact CB-CG1 3.47Å; F83-V680 HydrophobicContact CB-CG2 4.09Å; F83-V680 HydrophobicContact CD2-CG2 3.82Å; F83-V680 HydrophobicContact CG-CG1 4.28Å; F83-V680 HydrophobicContact CG-CG2 4.07Å; N678-V680 VanDerWaalsContact C-N 3.34Å; N678-V680 PolarHBondContact O-N 3.27Å; N678-V680 WeakPolarHBondContact OD1-CB 3.39Å; N678-V680 PolarHBondContact OD1-N 2.9Å; N678-V680 VanDerWaalsContact OD1-N 3.09Å; V680-A682 VanDerWaalsContact C-N 3.26Å; V680-A682 PolarHBondContact O-N 3.46Å; V680-S683 WeakPolarHBondContact O-CB 3.45Å; V680-S683 PolarHBondContact O-N 3.16Å; V680-E684 WeakPolarHBondContact O-CG 3.43Å; V680-E684 PolarHBondContact O-N 3.14Å
681	E	86.6	Confident	84.3	Confident	66 Å²	66	24.9 Å²	24.9	31%	0.308	15%	0.145	S	C	.	.	H	α-helix	trans	-58.2	-40	177	-73.6	-173.8	-177.7	0	0	111.6	A676 G677 N678 S683 E684 W685	A676-E681 HydrophobicContact CB-CB 4.01Å; G677-E681 WeakPolarHBondContact CA-OE2 3.48Å; G677-E681 PolarHBondContact N-OE2 3.26Å; N678-E681 PolarHBondContact OD1-N 3.22Å; E681-S683 VanDerWaalsContact C-N 3.3Å; E681-S683 PolarHBondContact O-N 3.43Å; E681-E684 PolarHBondContact O-N 3.42Å; E681-W685 WeakPolarHBondContact O-CB 3.24Å; E681-W685 PolarHBondContact O-N 3.5Å
682	A	86.7	Confident	83.9	Confident	9 Å²	9	23.4 Å²	23.4	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-59.3	-43.2	176.6	0	0	0	0	0	111.8	N661 A676 N678 C679 V680 W685 L686	N661-A682 HydrophobicContact CB-CB 4.09Å; A676-A682 HydrophobicContact CB-CB 3.76Å; N678-A682 WeakPolarHBondContact O-CB 3.43Å; N678-A682 PolarHBondContact O-N 3.47Å; C679-A682 PolarHBondContact O-N 3.03Å; V680-A682 VanDerWaalsContact C-N 3.26Å; V680-A682 PolarHBondContact O-N 3.46Å; A682-W685 PolarHBondContact O-N 3.03Å; A682-L686 WeakPolarHBondContact O-CB 3.48Å; A682-L686 WeakPolarHBondContact O-CD1 3.49Å; A682-L686 WeakPolarHBondContact O-CG 3.47Å; A682-L686 PolarHBondContact O-N 3.3Å
683	S	84.4	Confident	83.2	Confident	39 Å²	39	23.3 Å²	23.3	27%	0.273	14%	0.135	S	C	.	.	H	α-helix	trans	-64.3	-47.2	176.9	-159.6	0	0	0	0	111.5	C679 V680 E681 W685 L686 E687	C679-S683 PolarHBondContact O-N 3.39Å; C679-S683 VanDerWaalsContact O-N 3.07Å; V680-S683 WeakPolarHBondContact O-CB 3.45Å; V680-S683 PolarHBondContact O-N 3.16Å; E681-S683 VanDerWaalsContact C-N 3.3Å; E681-S683 PolarHBondContact O-N 3.43Å; S683-W685 VanDerWaalsContact C-N 3.29Å; S683-W685 PolarHBondContact O-N 3.47Å; S683-L686 WeakPolarHBondContact O-CB 3.46Å; S683-L686 PolarHBondContact O-N 3.39Å; S683-L686 VanDerWaalsContact O-N 3.15Å; S683-E687 WeakPolarHBondContact O-CB 3.39Å; S683-E687 PolarHBondContact O-N 2.93Å
684	E	83	Confident	82.3	Confident	63 Å²	63	25.6 Å²	25.6	29%	0.294	14%	0.143	S	C	.	.	H	α-helix	trans	-59.9	-39.1	177	-67.1	174.2	167.6	0	0	112	K596 V680 E681 I688	K596-E684 HydrophobicContact CD-CB 4.38Å; K596-E684 IonicContact NZ-OE2 3.91Å; K596-E684 PolarHBondContact NZ-OE2 2.91Å; V680-E684 WeakPolarHBondContact O-CG 3.43Å; V680-E684 PolarHBondContact O-N 3.14Å; E681-E684 PolarHBondContact O-N 3.42Å; E684-I688 WeakPolarHBondContact O-CB 3.37Å; E684-I688 WeakPolarHBondContact O-CG1 3.4Å; E684-I688 PolarHBondContact O-N 2.98Å; E684-I688 VanDerWaalsContact O-N 3.11Å
685	W	87.6	Confident	81.2	Confident	3 Å²	3	30.7 Å²	30.7	1%	0.011	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-44.2	174.9	-76.7	119.6	0	0	0	112.1	K596 V600 L620 V622 F663 E681 A682 S683 L689	K596-W685 HydrophobicContact CB-CH2 4.2Å; K596-W685 HydrophobicContact CB-CZ3 3.9Å; K596-W685 HydrophobicContact CD-CD2 3.82Å; K596-W685 HydrophobicContact CD-CE3 3.7Å; K596-W685 HydrophobicContact CD-CH2 4.02Å; K596-W685 HydrophobicContact CD-CZ2 4.12Å; K596-W685 HydrophobicContact CD-CZ3 3.79Å; K596-W685 VanDerWaalsContact CE-CE2 3.48Å; K596-W685 HydrophobicContact CG-CE3 4.17Å; K596-W685 HydrophobicContact CG-CH2 3.66Å; K596-W685 HydrophobicContact CG-CZ2 4.05Å; K596-W685 HydrophobicContact CG-CZ3 3.71Å; V600-W685 HydrophobicContact CG1-CZ2 4.14Å; L620-W685 HydrophobicContact CB-CH2 3.9Å; L620-W685 HydrophobicContact CB-CZ2 4.18Å; L620-W685 HydrophobicContact CB-CZ3 4.47Å; L620-W685 HydrophobicContact CD2-CD2 4.21Å; L620-W685 HydrophobicContact CD2-CE3 3.94Å; L620-W685 HydrophobicContact CD2-CH2 4.01Å; L620-W685 HydrophobicContact CD2-CZ2 4.28Å; L620-W685 HydrophobicContact CD2-CZ3 3.85Å; L620-W685 HydrophobicContact CG-CH2 4.16Å; L620-W685 HydrophobicContact CG-CZ3 4.24Å; V622-W685 HydrophobicContact CB-CZ3 4.43Å; V622-W685 HydrophobicContact CG2-CE3 4.27Å; V622-W685 HydrophobicContact CG2-CZ3 3.72Å; F663-W685 HydrophobicContact CE1-CB 3.99Å; F663-W685 HydrophobicContact CE1-CG 4.25Å; F663-W685 HydrophobicContact CE2-CB 4.35Å; F663-W685 HydrophobicContact CZ-CB 3.76Å; F663-W685 HydrophobicContact CZ-CG 4.04Å; E681-W685 WeakPolarHBondContact O-CB 3.24Å; E681-W685 PolarHBondContact O-N 3.5Å; A682-W685 PolarHBondContact O-N 3.03Å; S683-W685 VanDerWaalsContact C-N 3.29Å; S683-W685 PolarHBondContact O-N 3.47Å; W685-L689 WeakPolarHBondContact O-CB 3.45Å; W685-L689 WeakPolarHBondContact O-CD1 3.22Å; W685-L689 VanDerWaalsContact O-CG 3.28Å; W685-L689 WeakPolarHBondContact O-CG 3.4Å; W685-L689 PolarHBondContact O-N 3.4Å
686	L	84.4	Confident	80.5	Confident	36 Å²	36	30.4 Å²	30.4	19%	0.188	18%	0.177	C	C	.	.	H	α-helix	trans	-61	-45.1	177.6	-81.9	160.8	0	0	0	111.5	V649 K651 F663 A682 S683 G690	V649-L686 HydrophobicContact CG1-CD2 3.89Å; K651-L686 HydrophobicContact CB-CD1 4.04Å; F663-L686 HydrophobicContact CB-CD1 4.44Å; F663-L686 HydrophobicContact CB-CD2 4.02Å; F663-L686 HydrophobicContact CB-CG 4.19Å; A682-L686 WeakPolarHBondContact O-CB 3.48Å; A682-L686 WeakPolarHBondContact O-CD1 3.49Å; A682-L686 WeakPolarHBondContact O-CG 3.47Å; A682-L686 PolarHBondContact O-N 3.3Å; S683-L686 WeakPolarHBondContact O-CB 3.46Å; S683-L686 PolarHBondContact O-N 3.39Å; S683-L686 VanDerWaalsContact O-N 3.15Å; L686-G690 WeakPolarHBondContact O-CA 3.38Å; L686-G690 PolarHBondContact O-N 2.95Å
687	E	77.4	Confident	79.4	Confident	70 Å²	70	40 Å²	40	33%	0.327	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-57.5	179.4	-179.1	172.1	-154.9	0	0	111.3	S683 L689 G690 Q691	S683-E687 WeakPolarHBondContact O-CB 3.39Å; S683-E687 PolarHBondContact O-N 2.93Å; E687-L689 PolarHBondContact O-N 2.95Å; E687-G690 PolarHBondContact O-N 2.79Å; E687-G690 VanDerWaalsContact O-N 3.17Å; E687-Q691 WeakPolarHBondContact O-CB 3.4Å; E687-Q691 VanDerWaalsContact O-CG 3.26Å; E687-Q691 WeakPolarHBondContact O-CG 3.3Å; E687-Q691 PolarHBondContact O-N 2.84Å
688	I	77.2	Confident	78.7	Confident	26 Å²	26	39.3 Å²	39.3	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-43.2	-177.1	-66.6	175.9	0	0	0	111.3	L595 K596 V622 E684 Q691 V692	L595-I688 HydrophobicContact CB-CG2 3.85Å; L595-I688 HydrophobicContact CD1-CG2 4.2Å; K596-I688 HydrophobicContact CB-CD1 3.54Å; K596-I688 HydrophobicContact CD-CD1 3.58Å; K596-I688 HydrophobicContact CG-CD1 4.12Å; V622-I688 HydrophobicContact CG1-CG2 3.98Å; E684-I688 WeakPolarHBondContact O-CB 3.37Å; E684-I688 WeakPolarHBondContact O-CG1 3.4Å; E684-I688 PolarHBondContact O-N 2.98Å; E684-I688 VanDerWaalsContact O-N 3.11Å; I688-Q691 PolarHBondContact O-N 3.2Å; I688-V692 WeakPolarHBondContact O-CG1 3.48Å; I688-V692 WeakPolarHBondContact O-CG2 3.27Å; I688-V692 PolarHBondContact O-N 2.85Å
689	L	82.4	Confident	78.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.3	-35.2	178.7	-72.7	170.7	0	0	0	112.1	V622 L627 I646 V649 F663 V665 W685 E687 V692 S693	V622-L689 HydrophobicContact CG1-CD2 4.09Å; V622-L689 HydrophobicContact CG2-CD2 3.59Å; V622-L689 HydrophobicContact CG2-CG 4.25Å; L627-L689 HydrophobicContact CD1-CD2 4.23Å; L627-L689 HydrophobicContact CD2-CD2 4.23Å; I646-L689 HydrophobicContact CD1-CD2 4.27Å; V649-L689 HydrophobicContact CB-CB 4.25Å; V649-L689 HydrophobicContact CG1-CB 3.8Å; V649-L689 HydrophobicContact CG1-CD1 4.15Å; V649-L689 HydrophobicContact CG2-CB 3.79Å; F663-L689 HydrophobicContact CE2-CD1 3.85Å; V665-L689 HydrophobicContact CG2-CD1 3.91Å; W685-L689 WeakPolarHBondContact O-CB 3.45Å; W685-L689 WeakPolarHBondContact O-CD1 3.22Å; W685-L689 VanDerWaalsContact O-CG 3.28Å; W685-L689 WeakPolarHBondContact O-CG 3.4Å; W685-L689 PolarHBondContact O-N 3.4Å; E687-L689 PolarHBondContact O-N 2.95Å; L689-V692 HydrophobicContact CD2-CG2 4.47Å; L689-V692 WeakPolarHBondContact O-CG2 3.25Å; L689-S693 WeakPolarHBondContact O-CB 3.15Å; L689-S693 PolarHBondContact O-N 3.15Å; L689-S693 PolarHBondContact O-OG 3.14Å
690	G	76.1	Confident	78.2	Confident	2 Å²	2	44.4 Å²	44.4	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-66.3	-37.3	173.7	0	0	0	0	0	112.5	L686 E687 S693 R694	L686-G690 WeakPolarHBondContact O-CA 3.38Å; L686-G690 PolarHBondContact O-N 2.95Å; E687-G690 PolarHBondContact O-N 2.79Å; E687-G690 VanDerWaalsContact O-N 3.17Å; G690-S693 PolarHBondContact O-OG 3Å; G690-R694 PolarHBondContact O-N 2.94Å
691	Q	70.9	Confident	77.8	Confident	20 Å²	20	49.1 Å²	49.1	9%	0.093	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-52.6	175.7	-72.3	176	1.5	0	0	111.5	E687 I688 S693 R694 T732 A735 L737 D740	E687-Q691 WeakPolarHBondContact O-CB 3.4Å; E687-Q691 VanDerWaalsContact O-CG 3.26Å; E687-Q691 WeakPolarHBondContact O-CG 3.3Å; E687-Q691 PolarHBondContact O-N 2.84Å; I688-Q691 PolarHBondContact O-N 3.2Å; Q691-S693 PolarHBondContact O-N 2.77Å; Q691-R694 VanDerWaalsContact O-CB 3.22Å; Q691-R694 WeakPolarHBondContact O-CB 3.33Å; Q691-R694 PolarHBondContact O-N 3.35Å; Q691-R694 VanDerWaalsContact O-N 3.14Å; Q691-T732 HydrophobicContact CG-CG2 3.83Å; Q691-A735 HydrophobicContact CG-CB 4.23Å; Q691-L737 HydrophobicContact CB-CD2 4.36Å; Q691-D740 PolarHBondContact NE2-OD1 3.09Å
692	V	74.6	Confident	77.5	Confident	10 Å²	10	48.1 Å²	48.1	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-25.8	-178.4	-60.5	0	0	0	0	113.8	L595 V643 I688 L689 L737	L595-V692 HydrophobicContact CD1-CG1 3.3Å; V643-V692 HydrophobicContact CB-CB 4.23Å; V643-V692 HydrophobicContact CB-CG2 4.12Å; V643-V692 HydrophobicContact CG1-CB 4.12Å; V643-V692 HydrophobicContact CG1-CG2 3.85Å; I688-V692 WeakPolarHBondContact O-CG1 3.48Å; I688-V692 WeakPolarHBondContact O-CG2 3.27Å; I688-V692 PolarHBondContact O-N 2.85Å; L689-V692 HydrophobicContact CD2-CG2 4.47Å; L689-V692 WeakPolarHBondContact O-CG2 3.25Å; V692-L737 HydrophobicContact CB-CD2 4.49Å; V692-L737 HydrophobicContact CG1-CD2 4.13Å
693	S	75.3	Confident	77.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5.9	179.3	61.7	0	0	0	0	113.5	L689 G690 Q691 C695 N696	L689-S693 WeakPolarHBondContact O-CB 3.15Å; L689-S693 PolarHBondContact O-N 3.15Å; L689-S693 PolarHBondContact O-OG 3.14Å; G690-S693 PolarHBondContact O-OG 3Å; Q691-S693 PolarHBondContact O-N 2.77Å; S693-C695 PolarHBondContact O-N 3.06Å; S693-N696 WeakPolarHBondContact CA-ND2 3.39Å; S693-N696 WeakPolarHBondContact CB-ND2 3.49Å; S693-N696 WeakPolarHBondContact O-CB 3.4Å; S693-N696 VanDerWaalsContact O-CG 3.29Å; S693-N696 PolarHBondContact O-N 3.48Å; S693-N696 PolarHBondContact O-ND2 2.93Å
694	R	70.4	Confident	77.3	Confident	73 Å²	73	47.9 Å²	47.9	28%	0.275	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-45.6	-164.7	-176.5	176.1	-179.3	-127.1	-6.5	115	G690 Q691 N696 R699 T732	G690-R694 PolarHBondContact O-N 2.94Å; Q691-R694 VanDerWaalsContact O-CB 3.22Å; Q691-R694 WeakPolarHBondContact O-CB 3.33Å; Q691-R694 PolarHBondContact O-N 3.35Å; Q691-R694 VanDerWaalsContact O-N 3.14Å; R694-N696 VanDerWaalsContact C-N 3.3Å; R694-R699 VanDerWaalsContact CA-NH1 3.28Å; R694-T732 WeakPolarHBondContact CD-O 3.49Å; R694-T732 PolarHBondContact NE-O 3.01Å
695	C	66	Low	77.3	Confident	107 Å²	107	44.9 Å²	44.9	72%	0.723	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	19.7	-174.7	-56.5	0	0	0	0	112.4	S693 E697	S693-C695 PolarHBondContact O-N 3.06Å; C695-E697 PolarHBondContact O-N 3.36Å
696	N	76.8	Confident	76.9	Confident	23 Å²	23	44.9 Å²	44.9	12%	0.123	24%	0.241	C	C	.	.			trans	-73	128	179.6	-68.1	-7.9	0	0	0	110.2	V643 K644 I646 S693 R694 G698 R699	V643-N696 PolarHBondContact O-ND2 3.16Å; K644-N696 PolarHBondContact O-ND2 2.9Å; I646-N696 PolarHBondContact O-ND2 3.44Å; S693-N696 WeakPolarHBondContact CA-ND2 3.39Å; S693-N696 WeakPolarHBondContact CB-ND2 3.49Å; S693-N696 WeakPolarHBondContact O-CB 3.4Å; S693-N696 VanDerWaalsContact O-CG 3.29Å; S693-N696 PolarHBondContact O-N 3.48Å; S693-N696 PolarHBondContact O-ND2 2.93Å; R694-N696 VanDerWaalsContact C-N 3.3Å; N696-G698 PolarHBondContact O-N 2.94Å; N696-R699 PolarHBondContact O-N 3.4Å
697	E	67.6	Low	76.5	Confident	208 Å²	208	44 Å²	44	97%	0.972	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-23	-177.6	-64.7	176.8	176.7	0	0	113.5	C695	C695-E697 PolarHBondContact O-N 3.36Å
698	G	69.6	Low	76.4	Confident	43 Å²	43	45 Å²	45	44%	0.443	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	23.3	-178.8	0	0	0	0	0	115.6	Q647 N696 L700	Q647-G698 WeakPolarHBondContact CG-O 3.37Å; N696-G698 PolarHBondContact O-N 2.94Å; G698-L700 PolarHBondContact O-N 3.34Å
699	R	78.8	Confident	76.2	Confident	60 Å²	60	45.6 Å²	45.6	23%	0.226	24%	0.243	C	C	.	.			trans	-67.1	131.5	-177.2	-163.8	175.4	-179.7	154	4.9	111.4	Q647 R694 N696 T730 T732	Q647-R699 CarbonylContact O-C 3.47Å; Q647-R699 VanDerWaalsContact O-CA 3.26Å; Q647-R699 WeakPolarHBondContact O-CA 3.5Å; Q647-R699 VanDerWaalsContact O-CG 3.28Å; Q647-R699 WeakPolarHBondContact O-CG 3.39Å; R694-R699 VanDerWaalsContact CA-NH1 3.28Å; N696-R699 PolarHBondContact O-N 3.4Å; R699-T730 PolarHBondContact NH2-O 2.99Å; R699-T732 PolarHBondContact NH2-OG1 3.48Å
700	L	80.1	Confident	75.5	Confident	69 Å²	69	50.7 Å²	50.7	36%	0.361	29%	0.285	S	S	.	.			trans	-76.4	143.6	175.8	-65.8	171.2	0	0	0	110.4	Q647 A648 V666 G698 C729	Q647-L700 HydrophobicContact CB-CD1 4.28Å; Q647-L700 HydrophobicContact CB-CG 4.15Å; Q647-L700 PolarHBondContact O-N 3.31Å; A648-L700 HydrophobicContact CB-CB 4.42Å; V666-L700 HydrophobicContact CG1-CD1 3.74Å; G698-L700 PolarHBondContact O-N 3.34Å; L700-C729 WeakPolarHBondContact O-CB 3.42Å; L700-C729 PolarHBondContact O-SG 3.5Å; L700-C729 VanDerWaalsContact O-SG 3.37Å
701	T	77.1	Confident	75.4	Confident	105 Å²	105	52.4 Å²	52.4	64%	0.644	30%	0.303	S	S	*	.	S	Bend	trans	-87.9	-20.1	172.1	55	0	0	0	0	112.5	P728 C729	T701-P728 CarbonylContact O-C 3.18Å; T701-P728 WeakPolarHBondContact O-CA 3.35Å; T701-C729 PolarHBondContact O-N 3.35Å
702	T	81.4	Confident	75.7	Confident	45 Å²	45	52.4 Å²	52.4	28%	0.276	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148.1	-178.4	56.6	0	0	0	0	111.6	G725 K727	T702-G725 WeakPolarHBondContact CB-O 3.3Å; T702-G725 PolarHBondContact OG1-N 3.15Å; T702-G725 PolarHBondContact OG1-O 2.99Å; T702-K727 CarbonylContact C-O 3.48Å; T702-K727 WeakPolarHBondContact CA-O 3.48Å; T702-K727 WeakPolarHBondContact CB-O 3.43Å
703	Y	84.8	Confident	75.9	Confident	29 Å²	29	53.1 Å²	53.1	11%	0.114	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	166.6	177.6	77.9	-81.2	0	0	0	112.7	E650 G725 C726 K727 P728	E650-Y703 HydrophobicContact CB-CD1 4.22Å; E650-Y703 HydrophobicContact CB-CD2 3.64Å; E650-Y703 HydrophobicContact CB-CE1 4.08Å; E650-Y703 HydrophobicContact CB-CE2 3.51Å; E650-Y703 HydrophobicContact CB-CG 3.99Å; E650-Y703 HydrophobicContact CG-CD1 3.61Å; E650-Y703 HydrophobicContact CG-CD2 3.84Å; E650-Y703 HydrophobicContact CG-CE1 3.77Å; E650-Y703 HydrophobicContact CG-CE2 4.03Å; E650-Y703 HydrophobicContact CG-CG 3.62Å; Y703-G725 VanDerWaalsContact C-CA 3.42Å; Y703-G725 CarbonylContact O-C 3.34Å; Y703-G725 WeakPolarHBondContact O-CA 3.24Å; Y703-C726 PolarHBondContact O-N 2.75Å; Y703-K727 HydrophobicContact CD1-CB 4.3Å; Y703-K727 HydrophobicContact CE1-CB 4Å; Y703-K727 PolarHBondContact N-O 3.4Å; Y703-K727 PolarHBondContact O-N 3.5Å; Y703-P728 WeakPolarHBondContact CE1-O 3.23Å
704	H	82.3	Confident	76	Confident	13 Å²	13	58.2 Å²	58.2	6%	0.06	33%	0.332	C	S	.	.			trans	-99.6	122.7	170.7	-69.8	-66.1	0	0	0	110.2	Q664 S706 W713 C715 C716 A723 P724	Q664-H704 PolarHBondContact NE2-O 3.13Å; H704-S706 VanDerWaalsContact C-N 3.27Å; H704-S706 PolarHBondContact O-N 3.48Å; H704-W713 HydrophobicContact CB-CD2 4.06Å; H704-W713 HydrophobicContact CB-CE3 3.56Å; H704-W713 HydrophobicContact CB-CH2 4.13Å; H704-W713 HydrophobicContact CB-CZ3 3.6Å; H704-W713 AromaticContact CD2-CD2 3.76Å; H704-W713 AromaticContact CD2-CE2 3.48Å; H704-W713 VanDerWaalsContact CD2-CE2 3.48Å; H704-W713 AromaticContact CD2-CH2 3.92Å; H704-W713 AromaticContact CD2-CZ2 3.58Å; H704-W713 AromaticContact CD2-NE1 3.94Å; H704-W713 AromaticContact CG-CD2 3.66Å; H704-W713 AromaticContact CG-CE2 3.91Å; H704-W713 AromaticContact CG-CE3 3.71Å; H704-W713 AromaticContact NE2-CE2 3.78Å; H704-W713 AromaticContact NE2-NE1 3.74Å; H704-C715 PolarHBondContact ND1-SG 3Å; H704-C716 VanDerWaalsContact CE1-SG 3.54Å; H704-A723 PolarHBondContact NE2-O 3.16Å; H704-P724 PolarHBondContact CE1-O 2.64Å; H704-P724 PolarHBondContact NE2-O 2.81Å
705	S	81.6	Confident	76.3	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	-80.2	-5.4	-178.5	58.2	0	0	0	0	114.5	L652 D653 K727	L652-S705 WeakPolarHBondContact CA-O 3.47Å; L652-S705 WeakPolarHBondContact CD2-O 3.27Å; D653-S705 PolarHBondContact N-O 2.78Å; D653-S705 PolarHBondContact OD1-OG 2.85Å; D653-S705 WeakPolarHBondContact OD2-CB 3.4Å; D653-S705 PolarHBondContact OD2-OG 3.17Å; S705-K727 VanDerWaalsContact OG-CE 3.24Å; S705-K727 WeakPolarHBondContact OG-CE 3.29Å; S705-K727 PolarHBondContact OG-NZ 3.23Å
706	S	79.2	Confident	76.8	Confident	4 Å²	4	54 Å²	54	3%	0.028	31%	0.314	C	S	.	.	S	Bend	trans	-129	171.2	-179	-73.2	0	0	0	0	112.3	D653 H704 W713	D653-S706 PolarHBondContact OD2-OG 2.85Å; D653-S706 VanDerWaalsContact OD2-OG 3.05Å; H704-S706 VanDerWaalsContact C-N 3.27Å; H704-S706 PolarHBondContact O-N 3.48Å; S706-W713 VanDerWaalsContact O-CE3 3.3Å; S706-W713 VanDerWaalsContact O-CZ3 3.23Å; S706-W713 WeakPolarHBondContact O-CZ3 3.5Å
707	N	77.3	Confident	76.9	Confident	17 Å²	17	61 Å²	61	9%	0.091	34%	0.343	C	S	.	.			trans	-81.4	155.6	-179	74.4	6.7	0	0	0	112.8	A656 F657 T709 Q714	A656-N707 VanDerWaalsContact O-CG 3.22Å; A656-N707 PolarHBondContact O-ND2 3.19Å; F657-N707 HydrophobicContact CE1-CB 4Å; F657-N707 HydrophobicContact CE2-CB 4.21Å; F657-N707 HydrophobicContact CZ-CB 3.67Å; N707-T709 WeakPolarHBondContact ND2-CG2 3.18Å; N707-T709 WeakPolarHBondContact OD1-CG2 3.25Å; N707-T709 PolarHBondContact OD1-OG1 2.92Å; N707-Q714 PolarHBondContact O-N 3.1Å; N707-Q714 VanDerWaalsContact O-N 3.12Å
708	Y	75.3	Confident	77.4	Confident	91 Å²	91	54.6 Å²	54.6	36%	0.357	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113	168.7	-173.9	-95.8	0	0	0	109.4	G711 A712 W713 Q719	Y708-G711 WeakPolarHBondContact OH-CA 3.38Å; Y708-G711 PolarHBondContact OH-O 3.24Å; Y708-G711 VanDerWaalsContact OH-O 3.07Å; Y708-A712 VanDerWaalsContact CD2-C 3.42Å; Y708-W713 AromaticContact CD2-CD1 3.68Å; Y708-W713 AromaticContact CD2-CD2 3.87Å; Y708-W713 HydrophobicContact CD2-CD2 3.87Å; Y708-W713 AromaticContact CD2-CE2 3.8Å; Y708-W713 AromaticContact CD2-CG 3.82Å; Y708-W713 HydrophobicContact CD2-CG 3.82Å; Y708-W713 HydrophobicContact CD2-CZ2 4.47Å; Y708-W713 AromaticContact CD2-NE1 3.66Å; Y708-W713 HydrophobicContact CG-CD2 4.43Å; Y708-Q719 PolarHBondContact OH-O 2.79Å
709	T	71.7	Confident	78	Confident	39 Å²	39	59.8 Å²	59.8	24%	0.239	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	145.7	-177.6	46.4	0	0	0	0	110.8	N707 G711 A712 Q714	N707-T709 WeakPolarHBondContact ND2-CG2 3.18Å; N707-T709 WeakPolarHBondContact OD1-CG2 3.25Å; N707-T709 PolarHBondContact OD1-OG1 2.92Å; T709-G711 PolarHBondContact O-N 2.58Å; T709-A712 PolarHBondContact N-O 2.81Å; T709-A712 PolarHBondContact O-N 2.87Å; T709-A712 VanDerWaalsContact O-N 3.16Å; T709-Q714 WeakPolarHBondContact OG1-CG 3.27Å; T709-Q714 PolarHBondContact OG1-NE2 3.47Å; T709-Q714 VanDerWaalsContact OG1-NE2 3.1Å
710	A	67.8	Low	78	Confident	106 Å²	106	59.4 Å²	59.4	88%	0.876	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	34.3	-179.5	0	0	0	0	0	114.6	A712	A710-A712 VanDerWaalsContact C-N 3.33Å; A710-A712 PolarHBondContact O-N 3.21Å
711	G	74.3	Confident	77.3	Confident	38 Å²	38	58.1 Å²	58.1	39%	0.392	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	11.3	177.7	0	0	0	0	0	114.6	Y708 T709 Q719	Y708-G711 WeakPolarHBondContact OH-CA 3.38Å; Y708-G711 PolarHBondContact OH-O 3.24Å; Y708-G711 VanDerWaalsContact OH-O 3.07Å; T709-G711 PolarHBondContact O-N 2.58Å; G711-Q719 CarbonylContact O-C 3.5Å; G711-Q719 WeakPolarHBondContact O-CA 3.4Å
712	A	78.8	Confident	77.1	Confident	20 Å²	20	58.3 Å²	58.3	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	156.7	174.4	0	0	0	0	0	113.2	Y708 T709 A710 N718 Q719	Y708-A712 VanDerWaalsContact CD2-C 3.42Å; T709-A712 PolarHBondContact N-O 2.81Å; T709-A712 PolarHBondContact O-N 2.87Å; T709-A712 VanDerWaalsContact O-N 3.16Å; A710-A712 VanDerWaalsContact C-N 3.33Å; A710-A712 PolarHBondContact O-N 3.21Å; A712-N718 CarbonylContact C-O 3.56Å; A712-N718 WeakPolarHBondContact CA-O 3.36Å; A712-Q719 HydrophobicContact CB-CG 4.43Å
713	W	78.8	Confident	76.8	Confident	26 Å²	26	56.9 Å²	56.9	10%	0.098	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129	169.2	-72.3	101.5	0	0	0	110.7	H704 S706 Y708 C715 K717 N718 S720 G721	H704-W713 HydrophobicContact CB-CD2 4.06Å; H704-W713 HydrophobicContact CB-CE3 3.56Å; H704-W713 HydrophobicContact CB-CH2 4.13Å; H704-W713 HydrophobicContact CB-CZ3 3.6Å; H704-W713 AromaticContact CD2-CD2 3.76Å; H704-W713 AromaticContact CD2-CE2 3.48Å; H704-W713 VanDerWaalsContact CD2-CE2 3.48Å; H704-W713 AromaticContact CD2-CH2 3.92Å; H704-W713 AromaticContact CD2-CZ2 3.58Å; H704-W713 AromaticContact CD2-NE1 3.94Å; H704-W713 AromaticContact CG-CD2 3.66Å; H704-W713 AromaticContact CG-CE2 3.91Å; H704-W713 AromaticContact CG-CE3 3.71Å; H704-W713 AromaticContact NE2-CE2 3.78Å; H704-W713 AromaticContact NE2-NE1 3.74Å; S706-W713 VanDerWaalsContact O-CE3 3.3Å; S706-W713 VanDerWaalsContact O-CZ3 3.23Å; S706-W713 WeakPolarHBondContact O-CZ3 3.5Å; Y708-W713 AromaticContact CD2-CD1 3.68Å; Y708-W713 AromaticContact CD2-CD2 3.87Å; Y708-W713 HydrophobicContact CD2-CD2 3.87Å; Y708-W713 AromaticContact CD2-CE2 3.8Å; Y708-W713 AromaticContact CD2-CG 3.82Å; Y708-W713 HydrophobicContact CD2-CG 3.82Å; Y708-W713 HydrophobicContact CD2-CZ2 4.47Å; Y708-W713 AromaticContact CD2-NE1 3.66Å; Y708-W713 HydrophobicContact CG-CD2 4.43Å; W713-C715 PolarHBondContact O-N 3.48Å; W713-K717 WeakPolarHBondContact O-CA 3.47Å; W713-K717 PolarHBondContact O-N 3.27Å; W713-N718 PolarHBondContact N-O 3.02Å; W713-S720 VanDerWaalsContact CD1-O 3.32Å; W713-S720 PolarHBondContact NE1-O 2.88Å; W713-G721 WeakPolarHBondContact CZ2-O 3.27Å
714	Q	77	Confident	76.3	Confident	107 Å²	107	60.5 Å²	60.5	50%	0.5	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.3	-180	-65.5	-64.7	-45.8	0	0	113.6	N707 T709	N707-Q714 PolarHBondContact O-N 3.1Å; N707-Q714 VanDerWaalsContact O-N 3.12Å; T709-Q714 WeakPolarHBondContact OG1-CG 3.27Å; T709-Q714 PolarHBondContact OG1-NE2 3.47Å; T709-Q714 VanDerWaalsContact OG1-NE2 3.1Å
715	C	76.2	Confident	76.2	Confident	40 Å²	40	60.7 Å²	60.7	27%	0.27	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-49.2	179.8	47.3	0	0	0	0	113	H704 W713	H704-C715 PolarHBondContact ND1-SG 3Å; W713-C715 PolarHBondContact O-N 3.48Å
716	C	76.3	Confident	76.1	Confident	52 Å²	52	63.5 Å²	63.5	35%	0.351	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-0.1	-174.2	60.5	0	0	0	0	114.1	H704 N718 C726	H704-C716 VanDerWaalsContact CE1-SG 3.54Å; C716-N718 PolarHBondContact O-N 2.96Å; C716-N718 WeakPolarHBondContact SG-CB 3.49Å; C716-C726 HydrophobicContact CB-CB 3.63Å
717	K	79.6	Confident	76.1	Confident	170 Å²	170	66.9 Å²	66.9	74%	0.739	40%	0.402	S	S	*	.			trans	56.8	15.5	-175.4	-57.8	-178.5	-178.5	177.3	0	114.4	W713 Q719	W713-K717 WeakPolarHBondContact O-CA 3.47Å; W713-K717 PolarHBondContact O-N 3.27Å; K717-Q719 PolarHBondContact O-N 3.4Å
718	N	78.2	Confident	76	Confident	72 Å²	72	70.5 Å²	70.5	39%	0.385	43%	0.426	S	S	.	.			trans	-69	131	177.9	-166.8	-30.2	0	0	0	109.9	A712 W713 C716 S720 A723	A712-N718 CarbonylContact C-O 3.56Å; A712-N718 WeakPolarHBondContact CA-O 3.36Å; W713-N718 PolarHBondContact N-O 3.02Å; C716-N718 PolarHBondContact O-N 2.96Å; C716-N718 WeakPolarHBondContact SG-CB 3.49Å; N718-S720 PolarHBondContact OD1-N 3.16Å; N718-S720 VanDerWaalsContact OD1-N 3.08Å; N718-A723 HydrophobicContact CB-CB 4.38Å; N718-A723 VanDerWaalsContact ND2-CB 3.33Å; N718-A723 WeakPolarHBondContact ND2-CB 3.48Å
719	Q	82.5	Confident	76.1	Confident	152 Å²	152	66.9 Å²	66.9	71%	0.71	41%	0.414	S	S	*	.	S	Bend	trans	-81.2	-17.5	-174	-64.2	177.5	1.1	0	0	113	Y708 G711 A712 K717	Y708-Q719 PolarHBondContact OH-O 2.79Å; G711-Q719 CarbonylContact O-C 3.5Å; G711-Q719 WeakPolarHBondContact O-CA 3.4Å; A712-Q719 HydrophobicContact CB-CG 4.43Å; K717-Q719 PolarHBondContact O-N 3.4Å
720	S	77.3	Confident	76.1	Confident	53 Å²	53	69 Å²	69	37%	0.371	43%	0.427	S	S	.	.			trans	-83.6	121.8	177.5	179.8	0	0	0	0	111.8	W713 N718 S722 A723	W713-S720 VanDerWaalsContact CD1-O 3.32Å; W713-S720 PolarHBondContact NE1-O 2.88Å; N718-S720 PolarHBondContact OD1-N 3.16Å; N718-S720 VanDerWaalsContact OD1-N 3.08Å; S720-S722 PolarHBondContact O-N 3.18Å; S720-S722 PolarHBondContact OG-N 3.22Å; S720-S722 PolarHBondContact OG-OG 3.16Å; S720-A723 WeakPolarHBondContact O-CB 3.4Å; S720-A723 PolarHBondContact O-N 2.71Å
721	G	66.9	Low	75.6	Confident	41 Å²	41	68 Å²	68	42%	0.423	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-16.6	175.8	0	0	0	0	0	114.3	W713	W713-G721 WeakPolarHBondContact CZ2-O 3.27Å
722	S	72.9	Confident	74.6	Confident	110 Å²	110	67.4 Å²	67.4	77%	0.769	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	12.7	176.7	66.5	0	0	0	0	113.1	S720	S720-S722 PolarHBondContact O-N 3.18Å; S720-S722 PolarHBondContact OG-N 3.22Å; S720-S722 PolarHBondContact OG-OG 3.16Å
723	A	74	Confident	73.1	Confident	14 Å²	14	70.1 Å²	70.1	12%	0.116	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-61.3	143.7	178.9	0	0	0	0	0	111.8	H704 N718 S720	H704-A723 PolarHBondContact NE2-O 3.16Å; N718-A723 HydrophobicContact CB-CB 4.38Å; N718-A723 VanDerWaalsContact ND2-CB 3.33Å; N718-A723 WeakPolarHBondContact ND2-CB 3.48Å; S720-A723 WeakPolarHBondContact O-CB 3.4Å; S720-A723 PolarHBondContact O-N 2.71Å
724	P	75.1	Confident	71.4	Confident	106 Å²	106	73.7 Å²	73.7	69%	0.688	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-58.3	153.1	171.4	27	-34.1	0	0	0	110.5	H704	H704-P724 PolarHBondContact CE1-O 2.64Å; H704-P724 PolarHBondContact NE2-O 2.81Å
725	G	79	Confident	69.6	Low	17 Å²	17	69.3 Å²	69.3	18%	0.175	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-59.3	153	-175.8	0	0	0	0	0	113.3	T702 Y703	T702-G725 WeakPolarHBondContact CB-O 3.3Å; T702-G725 PolarHBondContact OG1-N 3.15Å; T702-G725 PolarHBondContact OG1-O 2.99Å; Y703-G725 VanDerWaalsContact C-CA 3.42Å; Y703-G725 CarbonylContact O-C 3.34Å; Y703-G725 WeakPolarHBondContact O-CA 3.24Å
726	C	80	Confident	68	Low	58 Å²	58	71 Å²	71	39%	0.392	41%	0.414	S	S	.	.	S	Bend	trans	-96.8	-10.8	179.6	67.3	0	0	0	0	114.3	Y703 C716	Y703-C726 PolarHBondContact O-N 2.75Å; C716-C726 HydrophobicContact CB-CB 3.63Å
727	K	78.5	Confident	66.5	Low	76 Å²	76	73 Å²	73	33%	0.33	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.9	177	-69.5	-172	-176.2	172.4	0	110	D653 T702 Y703 S705	D653-K727 IonicContact OD1-NZ 2.55Å; D653-K727 PolarHBondContact OD1-NZ 3.3Å; D653-K727 VanDerWaalsContact OD1-NZ 3.12Å; D653-K727 IonicContact OD2-NZ 3.68Å; T702-K727 CarbonylContact C-O 3.48Å; T702-K727 WeakPolarHBondContact CA-O 3.48Å; T702-K727 WeakPolarHBondContact CB-O 3.43Å; Y703-K727 HydrophobicContact CD1-CB 4.3Å; Y703-K727 HydrophobicContact CE1-CB 4Å; Y703-K727 PolarHBondContact N-O 3.4Å; Y703-K727 PolarHBondContact O-N 3.5Å; S705-K727 VanDerWaalsContact OG-CE 3.24Å; S705-K727 WeakPolarHBondContact OG-CE 3.29Å; S705-K727 PolarHBondContact OG-NZ 3.23Å
728	P	76.6	Confident	65	Low	93 Å²	93	72.2 Å²	72.2	60%	0.604	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	143.1	174.6	29.1	-34.3	0	0	0	110.7	T701 Y703	T701-P728 CarbonylContact O-C 3.18Å; T701-P728 WeakPolarHBondContact O-CA 3.35Å; Y703-P728 WeakPolarHBondContact CE1-O 3.23Å
729	C	77.7	Confident	63.9	Low	14 Å²	14	70.3 Å²	70.3	10%	0.095	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-70.2	148.7	174.2	-77.8	0	0	0	0	111.6	E650 L700 T701 I731	E650-C729 VanDerWaalsContact OE1-CA 3.23Å; E650-C729 WeakPolarHBondContact OE1-CA 3.45Å; E650-C729 VanDerWaalsContact OE1-CB 3.27Å; E650-C729 WeakPolarHBondContact OE1-CB 3.46Å; L700-C729 WeakPolarHBondContact O-CB 3.42Å; L700-C729 PolarHBondContact O-SG 3.5Å; L700-C729 VanDerWaalsContact O-SG 3.37Å; T701-C729 PolarHBondContact O-N 3.35Å; C729-I731 PolarHBondContact O-N 3.19Å
730	T	71.1	Confident	63	Low	83 Å²	83	67 Å²	67	51%	0.509	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-68.8	118.9	176.3	-51.6	0	0	0	0	109.1	E650 R699 T732	E650-T730 PolarHBondContact OE1-N 3.26Å; E650-T730 WeakPolarHBondContact OE2-CB 3.22Å; E650-T730 PolarHBondContact OE2-N 2.96Å; E650-T730 PolarHBondContact OE2-OG1 3.36Å; R699-T730 PolarHBondContact NH2-O 2.99Å; T730-T732 PolarHBondContact O-N 3.09Å
731	I	57.5	Low	62.7	Low	87 Å²	87	64.5 Å²	64.5	45%	0.446	38%	0.379	S	S	.	.			trans	-78.2	112.1	173.3	-57.3	175	0	0	0	107.7	C729 M733	C729-I731 PolarHBondContact O-N 3.19Å; I731-M733 PolarHBondContact O-N 3.18Å
732	T	53.5	Low	63.2	Low	25 Å²	25	64.5 Å²	64.5	15%	0.153	37%	0.369	C	S	.	.			trans	-77.1	117.5	172.6	-38.5	0	0	0	0	108.1	Q691 R694 R699 T730	Q691-T732 HydrophobicContact CG-CG2 3.83Å; R694-T732 WeakPolarHBondContact CD-O 3.49Å; R694-T732 PolarHBondContact NE-O 3.01Å; R699-T732 PolarHBondContact NH2-OG1 3.48Å; T730-T732 PolarHBondContact O-N 3.09Å
733	M	47.4	Very low	63.5	Low	76 Å²	76	60.1 Å²	60.1	37%	0.374	34%	0.338	S	S	.	.			trans	-69.6	171.5	179.4	-84.1	-147.2	162.5	0	0	113	I731 A735	I731-M733 PolarHBondContact O-N 3.18Å; M733-A735 VanDerWaalsContact C-N 3.28Å; M733-A735 PolarHBondContact O-N 3.02Å
734	L	43	Very low	64	Low	101 Å²	101	60.3 Å²	60.3	53%	0.529	34%	0.337	S	S	.	.			trans	-62.9	65.9	-168.1	-73.5	150.7	0	0	0	115.1	Y359 N736	Y359-L734 WeakPolarHBondContact CE2-O 3.49Å; Y359-L734 WeakPolarHBondContact OH-CB 3.5Å; L734-N736 PolarHBondContact O-N 3.47Å
735	A	39.2	Very low	64.5	Low	15 Å²	15	57.1 Å²	57.1	12%	0.124	31%	0.312	C	S	.	.			trans	-76.2	118.8	156.1	0	0	0	0	0	108.4	Q691 M733 L737	Q691-A735 HydrophobicContact CG-CB 4.23Å; M733-A735 VanDerWaalsContact C-N 3.28Å; M733-A735 PolarHBondContact O-N 3.02Å; A735-L737 PolarHBondContact O-N 3.46Å
736	N	42.2	Very low	65	Low	77 Å²	77	56.8 Å²	56.8	41%	0.412	31%	0.305	S	S	.	.			trans	-58.4	122.1	159.7	-176.1	-14.2	0	0	0	106.5	L734 Q738 L739 D740	L734-N736 PolarHBondContact O-N 3.47Å; N736-Q738 PolarHBondContact O-N 3.42Å; N736-Q738 PolarHBondContact OD1-N 3.32Å; N736-L739 PolarHBondContact O-N 3.35Å; N736-D740 PolarHBondContact O-N 2.95Å
737	L	44.2	Very low	65.4	Low	93 Å²	93	54 Å²	54	49%	0.487	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-19.3	-178	-84.5	158.4	0	0	0	113.5	Q691 V692 A735	Q691-L737 HydrophobicContact CB-CD2 4.36Å; V692-L737 HydrophobicContact CB-CD2 4.49Å; V692-L737 HydrophobicContact CG1-CD2 4.13Å; A735-L737 PolarHBondContact O-N 3.46Å
738	Q	48.1	Very low	66	Low	153 Å²	153	50.6 Å²	50.6	72%	0.715	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-26.9	175.1	-95.3	-179.5	-13.8	0	0	115.6	N736	N736-Q738 PolarHBondContact O-N 3.42Å; N736-Q738 PolarHBondContact OD1-N 3.32Å
739	L	56	Low	66.5	Low	32 Å²	32	48.6 Å²	48.6	17%	0.168	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	-18.4	-168	-65.3	174.9	0	0	0	115.3	L358 I401 V402 N736 I741	L358-L739 HydrophobicContact CB-CD1 4.35Å; I401-L739 HydrophobicContact CG2-CD2 3.75Å; V402-L739 HydrophobicContact CG2-CD2 4.02Å; N736-L739 PolarHBondContact O-N 3.35Å; L739-I741 HydrophobicContact CB-CD1 3.8Å; L739-I741 HydrophobicContact CB-CG1 4.08Å; L739-I741 HydrophobicContact CD1-CD1 4.38Å; L739-I741 WeakPolarHBondContact O-CG1 3.36Å
740	D	62.1	Low	67.2	Low	82 Å²	82	48 Å²	48	44%	0.439	25%	0.248	S	C	.	.			trans	50.8	59.2	177.2	-165.2	20.5	0	0	0	113.5	Q691 N736	Q691-D740 PolarHBondContact NE2-OD1 3.09Å; N736-D740 PolarHBondContact O-N 2.95Å
741	I	72.1	Confident	68.1	Low	2 Å²	2	44.3 Å²	44.3	1%	0.01	23%	0.225	C	C	.	.			trans	-121.7	126.9	-175.7	-61	171.2	0	0	0	109.8	R355 L358 L739 E746	R355-I741 HydrophobicContact CB-CD1 3.92Å; R355-I741 HydrophobicContact CB-CG1 4.22Å; R355-I741 HydrophobicContact CB-CG2 3.84Å; R355-I741 HydrophobicContact CG-CD1 4.08Å; R355-I741 HydrophobicContact CG-CG1 4.22Å; R355-I741 WeakPolarHBondContact O-CD1 3.43Å; L358-I741 HydrophobicContact CB-CD1 4.38Å; L739-I741 HydrophobicContact CB-CD1 3.8Å; L739-I741 HydrophobicContact CB-CG1 4.08Å; L739-I741 HydrophobicContact CD1-CD1 4.38Å; L739-I741 WeakPolarHBondContact O-CG1 3.36Å; I741-E746 HydrophobicContact CG2-CG 4.04Å
742	D	77	Confident	69.6	Low	40 Å²	40	41.6 Å²	41.6	21%	0.214	21%	0.214	C	C	.	.			trans	-98.4	99.8	171.9	-177.4	-20.3	0	0	0	110	R23 D744 R745 E746	R23-D742 IonicContact CZ-OD1 3.75Å; R23-D742 IonicContact CZ-OD2 3.39Å; R23-D742 IonicContact NH1-OD1 3.78Å; R23-D742 IonicContact NH1-OD2 3.72Å; R23-D742 PolarHBondContact NH1-OD2 3.44Å; R23-D742 IonicContact NH2-OD1 3.44Å; R23-D742 PolarHBondContact NH2-OD1 3.12Å; R23-D742 IonicContact NH2-OD2 3.46Å; R23-D742 PolarHBondContact NH2-OD2 3.34Å; R23-D742 VanDerWaalsContact NH2-OD2 3.13Å; D742-D744 VanDerWaalsContact C-N 3.32Å; D742-D744 PolarHBondContact O-N 3.49Å; D742-D744 PolarHBondContact OD1-N 3.01Å; D742-R745 HydrophobicContact CB-CB 3.93Å; D742-R745 PolarHBondContact O-N 3.22Å; D742-R745 PolarHBondContact OD1-N 3.08Å; D742-E746 WeakPolarHBondContact O-CG 3.5Å; D742-E746 PolarHBondContact O-N 3.38Å
743	C	79.9	Confident	71.2	Confident	18 Å²	18	40.9 Å²	40.9	12%	0.122	21%	0.209	C	C	.	.	H	α-helix	trans	-58.8	-39.7	-174.4	-68.7	0	0	0	0	114.3	L356 Y359 R745 E746 A747	L356-C743 HydrophobicContact CD1-CB 4.3Å; Y359-C743 WeakPolarHBondContact CD1-SG 3.36Å; Y359-C743 VanDerWaalsContact CD2-SG 3.53Å; Y359-C743 WeakPolarHBondContact CE1-SG 3.34Å; C743-R745 VanDerWaalsContact C-N 3.32Å; C743-E746 PolarHBondContact O-N 3.06Å; C743-A747 WeakPolarHBondContact O-CB 3.25Å; C743-A747 PolarHBondContact O-N 2.79Å
744	D	84.6	Confident	73.1	Confident	19 Å²	19	37.3 Å²	37.3	10%	0.102	19%	0.191	C	C	.	.	H	α-helix	trans	-69.2	-38.3	-177.5	-60.7	-29.1	0	0	0	110.2	R23 V309 S312 Y315 D742 A747 E748	R23-D744 IonicContact NH2-OD2 2.67Å; V309-D744 HydrophobicContact CG1-CB 3.5Å; V309-D744 VanDerWaalsContact CG1-CB 3.5Å; S312-D744 WeakPolarHBondContact CA-OD1 3.28Å; S312-D744 WeakPolarHBondContact CB-OD1 3.2Å; S312-D744 VanDerWaalsContact OG-CG 3.28Å; S312-D744 PolarHBondContact OG-OD1 2.84Å; S312-D744 PolarHBondContact OG-OD2 2.97Å; Y315-D744 HydrophobicContact CD2-CB 4.01Å; Y315-D744 HydrophobicContact CE2-CB 4.16Å; D742-D744 VanDerWaalsContact C-N 3.32Å; D742-D744 PolarHBondContact O-N 3.49Å; D742-D744 PolarHBondContact OD1-N 3.01Å; D744-A747 PolarHBondContact O-N 3.1Å; D744-E748 WeakPolarHBondContact O-CB 3.48Å; D744-E748 PolarHBondContact O-N 2.87Å
745	R	85.4	Confident	75.2	Confident	38 Å²	38	34.3 Å²	34.3	14%	0.143	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-43.6	172.8	-174.3	-172.5	-173.4	172.5	-4.9	112.1	L25 E84 D307 V309 D742 C743 A747 E748 R749	L25-R745 HydrophobicContact CD1-CB 4.12Å; L25-R745 HydrophobicContact CD1-CG 3.87Å; E84-R745 IonicContact OE1-CZ 3.4Å; E84-R745 IonicContact OE1-NH1 3.12Å; E84-R745 PolarHBondContact OE1-NH1 2.94Å; E84-R745 IonicContact OE1-NH2 3.55Å; E84-R745 PolarHBondContact OE1-NH2 3.31Å; E84-R745 IonicContact OE2-NH1 3.34Å; D307-R745 IonicContact OD2-NE 3.25Å; V309-R745 HydrophobicContact CG2-CB 4.17Å; V309-R745 HydrophobicContact CG2-CG 4.33Å; D742-R745 HydrophobicContact CB-CB 3.93Å; D742-R745 PolarHBondContact O-N 3.22Å; D742-R745 PolarHBondContact OD1-N 3.08Å; C743-R745 VanDerWaalsContact C-N 3.32Å; R745-A747 VanDerWaalsContact C-N 3.29Å; R745-A747 PolarHBondContact O-N 3.27Å; R745-E748 PolarHBondContact O-N 3.24Å; R745-R749 WeakPolarHBondContact O-CB 3.17Å; R745-R749 PolarHBondContact O-N 3.01Å
746	E	87.9	Confident	77.4	Confident	10 Å²	10	38.2 Å²	38.2	5%	0.047	21%	0.205	C	C	.	.	H	α-helix	trans	-64.3	-37.4	177.3	-60.1	-51.7	159.5	0	0	111.3	P352 R355 I741 D742 C743 R749 I750	P352-E746 WeakPolarHBondContact CA-OE2 3.33Å; P352-E746 HydrophobicContact CB-CB 4.3Å; P352-E746 VanDerWaalsContact CB-OE2 3.24Å; P352-E746 WeakPolarHBondContact CB-OE2 3.5Å; R355-E746 HydrophobicContact CB-CG 3.94Å; R355-E746 VanDerWaalsContact CD-CD 3.46Å; R355-E746 WeakPolarHBondContact CD-OE1 3.39Å; R355-E746 IonicContact CZ-OE1 3.16Å; R355-E746 IonicContact NE-OE1 2.81Å; R355-E746 IonicContact NH1-OE1 2.64Å; R355-E746 PolarHBondContact NH1-OE1 2.86Å; I741-E746 HydrophobicContact CG2-CG 4.04Å; D742-E746 WeakPolarHBondContact O-CG 3.5Å; D742-E746 PolarHBondContact O-N 3.38Å; C743-E746 PolarHBondContact O-N 3.06Å; E746-R749 PolarHBondContact O-N 3.44Å; E746-I750 VanDerWaalsContact O-CG1 3.28Å; E746-I750 WeakPolarHBondContact O-CG1 3.39Å; E746-I750 PolarHBondContact O-N 2.84Å
747	A	89.1	Confident	79.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.4	-44.4	174.7	0	0	0	0	0	112.3	Y315 C743 D744 R745 R749 I750 F751	Y315-A747 HydrophobicContact CD1-CB 3.79Å; Y315-A747 HydrophobicContact CD2-CB 4.43Å; Y315-A747 HydrophobicContact CG-CB 3.73Å; C743-A747 WeakPolarHBondContact O-CB 3.25Å; C743-A747 PolarHBondContact O-N 2.79Å; D744-A747 PolarHBondContact O-N 3.1Å; R745-A747 VanDerWaalsContact C-N 3.29Å; R745-A747 PolarHBondContact O-N 3.27Å; A747-R749 VanDerWaalsContact C-N 3.26Å; A747-R749 PolarHBondContact O-N 3.05Å; A747-I750 PolarHBondContact O-N 2.95Å; A747-F751 WeakPolarHBondContact O-CB 3.36Å; A747-F751 PolarHBondContact O-N 3.14Å
748	E	90.4	Very high	81.4	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.019	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-39.4	173	180	51	-151.4	0	0	111.3	D307 T308 V309 Y315 D744 R745 F751 S752 H813	D307-E748 HydrophobicContact CB-CG 4.15Å; T308-E748 VanDerWaalsContact O-CD 3.28Å; V309-E748 HydrophobicContact CG2-CB 4.19Å; V309-E748 HydrophobicContact CG2-CG 4.28Å; Y315-E748 HydrophobicContact CE1-CB 4.03Å; Y315-E748 VanDerWaalsContact CE1-OE2 3.3Å; Y315-E748 WeakPolarHBondContact CE1-OE2 3.31Å; Y315-E748 VanDerWaalsContact CZ-OE2 3.3Å; Y315-E748 WeakPolarHBondContact OH-CB 3.42Å; Y315-E748 PolarHBondContact OH-OE2 2.71Å; D744-E748 WeakPolarHBondContact O-CB 3.48Å; D744-E748 PolarHBondContact O-N 2.87Å; R745-E748 PolarHBondContact O-N 3.24Å; E748-F751 WeakPolarHBondContact O-CB 3.41Å; E748-F751 PolarHBondContact O-N 3.28Å; E748-S752 WeakPolarHBondContact O-CB 3.25Å; E748-S752 PolarHBondContact O-N 3.33Å; E748-S752 PolarHBondContact O-OG 3.2Å; E748-S752 PolarHBondContact OE1-OG 3.03Å; E748-H813 IonicContact OE1-CE1 3.61Å; E748-H813 PolarHBondContact OE1-CE1 3.03Å; E748-H813 IonicContact OE1-NE2 2.64Å; E748-H813 PolarHBondContact OE1-NE2 2.91Å; E748-H813 IonicContact OE2-CE1 2.71Å; E748-H813 IonicContact OE2-NE2 2.83Å; E748-H813 PolarHBondContact OE2-NE2 3.29Å
749	R	89	Confident	83.2	Confident	52 Å²	52	33.2 Å²	33.2	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-43.4	177.8	-170.5	67.9	-169.7	156.3	5.2	111.8	D307 P352 R745 E746 A747 F751 L753	D307-R749 IonicContact OD1-NH1 3.1Å; D307-R749 PolarHBondContact OD1-NH1 3.05Å; P352-R749 HydrophobicContact CB-CB 4.43Å; P352-R749 HydrophobicContact CB-CG 4.43Å; P352-R749 HydrophobicContact CG-CB 4.28Å; P352-R749 HydrophobicContact CG-CG 3.75Å; R745-R749 WeakPolarHBondContact O-CB 3.17Å; R745-R749 PolarHBondContact O-N 3.01Å; E746-R749 PolarHBondContact O-N 3.44Å; A747-R749 VanDerWaalsContact C-N 3.26Å; A747-R749 PolarHBondContact O-N 3.05Å; R749-F751 VanDerWaalsContact C-N 3.34Å; R749-L753 HydrophobicContact CG-CD1 4.33Å; R749-L753 WeakPolarHBondContact O-CB 3.34Å; R749-L753 VanDerWaalsContact O-CG 3.23Å; R749-L753 WeakPolarHBondContact O-CG 3.45Å; R749-L753 PolarHBondContact O-N 3.34Å
750	I	90.4	Very high	84.5	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-44.8	175.1	-67.9	167.3	0	0	0	110.1	L318 L322 L339 P352 L356 E746 A747 L753 L754	L318-I750 HydrophobicContact CD2-CG2 4.43Å; L322-I750 HydrophobicContact CD1-CD1 3.73Å; L322-I750 HydrophobicContact CD1-CG2 4.26Å; L339-I750 HydrophobicContact CD1-CG2 3.78Å; L339-I750 HydrophobicContact CD2-CG2 4.21Å; P352-I750 HydrophobicContact CB-CD1 4.2Å; P352-I750 HydrophobicContact CB-CG1 3.8Å; L356-I750 HydrophobicContact CD2-CD1 4.38Å; E746-I750 VanDerWaalsContact O-CG1 3.28Å; E746-I750 WeakPolarHBondContact O-CG1 3.39Å; E746-I750 PolarHBondContact O-N 2.84Å; A747-I750 PolarHBondContact O-N 2.95Å; I750-L753 PolarHBondContact O-N 3.12Å; I750-L754 HydrophobicContact CG2-CD1 3.95Å; I750-L754 HydrophobicContact CG2-CG 4.49Å; I750-L754 WeakPolarHBondContact O-CB 3.02Å; I750-L754 WeakPolarHBondContact O-CG 3.39Å; I750-L754 PolarHBondContact O-N 2.94Å
751	F	91.4	Very high	85.6	Confident	7 Å²	7	31.1 Å²	31.1	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-53.6	175.7	170	-104.3	0	0	0	111.9	L318 A747 E748 R749 L753 L754 S755 L809 Q810 H813	L318-F751 HydrophobicContact CD2-CB 4.23Å; A747-F751 WeakPolarHBondContact O-CB 3.36Å; A747-F751 PolarHBondContact O-N 3.14Å; E748-F751 WeakPolarHBondContact O-CB 3.41Å; E748-F751 PolarHBondContact O-N 3.28Å; R749-F751 VanDerWaalsContact C-N 3.34Å; F751-L753 VanDerWaalsContact C-N 3.3Å; F751-L753 PolarHBondContact O-N 2.87Å; F751-L754 WeakPolarHBondContact O-CB 3.36Å; F751-L754 PolarHBondContact O-N 3.47Å; F751-L754 VanDerWaalsContact O-N 3.15Å; F751-S755 WeakPolarHBondContact CE2-OG 3.26Å; F751-S755 PolarHBondContact O-N 2.86Å; F751-S755 PolarHBondContact O-OG 3.31Å; F751-S755 VanDerWaalsContact O-OG 3.09Å; F751-L809 HydrophobicContact CD2-CB 3.84Å; F751-L809 HydrophobicContact CD2-CD1 3.84Å; F751-L809 HydrophobicContact CE2-CB 3.56Å; F751-L809 HydrophobicContact CE2-CD1 4.43Å; F751-L809 HydrophobicContact CG-CD1 4.33Å; F751-L809 HydrophobicContact CZ-CB 4.12Å; F751-Q810 HydrophobicContact CE2-CB 4.47Å; F751-Q810 HydrophobicContact CZ-CB 4.14Å; F751-H813 AromaticContact CD1-NE2 3.84Å; F751-H813 AromaticContact CE1-CD2 3.38Å; F751-H813 WeakPolarHBondContact CE1-CD2 3.49Å; F751-H813 AromaticContact CE1-NE2 3.55Å; F751-H813 AromaticContact CZ-CD2 3.92Å
752	S	88.4	Confident	86.3	Confident	29 Å²	29	33.7 Å²	33.7	20%	0.203	19%	0.185	C	C	.	.	H	α-helix	trans	-56.7	-40.7	178.5	-81.6	0	0	0	0	112.9	E748 S756	E748-S752 WeakPolarHBondContact O-CB 3.25Å; E748-S752 PolarHBondContact O-N 3.33Å; E748-S752 PolarHBondContact O-OG 3.2Å; E748-S752 PolarHBondContact OE1-OG 3.03Å; S752-S756 WeakPolarHBondContact O-CB 3.5Å; S752-S756 PolarHBondContact O-N 3.46Å; S752-S756 PolarHBondContact O-OG 3.28Å
753	L	87.4	Confident	86.7	Confident	10 Å²	10	36.2 Å²	36.2	5%	0.052	20%	0.198	C	C	.	.	H	α-helix	trans	-65.8	-46	176.6	-75.1	171.9	0	0	0	111.8	F343 E348 A349 R749 I750 F751 S756 N757	F343-L753 HydrophobicContact CE1-CB 4.06Å; F343-L753 HydrophobicContact CE1-CD2 4.42Å; F343-L753 HydrophobicContact CE2-CB 4.41Å; F343-L753 HydrophobicContact CZ-CB 3.76Å; F343-L753 WeakPolarHBondContact CZ-O 3.25Å; E348-L753 HydrophobicContact CB-CD1 4.39Å; E348-L753 HydrophobicContact CB-CD2 4.2Å; A349-L753 HydrophobicContact CB-CD1 3.98Å; R749-L753 HydrophobicContact CG-CD1 4.33Å; R749-L753 WeakPolarHBondContact O-CB 3.34Å; R749-L753 VanDerWaalsContact O-CG 3.23Å; R749-L753 WeakPolarHBondContact O-CG 3.45Å; R749-L753 PolarHBondContact O-N 3.34Å; I750-L753 PolarHBondContact O-N 3.12Å; F751-L753 VanDerWaalsContact C-N 3.3Å; F751-L753 PolarHBondContact O-N 2.87Å; L753-S756 PolarHBondContact O-N 3.1Å; L753-N757 PolarHBondContact O-N 2.92Å; L753-N757 PolarHBondContact O-ND2 3.2Å
754	L	87.8	Confident	87	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-61.7	-48.3	177.2	-82.5	171.6	0	0	0	111.5	L339 F343 I750 F751 S756 N757 E758 L802 M806	L339-L754 HydrophobicContact CD2-CD1 3.9Å; L339-L754 HydrophobicContact CD2-CD2 3.45Å; L339-L754 VanDerWaalsContact CD2-CD2 3.45Å; L339-L754 HydrophobicContact CD2-CG 3.63Å; F343-L754 HydrophobicContact CE2-CD2 4.38Å; I750-L754 HydrophobicContact CG2-CD1 3.95Å; I750-L754 HydrophobicContact CG2-CG 4.49Å; I750-L754 WeakPolarHBondContact O-CB 3.02Å; I750-L754 WeakPolarHBondContact O-CG 3.39Å; I750-L754 PolarHBondContact O-N 2.94Å; F751-L754 WeakPolarHBondContact O-CB 3.36Å; F751-L754 PolarHBondContact O-N 3.47Å; F751-L754 VanDerWaalsContact O-N 3.15Å; L754-S756 VanDerWaalsContact C-N 3.28Å; L754-S756 PolarHBondContact O-N 3.06Å; L754-N757 CarbonylContact O-C 3.51Å; L754-N757 PolarHBondContact O-N 3.26Å; L754-E758 PolarHBondContact O-N 3.4Å; L754-E758 VanDerWaalsContact O-N 3.14Å; L754-L802 HydrophobicContact CD1-CD1 3.99Å; L754-L802 HydrophobicContact CD1-CD2 4.25Å; L754-L802 HydrophobicContact CD1-CG 4.33Å; L754-L802 HydrophobicContact CD2-CD2 4.1Å; L754-M806 HydrophobicContact CB-CE 3.54Å; L754-M806 HydrophobicContact CB-SD 3.72Å; L754-M806 HydrophobicContact CD1-CG 4.34Å; L754-M806 HydrophobicContact CD1-SD 3.87Å; L754-M806 HydrophobicContact CD2-SD 4.3Å; L754-M806 HydrophobicContact CG-SD 4.2Å
755	S	87.4	Confident	87	Confident	37 Å²	37	35.4 Å²	35.4	26%	0.259	19%	0.192	S	C	.	.	H	α-helix	trans	-61.5	-36.7	178.5	-58.8	0	0	0	0	111.9	F751 N757	F751-S755 WeakPolarHBondContact CE2-OG 3.26Å; F751-S755 PolarHBondContact O-N 2.86Å; F751-S755 PolarHBondContact O-OG 3.31Å; F751-S755 VanDerWaalsContact O-OG 3.09Å; S755-N757 PolarHBondContact O-N 3.47Å
756	S	84.7	Confident	86.9	Confident	97 Å²	97	37.4 Å²	37.4	68%	0.678	21%	0.205	S	C	*	.	H	α-helix	trans	-69.1	-17	175.6	-58.8	0	0	0	0	113.9	S752 L753 L754	S752-S756 WeakPolarHBondContact O-CB 3.5Å; S752-S756 PolarHBondContact O-N 3.46Å; S752-S756 PolarHBondContact O-OG 3.28Å; L753-S756 PolarHBondContact O-N 3.1Å; L754-S756 VanDerWaalsContact C-N 3.28Å; L754-S756 PolarHBondContact O-N 3.06Å
757	N	84.9	Confident	86.7	Confident	41 Å²	41	36.9 Å²	36.9	22%	0.219	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	28.8	-175.2	-68.9	-94.8	0	0	0	112.4	F343 L753 L754 S755 S759 K760 L761	F343-N757 HydrophobicContact CE1-CB 4.24Å; F343-N757 WeakPolarHBondContact CE1-ND2 3.42Å; F343-N757 HydrophobicContact CZ-CB 4.17Å; L753-N757 PolarHBondContact O-N 2.92Å; L753-N757 PolarHBondContact O-ND2 3.2Å; L754-N757 CarbonylContact O-C 3.51Å; L754-N757 PolarHBondContact O-N 3.26Å; S755-N757 PolarHBondContact O-N 3.47Å; N757-S759 PolarHBondContact O-N 2.96Å; N757-S759 VanDerWaalsContact O-N 3.15Å; N757-K760 PolarHBondContact O-N 3.01Å; N757-L761 PolarHBondContact O-N 3.26Å
758	E	84.9	Confident	86.4	Confident	97 Å²	97	36.9 Å²	36.9	45%	0.453	20%	0.203	S	C	.	.	H	α-helix	trans	-54.8	-34.9	-178.3	-170	-179.5	-179.8	0	0	112.7	L754 K760 L761 Q762 R803	L754-E758 PolarHBondContact O-N 3.4Å; L754-E758 VanDerWaalsContact O-N 3.14Å; E758-K760 VanDerWaalsContact C-N 3.32Å; E758-K760 PolarHBondContact O-N 3.3Å; E758-L761 WeakPolarHBondContact O-CB 3.15Å; E758-L761 PolarHBondContact O-N 2.89Å; E758-L761 VanDerWaalsContact O-N 3.12Å; E758-Q762 PolarHBondContact O-N 2.86Å; E758-R803 IonicContact OE1-NH2 2.91Å
759	S	85.8	Confident	85.9	Confident	80 Å²	80	38.5 Å²	38.5	56%	0.559	22%	0.217	S	C	*	.	H	α-helix	trans	-60.4	-37.1	176.5	59.4	0	0	0	0	113.5	N757 Q762 N763	N757-S759 PolarHBondContact O-N 2.96Å; N757-S759 VanDerWaalsContact O-N 3.15Å; S759-Q762 PolarHBondContact O-N 3.19Å; S759-N763 PolarHBondContact O-N 3.31Å; S759-N763 PolarHBondContact O-OD1 3.44Å
760	K	84.7	Confident	85.4	Confident	70 Å²	70	37.4 Å²	37.4	30%	0.304	22%	0.217	S	C	.	.	H	α-helix	trans	-70.5	-35	176.3	-70.4	-175.7	174.8	-177.9	0	111.7	I342 N757 E758 N763 M764	I342-K760 HydrophobicContact CG2-CB 4.09Å; I342-K760 HydrophobicContact CG2-CD 4.33Å; N757-K760 PolarHBondContact O-N 3.01Å; E758-K760 VanDerWaalsContact C-N 3.32Å; E758-K760 PolarHBondContact O-N 3.3Å; K760-N763 PolarHBondContact O-N 2.92Å; K760-M764 PolarHBondContact O-N 2.85Å; K760-M764 VanDerWaalsContact O-N 3.13Å
761	L	85.4	Confident	84.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-44.3	175.4	-170.6	70.5	0	0	0	110.4	I342 N757 E758 M764 E765 L799 L802 R803 M806	I342-L761 HydrophobicContact CD1-CB 4.44Å; I342-L761 HydrophobicContact CD1-CD1 3.47Å; I342-L761 VanDerWaalsContact CD1-CD1 3.47Å; N757-L761 PolarHBondContact O-N 3.26Å; E758-L761 WeakPolarHBondContact O-CB 3.15Å; E758-L761 PolarHBondContact O-N 2.89Å; E758-L761 VanDerWaalsContact O-N 3.12Å; L761-M764 PolarHBondContact O-N 3.08Å; L761-E765 PolarHBondContact O-N 2.81Å; L761-L799 HydrophobicContact CD1-CD2 3.37Å; L761-L799 HydrophobicContact CG-CD2 4.28Å; L761-L802 HydrophobicContact CD1-CD2 4.01Å; L761-R803 HydrophobicContact CD2-CG 3.66Å; L761-R803 HydrophobicContact CG-CG 4.46Å; L761-M806 HydrophobicContact CD2-SD 3.91Å
762	Q	85.9	Confident	83.7	Confident	56 Å²	56	43.9 Å²	43.9	26%	0.262	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-46.2	174.8	-172.5	62.9	60.6	0	0	111.7	E758 S759 M764 E765 D766 R803	E758-Q762 PolarHBondContact O-N 2.86Å; S759-Q762 PolarHBondContact O-N 3.19Å; Q762-M764 VanDerWaalsContact C-N 3.25Å; Q762-M764 PolarHBondContact O-N 2.99Å; Q762-E765 WeakPolarHBondContact O-CA 3.45Å; Q762-E765 WeakPolarHBondContact O-CB 3.27Å; Q762-E765 PolarHBondContact O-N 2.85Å; Q762-D766 PolarHBondContact NE2-OD1 2.78Å; Q762-D766 VanDerWaalsContact O-CG 3.26Å; Q762-D766 PolarHBondContact O-N 2.8Å; Q762-R803 VanDerWaalsContact OE1-CZ 3.27Å
763	N	86.1	Confident	82.7	Confident	92 Å²	92	47.7 Å²	47.7	49%	0.492	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-36.2	178	-67.4	-7.3	0	0	0	112.6	S759 K760 A767	S759-N763 PolarHBondContact O-N 3.31Å; S759-N763 PolarHBondContact O-OD1 3.44Å; K760-N763 PolarHBondContact O-N 2.92Å; N763-A767 WeakPolarHBondContact O-CB 3.4Å; N763-A767 PolarHBondContact O-N 2.86Å
764	M	84.5	Confident	81.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-71.5	-36.2	175.9	-168.7	176.4	179.4	0	0	111.9	I338 I342 K760 L761 Q762 A767 C768 F787 I789 T795 L799	I338-M764 HydrophobicContact CG1-CE 3.99Å; I338-M764 HydrophobicContact CG2-CE 4.44Å; I338-M764 HydrophobicContact CG2-SD 3.96Å; I342-M764 HydrophobicContact CG1-SD 4.42Å; K760-M764 PolarHBondContact O-N 2.85Å; K760-M764 VanDerWaalsContact O-N 3.13Å; L761-M764 PolarHBondContact O-N 3.08Å; Q762-M764 VanDerWaalsContact C-N 3.25Å; Q762-M764 PolarHBondContact O-N 2.99Å; M764-A767 PolarHBondContact O-N 2.88Å; M764-C768 PolarHBondContact O-N 3.02Å; M764-C768 PolarHBondContact O-SG 3.24Å; M764-F787 HydrophobicContact CB-CD1 4.36Å; M764-F787 HydrophobicContact CB-CD2 4.4Å; M764-F787 HydrophobicContact CB-CE1 4.09Å; M764-F787 HydrophobicContact CB-CE2 4.12Å; M764-F787 HydrophobicContact CB-CZ 3.95Å; M764-F787 HydrophobicContact CE-CB 4.4Å; M764-F787 HydrophobicContact CG-CD1 4.03Å; M764-F787 HydrophobicContact CG-CD2 4.25Å; M764-F787 HydrophobicContact CG-CE1 4.25Å; M764-F787 HydrophobicContact CG-CE2 4.46Å; M764-F787 HydrophobicContact CG-CG 4.03Å; M764-F787 HydrophobicContact CG-CZ 4.46Å; M764-F787 HydrophobicContact SD-CD1 3.93Å; M764-F787 HydrophobicContact SD-CE1 4.29Å; M764-F787 HydrophobicContact SD-CG 4.39Å; M764-I789 HydrophobicContact CE-CG1 4.15Å; M764-T795 HydrophobicContact CE-CG2 3.83Å; M764-L799 HydrophobicContact CB-CD1 4.41Å; M764-L799 HydrophobicContact CG-CD1 4.1Å; M764-L799 HydrophobicContact SD-CD2 4.35Å
765	E	85	Confident	79.7	Confident	21 Å²	21	65.4 Å²	65.4	10%	0.098	36%	0.356	C	S	.	.	H	α-helix	trans	-63.6	-46.3	173.9	-173.8	175.1	-170.8	0	0	111.2	L761 Q762 A767 C768 A769 F796 L799 R803	L761-E765 PolarHBondContact O-N 2.81Å; Q762-E765 WeakPolarHBondContact O-CA 3.45Å; Q762-E765 WeakPolarHBondContact O-CB 3.27Å; Q762-E765 PolarHBondContact O-N 2.85Å; E765-A767 VanDerWaalsContact C-N 3.34Å; E765-A767 PolarHBondContact O-N 2.84Å; E765-C768 WeakPolarHBondContact O-CB 3.41Å; E765-C768 PolarHBondContact O-N 3.41Å; E765-A769 PolarHBondContact O-N 3.35Å; E765-F796 HydrophobicContact CG-CD2 3.8Å; E765-F796 HydrophobicContact CG-CE2 3.42Å; E765-F796 VanDerWaalsContact CG-CE2 3.42Å; E765-F796 HydrophobicContact CG-CZ 4.29Å; E765-L799 HydrophobicContact CB-CD1 4.19Å; E765-R803 VanDerWaalsContact OE2-CD 3.25Å; E765-R803 WeakPolarHBondContact OE2-CD 3.48Å; E765-R803 IonicContact OE2-CZ 3.52Å; E765-R803 IonicContact OE2-NE 2.8Å; E765-R803 IonicContact OE2-NH1 2.82Å; E765-R803 PolarHBondContact OE2-NH1 2.91Å
766	D	84.1	Confident	77.9	Confident	79 Å²	79	66.3 Å²	66.3	42%	0.422	37%	0.371	S	S	.	.	H	α-helix	trans	-63.7	-39.8	177.4	-63.1	-17.9	0	0	0	111.3	Q762 A769 S770	Q762-D766 PolarHBondContact NE2-OD1 2.78Å; Q762-D766 VanDerWaalsContact O-CG 3.26Å; Q762-D766 PolarHBondContact O-N 2.8Å; D766-A769 PolarHBondContact O-N 2.67Å; D766-S770 WeakPolarHBondContact O-CB 3.16Å; D766-S770 PolarHBondContact O-N 3.03Å
767	A	82.7	Confident	76.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-46	173	0	0	0	0	0	111.9	N763 M764 E765 A769 S770 M771 Y784 I789	N763-A767 WeakPolarHBondContact O-CB 3.4Å; N763-A767 PolarHBondContact O-N 2.86Å; M764-A767 PolarHBondContact O-N 2.88Å; E765-A767 VanDerWaalsContact C-N 3.34Å; E765-A767 PolarHBondContact O-N 2.84Å; A767-A769 VanDerWaalsContact C-N 3.34Å; A767-A769 PolarHBondContact O-N 3.2Å; A767-S770 PolarHBondContact O-N 2.99Å; A767-M771 WeakPolarHBondContact O-CB 3.3Å; A767-M771 VanDerWaalsContact O-CG 3.23Å; A767-M771 WeakPolarHBondContact O-CG 3.38Å; A767-M771 PolarHBondContact O-N 2.85Å; A767-Y784 HydrophobicContact CB-CD1 3.38Å; A767-Y784 HydrophobicContact CB-CE1 3.65Å; A767-Y784 HydrophobicContact CB-CG 4.41Å; A767-I789 HydrophobicContact CB-CD1 4.29Å
768	C	83.4	Confident	74.4	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-63	-41	177	-66.9	0	0	0	0	111.7	M764 E765 A772 F796	M764-C768 PolarHBondContact O-N 3.02Å; M764-C768 PolarHBondContact O-SG 3.24Å; E765-C768 WeakPolarHBondContact O-CB 3.41Å; E765-C768 PolarHBondContact O-N 3.41Å; C768-A772 WeakPolarHBondContact O-CB 3.47Å; C768-A772 PolarHBondContact O-N 2.69Å; C768-A772 VanDerWaalsContact O-N 3.1Å; C768-F796 HydrophobicContact CB-CB 4.08Å; C768-F796 HydrophobicContact CB-CD2 4.18Å
769	A	80.7	Confident	72.5	Confident	38 Å²	38	80.2 Å²	80.2	31%	0.314	43%	0.425	S	S	.	.	H	α-helix	trans	-65.4	-44.3	177.5	0	0	0	0	0	111.8	E765 D766 A767 A772 V773 F796	E765-A769 PolarHBondContact O-N 3.35Å; D766-A769 PolarHBondContact O-N 2.67Å; A767-A769 VanDerWaalsContact C-N 3.34Å; A767-A769 PolarHBondContact O-N 3.2Å; A769-A772 PolarHBondContact O-N 2.85Å; A769-V773 VanDerWaalsContact O-CG2 3.3Å; A769-V773 WeakPolarHBondContact O-CG2 3.49Å; A769-V773 PolarHBondContact O-N 3.38Å; A769-F796 HydrophobicContact CB-CE2 4.21Å
770	S	78.1	Confident	70.6	Confident	29 Å²	29	82.3 Å²	82.3	20%	0.203	43%	0.426	C	S	.	.	H	α-helix	trans	-62.6	-47.8	177.3	-176	0	0	0	0	111.7	D766 A767 A772 V773 Y774	D766-S770 WeakPolarHBondContact O-CB 3.16Å; D766-S770 PolarHBondContact O-N 3.03Å; A767-S770 PolarHBondContact O-N 2.99Å; S770-A772 PolarHBondContact O-N 3.18Å; S770-V773 PolarHBondContact O-N 3.05Å; S770-V773 VanDerWaalsContact O-N 3.1Å; S770-Y774 PolarHBondContact O-N 2.79Å
771	M	75.8	Confident	68.8	Low	87 Å²	87	84.2 Å²	84.2	43%	0.429	44%	0.436	S	S	.	.	H	α-helix	trans	-62.3	-28.9	177.4	-70.6	176.9	72.4	0	0	113.4	A767 I789 P792	A767-M771 WeakPolarHBondContact O-CB 3.3Å; A767-M771 VanDerWaalsContact O-CG 3.23Å; A767-M771 WeakPolarHBondContact O-CG 3.38Å; A767-M771 PolarHBondContact O-N 2.85Å; M771-I789 HydrophobicContact CE-CB 4.48Å; M771-I789 HydrophobicContact CE-CG2 4.39Å; M771-I789 HydrophobicContact SD-CB 4.38Å; M771-I789 HydrophobicContact SD-CD1 4.03Å; M771-I789 HydrophobicContact SD-CG2 4.33Å; M771-P792 HydrophobicContact CB-CB 4.2Å; M771-P792 HydrophobicContact CB-CG 3.96Å; M771-P792 HydrophobicContact CE-CG 4.2Å
772	A	70.5	Confident	67.1	Low	55 Å²	55	92.3 Å²	92.3	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-78.5	-21.1	177.3	0	0	0	0	0	113.5	C768 A769 S770 P792	C768-A772 WeakPolarHBondContact O-CB 3.47Å; C768-A772 PolarHBondContact O-N 2.69Å; C768-A772 VanDerWaalsContact O-N 3.1Å; A769-A772 PolarHBondContact O-N 2.85Å; S770-A772 PolarHBondContact O-N 3.18Å; A772-P792 HydrophobicContact CB-CB 4.46Å
773	V	66.3	Low	65.3	Low	110 Å²	110	96.5 Å²	96.5	67%	0.667	49%	0.493	S	S	*	.	H	α-helix	trans	-108.4	-36.6	-172.6	177.9	0	0	0	0	112.8	A769 S770	A769-V773 VanDerWaalsContact O-CG2 3.3Å; A769-V773 WeakPolarHBondContact O-CG2 3.49Å; A769-V773 PolarHBondContact O-N 3.38Å; S770-V773 PolarHBondContact O-N 3.05Å; S770-V773 VanDerWaalsContact O-N 3.1Å
774	Y	60	Low	63.7	Low	177 Å²	177	95.2 Å²	95.2	69%	0.694	48%	0.482	S	S	*	.			trans	-109.2	121.8	-175.4	-78.2	-84	0	0	0	113.1	S770	S770-Y774 PolarHBondContact O-N 2.79Å
775	Q	53.5	Low	62.4	Low	207 Å²	207	99.4 Å²	99.4	97%	0.967	51%	0.511	S	S	*	.			trans	-105.1	32.9	170.9	-66.4	-176.7	-7.6	0	0	112.5
776	G	49.6	Very low	61.5	Low	55 Å²	55	104.7 Å²	104.7	57%	0.567	53%	0.534	S	S	*	.			trans	-96	172.2	-175.4	0	0	0	0	0	115.3
777	P	45.7	Very low	61.1	Low	130 Å²	130	102.7 Å²	102.7	84%	0.844	52%	0.521	S	S	*	.			trans	-70.2	150.7	-165.2	28.2	-33.1	0	0	0	115	R779	P777-R779 VanDerWaalsContact C-N 3.29Å; P777-R779 PolarHBondContact O-N 3.4Å
778	Q	49.9	Very low	60.8	Low	153 Å²	153	104.8 Å²	104.8	72%	0.715	53%	0.534	S	S	*	.	S	Bend	trans	-59	24.7	-158.6	-63.3	175.4	-29.4	0	0	119.8	Q781	Q778-Q781 VanDerWaalsContact CB-OE1 3.28Å; Q778-Q781 VanDerWaalsContact CG-OE1 3.29Å
779	R	44.3	Very low	60.6	Low	244 Å²	244	105.9 Å²	105.9	92%	0.921	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-20.4	-176	-83.7	-174.7	177.4	177.4	-0.4	115.7	P777	P777-R779 VanDerWaalsContact C-N 3.29Å; P777-R779 PolarHBondContact O-N 3.4Å
780	E	46.2	Very low	60.6	Low	125 Å²	125	108.7 Å²	108.7	58%	0.584	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	0.6	178.3	-61.3	-176.4	175	0	0	113.9	E782 Y784	E780-E782 VanDerWaalsContact C-N 3.28Å; E780-E782 PolarHBondContact O-N 3.15Å; E780-Y784 HydrophobicContact CB-CD2 4.12Å; E780-Y784 HydrophobicContact CB-CE2 3.57Å; E780-Y784 WeakPolarHBondContact O-CD2 3.38Å; E780-Y784 WeakPolarHBondContact O-CE2 3.39Å; E780-Y784 PolarHBondContact OE2-OH 2.84Å
781	Q	48	Very low	60.8	Low	109 Å²	109	111.2 Å²	111.2	51%	0.509	56%	0.555	S	S	.	*	H	α-helix	trans	-67.6	-18.8	-173.2	-81.1	179.8	-24	0	0	115	Q778 Y784 S785	Q778-Q781 VanDerWaalsContact CB-OE1 3.28Å; Q778-Q781 VanDerWaalsContact CG-OE1 3.29Å; Q781-Y784 PolarHBondContact O-N 2.95Å; Q781-S785 VanDerWaalsContact O-CB 3.31Å; Q781-S785 WeakPolarHBondContact O-CB 3.43Å; Q781-S785 PolarHBondContact O-N 2.87Å
782	E	49.6	Very low	61.1	Low	171 Å²	171	108 Å²	108	80%	0.799	54%	0.541	S	S	*	.	H	α-helix	trans	-67.9	-37.1	-178.2	-72.9	-174	170.4	0	0	112.9	E780 S785	E780-E782 VanDerWaalsContact C-N 3.28Å; E780-E782 PolarHBondContact O-N 3.15Å; E782-S785 PolarHBondContact O-OG 2.81Å
783	E	48.2	Very low	61.8	Low	144 Å²	144	112.1 Å²	112.1	67%	0.673	55%	0.548	S	S	*	.	H	α-helix	trans	-76.3	-35.6	175.4	-72.5	-162	146.1	0	0	112.6
784	Y	52.6	Low	62.7	Low	66 Å²	66	110.4 Å²	110.4	26%	0.259	53%	0.533	S	S	.	.	H	α-helix	trans	-79.2	-17.8	-179.4	-55.3	-52.9	0	0	0	114.3	A767 E780 Q781 K786 F787	A767-Y784 HydrophobicContact CB-CD1 3.38Å; A767-Y784 HydrophobicContact CB-CE1 3.65Å; A767-Y784 HydrophobicContact CB-CG 4.41Å; E780-Y784 HydrophobicContact CB-CD2 4.12Å; E780-Y784 HydrophobicContact CB-CE2 3.57Å; E780-Y784 WeakPolarHBondContact O-CD2 3.38Å; E780-Y784 WeakPolarHBondContact O-CE2 3.39Å; E780-Y784 PolarHBondContact OE2-OH 2.84Å; Q781-Y784 PolarHBondContact O-N 2.95Å; Y784-K786 PolarHBondContact O-N 3.42Å; Y784-F787 PolarHBondContact O-N 2.92Å
785	S	57	Low	63.9	Low	87 Å²	87	102 Å²	102	61%	0.608	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-12.6	174.5	70	0	0	0	0	114.2	Q781 E782	Q781-S785 VanDerWaalsContact O-CB 3.31Å; Q781-S785 WeakPolarHBondContact O-CB 3.43Å; Q781-S785 PolarHBondContact O-N 2.87Å; E782-S785 PolarHBondContact O-OG 2.81Å
786	K	65.3	Low	65.5	Low	132 Å²	132	95.4 Å²	95.4	57%	0.574	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-21.9	-179.7	-65.6	177.6	-176.9	170	0	113.5	R344 Y784	R344-K786 PolarHBondContact NH1-O 2.9Å; Y784-K786 PolarHBondContact O-N 3.42Å
787	F	75.7	Confident	67.3	Low	37 Å²	37	98.4 Å²	98.4	16%	0.162	47%	0.468	C	S	.	.	S	Bend	trans	-112.3	145.6	-176.8	-56.8	-66.4	0	0	0	112.3	M764 Y784 I789	M764-F787 HydrophobicContact CB-CD1 4.36Å; M764-F787 HydrophobicContact CB-CD2 4.4Å; M764-F787 HydrophobicContact CB-CE1 4.09Å; M764-F787 HydrophobicContact CB-CE2 4.12Å; M764-F787 HydrophobicContact CB-CZ 3.95Å; M764-F787 HydrophobicContact CE-CB 4.4Å; M764-F787 HydrophobicContact CG-CD1 4.03Å; M764-F787 HydrophobicContact CG-CD2 4.25Å; M764-F787 HydrophobicContact CG-CE1 4.25Å; M764-F787 HydrophobicContact CG-CE2 4.46Å; M764-F787 HydrophobicContact CG-CG 4.03Å; M764-F787 HydrophobicContact CG-CZ 4.46Å; M764-F787 HydrophobicContact SD-CD1 3.93Å; M764-F787 HydrophobicContact SD-CE1 4.29Å; M764-F787 HydrophobicContact SD-CG 4.39Å; Y784-F787 PolarHBondContact O-N 2.92Å; F787-I789 HydrophobicContact CB-CD1 3.94Å; F787-I789 HydrophobicContact CB-CG1 3.97Å; F787-I789 PolarHBondContact O-N 2.77Å
788	T	76.6	Confident	69.4	Low	44 Å²	44	92.9 Å²	92.9	27%	0.27	43%	0.431	S	S	.	.			trans	-94.1	88.4	174.5	-61.7	0	0	0	0	109.9	S332 D341 R344	S332-T788 WeakPolarHBondContact CB-O 3.45Å; D341-T788 VanDerWaalsContact OD2-CB 3.31Å; D341-T788 WeakPolarHBondContact OD2-CB 3.35Å; D341-T788 PolarHBondContact OD2-N 3.23Å; R344-T788 PolarHBondContact NH2-OG1 3.41Å
789	I	78.8	Confident	71.2	Confident	24 Å²	24	85.6 Å²	85.6	12%	0.123	40%	0.397	C	S	.	.			trans	-109.3	107.1	-179.1	-56.9	166	0	0	0	109.1	M764 A767 M771 F787 P792	M764-I789 HydrophobicContact CE-CG1 4.15Å; A767-I789 HydrophobicContact CB-CD1 4.29Å; M771-I789 HydrophobicContact CE-CB 4.48Å; M771-I789 HydrophobicContact CE-CG2 4.39Å; M771-I789 HydrophobicContact SD-CB 4.38Å; M771-I789 HydrophobicContact SD-CD1 4.03Å; M771-I789 HydrophobicContact SD-CG2 4.33Å; F787-I789 HydrophobicContact CB-CD1 3.94Å; F787-I789 HydrophobicContact CB-CG1 3.97Å; F787-I789 PolarHBondContact O-N 2.77Å; I789-P792 HydrophobicContact CG2-CB 4.3Å; I789-P792 HydrophobicContact CG2-CG 4.05Å
790	Q	80.3	Confident	73.3	Confident	97 Å²	97	79.5 Å²	79.5	45%	0.453	38%	0.378	S	S	.	.	S	Bend	trans	-89.4	-41.1	174.1	-65.1	178.1	-58.5	0	0	112.4	P330 S332	P330-Q790 HydrophobicContact CB-CB 4.28Å; P330-Q790 VanDerWaalsContact CB-OE1 3.32Å; P330-Q790 HydrophobicContact CG-CB 4.08Å; S332-Q790 WeakPolarHBondContact OG-CB 3.4Å; S332-Q790 WeakPolarHBondContact OG-CG 3.41Å; S332-Q790 PolarHBondContact OG-OE1 3.31Å
791	E	83.4	Confident	75.4	Confident	81 Å²	81	78.5 Å²	78.5	38%	0.379	37%	0.373	S	S	.	.			trans	-127.3	100.2	179.8	-174.4	59.9	-119.4	0	0	109.6	P330 K793 E794 T795	P330-E791 HydrophobicContact CG-CB 3.68Å; E791-K793 VanDerWaalsContact C-N 3.31Å; E791-K793 PolarHBondContact O-N 2.98Å; E791-E794 HydrophobicContact CB-CB 4.44Å; E791-E794 HydrophobicContact CG-CB 4.05Å; E791-E794 HydrophobicContact CG-CG 3.84Å; E791-T795 WeakPolarHBondContact O-CB 3.43Å; E791-T795 PolarHBondContact O-N 3.44Å; E791-T795 VanDerWaalsContact O-N 3.11Å; E791-T795 PolarHBondContact O-OG1 2.78Å
792	P	81.9	Confident	77.5	Confident	20 Å²	20	73.3 Å²	73.3	13%	0.13	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-36.5	-174.4	-25.9	34.5	0	0	0	113.7	M771 A772 I789 F796	M771-P792 HydrophobicContact CB-CB 4.2Å; M771-P792 HydrophobicContact CB-CG 3.96Å; M771-P792 HydrophobicContact CE-CG 4.2Å; A772-P792 HydrophobicContact CB-CB 4.46Å; I789-P792 HydrophobicContact CG2-CB 4.3Å; I789-P792 HydrophobicContact CG2-CG 4.05Å; P792-F796 VanDerWaalsContact O-CB 3.25Å; P792-F796 WeakPolarHBondContact O-CB 3.44Å; P792-F796 PolarHBondContact O-N 2.8Å
793	K	84.3	Confident	79.4	Confident	142 Å²	142	67.6 Å²	67.6	62%	0.617	32%	0.32	S	S	*	.	H	α-helix	trans	-68	-46.6	-176.8	-70.5	179.2	-179.3	174.7	0	112.6	E791 F796 Q797	E791-K793 VanDerWaalsContact C-N 3.31Å; E791-K793 PolarHBondContact O-N 2.98Å; K793-F796 PolarHBondContact O-N 3.02Å; K793-Q797 WeakPolarHBondContact O-CG 3.31Å; K793-Q797 PolarHBondContact O-N 3.44Å; K793-Q797 VanDerWaalsContact O-N 3.14Å
794	E	85.4	Confident	81.4	Confident	74 Å²	74	65 Å²	65	35%	0.346	31%	0.311	S	S	.	.	H	α-helix	trans	-69.7	-40.1	178.7	-67.7	-168.7	-179.1	0	0	111.5	P330 A333 E791 F796 Q797 T798	P330-E794 WeakPolarHBondContact CD-OE2 3.18Å; A333-E794 HydrophobicContact CB-CB 3.88Å; E791-E794 HydrophobicContact CB-CB 4.44Å; E791-E794 HydrophobicContact CG-CB 4.05Å; E791-E794 HydrophobicContact CG-CG 3.84Å; E794-F796 VanDerWaalsContact C-N 3.32Å; E794-F796 PolarHBondContact O-N 2.78Å; E794-Q797 PolarHBondContact O-N 2.78Å; E794-Q797 VanDerWaalsContact O-N 3.16Å; E794-T798 PolarHBondContact O-N 3.34Å; E794-T798 PolarHBondContact O-OG1 2.87Å
795	T	85.9	Confident	83.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-45.1	175.7	-51.9	0	0	0	0	110.7	I338 M764 E791 Q797 T798 L799	I338-T795 HydrophobicContact CD1-CG2 4.15Å; I338-T795 HydrophobicContact CG1-CG2 4.44Å; M764-T795 HydrophobicContact CE-CG2 3.83Å; E791-T795 WeakPolarHBondContact O-CB 3.43Å; E791-T795 PolarHBondContact O-N 3.44Å; E791-T795 VanDerWaalsContact O-N 3.11Å; E791-T795 PolarHBondContact O-OG1 2.78Å; T795-Q797 PolarHBondContact O-N 2.88Å; T795-T798 PolarHBondContact O-N 2.83Å; T795-L799 HydrophobicContact CG2-CD1 4.18Å; T795-L799 VanDerWaalsContact O-CG 3.27Å; T795-L799 WeakPolarHBondContact O-CG 3.27Å; T795-L799 PolarHBondContact O-N 2.88Å
796	F	86.5	Confident	84.9	Confident	68 Å²	68	59.5 Å²	59.5	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-60.5	-40.7	175.6	-173.4	-91.1	0	0	0	112.8	E765 C768 A769 P792 K793 E794 L799 K800	E765-F796 HydrophobicContact CG-CD2 3.8Å; E765-F796 HydrophobicContact CG-CE2 3.42Å; E765-F796 VanDerWaalsContact CG-CE2 3.42Å; E765-F796 HydrophobicContact CG-CZ 4.29Å; C768-F796 HydrophobicContact CB-CB 4.08Å; C768-F796 HydrophobicContact CB-CD2 4.18Å; A769-F796 HydrophobicContact CB-CE2 4.21Å; P792-F796 VanDerWaalsContact O-CB 3.25Å; P792-F796 WeakPolarHBondContact O-CB 3.44Å; P792-F796 PolarHBondContact O-N 2.8Å; K793-F796 PolarHBondContact O-N 3.02Å; E794-F796 VanDerWaalsContact C-N 3.32Å; E794-F796 PolarHBondContact O-N 2.78Å; F796-L799 PolarHBondContact O-N 2.78Å; F796-K800 WeakPolarHBondContact O-CB 3.19Å; F796-K800 PolarHBondContact O-N 2.86Å
797	Q	88	Confident	86.1	Confident	119 Å²	119	58.5 Å²	58.5	56%	0.556	28%	0.276	S	S	*	.	H	α-helix	trans	-63.7	-43.7	176.7	-72.6	177	7.1	0	0	112.3	K793 E794 T795 K800 Q801	K793-Q797 WeakPolarHBondContact O-CG 3.31Å; K793-Q797 PolarHBondContact O-N 3.44Å; K793-Q797 VanDerWaalsContact O-N 3.14Å; E794-Q797 PolarHBondContact O-N 2.78Å; E794-Q797 VanDerWaalsContact O-N 3.16Å; T795-Q797 PolarHBondContact O-N 2.88Å; Q797-K800 PolarHBondContact O-N 2.82Å; Q797-Q801 WeakPolarHBondContact O-CG 3.45Å; Q797-Q801 PolarHBondContact O-N 2.7Å
798	T	88.6	Confident	86.7	Confident	13 Å²	13	60.2 Å²	60.2	8%	0.08	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-41.9	176.4	-57.5	0	0	0	0	111.5	A333 A335 I338 E794 T795 K800 Q801 L802	A333-T798 WeakPolarHBondContact O-CB 3.37Å; A333-T798 WeakPolarHBondContact O-CG2 3.45Å; A333-T798 PolarHBondContact O-OG1 2.65Å; A335-T798 HydrophobicContact CB-CG2 3.91Å; I338-T798 HydrophobicContact CD1-CG2 3.76Å; E794-T798 PolarHBondContact O-N 3.34Å; E794-T798 PolarHBondContact O-OG1 2.87Å; T795-T798 PolarHBondContact O-N 2.83Å; T798-K800 VanDerWaalsContact C-N 3.34Å; T798-K800 PolarHBondContact O-N 2.71Å; T798-Q801 PolarHBondContact O-N 3.26Å; T798-L802 WeakPolarHBondContact O-CB 3.4Å; T798-L802 PolarHBondContact O-N 2.83Å
799	L	88.5	Confident	87.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59	-45.3	176	-72.9	169.9	0	0	0	111.4	I338 L761 M764 E765 T795 F796 Q801 L802 R803	I338-L799 HydrophobicContact CD1-CD2 4.21Å; I338-L799 HydrophobicContact CD1-CG 4.23Å; I338-L799 HydrophobicContact CG2-CD2 3.73Å; L761-L799 HydrophobicContact CD1-CD2 3.37Å; L761-L799 HydrophobicContact CG-CD2 4.28Å; M764-L799 HydrophobicContact CB-CD1 4.41Å; M764-L799 HydrophobicContact CG-CD1 4.1Å; M764-L799 HydrophobicContact SD-CD2 4.35Å; E765-L799 HydrophobicContact CB-CD1 4.19Å; T795-L799 HydrophobicContact CG2-CD1 4.18Å; T795-L799 VanDerWaalsContact O-CG 3.27Å; T795-L799 WeakPolarHBondContact O-CG 3.27Å; T795-L799 PolarHBondContact O-N 2.88Å; F796-L799 PolarHBondContact O-N 2.78Å; L799-Q801 PolarHBondContact O-N 2.67Å; L799-L802 PolarHBondContact O-N 2.93Å; L799-R803 PolarHBondContact O-N 3.19Å
800	K	89.2	Confident	87.8	Confident	117 Å²	117	60.7 Å²	60.7	51%	0.509	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-41.9	176.6	-172.1	174.6	-177	174.6	0	112.5	F796 Q797 T798 L802 R803 N804	F796-K800 WeakPolarHBondContact O-CB 3.19Å; F796-K800 PolarHBondContact O-N 2.86Å; Q797-K800 PolarHBondContact O-N 2.82Å; T798-K800 VanDerWaalsContact C-N 3.34Å; T798-K800 PolarHBondContact O-N 2.71Å; K800-L802 VanDerWaalsContact C-N 3.35Å; K800-R803 PolarHBondContact O-N 2.91Å; K800-N804 VanDerWaalsContact O-CG 3.23Å; K800-N804 PolarHBondContact O-N 2.85Å; K800-N804 VanDerWaalsContact O-N 3.08Å; K800-N804 PolarHBondContact O-OD1 2.82Å
801	Q	90.4	Very high	88.1	Confident	103 Å²	103	62.7 Å²	62.7	48%	0.481	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-42.6	174.7	-71.7	177.6	12.3	0	0	111.7	L321 Q797 T798 L799 N804 V805	L321-Q801 HydrophobicContact CD1-CB 4.32Å; L321-Q801 HydrophobicContact CD2-CB 4.37Å; Q797-Q801 WeakPolarHBondContact O-CG 3.45Å; Q797-Q801 PolarHBondContact O-N 2.7Å; T798-Q801 PolarHBondContact O-N 3.26Å; L799-Q801 PolarHBondContact O-N 2.67Å; Q801-N804 PolarHBondContact O-N 3.46Å; Q801-V805 WeakPolarHBondContact O-CG2 3.5Å; Q801-V805 PolarHBondContact O-N 3.16Å; Q801-V805 VanDerWaalsContact O-N 3.13Å
802	L	91.3	Very high	88.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-45.5	178.5	-172.6	65.6	0	0	0	111.2	L318 L321 L754 L761 T798 L799 K800 V805 M806	L318-L802 HydrophobicContact CD1-CD1 3.88Å; L321-L802 HydrophobicContact CD2-CB 4.03Å; L321-L802 HydrophobicContact CD2-CD1 3.84Å; L754-L802 HydrophobicContact CD1-CD1 3.99Å; L754-L802 HydrophobicContact CD1-CD2 4.25Å; L754-L802 HydrophobicContact CD1-CG 4.33Å; L754-L802 HydrophobicContact CD2-CD2 4.1Å; L761-L802 HydrophobicContact CD1-CD2 4.01Å; T798-L802 WeakPolarHBondContact O-CB 3.4Å; T798-L802 PolarHBondContact O-N 2.83Å; L799-L802 PolarHBondContact O-N 2.93Å; K800-L802 VanDerWaalsContact C-N 3.35Å; L802-V805 PolarHBondContact O-N 2.81Å; L802-M806 HydrophobicContact CG-SD 4.25Å; L802-M806 VanDerWaalsContact O-CG 3.3Å; L802-M806 WeakPolarHBondContact O-CG 3.31Å; L802-M806 PolarHBondContact O-N 2.88Å
803	R	89.5	Confident	88.2	Confident	52 Å²	52	60.3 Å²	60.3	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-60.4	-47.8	176.4	-73.7	-170.9	73.1	177.8	10.5	112.6	E758 L761 Q762 E765 L799 K800 V805 M806 E807	E758-R803 IonicContact OE1-NH2 2.91Å; L761-R803 HydrophobicContact CD2-CG 3.66Å; L761-R803 HydrophobicContact CG-CG 4.46Å; Q762-R803 VanDerWaalsContact OE1-CZ 3.27Å; E765-R803 VanDerWaalsContact OE2-CD 3.25Å; E765-R803 WeakPolarHBondContact OE2-CD 3.48Å; E765-R803 IonicContact OE2-CZ 3.52Å; E765-R803 IonicContact OE2-NE 2.8Å; E765-R803 IonicContact OE2-NH1 2.82Å; E765-R803 PolarHBondContact OE2-NH1 2.91Å; L799-R803 PolarHBondContact O-N 3.19Å; K800-R803 PolarHBondContact O-N 2.91Å; R803-V805 VanDerWaalsContact C-N 3.25Å; R803-V805 PolarHBondContact O-N 2.87Å; R803-M806 WeakPolarHBondContact O-CB 3.49Å; R803-M806 PolarHBondContact O-N 3.06Å; R803-E807 WeakPolarHBondContact O-CG 3.45Å; R803-E807 PolarHBondContact O-N 3.16Å
804	N	90.9	Very high	88	Confident	90 Å²	90	57.6 Å²	57.6	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-57.3	-40.9	177.9	-70.3	-9.5	0	0	0	112	K800 Q801 E808	K800-N804 VanDerWaalsContact O-CG 3.23Å; K800-N804 PolarHBondContact O-N 2.85Å; K800-N804 VanDerWaalsContact O-N 3.08Å; K800-N804 PolarHBondContact O-OD1 2.82Å; Q801-N804 PolarHBondContact O-N 3.46Å; N804-E808 PolarHBondContact O-N 3Å
805	V	91.8	Very high	87.5	Confident	25 Å²	25	57.8 Å²	57.8	15%	0.152	28%	0.276	C	S	.	.	H	α-helix	trans	-67.3	-41.3	176.7	170.5	0	0	0	0	111.3	P317 L318 Q801 L802 R803 L809	P317-V805 HydrophobicContact CB-CG1 4.09Å; P317-V805 HydrophobicContact CB-CG2 3.99Å; L318-V805 HydrophobicContact CB-CG1 3.75Å; L318-V805 HydrophobicContact CD1-CG1 4.34Å; Q801-V805 WeakPolarHBondContact O-CG2 3.5Å; Q801-V805 PolarHBondContact O-N 3.16Å; Q801-V805 VanDerWaalsContact O-N 3.13Å; L802-V805 PolarHBondContact O-N 2.81Å; R803-V805 VanDerWaalsContact C-N 3.25Å; R803-V805 PolarHBondContact O-N 2.87Å; V805-L809 HydrophobicContact CG1-CD1 4.12Å; V805-L809 WeakPolarHBondContact O-CB 3.46Å; V805-L809 WeakPolarHBondContact O-CG 3.45Å; V805-L809 PolarHBondContact O-N 2.81Å
806	M	91.3	Very high	86.6	Confident	12 Å²	12	61.7 Å²	61.7	6%	0.059	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-43.4	177.2	-72	175.4	60	0	0	112.5	L754 L761 L802 R803 E808 L809 Q810	L754-M806 HydrophobicContact CB-CE 3.54Å; L754-M806 HydrophobicContact CB-SD 3.72Å; L754-M806 HydrophobicContact CD1-CG 4.34Å; L754-M806 HydrophobicContact CD1-SD 3.87Å; L754-M806 HydrophobicContact CD2-SD 4.3Å; L754-M806 HydrophobicContact CG-SD 4.2Å; L761-M806 HydrophobicContact CD2-SD 3.91Å; L802-M806 HydrophobicContact CG-SD 4.25Å; L802-M806 VanDerWaalsContact O-CG 3.3Å; L802-M806 WeakPolarHBondContact O-CG 3.31Å; L802-M806 PolarHBondContact O-N 2.88Å; R803-M806 WeakPolarHBondContact O-CB 3.49Å; R803-M806 PolarHBondContact O-N 3.06Å; M806-E808 VanDerWaalsContact C-N 3.33Å; M806-E808 PolarHBondContact O-N 3.31Å; M806-L809 PolarHBondContact O-N 2.92Å; M806-Q810 WeakPolarHBondContact O-CB 3.31Å; M806-Q810 PolarHBondContact O-N 3.4Å
807	E	89.9	Confident	85.3	Confident	110 Å²	110	62.2 Å²	62.2	51%	0.514	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-43.3	177.9	-73.8	175.4	-171.4	0	0	111.5	R803 Q810 R811	R803-E807 WeakPolarHBondContact O-CG 3.45Å; R803-E807 PolarHBondContact O-N 3.16Å; E807-Q810 PolarHBondContact O-N 3.47Å; E807-R811 WeakPolarHBondContact O-CB 3.18Å; E807-R811 PolarHBondContact O-N 2.96Å
808	E	89.1	Confident	83.5	Confident	73 Å²	73	63.7 Å²	63.7	34%	0.341	31%	0.308	S	S	.	.	H	α-helix	trans	-65.7	-42.6	177.1	177	52.7	-155.3	0	0	112	N804 M806 R811 Q812	N804-E808 PolarHBondContact O-N 3Å; M806-E808 VanDerWaalsContact C-N 3.33Å; M806-E808 PolarHBondContact O-N 3.31Å; E808-R811 VanDerWaalsContact CD-NH2 3.3Å; E808-R811 WeakPolarHBondContact O-CB 3.43Å; E808-R811 PolarHBondContact O-N 3.39Å; E808-R811 IonicContact OE1-CZ 3.68Å; E808-R811 IonicContact OE1-NE 3.39Å; E808-R811 IonicContact OE1-NH2 3.81Å; E808-R811 PolarHBondContact OE1-NH2 3.07Å; E808-R811 IonicContact OE2-CZ 2.83Å; E808-R811 IonicContact OE2-NE 2.87Å; E808-R811 PolarHBondContact OE2-NE 3.25Å; E808-R811 IonicContact OE2-NH2 2.76Å; E808-R811 PolarHBondContact OE2-NH2 3.48Å; E808-R811 VanDerWaalsContact OE2-NH2 3.16Å; E808-Q812 WeakPolarHBondContact O-CG 3.4Å; E808-Q812 PolarHBondContact O-N 2.87Å; E808-Q812 VanDerWaalsContact O-N 3.09Å; E808-Q812 PolarHBondContact OE1-NE2 3.28Å
809	L	88.4	Confident	81.7	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-43.1	173.8	-81.1	172.4	0	0	0	112.1	C314 Y315 L318 F751 V805 M806 R811 Q812 H813	C314-L809 HydrophobicContact CB-CD2 4.2Å; C314-L809 VanDerWaalsContact O-CD2 3.26Å; C314-L809 WeakPolarHBondContact O-CD2 3.5Å; Y315-L809 HydrophobicContact CD1-CD1 4.44Å; Y315-L809 HydrophobicContact CD1-CD2 4.07Å; Y315-L809 HydrophobicContact CE1-CD2 4.25Å; L318-L809 HydrophobicContact CB-CD1 4.17Å; L318-L809 HydrophobicContact CD2-CD1 4.05Å; F751-L809 HydrophobicContact CD2-CB 3.84Å; F751-L809 HydrophobicContact CD2-CD1 3.84Å; F751-L809 HydrophobicContact CE2-CB 3.56Å; F751-L809 HydrophobicContact CE2-CD1 4.43Å; F751-L809 HydrophobicContact CG-CD1 4.33Å; F751-L809 HydrophobicContact CZ-CB 4.12Å; V805-L809 HydrophobicContact CG1-CD1 4.12Å; V805-L809 WeakPolarHBondContact O-CB 3.46Å; V805-L809 WeakPolarHBondContact O-CG 3.45Å; V805-L809 PolarHBondContact O-N 2.81Å; M806-L809 PolarHBondContact O-N 2.92Å; L809-R811 VanDerWaalsContact C-N 3.31Å; L809-R811 PolarHBondContact O-N 3.21Å; L809-Q812 PolarHBondContact O-N 2.96Å; L809-H813 PolarHBondContact O-N 3.01Å
810	Q	89.1	Confident	79.8	Confident	75 Å²	75	73.1 Å²	73.1	35%	0.35	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-39.8	177.3	-173.3	64.2	49.8	0	0	111.5	F751 M806 E807 Q812 H813 N814	F751-Q810 HydrophobicContact CE2-CB 4.47Å; F751-Q810 HydrophobicContact CZ-CB 4.14Å; M806-Q810 WeakPolarHBondContact O-CB 3.31Å; M806-Q810 PolarHBondContact O-N 3.4Å; E807-Q810 PolarHBondContact O-N 3.47Å; Q810-Q812 VanDerWaalsContact C-N 3.33Å; Q810-Q812 PolarHBondContact O-N 2.93Å; Q810-H813 WeakPolarHBondContact O-CB 3.32Å; Q810-H813 PolarHBondContact O-N 3.31Å; Q810-N814 PolarHBondContact NE2-OD1 3.26Å; Q810-N814 WeakPolarHBondContact O-CB 3.43Å; Q810-N814 PolarHBondContact O-N 3.46Å; Q810-N814 PolarHBondContact O-OD1 2.96Å
811	R	86.1	Confident	78.1	Confident	140 Å²	140	71 Å²	71	53%	0.528	37%	0.371	S	S	.	.	H	α-helix	trans	-61.7	-41.4	175.1	-169.3	-171.9	67.5	74.3	0.8	111.7	E807 E808 L809 N814 S815	E807-R811 WeakPolarHBondContact O-CB 3.18Å; E807-R811 PolarHBondContact O-N 2.96Å; E808-R811 VanDerWaalsContact CD-NH2 3.3Å; E808-R811 WeakPolarHBondContact O-CB 3.43Å; E808-R811 PolarHBondContact O-N 3.39Å; E808-R811 IonicContact OE1-CZ 3.68Å; E808-R811 IonicContact OE1-NE 3.39Å; E808-R811 IonicContact OE1-NH2 3.81Å; E808-R811 PolarHBondContact OE1-NH2 3.07Å; E808-R811 IonicContact OE2-CZ 2.83Å; E808-R811 IonicContact OE2-NE 2.87Å; E808-R811 PolarHBondContact OE2-NE 3.25Å; E808-R811 IonicContact OE2-NH2 2.76Å; E808-R811 PolarHBondContact OE2-NH2 3.48Å; E808-R811 VanDerWaalsContact OE2-NH2 3.16Å; L809-R811 VanDerWaalsContact C-N 3.31Å; L809-R811 PolarHBondContact O-N 3.21Å; R811-N814 PolarHBondContact O-N 2.79Å; R811-S815 WeakPolarHBondContact O-CB 3.43Å; R811-S815 PolarHBondContact O-N 2.83Å
812	Q	84.3	Confident	76.5	Confident	40 Å²	40	74 Å²	74	19%	0.187	39%	0.385	C	S	.	.	H	α-helix	trans	-67.1	-40.6	177.3	-68.7	177.2	21	0	0	112.3	L310 C314 E808 L809 Q810 S815 R816	L310-Q812 HydrophobicContact CD1-CB 4.25Å; C314-Q812 PolarHBondContact SG-OE1 2.89Å; E808-Q812 WeakPolarHBondContact O-CG 3.4Å; E808-Q812 PolarHBondContact O-N 2.87Å; E808-Q812 VanDerWaalsContact O-N 3.09Å; E808-Q812 PolarHBondContact OE1-NE2 3.28Å; L809-Q812 PolarHBondContact O-N 2.96Å; Q810-Q812 VanDerWaalsContact C-N 3.33Å; Q810-Q812 PolarHBondContact O-N 2.93Å; Q812-S815 PolarHBondContact O-N 2.82Å; Q812-R816 WeakPolarHBondContact O-CG 3.5Å; Q812-R816 PolarHBondContact O-N 2.85Å
813	H	83.2	Confident	75.3	Confident	10 Å²	10	82 Å²	82	5%	0.046	42%	0.416	C	S	.	.	H	α-helix	trans	-58.5	-51.2	171.6	-95	-78	0	0	0	111.9	T308 E748 F751 L809 Q810 S815 R816 N817	T308-H813 PolarHBondContact O-CE1 3.33Å; E748-H813 IonicContact OE1-CE1 3.61Å; E748-H813 PolarHBondContact OE1-CE1 3.03Å; E748-H813 IonicContact OE1-NE2 2.64Å; E748-H813 PolarHBondContact OE1-NE2 2.91Å; E748-H813 IonicContact OE2-CE1 2.71Å; E748-H813 IonicContact OE2-NE2 2.83Å; E748-H813 PolarHBondContact OE2-NE2 3.29Å; F751-H813 AromaticContact CD1-NE2 3.84Å; F751-H813 AromaticContact CE1-CD2 3.38Å; F751-H813 WeakPolarHBondContact CE1-CD2 3.49Å; F751-H813 AromaticContact CE1-NE2 3.55Å; F751-H813 AromaticContact CZ-CD2 3.92Å; L809-H813 PolarHBondContact O-N 3.01Å; Q810-H813 WeakPolarHBondContact O-CB 3.32Å; Q810-H813 PolarHBondContact O-N 3.31Å; H813-S815 VanDerWaalsContact C-N 3.34Å; H813-S815 PolarHBondContact O-N 2.89Å; H813-R816 PolarHBondContact O-N 3.39Å; H813-N817 PolarHBondContact O-N 3.18Å
814	N	80.7	Confident	74	Confident	85 Å²	85	80 Å²	80	46%	0.455	41%	0.412	S	S	.	.	H	α-helix	trans	-61.9	-40.4	-179.4	-68.3	-9.9	0	0	0	112.4	Q810 R811 R816	Q810-N814 PolarHBondContact NE2-OD1 3.26Å; Q810-N814 WeakPolarHBondContact O-CB 3.43Å; Q810-N814 PolarHBondContact O-N 3.46Å; Q810-N814 PolarHBondContact O-OD1 2.96Å; R811-N814 PolarHBondContact O-N 2.79Å; N814-R816 VanDerWaalsContact C-N 3.26Å; N814-R816 PolarHBondContact O-N 3.34Å
815	S	74.8	Confident	73.3	Confident	79 Å²	79	77 Å²	77	55%	0.552	40%	0.398	S	S	*	.	H	α-helix	trans	-64.4	-30.2	179.1	-175.8	0	0	0	0	113.2	R811 Q812 H813	R811-S815 WeakPolarHBondContact O-CB 3.43Å; R811-S815 PolarHBondContact O-N 2.83Å; Q812-S815 PolarHBondContact O-N 2.82Å; H813-S815 VanDerWaalsContact C-N 3.34Å; H813-S815 PolarHBondContact O-N 2.89Å
816	R	67.9	Low	72.2	Confident	81 Å²	81	78.2 Å²	78.2	31%	0.306	40%	0.403	S	S	.	.	H	α-helix	trans	-98.6	-22.1	-173.1	-70.5	-179.3	177.3	-143.9	5.5	113.6	I22 Q812 H813 N814 N818 T819	I22-R816 HydrophobicContact CD1-CB 3.73Å; I22-R816 HydrophobicContact CD1-CG 4.44Å; Q812-R816 WeakPolarHBondContact O-CG 3.5Å; Q812-R816 PolarHBondContact O-N 2.85Å; H813-R816 PolarHBondContact O-N 3.39Å; N814-R816 VanDerWaalsContact C-N 3.26Å; N814-R816 PolarHBondContact O-N 3.34Å; R816-N818 VanDerWaalsContact C-N 3.34Å; R816-T819 PolarHBondContact O-N 2.78Å; R816-T819 PolarHBondContact O-OG1 3.18Å
817	N	58.9	Low	70.8	Confident	80 Å²	80	84.8 Å²	84.8	43%	0.428	44%	0.439	S	S	.	.	H	α-helix	trans	-70.8	-27	173.2	-77.2	-15.6	0	0	0	113.3	H813 T819 T820	H813-N817 PolarHBondContact O-N 3.18Å; N817-T819 PolarHBondContact O-N 2.72Å; N817-T820 PolarHBondContact O-OG1 3.02Å
818	N	49.9	Very low	69.7	Low	149 Å²	149	82.6 Å²	82.6	80%	0.797	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-10.9	177.8	-75.8	-18.2	0	0	0	114.1	R816	R816-N818 VanDerWaalsContact C-N 3.34Å
819	T	51	Low	69	Low	117 Å²	117	79.8 Å²	79.8	72%	0.718	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-8	-176	24.2	0	0	0	0	115.5	R816 N817	R816-T819 PolarHBondContact O-N 2.78Å; R816-T819 PolarHBondContact O-OG1 3.18Å; N817-T819 PolarHBondContact O-N 2.72Å
820	T	48.6	Very low	68.6	Low	95 Å²	95	80.6 Å²	80.6	58%	0.583	42%	0.423	S	S	*	.	S	Bend	trans	-113.2	-0.4	-158.1	41	0	0	0	0	118.5	N817	N817-T820 PolarHBondContact O-OG1 3.02Å
821	A	52.2	Low	67.9	Low	73 Å²	73	80.1 Å²	80.1	60%	0.603	43%	0.425	S	S	*	.			trans	-146.6	101.9	176.5	0	0	0	0	0	115.5
822	Q	57.1	Low	66.6	Low	165 Å²	165	73.7 Å²	73.7	77%	0.771	40%	0.403	S	S	*	.			trans	-78	118.5	162.9	-169.8	177.1	11.5	0	0	109.1	G824 S825	Q822-G824 PolarHBondContact O-N 2.77Å; Q822-S825 WeakPolarHBondContact O-CB 3.5Å; Q822-S825 PolarHBondContact O-N 3.39Å; Q822-S825 VanDerWaalsContact O-N 3.15Å; Q822-S825 PolarHBondContact O-OG 3.47Å
823	Y	66.7	Low	65.3	Low	167 Å²	167	77.7 Å²	77.7	66%	0.655	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	129	176.5	-171.6	-106.3	0	0	0	110.7	I830	Y823-I830 HydrophobicContact CD1-CG1 4.47Å; Y823-I830 HydrophobicContact CE1-CD1 4.32Å; Y823-I830 HydrophobicContact CE1-CG1 3.98Å
824	G	62	Low	63.1	Low	10 Å²	10	81.2 Å²	81.2	10%	0.103	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	90	4.1	-173.6	0	0	0	0	0	115.4	A277 W278 Q822 N828	A277-G824 WeakPolarHBondContact CA-O 3.43Å; W278-G824 PolarHBondContact N-O 3.1Å; Q822-G824 PolarHBondContact O-N 2.77Å; G824-N828 WeakPolarHBondContact CA-O 3.39Å; G824-N828 PolarHBondContact N-O 3.27Å
825	S	75.6	Confident	60.8	Low	29 Å²	29	83.8 Å²	83.8	20%	0.203	47%	0.466	C	S	.	.	S	Bend	trans	-75.1	171.4	170.8	63.9	0	0	0	0	112.5	Q822 D827 N828 P829	Q822-S825 WeakPolarHBondContact O-CB 3.5Å; Q822-S825 PolarHBondContact O-N 3.39Å; Q822-S825 VanDerWaalsContact O-N 3.15Å; Q822-S825 PolarHBondContact O-OG 3.47Å; S825-D827 PolarHBondContact O-N 2.72Å; S825-N828 PolarHBondContact N-O 3.27Å; S825-N828 CarbonylContact O-C 3.37Å; S825-N828 PolarHBondContact O-N 3.42Å; S825-N828 PolarHBondContact OG-N 3.09Å; S825-P829 WeakPolarHBondContact O-CA 3.44Å
826	L	70	Confident	60.1	Low	49 Å²	49	84 Å²	84	26%	0.257	46%	0.462	S	S	.	.	S	Bend	trans	-60.3	-35.3	176.6	178.1	61.4	0	0	0	112	K142 K171 W278	K142-L826 HydrophobicContact CD-CD1 4.26Å; K142-L826 PolarHBondContact NZ-O 3.33Å; K171-L826 HydrophobicContact CD-CD1 3.88Å; K171-L826 HydrophobicContact CD-CD2 4.15Å; W278-L826 VanDerWaalsContact CD1-N 3.28Å; W278-L826 HydrophobicContact CD2-CB 4.38Å; W278-L826 HydrophobicContact CD2-CD1 3.74Å; W278-L826 HydrophobicContact CE3-CD1 3.83Å; W278-L826 HydrophobicContact CG-CB 4.4Å; W278-L826 HydrophobicContact CG-CD1 4.43Å; W278-L826 HydrophobicContact CH2-CD1 3.82Å; W278-L826 HydrophobicContact CZ2-CD1 3.78Å; W278-L826 HydrophobicContact CZ3-CD1 3.86Å
827	D	61.1	Low	59.7	Low	150 Å²	150	84.2 Å²	84.2	80%	0.802	47%	0.47	S	S	*	.	S	Bend	trans	-80.8	-27.6	-178.6	-58.9	-43.2	0	0	0	112	S825	S825-D827 PolarHBondContact O-N 2.72Å
828	N	65.9	Low	59.7	Low	64 Å²	64	84.4 Å²	84.4	34%	0.342	47%	0.473	S	S	.	.	S	Bend	trans	-130	72.9	175.2	-165	9.2	0	0	0	112.5	G824 S825	G824-N828 WeakPolarHBondContact CA-O 3.39Å; G824-N828 PolarHBondContact N-O 3.27Å; S825-N828 PolarHBondContact N-O 3.27Å; S825-N828 CarbonylContact O-C 3.37Å; S825-N828 PolarHBondContact O-N 3.42Å; S825-N828 PolarHBondContact OG-N 3.09Å
829	P	74.6	Confident	60.3	Low	15 Å²	15	80.6 Å²	80.6	10%	0.097	45%	0.453	C	S	.	.			trans	-75.3	153.6	-176.9	33	-38.7	0	0	0	112.9	K142 W278 L280 S825	K142-P829 HydrophobicContact CD-CB 4.29Å; K142-P829 HydrophobicContact CD-CG 3.94Å; K142-P829 HydrophobicContact CG-CG 4.38Å; W278-P829 HydrophobicContact CB-CB 3.75Å; W278-P829 CarbonylContact O-C 3.57Å; W278-P829 WeakPolarHBondContact O-CA 3.29Å; L280-P829 HydrophobicContact CD1-CG 3.87Å; L280-P829 HydrophobicContact CD2-CB 4.47Å; L280-P829 HydrophobicContact CD2-CG 3.75Å; L280-P829 HydrophobicContact CG-CB 3.99Å; L280-P829 HydrophobicContact CG-CG 3.57Å; S825-P829 WeakPolarHBondContact O-CA 3.44Å
830	I	81.3	Confident	60.9	Low	19 Å²	19	78.3 Å²	78.3	10%	0.097	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	131.1	-180	-56.6	176.2	0	0	0	110.3	A277 W278 Y279 L280 Y823 G832	A277-I830 HydrophobicContact CB-CD1 3.6Å; A277-I830 HydrophobicContact CB-CG1 4.37Å; W278-I830 PolarHBondContact O-N 3.28Å; Y279-I830 CarbonylContact C-O 3.55Å; Y279-I830 VanDerWaalsContact CA-O 3.31Å; Y279-I830 WeakPolarHBondContact CA-O 3.32Å; Y279-I830 HydrophobicContact CD1-CB 3.76Å; Y279-I830 HydrophobicContact CD1-CG2 3.92Å; Y279-I830 HydrophobicContact CE1-CB 3.76Å; Y279-I830 HydrophobicContact CE1-CD1 4.09Å; Y279-I830 HydrophobicContact CE1-CG1 4.5Å; Y279-I830 HydrophobicContact CE1-CG2 3.64Å; Y279-I830 HydrophobicContact CG-CB 4.45Å; L280-I830 PolarHBondContact N-O 3.05Å; Y823-I830 HydrophobicContact CD1-CG1 4.47Å; Y823-I830 HydrophobicContact CE1-CD1 4.32Å; Y823-I830 HydrophobicContact CE1-CG1 3.98Å; I830-G832 PolarHBondContact O-N 3.37Å
831	V	74.5	Confident	61.7	Low	65 Å²	65	77.2 Å²	77.2	39%	0.394	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	114.4	168	-175	0	0	0	0	108.6	L280	L280-V831 HydrophobicContact CD1-CG2 3.61Å
832	G	59.4	Low	62.4	Low	6 Å²	6	77.5 Å²	77.5	6%	0.062	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-63.5	155.3	173.5	0	0	0	0	0	111.8	I830 T834	I830-G832 PolarHBondContact O-N 3.37Å; G832-T834 PolarHBondContact O-N 3.31Å
833	K	55.2	Low	62.8	Low	123 Å²	123	70.8 Å²	70.8	54%	0.535	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-66.6	126.9	177.5	-73.5	-173.8	175.2	-172.6	0	110.5	P265	P265-K833 HydrophobicContact CG-CD 4.3Å
834	T	38.7	Very low	62.4	Low	85 Å²	85	62.8 Å²	62.8	52%	0.521	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-87.8	127.1	160.1	50.4	0	0	0	0	107.9	Q282 G832	Q282-T834 HydrophobicContact CB-CG2 4.15Å; Q282-T834 HydrophobicContact CG-CG2 4.13Å; G832-T834 PolarHBondContact O-N 3.31Å
835	S	31.1	Very low	62.5	Low	138 Å²	138	67.5 Å²	67.5	97%	0.965	39%	0.389	S	S	*	.			trans	-56	0	178.8	53.4	0	0	0	0	113.5

Retrieved 835 of 835 residues in 1711.1 ms (Link to these results)

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